data_9FXY
# 
_entry.id   9FXY 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.403 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   9FXY         pdb_00009fxy 10.2210/pdb9fxy/pdb 
WWPDB D_1292139709 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-04-23 ? 
2 'Structure model' 1 1 2025-04-30 ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
_pdbx_audit_revision_category.ordinal             1 
_pdbx_audit_revision_category.revision_ordinal    2 
_pdbx_audit_revision_category.data_content_type   'Structure model' 
_pdbx_audit_revision_category.category            citation 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_citation.journal_volume'          
2 2 'Structure model' '_citation.page_first'              
3 2 'Structure model' '_citation.page_last'               
4 2 'Structure model' '_citation.pdbx_database_id_PubMed' 
5 2 'Structure model' '_citation.title'                   
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9FXY 
_pdbx_database_status.recvd_initial_deposition_date   2024-07-02 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           N 
# 
loop_
_pdbx_database_related.db_name 
_pdbx_database_related.details 
_pdbx_database_related.db_id 
_pdbx_database_related.content_type 
PDB . 9FTN unspecified 
PDB . 9FXW unspecified 
PDB . 9FXU unspecified 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              a.perrakis@nki.nl 
_pdbx_contact_author.name_first         Anastassis 
_pdbx_contact_author.name_last          Perrakis 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-1151-6227 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Borza, R.'     1 0000-0003-2759-9511 
'Joosten, R.P.' 2 0000-0002-2323-2686 
'Perrakis, A.'  3 0000-0002-1151-6227 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   UK 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Bioorg.Med.Chem. 
_citation.journal_id_ASTM           BMECEP 
_citation.journal_id_CSD            1200 
_citation.journal_id_ISSN           1464-3391 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            124 
_citation.language                  ? 
_citation.page_first                118181 
_citation.page_last                 118181 
_citation.title                     
'Design, Synthesis, and Biological Implications of Autotaxin inhibitors with a Three-Point lock binding mode.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1016/j.bmc.2025.118181 
_citation.pdbx_database_id_PubMed   40233422 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Desroy, N.'      1  ? 
primary 'Borza, R.'       2  ? 
primary 'Heiermann, J.'   3  ? 
primary 'Triballeau, N.'  4  ? 
primary 'Joncour, A.'     5  ? 
primary 'Bienvenu, N.'    6  ? 
primary 'Hengeveld, W.J.' 7  ? 
primary 'Springer, J.'    8  ? 
primary 'Galien, R.'      9  ? 
primary 'Joosten, R.P.'   10 ? 
primary 'Perrakis, A.'    11 ? 
primary 'Heckmann, B.'    12 ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1  polymer     man 'Isoform 2 of Autotaxin' 92875.422 1   3.1.4.39,3.1.4.4 ? ? ? 
2  branched    man 
'beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose' 586.542   1   
?                ? ? ? 
3  non-polymer syn 'THIOCYANATE ION' 58.082    40  ?                ? ? ? 
4  non-polymer syn 'ZINC ION' 65.409    2   ?                ? ? ? 
5  non-polymer syn 'CALCIUM ION' 40.078    1   ?                ? ? ? 
6  non-polymer syn 'IODIDE ION' 126.904   7   ?                ? ? ? 
7  non-polymer syn 
;3-(3-((4-(4-fluorophenyl)thiazol-2-yl)(methyl)amino)-6-(1-(methylsulfonyl)piperidin-4-yl)imidazo[1,2-b]pyridazin-2-yl)propanenitrile
;
539.648   1   ?                ? ? ? 
8  non-polymer syn GLYCEROL 92.094    3   ?                ? ? ? 
9  non-polymer syn 'PHOSPHATE ION' 94.971    1   ?                ? ? ? 
10 water       nat water 18.015    368 ?                ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        
'Ectonucleotide pyrophosphatase/phosphodiesterase family member 2,E-NPP 2,Extracellular lysophospholipase D,LysoPLD' 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;GSCKGRCFELQEVGPPDCRCDNLCKSYSSCCHDFDELCLKTARGWECTKDRCGEVRNEENACHCSEDCLSRGDCCTNYQV
VCKGESHWVDDDCEEIKVPECPAGFVRPPLIIFSVDGFRASYMKKGSKVMPNIEKLRSCGTHAPYMRPVYPTKTFPNLYT
LATGLYPESHGIVGNSMYDPVFDASFHLRGREKFNHRWWGGQPLWITATKQGVRAGTFFWSVSIPHERRILTILQWLSLP
DNERPSVYAFYSEQPDFSGHKYGPFGPEMTNPLREIDKTVGQLMDGLKQLRLHRCVNVIFVGDHGMEDVTCDRTEFLSNY
LTNVDDITLVPGTLGRIRAKSINNSKYDPKTIIAALTCKKPDQHFKPYMKQHLPKRLHYANNRRIEDIHLLVDRRWHVAR
KPLDVYKKPSGKCFFQGDHGFDNKVNSMQTVFVGYGPTFKYRTKVPPFENIELYNVMCDLLGLKPAPNNGTHGSLNHLLR
TNTFRPTMPDEVSRPNYPGIMYLQSEFDLGCTCDDKVEPKNKLEELNKRLHTKGSTKERHLLYGRPAVLYRTSYDILYHT
DFESGYSEIFLMPLWTSYTISKQAEVSSIPEHLTNCVRPDVRVSPGFSQNCLAYKNDKQMSYGFLFPPYLSSSPEAKYDA
FLVTNMVPMYPAFKRVWAYFQRVLVKKYASERNGVNVISGPIFDYNYDGLRDTEDEIKQYVEGSSIPVPTHYYSIITSCL
DFTQPADKCDGPLSVSSFILPHRPDNDESCNSSEDESKWVEELMKMHTARVRDIEHLTGLDFYRKTSRSYSEILTLKTYL
HTYESEI
;
_entity_poly.pdbx_seq_one_letter_code_can   
;GSCKGRCFELQEVGPPDCRCDNLCKSYSSCCHDFDELCLKTARGWECTKDRCGEVRNEENACHCSEDCLSRGDCCTNYQV
VCKGESHWVDDDCEEIKVPECPAGFVRPPLIIFSVDGFRASYMKKGSKVMPNIEKLRSCGTHAPYMRPVYPTKTFPNLYT
LATGLYPESHGIVGNSMYDPVFDASFHLRGREKFNHRWWGGQPLWITATKQGVRAGTFFWSVSIPHERRILTILQWLSLP
DNERPSVYAFYSEQPDFSGHKYGPFGPEMTNPLREIDKTVGQLMDGLKQLRLHRCVNVIFVGDHGMEDVTCDRTEFLSNY
LTNVDDITLVPGTLGRIRAKSINNSKYDPKTIIAALTCKKPDQHFKPYMKQHLPKRLHYANNRRIEDIHLLVDRRWHVAR
KPLDVYKKPSGKCFFQGDHGFDNKVNSMQTVFVGYGPTFKYRTKVPPFENIELYNVMCDLLGLKPAPNNGTHGSLNHLLR
TNTFRPTMPDEVSRPNYPGIMYLQSEFDLGCTCDDKVEPKNKLEELNKRLHTKGSTKERHLLYGRPAVLYRTSYDILYHT
DFESGYSEIFLMPLWTSYTISKQAEVSSIPEHLTNCVRPDVRVSPGFSQNCLAYKNDKQMSYGFLFPPYLSSSPEAKYDA
FLVTNMVPMYPAFKRVWAYFQRVLVKKYASERNGVNVISGPIFDYNYDGLRDTEDEIKQYVEGSSIPVPTHYYSIITSCL
DFTQPADKCDGPLSVSSFILPHRPDNDESCNSSEDESKWVEELMKMHTARVRDIEHLTGLDFYRKTSRSYSEILTLKTYL
HTYESEI
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3  'THIOCYANATE ION' SCN   
4  'ZINC ION' ZN    
5  'CALCIUM ION' CA    
6  'IODIDE ION' IOD   
7  
;3-(3-((4-(4-fluorophenyl)thiazol-2-yl)(methyl)amino)-6-(1-(methylsulfonyl)piperidin-4-yl)imidazo[1,2-b]pyridazin-2-yl)propanenitrile
;
A1IG1 
8  GLYCEROL GOL   
9  'PHOSPHATE ION' PO4   
10 water HOH   
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   GLY n 
1 2   SER n 
1 3   CYS n 
1 4   LYS n 
1 5   GLY n 
1 6   ARG n 
1 7   CYS n 
1 8   PHE n 
1 9   GLU n 
1 10  LEU n 
1 11  GLN n 
1 12  GLU n 
1 13  VAL n 
1 14  GLY n 
1 15  PRO n 
1 16  PRO n 
1 17  ASP n 
1 18  CYS n 
1 19  ARG n 
1 20  CYS n 
1 21  ASP n 
1 22  ASN n 
1 23  LEU n 
1 24  CYS n 
1 25  LYS n 
1 26  SER n 
1 27  TYR n 
1 28  SER n 
1 29  SER n 
1 30  CYS n 
1 31  CYS n 
1 32  HIS n 
1 33  ASP n 
1 34  PHE n 
1 35  ASP n 
1 36  GLU n 
1 37  LEU n 
1 38  CYS n 
1 39  LEU n 
1 40  LYS n 
1 41  THR n 
1 42  ALA n 
1 43  ARG n 
1 44  GLY n 
1 45  TRP n 
1 46  GLU n 
1 47  CYS n 
1 48  THR n 
1 49  LYS n 
1 50  ASP n 
1 51  ARG n 
1 52  CYS n 
1 53  GLY n 
1 54  GLU n 
1 55  VAL n 
1 56  ARG n 
1 57  ASN n 
1 58  GLU n 
1 59  GLU n 
1 60  ASN n 
1 61  ALA n 
1 62  CYS n 
1 63  HIS n 
1 64  CYS n 
1 65  SER n 
1 66  GLU n 
1 67  ASP n 
1 68  CYS n 
1 69  LEU n 
1 70  SER n 
1 71  ARG n 
1 72  GLY n 
1 73  ASP n 
1 74  CYS n 
1 75  CYS n 
1 76  THR n 
1 77  ASN n 
1 78  TYR n 
1 79  GLN n 
1 80  VAL n 
1 81  VAL n 
1 82  CYS n 
1 83  LYS n 
1 84  GLY n 
1 85  GLU n 
1 86  SER n 
1 87  HIS n 
1 88  TRP n 
1 89  VAL n 
1 90  ASP n 
1 91  ASP n 
1 92  ASP n 
1 93  CYS n 
1 94  GLU n 
1 95  GLU n 
1 96  ILE n 
1 97  LYS n 
1 98  VAL n 
1 99  PRO n 
1 100 GLU n 
1 101 CYS n 
1 102 PRO n 
1 103 ALA n 
1 104 GLY n 
1 105 PHE n 
1 106 VAL n 
1 107 ARG n 
1 108 PRO n 
1 109 PRO n 
1 110 LEU n 
1 111 ILE n 
1 112 ILE n 
1 113 PHE n 
1 114 SER n 
1 115 VAL n 
1 116 ASP n 
1 117 GLY n 
1 118 PHE n 
1 119 ARG n 
1 120 ALA n 
1 121 SER n 
1 122 TYR n 
1 123 MET n 
1 124 LYS n 
1 125 LYS n 
1 126 GLY n 
1 127 SER n 
1 128 LYS n 
1 129 VAL n 
1 130 MET n 
1 131 PRO n 
1 132 ASN n 
1 133 ILE n 
1 134 GLU n 
1 135 LYS n 
1 136 LEU n 
1 137 ARG n 
1 138 SER n 
1 139 CYS n 
1 140 GLY n 
1 141 THR n 
1 142 HIS n 
1 143 ALA n 
1 144 PRO n 
1 145 TYR n 
1 146 MET n 
1 147 ARG n 
1 148 PRO n 
1 149 VAL n 
1 150 TYR n 
1 151 PRO n 
1 152 THR n 
1 153 LYS n 
1 154 THR n 
1 155 PHE n 
1 156 PRO n 
1 157 ASN n 
1 158 LEU n 
1 159 TYR n 
1 160 THR n 
1 161 LEU n 
1 162 ALA n 
1 163 THR n 
1 164 GLY n 
1 165 LEU n 
1 166 TYR n 
1 167 PRO n 
1 168 GLU n 
1 169 SER n 
1 170 HIS n 
1 171 GLY n 
1 172 ILE n 
1 173 VAL n 
1 174 GLY n 
1 175 ASN n 
1 176 SER n 
1 177 MET n 
1 178 TYR n 
1 179 ASP n 
1 180 PRO n 
1 181 VAL n 
1 182 PHE n 
1 183 ASP n 
1 184 ALA n 
1 185 SER n 
1 186 PHE n 
1 187 HIS n 
1 188 LEU n 
1 189 ARG n 
1 190 GLY n 
1 191 ARG n 
1 192 GLU n 
1 193 LYS n 
1 194 PHE n 
1 195 ASN n 
1 196 HIS n 
1 197 ARG n 
1 198 TRP n 
1 199 TRP n 
1 200 GLY n 
1 201 GLY n 
1 202 GLN n 
1 203 PRO n 
1 204 LEU n 
1 205 TRP n 
1 206 ILE n 
1 207 THR n 
1 208 ALA n 
1 209 THR n 
1 210 LYS n 
1 211 GLN n 
1 212 GLY n 
1 213 VAL n 
1 214 ARG n 
1 215 ALA n 
1 216 GLY n 
1 217 THR n 
1 218 PHE n 
1 219 PHE n 
1 220 TRP n 
1 221 SER n 
1 222 VAL n 
1 223 SER n 
1 224 ILE n 
1 225 PRO n 
1 226 HIS n 
1 227 GLU n 
1 228 ARG n 
1 229 ARG n 
1 230 ILE n 
1 231 LEU n 
1 232 THR n 
1 233 ILE n 
1 234 LEU n 
1 235 GLN n 
1 236 TRP n 
1 237 LEU n 
1 238 SER n 
1 239 LEU n 
1 240 PRO n 
1 241 ASP n 
1 242 ASN n 
1 243 GLU n 
1 244 ARG n 
1 245 PRO n 
1 246 SER n 
1 247 VAL n 
1 248 TYR n 
1 249 ALA n 
1 250 PHE n 
1 251 TYR n 
1 252 SER n 
1 253 GLU n 
1 254 GLN n 
1 255 PRO n 
1 256 ASP n 
1 257 PHE n 
1 258 SER n 
1 259 GLY n 
1 260 HIS n 
1 261 LYS n 
1 262 TYR n 
1 263 GLY n 
1 264 PRO n 
1 265 PHE n 
1 266 GLY n 
1 267 PRO n 
1 268 GLU n 
1 269 MET n 
1 270 THR n 
1 271 ASN n 
1 272 PRO n 
1 273 LEU n 
1 274 ARG n 
1 275 GLU n 
1 276 ILE n 
1 277 ASP n 
1 278 LYS n 
1 279 THR n 
1 280 VAL n 
1 281 GLY n 
1 282 GLN n 
1 283 LEU n 
1 284 MET n 
1 285 ASP n 
1 286 GLY n 
1 287 LEU n 
1 288 LYS n 
1 289 GLN n 
1 290 LEU n 
1 291 ARG n 
1 292 LEU n 
1 293 HIS n 
1 294 ARG n 
1 295 CYS n 
1 296 VAL n 
1 297 ASN n 
1 298 VAL n 
1 299 ILE n 
1 300 PHE n 
1 301 VAL n 
1 302 GLY n 
1 303 ASP n 
1 304 HIS n 
1 305 GLY n 
1 306 MET n 
1 307 GLU n 
1 308 ASP n 
1 309 VAL n 
1 310 THR n 
1 311 CYS n 
1 312 ASP n 
1 313 ARG n 
1 314 THR n 
1 315 GLU n 
1 316 PHE n 
1 317 LEU n 
1 318 SER n 
1 319 ASN n 
1 320 TYR n 
1 321 LEU n 
1 322 THR n 
1 323 ASN n 
1 324 VAL n 
1 325 ASP n 
1 326 ASP n 
1 327 ILE n 
1 328 THR n 
1 329 LEU n 
1 330 VAL n 
1 331 PRO n 
1 332 GLY n 
1 333 THR n 
1 334 LEU n 
1 335 GLY n 
1 336 ARG n 
1 337 ILE n 
1 338 ARG n 
1 339 ALA n 
1 340 LYS n 
1 341 SER n 
1 342 ILE n 
1 343 ASN n 
1 344 ASN n 
1 345 SER n 
1 346 LYS n 
1 347 TYR n 
1 348 ASP n 
1 349 PRO n 
1 350 LYS n 
1 351 THR n 
1 352 ILE n 
1 353 ILE n 
1 354 ALA n 
1 355 ALA n 
1 356 LEU n 
1 357 THR n 
1 358 CYS n 
1 359 LYS n 
1 360 LYS n 
1 361 PRO n 
1 362 ASP n 
1 363 GLN n 
1 364 HIS n 
1 365 PHE n 
1 366 LYS n 
1 367 PRO n 
1 368 TYR n 
1 369 MET n 
1 370 LYS n 
1 371 GLN n 
1 372 HIS n 
1 373 LEU n 
1 374 PRO n 
1 375 LYS n 
1 376 ARG n 
1 377 LEU n 
1 378 HIS n 
1 379 TYR n 
1 380 ALA n 
1 381 ASN n 
1 382 ASN n 
1 383 ARG n 
1 384 ARG n 
1 385 ILE n 
1 386 GLU n 
1 387 ASP n 
1 388 ILE n 
1 389 HIS n 
1 390 LEU n 
1 391 LEU n 
1 392 VAL n 
1 393 ASP n 
1 394 ARG n 
1 395 ARG n 
1 396 TRP n 
1 397 HIS n 
1 398 VAL n 
1 399 ALA n 
1 400 ARG n 
1 401 LYS n 
1 402 PRO n 
1 403 LEU n 
1 404 ASP n 
1 405 VAL n 
1 406 TYR n 
1 407 LYS n 
1 408 LYS n 
1 409 PRO n 
1 410 SER n 
1 411 GLY n 
1 412 LYS n 
1 413 CYS n 
1 414 PHE n 
1 415 PHE n 
1 416 GLN n 
1 417 GLY n 
1 418 ASP n 
1 419 HIS n 
1 420 GLY n 
1 421 PHE n 
1 422 ASP n 
1 423 ASN n 
1 424 LYS n 
1 425 VAL n 
1 426 ASN n 
1 427 SER n 
1 428 MET n 
1 429 GLN n 
1 430 THR n 
1 431 VAL n 
1 432 PHE n 
1 433 VAL n 
1 434 GLY n 
1 435 TYR n 
1 436 GLY n 
1 437 PRO n 
1 438 THR n 
1 439 PHE n 
1 440 LYS n 
1 441 TYR n 
1 442 ARG n 
1 443 THR n 
1 444 LYS n 
1 445 VAL n 
1 446 PRO n 
1 447 PRO n 
1 448 PHE n 
1 449 GLU n 
1 450 ASN n 
1 451 ILE n 
1 452 GLU n 
1 453 LEU n 
1 454 TYR n 
1 455 ASN n 
1 456 VAL n 
1 457 MET n 
1 458 CYS n 
1 459 ASP n 
1 460 LEU n 
1 461 LEU n 
1 462 GLY n 
1 463 LEU n 
1 464 LYS n 
1 465 PRO n 
1 466 ALA n 
1 467 PRO n 
1 468 ASN n 
1 469 ASN n 
1 470 GLY n 
1 471 THR n 
1 472 HIS n 
1 473 GLY n 
1 474 SER n 
1 475 LEU n 
1 476 ASN n 
1 477 HIS n 
1 478 LEU n 
1 479 LEU n 
1 480 ARG n 
1 481 THR n 
1 482 ASN n 
1 483 THR n 
1 484 PHE n 
1 485 ARG n 
1 486 PRO n 
1 487 THR n 
1 488 MET n 
1 489 PRO n 
1 490 ASP n 
1 491 GLU n 
1 492 VAL n 
1 493 SER n 
1 494 ARG n 
1 495 PRO n 
1 496 ASN n 
1 497 TYR n 
1 498 PRO n 
1 499 GLY n 
1 500 ILE n 
1 501 MET n 
1 502 TYR n 
1 503 LEU n 
1 504 GLN n 
1 505 SER n 
1 506 GLU n 
1 507 PHE n 
1 508 ASP n 
1 509 LEU n 
1 510 GLY n 
1 511 CYS n 
1 512 THR n 
1 513 CYS n 
1 514 ASP n 
1 515 ASP n 
1 516 LYS n 
1 517 VAL n 
1 518 GLU n 
1 519 PRO n 
1 520 LYS n 
1 521 ASN n 
1 522 LYS n 
1 523 LEU n 
1 524 GLU n 
1 525 GLU n 
1 526 LEU n 
1 527 ASN n 
1 528 LYS n 
1 529 ARG n 
1 530 LEU n 
1 531 HIS n 
1 532 THR n 
1 533 LYS n 
1 534 GLY n 
1 535 SER n 
1 536 THR n 
1 537 LYS n 
1 538 GLU n 
1 539 ARG n 
1 540 HIS n 
1 541 LEU n 
1 542 LEU n 
1 543 TYR n 
1 544 GLY n 
1 545 ARG n 
1 546 PRO n 
1 547 ALA n 
1 548 VAL n 
1 549 LEU n 
1 550 TYR n 
1 551 ARG n 
1 552 THR n 
1 553 SER n 
1 554 TYR n 
1 555 ASP n 
1 556 ILE n 
1 557 LEU n 
1 558 TYR n 
1 559 HIS n 
1 560 THR n 
1 561 ASP n 
1 562 PHE n 
1 563 GLU n 
1 564 SER n 
1 565 GLY n 
1 566 TYR n 
1 567 SER n 
1 568 GLU n 
1 569 ILE n 
1 570 PHE n 
1 571 LEU n 
1 572 MET n 
1 573 PRO n 
1 574 LEU n 
1 575 TRP n 
1 576 THR n 
1 577 SER n 
1 578 TYR n 
1 579 THR n 
1 580 ILE n 
1 581 SER n 
1 582 LYS n 
1 583 GLN n 
1 584 ALA n 
1 585 GLU n 
1 586 VAL n 
1 587 SER n 
1 588 SER n 
1 589 ILE n 
1 590 PRO n 
1 591 GLU n 
1 592 HIS n 
1 593 LEU n 
1 594 THR n 
1 595 ASN n 
1 596 CYS n 
1 597 VAL n 
1 598 ARG n 
1 599 PRO n 
1 600 ASP n 
1 601 VAL n 
1 602 ARG n 
1 603 VAL n 
1 604 SER n 
1 605 PRO n 
1 606 GLY n 
1 607 PHE n 
1 608 SER n 
1 609 GLN n 
1 610 ASN n 
1 611 CYS n 
1 612 LEU n 
1 613 ALA n 
1 614 TYR n 
1 615 LYS n 
1 616 ASN n 
1 617 ASP n 
1 618 LYS n 
1 619 GLN n 
1 620 MET n 
1 621 SER n 
1 622 TYR n 
1 623 GLY n 
1 624 PHE n 
1 625 LEU n 
1 626 PHE n 
1 627 PRO n 
1 628 PRO n 
1 629 TYR n 
1 630 LEU n 
1 631 SER n 
1 632 SER n 
1 633 SER n 
1 634 PRO n 
1 635 GLU n 
1 636 ALA n 
1 637 LYS n 
1 638 TYR n 
1 639 ASP n 
1 640 ALA n 
1 641 PHE n 
1 642 LEU n 
1 643 VAL n 
1 644 THR n 
1 645 ASN n 
1 646 MET n 
1 647 VAL n 
1 648 PRO n 
1 649 MET n 
1 650 TYR n 
1 651 PRO n 
1 652 ALA n 
1 653 PHE n 
1 654 LYS n 
1 655 ARG n 
1 656 VAL n 
1 657 TRP n 
1 658 ALA n 
1 659 TYR n 
1 660 PHE n 
1 661 GLN n 
1 662 ARG n 
1 663 VAL n 
1 664 LEU n 
1 665 VAL n 
1 666 LYS n 
1 667 LYS n 
1 668 TYR n 
1 669 ALA n 
1 670 SER n 
1 671 GLU n 
1 672 ARG n 
1 673 ASN n 
1 674 GLY n 
1 675 VAL n 
1 676 ASN n 
1 677 VAL n 
1 678 ILE n 
1 679 SER n 
1 680 GLY n 
1 681 PRO n 
1 682 ILE n 
1 683 PHE n 
1 684 ASP n 
1 685 TYR n 
1 686 ASN n 
1 687 TYR n 
1 688 ASP n 
1 689 GLY n 
1 690 LEU n 
1 691 ARG n 
1 692 ASP n 
1 693 THR n 
1 694 GLU n 
1 695 ASP n 
1 696 GLU n 
1 697 ILE n 
1 698 LYS n 
1 699 GLN n 
1 700 TYR n 
1 701 VAL n 
1 702 GLU n 
1 703 GLY n 
1 704 SER n 
1 705 SER n 
1 706 ILE n 
1 707 PRO n 
1 708 VAL n 
1 709 PRO n 
1 710 THR n 
1 711 HIS n 
1 712 TYR n 
1 713 TYR n 
1 714 SER n 
1 715 ILE n 
1 716 ILE n 
1 717 THR n 
1 718 SER n 
1 719 CYS n 
1 720 LEU n 
1 721 ASP n 
1 722 PHE n 
1 723 THR n 
1 724 GLN n 
1 725 PRO n 
1 726 ALA n 
1 727 ASP n 
1 728 LYS n 
1 729 CYS n 
1 730 ASP n 
1 731 GLY n 
1 732 PRO n 
1 733 LEU n 
1 734 SER n 
1 735 VAL n 
1 736 SER n 
1 737 SER n 
1 738 PHE n 
1 739 ILE n 
1 740 LEU n 
1 741 PRO n 
1 742 HIS n 
1 743 ARG n 
1 744 PRO n 
1 745 ASP n 
1 746 ASN n 
1 747 ASP n 
1 748 GLU n 
1 749 SER n 
1 750 CYS n 
1 751 ASN n 
1 752 SER n 
1 753 SER n 
1 754 GLU n 
1 755 ASP n 
1 756 GLU n 
1 757 SER n 
1 758 LYS n 
1 759 TRP n 
1 760 VAL n 
1 761 GLU n 
1 762 GLU n 
1 763 LEU n 
1 764 MET n 
1 765 LYS n 
1 766 MET n 
1 767 HIS n 
1 768 THR n 
1 769 ALA n 
1 770 ARG n 
1 771 VAL n 
1 772 ARG n 
1 773 ASP n 
1 774 ILE n 
1 775 GLU n 
1 776 HIS n 
1 777 LEU n 
1 778 THR n 
1 779 GLY n 
1 780 LEU n 
1 781 ASP n 
1 782 PHE n 
1 783 TYR n 
1 784 ARG n 
1 785 LYS n 
1 786 THR n 
1 787 SER n 
1 788 ARG n 
1 789 SER n 
1 790 TYR n 
1 791 SER n 
1 792 GLU n 
1 793 ILE n 
1 794 LEU n 
1 795 THR n 
1 796 LEU n 
1 797 LYS n 
1 798 THR n 
1 799 TYR n 
1 800 LEU n 
1 801 HIS n 
1 802 THR n 
1 803 TYR n 
1 804 GLU n 
1 805 SER n 
1 806 GLU n 
1 807 ILE n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   807 
_entity_src_gen.gene_src_common_name               'Norway rat' 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'Enpp2, Atx, Npps2' 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Rattus norvegicus' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     10116 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Homo sapiens' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     9606 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
_pdbx_entity_branch.entity_id   2 
_pdbx_entity_branch.type        oligosaccharide 
# 
loop_
_pdbx_entity_branch_descriptor.ordinal 
_pdbx_entity_branch_descriptor.entity_id 
_pdbx_entity_branch_descriptor.descriptor 
_pdbx_entity_branch_descriptor.type 
_pdbx_entity_branch_descriptor.program 
_pdbx_entity_branch_descriptor.program_version 
1 2 DManpb1-4DGlcpNAcb1-4DGlcpNAcb1-ROH                                          'Glycam Condensed Sequence' GMML       1.0   
2 2 'WURCS=2.0/2,3,2/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5]/1-1-2/a4-b1_b4-c1' WURCS                       PDB2Glycan 1.1.0 
3 2 '[][D-1-deoxy-GlcpNAc]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-Manp]{}}}'           LINUCS                      PDB-CARE   ?     
# 
loop_
_pdbx_entity_branch_link.link_id 
_pdbx_entity_branch_link.entity_id 
_pdbx_entity_branch_link.entity_branch_list_num_1 
_pdbx_entity_branch_link.comp_id_1 
_pdbx_entity_branch_link.atom_id_1 
_pdbx_entity_branch_link.leaving_atom_id_1 
_pdbx_entity_branch_link.entity_branch_list_num_2 
_pdbx_entity_branch_link.comp_id_2 
_pdbx_entity_branch_link.atom_id_2 
_pdbx_entity_branch_link.leaving_atom_id_2 
_pdbx_entity_branch_link.value_order 
_pdbx_entity_branch_link.details 
1 2 2 NAG C1 O1 1 NAG O4 HO4 sing ? 
2 2 3 BMA C1 O1 2 NAG O4 HO4 sing ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
A1IG1 non-polymer                  . 
;3-(3-((4-(4-fluorophenyl)thiazol-2-yl)(methyl)amino)-6-(1-(methylsulfonyl)piperidin-4-yl)imidazo[1,2-b]pyridazin-2-yl)propanenitrile
;
;3-[3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methyl-amino]-6-(1-methylsulfonylpiperidin-4-yl)imidazo[1,2-b]pyridazin-2-yl]propanenitrile
;
'C25 H26 F N7 O2 S2' 539.648 
ALA   'L-peptide linking'          y ALANINE ? 'C3 H7 N O2'         89.093  
ARG   'L-peptide linking'          y ARGININE ? 'C6 H15 N4 O2 1'     175.209 
ASN   'L-peptide linking'          y ASPARAGINE ? 'C4 H8 N2 O3'        132.118 
ASP   'L-peptide linking'          y 'ASPARTIC ACID' ? 'C4 H7 N O4'         133.103 
BMA   'D-saccharide, beta linking' . beta-D-mannopyranose 'beta-D-mannose; D-mannose; mannose' 'C6 H12 O6'          180.156 
CA    non-polymer                  . 'CALCIUM ION' ? 'Ca 2'               40.078  
CYS   'L-peptide linking'          y CYSTEINE ? 'C3 H7 N O2 S'       121.158 
GLN   'L-peptide linking'          y GLUTAMINE ? 'C5 H10 N2 O3'       146.144 
GLU   'L-peptide linking'          y 'GLUTAMIC ACID' ? 'C5 H9 N O4'         147.129 
GLY   'peptide linking'            y GLYCINE ? 'C2 H5 N O2'         75.067  
GOL   non-polymer                  . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3'           92.094  
HIS   'L-peptide linking'          y HISTIDINE ? 'C6 H10 N3 O2 1'     156.162 
HOH   non-polymer                  . WATER ? 'H2 O'               18.015  
ILE   'L-peptide linking'          y ISOLEUCINE ? 'C6 H13 N O2'        131.173 
IOD   non-polymer                  . 'IODIDE ION' ? 'I -1'               126.904 
LEU   'L-peptide linking'          y LEUCINE ? 'C6 H13 N O2'        131.173 
LYS   'L-peptide linking'          y LYSINE ? 'C6 H15 N2 O2 1'     147.195 
MET   'L-peptide linking'          y METHIONINE ? 'C5 H11 N O2 S'      149.211 
NAG   'D-saccharide, beta linking' . 2-acetamido-2-deoxy-beta-D-glucopyranose 
;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE
;
'C8 H15 N O6'        221.208 
PHE   'L-peptide linking'          y PHENYLALANINE ? 'C9 H11 N O2'        165.189 
PO4   non-polymer                  . 'PHOSPHATE ION' ? 'O4 P -3'            94.971  
PRO   'L-peptide linking'          y PROLINE ? 'C5 H9 N O2'         115.130 
SCN   non-polymer                  . 'THIOCYANATE ION' ? 'C N S -1'           58.082  
SER   'L-peptide linking'          y SERINE ? 'C3 H7 N O3'         105.093 
THR   'L-peptide linking'          y THREONINE ? 'C4 H9 N O3'         119.119 
TRP   'L-peptide linking'          y TRYPTOPHAN ? 'C11 H12 N2 O2'      204.225 
TYR   'L-peptide linking'          y TYROSINE ? 'C9 H11 N O3'        181.189 
VAL   'L-peptide linking'          y VALINE ? 'C5 H11 N O2'        117.146 
ZN    non-polymer                  . 'ZINC ION' ? 'Zn 2'               65.409  
# 
loop_
_pdbx_chem_comp_identifier.comp_id 
_pdbx_chem_comp_identifier.type 
_pdbx_chem_comp_identifier.program 
_pdbx_chem_comp_identifier.program_version 
_pdbx_chem_comp_identifier.identifier 
BMA 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML     1.0 DManpb                         
BMA 'COMMON NAME'                         GMML     1.0 b-D-mannopyranose              
BMA 'IUPAC CARBOHYDRATE SYMBOL'           PDB-CARE 1.0 b-D-Manp                       
BMA 'SNFG CARBOHYDRATE SYMBOL'            GMML     1.0 Man                            
NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML     1.0 DGlcpNAcb                      
NAG 'COMMON NAME'                         GMML     1.0 N-acetyl-b-D-glucopyranosamine 
NAG 'IUPAC CARBOHYDRATE SYMBOL'           PDB-CARE 1.0 b-D-GlcpNAc                    
NAG 'SNFG CARBOHYDRATE SYMBOL'            GMML     1.0 GlcNAc                         
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   GLY 1   56  56  GLY GLY A . n 
A 1 2   SER 2   57  57  SER SER A . n 
A 1 3   CYS 3   58  58  CYS CYS A . n 
A 1 4   LYS 4   59  59  LYS LYS A . n 
A 1 5   GLY 5   60  60  GLY GLY A . n 
A 1 6   ARG 6   61  61  ARG ARG A . n 
A 1 7   CYS 7   62  62  CYS CYS A . n 
A 1 8   PHE 8   63  63  PHE PHE A . n 
A 1 9   GLU 9   64  64  GLU GLU A . n 
A 1 10  LEU 10  65  65  LEU LEU A . n 
A 1 11  GLN 11  66  66  GLN GLN A . n 
A 1 12  GLU 12  67  67  GLU GLU A . n 
A 1 13  VAL 13  68  68  VAL VAL A . n 
A 1 14  GLY 14  69  69  GLY GLY A . n 
A 1 15  PRO 15  70  70  PRO PRO A . n 
A 1 16  PRO 16  71  71  PRO PRO A . n 
A 1 17  ASP 17  72  72  ASP ASP A . n 
A 1 18  CYS 18  73  73  CYS CYS A . n 
A 1 19  ARG 19  74  74  ARG ARG A . n 
A 1 20  CYS 20  75  75  CYS CYS A . n 
A 1 21  ASP 21  76  76  ASP ASP A . n 
A 1 22  ASN 22  77  77  ASN ASN A . n 
A 1 23  LEU 23  78  78  LEU LEU A . n 
A 1 24  CYS 24  79  79  CYS CYS A . n 
A 1 25  LYS 25  80  80  LYS LYS A . n 
A 1 26  SER 26  81  81  SER SER A . n 
A 1 27  TYR 27  82  82  TYR TYR A . n 
A 1 28  SER 28  83  83  SER SER A . n 
A 1 29  SER 29  84  84  SER SER A . n 
A 1 30  CYS 30  85  85  CYS CYS A . n 
A 1 31  CYS 31  86  86  CYS CYS A . n 
A 1 32  HIS 32  87  87  HIS HIS A . n 
A 1 33  ASP 33  88  88  ASP ASP A . n 
A 1 34  PHE 34  89  89  PHE PHE A . n 
A 1 35  ASP 35  90  90  ASP ASP A . n 
A 1 36  GLU 36  91  91  GLU GLU A . n 
A 1 37  LEU 37  92  92  LEU LEU A . n 
A 1 38  CYS 38  93  93  CYS CYS A . n 
A 1 39  LEU 39  94  94  LEU LEU A . n 
A 1 40  LYS 40  95  95  LYS LYS A . n 
A 1 41  THR 41  96  96  THR THR A . n 
A 1 42  ALA 42  97  97  ALA ALA A . n 
A 1 43  ARG 43  98  98  ARG ARG A . n 
A 1 44  GLY 44  99  99  GLY GLY A . n 
A 1 45  TRP 45  100 100 TRP TRP A . n 
A 1 46  GLU 46  101 101 GLU GLU A . n 
A 1 47  CYS 47  102 102 CYS CYS A . n 
A 1 48  THR 48  103 103 THR THR A . n 
A 1 49  LYS 49  104 104 LYS LYS A . n 
A 1 50  ASP 50  105 105 ASP ASP A . n 
A 1 51  ARG 51  106 106 ARG ARG A . n 
A 1 52  CYS 52  107 107 CYS CYS A . n 
A 1 53  GLY 53  108 108 GLY GLY A . n 
A 1 54  GLU 54  109 109 GLU GLU A . n 
A 1 55  VAL 55  110 110 VAL VAL A . n 
A 1 56  ARG 56  111 111 ARG ARG A . n 
A 1 57  ASN 57  112 112 ASN ASN A . n 
A 1 58  GLU 58  113 113 GLU GLU A . n 
A 1 59  GLU 59  114 114 GLU GLU A . n 
A 1 60  ASN 60  115 115 ASN ASN A . n 
A 1 61  ALA 61  116 116 ALA ALA A . n 
A 1 62  CYS 62  117 117 CYS CYS A . n 
A 1 63  HIS 63  118 118 HIS HIS A . n 
A 1 64  CYS 64  119 119 CYS CYS A . n 
A 1 65  SER 65  120 120 SER SER A . n 
A 1 66  GLU 66  121 121 GLU GLU A . n 
A 1 67  ASP 67  122 122 ASP ASP A . n 
A 1 68  CYS 68  123 123 CYS CYS A . n 
A 1 69  LEU 69  124 124 LEU LEU A . n 
A 1 70  SER 70  125 125 SER SER A . n 
A 1 71  ARG 71  126 126 ARG ARG A . n 
A 1 72  GLY 72  127 127 GLY GLY A . n 
A 1 73  ASP 73  128 128 ASP ASP A . n 
A 1 74  CYS 74  129 129 CYS CYS A . n 
A 1 75  CYS 75  130 130 CYS CYS A . n 
A 1 76  THR 76  131 131 THR THR A . n 
A 1 77  ASN 77  132 132 ASN ASN A . n 
A 1 78  TYR 78  133 133 TYR TYR A . n 
A 1 79  GLN 79  134 134 GLN GLN A . n 
A 1 80  VAL 80  135 135 VAL VAL A . n 
A 1 81  VAL 81  136 136 VAL VAL A . n 
A 1 82  CYS 82  137 137 CYS CYS A . n 
A 1 83  LYS 83  138 138 LYS LYS A . n 
A 1 84  GLY 84  139 139 GLY GLY A . n 
A 1 85  GLU 85  140 140 GLU GLU A . n 
A 1 86  SER 86  141 141 SER SER A . n 
A 1 87  HIS 87  142 142 HIS HIS A . n 
A 1 88  TRP 88  143 143 TRP TRP A . n 
A 1 89  VAL 89  144 144 VAL VAL A . n 
A 1 90  ASP 90  145 145 ASP ASP A . n 
A 1 91  ASP 91  146 146 ASP ASP A . n 
A 1 92  ASP 92  147 147 ASP ASP A . n 
A 1 93  CYS 93  148 148 CYS CYS A . n 
A 1 94  GLU 94  149 149 GLU GLU A . n 
A 1 95  GLU 95  150 150 GLU GLU A . n 
A 1 96  ILE 96  151 151 ILE ILE A . n 
A 1 97  LYS 97  152 152 LYS LYS A . n 
A 1 98  VAL 98  153 153 VAL VAL A . n 
A 1 99  PRO 99  154 154 PRO PRO A . n 
A 1 100 GLU 100 155 155 GLU GLU A . n 
A 1 101 CYS 101 156 156 CYS CYS A . n 
A 1 102 PRO 102 157 157 PRO PRO A . n 
A 1 103 ALA 103 158 158 ALA ALA A . n 
A 1 104 GLY 104 159 159 GLY GLY A . n 
A 1 105 PHE 105 160 160 PHE PHE A . n 
A 1 106 VAL 106 161 161 VAL VAL A . n 
A 1 107 ARG 107 162 162 ARG ARG A . n 
A 1 108 PRO 108 163 163 PRO PRO A . n 
A 1 109 PRO 109 164 164 PRO PRO A . n 
A 1 110 LEU 110 165 165 LEU LEU A . n 
A 1 111 ILE 111 166 166 ILE ILE A . n 
A 1 112 ILE 112 167 167 ILE ILE A . n 
A 1 113 PHE 113 168 168 PHE PHE A . n 
A 1 114 SER 114 169 169 SER SER A . n 
A 1 115 VAL 115 170 170 VAL VAL A . n 
A 1 116 ASP 116 171 171 ASP ASP A . n 
A 1 117 GLY 117 172 172 GLY GLY A . n 
A 1 118 PHE 118 173 173 PHE PHE A . n 
A 1 119 ARG 119 174 174 ARG ARG A . n 
A 1 120 ALA 120 175 175 ALA ALA A . n 
A 1 121 SER 121 176 176 SER SER A . n 
A 1 122 TYR 122 177 177 TYR TYR A . n 
A 1 123 MET 123 178 178 MET MET A . n 
A 1 124 LYS 124 179 179 LYS LYS A . n 
A 1 125 LYS 125 180 180 LYS LYS A . n 
A 1 126 GLY 126 181 181 GLY GLY A . n 
A 1 127 SER 127 182 182 SER SER A . n 
A 1 128 LYS 128 183 183 LYS LYS A . n 
A 1 129 VAL 129 184 184 VAL VAL A . n 
A 1 130 MET 130 185 185 MET MET A . n 
A 1 131 PRO 131 186 186 PRO PRO A . n 
A 1 132 ASN 132 187 187 ASN ASN A . n 
A 1 133 ILE 133 188 188 ILE ILE A . n 
A 1 134 GLU 134 189 189 GLU GLU A . n 
A 1 135 LYS 135 190 190 LYS LYS A . n 
A 1 136 LEU 136 191 191 LEU LEU A . n 
A 1 137 ARG 137 192 192 ARG ARG A . n 
A 1 138 SER 138 193 193 SER SER A . n 
A 1 139 CYS 139 194 194 CYS CYS A . n 
A 1 140 GLY 140 195 195 GLY GLY A . n 
A 1 141 THR 141 196 196 THR THR A . n 
A 1 142 HIS 142 197 197 HIS HIS A . n 
A 1 143 ALA 143 198 198 ALA ALA A . n 
A 1 144 PRO 144 199 199 PRO PRO A . n 
A 1 145 TYR 145 200 200 TYR TYR A . n 
A 1 146 MET 146 201 201 MET MET A . n 
A 1 147 ARG 147 202 202 ARG ARG A . n 
A 1 148 PRO 148 203 203 PRO PRO A . n 
A 1 149 VAL 149 204 204 VAL VAL A . n 
A 1 150 TYR 150 205 205 TYR TYR A . n 
A 1 151 PRO 151 206 206 PRO PRO A . n 
A 1 152 THR 152 207 207 THR THR A . n 
A 1 153 LYS 153 208 208 LYS LYS A . n 
A 1 154 THR 154 209 209 THR THR A . n 
A 1 155 PHE 155 210 210 PHE PHE A . n 
A 1 156 PRO 156 211 211 PRO PRO A . n 
A 1 157 ASN 157 212 212 ASN ASN A . n 
A 1 158 LEU 158 213 213 LEU LEU A . n 
A 1 159 TYR 159 214 214 TYR TYR A . n 
A 1 160 THR 160 215 215 THR THR A . n 
A 1 161 LEU 161 216 216 LEU LEU A . n 
A 1 162 ALA 162 217 217 ALA ALA A . n 
A 1 163 THR 163 218 218 THR THR A . n 
A 1 164 GLY 164 219 219 GLY GLY A . n 
A 1 165 LEU 165 220 220 LEU LEU A . n 
A 1 166 TYR 166 221 221 TYR TYR A . n 
A 1 167 PRO 167 222 222 PRO PRO A . n 
A 1 168 GLU 168 223 223 GLU GLU A . n 
A 1 169 SER 169 224 224 SER SER A . n 
A 1 170 HIS 170 225 225 HIS HIS A . n 
A 1 171 GLY 171 226 226 GLY GLY A . n 
A 1 172 ILE 172 227 227 ILE ILE A . n 
A 1 173 VAL 173 228 228 VAL VAL A . n 
A 1 174 GLY 174 229 229 GLY GLY A . n 
A 1 175 ASN 175 230 230 ASN ASN A . n 
A 1 176 SER 176 231 231 SER SER A . n 
A 1 177 MET 177 232 232 MET MET A . n 
A 1 178 TYR 178 233 233 TYR TYR A . n 
A 1 179 ASP 179 234 234 ASP ASP A . n 
A 1 180 PRO 180 235 235 PRO PRO A . n 
A 1 181 VAL 181 236 236 VAL VAL A . n 
A 1 182 PHE 182 237 237 PHE PHE A . n 
A 1 183 ASP 183 238 238 ASP ASP A . n 
A 1 184 ALA 184 239 239 ALA ALA A . n 
A 1 185 SER 185 240 240 SER SER A . n 
A 1 186 PHE 186 241 241 PHE PHE A . n 
A 1 187 HIS 187 242 242 HIS HIS A . n 
A 1 188 LEU 188 243 243 LEU LEU A . n 
A 1 189 ARG 189 244 244 ARG ARG A . n 
A 1 190 GLY 190 245 245 GLY GLY A . n 
A 1 191 ARG 191 246 246 ARG ARG A . n 
A 1 192 GLU 192 247 247 GLU GLU A . n 
A 1 193 LYS 193 248 248 LYS LYS A . n 
A 1 194 PHE 194 249 249 PHE PHE A . n 
A 1 195 ASN 195 250 250 ASN ASN A . n 
A 1 196 HIS 196 251 251 HIS HIS A . n 
A 1 197 ARG 197 252 252 ARG ARG A . n 
A 1 198 TRP 198 253 253 TRP TRP A . n 
A 1 199 TRP 199 254 254 TRP TRP A . n 
A 1 200 GLY 200 255 255 GLY GLY A . n 
A 1 201 GLY 201 256 256 GLY GLY A . n 
A 1 202 GLN 202 257 257 GLN GLN A . n 
A 1 203 PRO 203 258 258 PRO PRO A . n 
A 1 204 LEU 204 259 259 LEU LEU A . n 
A 1 205 TRP 205 260 260 TRP TRP A . n 
A 1 206 ILE 206 261 261 ILE ILE A . n 
A 1 207 THR 207 262 262 THR THR A . n 
A 1 208 ALA 208 263 263 ALA ALA A . n 
A 1 209 THR 209 264 264 THR THR A . n 
A 1 210 LYS 210 265 265 LYS LYS A . n 
A 1 211 GLN 211 266 266 GLN GLN A . n 
A 1 212 GLY 212 267 267 GLY GLY A . n 
A 1 213 VAL 213 268 268 VAL VAL A . n 
A 1 214 ARG 214 269 269 ARG ARG A . n 
A 1 215 ALA 215 270 270 ALA ALA A . n 
A 1 216 GLY 216 271 271 GLY GLY A . n 
A 1 217 THR 217 272 272 THR THR A . n 
A 1 218 PHE 218 273 273 PHE PHE A . n 
A 1 219 PHE 219 274 274 PHE PHE A . n 
A 1 220 TRP 220 275 275 TRP TRP A . n 
A 1 221 SER 221 276 276 SER SER A . n 
A 1 222 VAL 222 277 277 VAL VAL A . n 
A 1 223 SER 223 278 278 SER SER A . n 
A 1 224 ILE 224 279 279 ILE ILE A . n 
A 1 225 PRO 225 280 280 PRO PRO A . n 
A 1 226 HIS 226 281 281 HIS HIS A . n 
A 1 227 GLU 227 282 282 GLU GLU A . n 
A 1 228 ARG 228 283 283 ARG ARG A . n 
A 1 229 ARG 229 284 284 ARG ARG A . n 
A 1 230 ILE 230 285 285 ILE ILE A . n 
A 1 231 LEU 231 286 286 LEU LEU A . n 
A 1 232 THR 232 287 287 THR THR A . n 
A 1 233 ILE 233 288 288 ILE ILE A . n 
A 1 234 LEU 234 289 289 LEU LEU A . n 
A 1 235 GLN 235 290 290 GLN GLN A . n 
A 1 236 TRP 236 291 291 TRP TRP A . n 
A 1 237 LEU 237 292 292 LEU LEU A . n 
A 1 238 SER 238 293 293 SER SER A . n 
A 1 239 LEU 239 294 294 LEU LEU A . n 
A 1 240 PRO 240 295 295 PRO PRO A . n 
A 1 241 ASP 241 296 296 ASP ASP A . n 
A 1 242 ASN 242 297 297 ASN ASN A . n 
A 1 243 GLU 243 298 298 GLU GLU A . n 
A 1 244 ARG 244 299 299 ARG ARG A . n 
A 1 245 PRO 245 300 300 PRO PRO A . n 
A 1 246 SER 246 301 301 SER SER A . n 
A 1 247 VAL 247 302 302 VAL VAL A . n 
A 1 248 TYR 248 303 303 TYR TYR A . n 
A 1 249 ALA 249 304 304 ALA ALA A . n 
A 1 250 PHE 250 305 305 PHE PHE A . n 
A 1 251 TYR 251 306 306 TYR TYR A . n 
A 1 252 SER 252 307 307 SER SER A . n 
A 1 253 GLU 253 308 308 GLU GLU A . n 
A 1 254 GLN 254 309 309 GLN GLN A . n 
A 1 255 PRO 255 310 310 PRO PRO A . n 
A 1 256 ASP 256 311 311 ASP ASP A . n 
A 1 257 PHE 257 312 312 PHE PHE A . n 
A 1 258 SER 258 313 313 SER SER A . n 
A 1 259 GLY 259 314 314 GLY GLY A . n 
A 1 260 HIS 260 315 315 HIS HIS A . n 
A 1 261 LYS 261 316 316 LYS LYS A . n 
A 1 262 TYR 262 317 317 TYR TYR A . n 
A 1 263 GLY 263 318 318 GLY GLY A . n 
A 1 264 PRO 264 319 319 PRO PRO A . n 
A 1 265 PHE 265 320 320 PHE PHE A . n 
A 1 266 GLY 266 321 321 GLY GLY A . n 
A 1 267 PRO 267 322 322 PRO PRO A . n 
A 1 268 GLU 268 323 323 GLU GLU A . n 
A 1 269 MET 269 324 324 MET MET A . n 
A 1 270 THR 270 325 325 THR THR A . n 
A 1 271 ASN 271 326 326 ASN ASN A . n 
A 1 272 PRO 272 327 327 PRO PRO A . n 
A 1 273 LEU 273 328 328 LEU LEU A . n 
A 1 274 ARG 274 329 329 ARG ARG A . n 
A 1 275 GLU 275 330 330 GLU GLU A . n 
A 1 276 ILE 276 331 331 ILE ILE A . n 
A 1 277 ASP 277 332 332 ASP ASP A . n 
A 1 278 LYS 278 333 333 LYS LYS A . n 
A 1 279 THR 279 334 334 THR THR A . n 
A 1 280 VAL 280 335 335 VAL VAL A . n 
A 1 281 GLY 281 336 336 GLY GLY A . n 
A 1 282 GLN 282 337 337 GLN GLN A . n 
A 1 283 LEU 283 338 338 LEU LEU A . n 
A 1 284 MET 284 339 339 MET MET A . n 
A 1 285 ASP 285 340 340 ASP ASP A . n 
A 1 286 GLY 286 341 341 GLY GLY A . n 
A 1 287 LEU 287 342 342 LEU LEU A . n 
A 1 288 LYS 288 343 343 LYS LYS A . n 
A 1 289 GLN 289 344 344 GLN GLN A . n 
A 1 290 LEU 290 345 345 LEU LEU A . n 
A 1 291 ARG 291 346 346 ARG ARG A . n 
A 1 292 LEU 292 347 347 LEU LEU A . n 
A 1 293 HIS 293 348 348 HIS HIS A . n 
A 1 294 ARG 294 349 349 ARG ARG A . n 
A 1 295 CYS 295 350 350 CYS CYS A . n 
A 1 296 VAL 296 351 351 VAL VAL A . n 
A 1 297 ASN 297 352 352 ASN ASN A . n 
A 1 298 VAL 298 353 353 VAL VAL A . n 
A 1 299 ILE 299 354 354 ILE ILE A . n 
A 1 300 PHE 300 355 355 PHE PHE A . n 
A 1 301 VAL 301 356 356 VAL VAL A . n 
A 1 302 GLY 302 357 357 GLY GLY A . n 
A 1 303 ASP 303 358 358 ASP ASP A . n 
A 1 304 HIS 304 359 359 HIS HIS A . n 
A 1 305 GLY 305 360 360 GLY GLY A . n 
A 1 306 MET 306 361 361 MET MET A . n 
A 1 307 GLU 307 362 362 GLU GLU A . n 
A 1 308 ASP 308 363 363 ASP ASP A . n 
A 1 309 VAL 309 364 364 VAL VAL A . n 
A 1 310 THR 310 365 365 THR THR A . n 
A 1 311 CYS 311 366 366 CYS CYS A . n 
A 1 312 ASP 312 367 367 ASP ASP A . n 
A 1 313 ARG 313 368 368 ARG ARG A . n 
A 1 314 THR 314 369 369 THR THR A . n 
A 1 315 GLU 315 370 370 GLU GLU A . n 
A 1 316 PHE 316 371 371 PHE PHE A . n 
A 1 317 LEU 317 372 372 LEU LEU A . n 
A 1 318 SER 318 373 373 SER SER A . n 
A 1 319 ASN 319 374 374 ASN ASN A . n 
A 1 320 TYR 320 375 375 TYR TYR A . n 
A 1 321 LEU 321 376 376 LEU LEU A . n 
A 1 322 THR 322 377 377 THR THR A . n 
A 1 323 ASN 323 378 378 ASN ASN A . n 
A 1 324 VAL 324 379 379 VAL VAL A . n 
A 1 325 ASP 325 380 380 ASP ASP A . n 
A 1 326 ASP 326 381 381 ASP ASP A . n 
A 1 327 ILE 327 382 382 ILE ILE A . n 
A 1 328 THR 328 383 383 THR THR A . n 
A 1 329 LEU 329 384 384 LEU LEU A . n 
A 1 330 VAL 330 385 385 VAL VAL A . n 
A 1 331 PRO 331 386 386 PRO PRO A . n 
A 1 332 GLY 332 387 387 GLY GLY A . n 
A 1 333 THR 333 388 388 THR THR A . n 
A 1 334 LEU 334 389 389 LEU LEU A . n 
A 1 335 GLY 335 390 390 GLY GLY A . n 
A 1 336 ARG 336 391 391 ARG ARG A . n 
A 1 337 ILE 337 392 392 ILE ILE A . n 
A 1 338 ARG 338 393 393 ARG ARG A . n 
A 1 339 ALA 339 394 394 ALA ALA A . n 
A 1 340 LYS 340 395 395 LYS LYS A . n 
A 1 341 SER 341 396 396 SER SER A . n 
A 1 342 ILE 342 397 ?   ?   ?   A . n 
A 1 343 ASN 343 398 ?   ?   ?   A . n 
A 1 344 ASN 344 399 ?   ?   ?   A . n 
A 1 345 SER 345 400 ?   ?   ?   A . n 
A 1 346 LYS 346 401 401 LYS LYS A . n 
A 1 347 TYR 347 402 402 TYR TYR A . n 
A 1 348 ASP 348 403 403 ASP ASP A . n 
A 1 349 PRO 349 404 404 PRO PRO A . n 
A 1 350 LYS 350 405 405 LYS LYS A . n 
A 1 351 THR 351 406 406 THR THR A . n 
A 1 352 ILE 352 407 407 ILE ILE A . n 
A 1 353 ILE 353 408 408 ILE ILE A . n 
A 1 354 ALA 354 409 409 ALA ALA A . n 
A 1 355 ALA 355 410 410 ALA ALA A . n 
A 1 356 LEU 356 411 411 LEU LEU A . n 
A 1 357 THR 357 412 412 THR THR A . n 
A 1 358 CYS 358 413 413 CYS CYS A . n 
A 1 359 LYS 359 414 414 LYS LYS A . n 
A 1 360 LYS 360 415 415 LYS LYS A . n 
A 1 361 PRO 361 416 416 PRO PRO A . n 
A 1 362 ASP 362 417 417 ASP ASP A . n 
A 1 363 GLN 363 418 418 GLN GLN A . n 
A 1 364 HIS 364 419 419 HIS HIS A . n 
A 1 365 PHE 365 420 420 PHE PHE A . n 
A 1 366 LYS 366 421 421 LYS LYS A . n 
A 1 367 PRO 367 422 422 PRO PRO A . n 
A 1 368 TYR 368 423 423 TYR TYR A . n 
A 1 369 MET 369 424 424 MET MET A . n 
A 1 370 LYS 370 425 425 LYS LYS A . n 
A 1 371 GLN 371 426 426 GLN GLN A . n 
A 1 372 HIS 372 427 427 HIS HIS A . n 
A 1 373 LEU 373 428 428 LEU LEU A . n 
A 1 374 PRO 374 429 429 PRO PRO A . n 
A 1 375 LYS 375 430 430 LYS LYS A . n 
A 1 376 ARG 376 431 431 ARG ARG A . n 
A 1 377 LEU 377 432 432 LEU LEU A . n 
A 1 378 HIS 378 433 433 HIS HIS A . n 
A 1 379 TYR 379 434 434 TYR TYR A . n 
A 1 380 ALA 380 435 435 ALA ALA A . n 
A 1 381 ASN 381 436 436 ASN ASN A . n 
A 1 382 ASN 382 437 437 ASN ASN A . n 
A 1 383 ARG 383 438 438 ARG ARG A . n 
A 1 384 ARG 384 439 439 ARG ARG A . n 
A 1 385 ILE 385 440 440 ILE ILE A . n 
A 1 386 GLU 386 441 441 GLU GLU A . n 
A 1 387 ASP 387 442 442 ASP ASP A . n 
A 1 388 ILE 388 443 443 ILE ILE A . n 
A 1 389 HIS 389 444 444 HIS HIS A . n 
A 1 390 LEU 390 445 445 LEU LEU A . n 
A 1 391 LEU 391 446 446 LEU LEU A . n 
A 1 392 VAL 392 447 447 VAL VAL A . n 
A 1 393 ASP 393 448 448 ASP ASP A . n 
A 1 394 ARG 394 449 449 ARG ARG A . n 
A 1 395 ARG 395 450 450 ARG ARG A . n 
A 1 396 TRP 396 451 451 TRP TRP A . n 
A 1 397 HIS 397 452 452 HIS HIS A . n 
A 1 398 VAL 398 453 453 VAL VAL A . n 
A 1 399 ALA 399 454 454 ALA ALA A . n 
A 1 400 ARG 400 455 455 ARG ALA A . n 
A 1 401 LYS 401 456 456 LYS LYS A . n 
A 1 402 PRO 402 457 457 PRO PRO A . n 
A 1 403 LEU 403 458 458 LEU LEU A . n 
A 1 404 ASP 404 459 459 ASP ASP A . n 
A 1 405 VAL 405 460 460 VAL VAL A . n 
A 1 406 TYR 406 461 461 TYR TYR A . n 
A 1 407 LYS 407 462 462 LYS LYS A . n 
A 1 408 LYS 408 463 463 LYS LYS A . n 
A 1 409 PRO 409 464 464 PRO PRO A . n 
A 1 410 SER 410 465 465 SER SER A . n 
A 1 411 GLY 411 466 466 GLY GLY A . n 
A 1 412 LYS 412 467 467 LYS LYS A . n 
A 1 413 CYS 413 468 468 CYS CYS A . n 
A 1 414 PHE 414 469 469 PHE PHE A . n 
A 1 415 PHE 415 470 470 PHE PHE A . n 
A 1 416 GLN 416 471 471 GLN GLN A . n 
A 1 417 GLY 417 472 472 GLY GLY A . n 
A 1 418 ASP 418 473 473 ASP ASP A . n 
A 1 419 HIS 419 474 474 HIS HIS A . n 
A 1 420 GLY 420 475 475 GLY GLY A . n 
A 1 421 PHE 421 476 476 PHE PHE A . n 
A 1 422 ASP 422 477 477 ASP ASP A . n 
A 1 423 ASN 423 478 478 ASN ASN A . n 
A 1 424 LYS 424 479 479 LYS LYS A . n 
A 1 425 VAL 425 480 480 VAL VAL A . n 
A 1 426 ASN 426 481 481 ASN ASN A . n 
A 1 427 SER 427 482 482 SER SER A . n 
A 1 428 MET 428 483 483 MET MET A . n 
A 1 429 GLN 429 484 484 GLN GLN A . n 
A 1 430 THR 430 485 485 THR THR A . n 
A 1 431 VAL 431 486 486 VAL VAL A . n 
A 1 432 PHE 432 487 487 PHE PHE A . n 
A 1 433 VAL 433 488 488 VAL VAL A . n 
A 1 434 GLY 434 489 489 GLY GLY A . n 
A 1 435 TYR 435 490 490 TYR TYR A . n 
A 1 436 GLY 436 491 491 GLY GLY A . n 
A 1 437 PRO 437 492 492 PRO PRO A . n 
A 1 438 THR 438 493 493 THR THR A . n 
A 1 439 PHE 439 494 494 PHE PHE A . n 
A 1 440 LYS 440 495 495 LYS LYS A . n 
A 1 441 TYR 441 496 496 TYR TYR A . n 
A 1 442 ARG 442 497 497 ARG ARG A . n 
A 1 443 THR 443 498 498 THR THR A . n 
A 1 444 LYS 444 499 499 LYS LYS A . n 
A 1 445 VAL 445 500 500 VAL VAL A . n 
A 1 446 PRO 446 501 501 PRO PRO A . n 
A 1 447 PRO 447 502 502 PRO PRO A . n 
A 1 448 PHE 448 503 503 PHE PHE A . n 
A 1 449 GLU 449 504 504 GLU GLU A . n 
A 1 450 ASN 450 505 505 ASN ASN A . n 
A 1 451 ILE 451 506 506 ILE ILE A . n 
A 1 452 GLU 452 507 507 GLU GLU A . n 
A 1 453 LEU 453 508 508 LEU LEU A . n 
A 1 454 TYR 454 509 509 TYR TYR A . n 
A 1 455 ASN 455 510 510 ASN ASN A . n 
A 1 456 VAL 456 511 511 VAL VAL A . n 
A 1 457 MET 457 512 512 MET MET A . n 
A 1 458 CYS 458 513 513 CYS CYS A . n 
A 1 459 ASP 459 514 514 ASP ASP A . n 
A 1 460 LEU 460 515 515 LEU LEU A . n 
A 1 461 LEU 461 516 516 LEU LEU A . n 
A 1 462 GLY 462 517 517 GLY GLY A . n 
A 1 463 LEU 463 518 518 LEU LEU A . n 
A 1 464 LYS 464 519 519 LYS LYS A . n 
A 1 465 PRO 465 520 520 PRO PRO A . n 
A 1 466 ALA 466 521 521 ALA ALA A . n 
A 1 467 PRO 467 522 522 PRO PRO A . n 
A 1 468 ASN 468 523 523 ASN ASN A . n 
A 1 469 ASN 469 524 524 ASN ASN A . n 
A 1 470 GLY 470 525 525 GLY GLY A . n 
A 1 471 THR 471 526 526 THR THR A . n 
A 1 472 HIS 472 527 527 HIS HIS A . n 
A 1 473 GLY 473 528 528 GLY GLY A . n 
A 1 474 SER 474 529 529 SER SER A . n 
A 1 475 LEU 475 530 530 LEU LEU A . n 
A 1 476 ASN 476 531 531 ASN ASN A . n 
A 1 477 HIS 477 532 532 HIS HIS A . n 
A 1 478 LEU 478 533 533 LEU LEU A . n 
A 1 479 LEU 479 534 534 LEU LEU A . n 
A 1 480 ARG 480 535 535 ARG ARG A . n 
A 1 481 THR 481 536 536 THR THR A . n 
A 1 482 ASN 482 537 537 ASN ASN A . n 
A 1 483 THR 483 538 538 THR THR A . n 
A 1 484 PHE 484 539 539 PHE PHE A . n 
A 1 485 ARG 485 540 540 ARG ARG A . n 
A 1 486 PRO 486 541 541 PRO PRO A . n 
A 1 487 THR 487 542 542 THR THR A . n 
A 1 488 MET 488 543 543 MET MET A . n 
A 1 489 PRO 489 544 544 PRO PRO A . n 
A 1 490 ASP 490 545 545 ASP ASP A . n 
A 1 491 GLU 491 546 546 GLU GLU A . n 
A 1 492 VAL 492 547 547 VAL VAL A . n 
A 1 493 SER 493 548 548 SER SER A . n 
A 1 494 ARG 494 549 549 ARG ARG A . n 
A 1 495 PRO 495 550 550 PRO PRO A . n 
A 1 496 ASN 496 551 551 ASN ASN A . n 
A 1 497 TYR 497 552 552 TYR TYR A . n 
A 1 498 PRO 498 553 553 PRO PRO A . n 
A 1 499 GLY 499 554 554 GLY GLY A . n 
A 1 500 ILE 500 555 555 ILE ILE A . n 
A 1 501 MET 501 556 556 MET MET A . n 
A 1 502 TYR 502 557 557 TYR TYR A . n 
A 1 503 LEU 503 558 558 LEU LEU A . n 
A 1 504 GLN 504 559 559 GLN GLN A . n 
A 1 505 SER 505 560 560 SER SER A . n 
A 1 506 GLU 506 561 561 GLU GLU A . n 
A 1 507 PHE 507 562 562 PHE PHE A . n 
A 1 508 ASP 508 563 563 ASP ASP A . n 
A 1 509 LEU 509 564 564 LEU LEU A . n 
A 1 510 GLY 510 565 565 GLY GLY A . n 
A 1 511 CYS 511 566 566 CYS CYS A . n 
A 1 512 THR 512 567 567 THR THR A . n 
A 1 513 CYS 513 568 568 CYS CYS A . n 
A 1 514 ASP 514 569 569 ASP ASP A . n 
A 1 515 ASP 515 570 570 ASP ASP A . n 
A 1 516 LYS 516 571 ?   ?   ?   A . n 
A 1 517 VAL 517 572 ?   ?   ?   A . n 
A 1 518 GLU 518 573 ?   ?   ?   A . n 
A 1 519 PRO 519 574 ?   ?   ?   A . n 
A 1 520 LYS 520 575 ?   ?   ?   A . n 
A 1 521 ASN 521 576 ?   ?   ?   A . n 
A 1 522 LYS 522 577 ?   ?   ?   A . n 
A 1 523 LEU 523 578 ?   ?   ?   A . n 
A 1 524 GLU 524 579 ?   ?   ?   A . n 
A 1 525 GLU 525 580 ?   ?   ?   A . n 
A 1 526 LEU 526 581 ?   ?   ?   A . n 
A 1 527 ASN 527 582 ?   ?   ?   A . n 
A 1 528 LYS 528 583 ?   ?   ?   A . n 
A 1 529 ARG 529 584 ?   ?   ?   A . n 
A 1 530 LEU 530 585 ?   ?   ?   A . n 
A 1 531 HIS 531 586 586 HIS HIS A . n 
A 1 532 THR 532 587 587 THR THR A . n 
A 1 533 LYS 533 588 588 LYS LYS A . n 
A 1 534 GLY 534 589 589 GLY GLY A . n 
A 1 535 SER 535 590 590 SER SER A . n 
A 1 536 THR 536 591 591 THR THR A . n 
A 1 537 LYS 537 592 592 LYS LYS A . n 
A 1 538 GLU 538 593 593 GLU GLU A . n 
A 1 539 ARG 539 594 594 ARG ARG A . n 
A 1 540 HIS 540 595 595 HIS HIS A . n 
A 1 541 LEU 541 596 596 LEU LEU A . n 
A 1 542 LEU 542 597 597 LEU LEU A . n 
A 1 543 TYR 543 598 598 TYR TYR A . n 
A 1 544 GLY 544 599 599 GLY GLY A . n 
A 1 545 ARG 545 600 600 ARG ARG A . n 
A 1 546 PRO 546 601 601 PRO PRO A . n 
A 1 547 ALA 547 602 602 ALA ALA A . n 
A 1 548 VAL 548 603 603 VAL VAL A . n 
A 1 549 LEU 549 604 604 LEU LEU A . n 
A 1 550 TYR 550 605 605 TYR TYR A . n 
A 1 551 ARG 551 606 606 ARG ARG A . n 
A 1 552 THR 552 607 607 THR THR A . n 
A 1 553 SER 553 608 608 SER SER A . n 
A 1 554 TYR 554 609 609 TYR TYR A . n 
A 1 555 ASP 555 610 610 ASP ASP A . n 
A 1 556 ILE 556 611 611 ILE ILE A . n 
A 1 557 LEU 557 612 612 LEU LEU A . n 
A 1 558 TYR 558 613 613 TYR TYR A . n 
A 1 559 HIS 559 614 614 HIS HIS A . n 
A 1 560 THR 560 615 615 THR THR A . n 
A 1 561 ASP 561 616 616 ASP ASP A . n 
A 1 562 PHE 562 617 617 PHE PHE A . n 
A 1 563 GLU 563 618 618 GLU GLU A . n 
A 1 564 SER 564 619 619 SER SER A . n 
A 1 565 GLY 565 620 620 GLY GLY A . n 
A 1 566 TYR 566 621 621 TYR TYR A . n 
A 1 567 SER 567 622 622 SER SER A . n 
A 1 568 GLU 568 623 623 GLU GLU A . n 
A 1 569 ILE 569 624 624 ILE ILE A . n 
A 1 570 PHE 570 625 625 PHE PHE A . n 
A 1 571 LEU 571 626 626 LEU LEU A . n 
A 1 572 MET 572 627 627 MET MET A . n 
A 1 573 PRO 573 628 628 PRO PRO A . n 
A 1 574 LEU 574 629 629 LEU LEU A . n 
A 1 575 TRP 575 630 630 TRP TRP A . n 
A 1 576 THR 576 631 631 THR THR A . n 
A 1 577 SER 577 632 632 SER SER A . n 
A 1 578 TYR 578 633 633 TYR TYR A . n 
A 1 579 THR 579 634 634 THR THR A . n 
A 1 580 ILE 580 635 635 ILE ILE A . n 
A 1 581 SER 581 636 636 SER SER A . n 
A 1 582 LYS 582 637 637 LYS LYS A . n 
A 1 583 GLN 583 638 638 GLN GLN A . n 
A 1 584 ALA 584 639 639 ALA ALA A . n 
A 1 585 GLU 585 640 640 GLU GLU A . n 
A 1 586 VAL 586 641 641 VAL VAL A . n 
A 1 587 SER 587 642 642 SER SER A . n 
A 1 588 SER 588 643 643 SER SER A . n 
A 1 589 ILE 589 644 644 ILE ILE A . n 
A 1 590 PRO 590 645 645 PRO PRO A . n 
A 1 591 GLU 591 646 646 GLU GLU A . n 
A 1 592 HIS 592 647 647 HIS HIS A . n 
A 1 593 LEU 593 648 648 LEU LEU A . n 
A 1 594 THR 594 649 649 THR THR A . n 
A 1 595 ASN 595 650 650 ASN ASN A . n 
A 1 596 CYS 596 651 651 CYS CYS A . n 
A 1 597 VAL 597 652 652 VAL VAL A . n 
A 1 598 ARG 598 653 653 ARG ARG A . n 
A 1 599 PRO 599 654 654 PRO PRO A . n 
A 1 600 ASP 600 655 655 ASP ASP A . n 
A 1 601 VAL 601 656 656 VAL VAL A . n 
A 1 602 ARG 602 657 657 ARG ARG A . n 
A 1 603 VAL 603 658 658 VAL VAL A . n 
A 1 604 SER 604 659 659 SER SER A . n 
A 1 605 PRO 605 660 660 PRO PRO A . n 
A 1 606 GLY 606 661 661 GLY GLY A . n 
A 1 607 PHE 607 662 662 PHE PHE A . n 
A 1 608 SER 608 663 663 SER SER A . n 
A 1 609 GLN 609 664 664 GLN GLN A . n 
A 1 610 ASN 610 665 665 ASN ASN A . n 
A 1 611 CYS 611 666 666 CYS CYS A . n 
A 1 612 LEU 612 667 667 LEU LEU A . n 
A 1 613 ALA 613 668 668 ALA ALA A . n 
A 1 614 TYR 614 669 669 TYR TYR A . n 
A 1 615 LYS 615 670 670 LYS LYS A . n 
A 1 616 ASN 616 671 671 ASN ASN A . n 
A 1 617 ASP 617 672 672 ASP ASP A . n 
A 1 618 LYS 618 673 673 LYS LYS A . n 
A 1 619 GLN 619 674 674 GLN GLN A . n 
A 1 620 MET 620 675 675 MET MET A . n 
A 1 621 SER 621 676 676 SER SER A . n 
A 1 622 TYR 622 677 677 TYR TYR A . n 
A 1 623 GLY 623 678 678 GLY GLY A . n 
A 1 624 PHE 624 679 679 PHE PHE A . n 
A 1 625 LEU 625 680 680 LEU LEU A . n 
A 1 626 PHE 626 681 681 PHE PHE A . n 
A 1 627 PRO 627 682 682 PRO PRO A . n 
A 1 628 PRO 628 683 683 PRO PRO A . n 
A 1 629 TYR 629 684 684 TYR TYR A . n 
A 1 630 LEU 630 685 685 LEU LEU A . n 
A 1 631 SER 631 686 686 SER SER A . n 
A 1 632 SER 632 687 687 SER SER A . n 
A 1 633 SER 633 688 688 SER SER A . n 
A 1 634 PRO 634 689 689 PRO PRO A . n 
A 1 635 GLU 635 690 690 GLU GLU A . n 
A 1 636 ALA 636 691 691 ALA ALA A . n 
A 1 637 LYS 637 692 692 LYS LYS A . n 
A 1 638 TYR 638 693 693 TYR TYR A . n 
A 1 639 ASP 639 694 694 ASP ASP A . n 
A 1 640 ALA 640 695 695 ALA ALA A . n 
A 1 641 PHE 641 696 696 PHE PHE A . n 
A 1 642 LEU 642 697 697 LEU LEU A . n 
A 1 643 VAL 643 698 698 VAL VAL A . n 
A 1 644 THR 644 699 699 THR THR A . n 
A 1 645 ASN 645 700 700 ASN ASN A . n 
A 1 646 MET 646 701 701 MET MET A . n 
A 1 647 VAL 647 702 702 VAL VAL A . n 
A 1 648 PRO 648 703 703 PRO PRO A . n 
A 1 649 MET 649 704 704 MET MET A . n 
A 1 650 TYR 650 705 705 TYR TYR A . n 
A 1 651 PRO 651 706 706 PRO PRO A . n 
A 1 652 ALA 652 707 707 ALA ALA A . n 
A 1 653 PHE 653 708 708 PHE PHE A . n 
A 1 654 LYS 654 709 709 LYS LYS A . n 
A 1 655 ARG 655 710 710 ARG ARG A . n 
A 1 656 VAL 656 711 711 VAL VAL A . n 
A 1 657 TRP 657 712 712 TRP TRP A . n 
A 1 658 ALA 658 713 713 ALA ALA A . n 
A 1 659 TYR 659 714 714 TYR TYR A . n 
A 1 660 PHE 660 715 715 PHE PHE A . n 
A 1 661 GLN 661 716 716 GLN GLN A . n 
A 1 662 ARG 662 717 717 ARG ARG A . n 
A 1 663 VAL 663 718 718 VAL VAL A . n 
A 1 664 LEU 664 719 719 LEU LEU A . n 
A 1 665 VAL 665 720 720 VAL VAL A . n 
A 1 666 LYS 666 721 721 LYS LYS A . n 
A 1 667 LYS 667 722 722 LYS LYS A . n 
A 1 668 TYR 668 723 723 TYR TYR A . n 
A 1 669 ALA 669 724 724 ALA ALA A . n 
A 1 670 SER 670 725 725 SER SER A . n 
A 1 671 GLU 671 726 726 GLU GLU A . n 
A 1 672 ARG 672 727 727 ARG ARG A . n 
A 1 673 ASN 673 728 728 ASN ASN A . n 
A 1 674 GLY 674 729 729 GLY GLY A . n 
A 1 675 VAL 675 730 730 VAL VAL A . n 
A 1 676 ASN 676 731 731 ASN ASN A . n 
A 1 677 VAL 677 732 732 VAL VAL A . n 
A 1 678 ILE 678 733 733 ILE ILE A . n 
A 1 679 SER 679 734 734 SER SER A . n 
A 1 680 GLY 680 735 735 GLY GLY A . n 
A 1 681 PRO 681 736 736 PRO PRO A . n 
A 1 682 ILE 682 737 737 ILE ILE A . n 
A 1 683 PHE 683 738 738 PHE PHE A . n 
A 1 684 ASP 684 739 739 ASP ASP A . n 
A 1 685 TYR 685 740 740 TYR TYR A . n 
A 1 686 ASN 686 741 741 ASN ASN A . n 
A 1 687 TYR 687 742 742 TYR TYR A . n 
A 1 688 ASP 688 743 743 ASP ASP A . n 
A 1 689 GLY 689 744 744 GLY GLY A . n 
A 1 690 LEU 690 745 745 LEU LEU A . n 
A 1 691 ARG 691 746 746 ARG ARG A . n 
A 1 692 ASP 692 747 747 ASP ASP A . n 
A 1 693 THR 693 748 748 THR THR A . n 
A 1 694 GLU 694 749 749 GLU GLU A . n 
A 1 695 ASP 695 750 750 ASP ASP A . n 
A 1 696 GLU 696 751 751 GLU GLU A . n 
A 1 697 ILE 697 752 752 ILE ILE A . n 
A 1 698 LYS 698 753 753 LYS LYS A . n 
A 1 699 GLN 699 754 754 GLN GLN A . n 
A 1 700 TYR 700 755 755 TYR TYR A . n 
A 1 701 VAL 701 756 756 VAL VAL A . n 
A 1 702 GLU 702 757 757 GLU GLU A . n 
A 1 703 GLY 703 758 758 GLY GLY A . n 
A 1 704 SER 704 759 759 SER SER A . n 
A 1 705 SER 705 760 760 SER SER A . n 
A 1 706 ILE 706 761 761 ILE ILE A . n 
A 1 707 PRO 707 762 762 PRO PRO A . n 
A 1 708 VAL 708 763 763 VAL VAL A . n 
A 1 709 PRO 709 764 764 PRO PRO A . n 
A 1 710 THR 710 765 765 THR THR A . n 
A 1 711 HIS 711 766 766 HIS HIS A . n 
A 1 712 TYR 712 767 767 TYR TYR A . n 
A 1 713 TYR 713 768 768 TYR TYR A . n 
A 1 714 SER 714 769 769 SER SER A . n 
A 1 715 ILE 715 770 770 ILE ILE A . n 
A 1 716 ILE 716 771 771 ILE ILE A . n 
A 1 717 THR 717 772 772 THR THR A . n 
A 1 718 SER 718 773 773 SER SER A . n 
A 1 719 CYS 719 774 774 CYS CYS A . n 
A 1 720 LEU 720 775 775 LEU LEU A . n 
A 1 721 ASP 721 776 776 ASP ASP A . n 
A 1 722 PHE 722 777 777 PHE PHE A . n 
A 1 723 THR 723 778 778 THR THR A . n 
A 1 724 GLN 724 779 779 GLN GLN A . n 
A 1 725 PRO 725 780 780 PRO PRO A . n 
A 1 726 ALA 726 781 781 ALA ALA A . n 
A 1 727 ASP 727 782 782 ASP ASP A . n 
A 1 728 LYS 728 783 783 LYS LYS A . n 
A 1 729 CYS 729 784 784 CYS CYS A . n 
A 1 730 ASP 730 785 785 ASP ASP A . n 
A 1 731 GLY 731 786 786 GLY GLY A . n 
A 1 732 PRO 732 787 787 PRO PRO A . n 
A 1 733 LEU 733 788 788 LEU LEU A . n 
A 1 734 SER 734 789 789 SER SER A . n 
A 1 735 VAL 735 790 790 VAL VAL A . n 
A 1 736 SER 736 791 791 SER SER A . n 
A 1 737 SER 737 792 792 SER SER A . n 
A 1 738 PHE 738 793 793 PHE PHE A . n 
A 1 739 ILE 739 794 794 ILE ILE A . n 
A 1 740 LEU 740 795 795 LEU LEU A . n 
A 1 741 PRO 741 796 796 PRO PRO A . n 
A 1 742 HIS 742 797 797 HIS HIS A . n 
A 1 743 ARG 743 798 798 ARG ARG A . n 
A 1 744 PRO 744 799 799 PRO PRO A . n 
A 1 745 ASP 745 800 800 ASP ASP A . n 
A 1 746 ASN 746 801 801 ASN ASN A . n 
A 1 747 ASP 747 802 802 ASP ASP A . n 
A 1 748 GLU 748 803 803 GLU GLU A . n 
A 1 749 SER 749 804 804 SER SER A . n 
A 1 750 CYS 750 805 805 CYS CYS A . n 
A 1 751 ASN 751 806 806 ASN ASN A . n 
A 1 752 SER 752 807 807 SER SER A . n 
A 1 753 SER 753 808 808 SER SER A . n 
A 1 754 GLU 754 809 809 GLU GLU A . n 
A 1 755 ASP 755 810 810 ASP ASP A . n 
A 1 756 GLU 756 811 811 GLU GLU A . n 
A 1 757 SER 757 812 812 SER SER A . n 
A 1 758 LYS 758 813 813 LYS LYS A . n 
A 1 759 TRP 759 814 814 TRP TRP A . n 
A 1 760 VAL 760 815 815 VAL VAL A . n 
A 1 761 GLU 761 816 816 GLU GLU A . n 
A 1 762 GLU 762 817 817 GLU GLU A . n 
A 1 763 LEU 763 818 818 LEU LEU A . n 
A 1 764 MET 764 819 819 MET MET A . n 
A 1 765 LYS 765 820 820 LYS LYS A . n 
A 1 766 MET 766 821 821 MET MET A . n 
A 1 767 HIS 767 822 822 HIS HIS A . n 
A 1 768 THR 768 823 823 THR THR A . n 
A 1 769 ALA 769 824 824 ALA ALA A . n 
A 1 770 ARG 770 825 825 ARG ARG A . n 
A 1 771 VAL 771 826 826 VAL VAL A . n 
A 1 772 ARG 772 827 827 ARG ARG A . n 
A 1 773 ASP 773 828 828 ASP ASP A . n 
A 1 774 ILE 774 829 829 ILE ILE A . n 
A 1 775 GLU 775 830 830 GLU GLU A . n 
A 1 776 HIS 776 831 831 HIS HIS A . n 
A 1 777 LEU 777 832 832 LEU LEU A . n 
A 1 778 THR 778 833 833 THR THR A . n 
A 1 779 GLY 779 834 834 GLY GLY A . n 
A 1 780 LEU 780 835 835 LEU LEU A . n 
A 1 781 ASP 781 836 836 ASP ASP A . n 
A 1 782 PHE 782 837 837 PHE PHE A . n 
A 1 783 TYR 783 838 838 TYR TYR A . n 
A 1 784 ARG 784 839 839 ARG ARG A . n 
A 1 785 LYS 785 840 840 LYS LYS A . n 
A 1 786 THR 786 841 841 THR THR A . n 
A 1 787 SER 787 842 842 SER SER A . n 
A 1 788 ARG 788 843 843 ARG ARG A . n 
A 1 789 SER 789 844 844 SER SER A . n 
A 1 790 TYR 790 845 845 TYR TYR A . n 
A 1 791 SER 791 846 846 SER SER A . n 
A 1 792 GLU 792 847 847 GLU GLU A . n 
A 1 793 ILE 793 848 848 ILE ILE A . n 
A 1 794 LEU 794 849 849 LEU LEU A . n 
A 1 795 THR 795 850 850 THR THR A . n 
A 1 796 LEU 796 851 851 LEU LEU A . n 
A 1 797 LYS 797 852 852 LYS LYS A . n 
A 1 798 THR 798 853 853 THR THR A . n 
A 1 799 TYR 799 854 854 TYR TYR A . n 
A 1 800 LEU 800 855 855 LEU LEU A . n 
A 1 801 HIS 801 856 856 HIS HIS A . n 
A 1 802 THR 802 857 857 THR THR A . n 
A 1 803 TYR 803 858 858 TYR TYR A . n 
A 1 804 GLU 804 859 859 GLU GLU A . n 
A 1 805 SER 805 860 ?   ?   ?   A . n 
A 1 806 GLU 806 861 ?   ?   ?   A . n 
A 1 807 ILE 807 862 ?   ?   ?   A . n 
# 
loop_
_pdbx_branch_scheme.asym_id 
_pdbx_branch_scheme.entity_id 
_pdbx_branch_scheme.mon_id 
_pdbx_branch_scheme.num 
_pdbx_branch_scheme.pdb_asym_id 
_pdbx_branch_scheme.pdb_mon_id 
_pdbx_branch_scheme.pdb_seq_num 
_pdbx_branch_scheme.auth_asym_id 
_pdbx_branch_scheme.auth_mon_id 
_pdbx_branch_scheme.auth_seq_num 
_pdbx_branch_scheme.hetero 
B 2 NAG 1 B NAG 1 A NAG 7802 n 
B 2 NAG 2 B NAG 2 A NAG 7803 n 
B 2 BMA 3 B BMA 3 A BMA 7838 n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        A1IG1 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   A1IG1 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
C  3  SCN   1   901  1863 SCN   SCN A . 
D  3  SCN   1   902  1864 SCN   SCN A . 
E  3  SCN   1   903  1865 SCN   SCN A . 
F  4  ZN    1   904  1867 ZN    ZN  A . 
G  4  ZN    1   905  1868 ZN    ZN  A . 
H  5  CA    1   906  1869 CA    CA  A . 
I  6  IOD   1   907  1871 IOD   IOD A . 
J  6  IOD   1   908  1881 IOD   IOD A . 
K  7  A1IG1 1   909  1901 A1IG1 G21 A . 
L  3  SCN   1   910  2001 SCN   SCN A . 
M  6  IOD   1   911  2201 IOD   IOD A . 
N  3  SCN   1   912  3501 SCN   SCN A . 
O  3  SCN   1   913  5101 SCN   SCN A . 
P  3  SCN   1   914  6801 SCN   SCN A . 
Q  3  SCN   1   915  7101 SCN   SCN A . 
R  3  SCN   1   916  7201 SCN   SCN A . 
S  3  SCN   1   917  7401 SCN   SCN A . 
T  3  SCN   1   918  7501 SCN   SCN A . 
U  3  SCN   1   919  7601 SCN   SCN A . 
V  3  SCN   1   920  7701 SCN   SCN A . 
W  3  SCN   1   921  7801 SCN   SCN A . 
X  3  SCN   1   922  7805 SCN   SCN A . 
Y  3  SCN   1   923  7806 SCN   SCN A . 
Z  3  SCN   1   924  7808 SCN   SCN A . 
AA 3  SCN   1   925  7809 SCN   SCN A . 
BA 3  SCN   1   926  7810 SCN   SCN A . 
CA 3  SCN   1   927  7811 SCN   SCN A . 
DA 3  SCN   1   928  7812 SCN   SCN A . 
EA 3  SCN   1   929  7813 SCN   SCN A . 
FA 3  SCN   1   930  7814 SCN   SCN A . 
GA 3  SCN   1   931  7815 SCN   SCN A . 
HA 3  SCN   1   932  7816 SCN   SCN A . 
IA 3  SCN   1   933  7817 SCN   SCN A . 
JA 3  SCN   1   934  7818 SCN   SCN A . 
KA 3  SCN   1   935  7819 SCN   SCN A . 
LA 3  SCN   1   936  7820 SCN   SCN A . 
MA 3  SCN   1   937  7821 SCN   SCN A . 
NA 3  SCN   1   938  7822 SCN   SCN A . 
OA 8  GOL   1   939  7823 GOL   GOL A . 
PA 3  SCN   1   940  7825 SCN   SCN A . 
QA 3  SCN   1   941  7826 SCN   SCN A . 
RA 3  SCN   1   942  7827 SCN   SCN A . 
SA 3  SCN   1   943  7828 SCN   SCN A . 
TA 3  SCN   1   944  7830 SCN   SCN A . 
UA 3  SCN   1   945  7831 SCN   SCN A . 
VA 3  SCN   1   946  7833 SCN   SCN A . 
WA 9  PO4   1   947  7834 PO4   PO4 A . 
XA 3  SCN   1   948  7835 SCN   SCN A . 
YA 8  GOL   1   949  7836 GOL   GOL A . 
ZA 8  GOL   1   950  7837 GOL   GOL A . 
AB 6  IOD   1   951  1    IOD   IOD A . 
BB 6  IOD   1   952  2    IOD   IOD A . 
CB 6  IOD   1   953  3    IOD   IOD A . 
DB 6  IOD   1   954  4    IOD   IOD A . 
EB 3  SCN   1   955  101  SCN   SCN A . 
FB 10 HOH   1   5601 5601 HOH   HOH A . 
FB 10 HOH   2   5602 281  HOH   HOH A . 
FB 10 HOH   3   5603 78   HOH   HOH A . 
FB 10 HOH   4   5604 37   HOH   HOH A . 
FB 10 HOH   5   5605 97   HOH   HOH A . 
FB 10 HOH   6   5606 262  HOH   HOH A . 
FB 10 HOH   7   5607 4701 HOH   HOH A . 
FB 10 HOH   8   5608 3201 HOH   HOH A . 
FB 10 HOH   9   5609 19   HOH   HOH A . 
FB 10 HOH   10  5610 80   HOH   HOH A . 
FB 10 HOH   11  5611 68   HOH   HOH A . 
FB 10 HOH   12  5612 35   HOH   HOH A . 
FB 10 HOH   13  5613 101  HOH   HOH A . 
FB 10 HOH   14  5614 138  HOH   HOH A . 
FB 10 HOH   15  5615 182  HOH   HOH A . 
FB 10 HOH   16  5616 112  HOH   HOH A . 
FB 10 HOH   17  5617 52   HOH   HOH A . 
FB 10 HOH   18  5618 30   HOH   HOH A . 
FB 10 HOH   19  5619 137  HOH   HOH A . 
FB 10 HOH   20  5620 10   HOH   HOH A . 
FB 10 HOH   21  5621 25   HOH   HOH A . 
FB 10 HOH   22  5622 29   HOH   HOH A . 
FB 10 HOH   23  5623 240  HOH   HOH A . 
FB 10 HOH   24  5624 5901 HOH   HOH A . 
FB 10 HOH   25  5625 225  HOH   HOH A . 
FB 10 HOH   26  5626 17   HOH   HOH A . 
FB 10 HOH   27  5627 46   HOH   HOH A . 
FB 10 HOH   28  5628 98   HOH   HOH A . 
FB 10 HOH   29  5629 85   HOH   HOH A . 
FB 10 HOH   30  5630 28   HOH   HOH A . 
FB 10 HOH   31  5631 3601 HOH   HOH A . 
FB 10 HOH   32  5632 2701 HOH   HOH A . 
FB 10 HOH   33  5633 228  HOH   HOH A . 
FB 10 HOH   34  5634 54   HOH   HOH A . 
FB 10 HOH   35  5635 116  HOH   HOH A . 
FB 10 HOH   36  5636 14   HOH   HOH A . 
FB 10 HOH   37  5637 16   HOH   HOH A . 
FB 10 HOH   38  5638 38   HOH   HOH A . 
FB 10 HOH   39  5639 27   HOH   HOH A . 
FB 10 HOH   40  5640 2901 HOH   HOH A . 
FB 10 HOH   41  5641 186  HOH   HOH A . 
FB 10 HOH   42  5642 136  HOH   HOH A . 
FB 10 HOH   43  5643 15   HOH   HOH A . 
FB 10 HOH   44  5644 70   HOH   HOH A . 
FB 10 HOH   45  5645 64   HOH   HOH A . 
FB 10 HOH   46  5646 69   HOH   HOH A . 
FB 10 HOH   47  5647 269  HOH   HOH A . 
FB 10 HOH   48  5648 201  HOH   HOH A . 
FB 10 HOH   49  5649 106  HOH   HOH A . 
FB 10 HOH   50  5650 33   HOH   HOH A . 
FB 10 HOH   51  5651 76   HOH   HOH A . 
FB 10 HOH   52  5652 21   HOH   HOH A . 
FB 10 HOH   53  5653 224  HOH   HOH A . 
FB 10 HOH   54  5654 79   HOH   HOH A . 
FB 10 HOH   55  5655 140  HOH   HOH A . 
FB 10 HOH   56  5656 239  HOH   HOH A . 
FB 10 HOH   57  5657 61   HOH   HOH A . 
FB 10 HOH   58  5658 209  HOH   HOH A . 
FB 10 HOH   59  5659 215  HOH   HOH A . 
FB 10 HOH   60  5660 194  HOH   HOH A . 
FB 10 HOH   61  5661 192  HOH   HOH A . 
FB 10 HOH   62  5662 51   HOH   HOH A . 
FB 10 HOH   63  5663 183  HOH   HOH A . 
FB 10 HOH   64  5664 229  HOH   HOH A . 
FB 10 HOH   65  5665 172  HOH   HOH A . 
FB 10 HOH   66  5666 91   HOH   HOH A . 
FB 10 HOH   67  5667 141  HOH   HOH A . 
FB 10 HOH   68  5668 155  HOH   HOH A . 
FB 10 HOH   69  5669 72   HOH   HOH A . 
FB 10 HOH   70  5670 32   HOH   HOH A . 
FB 10 HOH   71  5671 50   HOH   HOH A . 
FB 10 HOH   72  5672 107  HOH   HOH A . 
FB 10 HOH   73  5673 5701 HOH   HOH A . 
FB 10 HOH   74  5674 9    HOH   HOH A . 
FB 10 HOH   75  5675 117  HOH   HOH A . 
FB 10 HOH   76  5676 265  HOH   HOH A . 
FB 10 HOH   77  5677 43   HOH   HOH A . 
FB 10 HOH   78  5678 259  HOH   HOH A . 
FB 10 HOH   79  5679 127  HOH   HOH A . 
FB 10 HOH   80  5680 4201 HOH   HOH A . 
FB 10 HOH   81  5681 18   HOH   HOH A . 
FB 10 HOH   82  5682 3    HOH   HOH A . 
FB 10 HOH   83  5683 26   HOH   HOH A . 
FB 10 HOH   84  5684 232  HOH   HOH A . 
FB 10 HOH   85  5685 168  HOH   HOH A . 
FB 10 HOH   86  5686 12   HOH   HOH A . 
FB 10 HOH   87  5687 185  HOH   HOH A . 
FB 10 HOH   88  5688 85   HOH   HOH A . 
FB 10 HOH   89  5689 56   HOH   HOH A . 
FB 10 HOH   90  5690 2501 HOH   HOH A . 
FB 10 HOH   91  5691 278  HOH   HOH A . 
FB 10 HOH   92  5692 4901 HOH   HOH A . 
FB 10 HOH   93  5693 4    HOH   HOH A . 
FB 10 HOH   94  5694 221  HOH   HOH A . 
FB 10 HOH   95  5695 149  HOH   HOH A . 
FB 10 HOH   96  5696 78   HOH   HOH A . 
FB 10 HOH   97  5697 4101 HOH   HOH A . 
FB 10 HOH   98  5698 102  HOH   HOH A . 
FB 10 HOH   99  5699 19   HOH   HOH A . 
FB 10 HOH   100 5700 74   HOH   HOH A . 
FB 10 HOH   101 5701 150  HOH   HOH A . 
FB 10 HOH   102 5702 2301 HOH   HOH A . 
FB 10 HOH   103 5703 86   HOH   HOH A . 
FB 10 HOH   104 5704 100  HOH   HOH A . 
FB 10 HOH   105 5705 55   HOH   HOH A . 
FB 10 HOH   106 5706 211  HOH   HOH A . 
FB 10 HOH   107 5707 73   HOH   HOH A . 
FB 10 HOH   108 5708 7    HOH   HOH A . 
FB 10 HOH   109 5709 6    HOH   HOH A . 
FB 10 HOH   110 5710 75   HOH   HOH A . 
FB 10 HOH   111 5711 175  HOH   HOH A . 
FB 10 HOH   112 5712 174  HOH   HOH A . 
FB 10 HOH   113 5713 277  HOH   HOH A . 
FB 10 HOH   114 5714 204  HOH   HOH A . 
FB 10 HOH   115 5715 143  HOH   HOH A . 
FB 10 HOH   116 5716 62   HOH   HOH A . 
FB 10 HOH   117 5717 158  HOH   HOH A . 
FB 10 HOH   118 5718 103  HOH   HOH A . 
FB 10 HOH   119 5719 236  HOH   HOH A . 
FB 10 HOH   120 5720 282  HOH   HOH A . 
FB 10 HOH   121 5721 200  HOH   HOH A . 
FB 10 HOH   122 5722 28   HOH   HOH A . 
FB 10 HOH   123 5723 128  HOH   HOH A . 
FB 10 HOH   124 5724 207  HOH   HOH A . 
FB 10 HOH   125 5725 234  HOH   HOH A . 
FB 10 HOH   126 5726 120  HOH   HOH A . 
FB 10 HOH   127 5727 5201 HOH   HOH A . 
FB 10 HOH   128 5728 243  HOH   HOH A . 
FB 10 HOH   129 5729 86   HOH   HOH A . 
FB 10 HOH   130 5730 4401 HOH   HOH A . 
FB 10 HOH   131 5731 47   HOH   HOH A . 
FB 10 HOH   132 5732 193  HOH   HOH A . 
FB 10 HOH   133 5733 5401 HOH   HOH A . 
FB 10 HOH   134 5734 6001 HOH   HOH A . 
FB 10 HOH   135 5735 6301 HOH   HOH A . 
FB 10 HOH   136 5736 130  HOH   HOH A . 
FB 10 HOH   137 5737 74   HOH   HOH A . 
FB 10 HOH   138 5738 176  HOH   HOH A . 
FB 10 HOH   139 5739 233  HOH   HOH A . 
FB 10 HOH   140 5740 83   HOH   HOH A . 
FB 10 HOH   141 5741 11   HOH   HOH A . 
FB 10 HOH   142 5742 59   HOH   HOH A . 
FB 10 HOH   143 5743 48   HOH   HOH A . 
FB 10 HOH   144 5744 179  HOH   HOH A . 
FB 10 HOH   145 5745 26   HOH   HOH A . 
FB 10 HOH   146 5746 42   HOH   HOH A . 
FB 10 HOH   147 5747 8    HOH   HOH A . 
FB 10 HOH   148 5748 104  HOH   HOH A . 
FB 10 HOH   149 5749 3    HOH   HOH A . 
FB 10 HOH   150 5750 6601 HOH   HOH A . 
FB 10 HOH   151 5751 258  HOH   HOH A . 
FB 10 HOH   152 5752 3001 HOH   HOH A . 
FB 10 HOH   153 5753 22   HOH   HOH A . 
FB 10 HOH   154 5754 41   HOH   HOH A . 
FB 10 HOH   155 5755 257  HOH   HOH A . 
FB 10 HOH   156 5756 153  HOH   HOH A . 
FB 10 HOH   157 5757 75   HOH   HOH A . 
FB 10 HOH   158 5758 39   HOH   HOH A . 
FB 10 HOH   159 5759 2    HOH   HOH A . 
FB 10 HOH   160 5760 235  HOH   HOH A . 
FB 10 HOH   161 5761 14   HOH   HOH A . 
FB 10 HOH   162 5762 6    HOH   HOH A . 
FB 10 HOH   163 5763 151  HOH   HOH A . 
FB 10 HOH   164 5764 145  HOH   HOH A . 
FB 10 HOH   165 5765 5001 HOH   HOH A . 
FB 10 HOH   166 5766 5    HOH   HOH A . 
FB 10 HOH   167 5767 241  HOH   HOH A . 
FB 10 HOH   168 5768 230  HOH   HOH A . 
FB 10 HOH   169 5769 93   HOH   HOH A . 
FB 10 HOH   170 5770 35   HOH   HOH A . 
FB 10 HOH   171 5771 96   HOH   HOH A . 
FB 10 HOH   172 5772 10   HOH   HOH A . 
FB 10 HOH   173 5773 3301 HOH   HOH A . 
FB 10 HOH   174 5774 8    HOH   HOH A . 
FB 10 HOH   175 5775 4    HOH   HOH A . 
FB 10 HOH   176 5776 165  HOH   HOH A . 
FB 10 HOH   177 5777 4301 HOH   HOH A . 
FB 10 HOH   178 5778 198  HOH   HOH A . 
FB 10 HOH   179 5779 43   HOH   HOH A . 
FB 10 HOH   180 5780 88   HOH   HOH A . 
FB 10 HOH   181 5781 27   HOH   HOH A . 
FB 10 HOH   182 5782 24   HOH   HOH A . 
FB 10 HOH   183 5783 283  HOH   HOH A . 
FB 10 HOH   184 5784 210  HOH   HOH A . 
FB 10 HOH   185 5785 80   HOH   HOH A . 
FB 10 HOH   186 5786 7    HOH   HOH A . 
FB 10 HOH   187 5787 3401 HOH   HOH A . 
FB 10 HOH   188 5788 2601 HOH   HOH A . 
FB 10 HOH   189 5789 244  HOH   HOH A . 
FB 10 HOH   190 5790 5801 HOH   HOH A . 
FB 10 HOH   191 5791 9    HOH   HOH A . 
FB 10 HOH   192 5792 81   HOH   HOH A . 
FB 10 HOH   193 5793 2401 HOH   HOH A . 
FB 10 HOH   194 5794 25   HOH   HOH A . 
FB 10 HOH   195 5795 76   HOH   HOH A . 
FB 10 HOH   196 5796 189  HOH   HOH A . 
FB 10 HOH   197 5797 24   HOH   HOH A . 
FB 10 HOH   198 5798 77   HOH   HOH A . 
FB 10 HOH   199 5799 23   HOH   HOH A . 
FB 10 HOH   200 5800 20   HOH   HOH A . 
FB 10 HOH   201 5801 5301 HOH   HOH A . 
FB 10 HOH   202 5802 84   HOH   HOH A . 
FB 10 HOH   203 5803 144  HOH   HOH A . 
FB 10 HOH   204 5804 64   HOH   HOH A . 
FB 10 HOH   205 5805 3101 HOH   HOH A . 
FB 10 HOH   206 5806 256  HOH   HOH A . 
FB 10 HOH   207 5807 13   HOH   HOH A . 
FB 10 HOH   208 5808 223  HOH   HOH A . 
FB 10 HOH   209 5809 260  HOH   HOH A . 
FB 10 HOH   210 5810 37   HOH   HOH A . 
FB 10 HOH   211 5811 227  HOH   HOH A . 
FB 10 HOH   212 5812 129  HOH   HOH A . 
FB 10 HOH   213 5813 231  HOH   HOH A . 
FB 10 HOH   214 5814 42   HOH   HOH A . 
FB 10 HOH   215 5815 3801 HOH   HOH A . 
FB 10 HOH   216 5816 113  HOH   HOH A . 
FB 10 HOH   217 5817 94   HOH   HOH A . 
FB 10 HOH   218 5818 160  HOH   HOH A . 
FB 10 HOH   219 5819 156  HOH   HOH A . 
FB 10 HOH   220 5820 87   HOH   HOH A . 
FB 10 HOH   221 5821 267  HOH   HOH A . 
FB 10 HOH   222 5822 226  HOH   HOH A . 
FB 10 HOH   223 5823 12   HOH   HOH A . 
FB 10 HOH   224 5824 61   HOH   HOH A . 
FB 10 HOH   225 5825 164  HOH   HOH A . 
FB 10 HOH   226 5826 6101 HOH   HOH A . 
FB 10 HOH   227 5827 2801 HOH   HOH A . 
FB 10 HOH   228 5828 279  HOH   HOH A . 
FB 10 HOH   229 5829 22   HOH   HOH A . 
FB 10 HOH   230 5830 134  HOH   HOH A . 
FB 10 HOH   231 5831 65   HOH   HOH A . 
FB 10 HOH   232 5832 180  HOH   HOH A . 
FB 10 HOH   233 5833 81   HOH   HOH A . 
FB 10 HOH   234 5834 71   HOH   HOH A . 
FB 10 HOH   235 5835 66   HOH   HOH A . 
FB 10 HOH   236 5836 133  HOH   HOH A . 
FB 10 HOH   237 5837 274  HOH   HOH A . 
FB 10 HOH   238 5838 58   HOH   HOH A . 
FB 10 HOH   239 5839 124  HOH   HOH A . 
FB 10 HOH   240 5840 92   HOH   HOH A . 
FB 10 HOH   241 5841 4601 HOH   HOH A . 
FB 10 HOH   242 5842 108  HOH   HOH A . 
FB 10 HOH   243 5843 159  HOH   HOH A . 
FB 10 HOH   244 5844 162  HOH   HOH A . 
FB 10 HOH   245 5845 62   HOH   HOH A . 
FB 10 HOH   246 5846 135  HOH   HOH A . 
FB 10 HOH   247 5847 6401 HOH   HOH A . 
FB 10 HOH   248 5848 20   HOH   HOH A . 
FB 10 HOH   249 5849 32   HOH   HOH A . 
FB 10 HOH   250 5850 109  HOH   HOH A . 
FB 10 HOH   251 5851 70   HOH   HOH A . 
FB 10 HOH   252 5852 60   HOH   HOH A . 
FB 10 HOH   253 5853 196  HOH   HOH A . 
FB 10 HOH   254 5854 16   HOH   HOH A . 
FB 10 HOH   255 5855 154  HOH   HOH A . 
FB 10 HOH   256 5856 41   HOH   HOH A . 
FB 10 HOH   257 5857 90   HOH   HOH A . 
FB 10 HOH   258 5858 280  HOH   HOH A . 
FB 10 HOH   259 5859 111  HOH   HOH A . 
FB 10 HOH   260 5860 56   HOH   HOH A . 
FB 10 HOH   261 5861 247  HOH   HOH A . 
FB 10 HOH   262 5862 88   HOH   HOH A . 
FB 10 HOH   263 5863 118  HOH   HOH A . 
FB 10 HOH   264 5864 6201 HOH   HOH A . 
FB 10 HOH   265 5865 46   HOH   HOH A . 
FB 10 HOH   266 5866 242  HOH   HOH A . 
FB 10 HOH   267 5867 6501 HOH   HOH A . 
FB 10 HOH   268 5868 99   HOH   HOH A . 
FB 10 HOH   269 5869 68   HOH   HOH A . 
FB 10 HOH   270 5870 49   HOH   HOH A . 
FB 10 HOH   271 5871 163  HOH   HOH A . 
FB 10 HOH   272 5872 31   HOH   HOH A . 
FB 10 HOH   273 5873 178  HOH   HOH A . 
FB 10 HOH   274 5874 275  HOH   HOH A . 
FB 10 HOH   275 5875 77   HOH   HOH A . 
FB 10 HOH   276 5876 15   HOH   HOH A . 
FB 10 HOH   277 5877 199  HOH   HOH A . 
FB 10 HOH   278 5878 44   HOH   HOH A . 
FB 10 HOH   279 5879 17   HOH   HOH A . 
FB 10 HOH   280 5880 139  HOH   HOH A . 
FB 10 HOH   281 5881 87   HOH   HOH A . 
FB 10 HOH   282 5882 34   HOH   HOH A . 
FB 10 HOH   283 5883 110  HOH   HOH A . 
FB 10 HOH   284 5884 63   HOH   HOH A . 
FB 10 HOH   285 5885 264  HOH   HOH A . 
FB 10 HOH   286 5886 121  HOH   HOH A . 
FB 10 HOH   287 5887 95   HOH   HOH A . 
FB 10 HOH   288 5888 284  HOH   HOH A . 
FB 10 HOH   289 5889 191  HOH   HOH A . 
FB 10 HOH   290 5890 238  HOH   HOH A . 
FB 10 HOH   291 5891 72   HOH   HOH A . 
FB 10 HOH   292 5892 252  HOH   HOH A . 
FB 10 HOH   293 5893 147  HOH   HOH A . 
FB 10 HOH   294 5894 219  HOH   HOH A . 
FB 10 HOH   295 5895 115  HOH   HOH A . 
FB 10 HOH   296 5896 245  HOH   HOH A . 
FB 10 HOH   297 5897 38   HOH   HOH A . 
FB 10 HOH   298 5898 152  HOH   HOH A . 
FB 10 HOH   299 5899 205  HOH   HOH A . 
FB 10 HOH   300 5900 58   HOH   HOH A . 
FB 10 HOH   301 5901 79   HOH   HOH A . 
FB 10 HOH   302 5902 170  HOH   HOH A . 
FB 10 HOH   303 5903 261  HOH   HOH A . 
FB 10 HOH   304 5904 71   HOH   HOH A . 
FB 10 HOH   305 5905 272  HOH   HOH A . 
FB 10 HOH   306 5906 1    HOH   HOH A . 
FB 10 HOH   307 5907 142  HOH   HOH A . 
FB 10 HOH   308 5908 177  HOH   HOH A . 
FB 10 HOH   309 5909 273  HOH   HOH A . 
FB 10 HOH   310 5910 188  HOH   HOH A . 
FB 10 HOH   311 5911 69   HOH   HOH A . 
FB 10 HOH   312 5912 39   HOH   HOH A . 
FB 10 HOH   313 5913 29   HOH   HOH A . 
FB 10 HOH   314 5914 146  HOH   HOH A . 
FB 10 HOH   315 5915 30   HOH   HOH A . 
FB 10 HOH   316 5916 157  HOH   HOH A . 
FB 10 HOH   317 5917 246  HOH   HOH A . 
FB 10 HOH   318 5918 271  HOH   HOH A . 
FB 10 HOH   319 5919 237  HOH   HOH A . 
FB 10 HOH   320 5920 187  HOH   HOH A . 
FB 10 HOH   321 5921 44   HOH   HOH A . 
FB 10 HOH   322 5922 214  HOH   HOH A . 
FB 10 HOH   323 5923 222  HOH   HOH A . 
FB 10 HOH   324 5924 60   HOH   HOH A . 
FB 10 HOH   325 5925 195  HOH   HOH A . 
FB 10 HOH   326 5926 123  HOH   HOH A . 
FB 10 HOH   327 5927 36   HOH   HOH A . 
FB 10 HOH   328 5928 255  HOH   HOH A . 
FB 10 HOH   329 5929 217  HOH   HOH A . 
FB 10 HOH   330 5930 213  HOH   HOH A . 
FB 10 HOH   331 5931 169  HOH   HOH A . 
FB 10 HOH   332 5932 218  HOH   HOH A . 
FB 10 HOH   333 5933 55   HOH   HOH A . 
FB 10 HOH   334 5934 4501 HOH   HOH A . 
FB 10 HOH   335 5935 248  HOH   HOH A . 
FB 10 HOH   336 5936 131  HOH   HOH A . 
FB 10 HOH   337 5937 190  HOH   HOH A . 
FB 10 HOH   338 5938 250  HOH   HOH A . 
FB 10 HOH   339 5939 166  HOH   HOH A . 
FB 10 HOH   340 5940 36   HOH   HOH A . 
FB 10 HOH   341 5941 65   HOH   HOH A . 
FB 10 HOH   342 5942 181  HOH   HOH A . 
FB 10 HOH   343 5943 253  HOH   HOH A . 
FB 10 HOH   344 5944 6901 HOH   HOH A . 
FB 10 HOH   345 5945 57   HOH   HOH A . 
FB 10 HOH   346 5946 5    HOH   HOH A . 
FB 10 HOH   347 5947 161  HOH   HOH A . 
FB 10 HOH   348 5948 66   HOH   HOH A . 
FB 10 HOH   349 5949 173  HOH   HOH A . 
FB 10 HOH   350 5950 171  HOH   HOH A . 
FB 10 HOH   351 5951 254  HOH   HOH A . 
FB 10 HOH   352 5952 57   HOH   HOH A . 
FB 10 HOH   353 5953 270  HOH   HOH A . 
FB 10 HOH   354 5954 167  HOH   HOH A . 
FB 10 HOH   355 5955 268  HOH   HOH A . 
FB 10 HOH   356 5956 53   HOH   HOH A . 
FB 10 HOH   357 5957 251  HOH   HOH A . 
FB 10 HOH   358 5958 208  HOH   HOH A . 
FB 10 HOH   359 5959 34   HOH   HOH A . 
FB 10 HOH   360 5960 54   HOH   HOH A . 
FB 10 HOH   361 5961 266  HOH   HOH A . 
FB 10 HOH   362 5962 249  HOH   HOH A . 
FB 10 HOH   363 5963 53   HOH   HOH A . 
FB 10 HOH   364 5964 82   HOH   HOH A . 
FB 10 HOH   365 5965 84   HOH   HOH A . 
FB 10 HOH   366 5966 2    HOH   HOH A . 
FB 10 HOH   367 5967 216  HOH   HOH A . 
FB 10 HOH   368 5968 83   HOH   HOH A . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? REFMAC     ? ? ? 5.8.0419 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? Aimless    ? ? ? 1.12.15  2 
? phasing          ? ? ? ? ? ? ? ? ? ? ? MOLREP     ? ? ? 11.7.03  3 
? 'model building' ? ? ? ? ? ? ? ? ? ? ? Coot       ? ? ? 0.9.8.92 4 
? 'model building' ? ? ? ? ? ? ? ? ? ? ? MolProbity ? ? ? 4.5.2    5 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS        ? ? ? .        6 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PDB-REDO   ? ? ? .        7 
# 
_cell.angle_alpha                  105.724 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   96.546 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  93.615 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9FXY 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     53.603 
_cell.length_a_esd                 ? 
_cell.length_b                     62.885 
_cell.length_b_esd                 ? 
_cell.length_c                     64.594 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        1 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9FXY 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                1 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9FXY 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.29 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          46.40 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, HANGING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    
;ATX was incubated with each screened compound at a 1:10 (protein:compound) ratio for at least 30 minutes. Crystals were grown for at least 7 days in a 24-well optimization screen: 18 to 20% PEG 3350, 0.1 to 0.4 M NaSCN, and 0.1 to 0.4 M NH4I.
;
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS3 2M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2021-05-06 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.965459 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'ESRF BEAMLINE MASSIF-1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.965459 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   MASSIF-1 
_diffrn_source.pdbx_synchrotron_site       ESRF 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9FXY 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              2.00 
_reflns.d_resolution_low                               43.19 
_reflns.details                                        ? 
_reflns.limit_h_max                                    ? 
_reflns.limit_h_min                                    ? 
_reflns.limit_k_max                                    ? 
_reflns.limit_k_min                                    ? 
_reflns.limit_l_max                                    ? 
_reflns.limit_l_min                                    ? 
_reflns.number_all                                     ? 
_reflns.number_obs                                     52110 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           96 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                1.7 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          5.5 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.137 
_reflns.pdbx_Rpim_I_all                                0.097 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.983 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.097 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    2.00 
_reflns_shell.d_res_low                                     2.05 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             3821 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               1.7 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_reflns_shell.pdbx_Rpim_I_all                               ? 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.588 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          94.4 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            -0.263 
_refine.aniso_B[1][2]                            0.065 
_refine.aniso_B[1][3]                            0.689 
_refine.aniso_B[2][2]                            -0.355 
_refine.aniso_B[2][3]                            -0.166 
_refine.aniso_B[3][3]                            0.434 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               31.226 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.958 
_refine.correlation_coeff_Fo_to_Fc_free          0.940 
_refine.details                                  'Hydrogens have been added in their riding positions' 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9FXY 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            2.000 
_refine.ls_d_res_low                             43.19 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     52102 
_refine.ls_number_reflns_R_free                  2571 
_refine.ls_number_reflns_R_work                  49531 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    95.998 
_refine.ls_percent_reflns_R_free                 4.935 
_refine.ls_R_factor_all                          0.173 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.2175 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1709 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'MASK BULK SOLVENT' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.199 
_refine.pdbx_overall_ESU_R_Free                  0.168 
_refine.pdbx_solvent_vdw_probe_radii             1.100 
_refine.pdbx_solvent_ion_probe_radii             0.700 
_refine.pdbx_solvent_shrinkage_radii             0.700 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             11.110 
_refine.overall_SU_ML                            0.140 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       2.000 
_refine_hist.d_res_low                        43.19 
_refine_hist.number_atoms_solvent             368 
_refine_hist.number_atoms_total               6936 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        6339 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         229 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.013  0.016  6727  ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.016  6009  ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.382  1.783  9066  ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 0.484  1.567  13921 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 9.823  5.283  831   ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 14.969 10.000 11    ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 14.076 10.000 1089  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 16.526 10.000 314   ? r_dihedral_angle_6_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.072  0.200  930   ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.006  0.020  7696  ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  1557  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.213  0.200  1432  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.193  0.200  5828  ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.185  0.200  3231  ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.083  0.200  3412  ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.166  0.200  340   ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.028  0.200  2     ? r_symmetry_xyhbond_nbd_other   ? ? 
'X-RAY DIFFRACTION' ? 0.140  0.200  8     ? r_metal_ion_refined            ? ? 
'X-RAY DIFFRACTION' ? 0.165  0.200  16    ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.232  0.200  59    ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.082  0.200  4     ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 5.636  1.804  3182  ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 5.096  1.780  3142  ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 6.298  3.181  3924  ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 6.297  3.182  3925  ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 8.567  2.387  3545  ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 8.568  2.387  3545  ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 11.042 4.055  5142  ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 11.031 4.056  5142  ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 12.424 23.103 30048 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 12.431 23.030 29942 ? r_lrange_other                 ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 2.000 2.052 . . 179 3634 94.4279 . . . . 0.274 . . . . . . . . . . . 0.309 
'X-RAY DIFFRACTION' 2.052 2.108 . . 190 3459 93.6842 . . . . 0.262 . . . . . . . . . . . 0.303 
'X-RAY DIFFRACTION' 2.108 2.169 . . 185 3465 95.3750 . . . . 0.231 . . . . . . . . . . . 0.273 
'X-RAY DIFFRACTION' 2.169 2.235 . . 170 3405 96.1797 . . . . 0.222 . . . . . . . . . . . 0.273 
'X-RAY DIFFRACTION' 2.235 2.309 . . 180 3236 96.5517 . . . . 0.197 . . . . . . . . . . . 0.247 
'X-RAY DIFFRACTION' 2.309 2.389 . . 181 3107 96.0280 . . . . 0.188 . . . . . . . . . . . 0.235 
'X-RAY DIFFRACTION' 2.389 2.479 . . 160 3074 96.2500 . . . . 0.173 . . . . . . . . . . . 0.240 
'X-RAY DIFFRACTION' 2.479 2.580 . . 154 2954 96.4618 . . . . 0.165 . . . . . . . . . . . 0.234 
'X-RAY DIFFRACTION' 2.580 2.694 . . 135 2806 95.8605 . . . . 0.163 . . . . . . . . . . . 0.263 
'X-RAY DIFFRACTION' 2.694 2.825 . . 128 2723 96.2525 . . . . 0.147 . . . . . . . . . . . 0.224 
'X-RAY DIFFRACTION' 2.825 2.978 . . 127 2532 94.8626 . . . . 0.141 . . . . . . . . . . . 0.196 
'X-RAY DIFFRACTION' 2.978 3.157 . . 133 2408 95.8145 . . . . 0.130 . . . . . . . . . . . 0.176 
'X-RAY DIFFRACTION' 3.157 3.374 . . 126 2286 97.7310 . . . . 0.132 . . . . . . . . . . . 0.175 
'X-RAY DIFFRACTION' 3.374 3.642 . . 110 2137 96.9789 . . . . 0.138 . . . . . . . . . . . 0.196 
'X-RAY DIFFRACTION' 3.642 3.987 . . 76  1999 97.3721 . . . . 0.141 . . . . . . . . . . . 0.182 
'X-RAY DIFFRACTION' 3.987 4.453 . . 98  1784 96.8605 . . . . 0.133 . . . . . . . . . . . 0.138 
'X-RAY DIFFRACTION' 4.453 5.133 . . 93  1558 97.2893 . . . . 0.144 . . . . . . . . . . . 0.191 
'X-RAY DIFFRACTION' 5.133 6.265 . . 68  1324 96.1326 . . . . 0.208 . . . . . . . . . . . 0.247 
'X-RAY DIFFRACTION' 6.265 8.768 . . 61  1043 98.0462 . . . . 0.222 . . . . . . . . . . . 0.282 
'X-RAY DIFFRACTION' 8.768 43.19 . . 17  597  96.8454 . . . . 0.266 . . . . . . . . . . . 0.269 
# 
_struct.entry_id                     9FXY 
_struct.title                        'Crystal Structure of Autotaxin (ENPP2) with Type IV Inhibitor' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        9FXY 
_struct_keywords.text            
;Type VI, Inhibitor, Complex, Ectonucleotide Pyrophosphatase/Phosphodiesterase 2, lysophospholipase D (lysoPLD), lysophosphatidic acid (LPA), HYDROLASE
;
_struct_keywords.pdbx_keywords   HYDROLASE 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A  N N 1  ? 
B  N N 2  ? 
C  N N 3  ? 
D  N N 3  ? 
E  N N 3  ? 
F  N N 4  ? 
G  N N 4  ? 
H  N N 5  ? 
I  N N 6  ? 
J  N N 6  ? 
K  N N 7  ? 
L  N N 3  ? 
M  N N 6  ? 
N  N N 3  ? 
O  N N 3  ? 
P  N N 3  ? 
Q  N N 3  ? 
R  N N 3  ? 
S  N N 3  ? 
T  N N 3  ? 
U  N N 3  ? 
V  N N 3  ? 
W  N N 3  ? 
X  N N 3  ? 
Y  N N 3  ? 
Z  N N 3  ? 
AA N N 3  ? 
BA N N 3  ? 
CA N N 3  ? 
DA N N 3  ? 
EA N N 3  ? 
FA N N 3  ? 
GA N N 3  ? 
HA N N 3  ? 
IA N N 3  ? 
JA N N 3  ? 
KA N N 3  ? 
LA N N 3  ? 
MA N N 3  ? 
NA N N 3  ? 
OA N N 8  ? 
PA N N 3  ? 
QA N N 3  ? 
RA N N 3  ? 
SA N N 3  ? 
TA N N 3  ? 
UA N N 3  ? 
VA N N 3  ? 
WA N N 9  ? 
XA N N 3  ? 
YA N N 8  ? 
ZA N N 8  ? 
AB N N 6  ? 
BB N N 6  ? 
CB N N 6  ? 
DB N N 6  ? 
EB N N 3  ? 
FB N N 10 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    ENPP2_RAT 
_struct_ref.pdbx_db_accession          Q64610 
_struct_ref.pdbx_db_isoform            Q64610-2 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;GSCKGRCFELQEVGPPDCRCDNLCKSYSSCCHDFDELCLKTARGWECTKDRCGEVRNEENACHCSEDCLSRGDCCTNYQV
VCKGESHWVDDDCEEIKVPECPAGFVRPPLIIFSVDGFRASYMKKGSKVMPNIEKLRSCGTHAPYMRPVYPTKTFPNLYT
LATGLYPESHGIVGNSMYDPVFDASFHLRGREKFNHRWWGGQPLWITATKQGVRAGTFFWSVSIPHERRILTILQWLSLP
DNERPSVYAFYSEQPDFSGHKYGPFGPEMTNPLREIDKTVGQLMDGLKQLRLHRCVNVIFVGDHGMEDVTCDRTEFLSNY
LTNVDDITLVPGTLGRIRAKSINNSKYDPKTIIANLTCKKPDQHFKPYMKQHLPKRLHYANNRRIEDIHLLVDRRWHVAR
KPLDVYKKPSGKCFFQGDHGFDNKVNSMQTVFVGYGPTFKYRTKVPPFENIELYNVMCDLLGLKPAPNNGTHGSLNHLLR
TNTFRPTMPDEVSRPNYPGIMYLQSEFDLGCTCDDKVEPKNKLEELNKRLHTKGSRKERHLLYGRPAVLYRTSYDILYHT
DFESGYSEIFLMPLWTSYTISKQAEVSSIPEHLTNCVRPDVRVSPGFSQNCLAYKNDKQMSYGFLFPPYLSSSPEAKYDA
FLVTNMVPMYPAFKRVWAYFQRVLVKKYASERNGVNVISGPIFDYNYDGLRDTEDEIKQYVEGSSIPVPTHYYSIITSCL
DFTQPADKCDGPLSVSSFILPHRPDNDESCNSSEDESKWVEELMKMHTARVRDIEHLTGLDFYRKTSRSYSEILTLKTYL
HTYESEI
;
_struct_ref.pdbx_align_begin           56 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9FXY 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 1 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 807 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             Q64610 
_struct_ref_seq.db_align_beg                  56 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  862 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       56 
_struct_ref_seq.pdbx_auth_seq_align_end       862 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 9FXY ALA A 355 ? UNP Q64610 ASN 410 'engineered mutation' 410 1 
1 9FXY THR A 536 ? UNP Q64610 ARG 591 'engineered mutation' 591 2 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 10840 ? 
1 MORE         -160  ? 
1 'SSA (A^2)'  31660 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      
;A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,V,W,X,Y,Z,AA,BA,CA,DA,EA,FA,GA,HA,IA,JA,KA,LA,MA,NA,OA,PA,QA,RA,SA,TA,UA,VA,WA,XA,YA,ZA,AB,BB,CB,DB,EB,FB
;
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 LEU A 23  ? SER A 28  ? LEU A 78  SER A 83  5 ? 6  
HELX_P HELX_P2  AA2 ASP A 33  ? LEU A 39  ? ASP A 88  LEU A 94  1 ? 7  
HELX_P HELX_P3  AA3 THR A 48  ? CYS A 52  ? THR A 103 CYS A 107 5 ? 5  
HELX_P HELX_P4  AA4 ASP A 67  ? GLY A 72  ? ASP A 122 GLY A 127 1 ? 6  
HELX_P HELX_P5  AA5 ASN A 77  ? GLY A 84  ? ASN A 132 GLY A 139 1 ? 8  
HELX_P HELX_P6  AA6 HIS A 87  ? ASP A 91  ? HIS A 142 ASP A 146 5 ? 5  
HELX_P HELX_P7  AA7 ARG A 119 ? GLY A 126 ? ARG A 174 GLY A 181 5 ? 8  
HELX_P HELX_P8  AA8 MET A 130 ? GLY A 140 ? MET A 185 GLY A 195 1 ? 11 
HELX_P HELX_P9  AA9 LYS A 153 ? GLY A 164 ? LYS A 208 GLY A 219 1 ? 12 
HELX_P HELX_P10 AB1 TYR A 166 ? GLY A 171 ? TYR A 221 GLY A 226 1 ? 6  
HELX_P HELX_P11 AB2 ARG A 191 ? TRP A 199 ? ARG A 246 TRP A 254 5 ? 9  
HELX_P HELX_P12 AB3 PRO A 203 ? GLN A 211 ? PRO A 258 GLN A 266 1 ? 9  
HELX_P HELX_P13 AB4 PRO A 225 ? LEU A 237 ? PRO A 280 LEU A 292 1 ? 13 
HELX_P HELX_P14 AB5 ASP A 256 ? GLY A 263 ? ASP A 311 GLY A 318 1 ? 8  
HELX_P HELX_P15 AB6 GLY A 266 ? GLU A 268 ? GLY A 321 GLU A 323 5 ? 3  
HELX_P HELX_P16 AB7 MET A 269 ? LEU A 290 ? MET A 324 LEU A 345 1 ? 22 
HELX_P HELX_P17 AB8 SER A 318 ? TYR A 320 ? SER A 373 TYR A 375 5 ? 3  
HELX_P HELX_P18 AB9 ASN A 323 ? ASP A 325 ? ASN A 378 ASP A 380 5 ? 3  
HELX_P HELX_P19 AC1 ASP A 348 ? LEU A 356 ? ASP A 403 LEU A 411 1 ? 9  
HELX_P HELX_P20 AC2 GLN A 371 ? LEU A 373 ? GLN A 426 LEU A 428 5 ? 3  
HELX_P HELX_P21 AC3 PRO A 374 ? HIS A 378 ? PRO A 429 HIS A 433 5 ? 5  
HELX_P HELX_P22 AC4 LYS A 401 ? VAL A 405 ? LYS A 456 VAL A 460 5 ? 5  
HELX_P HELX_P23 AC5 VAL A 425 ? GLN A 429 ? VAL A 480 GLN A 484 5 ? 5  
HELX_P HELX_P24 AC6 GLU A 452 ? LEU A 461 ? GLU A 507 LEU A 516 1 ? 10 
HELX_P HELX_P25 AC7 LEU A 475 ? LEU A 479 ? LEU A 530 LEU A 534 5 ? 5  
HELX_P HELX_P26 AC8 LEU A 503 ? PHE A 507 ? LEU A 558 PHE A 562 5 ? 5  
HELX_P HELX_P27 AC9 SER A 535 ? LEU A 541 ? SER A 590 LEU A 596 1 ? 7  
HELX_P HELX_P28 AD1 PRO A 590 ? THR A 594 ? PRO A 645 THR A 649 5 ? 5  
HELX_P HELX_P29 AD2 SER A 604 ? SER A 608 ? SER A 659 SER A 663 5 ? 5  
HELX_P HELX_P30 AD3 CYS A 611 ? ASP A 617 ? CYS A 666 ASP A 672 1 ? 7  
HELX_P HELX_P31 AD4 PRO A 627 ? SER A 631 ? PRO A 682 SER A 686 5 ? 5  
HELX_P HELX_P32 AD5 SER A 633 ? TYR A 638 ? SER A 688 TYR A 693 1 ? 6  
HELX_P HELX_P33 AD6 ASP A 639 ? THR A 644 ? ASP A 694 THR A 699 5 ? 6  
HELX_P HELX_P34 AD7 TYR A 650 ? VAL A 663 ? TYR A 705 VAL A 718 1 ? 14 
HELX_P HELX_P35 AD8 VAL A 663 ? ASN A 673 ? VAL A 718 ASN A 728 1 ? 11 
HELX_P HELX_P36 AD9 THR A 693 ? ILE A 697 ? THR A 748 ILE A 752 5 ? 5  
HELX_P HELX_P37 AE1 ASP A 755 ? LYS A 758 ? ASP A 810 LYS A 813 5 ? 4  
HELX_P HELX_P38 AE2 TRP A 759 ? HIS A 767 ? TRP A 814 HIS A 822 1 ? 9  
HELX_P HELX_P39 AE3 ARG A 770 ? GLY A 779 ? ARG A 825 GLY A 834 1 ? 10 
HELX_P HELX_P40 AE4 SER A 789 ? TYR A 799 ? SER A 844 TYR A 854 1 ? 11 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1  disulf ?    ? A CYS 3   SG  ? ? ? 1_555 A  CYS 20  SG ? ? A CYS 58  A CYS 75   1_555 ? ? ? ? ? ? ? 2.027 ? ? 
disulf2  disulf ?    ? A CYS 7   SG  ? ? ? 1_555 A  CYS 38  SG ? ? A CYS 62  A CYS 93   1_555 ? ? ? ? ? ? ? 2.016 ? ? 
disulf3  disulf ?    ? A CYS 18  SG  ? ? ? 1_555 A  CYS 31  SG ? ? A CYS 73  A CYS 86   1_555 ? ? ? ? ? ? ? 2.060 ? ? 
disulf4  disulf ?    ? A CYS 24  SG  ? ? ? 1_555 A  CYS 30  SG ? ? A CYS 79  A CYS 85   1_555 ? ? ? ? ? ? ? 2.062 ? ? 
disulf5  disulf ?    ? A CYS 47  SG  ? ? ? 1_555 A  CYS 64  SG ? ? A CYS 102 A CYS 119  1_555 ? ? ? ? ? ? ? 2.065 ? ? 
disulf6  disulf ?    ? A CYS 52  SG  ? ? ? 1_555 A  CYS 82  SG ? ? A CYS 107 A CYS 137  1_555 ? ? ? ? ? ? ? 2.058 ? ? 
disulf7  disulf ?    ? A CYS 62  SG  ? ? ? 1_555 A  CYS 75  SG ? ? A CYS 117 A CYS 130  1_555 ? ? ? ? ? ? ? 2.063 ? ? 
disulf8  disulf ?    ? A CYS 68  SG  ? ? ? 1_555 A  CYS 74  SG ? ? A CYS 123 A CYS 129  1_555 ? ? ? ? ? ? ? 2.043 ? ? 
disulf9  disulf ?    ? A CYS 93  SG  ? ? ? 1_555 A  CYS 139 SG ? ? A CYS 148 A CYS 194  1_555 ? ? ? ? ? ? ? 2.002 ? ? 
disulf10 disulf ?    ? A CYS 101 SG  ? ? ? 1_555 A  CYS 295 SG ? ? A CYS 156 A CYS 350  1_555 ? ? ? ? ? ? ? 2.121 ? ? 
disulf11 disulf ?    ? A CYS 311 SG  ? ? ? 1_555 A  CYS 413 SG ? ? A CYS 366 A CYS 468  1_555 ? ? ? ? ? ? ? 2.053 ? ? 
disulf12 disulf ?    ? A CYS 358 SG  ? ? ? 1_555 A  CYS 750 SG ? ? A CYS 413 A CYS 805  1_555 ? ? ? ? ? ? ? 2.043 ? ? 
disulf13 disulf ?    ? A CYS 511 SG  ? ? ? 1_555 A  CYS 611 SG ? ? A CYS 566 A CYS 666  1_555 ? ? ? ? ? ? ? 2.098 ? ? 
disulf14 disulf ?    ? A CYS 513 SG  ? ? ? 1_555 A  CYS 596 SG ? ? A CYS 568 A CYS 651  1_555 ? ? ? ? ? ? ? 2.069 ? ? 
disulf15 disulf ?    ? A CYS 719 SG  ? ? ? 1_555 A  CYS 729 SG ? ? A CYS 774 A CYS 784  1_555 ? ? ? ? ? ? ? 2.090 ? ? 
covale1  covale one  ? A ASN 469 ND2 ? ? ? 1_555 B  NAG .   C1 ? ? A ASN 524 B NAG 1    1_555 ? ? ? ? ? ? ? 1.434 ? 
N-Glycosylation 
covale2  covale both ? B NAG .   O4  ? ? ? 1_555 B  NAG .   C1 ? ? B NAG 1   B NAG 2    1_555 ? ? ? ? ? ? ? 1.387 ? ? 
covale3  covale both ? B NAG .   O4  ? ? ? 1_555 B  BMA .   C1 ? ? B NAG 2   B BMA 3    1_555 ? ? ? ? ? ? ? 1.405 ? ? 
metalc1  metalc ?    ? A ASP 116 OD1 ? ? ? 1_555 G  ZN  .   ZN ? ? A ASP 171 A ZN  905  1_555 ? ? ? ? ? ? ? 2.007 ? ? 
metalc2  metalc ?    ? A THR 154 OG1 ? ? ? 1_555 G  ZN  .   ZN ? ? A THR 209 A ZN  905  1_555 ? ? ? ? ? ? ? 2.079 ? ? 
metalc3  metalc ?    ? A ASP 256 OD1 ? ? ? 1_555 F  ZN  .   ZN ? ? A ASP 311 A ZN  904  1_555 ? ? ? ? ? ? ? 2.197 ? ? 
metalc4  metalc ?    ? A ASP 256 OD2 ? ? ? 1_555 F  ZN  .   ZN ? ? A ASP 311 A ZN  904  1_555 ? ? ? ? ? ? ? 2.475 ? ? 
metalc5  metalc ?    ? A HIS 260 NE2 ? ? ? 1_555 F  ZN  .   ZN ? ? A HIS 315 A ZN  904  1_555 ? ? ? ? ? ? ? 1.999 ? ? 
metalc6  metalc ?    ? A ASP 303 OD2 ? ? ? 1_555 G  ZN  .   ZN ? ? A ASP 358 A ZN  905  1_555 ? ? ? ? ? ? ? 1.996 ? ? 
metalc7  metalc ?    ? A HIS 304 NE2 ? ? ? 1_555 G  ZN  .   ZN ? ? A HIS 359 A ZN  905  1_555 ? ? ? ? ? ? ? 2.141 ? ? 
metalc8  metalc ?    ? A HIS 419 NE2 ? ? ? 1_555 F  ZN  .   ZN ? ? A HIS 474 A ZN  904  1_555 ? ? ? ? ? ? ? 2.177 ? ? 
metalc9  metalc ?    ? A ASP 684 OD1 ? ? ? 1_555 H  CA  .   CA ? ? A ASP 739 A CA  906  1_555 ? ? ? ? ? ? ? 2.198 ? ? 
metalc10 metalc ?    ? A ASN 686 OD1 ? ? ? 1_555 H  CA  .   CA ? ? A ASN 741 A CA  906  1_555 ? ? ? ? ? ? ? 2.227 ? ? 
metalc11 metalc ?    ? A ASP 688 OD1 ? ? ? 1_555 H  CA  .   CA ? ? A ASP 743 A CA  906  1_555 ? ? ? ? ? ? ? 2.461 ? ? 
metalc12 metalc ?    ? A LEU 690 O   ? ? ? 1_555 H  CA  .   CA ? ? A LEU 745 A CA  906  1_555 ? ? ? ? ? ? ? 2.189 ? ? 
metalc13 metalc ?    ? A ASP 692 OD1 ? ? ? 1_555 H  CA  .   CA ? ? A ASP 747 A CA  906  1_555 ? ? ? ? ? ? ? 2.341 ? ? 
metalc14 metalc ?    ? F ZN  .   ZN  ? ? ? 1_555 WA PO4 .   O2 ? ? A ZN  904 A PO4 947  1_555 ? ? ? ? ? ? ? 2.478 ? ? 
metalc15 metalc ?    ? F ZN  .   ZN  ? ? ? 1_555 WA PO4 .   O4 ? ? A ZN  904 A PO4 947  1_555 ? ? ? ? ? ? ? 2.420 ? ? 
metalc16 metalc ?    ? H CA  .   CA  ? ? ? 1_555 FB HOH .   O  ? ? A CA  906 A HOH 5737 1_555 ? ? ? ? ? ? ? 2.339 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
metalc ? ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  OD1 ? A  ASP 116 ? A ASP 171 ? 1_555 ZN ? G ZN . ? A ZN 905 ? 1_555 OG1 ? A  THR 154 ? A THR 209  ? 1_555 126.0 ? 
2  OD1 ? A  ASP 116 ? A ASP 171 ? 1_555 ZN ? G ZN . ? A ZN 905 ? 1_555 OD2 ? A  ASP 303 ? A ASP 358  ? 1_555 103.3 ? 
3  OG1 ? A  THR 154 ? A THR 209 ? 1_555 ZN ? G ZN . ? A ZN 905 ? 1_555 OD2 ? A  ASP 303 ? A ASP 358  ? 1_555 110.6 ? 
4  OD1 ? A  ASP 116 ? A ASP 171 ? 1_555 ZN ? G ZN . ? A ZN 905 ? 1_555 NE2 ? A  HIS 304 ? A HIS 359  ? 1_555 109.1 ? 
5  OG1 ? A  THR 154 ? A THR 209 ? 1_555 ZN ? G ZN . ? A ZN 905 ? 1_555 NE2 ? A  HIS 304 ? A HIS 359  ? 1_555 107.9 ? 
6  OD2 ? A  ASP 303 ? A ASP 358 ? 1_555 ZN ? G ZN . ? A ZN 905 ? 1_555 NE2 ? A  HIS 304 ? A HIS 359  ? 1_555 95.9  ? 
7  OD1 ? A  ASP 256 ? A ASP 311 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 OD2 ? A  ASP 256 ? A ASP 311  ? 1_555 54.7  ? 
8  OD1 ? A  ASP 256 ? A ASP 311 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 NE2 ? A  HIS 260 ? A HIS 315  ? 1_555 101.2 ? 
9  OD2 ? A  ASP 256 ? A ASP 311 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 NE2 ? A  HIS 260 ? A HIS 315  ? 1_555 91.0  ? 
10 OD1 ? A  ASP 256 ? A ASP 311 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 NE2 ? A  HIS 419 ? A HIS 474  ? 1_555 94.5  ? 
11 OD2 ? A  ASP 256 ? A ASP 311 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 NE2 ? A  HIS 419 ? A HIS 474  ? 1_555 147.5 ? 
12 NE2 ? A  HIS 260 ? A HIS 315 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 NE2 ? A  HIS 419 ? A HIS 474  ? 1_555 106.5 ? 
13 OD1 ? A  ASP 256 ? A ASP 311 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 O2  ? WA PO4 .   ? A PO4 947  ? 1_555 160.7 ? 
14 OD2 ? A  ASP 256 ? A ASP 311 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 O2  ? WA PO4 .   ? A PO4 947  ? 1_555 118.8 ? 
15 NE2 ? A  HIS 260 ? A HIS 315 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 O2  ? WA PO4 .   ? A PO4 947  ? 1_555 97.0  ? 
16 NE2 ? A  HIS 419 ? A HIS 474 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 O2  ? WA PO4 .   ? A PO4 947  ? 1_555 86.6  ? 
17 OD1 ? A  ASP 256 ? A ASP 311 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 O4  ? WA PO4 .   ? A PO4 947  ? 1_555 100.7 ? 
18 OD2 ? A  ASP 256 ? A ASP 311 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 O4  ? WA PO4 .   ? A PO4 947  ? 1_555 85.3  ? 
19 NE2 ? A  HIS 260 ? A HIS 315 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 O4  ? WA PO4 .   ? A PO4 947  ? 1_555 150.2 ? 
20 NE2 ? A  HIS 419 ? A HIS 474 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 O4  ? WA PO4 .   ? A PO4 947  ? 1_555 91.7  ? 
21 O2  ? WA PO4 .   ? A PO4 947 ? 1_555 ZN ? F ZN . ? A ZN 904 ? 1_555 O4  ? WA PO4 .   ? A PO4 947  ? 1_555 60.0  ? 
22 OD1 ? A  ASP 684 ? A ASP 739 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 OD1 ? A  ASN 686 ? A ASN 741  ? 1_555 81.9  ? 
23 OD1 ? A  ASP 684 ? A ASP 739 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 OD1 ? A  ASP 688 ? A ASP 743  ? 1_555 75.5  ? 
24 OD1 ? A  ASN 686 ? A ASN 741 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 OD1 ? A  ASP 688 ? A ASP 743  ? 1_555 81.1  ? 
25 OD1 ? A  ASP 684 ? A ASP 739 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 O   ? A  LEU 690 ? A LEU 745  ? 1_555 88.9  ? 
26 OD1 ? A  ASN 686 ? A ASN 741 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 O   ? A  LEU 690 ? A LEU 745  ? 1_555 164.4 ? 
27 OD1 ? A  ASP 688 ? A ASP 743 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 O   ? A  LEU 690 ? A LEU 745  ? 1_555 84.4  ? 
28 OD1 ? A  ASP 684 ? A ASP 739 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 OD1 ? A  ASP 692 ? A ASP 747  ? 1_555 100.7 ? 
29 OD1 ? A  ASN 686 ? A ASN 741 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 OD1 ? A  ASP 692 ? A ASP 747  ? 1_555 86.6  ? 
30 OD1 ? A  ASP 688 ? A ASP 743 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 OD1 ? A  ASP 692 ? A ASP 747  ? 1_555 167.5 ? 
31 O   ? A  LEU 690 ? A LEU 745 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 OD1 ? A  ASP 692 ? A ASP 747  ? 1_555 107.6 ? 
32 OD1 ? A  ASP 684 ? A ASP 739 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 O   ? FB HOH .   ? A HOH 5737 ? 1_555 156.4 ? 
33 OD1 ? A  ASN 686 ? A ASN 741 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 O   ? FB HOH .   ? A HOH 5737 ? 1_555 84.7  ? 
34 OD1 ? A  ASP 688 ? A ASP 743 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 O   ? FB HOH .   ? A HOH 5737 ? 1_555 83.3  ? 
35 O   ? A  LEU 690 ? A LEU 745 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 O   ? FB HOH .   ? A HOH 5737 ? 1_555 99.4  ? 
36 OD1 ? A  ASP 692 ? A ASP 747 ? 1_555 CA ? H CA . ? A CA 906 ? 1_555 O   ? FB HOH .   ? A HOH 5737 ? 1_555 97.8  ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1  NAG B .   ? ASN A 469 ? NAG B 1   ? 1_555 ASN A 524 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate       
2  CYS A 3   ? CYS A 20  ? CYS A 58  ? 1_555 CYS A 75  ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
3  CYS A 7   ? CYS A 38  ? CYS A 62  ? 1_555 CYS A 93  ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
4  CYS A 18  ? CYS A 31  ? CYS A 73  ? 1_555 CYS A 86  ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
5  CYS A 24  ? CYS A 30  ? CYS A 79  ? 1_555 CYS A 85  ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
6  CYS A 47  ? CYS A 64  ? CYS A 102 ? 1_555 CYS A 119 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
7  CYS A 52  ? CYS A 82  ? CYS A 107 ? 1_555 CYS A 137 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
8  CYS A 62  ? CYS A 75  ? CYS A 117 ? 1_555 CYS A 130 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
9  CYS A 68  ? CYS A 74  ? CYS A 123 ? 1_555 CYS A 129 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
10 CYS A 93  ? CYS A 139 ? CYS A 148 ? 1_555 CYS A 194 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
11 CYS A 101 ? CYS A 295 ? CYS A 156 ? 1_555 CYS A 350 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
12 CYS A 311 ? CYS A 413 ? CYS A 366 ? 1_555 CYS A 468 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
13 CYS A 358 ? CYS A 750 ? CYS A 413 ? 1_555 CYS A 805 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
14 CYS A 511 ? CYS A 611 ? CYS A 566 ? 1_555 CYS A 666 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
15 CYS A 513 ? CYS A 596 ? CYS A 568 ? 1_555 CYS A 651 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
16 CYS A 719 ? CYS A 729 ? CYS A 774 ? 1_555 CYS A 784 ? 1_555 SG SG  .   . .   None            'Disulfide bridge' 
# 
loop_
_struct_mon_prot_cis.pdbx_id 
_struct_mon_prot_cis.label_comp_id 
_struct_mon_prot_cis.label_seq_id 
_struct_mon_prot_cis.label_asym_id 
_struct_mon_prot_cis.label_alt_id 
_struct_mon_prot_cis.pdbx_PDB_ins_code 
_struct_mon_prot_cis.auth_comp_id 
_struct_mon_prot_cis.auth_seq_id 
_struct_mon_prot_cis.auth_asym_id 
_struct_mon_prot_cis.pdbx_label_comp_id_2 
_struct_mon_prot_cis.pdbx_label_seq_id_2 
_struct_mon_prot_cis.pdbx_label_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2 
_struct_mon_prot_cis.pdbx_auth_comp_id_2 
_struct_mon_prot_cis.pdbx_auth_seq_id_2 
_struct_mon_prot_cis.pdbx_auth_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_model_num 
_struct_mon_prot_cis.pdbx_omega_angle 
1 PRO 15  A . ? PRO 70  A PRO 16  A ? PRO 71  A 1 4.53  
2 TYR 150 A . ? TYR 205 A PRO 151 A ? PRO 206 A 1 -8.81 
3 GLN 254 A . ? GLN 309 A PRO 255 A ? PRO 310 A 1 2.36  
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 6 ? 
AA2 ? 2 ? 
AA3 ? 2 ? 
AA4 ? 2 ? 
AA5 ? 2 ? 
AA6 ? 4 ? 
AA7 ? 2 ? 
AA8 ? 7 ? 
AA9 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? parallel      
AA1 2 3 ? parallel      
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA1 5 6 ? parallel      
AA2 1 2 ? parallel      
AA3 1 2 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA5 1 2 ? parallel      
AA6 1 2 ? anti-parallel 
AA6 2 3 ? anti-parallel 
AA6 3 4 ? anti-parallel 
AA7 1 2 ? anti-parallel 
AA8 1 2 ? anti-parallel 
AA8 2 3 ? anti-parallel 
AA8 3 4 ? anti-parallel 
AA8 4 5 ? anti-parallel 
AA8 5 6 ? anti-parallel 
AA8 6 7 ? anti-parallel 
AA9 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 VAL A 247 ? PRO A 255 ? VAL A 302 PRO A 310 
AA1 2 LEU A 110 ? ASP A 116 ? LEU A 165 ASP A 171 
AA1 3 ASN A 297 ? GLY A 302 ? ASN A 352 GLY A 357 
AA1 4 PHE A 432 ? TYR A 435 ? PHE A 487 TYR A 490 
AA1 5 THR A 141 ? HIS A 142 ? THR A 196 HIS A 197 
AA1 6 THR A 443 ? LYS A 444 ? THR A 498 LYS A 499 
AA2 1 MET A 146 ? ARG A 147 ? MET A 201 ARG A 202 
AA2 2 PHE A 448 ? GLU A 449 ? PHE A 503 GLU A 504 
AA3 1 MET A 177 ? ASP A 179 ? MET A 232 ASP A 234 
AA3 2 ALA A 184 ? PHE A 186 ? ALA A 239 PHE A 241 
AA4 1 GLU A 307 ? ASP A 308 ? GLU A 362 ASP A 363 
AA4 2 GLY A 417 ? ASP A 418 ? GLY A 472 ASP A 473 
AA5 1 THR A 314 ? PHE A 316 ? THR A 369 PHE A 371 
AA5 2 HIS A 397 ? ALA A 399 ? HIS A 452 ALA A 454 
AA6 1 ILE A 327 ? VAL A 330 ? ILE A 382 VAL A 385 
AA6 2 LEU A 334 ? ALA A 339 ? LEU A 389 ALA A 394 
AA6 3 ILE A 388 ? VAL A 392 ? ILE A 443 VAL A 447 
AA6 4 PHE A 365 ? MET A 369 ? PHE A 420 MET A 424 
AA7 1 ALA A 547 ? VAL A 548 ? ALA A 602 VAL A 603 
AA7 2 LEU A 780 ? ASP A 781 ? LEU A 835 ASP A 836 
AA8 1 TYR A 554 ? TYR A 558 ? TYR A 609 TYR A 613 
AA8 2 GLU A 563 ? SER A 567 ? GLU A 618 SER A 622 
AA8 3 PRO A 573 ? ILE A 580 ? PRO A 628 ILE A 635 
AA8 4 VAL A 675 ? ILE A 682 ? VAL A 730 ILE A 737 
AA8 5 HIS A 711 ? CYS A 719 ? HIS A 766 CYS A 774 
AA8 6 LEU A 733 ? PRO A 741 ? LEU A 788 PRO A 796 
AA8 7 THR A 768 ? ALA A 769 ? THR A 823 ALA A 824 
AA9 1 SER A 621 ? PHE A 624 ? SER A 676 PHE A 679 
AA9 2 MET A 646 ? MET A 649 ? MET A 701 MET A 704 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 O PHE A 250 ? O PHE A 305 N SER A 114 ? N SER A 169 
AA1 2 3 N PHE A 113 ? N PHE A 168 O ILE A 299 ? O ILE A 354 
AA1 3 4 N VAL A 298 ? N VAL A 353 O TYR A 435 ? O TYR A 490 
AA1 4 5 O GLY A 434 ? O GLY A 489 N THR A 141 ? N THR A 196 
AA1 5 6 N HIS A 142 ? N HIS A 197 O THR A 443 ? O THR A 498 
AA2 1 2 N ARG A 147 ? N ARG A 202 O PHE A 448 ? O PHE A 503 
AA3 1 2 N MET A 177 ? N MET A 232 O PHE A 186 ? O PHE A 241 
AA4 1 2 N GLU A 307 ? N GLU A 362 O ASP A 418 ? O ASP A 473 
AA5 1 2 N GLU A 315 ? N GLU A 370 O ALA A 399 ? O ALA A 454 
AA6 1 2 N THR A 328 ? N THR A 383 O ARG A 338 ? O ARG A 393 
AA6 2 3 N GLY A 335 ? N GLY A 390 O LEU A 390 ? O LEU A 445 
AA6 3 4 O HIS A 389 ? O HIS A 444 N TYR A 368 ? N TYR A 423 
AA7 1 2 N ALA A 547 ? N ALA A 602 O ASP A 781 ? O ASP A 836 
AA8 1 2 N ASP A 555 ? N ASP A 610 O TYR A 566 ? O TYR A 621 
AA8 2 3 N GLY A 565 ? N GLY A 620 O LEU A 574 ? O LEU A 629 
AA8 3 4 N TYR A 578 ? N TYR A 633 O VAL A 677 ? O VAL A 732 
AA8 4 5 N ASN A 676 ? N ASN A 731 O THR A 717 ? O THR A 772 
AA8 5 6 N SER A 718 ? N SER A 773 O SER A 734 ? O SER A 789 
AA8 6 7 N SER A 737 ? N SER A 792 O ALA A 769 ? O ALA A 824 
AA9 1 2 N SER A 621 ? N SER A 676 O MET A 649 ? O MET A 704 
# 
_pdbx_entry_details.entry_id                   9FXY 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1  1 HE2 A HIS 315 ? ? ZN  A ZN  904  ? ? 1.14 
2  1 HG  A SER 759 ? ? H   A ILE 761  ? ? 1.18 
3  1 HG  A SER 642 ? ? HZ3 A LYS 692  ? ? 1.21 
4  1 HG1 A THR 485 ? ? H   A VAL 486  ? ? 1.24 
5  1 H   A TYR 705 ? ? HE2 A HIS 797  ? ? 1.26 
6  1 HG1 A THR 209 ? ? ZN  A ZN  905  ? ? 1.28 
7  1 HE2 A HIS 474 ? ? ZN  A ZN  904  ? ? 1.33 
8  1 HE2 A HIS 359 ? ? ZN  A ZN  905  ? ? 1.45 
9  1 HH  A TYR 221 ? ? O   A HOH 5608 ? ? 1.57 
10 1 HD1 A HIS 197 ? ? O   A HOH 5607 ? ? 1.58 
11 1 HH  A TYR 233 ? ? OD1 A ASP 238  ? ? 1.59 
12 1 OE1 A GLU 859 ? ? O   A HOH 5601 ? ? 2.11 
13 1 O   A MET 675 ? ? O   A HOH 5602 ? ? 2.18 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1  1 ASP A 128 ? ? -147.26 28.63   
2  1 HIS A 433 ? ? 38.38   54.76   
3  1 ALA A 435 ? ? -155.65 -36.37  
4  1 ARG A 450 ? ? 85.86   0.13    
5  1 ASP A 477 ? ? -32.81  130.56  
6  1 THR A 485 ? ? -126.94 -162.35 
7  1 ASP A 563 ? ? -113.63 76.11   
8  1 LYS A 588 ? ? 12.58   -90.96  
9  1 SER A 676 ? ? -111.55 -161.06 
10 1 TYR A 742 ? ? 38.64   49.90   
11 1 TRP A 814 ? ? -144.51 -26.56  
# 
loop_
_pdbx_validate_planes.id 
_pdbx_validate_planes.PDB_model_num 
_pdbx_validate_planes.auth_comp_id 
_pdbx_validate_planes.auth_asym_id 
_pdbx_validate_planes.auth_seq_id 
_pdbx_validate_planes.PDB_ins_code 
_pdbx_validate_planes.label_alt_id 
_pdbx_validate_planes.rmsd 
_pdbx_validate_planes.type 
1  1 ARG A 98  ? ? 0.101 'SIDE CHAIN' 
2  1 ARG A 111 ? ? 0.113 'SIDE CHAIN' 
3  1 ARG A 192 ? ? 0.099 'SIDE CHAIN' 
4  1 ARG A 202 ? ? 0.078 'SIDE CHAIN' 
5  1 ARG A 246 ? ? 0.231 'SIDE CHAIN' 
6  1 ARG A 329 ? ? 0.085 'SIDE CHAIN' 
7  1 ARG A 449 ? ? 0.086 'SIDE CHAIN' 
8  1 ARG A 540 ? ? 0.147 'SIDE CHAIN' 
9  1 ARG A 827 ? ? 0.072 'SIDE CHAIN' 
10 1 ARG A 839 ? ? 0.076 'SIDE CHAIN' 
# 
_pdbx_refine_tls.id               1 
_pdbx_refine_tls.pdbx_refine_id   'X-RAY DIFFRACTION' 
_pdbx_refine_tls.details          ? 
_pdbx_refine_tls.method           refined 
_pdbx_refine_tls.origin_x         0.6063 
_pdbx_refine_tls.origin_y         -0.0992 
_pdbx_refine_tls.origin_z         1.0771 
_pdbx_refine_tls.T[1][1]          0.0643 
_pdbx_refine_tls.T[1][1]_esd      ? 
_pdbx_refine_tls.T[1][2]          -0.0623 
_pdbx_refine_tls.T[1][2]_esd      ? 
_pdbx_refine_tls.T[1][3]          -0.0312 
_pdbx_refine_tls.T[1][3]_esd      ? 
_pdbx_refine_tls.T[2][2]          0.0609 
_pdbx_refine_tls.T[2][2]_esd      ? 
_pdbx_refine_tls.T[2][3]          0.0297 
_pdbx_refine_tls.T[2][3]_esd      ? 
_pdbx_refine_tls.T[3][3]          0.0155 
_pdbx_refine_tls.T[3][3]_esd      ? 
_pdbx_refine_tls.L[1][1]          0.4458 
_pdbx_refine_tls.L[1][1]_esd      ? 
_pdbx_refine_tls.L[1][2]          0.0856 
_pdbx_refine_tls.L[1][2]_esd      ? 
_pdbx_refine_tls.L[1][3]          0.1424 
_pdbx_refine_tls.L[1][3]_esd      ? 
_pdbx_refine_tls.L[2][2]          0.6284 
_pdbx_refine_tls.L[2][2]_esd      ? 
_pdbx_refine_tls.L[2][3]          0.1155 
_pdbx_refine_tls.L[2][3]_esd      ? 
_pdbx_refine_tls.L[3][3]          0.7726 
_pdbx_refine_tls.L[3][3]_esd      ? 
_pdbx_refine_tls.S[1][1]          0.0066 
_pdbx_refine_tls.S[1][1]_esd      ? 
_pdbx_refine_tls.S[1][2]          -0.0022 
_pdbx_refine_tls.S[1][2]_esd      ? 
_pdbx_refine_tls.S[1][3]          -0.0057 
_pdbx_refine_tls.S[1][3]_esd      ? 
_pdbx_refine_tls.S[2][1]          0.0088 
_pdbx_refine_tls.S[2][1]_esd      ? 
_pdbx_refine_tls.S[2][2]          0.0085 
_pdbx_refine_tls.S[2][2]_esd      ? 
_pdbx_refine_tls.S[2][3]          -0.0176 
_pdbx_refine_tls.S[2][3]_esd      ? 
_pdbx_refine_tls.S[3][1]          0.0061 
_pdbx_refine_tls.S[3][1]_esd      ? 
_pdbx_refine_tls.S[3][2]          0.0065 
_pdbx_refine_tls.S[3][2]_esd      ? 
_pdbx_refine_tls.S[3][3]          -0.0151 
_pdbx_refine_tls.S[3][3]_esd      ? 
# 
_pdbx_refine_tls_group.id                  1 
_pdbx_refine_tls_group.pdbx_refine_id      'X-RAY DIFFRACTION' 
_pdbx_refine_tls_group.refine_tls_id       1 
_pdbx_refine_tls_group.beg_label_asym_id   ? 
_pdbx_refine_tls_group.beg_label_seq_id    ? 
_pdbx_refine_tls_group.beg_auth_asym_id    A 
_pdbx_refine_tls_group.beg_auth_seq_id     56 
_pdbx_refine_tls_group.beg_PDB_ins_code    ? 
_pdbx_refine_tls_group.end_label_asym_id   ? 
_pdbx_refine_tls_group.end_label_seq_id    ? 
_pdbx_refine_tls_group.end_auth_asym_id    A 
_pdbx_refine_tls_group.end_auth_seq_id     7838 
_pdbx_refine_tls_group.end_PDB_ins_code    ? 
_pdbx_refine_tls_group.selection           ALL 
_pdbx_refine_tls_group.selection_details   ? 
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? A HOH 5966 ? 5.97 . 
2 1 O ? A HOH 5967 ? 6.28 . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 A ILE 397 ? A ILE 342 
2  1 Y 1 A ASN 398 ? A ASN 343 
3  1 Y 1 A ASN 399 ? A ASN 344 
4  1 Y 1 A SER 400 ? A SER 345 
5  1 Y 1 A LYS 571 ? A LYS 516 
6  1 Y 1 A VAL 572 ? A VAL 517 
7  1 Y 1 A GLU 573 ? A GLU 518 
8  1 Y 1 A PRO 574 ? A PRO 519 
9  1 Y 1 A LYS 575 ? A LYS 520 
10 1 Y 1 A ASN 576 ? A ASN 521 
11 1 Y 1 A LYS 577 ? A LYS 522 
12 1 Y 1 A LEU 578 ? A LEU 523 
13 1 Y 1 A GLU 579 ? A GLU 524 
14 1 Y 1 A GLU 580 ? A GLU 525 
15 1 Y 1 A LEU 581 ? A LEU 526 
16 1 Y 1 A ASN 582 ? A ASN 527 
17 1 Y 1 A LYS 583 ? A LYS 528 
18 1 Y 1 A ARG 584 ? A ARG 529 
19 1 Y 1 A LEU 585 ? A LEU 530 
20 1 Y 1 A SER 860 ? A SER 805 
21 1 Y 1 A GLU 861 ? A GLU 806 
22 1 Y 1 A ILE 862 ? A ILE 807 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
A1IG1 C1   C  N N 1   
A1IG1 C2   C  Y N 2   
A1IG1 C3   C  Y N 3   
A1IG1 C4   C  Y N 4   
A1IG1 C5   C  Y N 5   
A1IG1 N5   N  N N 6   
A1IG1 C10  C  Y N 7   
A1IG1 C11  C  Y N 8   
A1IG1 C6   C  Y N 9   
A1IG1 C7   C  Y N 10  
A1IG1 C9   C  Y N 11  
A1IG1 N1   N  N N 12  
A1IG1 N2   N  Y N 13  
A1IG1 F1   F  N N 14  
A1IG1 C8   C  Y N 15  
A1IG1 S1   S  Y N 16  
A1IG1 C12  C  Y N 17  
A1IG1 C13  C  N N 18  
A1IG1 C14  C  N N 19  
A1IG1 C15  C  N N 20  
A1IG1 N3   N  N N 21  
A1IG1 N4   N  Y N 22  
A1IG1 C16  C  Y N 23  
A1IG1 C17  C  Y N 24  
A1IG1 C18  C  Y N 25  
A1IG1 C19  C  Y N 26  
A1IG1 C20  C  N N 27  
A1IG1 C21  C  N N 28  
A1IG1 C22  C  N N 29  
A1IG1 S2   S  N N 30  
A1IG1 C23  C  N N 31  
A1IG1 O1   O  N N 32  
A1IG1 O2   O  N N 33  
A1IG1 C24  C  N N 34  
A1IG1 C25  C  N N 35  
A1IG1 N6   N  Y N 36  
A1IG1 N7   N  Y N 37  
A1IG1 H1   H  N N 38  
A1IG1 H2   H  N N 39  
A1IG1 H3   H  N N 40  
A1IG1 H4   H  N N 41  
A1IG1 H8   H  N N 42  
A1IG1 H5   H  N N 43  
A1IG1 H7   H  N N 44  
A1IG1 H6   H  N N 45  
A1IG1 H9   H  N N 46  
A1IG1 H10  H  N N 47  
A1IG1 H11  H  N N 48  
A1IG1 H12  H  N N 49  
A1IG1 H13  H  N N 50  
A1IG1 H14  H  N N 51  
A1IG1 H15  H  N N 52  
A1IG1 H16  H  N N 53  
A1IG1 H17  H  N N 54  
A1IG1 H19  H  N N 55  
A1IG1 H18  H  N N 56  
A1IG1 H22  H  N N 57  
A1IG1 H20  H  N N 58  
A1IG1 H21  H  N N 59  
A1IG1 H23  H  N N 60  
A1IG1 H24  H  N N 61  
A1IG1 H26  H  N N 62  
A1IG1 H25  H  N N 63  
ALA   N    N  N N 64  
ALA   CA   C  N S 65  
ALA   C    C  N N 66  
ALA   O    O  N N 67  
ALA   CB   C  N N 68  
ALA   OXT  O  N N 69  
ALA   H    H  N N 70  
ALA   H2   H  N N 71  
ALA   HA   H  N N 72  
ALA   HB1  H  N N 73  
ALA   HB2  H  N N 74  
ALA   HB3  H  N N 75  
ALA   HXT  H  N N 76  
ARG   N    N  N N 77  
ARG   CA   C  N S 78  
ARG   C    C  N N 79  
ARG   O    O  N N 80  
ARG   CB   C  N N 81  
ARG   CG   C  N N 82  
ARG   CD   C  N N 83  
ARG   NE   N  N N 84  
ARG   CZ   C  N N 85  
ARG   NH1  N  N N 86  
ARG   NH2  N  N N 87  
ARG   OXT  O  N N 88  
ARG   H    H  N N 89  
ARG   H2   H  N N 90  
ARG   HA   H  N N 91  
ARG   HB2  H  N N 92  
ARG   HB3  H  N N 93  
ARG   HG2  H  N N 94  
ARG   HG3  H  N N 95  
ARG   HD2  H  N N 96  
ARG   HD3  H  N N 97  
ARG   HE   H  N N 98  
ARG   HH11 H  N N 99  
ARG   HH12 H  N N 100 
ARG   HH21 H  N N 101 
ARG   HH22 H  N N 102 
ARG   HXT  H  N N 103 
ASN   N    N  N N 104 
ASN   CA   C  N S 105 
ASN   C    C  N N 106 
ASN   O    O  N N 107 
ASN   CB   C  N N 108 
ASN   CG   C  N N 109 
ASN   OD1  O  N N 110 
ASN   ND2  N  N N 111 
ASN   OXT  O  N N 112 
ASN   H    H  N N 113 
ASN   H2   H  N N 114 
ASN   HA   H  N N 115 
ASN   HB2  H  N N 116 
ASN   HB3  H  N N 117 
ASN   HD21 H  N N 118 
ASN   HD22 H  N N 119 
ASN   HXT  H  N N 120 
ASP   N    N  N N 121 
ASP   CA   C  N S 122 
ASP   C    C  N N 123 
ASP   O    O  N N 124 
ASP   CB   C  N N 125 
ASP   CG   C  N N 126 
ASP   OD1  O  N N 127 
ASP   OD2  O  N N 128 
ASP   OXT  O  N N 129 
ASP   H    H  N N 130 
ASP   H2   H  N N 131 
ASP   HA   H  N N 132 
ASP   HB2  H  N N 133 
ASP   HB3  H  N N 134 
ASP   HD2  H  N N 135 
ASP   HXT  H  N N 136 
BMA   C1   C  N R 137 
BMA   C2   C  N S 138 
BMA   C3   C  N S 139 
BMA   C4   C  N S 140 
BMA   C5   C  N R 141 
BMA   C6   C  N N 142 
BMA   O1   O  N N 143 
BMA   O2   O  N N 144 
BMA   O3   O  N N 145 
BMA   O4   O  N N 146 
BMA   O5   O  N N 147 
BMA   O6   O  N N 148 
BMA   H1   H  N N 149 
BMA   H2   H  N N 150 
BMA   H3   H  N N 151 
BMA   H4   H  N N 152 
BMA   H5   H  N N 153 
BMA   H61  H  N N 154 
BMA   H62  H  N N 155 
BMA   HO1  H  N N 156 
BMA   HO2  H  N N 157 
BMA   HO3  H  N N 158 
BMA   HO4  H  N N 159 
BMA   HO6  H  N N 160 
CA    CA   CA N N 161 
CYS   N    N  N N 162 
CYS   CA   C  N R 163 
CYS   C    C  N N 164 
CYS   O    O  N N 165 
CYS   CB   C  N N 166 
CYS   SG   S  N N 167 
CYS   OXT  O  N N 168 
CYS   H    H  N N 169 
CYS   H2   H  N N 170 
CYS   HA   H  N N 171 
CYS   HB2  H  N N 172 
CYS   HB3  H  N N 173 
CYS   HG   H  N N 174 
CYS   HXT  H  N N 175 
GLN   N    N  N N 176 
GLN   CA   C  N S 177 
GLN   C    C  N N 178 
GLN   O    O  N N 179 
GLN   CB   C  N N 180 
GLN   CG   C  N N 181 
GLN   CD   C  N N 182 
GLN   OE1  O  N N 183 
GLN   NE2  N  N N 184 
GLN   OXT  O  N N 185 
GLN   H    H  N N 186 
GLN   H2   H  N N 187 
GLN   HA   H  N N 188 
GLN   HB2  H  N N 189 
GLN   HB3  H  N N 190 
GLN   HG2  H  N N 191 
GLN   HG3  H  N N 192 
GLN   HE21 H  N N 193 
GLN   HE22 H  N N 194 
GLN   HXT  H  N N 195 
GLU   N    N  N N 196 
GLU   CA   C  N S 197 
GLU   C    C  N N 198 
GLU   O    O  N N 199 
GLU   CB   C  N N 200 
GLU   CG   C  N N 201 
GLU   CD   C  N N 202 
GLU   OE1  O  N N 203 
GLU   OE2  O  N N 204 
GLU   OXT  O  N N 205 
GLU   H    H  N N 206 
GLU   H2   H  N N 207 
GLU   HA   H  N N 208 
GLU   HB2  H  N N 209 
GLU   HB3  H  N N 210 
GLU   HG2  H  N N 211 
GLU   HG3  H  N N 212 
GLU   HE2  H  N N 213 
GLU   HXT  H  N N 214 
GLY   N    N  N N 215 
GLY   CA   C  N N 216 
GLY   C    C  N N 217 
GLY   O    O  N N 218 
GLY   OXT  O  N N 219 
GLY   H    H  N N 220 
GLY   H2   H  N N 221 
GLY   HA2  H  N N 222 
GLY   HA3  H  N N 223 
GLY   HXT  H  N N 224 
GOL   C1   C  N N 225 
GOL   O1   O  N N 226 
GOL   C2   C  N N 227 
GOL   O2   O  N N 228 
GOL   C3   C  N N 229 
GOL   O3   O  N N 230 
GOL   H11  H  N N 231 
GOL   H12  H  N N 232 
GOL   HO1  H  N N 233 
GOL   H2   H  N N 234 
GOL   HO2  H  N N 235 
GOL   H31  H  N N 236 
GOL   H32  H  N N 237 
GOL   HO3  H  N N 238 
HIS   N    N  N N 239 
HIS   CA   C  N S 240 
HIS   C    C  N N 241 
HIS   O    O  N N 242 
HIS   CB   C  N N 243 
HIS   CG   C  Y N 244 
HIS   ND1  N  Y N 245 
HIS   CD2  C  Y N 246 
HIS   CE1  C  Y N 247 
HIS   NE2  N  Y N 248 
HIS   OXT  O  N N 249 
HIS   H    H  N N 250 
HIS   H2   H  N N 251 
HIS   HA   H  N N 252 
HIS   HB2  H  N N 253 
HIS   HB3  H  N N 254 
HIS   HD1  H  N N 255 
HIS   HD2  H  N N 256 
HIS   HE1  H  N N 257 
HIS   HE2  H  N N 258 
HIS   HXT  H  N N 259 
HOH   O    O  N N 260 
HOH   H1   H  N N 261 
HOH   H2   H  N N 262 
ILE   N    N  N N 263 
ILE   CA   C  N S 264 
ILE   C    C  N N 265 
ILE   O    O  N N 266 
ILE   CB   C  N S 267 
ILE   CG1  C  N N 268 
ILE   CG2  C  N N 269 
ILE   CD1  C  N N 270 
ILE   OXT  O  N N 271 
ILE   H    H  N N 272 
ILE   H2   H  N N 273 
ILE   HA   H  N N 274 
ILE   HB   H  N N 275 
ILE   HG12 H  N N 276 
ILE   HG13 H  N N 277 
ILE   HG21 H  N N 278 
ILE   HG22 H  N N 279 
ILE   HG23 H  N N 280 
ILE   HD11 H  N N 281 
ILE   HD12 H  N N 282 
ILE   HD13 H  N N 283 
ILE   HXT  H  N N 284 
IOD   I    I  N N 285 
LEU   N    N  N N 286 
LEU   CA   C  N S 287 
LEU   C    C  N N 288 
LEU   O    O  N N 289 
LEU   CB   C  N N 290 
LEU   CG   C  N N 291 
LEU   CD1  C  N N 292 
LEU   CD2  C  N N 293 
LEU   OXT  O  N N 294 
LEU   H    H  N N 295 
LEU   H2   H  N N 296 
LEU   HA   H  N N 297 
LEU   HB2  H  N N 298 
LEU   HB3  H  N N 299 
LEU   HG   H  N N 300 
LEU   HD11 H  N N 301 
LEU   HD12 H  N N 302 
LEU   HD13 H  N N 303 
LEU   HD21 H  N N 304 
LEU   HD22 H  N N 305 
LEU   HD23 H  N N 306 
LEU   HXT  H  N N 307 
LYS   N    N  N N 308 
LYS   CA   C  N S 309 
LYS   C    C  N N 310 
LYS   O    O  N N 311 
LYS   CB   C  N N 312 
LYS   CG   C  N N 313 
LYS   CD   C  N N 314 
LYS   CE   C  N N 315 
LYS   NZ   N  N N 316 
LYS   OXT  O  N N 317 
LYS   H    H  N N 318 
LYS   H2   H  N N 319 
LYS   HA   H  N N 320 
LYS   HB2  H  N N 321 
LYS   HB3  H  N N 322 
LYS   HG2  H  N N 323 
LYS   HG3  H  N N 324 
LYS   HD2  H  N N 325 
LYS   HD3  H  N N 326 
LYS   HE2  H  N N 327 
LYS   HE3  H  N N 328 
LYS   HZ1  H  N N 329 
LYS   HZ2  H  N N 330 
LYS   HZ3  H  N N 331 
LYS   HXT  H  N N 332 
MET   N    N  N N 333 
MET   CA   C  N S 334 
MET   C    C  N N 335 
MET   O    O  N N 336 
MET   CB   C  N N 337 
MET   CG   C  N N 338 
MET   SD   S  N N 339 
MET   CE   C  N N 340 
MET   OXT  O  N N 341 
MET   H    H  N N 342 
MET   H2   H  N N 343 
MET   HA   H  N N 344 
MET   HB2  H  N N 345 
MET   HB3  H  N N 346 
MET   HG2  H  N N 347 
MET   HG3  H  N N 348 
MET   HE1  H  N N 349 
MET   HE2  H  N N 350 
MET   HE3  H  N N 351 
MET   HXT  H  N N 352 
NAG   C1   C  N R 353 
NAG   C2   C  N R 354 
NAG   C3   C  N R 355 
NAG   C4   C  N S 356 
NAG   C5   C  N R 357 
NAG   C6   C  N N 358 
NAG   C7   C  N N 359 
NAG   C8   C  N N 360 
NAG   N2   N  N N 361 
NAG   O1   O  N N 362 
NAG   O3   O  N N 363 
NAG   O4   O  N N 364 
NAG   O5   O  N N 365 
NAG   O6   O  N N 366 
NAG   O7   O  N N 367 
NAG   H1   H  N N 368 
NAG   H2   H  N N 369 
NAG   H3   H  N N 370 
NAG   H4   H  N N 371 
NAG   H5   H  N N 372 
NAG   H61  H  N N 373 
NAG   H62  H  N N 374 
NAG   H81  H  N N 375 
NAG   H82  H  N N 376 
NAG   H83  H  N N 377 
NAG   HN2  H  N N 378 
NAG   HO1  H  N N 379 
NAG   HO3  H  N N 380 
NAG   HO4  H  N N 381 
NAG   HO6  H  N N 382 
PHE   N    N  N N 383 
PHE   CA   C  N S 384 
PHE   C    C  N N 385 
PHE   O    O  N N 386 
PHE   CB   C  N N 387 
PHE   CG   C  Y N 388 
PHE   CD1  C  Y N 389 
PHE   CD2  C  Y N 390 
PHE   CE1  C  Y N 391 
PHE   CE2  C  Y N 392 
PHE   CZ   C  Y N 393 
PHE   OXT  O  N N 394 
PHE   H    H  N N 395 
PHE   H2   H  N N 396 
PHE   HA   H  N N 397 
PHE   HB2  H  N N 398 
PHE   HB3  H  N N 399 
PHE   HD1  H  N N 400 
PHE   HD2  H  N N 401 
PHE   HE1  H  N N 402 
PHE   HE2  H  N N 403 
PHE   HZ   H  N N 404 
PHE   HXT  H  N N 405 
PO4   P    P  N N 406 
PO4   O1   O  N N 407 
PO4   O2   O  N N 408 
PO4   O3   O  N N 409 
PO4   O4   O  N N 410 
PRO   N    N  N N 411 
PRO   CA   C  N S 412 
PRO   C    C  N N 413 
PRO   O    O  N N 414 
PRO   CB   C  N N 415 
PRO   CG   C  N N 416 
PRO   CD   C  N N 417 
PRO   OXT  O  N N 418 
PRO   H    H  N N 419 
PRO   HA   H  N N 420 
PRO   HB2  H  N N 421 
PRO   HB3  H  N N 422 
PRO   HG2  H  N N 423 
PRO   HG3  H  N N 424 
PRO   HD2  H  N N 425 
PRO   HD3  H  N N 426 
PRO   HXT  H  N N 427 
SCN   S    S  N N 428 
SCN   C    C  N N 429 
SCN   N    N  N N 430 
SER   N    N  N N 431 
SER   CA   C  N S 432 
SER   C    C  N N 433 
SER   O    O  N N 434 
SER   CB   C  N N 435 
SER   OG   O  N N 436 
SER   OXT  O  N N 437 
SER   H    H  N N 438 
SER   H2   H  N N 439 
SER   HA   H  N N 440 
SER   HB2  H  N N 441 
SER   HB3  H  N N 442 
SER   HG   H  N N 443 
SER   HXT  H  N N 444 
THR   N    N  N N 445 
THR   CA   C  N S 446 
THR   C    C  N N 447 
THR   O    O  N N 448 
THR   CB   C  N R 449 
THR   OG1  O  N N 450 
THR   CG2  C  N N 451 
THR   OXT  O  N N 452 
THR   H    H  N N 453 
THR   H2   H  N N 454 
THR   HA   H  N N 455 
THR   HB   H  N N 456 
THR   HG1  H  N N 457 
THR   HG21 H  N N 458 
THR   HG22 H  N N 459 
THR   HG23 H  N N 460 
THR   HXT  H  N N 461 
TRP   N    N  N N 462 
TRP   CA   C  N S 463 
TRP   C    C  N N 464 
TRP   O    O  N N 465 
TRP   CB   C  N N 466 
TRP   CG   C  Y N 467 
TRP   CD1  C  Y N 468 
TRP   CD2  C  Y N 469 
TRP   NE1  N  Y N 470 
TRP   CE2  C  Y N 471 
TRP   CE3  C  Y N 472 
TRP   CZ2  C  Y N 473 
TRP   CZ3  C  Y N 474 
TRP   CH2  C  Y N 475 
TRP   OXT  O  N N 476 
TRP   H    H  N N 477 
TRP   H2   H  N N 478 
TRP   HA   H  N N 479 
TRP   HB2  H  N N 480 
TRP   HB3  H  N N 481 
TRP   HD1  H  N N 482 
TRP   HE1  H  N N 483 
TRP   HE3  H  N N 484 
TRP   HZ2  H  N N 485 
TRP   HZ3  H  N N 486 
TRP   HH2  H  N N 487 
TRP   HXT  H  N N 488 
TYR   N    N  N N 489 
TYR   CA   C  N S 490 
TYR   C    C  N N 491 
TYR   O    O  N N 492 
TYR   CB   C  N N 493 
TYR   CG   C  Y N 494 
TYR   CD1  C  Y N 495 
TYR   CD2  C  Y N 496 
TYR   CE1  C  Y N 497 
TYR   CE2  C  Y N 498 
TYR   CZ   C  Y N 499 
TYR   OH   O  N N 500 
TYR   OXT  O  N N 501 
TYR   H    H  N N 502 
TYR   H2   H  N N 503 
TYR   HA   H  N N 504 
TYR   HB2  H  N N 505 
TYR   HB3  H  N N 506 
TYR   HD1  H  N N 507 
TYR   HD2  H  N N 508 
TYR   HE1  H  N N 509 
TYR   HE2  H  N N 510 
TYR   HH   H  N N 511 
TYR   HXT  H  N N 512 
VAL   N    N  N N 513 
VAL   CA   C  N S 514 
VAL   C    C  N N 515 
VAL   O    O  N N 516 
VAL   CB   C  N N 517 
VAL   CG1  C  N N 518 
VAL   CG2  C  N N 519 
VAL   OXT  O  N N 520 
VAL   H    H  N N 521 
VAL   H2   H  N N 522 
VAL   HA   H  N N 523 
VAL   HB   H  N N 524 
VAL   HG11 H  N N 525 
VAL   HG12 H  N N 526 
VAL   HG13 H  N N 527 
VAL   HG21 H  N N 528 
VAL   HG22 H  N N 529 
VAL   HG23 H  N N 530 
VAL   HXT  H  N N 531 
ZN    ZN   ZN N N 532 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
A1IG1 O2  S2   doub N N 1   
A1IG1 C23 S2   sing N N 2   
A1IG1 S2  O1   doub N N 3   
A1IG1 S2  N5   sing N N 4   
A1IG1 C22 N5   sing N N 5   
A1IG1 C22 C21  sing N N 6   
A1IG1 N5  C24  sing N N 7   
A1IG1 C21 C20  sing N N 8   
A1IG1 C24 C25  sing N N 9   
A1IG1 C20 C25  sing N N 10  
A1IG1 C20 C19  sing N N 11  
A1IG1 C1  N1   sing N N 12  
A1IG1 C6  C5   doub Y N 13  
A1IG1 C6  C7   sing Y N 14  
A1IG1 C19 N6   doub Y N 15  
A1IG1 C19 C18  sing Y N 16  
A1IG1 N6  N7   sing Y N 17  
A1IG1 C5  C4   sing Y N 18  
A1IG1 F1  C7   sing N N 19  
A1IG1 N1  C11  sing N N 20  
A1IG1 N1  C2   sing N N 21  
A1IG1 C7  C8   doub Y N 22  
A1IG1 C18 C17  doub Y N 23  
A1IG1 N2  C2   doub Y N 24  
A1IG1 N2  C3   sing Y N 25  
A1IG1 N7  C11  sing Y N 26  
A1IG1 N7  C16  sing Y N 27  
A1IG1 C11 C12  doub Y N 28  
A1IG1 C2  S1   sing Y N 29  
A1IG1 C4  C3   sing N N 30  
A1IG1 C4  C9   doub Y N 31  
A1IG1 C3  C10  doub Y N 32  
A1IG1 C17 C16  sing Y N 33  
A1IG1 C16 N4   doub Y N 34  
A1IG1 C8  C9   sing Y N 35  
A1IG1 C12 N4   sing Y N 36  
A1IG1 C12 C13  sing N N 37  
A1IG1 S1  C10  sing Y N 38  
A1IG1 C13 C14  sing N N 39  
A1IG1 C14 C15  sing N N 40  
A1IG1 C15 N3   trip N N 41  
A1IG1 C1  H1   sing N N 42  
A1IG1 C1  H2   sing N N 43  
A1IG1 C1  H3   sing N N 44  
A1IG1 C5  H4   sing N N 45  
A1IG1 C10 H8   sing N N 46  
A1IG1 C6  H5   sing N N 47  
A1IG1 C9  H7   sing N N 48  
A1IG1 C8  H6   sing N N 49  
A1IG1 C13 H9   sing N N 50  
A1IG1 C13 H10  sing N N 51  
A1IG1 C14 H11  sing N N 52  
A1IG1 C14 H12  sing N N 53  
A1IG1 C17 H13  sing N N 54  
A1IG1 C18 H14  sing N N 55  
A1IG1 C20 H15  sing N N 56  
A1IG1 C21 H16  sing N N 57  
A1IG1 C21 H17  sing N N 58  
A1IG1 C22 H19  sing N N 59  
A1IG1 C22 H18  sing N N 60  
A1IG1 C23 H22  sing N N 61  
A1IG1 C23 H20  sing N N 62  
A1IG1 C23 H21  sing N N 63  
A1IG1 C24 H23  sing N N 64  
A1IG1 C24 H24  sing N N 65  
A1IG1 C25 H26  sing N N 66  
A1IG1 C25 H25  sing N N 67  
ALA   N   CA   sing N N 68  
ALA   N   H    sing N N 69  
ALA   N   H2   sing N N 70  
ALA   CA  C    sing N N 71  
ALA   CA  CB   sing N N 72  
ALA   CA  HA   sing N N 73  
ALA   C   O    doub N N 74  
ALA   C   OXT  sing N N 75  
ALA   CB  HB1  sing N N 76  
ALA   CB  HB2  sing N N 77  
ALA   CB  HB3  sing N N 78  
ALA   OXT HXT  sing N N 79  
ARG   N   CA   sing N N 80  
ARG   N   H    sing N N 81  
ARG   N   H2   sing N N 82  
ARG   CA  C    sing N N 83  
ARG   CA  CB   sing N N 84  
ARG   CA  HA   sing N N 85  
ARG   C   O    doub N N 86  
ARG   C   OXT  sing N N 87  
ARG   CB  CG   sing N N 88  
ARG   CB  HB2  sing N N 89  
ARG   CB  HB3  sing N N 90  
ARG   CG  CD   sing N N 91  
ARG   CG  HG2  sing N N 92  
ARG   CG  HG3  sing N N 93  
ARG   CD  NE   sing N N 94  
ARG   CD  HD2  sing N N 95  
ARG   CD  HD3  sing N N 96  
ARG   NE  CZ   sing N N 97  
ARG   NE  HE   sing N N 98  
ARG   CZ  NH1  sing N N 99  
ARG   CZ  NH2  doub N N 100 
ARG   NH1 HH11 sing N N 101 
ARG   NH1 HH12 sing N N 102 
ARG   NH2 HH21 sing N N 103 
ARG   NH2 HH22 sing N N 104 
ARG   OXT HXT  sing N N 105 
ASN   N   CA   sing N N 106 
ASN   N   H    sing N N 107 
ASN   N   H2   sing N N 108 
ASN   CA  C    sing N N 109 
ASN   CA  CB   sing N N 110 
ASN   CA  HA   sing N N 111 
ASN   C   O    doub N N 112 
ASN   C   OXT  sing N N 113 
ASN   CB  CG   sing N N 114 
ASN   CB  HB2  sing N N 115 
ASN   CB  HB3  sing N N 116 
ASN   CG  OD1  doub N N 117 
ASN   CG  ND2  sing N N 118 
ASN   ND2 HD21 sing N N 119 
ASN   ND2 HD22 sing N N 120 
ASN   OXT HXT  sing N N 121 
ASP   N   CA   sing N N 122 
ASP   N   H    sing N N 123 
ASP   N   H2   sing N N 124 
ASP   CA  C    sing N N 125 
ASP   CA  CB   sing N N 126 
ASP   CA  HA   sing N N 127 
ASP   C   O    doub N N 128 
ASP   C   OXT  sing N N 129 
ASP   CB  CG   sing N N 130 
ASP   CB  HB2  sing N N 131 
ASP   CB  HB3  sing N N 132 
ASP   CG  OD1  doub N N 133 
ASP   CG  OD2  sing N N 134 
ASP   OD2 HD2  sing N N 135 
ASP   OXT HXT  sing N N 136 
BMA   C1  C2   sing N N 137 
BMA   C1  O1   sing N N 138 
BMA   C1  O5   sing N N 139 
BMA   C1  H1   sing N N 140 
BMA   C2  C3   sing N N 141 
BMA   C2  O2   sing N N 142 
BMA   C2  H2   sing N N 143 
BMA   C3  C4   sing N N 144 
BMA   C3  O3   sing N N 145 
BMA   C3  H3   sing N N 146 
BMA   C4  C5   sing N N 147 
BMA   C4  O4   sing N N 148 
BMA   C4  H4   sing N N 149 
BMA   C5  C6   sing N N 150 
BMA   C5  O5   sing N N 151 
BMA   C5  H5   sing N N 152 
BMA   C6  O6   sing N N 153 
BMA   C6  H61  sing N N 154 
BMA   C6  H62  sing N N 155 
BMA   O1  HO1  sing N N 156 
BMA   O2  HO2  sing N N 157 
BMA   O3  HO3  sing N N 158 
BMA   O4  HO4  sing N N 159 
BMA   O6  HO6  sing N N 160 
CYS   N   CA   sing N N 161 
CYS   N   H    sing N N 162 
CYS   N   H2   sing N N 163 
CYS   CA  C    sing N N 164 
CYS   CA  CB   sing N N 165 
CYS   CA  HA   sing N N 166 
CYS   C   O    doub N N 167 
CYS   C   OXT  sing N N 168 
CYS   CB  SG   sing N N 169 
CYS   CB  HB2  sing N N 170 
CYS   CB  HB3  sing N N 171 
CYS   SG  HG   sing N N 172 
CYS   OXT HXT  sing N N 173 
GLN   N   CA   sing N N 174 
GLN   N   H    sing N N 175 
GLN   N   H2   sing N N 176 
GLN   CA  C    sing N N 177 
GLN   CA  CB   sing N N 178 
GLN   CA  HA   sing N N 179 
GLN   C   O    doub N N 180 
GLN   C   OXT  sing N N 181 
GLN   CB  CG   sing N N 182 
GLN   CB  HB2  sing N N 183 
GLN   CB  HB3  sing N N 184 
GLN   CG  CD   sing N N 185 
GLN   CG  HG2  sing N N 186 
GLN   CG  HG3  sing N N 187 
GLN   CD  OE1  doub N N 188 
GLN   CD  NE2  sing N N 189 
GLN   NE2 HE21 sing N N 190 
GLN   NE2 HE22 sing N N 191 
GLN   OXT HXT  sing N N 192 
GLU   N   CA   sing N N 193 
GLU   N   H    sing N N 194 
GLU   N   H2   sing N N 195 
GLU   CA  C    sing N N 196 
GLU   CA  CB   sing N N 197 
GLU   CA  HA   sing N N 198 
GLU   C   O    doub N N 199 
GLU   C   OXT  sing N N 200 
GLU   CB  CG   sing N N 201 
GLU   CB  HB2  sing N N 202 
GLU   CB  HB3  sing N N 203 
GLU   CG  CD   sing N N 204 
GLU   CG  HG2  sing N N 205 
GLU   CG  HG3  sing N N 206 
GLU   CD  OE1  doub N N 207 
GLU   CD  OE2  sing N N 208 
GLU   OE2 HE2  sing N N 209 
GLU   OXT HXT  sing N N 210 
GLY   N   CA   sing N N 211 
GLY   N   H    sing N N 212 
GLY   N   H2   sing N N 213 
GLY   CA  C    sing N N 214 
GLY   CA  HA2  sing N N 215 
GLY   CA  HA3  sing N N 216 
GLY   C   O    doub N N 217 
GLY   C   OXT  sing N N 218 
GLY   OXT HXT  sing N N 219 
GOL   C1  O1   sing N N 220 
GOL   C1  C2   sing N N 221 
GOL   C1  H11  sing N N 222 
GOL   C1  H12  sing N N 223 
GOL   O1  HO1  sing N N 224 
GOL   C2  O2   sing N N 225 
GOL   C2  C3   sing N N 226 
GOL   C2  H2   sing N N 227 
GOL   O2  HO2  sing N N 228 
GOL   C3  O3   sing N N 229 
GOL   C3  H31  sing N N 230 
GOL   C3  H32  sing N N 231 
GOL   O3  HO3  sing N N 232 
HIS   N   CA   sing N N 233 
HIS   N   H    sing N N 234 
HIS   N   H2   sing N N 235 
HIS   CA  C    sing N N 236 
HIS   CA  CB   sing N N 237 
HIS   CA  HA   sing N N 238 
HIS   C   O    doub N N 239 
HIS   C   OXT  sing N N 240 
HIS   CB  CG   sing N N 241 
HIS   CB  HB2  sing N N 242 
HIS   CB  HB3  sing N N 243 
HIS   CG  ND1  sing Y N 244 
HIS   CG  CD2  doub Y N 245 
HIS   ND1 CE1  doub Y N 246 
HIS   ND1 HD1  sing N N 247 
HIS   CD2 NE2  sing Y N 248 
HIS   CD2 HD2  sing N N 249 
HIS   CE1 NE2  sing Y N 250 
HIS   CE1 HE1  sing N N 251 
HIS   NE2 HE2  sing N N 252 
HIS   OXT HXT  sing N N 253 
HOH   O   H1   sing N N 254 
HOH   O   H2   sing N N 255 
ILE   N   CA   sing N N 256 
ILE   N   H    sing N N 257 
ILE   N   H2   sing N N 258 
ILE   CA  C    sing N N 259 
ILE   CA  CB   sing N N 260 
ILE   CA  HA   sing N N 261 
ILE   C   O    doub N N 262 
ILE   C   OXT  sing N N 263 
ILE   CB  CG1  sing N N 264 
ILE   CB  CG2  sing N N 265 
ILE   CB  HB   sing N N 266 
ILE   CG1 CD1  sing N N 267 
ILE   CG1 HG12 sing N N 268 
ILE   CG1 HG13 sing N N 269 
ILE   CG2 HG21 sing N N 270 
ILE   CG2 HG22 sing N N 271 
ILE   CG2 HG23 sing N N 272 
ILE   CD1 HD11 sing N N 273 
ILE   CD1 HD12 sing N N 274 
ILE   CD1 HD13 sing N N 275 
ILE   OXT HXT  sing N N 276 
LEU   N   CA   sing N N 277 
LEU   N   H    sing N N 278 
LEU   N   H2   sing N N 279 
LEU   CA  C    sing N N 280 
LEU   CA  CB   sing N N 281 
LEU   CA  HA   sing N N 282 
LEU   C   O    doub N N 283 
LEU   C   OXT  sing N N 284 
LEU   CB  CG   sing N N 285 
LEU   CB  HB2  sing N N 286 
LEU   CB  HB3  sing N N 287 
LEU   CG  CD1  sing N N 288 
LEU   CG  CD2  sing N N 289 
LEU   CG  HG   sing N N 290 
LEU   CD1 HD11 sing N N 291 
LEU   CD1 HD12 sing N N 292 
LEU   CD1 HD13 sing N N 293 
LEU   CD2 HD21 sing N N 294 
LEU   CD2 HD22 sing N N 295 
LEU   CD2 HD23 sing N N 296 
LEU   OXT HXT  sing N N 297 
LYS   N   CA   sing N N 298 
LYS   N   H    sing N N 299 
LYS   N   H2   sing N N 300 
LYS   CA  C    sing N N 301 
LYS   CA  CB   sing N N 302 
LYS   CA  HA   sing N N 303 
LYS   C   O    doub N N 304 
LYS   C   OXT  sing N N 305 
LYS   CB  CG   sing N N 306 
LYS   CB  HB2  sing N N 307 
LYS   CB  HB3  sing N N 308 
LYS   CG  CD   sing N N 309 
LYS   CG  HG2  sing N N 310 
LYS   CG  HG3  sing N N 311 
LYS   CD  CE   sing N N 312 
LYS   CD  HD2  sing N N 313 
LYS   CD  HD3  sing N N 314 
LYS   CE  NZ   sing N N 315 
LYS   CE  HE2  sing N N 316 
LYS   CE  HE3  sing N N 317 
LYS   NZ  HZ1  sing N N 318 
LYS   NZ  HZ2  sing N N 319 
LYS   NZ  HZ3  sing N N 320 
LYS   OXT HXT  sing N N 321 
MET   N   CA   sing N N 322 
MET   N   H    sing N N 323 
MET   N   H2   sing N N 324 
MET   CA  C    sing N N 325 
MET   CA  CB   sing N N 326 
MET   CA  HA   sing N N 327 
MET   C   O    doub N N 328 
MET   C   OXT  sing N N 329 
MET   CB  CG   sing N N 330 
MET   CB  HB2  sing N N 331 
MET   CB  HB3  sing N N 332 
MET   CG  SD   sing N N 333 
MET   CG  HG2  sing N N 334 
MET   CG  HG3  sing N N 335 
MET   SD  CE   sing N N 336 
MET   CE  HE1  sing N N 337 
MET   CE  HE2  sing N N 338 
MET   CE  HE3  sing N N 339 
MET   OXT HXT  sing N N 340 
NAG   C1  C2   sing N N 341 
NAG   C1  O1   sing N N 342 
NAG   C1  O5   sing N N 343 
NAG   C1  H1   sing N N 344 
NAG   C2  C3   sing N N 345 
NAG   C2  N2   sing N N 346 
NAG   C2  H2   sing N N 347 
NAG   C3  C4   sing N N 348 
NAG   C3  O3   sing N N 349 
NAG   C3  H3   sing N N 350 
NAG   C4  C5   sing N N 351 
NAG   C4  O4   sing N N 352 
NAG   C4  H4   sing N N 353 
NAG   C5  C6   sing N N 354 
NAG   C5  O5   sing N N 355 
NAG   C5  H5   sing N N 356 
NAG   C6  O6   sing N N 357 
NAG   C6  H61  sing N N 358 
NAG   C6  H62  sing N N 359 
NAG   C7  C8   sing N N 360 
NAG   C7  N2   sing N N 361 
NAG   C7  O7   doub N N 362 
NAG   C8  H81  sing N N 363 
NAG   C8  H82  sing N N 364 
NAG   C8  H83  sing N N 365 
NAG   N2  HN2  sing N N 366 
NAG   O1  HO1  sing N N 367 
NAG   O3  HO3  sing N N 368 
NAG   O4  HO4  sing N N 369 
NAG   O6  HO6  sing N N 370 
PHE   N   CA   sing N N 371 
PHE   N   H    sing N N 372 
PHE   N   H2   sing N N 373 
PHE   CA  C    sing N N 374 
PHE   CA  CB   sing N N 375 
PHE   CA  HA   sing N N 376 
PHE   C   O    doub N N 377 
PHE   C   OXT  sing N N 378 
PHE   CB  CG   sing N N 379 
PHE   CB  HB2  sing N N 380 
PHE   CB  HB3  sing N N 381 
PHE   CG  CD1  doub Y N 382 
PHE   CG  CD2  sing Y N 383 
PHE   CD1 CE1  sing Y N 384 
PHE   CD1 HD1  sing N N 385 
PHE   CD2 CE2  doub Y N 386 
PHE   CD2 HD2  sing N N 387 
PHE   CE1 CZ   doub Y N 388 
PHE   CE1 HE1  sing N N 389 
PHE   CE2 CZ   sing Y N 390 
PHE   CE2 HE2  sing N N 391 
PHE   CZ  HZ   sing N N 392 
PHE   OXT HXT  sing N N 393 
PO4   P   O1   doub N N 394 
PO4   P   O2   sing N N 395 
PO4   P   O3   sing N N 396 
PO4   P   O4   sing N N 397 
PRO   N   CA   sing N N 398 
PRO   N   CD   sing N N 399 
PRO   N   H    sing N N 400 
PRO   CA  C    sing N N 401 
PRO   CA  CB   sing N N 402 
PRO   CA  HA   sing N N 403 
PRO   C   O    doub N N 404 
PRO   C   OXT  sing N N 405 
PRO   CB  CG   sing N N 406 
PRO   CB  HB2  sing N N 407 
PRO   CB  HB3  sing N N 408 
PRO   CG  CD   sing N N 409 
PRO   CG  HG2  sing N N 410 
PRO   CG  HG3  sing N N 411 
PRO   CD  HD2  sing N N 412 
PRO   CD  HD3  sing N N 413 
PRO   OXT HXT  sing N N 414 
SCN   S   C    sing N N 415 
SCN   C   N    trip N N 416 
SER   N   CA   sing N N 417 
SER   N   H    sing N N 418 
SER   N   H2   sing N N 419 
SER   CA  C    sing N N 420 
SER   CA  CB   sing N N 421 
SER   CA  HA   sing N N 422 
SER   C   O    doub N N 423 
SER   C   OXT  sing N N 424 
SER   CB  OG   sing N N 425 
SER   CB  HB2  sing N N 426 
SER   CB  HB3  sing N N 427 
SER   OG  HG   sing N N 428 
SER   OXT HXT  sing N N 429 
THR   N   CA   sing N N 430 
THR   N   H    sing N N 431 
THR   N   H2   sing N N 432 
THR   CA  C    sing N N 433 
THR   CA  CB   sing N N 434 
THR   CA  HA   sing N N 435 
THR   C   O    doub N N 436 
THR   C   OXT  sing N N 437 
THR   CB  OG1  sing N N 438 
THR   CB  CG2  sing N N 439 
THR   CB  HB   sing N N 440 
THR   OG1 HG1  sing N N 441 
THR   CG2 HG21 sing N N 442 
THR   CG2 HG22 sing N N 443 
THR   CG2 HG23 sing N N 444 
THR   OXT HXT  sing N N 445 
TRP   N   CA   sing N N 446 
TRP   N   H    sing N N 447 
TRP   N   H2   sing N N 448 
TRP   CA  C    sing N N 449 
TRP   CA  CB   sing N N 450 
TRP   CA  HA   sing N N 451 
TRP   C   O    doub N N 452 
TRP   C   OXT  sing N N 453 
TRP   CB  CG   sing N N 454 
TRP   CB  HB2  sing N N 455 
TRP   CB  HB3  sing N N 456 
TRP   CG  CD1  doub Y N 457 
TRP   CG  CD2  sing Y N 458 
TRP   CD1 NE1  sing Y N 459 
TRP   CD1 HD1  sing N N 460 
TRP   CD2 CE2  doub Y N 461 
TRP   CD2 CE3  sing Y N 462 
TRP   NE1 CE2  sing Y N 463 
TRP   NE1 HE1  sing N N 464 
TRP   CE2 CZ2  sing Y N 465 
TRP   CE3 CZ3  doub Y N 466 
TRP   CE3 HE3  sing N N 467 
TRP   CZ2 CH2  doub Y N 468 
TRP   CZ2 HZ2  sing N N 469 
TRP   CZ3 CH2  sing Y N 470 
TRP   CZ3 HZ3  sing N N 471 
TRP   CH2 HH2  sing N N 472 
TRP   OXT HXT  sing N N 473 
TYR   N   CA   sing N N 474 
TYR   N   H    sing N N 475 
TYR   N   H2   sing N N 476 
TYR   CA  C    sing N N 477 
TYR   CA  CB   sing N N 478 
TYR   CA  HA   sing N N 479 
TYR   C   O    doub N N 480 
TYR   C   OXT  sing N N 481 
TYR   CB  CG   sing N N 482 
TYR   CB  HB2  sing N N 483 
TYR   CB  HB3  sing N N 484 
TYR   CG  CD1  doub Y N 485 
TYR   CG  CD2  sing Y N 486 
TYR   CD1 CE1  sing Y N 487 
TYR   CD1 HD1  sing N N 488 
TYR   CD2 CE2  doub Y N 489 
TYR   CD2 HD2  sing N N 490 
TYR   CE1 CZ   doub Y N 491 
TYR   CE1 HE1  sing N N 492 
TYR   CE2 CZ   sing Y N 493 
TYR   CE2 HE2  sing N N 494 
TYR   CZ  OH   sing N N 495 
TYR   OH  HH   sing N N 496 
TYR   OXT HXT  sing N N 497 
VAL   N   CA   sing N N 498 
VAL   N   H    sing N N 499 
VAL   N   H2   sing N N 500 
VAL   CA  C    sing N N 501 
VAL   CA  CB   sing N N 502 
VAL   CA  HA   sing N N 503 
VAL   C   O    doub N N 504 
VAL   C   OXT  sing N N 505 
VAL   CB  CG1  sing N N 506 
VAL   CB  CG2  sing N N 507 
VAL   CB  HB   sing N N 508 
VAL   CG1 HG11 sing N N 509 
VAL   CG1 HG12 sing N N 510 
VAL   CG1 HG13 sing N N 511 
VAL   CG2 HG21 sing N N 512 
VAL   CG2 HG22 sing N N 513 
VAL   CG2 HG23 sing N N 514 
VAL   OXT HXT  sing N N 515 
# 
_pdbx_audit_support.funding_organization   'Oncode Institute' 
_pdbx_audit_support.country                Netherlands 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
loop_
_pdbx_entity_branch_list.entity_id 
_pdbx_entity_branch_list.comp_id 
_pdbx_entity_branch_list.num 
_pdbx_entity_branch_list.hetero 
2 NAG 1 n 
2 NAG 2 n 
2 BMA 3 n 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   2XR9 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9FXY 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.018656 
_atom_sites.fract_transf_matrix[1][2]   0.001179 
_atom_sites.fract_transf_matrix[1][3]   0.002575 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.015934 
_atom_sites.fract_transf_matrix[2][3]   0.004658 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   0.016235 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.pdbx_scat_Z 
_atom_type.pdbx_N_electrons 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
C  6  6  2.3103  20.8439 1.0201  10.2075 1.5888 0.5687  0.8651 51.6512  0.2156   
CA 20 20 8.6266  10.4421 7.3873  0.6599  1.5899 85.7484 1.0211 178.4370 1.6645   
F  9  9  3.5395  10.2825 2.6414  4.2944  1.5171 0.2615  1.0244 26.1476  0.3033   
H  1  1  0.4930  10.5109 0.3229  26.1257 0.1402 3.1424  0.0408 57.7997  0.0030   
I  53 53 20.1470 4.3470  18.9947 0.3814  7.5137 27.7660 2.2735 66.8776  3.7332   
N  7  7  12.2220 0.0057  3.1346  9.8933  2.0141 28.9975 1.1672 0.5826   -11.5379 
O  8  8  3.0487  13.2771 2.2870  5.7011  1.5464 0.3239  0.8671 32.9089  0.2508   
P  15 15 6.4348  1.9067  4.1793  27.1570 1.7801 0.5260  1.4909 68.1645  1.2642   
S  16 16 6.9054  1.4679  5.2035  22.2151 1.4379 0.2536  1.5863 56.1720  1.0454   
ZN 30 30 14.0812 3.2655  7.0352  0.2333  5.1677 10.3163 2.4112 58.7097  1.0421   
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
_atom_site.calc_flag 
_atom_site.pdbx_tls_group_id 
ATOM   1     N  N    . GLY   A  1  1   ? 39.719  8.460   24.350  1.000 60.851  0 56   GLY   A N    1 ? 1 
ATOM   2     C  CA   . GLY   A  1  1   ? 39.142  7.198   24.806  1.000 52.686  0 56   GLY   A CA   1 ? 1 
ATOM   3     C  C    . GLY   A  1  1   ? 37.956  7.340   25.761  1.000 52.270  0 56   GLY   A C    1 ? 1 
ATOM   4     O  O    . GLY   A  1  1   ? 37.612  6.400   26.478  1.000 53.785  0 56   GLY   A O    1 ? 1 
ATOM   5     H  H1   . GLY   A  1  1   ? 40.546  8.314   23.996  1.000 58.819  0 56   GLY   A H1   1 c 1 
ATOM   6     H  H2   . GLY   A  1  1   ? 39.802  9.043   25.046  1.000 58.512  0 56   GLY   A H2   1 c 1 
ATOM   7     H  H3   . GLY   A  1  1   ? 39.192  8.834   23.707  1.000 57.615  0 56   GLY   A H3   1 c 1 
ATOM   8     H  HA2  . GLY   A  1  1   ? 38.858  6.681   24.015  1.000 53.987  0 56   GLY   A HA2  1 c 1 
ATOM   9     H  HA3  . GLY   A  1  1   ? 39.852  6.675   25.257  1.000 55.160  0 56   GLY   A HA3  1 c 1 
ATOM   10    N  N    . SER   A  1  2   ? 37.335  8.521   25.768  1.000 54.347  0 57   SER   A N    1 ? 1 
ATOM   11    C  CA   . SER   A  1  2   ? 36.346  8.849   26.777  1.000 57.366  0 57   SER   A CA   1 ? 1 
ATOM   12    C  C    . SER   A  1  2   ? 35.045  9.313   26.137  1.000 53.570  0 57   SER   A C    1 ? 1 
ATOM   13    O  O    . SER   A  1  2   ? 35.059  9.988   25.115  1.000 49.385  0 57   SER   A O    1 ? 1 
ATOM   14    C  CB   . SER   A  1  2   ? 36.857  9.950   27.689  1.000 56.357  0 57   SER   A CB   1 ? 1 
ATOM   15    O  OG   . SER   A  1  2   ? 35.848  10.343  28.606  1.000 60.625  0 57   SER   A OG   1 ? 1 
ATOM   16    H  H    . SER   A  1  2   ? 37.518  9.135   25.117  1.000 54.479  0 57   SER   A H    1 c 1 
ATOM   17    H  HA   . SER   A  1  2   ? 36.162  8.038   27.323  1.000 55.807  0 57   SER   A HA   1 c 1 
ATOM   18    H  HB2  . SER   A  1  2   ? 37.644  9.628   28.183  1.000 58.585  0 57   SER   A HB2  1 c 1 
ATOM   19    H  HB3  . SER   A  1  2   ? 37.130  10.725  27.147  1.000 57.908  0 57   SER   A HB3  1 c 1 
ATOM   20    H  HG   . SER   A  1  2   ? 35.904  9.865   29.304  0.000 37.080  0 57   SER   A HG   1 c 1 
ATOM   21    N  N    . CYS   A  1  3   ? 33.931  8.969   26.777  1.000 51.560  0 58   CYS   A N    1 ? 1 
ATOM   22    C  CA   . CYS   A  1  3   ? 32.636  9.467   26.363  1.000 58.526  0 58   CYS   A CA   1 ? 1 
ATOM   23    C  C    . CYS   A  1  3   ? 32.271  10.742  27.109  1.000 53.903  0 58   CYS   A C    1 ? 1 
ATOM   24    O  O    . CYS   A  1  3   ? 31.247  11.354  26.805  1.000 52.850  0 58   CYS   A O    1 ? 1 
ATOM   25    C  CB   . CYS   A  1  3   ? 31.567  8.389   26.531  1.000 67.913  0 58   CYS   A CB   1 ? 1 
ATOM   26    S  SG   . CYS   A  1  3   ? 31.618  7.101   25.252  1.000 42.822  0 58   CYS   A SG   1 ? 1 
ATOM   27    H  H    . CYS   A  1  3   ? 33.977  8.405   27.494  1.000 54.001  0 58   CYS   A H    1 c 1 
ATOM   28    H  HA   . CYS   A  1  3   ? 32.694  9.687   25.408  1.000 56.962  0 58   CYS   A HA   1 c 1 
ATOM   29    H  HB2  . CYS   A  1  3   ? 31.678  7.962   27.405  1.000 59.686  0 58   CYS   A HB2  1 c 1 
ATOM   30    H  HB3  . CYS   A  1  3   ? 30.683  8.808   26.512  1.000 58.684  0 58   CYS   A HB3  1 c 1 
ATOM   31    N  N    . LYS   A  1  4   ? 33.121  11.152  28.060  1.000 51.903  0 59   LYS   A N    1 ? 1 
ATOM   32    C  CA   . LYS   A  1  4   ? 32.885  12.385  28.784  1.000 42.867  0 59   LYS   A CA   1 ? 1 
ATOM   33    C  C    . LYS   A  1  4   ? 32.777  13.512  27.767  1.000 46.769  0 59   LYS   A C    1 ? 1 
ATOM   34    O  O    . LYS   A  1  4   ? 33.681  13.723  26.964  1.000 70.280  0 59   LYS   A O    1 ? 1 
ATOM   35    C  CB   . LYS   A  1  4   ? 33.966  12.628  29.819  1.000 50.972  0 59   LYS   A CB   1 ? 1 
ATOM   36    C  CG   . LYS   A  1  4   ? 33.573  13.641  30.898  1.000 74.998  0 59   LYS   A CG   1 ? 1 
ATOM   37    C  CD   . LYS   A  1  4   ? 34.171  13.268  32.291  1.000 89.916  0 59   LYS   A CD   1 ? 1 
ATOM   38    C  CE   . LYS   A  1  4   ? 33.637  14.106  33.422  1.000 89.366  0 59   LYS   A CE   1 ? 1 
ATOM   39    N  NZ   . LYS   A  1  4   ? 34.135  15.503  33.339  1.000 109.024 0 59   LYS   A NZ   1 ? 1 
ATOM   40    H  H    . LYS   A  1  4   ? 33.856  10.651  28.266  1.000 50.752  0 59   LYS   A H    1 c 1 
ATOM   41    H  HA   . LYS   A  1  4   ? 32.022  12.302  29.249  1.000 46.378  0 59   LYS   A HA   1 c 1 
ATOM   42    H  HB2  . LYS   A  1  4   ? 34.183  11.775  30.250  1.000 53.751  0 59   LYS   A HB2  1 c 1 
ATOM   43    H  HB3  . LYS   A  1  4   ? 34.771  12.949  29.363  1.000 53.705  0 59   LYS   A HB3  1 c 1 
ATOM   44    H  HG2  . LYS   A  1  4   ? 33.894  14.530  30.635  1.000 70.872  0 59   LYS   A HG2  1 c 1 
ATOM   45    H  HG3  . LYS   A  1  4   ? 32.595  13.678  30.966  1.000 69.523  0 59   LYS   A HG3  1 c 1 
ATOM   46    H  HD2  . LYS   A  1  4   ? 33.975  12.326  32.479  1.000 85.851  0 59   LYS   A HD2  1 c 1 
ATOM   47    H  HD3  . LYS   A  1  4   ? 35.146  13.370  32.256  1.000 87.044  0 59   LYS   A HD3  1 c 1 
ATOM   48    H  HE2  . LYS   A  1  4   ? 32.662  14.113  33.392  1.000 92.958  0 59   LYS   A HE2  1 c 1 
ATOM   49    H  HE3  . LYS   A  1  4   ? 33.913  13.719  34.275  1.000 94.142  0 59   LYS   A HE3  1 c 1 
ATOM   50    H  HZ1  . LYS   A  1  4   ? 33.807  15.904  32.594  1.000 101.674 0 59   LYS   A HZ1  1 c 1 
ATOM   51    H  HZ2  . LYS   A  1  4   ? 35.041  15.506  33.304  1.000 102.994 0 59   LYS   A HZ2  1 c 1 
ATOM   52    H  HZ3  . LYS   A  1  4   ? 33.865  15.970  34.069  1.000 102.720 0 59   LYS   A HZ3  1 c 1 
ATOM   53    N  N    . GLY   A  1  5   ? 31.610  14.168  27.770  1.000 60.555  0 60   GLY   A N    1 ? 1 
ATOM   54    C  CA   . GLY   A  1  5   ? 31.302  15.252  26.860  1.000 42.132  0 60   GLY   A CA   1 ? 1 
ATOM   55    C  C    . GLY   A  1  5   ? 30.639  14.801  25.569  1.000 40.534  0 60   GLY   A C    1 ? 1 
ATOM   56    O  O    . GLY   A  1  5   ? 30.296  15.640  24.748  1.000 53.036  0 60   GLY   A O    1 ? 1 
ATOM   57    H  H    . GLY   A  1  5   ? 30.972  13.923  28.376  1.000 51.538  0 60   GLY   A H    1 c 1 
ATOM   58    H  HA2  . GLY   A  1  5   ? 30.703  15.891  27.323  1.000 45.391  0 60   GLY   A HA2  1 c 1 
ATOM   59    H  HA3  . GLY   A  1  5   ? 32.139  15.734  26.642  1.000 46.104  0 60   GLY   A HA3  1 c 1 
ATOM   60    N  N    . ARG   A  1  6   ? 30.454  13.487  25.381  1.000 50.358  0 61   ARG   A N    1 ? 1 
ATOM   61    C  CA   . ARG   A  1  6   ? 30.095  12.957  24.072  1.000 33.052  0 61   ARG   A CA   1 ? 1 
ATOM   62    C  C    . ARG   A  1  6   ? 28.922  11.985  24.008  1.000 34.696  0 61   ARG   A C    1 ? 1 
ATOM   63    O  O    . ARG   A  1  6   ? 28.646  11.421  22.943  1.000 37.809  0 61   ARG   A O    1 ? 1 
ATOM   64    C  CB   . ARG   A  1  6   ? 31.300  12.198  23.484  1.000 43.523  0 61   ARG   A CB   1 ? 1 
ATOM   65    C  CG   . ARG   A  1  6   ? 32.508  13.064  23.101  1.000 50.770  0 61   ARG   A CG   1 ? 1 
ATOM   66    C  CD   . ARG   A  1  6   ? 33.731  12.196  22.799  1.000 44.290  0 61   ARG   A CD   1 ? 1 
ATOM   67    N  NE   . ARG   A  1  6   ? 33.494  11.195  21.761  1.000 44.262  0 61   ARG   A NE   1 ? 1 
ATOM   68    C  CZ   . ARG   A  1  6   ? 34.175  10.057  21.643  1.000 46.520  0 61   ARG   A CZ   1 ? 1 
ATOM   69    N  NH1  . ARG   A  1  6   ? 35.126  9.731   22.494  1.000 42.715  0 61   ARG   A NH1  1 ? 1 
ATOM   70    N  NH2  . ARG   A  1  6   ? 33.875  9.207   20.667  1.000 37.149  0 61   ARG   A NH2  1 ? 1 
ATOM   71    H  H    . ARG   A  1  6   ? 30.553  12.908  26.080  1.000 43.305  0 61   ARG   A H    1 c 1 
ATOM   72    H  HA   . ARG   A  1  6   ? 29.892  13.716  23.480  1.000 37.595  0 61   ARG   A HA   1 c 1 
ATOM   73    H  HB2  . ARG   A  1  6   ? 31.592  11.531  24.140  1.000 42.265  0 61   ARG   A HB2  1 c 1 
ATOM   74    H  HB3  . ARG   A  1  6   ? 31.003  11.716  22.685  1.000 41.404  0 61   ARG   A HB3  1 c 1 
ATOM   75    H  HG2  . ARG   A  1  6   ? 32.289  13.601  22.310  1.000 47.220  0 61   ARG   A HG2  1 c 1 
ATOM   76    H  HG3  . ARG   A  1  6   ? 32.720  13.675  23.838  1.000 47.951  0 61   ARG   A HG3  1 c 1 
ATOM   77    H  HD2  . ARG   A  1  6   ? 34.471  12.776  22.518  1.000 46.400  0 61   ARG   A HD2  1 c 1 
ATOM   78    H  HD3  . ARG   A  1  6   ? 34.007  11.743  23.623  1.000 46.226  0 61   ARG   A HD3  1 c 1 
ATOM   79    H  HE   . ARG   A  1  6   ? 32.867  11.354  21.178  1.000 44.055  0 61   ARG   A HE   1 c 1 
ATOM   80    H  HH11 . ARG   A  1  6   ? 35.717  10.337  22.749  1.000 44.646  0 61   ARG   A HH11 1 c 1 
ATOM   81    H  HH12 . ARG   A  1  6   ? 35.173  8.905   22.803  1.000 44.054  0 61   ARG   A HH12 1 c 1 
ATOM   82    H  HH21 . ARG   A  1  6   ? 34.276  8.425   20.629  1.000 39.814  0 61   ARG   A HH21 1 c 1 
ATOM   83    H  HH22 . ARG   A  1  6   ? 33.278  9.427   20.061  1.000 39.169  0 61   ARG   A HH22 1 c 1 
ATOM   84    N  N    . CYS   A  1  7   ? 28.240  11.749  25.130  1.000 37.968  0 62   CYS   A N    1 ? 1 
ATOM   85    C  CA   . CYS   A  1  7   ? 27.163  10.766  25.129  1.000 33.887  0 62   CYS   A CA   1 ? 1 
ATOM   86    C  C    . CYS   A  1  7   ? 26.130  11.027  24.040  1.000 29.086  0 62   CYS   A C    1 ? 1 
ATOM   87    O  O    . CYS   A  1  7   ? 25.586  12.108  23.955  1.000 34.328  0 62   CYS   A O    1 ? 1 
ATOM   88    C  CB   . CYS   A  1  7   ? 26.494  10.681  26.480  1.000 37.404  0 62   CYS   A CB   1 ? 1 
ATOM   89    S  SG   . CYS   A  1  7   ? 27.580  10.017  27.759  1.000 31.952  0 62   CYS   A SG   1 ? 1 
ATOM   90    H  H    . CYS   A  1  7   ? 28.434  12.202  25.900  1.000 36.881  0 62   CYS   A H    1 c 1 
ATOM   91    H  HA   . CYS   A  1  7   ? 27.575  9.891   24.948  1.000 34.249  0 62   CYS   A HA   1 c 1 
ATOM   92    H  HB2  . CYS   A  1  7   ? 26.200  11.574  26.752  1.000 35.220  0 62   CYS   A HB2  1 c 1 
ATOM   93    H  HB3  . CYS   A  1  7   ? 25.702  10.108  26.414  1.000 34.628  0 62   CYS   A HB3  1 c 1 
ATOM   94    N  N    . PHE   A  1  8   ? 25.865  10.001  23.236  1.000 28.220  0 63   PHE   A N    1 ? 1 
ATOM   95    C  CA   . PHE   A  1  8   ? 24.879  10.077  22.177  1.000 29.054  0 63   PHE   A CA   1 ? 1 
ATOM   96    C  C    . PHE   A  1  8   ? 25.276  11.186  21.209  1.000 29.688  0 63   PHE   A C    1 ? 1 
ATOM   97    O  O    . PHE   A  1  8   ? 24.410  11.854  20.652  1.000 36.894  0 63   PHE   A O    1 ? 1 
ATOM   98    C  CB   . PHE   A  1  8   ? 23.470  10.255  22.782  1.000 26.522  0 63   PHE   A CB   1 ? 1 
ATOM   99    C  CG   . PHE   A  1  8   ? 23.163  9.153   23.763  1.000 28.101  0 63   PHE   A CG   1 ? 1 
ATOM   100   C  CD1  . PHE   A  1  8   ? 22.882  7.870   23.324  1.000 29.987  0 63   PHE   A CD1  1 ? 1 
ATOM   101   C  CD2  . PHE   A  1  8   ? 23.244  9.375   25.121  1.000 31.890  0 63   PHE   A CD2  1 ? 1 
ATOM   102   C  CE1  . PHE   A  1  8   ? 22.638  6.845   24.235  1.000 31.973  0 63   PHE   A CE1  1 ? 1 
ATOM   103   C  CE2  . PHE   A  1  8   ? 23.010  8.346   26.029  1.000 32.564  0 63   PHE   A CE2  1 ? 1 
ATOM   104   C  CZ   . PHE   A  1  8   ? 22.697  7.094   25.581  1.000 32.240  0 63   PHE   A CZ   1 ? 1 
ATOM   105   H  H    . PHE   A  1  8   ? 26.319  9.216   23.351  1.000 28.917  0 63   PHE   A H    1 c 1 
ATOM   106   H  HA   . PHE   A  1  8   ? 24.895  9.220   21.680  1.000 28.198  0 63   PHE   A HA   1 c 1 
ATOM   107   H  HB2  . PHE   A  1  8   ? 23.416  11.123  23.234  1.000 27.598  0 63   PHE   A HB2  1 c 1 
ATOM   108   H  HB3  . PHE   A  1  8   ? 22.808  10.242  22.060  1.000 26.791  0 63   PHE   A HB3  1 c 1 
ATOM   109   H  HD1  . PHE   A  1  8   ? 22.836  7.694   22.399  1.000 29.506  0 63   PHE   A HD1  1 c 1 
ATOM   110   H  HD2  . PHE   A  1  8   ? 23.456  10.238  25.439  1.000 31.453  0 63   PHE   A HD2  1 c 1 
ATOM   111   H  HE1  . PHE   A  1  8   ? 22.427  5.981   23.925  1.000 31.147  0 63   PHE   A HE1  1 c 1 
ATOM   112   H  HE2  . PHE   A  1  8   ? 23.045  8.520   26.955  1.000 32.930  0 63   PHE   A HE2  1 c 1 
ATOM   113   H  HZ   . PHE   A  1  8   ? 22.532  6.399   26.198  1.000 32.405  0 63   PHE   A HZ   1 c 1 
ATOM   114   N  N    . GLU   A  1  9   ? 26.593  11.363  21.024  1.000 33.051  0 64   GLU   A N    1 ? 1 
ATOM   115   C  CA   . GLU   A  1  9   ? 27.132  12.295  20.050  1.000 43.183  0 64   GLU   A CA   1 ? 1 
ATOM   116   C  C    . GLU   A  1  9   ? 26.517  12.001  18.686  1.000 39.656  0 64   GLU   A C    1 ? 1 
ATOM   117   O  O    . GLU   A  1  9   ? 26.359  10.843  18.312  1.000 35.005  0 64   GLU   A O    1 ? 1 
ATOM   118   C  CB   . GLU   A  1  9   ? 28.653  12.177  19.930  1.000 41.945  0 64   GLU   A CB   1 ? 1 
ATOM   119   C  CG   . GLU   A  1  9   ? 29.125  10.771  19.557  1.000 58.622  0 64   GLU   A CG   1 ? 1 
ATOM   120   C  CD   . GLU   A  1  9   ? 30.617  10.540  19.716  1.000 72.112  0 64   GLU   A CD   1 ? 1 
ATOM   121   O  OE1  . GLU   A  1  9   ? 31.333  11.530  19.988  1.000 49.990  0 64   GLU   A OE1  1 ? 1 
ATOM   122   O  OE2  . GLU   A  1  9   ? 31.067  9.375   19.591  1.000 53.097  0 64   GLU   A OE2  1 ? 1 
ATOM   123   H  H    . GLU   A  1  9   ? 27.179  10.877  21.528  1.000 34.756  0 64   GLU   A H    1 c 1 
ATOM   124   H  HA   . GLU   A  1  9   ? 26.896  13.210  20.324  1.000 40.200  0 64   GLU   A HA   1 c 1 
ATOM   125   H  HB2  . GLU   A  1  9   ? 28.962  12.808  19.246  1.000 45.693  0 64   GLU   A HB2  1 c 1 
ATOM   126   H  HB3  . GLU   A  1  9   ? 29.057  12.436  20.783  1.000 46.047  0 64   GLU   A HB3  1 c 1 
ATOM   127   H  HG2  . GLU   A  1  9   ? 28.652  10.116  20.111  1.000 55.664  0 64   GLU   A HG2  1 c 1 
ATOM   128   H  HG3  . GLU   A  1  9   ? 28.887  10.593  18.623  1.000 55.650  0 64   GLU   A HG3  1 c 1 
ATOM   129   N  N    . LEU   A  1  10  ? 26.201  13.074  17.957  1.000 41.521  0 65   LEU   A N    1 ? 1 
ATOM   130   C  CA   . LEU   A  1  10  ? 25.524  12.987  16.677  1.000 40.286  0 65   LEU   A CA   1 ? 1 
ATOM   131   C  C    . LEU   A  1  10  ? 26.512  12.674  15.555  1.000 52.098  0 65   LEU   A C    1 ? 1 
ATOM   132   O  O    . LEU   A  1  10  ? 26.246  11.819  14.716  1.000 85.874  0 65   LEU   A O    1 ? 1 
ATOM   133   C  CB   . LEU   A  1  10  ? 24.772  14.307  16.437  1.000 35.539  0 65   LEU   A CB   1 ? 1 
ATOM   134   C  CG   . LEU   A  1  10  ? 23.457  14.433  17.229  1.000 36.534  0 65   LEU   A CG   1 ? 1 
ATOM   135   C  CD1  . LEU   A  1  10  ? 22.802  15.758  17.008  1.000 38.872  0 65   LEU   A CD1  1 ? 1 
ATOM   136   C  CD2  . LEU   A  1  10  ? 22.466  13.257  16.883  1.000 33.829  0 65   LEU   A CD2  1 ? 1 
ATOM   137   H  H    . LEU   A  1  10  ? 26.425  13.902  18.274  1.000 41.173  0 65   LEU   A H    1 c 1 
ATOM   138   H  HA   . LEU   A  1  10  ? 24.874  12.250  16.726  1.000 40.718  0 65   LEU   A HA   1 c 1 
ATOM   139   H  HB2  . LEU   A  1  10  ? 25.358  15.051  16.679  1.000 37.384  0 65   LEU   A HB2  1 c 1 
ATOM   140   H  HB3  . LEU   A  1  10  ? 24.571  14.383  15.483  1.000 36.649  0 65   LEU   A HB3  1 c 1 
ATOM   141   H  HG   . LEU   A  1  10  ? 23.678  14.365  18.191  1.000 36.636  0 65   LEU   A HG   1 c 1 
ATOM   142   H  HD11 . LEU   A  1  10  ? 22.074  15.871  17.643  1.000 37.939  0 65   LEU   A HD11 1 c 1 
ATOM   143   H  HD12 . LEU   A  1  10  ? 22.451  15.798  16.102  1.000 37.707  0 65   LEU   A HD12 1 c 1 
ATOM   144   H  HD13 . LEU   A  1  10  ? 23.455  16.468  17.134  1.000 38.614  0 65   LEU   A HD13 1 c 1 
ATOM   145   H  HD21 . LEU   A  1  10  ? 22.756  12.443  17.330  1.000 34.481  0 65   LEU   A HD21 1 c 1 
ATOM   146   H  HD22 . LEU   A  1  10  ? 22.457  13.112  15.920  1.000 34.132  0 65   LEU   A HD22 1 c 1 
ATOM   147   H  HD23 . LEU   A  1  10  ? 21.570  13.488  17.184  1.000 33.993  0 65   LEU   A HD23 1 c 1 
ATOM   148   N  N    . GLN   A  1  11  ? 27.666  13.341  15.574  1.000 63.360  0 66   GLN   A N    1 ? 1 
ATOM   149   C  CA   . GLN   A  1  11  ? 28.765  12.982  14.693  1.000 81.800  0 66   GLN   A CA   1 ? 1 
ATOM   150   C  C    . GLN   A  1  11  ? 29.534  11.803  15.285  1.000 65.003  0 66   GLN   A C    1 ? 1 
ATOM   151   O  O    . GLN   A  1  11  ? 30.373  11.974  16.167  1.000 61.952  0 66   GLN   A O    1 ? 1 
ATOM   152   C  CB   . GLN   A  1  11  ? 29.678  14.184  14.430  1.000 81.443  0 66   GLN   A CB   1 ? 1 
ATOM   153   C  CG   . GLN   A  1  11  ? 28.983  15.228  13.562  1.000 92.430  0 66   GLN   A CG   1 ? 1 
ATOM   154   C  CD   . GLN   A  1  11  ? 29.914  16.268  13.002  1.000 115.133 0 66   GLN   A CD   1 ? 1 
ATOM   155   O  OE1  . GLN   A  1  11  ? 31.132  16.233  13.212  1.000 105.037 0 66   GLN   A OE1  1 ? 1 
ATOM   156   N  NE2  . GLN   A  1  11  ? 29.348  17.221  12.264  1.000 121.373 0 66   GLN   A NE2  1 ? 1 
ATOM   157   H  H    . GLN   A  1  11  ? 27.772  14.044  16.148  1.000 64.133  0 66   GLN   A H    1 c 1 
ATOM   158   H  HA   . GLN   A  1  11  ? 28.382  12.698  13.832  1.000 73.746  0 66   GLN   A HA   1 c 1 
ATOM   159   H  HB2  . GLN   A  1  11  ? 29.933  14.586  15.287  1.000 84.338  0 66   GLN   A HB2  1 c 1 
ATOM   160   H  HB3  . GLN   A  1  11  ? 30.492  13.873  13.982  1.000 84.455  0 66   GLN   A HB3  1 c 1 
ATOM   161   H  HG2  . GLN   A  1  11  ? 28.533  14.775  12.818  1.000 93.500  0 66   GLN   A HG2  1 c 1 
ATOM   162   H  HG3  . GLN   A  1  11  ? 28.294  15.677  14.096  1.000 93.679  0 66   GLN   A HG3  1 c 1 
ATOM   163   H  HE21 . GLN   A  1  11  ? 28.469  17.244  12.169  1.000 118.560 0 66   GLN   A HE21 1 c 1 
ATOM   164   H  HE22 . GLN   A  1  11  ? 29.850  17.832  11.870  1.000 119.614 0 66   GLN   A HE22 1 c 1 
ATOM   165   N  N    . GLU   A  1  12  ? 29.185  10.604  14.802  1.000 61.632  0 67   GLU   A N    1 ? 1 
ATOM   166   C  CA   . GLU   A  1  12  ? 29.858  9.367   15.157  1.000 57.898  0 67   GLU   A CA   1 ? 1 
ATOM   167   C  C    . GLU   A  1  12  ? 31.313  9.393   14.697  1.000 89.608  0 67   GLU   A C    1 ? 1 
ATOM   168   O  O    . GLU   A  1  12  ? 31.603  9.836   13.589  1.000 98.664  0 67   GLU   A O    1 ? 1 
ATOM   169   C  CB   . GLU   A  1  12  ? 29.132  8.204   14.482  1.000 86.245  0 67   GLU   A CB   1 ? 1 
ATOM   170   C  CG   . GLU   A  1  12  ? 29.716  6.834   14.753  1.000 96.729  0 67   GLU   A CG   1 ? 1 
ATOM   171   C  CD   . GLU   A  1  12  ? 29.452  5.815   13.661  1.000 92.171  0 67   GLU   A CD   1 ? 1 
ATOM   172   O  OE1  . GLU   A  1  12  ? 28.272  5.593   13.301  1.000 71.055  0 67   GLU   A OE1  1 ? 1 
ATOM   173   O  OE2  . GLU   A  1  12  ? 30.443  5.222   13.176  1.000 97.501  0 67   GLU   A OE2  1 ? 1 
ATOM   174   H  H    . GLU   A  1  12  ? 28.482  10.558  14.219  1.000 61.297  0 67   GLU   A H    1 c 1 
ATOM   175   H  HA   . GLU   A  1  12  ? 29.824  9.255   16.134  1.000 68.401  0 67   GLU   A HA   1 c 1 
ATOM   176   H  HB2  . GLU   A  1  12  ? 28.198  8.211   14.780  1.000 79.532  0 67   GLU   A HB2  1 c 1 
ATOM   177   H  HB3  . GLU   A  1  12  ? 29.135  8.360   13.515  1.000 79.856  0 67   GLU   A HB3  1 c 1 
ATOM   178   H  HG2  . GLU   A  1  12  ? 30.684  6.913   14.873  1.000 93.794  0 67   GLU   A HG2  1 c 1 
ATOM   179   H  HG3  . GLU   A  1  12  ? 29.343  6.490   15.592  1.000 92.381  0 67   GLU   A HG3  1 c 1 
ATOM   180   N  N    . VAL   A  1  13  ? 32.215  8.905   15.554  1.000 101.890 0 68   VAL   A N    1 ? 1 
ATOM   181   C  CA   . VAL   A  1  13  ? 33.628  8.813   15.229  1.000 79.467  0 68   VAL   A CA   1 ? 1 
ATOM   182   C  C    . VAL   A  1  13  ? 33.899  7.526   14.451  1.000 88.029  0 68   VAL   A C    1 ? 1 
ATOM   183   O  O    . VAL   A  1  13  ? 33.334  6.474   14.752  1.000 83.747  0 68   VAL   A O    1 ? 1 
ATOM   184   C  CB   . VAL   A  1  13  ? 34.497  8.905   16.510  1.000 80.025  0 68   VAL   A CB   1 ? 1 
ATOM   185   C  CG1  . VAL   A  1  13  ? 35.986  8.866   16.179  1.000 119.796 0 68   VAL   A CG1  1 ? 1 
ATOM   186   C  CG2  . VAL   A  1  13  ? 34.159  10.157  17.303  1.000 76.098  0 68   VAL   A CG2  1 ? 1 
ATOM   187   H  H    . VAL   A  1  13  ? 31.936  8.612   16.374  1.000 92.224  0 68   VAL   A H    1 c 1 
ATOM   188   H  HA   . VAL   A  1  13  ? 33.856  9.568   14.657  1.000 85.407  0 68   VAL   A HA   1 c 1 
ATOM   189   H  HB   . VAL   A  1  13  ? 34.287  8.119   17.074  1.000 85.117  0 68   VAL   A HB   1 c 1 
ATOM   190   H  HG11 . VAL   A  1  13  ? 36.180  9.513   15.478  1.000 106.107 0 68   VAL   A HG11 1 c 1 
ATOM   191   H  HG12 . VAL   A  1  13  ? 36.229  7.976   15.874  1.000 105.642 0 68   VAL   A HG12 1 c 1 
ATOM   192   H  HG13 . VAL   A  1  13  ? 36.501  9.088   16.974  1.000 106.215 0 68   VAL   A HG13 1 c 1 
ATOM   193   H  HG21 . VAL   A  1  13  ? 34.776  10.247  18.049  1.000 78.065  0 68   VAL   A HG21 1 c 1 
ATOM   194   H  HG22 . VAL   A  1  13  ? 33.249  10.093  17.643  1.000 76.918  0 68   VAL   A HG22 1 c 1 
ATOM   195   H  HG23 . VAL   A  1  13  ? 34.234  10.937  16.725  1.000 77.373  0 68   VAL   A HG23 1 c 1 
ATOM   196   N  N    . GLY   A  1  14  ? 34.774  7.635   13.447  1.000 98.303  0 69   GLY   A N    1 ? 1 
ATOM   197   C  CA   . GLY   A  1  14  ? 35.161  6.505   12.624  1.000 95.789  0 69   GLY   A CA   1 ? 1 
ATOM   198   C  C    . GLY   A  1  14  ? 36.124  5.565   13.341  1.000 104.694 0 69   GLY   A C    1 ? 1 
ATOM   199   O  O    . GLY   A  1  14  ? 36.536  5.816   14.476  1.000 73.267  0 69   GLY   A O    1 ? 1 
ATOM   200   H  H    . GLY   A  1  14  ? 35.147  8.450   13.269  1.000 95.391  0 69   GLY   A H    1 c 1 
ATOM   201   H  HA2  . GLY   A  1  14  ? 34.347  6.005   12.363  1.000 97.269  0 69   GLY   A HA2  1 c 1 
ATOM   202   H  HA3  . GLY   A  1  14  ? 35.589  6.843   11.797  1.000 98.346  0 69   GLY   A HA3  1 c 1 
ATOM   203   N  N    . PRO   A  1  15  ? 36.502  4.442   12.694  1.000 102.880 0 70   PRO   A N    1 ? 1 
ATOM   204   C  CA   . PRO   A  1  15  ? 37.409  3.489   13.317  1.000 69.674  0 70   PRO   A CA   1 ? 1 
ATOM   205   C  C    . PRO   A  1  15  ? 38.858  3.918   13.160  1.000 84.420  0 70   PRO   A C    1 ? 1 
ATOM   206   O  O    . PRO   A  1  15  ? 39.262  4.489   12.141  1.000 64.547  0 70   PRO   A O    1 ? 1 
ATOM   207   C  CB   . PRO   A  1  15  ? 37.120  2.182   12.585  1.000 78.821  0 70   PRO   A CB   1 ? 1 
ATOM   208   C  CG   . PRO   A  1  15  ? 36.582  2.611   11.213  1.000 74.967  0 70   PRO   A CG   1 ? 1 
ATOM   209   C  CD   . PRO   A  1  15  ? 36.060  4.032   11.349  1.000 92.337  0 70   PRO   A CD   1 ? 1 
ATOM   210   H  HA   . PRO   A  1  15  ? 37.172  3.395   14.273  1.000 79.419  0 70   PRO   A HA   1 c 1 
ATOM   211   H  HB2  . PRO   A  1  15  ? 37.937  1.648   12.487  1.000 76.556  0 70   PRO   A HB2  1 c 1 
ATOM   212   H  HB3  . PRO   A  1  15  ? 36.453  1.651   13.070  1.000 75.386  0 70   PRO   A HB3  1 c 1 
ATOM   213   H  HG2  . PRO   A  1  15  ? 37.295  2.575   10.543  1.000 79.881  0 70   PRO   A HG2  1 c 1 
ATOM   214   H  HG3  . PRO   A  1  15  ? 35.862  2.012   10.929  1.000 78.780  0 70   PRO   A HG3  1 c 1 
ATOM   215   H  HD2  . PRO   A  1  15  ? 36.442  4.613   10.665  1.000 90.252  0 70   PRO   A HD2  1 c 1 
ATOM   216   H  HD3  . PRO   A  1  15  ? 35.088  4.055   11.278  1.000 89.304  0 70   PRO   A HD3  1 c 1 
ATOM   217   N  N    . PRO   A  1  16  ? 39.674  3.590   14.175  1.000 81.377  0 71   PRO   A N    1 ? 1 
ATOM   218   C  CA   . PRO   A  1  16  ? 39.196  2.785   15.292  1.000 81.940  0 71   PRO   A CA   1 ? 1 
ATOM   219   C  C    . PRO   A  1  16  ? 38.989  3.535   16.609  1.000 109.605 0 71   PRO   A C    1 ? 1 
ATOM   220   O  O    . PRO   A  1  16  ? 39.135  2.933   17.670  1.000 127.097 0 71   PRO   A O    1 ? 1 
ATOM   221   C  CB   . PRO   A  1  16  ? 40.334  1.780   15.407  1.000 86.666  0 71   PRO   A CB   1 ? 1 
ATOM   222   C  CG   . PRO   A  1  16  ? 41.622  2.643   15.033  1.000 96.795  0 71   PRO   A CG   1 ? 1 
ATOM   223   C  CD   . PRO   A  1  16  ? 41.111  3.868   14.275  1.000 69.630  0 71   PRO   A CD   1 ? 1 
ATOM   224   H  HA   . PRO   A  1  16  ? 38.370  2.304   15.040  1.000 85.862  0 71   PRO   A HA   1 c 1 
ATOM   225   H  HB2  . PRO   A  1  16  ? 40.404  1.419   16.316  1.000 88.201  0 71   PRO   A HB2  1 c 1 
ATOM   226   H  HB3  . PRO   A  1  16  ? 40.215  1.038   14.777  1.000 87.540  0 71   PRO   A HB3  1 c 1 
ATOM   227   H  HG2  . PRO   A  1  16  ? 42.100  2.917   15.842  1.000 88.269  0 71   PRO   A HG2  1 c 1 
ATOM   228   H  HG3  . PRO   A  1  16  ? 42.233  2.124   14.471  1.000 88.216  0 71   PRO   A HG3  1 c 1 
ATOM   229   H  HD2  . PRO   A  1  16  ? 41.278  4.689   14.772  1.000 77.745  0 71   PRO   A HD2  1 c 1 
ATOM   230   H  HD3  . PRO   A  1  16  ? 41.515  3.936   13.393  1.000 77.784  0 71   PRO   A HD3  1 c 1 
ATOM   231   N  N    . ASP   A  1  17  ? 38.645  4.829   16.575  1.000 105.025 0 72   ASP   A N    1 ? 1 
ATOM   232   C  CA   . ASP   A  1  17  ? 38.514  5.554   17.832  1.000 86.498  0 72   ASP   A CA   1 ? 1 
ATOM   233   C  C    . ASP   A  1  17  ? 37.173  5.162   18.437  1.000 78.483  0 72   ASP   A C    1 ? 1 
ATOM   234   O  O    . ASP   A  1  17  ? 36.195  4.982   17.717  1.000 85.602  0 72   ASP   A O    1 ? 1 
ATOM   235   C  CB   . ASP   A  1  17  ? 38.643  7.059   17.660  1.000 81.904  0 72   ASP   A CB   1 ? 1 
ATOM   236   C  CG   . ASP   A  1  17  ? 39.973  7.447   17.033  1.000 81.535  0 72   ASP   A CG   1 ? 1 
ATOM   237   O  OD1  . ASP   A  1  17  ? 40.301  6.897   15.970  1.000 80.107  0 72   ASP   A OD1  1 ? 1 
ATOM   238   O  OD2  . ASP   A  1  17  ? 40.688  8.313   17.612  1.000 57.279  0 72   ASP   A OD2  1 ? 1 
ATOM   239   H  H    . ASP   A  1  17  ? 38.486  5.257   15.783  1.000 100.822 0 72   ASP   A H    1 c 1 
ATOM   240   H  HA   . ASP   A  1  17  ? 39.232  5.254   18.438  1.000 88.108  0 72   ASP   A HA   1 c 1 
ATOM   241   H  HB2  . ASP   A  1  17  ? 37.924  7.378   17.085  1.000 82.386  0 72   ASP   A HB2  1 c 1 
ATOM   242   H  HB3  . ASP   A  1  17  ? 38.562  7.497   18.532  1.000 82.611  0 72   ASP   A HB3  1 c 1 
ATOM   243   N  N    . CYS   A  1  18  ? 37.152  4.982   19.760  1.000 63.245  0 73   CYS   A N    1 ? 1 
ATOM   244   C  CA   . CYS   A  1  18  ? 35.978  4.440   20.426  1.000 56.736  0 73   CYS   A CA   1 ? 1 
ATOM   245   C  C    . CYS   A  1  18  ? 34.783  5.380   20.252  1.000 62.311  0 73   CYS   A C    1 ? 1 
ATOM   246   O  O    . CYS   A  1  18  ? 34.943  6.570   19.975  1.000 54.980  0 73   CYS   A O    1 ? 1 
ATOM   247   C  CB   . CYS   A  1  18  ? 36.284  4.156   21.891  1.000 51.107  0 73   CYS   A CB   1 ? 1 
ATOM   248   S  SG   . CYS   A  1  18  ? 36.657  5.635   22.863  1.000 63.619  0 73   CYS   A SG   1 ? 1 
ATOM   249   H  H    . CYS   A  1  18  ? 37.883  5.206   20.261  1.000 65.924  0 73   CYS   A H    1 c 1 
ATOM   250   H  HA   . CYS   A  1  18  ? 35.760  3.583   19.991  1.000 57.546  0 73   CYS   A HA   1 c 1 
ATOM   251   H  HB2  . CYS   A  1  18  ? 35.516  3.706   22.294  1.000 53.874  0 73   CYS   A HB2  1 c 1 
ATOM   252   H  HB3  . CYS   A  1  18  ? 37.050  3.549   21.945  1.000 55.149  0 73   CYS   A HB3  1 c 1 
ATOM   253   N  N    . ARG   A  1  19  ? 33.573  4.831   20.379  1.000 57.745  0 74   ARG   A N    1 ? 1 
ATOM   254   C  CA   . ARG   A  1  19  ? 32.366  5.572   20.052  1.000 50.572  0 74   ARG   A CA   1 ? 1 
ATOM   255   C  C    . ARG   A  1  19  ? 31.489  5.792   21.280  1.000 43.442  0 74   ARG   A C    1 ? 1 
ATOM   256   O  O    . ARG   A  1  19  ? 31.625  5.089   22.273  1.000 40.078  0 74   ARG   A O    1 ? 1 
ATOM   257   C  CB   . ARG   A  1  19  ? 31.558  4.826   18.973  1.000 46.111  0 74   ARG   A CB   1 ? 1 
ATOM   258   C  CG   . ARG   A  1  19  ? 32.403  4.300   17.810  1.000 53.691  0 74   ARG   A CG   1 ? 1 
ATOM   259   C  CD   . ARG   A  1  19  ? 31.634  4.134   16.523  1.000 50.522  0 74   ARG   A CD   1 ? 1 
ATOM   260   N  NE   . ARG   A  1  19  ? 30.332  3.488   16.696  1.000 69.154  0 74   ARG   A NE   1 ? 1 
ATOM   261   C  CZ   . ARG   A  1  19  ? 29.590  2.973   15.718  1.000 65.057  0 74   ARG   A CZ   1 ? 1 
ATOM   262   N  NH1  . ARG   A  1  19  ? 30.077  2.791   14.500  1.000 72.024  0 74   ARG   A NH1  1 ? 1 
ATOM   263   N  NH2  . ARG   A  1  19  ? 28.338  2.602   15.978  1.000 69.157  0 74   ARG   A NH2  1 ? 1 
ATOM   264   H  H    . ARG   A  1  19  ? 33.497  3.970   20.678  1.000 57.066  0 74   ARG   A H    1 c 1 
ATOM   265   H  HA   . ARG   A  1  19  ? 32.627  6.452   19.695  1.000 49.758  0 74   ARG   A HA   1 c 1 
ATOM   266   H  HB2  . ARG   A  1  19  ? 31.101  4.071   19.395  1.000 48.003  0 74   ARG   A HB2  1 c 1 
ATOM   267   H  HB3  . ARG   A  1  19  ? 30.877  5.431   18.620  1.000 47.985  0 74   ARG   A HB3  1 c 1 
ATOM   268   H  HG2  . ARG   A  1  19  ? 33.148  4.918   17.653  1.000 51.859  0 74   ARG   A HG2  1 c 1 
ATOM   269   H  HG3  . ARG   A  1  19  ? 32.785  3.432   18.061  1.000 51.696  0 74   ARG   A HG3  1 c 1 
ATOM   270   H  HD2  . ARG   A  1  19  ? 31.498  5.018   16.118  1.000 55.113  0 74   ARG   A HD2  1 c 1 
ATOM   271   H  HD3  . ARG   A  1  19  ? 32.173  3.603   15.899  1.000 55.465  0 74   ARG   A HD3  1 c 1 
ATOM   272   H  HE   . ARG   A  1  19  ? 30.016  3.429   17.505  1.000 62.700  0 74   ARG   A HE   1 c 1 
ATOM   273   H  HH11 . ARG   A  1  19  ? 30.882  2.451   14.394  1.000 70.043  0 74   ARG   A HH11 1 c 1 
ATOM   274   H  HH12 . ARG   A  1  19  ? 29.588  3.000   13.797  1.000 69.417  0 74   ARG   A HH12 1 c 1 
ATOM   275   H  HH21 . ARG   A  1  19  ? 27.936  2.021   15.454  1.000 67.255  0 74   ARG   A HH21 1 c 1 
ATOM   276   H  HH22 . ARG   A  1  19  ? 27.916  2.940   16.672  1.000 67.218  0 74   ARG   A HH22 1 c 1 
ATOM   277   N  N    . CYS   A  1  20  ? 30.593  6.782   21.179  1.000 49.224  0 75   CYS   A N    1 ? 1 
ATOM   278   C  CA   . CYS   A  1  20  ? 29.626  7.107   22.214  1.000 39.049  0 75   CYS   A CA   1 ? 1 
ATOM   279   C  C    . CYS   A  1  20  ? 28.253  7.378   21.612  1.000 41.960  0 75   CYS   A C    1 ? 1 
ATOM   280   O  O    . CYS   A  1  20  ? 27.432  8.069   22.220  1.000 39.840  0 75   CYS   A O    1 ? 1 
ATOM   281   C  CB   . CYS   A  1  20  ? 30.104  8.312   22.991  1.000 45.550  0 75   CYS   A CB   1 ? 1 
ATOM   282   S  SG   . CYS   A  1  20  ? 31.812  8.168   23.539  1.000 39.434  0 75   CYS   A SG   1 ? 1 
ATOM   283   H  H    . CYS   A  1  20  ? 30.599  7.293   20.421  1.000 44.856  0 75   CYS   A H    1 c 1 
ATOM   284   H  HA   . CYS   A  1  20  ? 29.558  6.341   22.829  1.000 42.603  0 75   CYS   A HA   1 c 1 
ATOM   285   H  HB2  . CYS   A  1  20  ? 30.023  9.111   22.429  1.000 42.363  0 75   CYS   A HB2  1 c 1 
ATOM   286   H  HB3  . CYS   A  1  20  ? 29.534  8.436   23.777  1.000 42.411  0 75   CYS   A HB3  1 c 1 
ATOM   287   N  N    . ASP   A  1  21  ? 28.021  6.845   20.412  1.000 32.492  0 76   ASP   A N    1 ? 1 
ATOM   288   C  CA   . ASP   A  1  21  ? 26.810  7.149   19.670  1.000 38.770  0 76   ASP   A CA   1 ? 1 
ATOM   289   C  C    . ASP   A  1  21  ? 25.725  6.141   20.050  1.000 34.059  0 76   ASP   A C    1 ? 1 
ATOM   290   O  O    . ASP   A  1  21  ? 25.974  5.216   20.821  1.000 32.686  0 76   ASP   A O    1 ? 1 
ATOM   291   C  CB   . ASP   A  1  21  ? 27.104  7.136   18.165  1.000 35.418  0 76   ASP   A CB   1 ? 1 
ATOM   292   C  CG   . ASP   A  1  21  ? 27.525  5.774   17.665  1.000 41.612  0 76   ASP   A CG   1 ? 1 
ATOM   293   O  OD1  . ASP   A  1  21  ? 28.660  5.369   17.947  1.000 46.426  0 76   ASP   A OD1  1 ? 1 
ATOM   294   O  OD2  . ASP   A  1  21  ? 26.710  5.102   17.004  1.000 37.458  0 76   ASP   A OD2  1 ? 1 
ATOM   295   H  H    . ASP   A  1  21  ? 28.623  6.259   20.053  1.000 36.274  0 76   ASP   A H    1 c 1 
ATOM   296   H  HA   . ASP   A  1  21  ? 26.505  8.053   19.920  1.000 35.854  0 76   ASP   A HA   1 c 1 
ATOM   297   H  HB2  . ASP   A  1  21  ? 26.304  7.416   17.674  1.000 36.844  0 76   ASP   A HB2  1 c 1 
ATOM   298   H  HB3  . ASP   A  1  21  ? 27.822  7.773   17.971  1.000 37.824  0 76   ASP   A HB3  1 c 1 
ATOM   299   N  N    . ASN   A  1  22  ? 24.521  6.340   19.500  1.000 30.623  0 77   ASN   A N    1 ? 1 
ATOM   300   C  CA   . ASN   A  1  22  ? 23.355  5.509   19.771  1.000 32.311  0 77   ASN   A CA   1 ? 1 
ATOM   301   C  C    . ASN   A  1  22  ? 23.557  4.030   19.486  1.000 32.359  0 77   ASN   A C    1 ? 1 
ATOM   302   O  O    . ASN   A  1  22  ? 22.865  3.199   20.063  1.000 29.775  0 77   ASN   A O    1 ? 1 
ATOM   303   C  CB   . ASN   A  1  22  ? 22.150  5.898   18.900  1.000 31.228  0 77   ASN   A CB   1 ? 1 
ATOM   304   C  CG   . ASN   A  1  22  ? 21.494  7.182   19.282  1.000 32.761  0 77   ASN   A CG   1 ? 1 
ATOM   305   O  OD1  . ASN   A  1  22  ? 22.101  8.053   19.957  1.000 28.433  0 77   ASN   A OD1  1 ? 1 
ATOM   306   N  ND2  . ASN   A  1  22  ? 20.256  7.365   18.812  1.000 25.285  0 77   ASN   A ND2  1 ? 1 
ATOM   307   H  H    . ASN   A  1  22  ? 24.421  7.042   18.924  1.000 31.651  0 77   ASN   A H    1 c 1 
ATOM   308   H  HA   . ASN   A  1  22  ? 23.100  5.621   20.717  1.000 31.957  0 77   ASN   A HA   1 c 1 
ATOM   309   H  HB2  . ASN   A  1  22  ? 22.446  5.962   17.969  1.000 31.563  0 77   ASN   A HB2  1 c 1 
ATOM   310   H  HB3  . ASN   A  1  22  ? 21.485  5.182   18.953  1.000 31.269  0 77   ASN   A HB3  1 c 1 
ATOM   311   H  HD21 . ASN   A  1  22  ? 19.938  6.833   18.181  1.000 26.818  0 77   ASN   A HD21 1 c 1 
ATOM   312   H  HD22 . ASN   A  1  22  ? 19.755  8.017   19.130  1.000 26.925  0 77   ASN   A HD22 1 c 1 
ATOM   313   N  N    . LEU   A  1  23  ? 24.456  3.731   18.544  1.000 32.720  0 78   LEU   A N    1 ? 1 
ATOM   314   C  CA   . LEU   A  1  23  ? 24.614  2.386   18.032  1.000 31.696  0 78   LEU   A CA   1 ? 1 
ATOM   315   C  C    . LEU   A  1  23  ? 25.936  1.750   18.455  1.000 37.961  0 78   LEU   A C    1 ? 1 
ATOM   316   O  O    . LEU   A  1  23  ? 26.260  0.654   17.994  1.000 35.034  0 78   LEU   A O    1 ? 1 
ATOM   317   C  CB   . LEU   A  1  23  ? 24.516  2.442   16.497  1.000 33.350  0 78   LEU   A CB   1 ? 1 
ATOM   318   C  CG   . LEU   A  1  23  ? 23.110  2.477   15.873  1.000 32.459  0 78   LEU   A CG   1 ? 1 
ATOM   319   C  CD1  . LEU   A  1  23  ? 23.217  2.370   14.368  1.000 33.308  0 78   LEU   A CD1  1 ? 1 
ATOM   320   C  CD2  . LEU   A  1  23  ? 22.218  1.348   16.362  1.000 35.460  0 78   LEU   A CD2  1 ? 1 
ATOM   321   H  H    . LEU   A  1  23  ? 24.983  4.393   18.199  1.000 32.671  0 78   LEU   A H    1 c 1 
ATOM   322   H  HA   . LEU   A  1  23  ? 23.881  1.834   18.382  1.000 32.962  0 78   LEU   A HA   1 c 1 
ATOM   323   H  HB2  . LEU   A  1  23  ? 25.001  3.234   16.193  1.000 33.127  0 78   LEU   A HB2  1 c 1 
ATOM   324   H  HB3  . LEU   A  1  23  ? 24.984  1.662   16.136  1.000 33.096  0 78   LEU   A HB3  1 c 1 
ATOM   325   H  HG   . LEU   A  1  23  ? 22.684  3.340   16.099  1.000 33.082  0 78   LEU   A HG   1 c 1 
ATOM   326   H  HD11 . LEU   A  1  23  ? 22.342  2.517   13.969  1.000 32.523  0 78   LEU   A HD11 1 c 1 
ATOM   327   H  HD12 . LEU   A  1  23  ? 23.539  1.484   14.128  1.000 33.307  0 78   LEU   A HD12 1 c 1 
ATOM   328   H  HD13 . LEU   A  1  23  ? 23.840  3.040   14.038  1.000 33.270  0 78   LEU   A HD13 1 c 1 
ATOM   329   H  HD21 . LEU   A  1  23  ? 21.961  1.512   17.286  1.000 34.478  0 78   LEU   A HD21 1 c 1 
ATOM   330   H  HD22 . LEU   A  1  23  ? 22.699  0.504   16.304  1.000 34.684  0 78   LEU   A HD22 1 c 1 
ATOM   331   H  HD23 . LEU   A  1  23  ? 21.418  1.302   15.809  1.000 33.932  0 78   LEU   A HD23 1 c 1 
ATOM   332   N  N    . CYS   A  1  24  ? 26.698  2.415   19.337  1.000 31.536  0 79   CYS   A N    1 ? 1 
ATOM   333   C  CA   . CYS   A  1  24  ? 28.020  1.895   19.649  1.000 34.061  0 79   CYS   A CA   1 ? 1 
ATOM   334   C  C    . CYS   A  1  24  ? 27.918  0.519   20.317  1.000 29.979  0 79   CYS   A C    1 ? 1 
ATOM   335   O  O    . CYS   A  1  24  ? 28.785  -0.334  20.133  1.000 41.416  0 79   CYS   A O    1 ? 1 
ATOM   336   C  CB   . CYS   A  1  24  ? 28.866  2.881   20.473  1.000 33.050  0 79   CYS   A CB   1 ? 1 
ATOM   337   S  SG   . CYS   A  1  24  ? 28.333  3.121   22.187  1.000 35.774  0 79   CYS   A SG   1 ? 1 
ATOM   338   H  H    . CYS   A  1  24  ? 26.400  3.177   19.744  1.000 33.323  0 79   CYS   A H    1 c 1 
ATOM   339   H  HA   . CYS   A  1  24  ? 28.484  1.768   18.789  1.000 32.676  0 79   CYS   A HA   1 c 1 
ATOM   340   H  HB2  . CYS   A  1  24  ? 29.792  2.564   20.485  1.000 34.601  0 79   CYS   A HB2  1 c 1 
ATOM   341   H  HB3  . CYS   A  1  24  ? 28.857  3.752   20.027  1.000 33.915  0 79   CYS   A HB3  1 c 1 
ATOM   342   N  N    . LYS   A  1  25  ? 26.870  0.302   21.114  1.000 38.385  0 80   LYS   A N    1 ? 1 
ATOM   343   C  CA   . LYS   A  1  25  ? 26.689  -0.982  21.777  1.000 40.364  0 80   LYS   A CA   1 ? 1 
ATOM   344   C  C    . LYS   A  1  25  ? 26.509  -2.117  20.767  1.000 54.879  0 80   LYS   A C    1 ? 1 
ATOM   345   O  O    . LYS   A  1  25  ? 27.036  -3.208  20.990  1.000 56.131  0 80   LYS   A O    1 ? 1 
ATOM   346   C  CB   . LYS   A  1  25  ? 25.498  -0.960  22.745  1.000 37.577  0 80   LYS   A CB   1 ? 1 
ATOM   347   C  CG   . LYS   A  1  25  ? 25.676  -0.021  23.928  1.000 41.917  0 80   LYS   A CG   1 ? 1 
ATOM   348   C  CD   . LYS   A  1  25  ? 26.644  -0.513  24.992  1.000 46.359  0 80   LYS   A CD   1 ? 1 
ATOM   349   C  CE   . LYS   A  1  25  ? 26.024  -1.526  25.904  1.000 53.843  0 80   LYS   A CE   1 ? 1 
ATOM   350   N  NZ   . LYS   A  1  25  ? 26.995  -1.916  26.943  1.000 58.039  0 80   LYS   A NZ   1 ? 1 
ATOM   351   H  H    . LYS   A  1  25  ? 26.257  0.965   21.256  1.000 35.892  0 80   LYS   A H    1 c 1 
ATOM   352   H  HA   . LYS   A  1  25  ? 27.503  -1.167  22.297  1.000 42.435  0 80   LYS   A HA   1 c 1 
ATOM   353   H  HB2  . LYS   A  1  25  ? 24.697  -0.691  22.249  1.000 38.339  0 80   LYS   A HB2  1 c 1 
ATOM   354   H  HB3  . LYS   A  1  25  ? 25.352  -1.868  23.084  1.000 39.235  0 80   LYS   A HB3  1 c 1 
ATOM   355   H  HG2  . LYS   A  1  25  ? 25.991  0.844   23.595  1.000 41.606  0 80   LYS   A HG2  1 c 1 
ATOM   356   H  HG3  . LYS   A  1  25  ? 24.800  0.124   24.344  1.000 41.458  0 80   LYS   A HG3  1 c 1 
ATOM   357   H  HD2  . LYS   A  1  25  ? 27.426  -0.914  24.557  1.000 47.332  0 80   LYS   A HD2  1 c 1 
ATOM   358   H  HD3  . LYS   A  1  25  ? 26.951  0.251   25.525  1.000 47.393  0 80   LYS   A HD3  1 c 1 
ATOM   359   H  HE2  . LYS   A  1  25  ? 25.229  -1.151  26.328  1.000 52.315  0 80   LYS   A HE2  1 c 1 
ATOM   360   H  HE3  . LYS   A  1  25  ? 25.760  -2.316  25.395  1.000 52.362  0 80   LYS   A HE3  1 c 1 
ATOM   361   H  HZ1  . LYS   A  1  25  ? 27.249  -1.186  27.416  1.000 57.070  0 80   LYS   A HZ1  1 c 1 
ATOM   362   H  HZ2  . LYS   A  1  25  ? 27.725  -2.290  26.557  1.000 57.290  0 80   LYS   A HZ2  1 c 1 
ATOM   363   H  HZ3  . LYS   A  1  25  ? 26.616  -2.518  27.507  1.000 57.078  0 80   LYS   A HZ3  1 c 1 
ATOM   364   N  N    . SER   A  1  26  ? 25.802  -1.837  19.658  1.000 46.631  0 81   SER   A N    1 ? 1 
ATOM   365   C  CA   . SER   A  1  26  ? 25.565  -2.817  18.607  1.000 45.294  0 81   SER   A CA   1 ? 1 
ATOM   366   C  C    . SER   A  1  26  ? 26.817  -3.106  17.793  1.000 52.387  0 81   SER   A C    1 ? 1 
ATOM   367   O  O    . SER   A  1  26  ? 26.841  -4.094  17.074  1.000 54.441  0 81   SER   A O    1 ? 1 
ATOM   368   C  CB   . SER   A  1  26  ? 24.481  -2.360  17.636  1.000 35.178  0 81   SER   A CB   1 ? 1 
ATOM   369   O  OG   . SER   A  1  26  ? 23.247  -2.174  18.300  1.000 35.737  0 81   SER   A OG   1 ? 1 
ATOM   370   H  H    . SER   A  1  26  ? 25.449  -1.000  19.558  1.000 47.478  0 81   SER   A H    1 c 1 
ATOM   371   H  HA   . SER   A  1  26  ? 25.268  -3.664  19.036  1.000 44.740  0 81   SER   A HA   1 c 1 
ATOM   372   H  HB2  . SER   A  1  26  ? 24.757  -1.514  17.215  1.000 37.226  0 81   SER   A HB2  1 c 1 
ATOM   373   H  HB3  . SER   A  1  26  ? 24.373  -3.034  16.927  1.000 37.232  0 81   SER   A HB3  1 c 1 
ATOM   374   H  HG   . SER   A  1  26  ? 23.216  -1.391  18.598  0.000 23.060  0 81   SER   A HG   1 c 1 
ATOM   375   N  N    . TYR   A  1  27  ? 27.809  -2.210  17.860  1.000 43.923  0 82   TYR   A N    1 ? 1 
ATOM   376   C  CA   . TYR   A  1  27  ? 29.109  -2.462  17.258  1.000 53.325  0 82   TYR   A CA   1 ? 1 
ATOM   377   C  C    . TYR   A  1  27  ? 30.120  -2.934  18.308  1.000 52.170  0 82   TYR   A C    1 ? 1 
ATOM   378   O  O    . TYR   A  1  27  ? 31.283  -3.161  18.000  1.000 52.031  0 82   TYR   A O    1 ? 1 
ATOM   379   C  CB   . TYR   A  1  27  ? 29.625  -1.196  16.550  1.000 61.883  0 82   TYR   A CB   1 ? 1 
ATOM   380   C  CG   . TYR   A  1  27  ? 29.094  -0.922  15.152  1.000 75.706  0 82   TYR   A CG   1 ? 1 
ATOM   381   C  CD1  . TYR   A  1  27  ? 27.751  -1.095  14.846  1.000 66.473  0 82   TYR   A CD1  1 ? 1 
ATOM   382   C  CD2  . TYR   A  1  27  ? 29.927  -0.424  14.158  1.000 85.493  0 82   TYR   A CD2  1 ? 1 
ATOM   383   C  CE1  . TYR   A  1  27  ? 27.261  -0.822  13.577  1.000 69.194  0 82   TYR   A CE1  1 ? 1 
ATOM   384   C  CE2  . TYR   A  1  27  ? 29.449  -0.141  12.889  1.000 72.565  0 82   TYR   A CE2  1 ? 1 
ATOM   385   C  CZ   . TYR   A  1  27  ? 28.114  -0.338  12.600  1.000 84.581  0 82   TYR   A CZ   1 ? 1 
ATOM   386   O  OH   . TYR   A  1  27  ? 27.656  -0.053  11.331  1.000 89.672  0 82   TYR   A OH   1 ? 1 
ATOM   387   H  H    . TYR   A  1  27  ? 27.667  -1.410  18.277  1.000 47.626  0 82   TYR   A H    1 c 1 
ATOM   388   H  HA   . TYR   A  1  27  ? 29.011  -3.178  16.581  1.000 52.315  0 82   TYR   A HA   1 c 1 
ATOM   389   H  HB2  . TYR   A  1  27  ? 29.410  -0.426  17.117  1.000 62.465  0 82   TYR   A HB2  1 c 1 
ATOM   390   H  HB3  . TYR   A  1  27  ? 30.602  -1.255  16.499  1.000 63.318  0 82   TYR   A HB3  1 c 1 
ATOM   391   H  HD1  . TYR   A  1  27  ? 27.162  -1.421  15.505  1.000 68.596  0 82   TYR   A HD1  1 c 1 
ATOM   392   H  HD2  . TYR   A  1  27  ? 30.840  -0.284  14.347  1.000 80.410  0 82   TYR   A HD2  1 c 1 
ATOM   393   H  HE1  . TYR   A  1  27  ? 26.349  -0.956  13.382  1.000 70.988  0 82   TYR   A HE1  1 c 1 
ATOM   394   H  HE2  . TYR   A  1  27  ? 30.033  0.183   12.224  1.000 78.318  0 82   TYR   A HE2  1 c 1 
ATOM   395   H  HH   . TYR   A  1  27  ? 26.828  -0.177  11.133  0.000 70.100  0 82   TYR   A HH   1 c 1 
ATOM   396   N  N    . SER   A  1  28  ? 29.667  -3.121  19.549  1.000 59.858  0 83   SER   A N    1 ? 1 
ATOM   397   C  CA   . SER   A  1  28  ? 30.572  -3.383  20.658  1.000 57.797  0 83   SER   A CA   1 ? 1 
ATOM   398   C  C    . SER   A  1  28  ? 31.775  -2.448  20.608  1.000 57.454  0 83   SER   A C    1 ? 1 
ATOM   399   O  O    . SER   A  1  28  ? 32.889  -2.864  20.926  1.000 49.739  0 83   SER   A O    1 ? 1 
ATOM   400   C  CB   . SER   A  1  28  ? 31.050  -4.833  20.650  1.000 60.042  0 83   SER   A CB   1 ? 1 
ATOM   401   O  OG   . SER   A  1  28  ? 29.951  -5.723  20.732  1.000 68.874  0 83   SER   A OG   1 ? 1 
ATOM   402   H  H    . SER   A  1  28  ? 28.769  -3.097  19.714  1.000 56.564  0 83   SER   A H    1 c 1 
ATOM   403   H  HA   . SER   A  1  28  ? 30.080  -3.215  21.506  1.000 58.386  0 83   SER   A HA   1 c 1 
ATOM   404   H  HB2  . SER   A  1  28  ? 31.555  -5.009  19.825  1.000 61.756  0 83   SER   A HB2  1 c 1 
ATOM   405   H  HB3  . SER   A  1  28  ? 31.648  -4.984  21.415  1.000 62.267  0 83   SER   A HB3  1 c 1 
ATOM   406   H  HG   . SER   A  1  28  ? 29.701  -5.897  19.917  0.000 52.770  0 83   SER   A HG   1 c 1 
ATOM   407   N  N    . SER   A  1  29  ? 31.532  -1.188  20.218  1.000 50.513  0 84   SER   A N    1 ? 1 
ATOM   408   C  CA   . SER   A  1  29  ? 32.603  -0.236  19.983  1.000 43.317  0 84   SER   A CA   1 ? 1 
ATOM   409   C  C    . SER   A  1  29  ? 32.550  0.991   20.900  1.000 39.516  0 84   SER   A C    1 ? 1 
ATOM   410   O  O    . SER   A  1  29  ? 33.162  2.012   20.602  1.000 43.631  0 84   SER   A O    1 ? 1 
ATOM   411   C  CB   . SER   A  1  29  ? 32.566  0.197   18.526  1.000 56.007  0 84   SER   A CB   1 ? 1 
ATOM   412   O  OG   . SER   A  1  29  ? 31.443  1.021   18.275  1.000 64.668  0 84   SER   A OG   1 ? 1 
ATOM   413   H  H    . SER   A  1  29  ? 30.668  -0.908  20.115  1.000 49.425  0 84   SER   A H    1 c 1 
ATOM   414   H  HA   . SER   A  1  29  ? 33.468  -0.699  20.145  1.000 46.725  0 84   SER   A HA   1 c 1 
ATOM   415   H  HB2  . SER   A  1  29  ? 33.390  0.690   18.310  1.000 54.872  0 84   SER   A HB2  1 c 1 
ATOM   416   H  HB3  . SER   A  1  29  ? 32.525  -0.599  17.950  1.000 54.341  0 84   SER   A HB3  1 c 1 
ATOM   417   H  HG   . SER   A  1  29  ? 31.673  1.821   18.397  0.000 45.280  0 84   SER   A HG   1 c 1 
ATOM   418   N  N    . CYS   A  1  30  ? 31.794  0.908   22.007  1.000 40.387  0 85   CYS   A N    1 ? 1 
ATOM   419   C  CA   . CYS   A  1  30  ? 31.630  2.047   22.891  1.000 36.638  0 85   CYS   A CA   1 ? 1 
ATOM   420   C  C    . CYS   A  1  30  ? 32.933  2.261   23.645  1.000 42.935  0 85   CYS   A C    1 ? 1 
ATOM   421   O  O    . CYS   A  1  30  ? 33.607  1.293   23.985  1.000 39.111  0 85   CYS   A O    1 ? 1 
ATOM   422   C  CB   . CYS   A  1  30  ? 30.506  1.837   23.887  1.000 40.560  0 85   CYS   A CB   1 ? 1 
ATOM   423   S  SG   . CYS   A  1  30  ? 28.926  1.400   23.156  1.000 46.130  0 85   CYS   A SG   1 ? 1 
ATOM   424   H  H    . CYS   A  1  30  ? 31.378  0.122   22.216  1.000 39.163  0 85   CYS   A H    1 c 1 
ATOM   425   H  HA   . CYS   A  1  30  ? 31.432  2.839   22.347  1.000 38.712  0 85   CYS   A HA   1 c 1 
ATOM   426   H  HB2  . CYS   A  1  30  ? 30.763  1.129   24.512  1.000 41.008  0 85   CYS   A HB2  1 c 1 
ATOM   427   H  HB3  . CYS   A  1  30  ? 30.387  2.659   24.403  1.000 40.511  0 85   CYS   A HB3  1 c 1 
ATOM   428   N  N    . CYS   A  1  31  ? 33.230  3.517   23.980  1.000 43.302  0 86   CYS   A N    1 ? 1 
ATOM   429   C  CA   . CYS   A  1  31  ? 34.327  3.785   24.889  1.000 38.665  0 86   CYS   A CA   1 ? 1 
ATOM   430   C  C    . CYS   A  1  31  ? 34.038  3.082   26.208  1.000 44.898  0 86   CYS   A C    1 ? 1 
ATOM   431   O  O    . CYS   A  1  31  ? 32.898  2.727   26.512  1.000 49.703  0 86   CYS   A O    1 ? 1 
ATOM   432   C  CB   . CYS   A  1  31  ? 34.569  5.271   25.097  1.000 37.477  0 86   CYS   A CB   1 ? 1 
ATOM   433   S  SG   . CYS   A  1  31  ? 34.821  6.227   23.587  1.000 57.173  0 86   CYS   A SG   1 ? 1 
ATOM   434   H  H    . CYS   A  1  31  ? 32.746  4.213   23.640  1.000 41.311  0 86   CYS   A H    1 c 1 
ATOM   435   H  HA   . CYS   A  1  31  ? 35.142  3.393   24.502  1.000 40.953  0 86   CYS   A HA   1 c 1 
ATOM   436   H  HB2  . CYS   A  1  31  ? 33.809  5.649   25.579  1.000 40.354  0 86   CYS   A HB2  1 c 1 
ATOM   437   H  HB3  . CYS   A  1  31  ? 35.360  5.382   25.663  1.000 41.526  0 86   CYS   A HB3  1 c 1 
ATOM   438   N  N    . HIS   A  1  32  ? 35.094  2.912   27.001  1.000 47.695  0 87   HIS   A N    1 ? 1 
ATOM   439   C  CA   . HIS   A  1  32  ? 35.020  2.086   28.186  1.000 46.322  0 87   HIS   A CA   1 ? 1 
ATOM   440   C  C    . HIS   A  1  32  ? 34.018  2.669   29.181  1.000 43.121  0 87   HIS   A C    1 ? 1 
ATOM   441   O  O    . HIS   A  1  32  ? 33.298  1.935   29.848  1.000 49.983  0 87   HIS   A O    1 ? 1 
ATOM   442   C  CB   . HIS   A  1  32  ? 36.436  1.946   28.794  1.000 58.339  0 87   HIS   A CB   1 ? 1 
ATOM   443   C  CG   . HIS   A  1  32  ? 36.928  3.159   29.529  1.000 71.880  0 87   HIS   A CG   1 ? 1 
ATOM   444   N  ND1  . HIS   A  1  32  ? 36.811  3.270   30.921  1.000 73.229  0 87   HIS   A ND1  1 ? 1 
ATOM   445   C  CD2  . HIS   A  1  32  ? 37.502  4.285   29.054  1.000 94.492  0 87   HIS   A CD2  1 ? 1 
ATOM   446   C  CE1  . HIS   A  1  32  ? 37.326  4.451   31.240  1.000 75.678  0 87   HIS   A CE1  1 ? 1 
ATOM   447   N  NE2  . HIS   A  1  32  ? 37.757  5.099   30.145  1.000 96.282  0 87   HIS   A NE2  1 ? 1 
ATOM   448   H  H    . HIS   A  1  32  ? 35.884  3.326   26.797  1.000 47.445  0 87   HIS   A H    1 c 1 
ATOM   449   H  HA   . HIS   A  1  32  ? 34.711  1.191   27.912  1.000 47.500  0 87   HIS   A HA   1 c 1 
ATOM   450   H  HB2  . HIS   A  1  32  ? 36.436  1.187   29.410  1.000 58.453  0 87   HIS   A HB2  1 c 1 
ATOM   451   H  HB3  . HIS   A  1  32  ? 37.066  1.743   28.072  1.000 58.197  0 87   HIS   A HB3  1 c 1 
ATOM   452   H  HD1  . HIS   A  1  32  ? 36.452  2.655   31.464  0.000 48.970  0 87   HIS   A HD1  1 c 1 
ATOM   453   H  HD2  . HIS   A  1  32  ? 37.698  4.474   28.150  1.000 87.779  0 87   HIS   A HD2  1 c 1 
ATOM   454   H  HE1  . HIS   A  1  32  ? 37.383  4.789   32.118  1.000 79.811  0 87   HIS   A HE1  1 c 1 
ATOM   455   H  HE2  . HIS   A  1  32  ? 38.138  5.888   30.141  0.000 73.100  0 87   HIS   A HE2  1 c 1 
ATOM   456   N  N    . ASP   A  1  33  ? 33.951  4.004   29.252  1.000 56.887  0 88   ASP   A N    1 ? 1 
ATOM   457   C  CA   . ASP   A  1  33  ? 33.151  4.672   30.266  1.000 60.958  0 88   ASP   A CA   1 ? 1 
ATOM   458   C  C    . ASP   A  1  33  ? 31.732  4.988   29.774  1.000 51.404  0 88   ASP   A C    1 ? 1 
ATOM   459   O  O    . ASP   A  1  33  ? 31.005  5.758   30.401  1.000 47.046  0 88   ASP   A O    1 ? 1 
ATOM   460   C  CB   . ASP   A  1  33  ? 33.921  5.916   30.774  1.000 49.707  0 88   ASP   A CB   1 ? 1 
ATOM   461   C  CG   . ASP   A  1  33  ? 34.386  6.896   29.713  1.000 66.988  0 88   ASP   A CG   1 ? 1 
ATOM   462   O  OD1  . ASP   A  1  33  ? 34.127  6.639   28.510  1.000 57.906  0 88   ASP   A OD1  1 ? 1 
ATOM   463   O  OD2  . ASP   A  1  33  ? 35.015  7.926   30.082  1.000 48.378  0 88   ASP   A OD2  1 ? 1 
ATOM   464   H  H    . ASP   A  1  33  ? 34.418  4.511   28.653  1.000 53.636  0 88   ASP   A H    1 c 1 
ATOM   465   H  HA   . ASP   A  1  33  ? 33.069  4.056   31.031  1.000 56.215  0 88   ASP   A HA   1 c 1 
ATOM   466   H  HB2  . ASP   A  1  33  ? 33.348  6.403   31.401  1.000 55.496  0 88   ASP   A HB2  1 c 1 
ATOM   467   H  HB3  . ASP   A  1  33  ? 34.711  5.611   31.265  1.000 56.465  0 88   ASP   A HB3  1 c 1 
ATOM   468   N  N    . PHE   A  1  34  ? 31.311  4.350   28.677  1.000 46.274  0 89   PHE   A N    1 ? 1 
ATOM   469   C  CA   . PHE   A  1  34  ? 30.019  4.651   28.072  1.000 46.586  0 89   PHE   A CA   1 ? 1 
ATOM   470   C  C    . PHE   A  1  34  ? 28.873  4.298   29.022  1.000 42.564  0 89   PHE   A C    1 ? 1 
ATOM   471   O  O    . PHE   A  1  34  ? 28.013  5.133   29.318  1.000 36.641  0 89   PHE   A O    1 ? 1 
ATOM   472   C  CB   . PHE   A  1  34  ? 29.847  3.915   26.735  1.000 36.756  0 89   PHE   A CB   1 ? 1 
ATOM   473   C  CG   . PHE   A  1  34  ? 28.471  4.064   26.095  1.000 30.710  0 89   PHE   A CG   1 ? 1 
ATOM   474   C  CD1  . PHE   A  1  34  ? 28.167  5.167   25.318  1.000 30.056  0 89   PHE   A CD1  1 ? 1 
ATOM   475   C  CD2  . PHE   A  1  34  ? 27.492  3.109   26.287  1.000 34.263  0 89   PHE   A CD2  1 ? 1 
ATOM   476   C  CE1  . PHE   A  1  34  ? 26.912  5.323   24.756  1.000 30.122  0 89   PHE   A CE1  1 ? 1 
ATOM   477   C  CE2  . PHE   A  1  34  ? 26.242  3.249   25.687  1.000 32.653  0 89   PHE   A CE2  1 ? 1 
ATOM   478   C  CZ   . PHE   A  1  34  ? 25.959  4.358   24.932  1.000 29.150  0 89   PHE   A CZ   1 ? 1 
ATOM   479   H  H    . PHE   A  1  34  ? 31.835  3.707   28.294  1.000 47.772  0 89   PHE   A H    1 c 1 
ATOM   480   H  HA   . PHE   A  1  34  ? 29.980  5.625   27.896  1.000 43.629  0 89   PHE   A HA   1 c 1 
ATOM   481   H  HB2  . PHE   A  1  34  ? 30.523  4.251   26.111  1.000 37.366  0 89   PHE   A HB2  1 c 1 
ATOM   482   H  HB3  . PHE   A  1  34  ? 30.025  2.963   26.883  1.000 37.357  0 89   PHE   A HB3  1 c 1 
ATOM   483   H  HD1  . PHE   A  1  34  ? 28.817  5.839   25.195  1.000 30.772  0 89   PHE   A HD1  1 c 1 
ATOM   484   H  HD2  . PHE   A  1  34  ? 27.683  2.340   26.800  1.000 33.371  0 89   PHE   A HD2  1 c 1 
ATOM   485   H  HE1  . PHE   A  1  34  ? 26.725  6.080   24.224  1.000 29.545  0 89   PHE   A HE1  1 c 1 
ATOM   486   H  HE2  . PHE   A  1  34  ? 25.583  2.590   25.817  1.000 31.773  0 89   PHE   A HE2  1 c 1 
ATOM   487   H  HZ   . PHE   A  1  34  ? 25.108  4.456   24.536  1.000 29.369  0 89   PHE   A HZ   1 c 1 
ATOM   488   N  N    . ASP   A  1  35  ? 28.874  3.052   29.497  1.000 39.965  0 90   ASP   A N    1 ? 1 
ATOM   489   C  CA   . ASP   A  1  35  ? 27.837  2.595   30.408  1.000 44.876  0 90   ASP   A CA   1 ? 1 
ATOM   490   C  C    . ASP   A  1  35  ? 27.742  3.538   31.599  1.000 48.566  0 90   ASP   A C    1 ? 1 
ATOM   491   O  O    . ASP   A  1  35  ? 26.652  3.935   32.000  1.000 54.566  0 90   ASP   A O    1 ? 1 
ATOM   492   C  CB   . ASP   A  1  35  ? 28.121  1.203   30.916  1.000 43.168  0 90   ASP   A CB   1 ? 1 
ATOM   493   C  CG   . ASP   A  1  35  ? 27.823  0.092   29.956  1.000 46.170  0 90   ASP   A CG   1 ? 1 
ATOM   494   O  OD1  . ASP   A  1  35  ? 27.411  0.387   28.821  1.000 59.227  0 90   ASP   A OD1  1 ? 1 
ATOM   495   O  OD2  . ASP   A  1  35  ? 27.991  -1.080  30.343  1.000 54.816  0 90   ASP   A OD2  1 ? 1 
ATOM   496   H  H    . ASP   A  1  35  ? 29.533  2.470   29.245  1.000 42.081  0 90   ASP   A H    1 c 1 
ATOM   497   H  HA   . ASP   A  1  35  ? 26.974  2.594   29.931  1.000 43.324  0 90   ASP   A HA   1 c 1 
ATOM   498   H  HB2  . ASP   A  1  35  ? 29.067  1.146   31.160  1.000 45.098  0 90   ASP   A HB2  1 c 1 
ATOM   499   H  HB3  . ASP   A  1  35  ? 27.592  1.049   31.725  1.000 44.555  0 90   ASP   A HB3  1 c 1 
ATOM   500   N  N    . GLU   A  1  36  ? 28.908  3.938   32.106  1.000 59.373  0 91   GLU   A N    1 ? 1 
ATOM   501   C  CA   . GLU   A  1  36  ? 28.986  4.629   33.377  1.000 54.690  0 91   GLU   A CA   1 ? 1 
ATOM   502   C  C    . GLU   A  1  36  ? 28.420  6.040   33.243  1.000 44.019  0 91   GLU   A C    1 ? 1 
ATOM   503   O  O    . GLU   A  1  36  ? 27.723  6.506   34.138  1.000 44.877  0 91   GLU   A O    1 ? 1 
ATOM   504   C  CB   . GLU   A  1  36  ? 30.453  4.664   33.879  1.000 70.126  0 91   GLU   A CB   1 ? 1 
ATOM   505   C  CG   . GLU   A  1  36  ? 31.206  3.345   33.734  1.000 80.649  0 91   GLU   A CG   1 ? 1 
ATOM   506   C  CD   . GLU   A  1  36  ? 32.573  3.314   34.401  1.000 84.734  0 91   GLU   A CD   1 ? 1 
ATOM   507   O  OE1  . GLU   A  1  36  ? 33.378  4.257   34.210  1.000 74.486  0 91   GLU   A OE1  1 ? 1 
ATOM   508   O  OE2  . GLU   A  1  36  ? 32.839  2.324   35.118  1.000 59.367  0 91   GLU   A OE2  1 ? 1 
ATOM   509   H  H    . GLU   A  1  36  ? 29.677  3.786   31.637  1.000 55.846  0 91   GLU   A H    1 c 1 
ATOM   510   H  HA   . GLU   A  1  36  ? 28.442  4.134   34.032  1.000 55.557  0 91   GLU   A HA   1 c 1 
ATOM   511   H  HB2  . GLU   A  1  36  ? 30.934  5.357   33.381  1.000 68.164  0 91   GLU   A HB2  1 c 1 
ATOM   512   H  HB3  . GLU   A  1  36  ? 30.450  4.923   34.824  1.000 68.824  0 91   GLU   A HB3  1 c 1 
ATOM   513   H  HG2  . GLU   A  1  36  ? 30.660  2.625   34.113  1.000 78.453  0 91   GLU   A HG2  1 c 1 
ATOM   514   H  HG3  . GLU   A  1  36  ? 31.329  3.151   32.781  1.000 78.064  0 91   GLU   A HG3  1 c 1 
ATOM   515   N  N    . LEU   A  1  37  ? 28.746  6.716   32.134  1.000 42.427  0 92   LEU   A N    1 ? 1 
ATOM   516   C  CA   . LEU   A  1  37  ? 28.388  8.113   31.932  1.000 40.339  0 92   LEU   A CA   1 ? 1 
ATOM   517   C  C    . LEU   A  1  37  ? 27.080  8.305   31.167  1.000 45.788  0 92   LEU   A C    1 ? 1 
ATOM   518   O  O    . LEU   A  1  37  ? 26.332  9.228   31.493  1.000 42.968  0 92   LEU   A O    1 ? 1 
ATOM   519   C  CB   . LEU   A  1  37  ? 29.495  8.854   31.177  1.000 44.120  0 92   LEU   A CB   1 ? 1 
ATOM   520   C  CG   . LEU   A  1  37  ? 30.695  9.331   32.006  1.000 52.787  0 92   LEU   A CG   1 ? 1 
ATOM   521   C  CD1  . LEU   A  1  37  ? 31.213  8.242   32.941  1.000 55.481  0 92   LEU   A CD1  1 ? 1 
ATOM   522   C  CD2  . LEU   A  1  37  ? 31.803  9.810   31.105  1.000 67.429  0 92   LEU   A CD2  1 ? 1 
ATOM   523   H  H    . LEU   A  1  37  ? 29.217  6.288   31.478  1.000 42.480  0 92   LEU   A H    1 c 1 
ATOM   524   H  HA   . LEU   A  1  37  ? 28.285  8.527   32.818  1.000 42.902  0 92   LEU   A HA   1 c 1 
ATOM   525   H  HB2  . LEU   A  1  37  ? 29.826  8.266   30.469  1.000 44.708  0 92   LEU   A HB2  1 c 1 
ATOM   526   H  HB3  . LEU   A  1  37  ? 29.097  9.635   30.743  1.000 44.449  0 92   LEU   A HB3  1 c 1 
ATOM   527   H  HG   . LEU   A  1  37  ? 30.400  10.095  32.561  1.000 53.962  0 92   LEU   A HG   1 c 1 
ATOM   528   H  HD11 . LEU   A  1  37  ? 32.026  8.550   33.378  1.000 55.579  0 92   LEU   A HD11 1 c 1 
ATOM   529   H  HD12 . LEU   A  1  37  ? 31.406  7.439   32.428  1.000 54.716  0 92   LEU   A HD12 1 c 1 
ATOM   530   H  HD13 . LEU   A  1  37  ? 30.540  8.043   33.615  1.000 54.584  0 92   LEU   A HD13 1 c 1 
ATOM   531   H  HD21 . LEU   A  1  37  ? 31.475  10.532  30.543  1.000 62.034  0 92   LEU   A HD21 1 c 1 
ATOM   532   H  HD22 . LEU   A  1  37  ? 32.107  9.075   30.544  1.000 62.435  0 92   LEU   A HD22 1 c 1 
ATOM   533   H  HD23 . LEU   A  1  37  ? 32.546  10.132  31.646  1.000 63.287  0 92   LEU   A HD23 1 c 1 
ATOM   534   N  N    . CYS   A  1  38  ? 26.833  7.454   30.155  1.000 46.715  0 93   CYS   A N    1 ? 1 
ATOM   535   C  CA   . CYS   A  1  38  ? 25.715  7.624   29.231  1.000 53.410  0 93   CYS   A CA   1 ? 1 
ATOM   536   C  C    . CYS   A  1  38  ? 24.499  6.752   29.549  1.000 51.432  0 93   CYS   A C    1 ? 1 
ATOM   537   O  O    . CYS   A  1  38  ? 23.384  7.069   29.120  1.000 38.499  0 93   CYS   A O    1 ? 1 
ATOM   538   C  CB   . CYS   A  1  38  ? 26.151  7.373   27.784  1.000 47.018  0 93   CYS   A CB   1 ? 1 
ATOM   539   S  SG   . CYS   A  1  38  ? 27.758  8.052   27.344  1.000 40.370  0 93   CYS   A SG   1 ? 1 
ATOM   540   H  H    . CYS   A  1  38  ? 27.392  6.741   30.032  1.000 47.879  0 93   CYS   A H    1 c 1 
ATOM   541   H  HA   . CYS   A  1  38  ? 25.428  8.564   29.292  1.000 50.104  0 93   CYS   A HA   1 c 1 
ATOM   542   H  HB2  . CYS   A  1  38  ? 26.173  6.408   27.624  1.000 46.614  0 93   CYS   A HB2  1 c 1 
ATOM   543   H  HB3  . CYS   A  1  38  ? 25.482  7.758   27.182  1.000 46.062  0 93   CYS   A HB3  1 c 1 
ATOM   544   N  N    . LEU   A  1  39  ? 24.720  5.628   30.246  1.000 39.753  0 94   LEU   A N    1 ? 1 
ATOM   545   C  CA   . LEU   A  1  39  ? 23.616  4.759   30.608  1.000 37.129  0 94   LEU   A CA   1 ? 1 
ATOM   546   C  C    . LEU   A  1  39  ? 23.401  4.701   32.120  1.000 40.904  0 94   LEU   A C    1 ? 1 
ATOM   547   O  O    . LEU   A  1  39  ? 23.214  3.620   32.662  1.000 42.243  0 94   LEU   A O    1 ? 1 
ATOM   548   C  CB   . LEU   A  1  39  ? 23.866  3.357   30.043  1.000 35.727  0 94   LEU   A CB   1 ? 1 
ATOM   549   C  CG   . LEU   A  1  39  ? 24.078  3.261   28.528  1.000 38.321  0 94   LEU   A CG   1 ? 1 
ATOM   550   C  CD1  . LEU   A  1  39  ? 24.277  1.860   28.130  1.000 37.347  0 94   LEU   A CD1  1 ? 1 
ATOM   551   C  CD2  . LEU   A  1  39  ? 22.914  3.822   27.737  1.000 41.223  0 94   LEU   A CD2  1 ? 1 
ATOM   552   H  H    . LEU   A  1  39  ? 25.569  5.396   30.494  1.000 42.294  0 94   LEU   A H    1 c 1 
ATOM   553   H  HA   . LEU   A  1  39  ? 22.796  5.121   30.202  1.000 37.418  0 94   LEU   A HA   1 c 1 
ATOM   554   H  HB2  . LEU   A  1  39  ? 24.654  2.986   30.487  1.000 37.383  0 94   LEU   A HB2  1 c 1 
ATOM   555   H  HB3  . LEU   A  1  39  ? 23.104  2.792   30.280  1.000 36.514  0 94   LEU   A HB3  1 c 1 
ATOM   556   H  HG   . LEU   A  1  39  ? 24.891  3.772   28.292  1.000 38.455  0 94   LEU   A HG   1 c 1 
ATOM   557   H  HD11 . LEU   A  1  39  ? 24.380  1.804   27.166  1.000 37.266  0 94   LEU   A HD11 1 c 1 
ATOM   558   H  HD12 . LEU   A  1  39  ? 23.505  1.333   28.404  1.000 37.420  0 94   LEU   A HD12 1 c 1 
ATOM   559   H  HD13 . LEU   A  1  39  ? 25.076  1.511   28.563  1.000 38.309  0 94   LEU   A HD13 1 c 1 
ATOM   560   H  HD21 . LEU   A  1  39  ? 22.828  4.775   27.913  1.000 39.909  0 94   LEU   A HD21 1 c 1 
ATOM   561   H  HD22 . LEU   A  1  39  ? 22.094  3.369   28.000  1.000 39.720  0 94   LEU   A HD22 1 c 1 
ATOM   562   H  HD23 . LEU   A  1  39  ? 23.070  3.683   26.787  1.000 39.533  0 94   LEU   A HD23 1 c 1 
ATOM   563   N  N    . LYS   A  1  40  ? 23.374  5.865   32.789  1.000 41.071  0 95   LYS   A N    1 ? 1 
ATOM   564   C  CA   . LYS   A  1  40  ? 23.089  5.929   34.218  1.000 46.152  0 95   LYS   A CA   1 ? 1 
ATOM   565   C  C    . LYS   A  1  40  ? 21.632  5.574   34.520  1.000 42.279  0 95   LYS   A C    1 ? 1 
ATOM   566   O  O    . LYS   A  1  40  ? 20.724  6.030   33.828  1.000 38.416  0 95   LYS   A O    1 ? 1 
ATOM   567   C  CB   . LYS   A  1  40  ? 23.385  7.327   34.765  1.000 43.785  0 95   LYS   A CB   1 ? 1 
ATOM   568   C  CG   . LYS   A  1  40  ? 24.843  7.749   34.646  1.000 47.885  0 95   LYS   A CG   1 ? 1 
ATOM   569   C  CD   . LYS   A  1  40  ? 25.092  9.201   35.094  1.000 52.275  0 95   LYS   A CD   1 ? 1 
ATOM   570   C  CE   . LYS   A  1  40  ? 26.555  9.561   34.968  1.000 56.136  0 95   LYS   A CE   1 ? 1 
ATOM   571   N  NZ   . LYS   A  1  40  ? 26.836  10.896  35.522  1.000 66.516  0 95   LYS   A NZ   1 ? 1 
ATOM   572   H  H    . LYS   A  1  40  ? 23.530  6.644   32.337  1.000 41.935  0 95   LYS   A H    1 c 1 
ATOM   573   H  HA   . LYS   A  1  40  ? 23.673  5.282   34.677  1.000 44.421  0 95   LYS   A HA   1 c 1 
ATOM   574   H  HB2  . LYS   A  1  40  ? 22.830  7.975   34.282  1.000 44.657  0 95   LYS   A HB2  1 c 1 
ATOM   575   H  HB3  . LYS   A  1  40  ? 23.126  7.354   35.710  1.000 45.543  0 95   LYS   A HB3  1 c 1 
ATOM   576   H  HG2  . LYS   A  1  40  ? 25.390  7.148   35.195  1.000 48.375  0 95   LYS   A HG2  1 c 1 
ATOM   577   H  HG3  . LYS   A  1  40  ? 25.131  7.648   33.715  1.000 47.517  0 95   LYS   A HG3  1 c 1 
ATOM   578   H  HD2  . LYS   A  1  40  ? 24.558  9.810   34.540  1.000 51.515  0 95   LYS   A HD2  1 c 1 
ATOM   579   H  HD3  . LYS   A  1  40  ? 24.811  9.306   36.028  1.000 52.290  0 95   LYS   A HD3  1 c 1 
ATOM   580   H  HE2  . LYS   A  1  40  ? 27.097  8.901   35.440  1.000 57.906  0 95   LYS   A HE2  1 c 1 
ATOM   581   H  HE3  . LYS   A  1  40  ? 26.813  9.550   34.029  1.000 56.899  0 95   LYS   A HE3  1 c 1 
ATOM   582   H  HZ1  . LYS   A  1  40  ? 26.613  10.916  36.400  1.000 63.365  0 95   LYS   A HZ1  1 c 1 
ATOM   583   H  HZ2  . LYS   A  1  40  ? 26.351  11.521  35.078  1.000 62.769  0 95   LYS   A HZ2  1 c 1 
ATOM   584   H  HZ3  . LYS   A  1  40  ? 27.718  11.086  35.434  1.000 63.618  0 95   LYS   A HZ3  1 c 1 
ATOM   585   N  N    . THR   A  1  41  ? 21.416  4.753   35.548  1.000 34.001  0 96   THR   A N    1 ? 1 
ATOM   586   C  CA   . THR   A  1  41  ? 20.076  4.312   35.899  1.000 39.426  0 96   THR   A CA   1 ? 1 
ATOM   587   C  C    . THR   A  1  41  ? 19.710  4.571   37.355  1.000 37.718  0 96   THR   A C    1 ? 1 
ATOM   588   O  O    . THR   A  1  41  ? 18.540  4.440   37.713  1.000 32.058  0 96   THR   A O    1 ? 1 
ATOM   589   C  CB   . THR   A  1  41  ? 19.886  2.807   35.590  1.000 42.338  0 96   THR   A CB   1 ? 1 
ATOM   590   O  OG1  . THR   A  1  41  ? 20.888  2.087   36.299  1.000 40.773  0 96   THR   A OG1  1 ? 1 
ATOM   591   C  CG2  . THR   A  1  41  ? 19.941  2.507   34.107  1.000 40.887  0 96   THR   A CG2  1 ? 1 
ATOM   592   H  H    . THR   A  1  41  ? 22.127  4.437   36.028  1.000 37.718  0 96   THR   A H    1 c 1 
ATOM   593   H  HA   . THR   A  1  41  ? 19.442  4.814   35.338  1.000 37.671  0 96   THR   A HA   1 c 1 
ATOM   594   H  HB   . THR   A  1  41  ? 19.001  2.534   35.931  1.000 40.942  0 96   THR   A HB   1 c 1 
ATOM   595   H  HG1  . THR   A  1  41  ? 21.652  2.343   36.036  0.000 20.180  0 96   THR   A HG1  1 c 1 
ATOM   596   H  HG21 . THR   A  1  41  ? 19.810  1.553   33.963  1.000 41.002  0 96   THR   A HG21 1 c 1 
ATOM   597   H  HG22 . THR   A  1  41  ? 20.808  2.772   33.753  1.000 41.170  0 96   THR   A HG22 1 c 1 
ATOM   598   H  HG23 . THR   A  1  41  ? 19.238  3.002   33.649  1.000 40.552  0 96   THR   A HG23 1 c 1 
ATOM   599   N  N    . ALA   A  1  42  ? 20.702  4.951   38.176  1.000 40.455  0 97   ALA   A N    1 ? 1 
ATOM   600   C  CA   . ALA   A  1  42  ? 20.483  5.139   39.599  1.000 37.812  0 97   ALA   A CA   1 ? 1 
ATOM   601   C  C    . ALA   A  1  42  ? 19.280  6.052   39.839  1.000 44.603  0 97   ALA   A C    1 ? 1 
ATOM   602   O  O    . ALA   A  1  42  ? 19.163  7.133   39.242  1.000 41.144  0 97   ALA   A O    1 ? 1 
ATOM   603   C  CB   . ALA   A  1  42  ? 21.734  5.695   40.267  1.000 35.411  0 97   ALA   A CB   1 ? 1 
ATOM   604   H  H    . ALA   A  1  42  ? 21.537  5.102   37.839  1.000 39.232  0 97   ALA   A H    1 c 1 
ATOM   605   H  HA   . ALA   A  1  42  ? 20.287  4.258   39.995  1.000 38.971  0 97   ALA   A HA   1 c 1 
ATOM   606   H  HB1  . ALA   A  1  42  ? 21.588  5.761   41.226  1.000 36.870  0 97   ALA   A HB1  1 c 1 
ATOM   607   H  HB2  . ALA   A  1  42  ? 22.485  5.103   40.095  1.000 36.522  0 97   ALA   A HB2  1 c 1 
ATOM   608   H  HB3  . ALA   A  1  42  ? 21.928  6.576   39.910  1.000 36.191  0 97   ALA   A HB3  1 c 1 
ATOM   609   N  N    . ARG   A  1  43  ? 18.361  5.541   40.668  1.000 31.695  0 98   ARG   A N    1 ? 1 
ATOM   610   C  CA   . ARG   A  1  43  ? 17.192  6.242   41.172  1.000 33.614  0 98   ARG   A CA   1 ? 1 
ATOM   611   C  C    . ARG   A  1  43  ? 16.081  6.435   40.144  1.000 31.713  0 98   ARG   A C    1 ? 1 
ATOM   612   O  O    . ARG   A  1  43  ? 15.142  7.163   40.432  1.000 35.064  0 98   ARG   A O    1 ? 1 
ATOM   613   C  CB   . ARG   A  1  43  ? 17.583  7.591   41.783  1.000 33.487  0 98   ARG   A CB   1 ? 1 
ATOM   614   C  CG   . ARG   A  1  43  ? 18.398  7.433   43.054  1.000 37.773  0 98   ARG   A CG   1 ? 1 
ATOM   615   C  CD   . ARG   A  1  43  ? 17.580  7.721   44.265  1.000 48.044  0 98   ARG   A CD   1 ? 1 
ATOM   616   N  NE   . ARG   A  1  43  ? 17.711  9.125   44.636  1.000 46.225  0 98   ARG   A NE   1 ? 1 
ATOM   617   C  CZ   . ARG   A  1  43  ? 17.019  9.736   45.588  1.000 45.120  0 98   ARG   A CZ   1 ? 1 
ATOM   618   N  NH1  . ARG   A  1  43  ? 15.854  9.265   46.008  1.000 47.727  0 98   ARG   A NH1  1 ? 1 
ATOM   619   N  NH2  . ARG   A  1  43  ? 17.497  10.865  46.114  1.000 52.314  0 98   ARG   A NH2  1 ? 1 
ATOM   620   H  H    . ARG   A  1  43  ? 18.476  4.676   40.939  1.000 34.844  0 98   ARG   A H    1 c 1 
ATOM   621   H  HA   . ARG   A  1  43  ? 16.821  5.689   41.897  1.000 33.282  0 98   ARG   A HA   1 c 1 
ATOM   622   H  HB2  . ARG   A  1  43  ? 18.102  8.102   41.131  1.000 34.185  0 98   ARG   A HB2  1 c 1 
ATOM   623   H  HB3  . ARG   A  1  43  ? 16.769  8.098   41.985  1.000 34.373  0 98   ARG   A HB3  1 c 1 
ATOM   624   H  HG2  . ARG   A  1  43  ? 18.741  6.516   43.111  1.000 38.886  0 98   ARG   A HG2  1 c 1 
ATOM   625   H  HG3  . ARG   A  1  43  ? 19.164  8.041   43.030  1.000 39.113  0 98   ARG   A HG3  1 c 1 
ATOM   626   H  HD2  . ARG   A  1  43  ? 16.641  7.516   44.081  1.000 44.511  0 98   ARG   A HD2  1 c 1 
ATOM   627   H  HD3  . ARG   A  1  43  ? 17.879  7.154   45.007  1.000 45.509  0 98   ARG   A HD3  1 c 1 
ATOM   628   H  HE   . ARG   A  1  43  ? 18.289  9.607   44.194  1.000 46.130  0 98   ARG   A HE   1 c 1 
ATOM   629   H  HH11 . ARG   A  1  43  ? 15.388  8.718   45.495  1.000 46.373  0 98   ARG   A HH11 1 c 1 
ATOM   630   H  HH12 . ARG   A  1  43  ? 15.545  9.505   46.800  1.000 47.460  0 98   ARG   A HH12 1 c 1 
ATOM   631   H  HH21 . ARG   A  1  43  ? 17.131  11.200  46.839  1.000 50.314  0 98   ARG   A HH21 1 c 1 
ATOM   632   H  HH22 . ARG   A  1  43  ? 18.177  11.273  45.734  1.000 49.963  0 98   ARG   A HH22 1 c 1 
ATOM   633   N  N    . GLY   A  1  44  ? 16.182  5.766   38.993  1.000 29.415  0 99   GLY   A N    1 ? 1 
ATOM   634   C  CA   . GLY   A  1  44  ? 15.114  5.768   37.997  1.000 31.659  0 99   GLY   A CA   1 ? 1 
ATOM   635   C  C    . GLY   A  1  44  ? 14.976  7.084   37.230  1.000 30.084  0 99   GLY   A C    1 ? 1 
ATOM   636   O  O    . GLY   A  1  44  ? 15.910  7.879   37.162  1.000 28.387  0 99   GLY   A O    1 ? 1 
ATOM   637   H  H    . GLY   A  1  44  ? 16.937  5.283   38.819  1.000 30.607  0 99   GLY   A H    1 c 1 
ATOM   638   H  HA2  . GLY   A  1  44  ? 15.285  5.037   37.351  1.000 30.275  0 99   GLY   A HA2  1 c 1 
ATOM   639   H  HA3  . GLY   A  1  44  ? 14.260  5.567   38.451  1.000 30.791  0 99   GLY   A HA3  1 c 1 
ATOM   640   N  N    . TRP   A  1  45  ? 13.781  7.321   36.684  1.000 31.033  0 100  TRP   A N    1 ? 1 
ATOM   641   C  CA   . TRP   A  1  45  ? 13.565  8.359   35.698  1.000 30.186  0 100  TRP   A CA   1 ? 1 
ATOM   642   C  C    . TRP   A  1  45  ? 12.581  9.432   36.131  1.000 27.502  0 100  TRP   A C    1 ? 1 
ATOM   643   O  O    . TRP   A  1  45  ? 12.241  10.285  35.321  1.000 26.971  0 100  TRP   A O    1 ? 1 
ATOM   644   C  CB   . TRP   A  1  45  ? 13.094  7.705   34.398  1.000 27.287  0 100  TRP   A CB   1 ? 1 
ATOM   645   C  CG   . TRP   A  1  45  ? 13.988  6.592   34.010  1.000 34.150  0 100  TRP   A CG   1 ? 1 
ATOM   646   C  CD1  . TRP   A  1  45  ? 13.769  5.253   34.204  1.000 38.161  0 100  TRP   A CD1  1 ? 1 
ATOM   647   C  CD2  . TRP   A  1  45  ? 15.279  6.705   33.387  1.000 31.647  0 100  TRP   A CD2  1 ? 1 
ATOM   648   N  NE1  . TRP   A  1  45  ? 14.843  4.525   33.722  1.000 39.652  0 100  TRP   A NE1  1 ? 1 
ATOM   649   C  CE2  . TRP   A  1  45  ? 15.786  5.393   33.230  1.000 34.281  0 100  TRP   A CE2  1 ? 1 
ATOM   650   C  CE3  . TRP   A  1  45  ? 16.043  7.775   32.938  1.000 27.350  0 100  TRP   A CE3  1 ? 1 
ATOM   651   C  CZ2  . TRP   A  1  45  ? 17.014  5.144   32.652  1.000 36.314  0 100  TRP   A CZ2  1 ? 1 
ATOM   652   C  CZ3  . TRP   A  1  45  ? 17.245  7.517   32.347  1.000 29.148  0 100  TRP   A CZ3  1 ? 1 
ATOM   653   C  CH2  . TRP   A  1  45  ? 17.719  6.220   32.205  1.000 30.206  0 100  TRP   A CH2  1 ? 1 
ATOM   654   H  H    . TRP   A  1  45  ? 13.070  6.805   36.935  1.000 30.541  0 100  TRP   A H    1 c 1 
ATOM   655   H  HA   . TRP   A  1  45  ? 14.432  8.787   35.515  1.000 29.412  0 100  TRP   A HA   1 c 1 
ATOM   656   H  HB2  . TRP   A  1  45  ? 12.184  7.368   34.524  1.000 28.979  0 100  TRP   A HB2  1 c 1 
ATOM   657   H  HB3  . TRP   A  1  45  ? 13.080  8.379   33.689  1.000 28.783  0 100  TRP   A HB3  1 c 1 
ATOM   658   H  HD1  . TRP   A  1  45  ? 13.005  4.876   34.614  1.000 37.320  0 100  TRP   A HD1  1 c 1 
ATOM   659   H  HE1  . TRP   A  1  45  ? 14.920  3.652   33.754  1.000 37.738  0 100  TRP   A HE1  1 c 1 
ATOM   660   H  HE3  . TRP   A  1  45  ? 15.731  8.661   33.031  1.000 28.819  0 100  TRP   A HE3  1 c 1 
ATOM   661   H  HZ2  . TRP   A  1  45  ? 17.329  4.264   32.533  1.000 34.225  0 100  TRP   A HZ2  1 c 1 
ATOM   662   H  HZ3  . TRP   A  1  45  ? 17.780  8.237   32.053  1.000 29.137  0 100  TRP   A HZ3  1 c 1 
ATOM   663   H  HH2  . TRP   A  1  45  ? 18.562  6.081   31.810  1.000 31.340  0 100  TRP   A HH2  1 c 1 
ATOM   664   N  N    . GLU   A  1  46  ? 12.168  9.386   37.401  1.000 29.696  0 101  GLU   A N    1 ? 1 
ATOM   665   C  CA   . GLU   A  1  46  ? 11.159  10.288  37.932  1.000 35.517  0 101  GLU   A CA   1 ? 1 
ATOM   666   C  C    . GLU   A  1  46  ? 11.641  10.990  39.190  1.000 34.260  0 101  GLU   A C    1 ? 1 
ATOM   667   O  O    . GLU   A  1  46  ? 12.048  10.330  40.132  1.000 33.750  0 101  GLU   A O    1 ? 1 
ATOM   668   C  CB   . GLU   A  1  46  ? 9.882   9.533   38.304  1.000 35.938  0 101  GLU   A CB   1 ? 1 
ATOM   669   C  CG   . GLU   A  1  46  ? 9.190   8.868   37.125  1.000 38.681  0 101  GLU   A CG   1 ? 1 
ATOM   670   C  CD   . GLU   A  1  46  ? 7.936   8.126   37.530  1.000 40.361  0 101  GLU   A CD   1 ? 1 
ATOM   671   O  OE1  . GLU   A  1  46  ? 7.461   8.375   38.655  1.000 47.755  0 101  GLU   A OE1  1 ? 1 
ATOM   672   O  OE2  . GLU   A  1  46  ? 7.432   7.294   36.745  1.000 47.640  0 101  GLU   A OE2  1 ? 1 
ATOM   673   H  H    . GLU   A  1  46  ? 12.537  8.770   37.966  1.000 30.763  0 101  GLU   A H    1 c 1 
ATOM   674   H  HA   . GLU   A  1  46  ? 10.944  10.963  37.249  1.000 33.463  0 101  GLU   A HA   1 c 1 
ATOM   675   H  HB2  . GLU   A  1  46  ? 10.106  8.848   38.968  1.000 37.085  0 101  GLU   A HB2  1 c 1 
ATOM   676   H  HB3  . GLU   A  1  46  ? 9.260   10.164  38.723  1.000 36.896  0 101  GLU   A HB3  1 c 1 
ATOM   677   H  HG2  . GLU   A  1  46  ? 8.955   9.550   36.462  1.000 37.893  0 101  GLU   A HG2  1 c 1 
ATOM   678   H  HG3  . GLU   A  1  46  ? 9.808   8.236   36.700  1.000 37.895  0 101  GLU   A HG3  1 c 1 
ATOM   679   N  N    . CYS   A  1  47  ? 11.545  12.321  39.216  1.000 31.548  0 102  CYS   A N    1 ? 1 
ATOM   680   C  CA   . CYS   A  1  47  ? 11.711  13.050  40.462  1.000 34.686  0 102  CYS   A CA   1 ? 1 
ATOM   681   C  C    . CYS   A  1  47  ? 10.628  12.613  41.444  1.000 33.631  0 102  CYS   A C    1 ? 1 
ATOM   682   O  O    . CYS   A  1  47  ? 9.502   12.355  41.052  1.000 34.266  0 102  CYS   A O    1 ? 1 
ATOM   683   C  CB   . CYS   A  1  47  ? 11.679  14.565  40.240  1.000 37.788  0 102  CYS   A CB   1 ? 1 
ATOM   684   S  SG   . CYS   A  1  47  ? 13.167  15.223  39.427  1.000 45.729  0 102  CYS   A SG   1 ? 1 
ATOM   685   H  H    . CYS   A  1  47  ? 11.391  12.785  38.444  1.000 32.282  0 102  CYS   A H    1 c 1 
ATOM   686   H  HA   . CYS   A  1  47  ? 12.588  12.809  40.837  1.000 34.762  0 102  CYS   A HA   1 c 1 
ATOM   687   H  HB2  . CYS   A  1  47  ? 10.901  14.790  39.691  1.000 37.850  0 102  CYS   A HB2  1 c 1 
ATOM   688   H  HB3  . CYS   A  1  47  ? 11.576  15.012  41.104  1.000 38.891  0 102  CYS   A HB3  1 c 1 
ATOM   689   N  N    . THR   A  1  48  ? 10.988  12.525  42.719  1.000 31.979  0 103  THR   A N    1 ? 1 
ATOM   690   C  CA   . THR   A  1  48  ? 10.016  12.380  43.785  1.000 35.714  0 103  THR   A CA   1 ? 1 
ATOM   691   C  C    . THR   A  1  48  ? 10.194  13.613  44.665  1.000 35.302  0 103  THR   A C    1 ? 1 
ATOM   692   O  O    . THR   A  1  48  ? 11.222  14.279  44.575  1.000 33.560  0 103  THR   A O    1 ? 1 
ATOM   693   C  CB   . THR   A  1  48  ? 10.256  11.076  44.539  1.000 38.911  0 103  THR   A CB   1 ? 1 
ATOM   694   O  OG1  . THR   A  1  48  ? 11.584  11.115  45.062  1.000 38.917  0 103  THR   A OG1  1 ? 1 
ATOM   695   C  CG2  . THR   A  1  48  ? 10.060  9.819   43.648  1.000 40.045  0 103  THR   A CG2  1 ? 1 
ATOM   696   H  H    . THR   A  1  48  ? 11.875  12.555  42.937  1.000 33.551  0 103  THR   A H    1 c 1 
ATOM   697   H  HA   . THR   A  1  48  ? 9.109   12.378  43.401  1.000 34.904  0 103  THR   A HA   1 c 1 
ATOM   698   H  HB   . THR   A  1  48  ? 9.619   11.034  45.291  1.000 39.033  0 103  THR   A HB   1 c 1 
ATOM   699   H  HG1  . THR   A  1  48  ? 12.149  11.195  44.426  0.000 15.080  0 103  THR   A HG1  1 c 1 
ATOM   700   H  HG21 . THR   A  1  48  ? 10.200  9.017   44.182  1.000 39.788  0 103  THR   A HG21 1 c 1 
ATOM   701   H  HG22 . THR   A  1  48  ? 10.701  9.835   42.915  1.000 38.996  0 103  THR   A HG22 1 c 1 
ATOM   702   H  HG23 . THR   A  1  48  ? 9.156   9.814   43.287  1.000 39.101  0 103  THR   A HG23 1 c 1 
ATOM   703   N  N    . LYS   A  1  49  ? 9.204   13.897  45.526  1.000 37.427  0 104  LYS   A N    1 ? 1 
ATOM   704   C  CA   . LYS   A  1  49  ? 9.179   15.137  46.293  1.000 44.228  0 104  LYS   A CA   1 ? 1 
ATOM   705   C  C    . LYS   A  1  49  ? 10.380  15.250  47.226  1.000 43.363  0 104  LYS   A C    1 ? 1 
ATOM   706   O  O    . LYS   A  1  49  ? 10.845  16.348  47.469  1.000 43.176  0 104  LYS   A O    1 ? 1 
ATOM   707   C  CB   . LYS   A  1  49  ? 7.872   15.313  47.113  1.000 47.120  0 104  LYS   A CB   1 ? 1 
ATOM   708   C  CG   . LYS   A  1  49  ? 6.704   15.831  46.276  1.000 67.904  0 104  LYS   A CG   1 ? 1 
ATOM   709   C  CD   . LYS   A  1  49  ? 5.417   16.023  47.066  1.000 87.735  0 104  LYS   A CD   1 ? 1 
ATOM   710   C  CE   . LYS   A  1  49  ? 5.491   17.173  48.037  1.000 101.422 0 104  LYS   A CE   1 ? 1 
ATOM   711   N  NZ   . LYS   A  1  49  ? 4.177   17.414  48.677  1.000 102.324 0 104  LYS   A NZ   1 ? 1 
ATOM   712   H  H    . LYS   A  1  49  ? 8.523   13.297  45.637  1.000 38.231  0 104  LYS   A H    1 c 1 
ATOM   713   H  HA   . LYS   A  1  49  ? 9.231   15.879  45.649  1.000 42.668  0 104  LYS   A HA   1 c 1 
ATOM   714   H  HB2  . LYS   A  1  49  ? 7.625   14.449  47.503  1.000 50.459  0 104  LYS   A HB2  1 c 1 
ATOM   715   H  HB3  . LYS   A  1  49  ? 8.041   15.941  47.846  1.000 51.355  0 104  LYS   A HB3  1 c 1 
ATOM   716   H  HG2  . LYS   A  1  49  ? 6.961   16.689  45.875  1.000 64.801  0 104  LYS   A HG2  1 c 1 
ATOM   717   H  HG3  . LYS   A  1  49  ? 6.537   15.199  45.545  1.000 64.228  0 104  LYS   A HG3  1 c 1 
ATOM   718   H  HD2  . LYS   A  1  49  ? 4.678   16.182  46.441  1.000 84.795  0 104  LYS   A HD2  1 c 1 
ATOM   719   H  HD3  . LYS   A  1  49  ? 5.221   15.200  47.563  1.000 85.443  0 104  LYS   A HD3  1 c 1 
ATOM   720   H  HE2  . LYS   A  1  49  ? 6.151   16.979  48.729  1.000 97.893  0 104  LYS   A HE2  1 c 1 
ATOM   721   H  HE3  . LYS   A  1  49  ? 5.770   17.982  47.568  1.000 98.042  0 104  LYS   A HE3  1 c 1 
ATOM   722   H  HZ1  . LYS   A  1  49  ? 3.903   16.664  49.106  1.000 102.401 0 104  LYS   A HZ1  1 c 1 
ATOM   723   H  HZ2  . LYS   A  1  49  ? 3.564   17.636  48.046  1.000 101.806 0 104  LYS   A HZ2  1 c 1 
ATOM   724   H  HZ3  . LYS   A  1  49  ? 4.246   18.091  49.276  1.000 102.863 0 104  LYS   A HZ3  1 c 1 
ATOM   725   N  N    . ASP   A  1  50  ? 10.869  14.109  47.732  1.000 42.513  0 105  ASP   A N    1 ? 1 
ATOM   726   C  CA   . ASP   A  1  50  ? 12.021  14.084  48.616  1.000 42.329  0 105  ASP   A CA   1 ? 1 
ATOM   727   C  C    . ASP   A  1  50  ? 13.322  14.367  47.877  1.000 38.335  0 105  ASP   A C    1 ? 1 
ATOM   728   O  O    . ASP   A  1  50  ? 14.326  14.651  48.519  1.000 38.101  0 105  ASP   A O    1 ? 1 
ATOM   729   C  CB   . ASP   A  1  50  ? 12.130  12.749  49.359  1.000 43.106  0 105  ASP   A CB   1 ? 1 
ATOM   730   C  CG   . ASP   A  1  50  ? 12.279  11.555  48.419  1.000 66.920  0 105  ASP   A CG   1 ? 1 
ATOM   731   O  OD1  . ASP   A  1  50  ? 11.254  11.140  47.810  1.000 67.113  0 105  ASP   A OD1  1 ? 1 
ATOM   732   O  OD2  . ASP   A  1  50  ? 13.423  11.049  48.269  1.000 70.768  0 105  ASP   A OD2  1 ? 1 
ATOM   733   H  H    . ASP   A  1  50  ? 10.459  13.319  47.525  1.000 42.255  0 105  ASP   A H    1 c 1 
ATOM   734   H  HA   . ASP   A  1  50  ? 11.895  14.791  49.293  1.000 42.485  0 105  ASP   A HA   1 c 1 
ATOM   735   H  HB2  . ASP   A  1  50  ? 12.907  12.775  49.955  1.000 47.867  0 105  ASP   A HB2  1 c 1 
ATOM   736   H  HB3  . ASP   A  1  50  ? 11.328  12.618  49.905  1.000 47.482  0 105  ASP   A HB3  1 c 1 
ATOM   737   N  N    . ARG   A  1  51  ? 13.317  14.289  46.540  1.000 34.206  0 106  ARG   A N    1 ? 1 
ATOM   738   C  CA   . ARG   A  1  51  ? 14.492  14.679  45.764  1.000 36.142  0 106  ARG   A CA   1 ? 1 
ATOM   739   C  C    . ARG   A  1  51  ? 14.530  16.157  45.364  1.000 34.556  0 106  ARG   A C    1 ? 1 
ATOM   740   O  O    . ARG   A  1  51  ? 15.568  16.639  44.905  1.000 34.552  0 106  ARG   A O    1 ? 1 
ATOM   741   C  CB   . ARG   A  1  51  ? 14.607  13.853  44.486  1.000 33.864  0 106  ARG   A CB   1 ? 1 
ATOM   742   C  CG   . ARG   A  1  51  ? 14.798  12.369  44.748  1.000 33.511  0 106  ARG   A CG   1 ? 1 
ATOM   743   C  CD   . ARG   A  1  51  ? 15.109  11.626  43.515  1.000 29.760  0 106  ARG   A CD   1 ? 1 
ATOM   744   N  NE   . ARG   A  1  51  ? 16.336  12.124  42.919  1.000 28.898  0 106  ARG   A NE   1 ? 1 
ATOM   745   C  CZ   . ARG   A  1  51  ? 16.754  11.838  41.694  1.000 25.307  0 106  ARG   A CZ   1 ? 1 
ATOM   746   N  NH1  . ARG   A  1  51  ? 16.201  10.875  40.984  1.000 24.945  0 106  ARG   A NH1  1 ? 1 
ATOM   747   N  NH2  . ARG   A  1  51  ? 17.782  12.514  41.182  1.000 24.472  0 106  ARG   A NH2  1 ? 1 
ATOM   748   H  H    . ARG   A  1  51  ? 12.582  13.973  46.101  1.000 34.978  0 106  ARG   A H    1 c 1 
ATOM   749   H  HA   . ARG   A  1  51  ? 15.288  14.495  46.313  1.000 35.715  0 106  ARG   A HA   1 c 1 
ATOM   750   H  HB2  . ARG   A  1  51  ? 13.792  13.980  43.956  1.000 33.514  0 106  ARG   A HB2  1 c 1 
ATOM   751   H  HB3  . ARG   A  1  51  ? 15.362  14.188  43.962  1.000 33.806  0 106  ARG   A HB3  1 c 1 
ATOM   752   H  HG2  . ARG   A  1  51  ? 15.528  12.245  45.389  1.000 33.623  0 106  ARG   A HG2  1 c 1 
ATOM   753   H  HG3  . ARG   A  1  51  ? 13.981  12.001  45.146  1.000 32.955  0 106  ARG   A HG3  1 c 1 
ATOM   754   H  HD2  . ARG   A  1  51  ? 15.205  10.672  43.720  1.000 30.245  0 106  ARG   A HD2  1 c 1 
ATOM   755   H  HD3  . ARG   A  1  51  ? 14.371  11.728  42.876  1.000 29.560  0 106  ARG   A HD3  1 c 1 
ATOM   756   H  HE   . ARG   A  1  51  ? 16.848  12.632  43.409  1.000 28.833  0 106  ARG   A HE   1 c 1 
ATOM   757   H  HH11 . ARG   A  1  51  ? 15.796  10.204  41.392  1.000 24.951  0 106  ARG   A HH11 1 c 1 
ATOM   758   H  HH12 . ARG   A  1  51  ? 16.241  10.902  40.102  1.000 24.277  0 106  ARG   A HH12 1 c 1 
ATOM   759   H  HH21 . ARG   A  1  51  ? 17.920  12.508  40.312  1.000 24.250  0 106  ARG   A HH21 1 c 1 
ATOM   760   H  HH22 . ARG   A  1  51  ? 18.322  12.962  41.713  1.000 25.372  0 106  ARG   A HH22 1 c 1 
ATOM   761   N  N    . CYS   A  1  52  ? 13.402  16.865  45.530  1.000 33.861  0 107  CYS   A N    1 ? 1 
ATOM   762   C  CA   . CYS   A  1  52  ? 13.265  18.237  45.051  1.000 36.563  0 107  CYS   A CA   1 ? 1 
ATOM   763   C  C    . CYS   A  1  52  ? 14.237  19.156  45.766  1.000 32.966  0 107  CYS   A C    1 ? 1 
ATOM   764   O  O    . CYS   A  1  52  ? 14.120  19.314  46.959  1.000 35.716  0 107  CYS   A O    1 ? 1 
ATOM   765   C  CB   . CYS   A  1  52  ? 11.846  18.758  45.234  1.000 38.603  0 107  CYS   A CB   1 ? 1 
ATOM   766   S  SG   . CYS   A  1  52  ? 10.641  17.988  44.127  1.000 51.960  0 107  CYS   A SG   1 ? 1 
ATOM   767   H  H    . CYS   A  1  52  ? 12.692  16.480  45.957  1.000 34.779  0 107  CYS   A H    1 c 1 
ATOM   768   H  HA   . CYS   A  1  52  ? 13.477  18.242  44.091  1.000 34.766  0 107  CYS   A HA   1 c 1 
ATOM   769   H  HB2  . CYS   A  1  52  ? 11.564  18.601  46.158  1.000 40.770  0 107  CYS   A HB2  1 c 1 
ATOM   770   H  HB3  . CYS   A  1  52  ? 11.837  19.725  45.077  1.000 40.276  0 107  CYS   A HB3  1 c 1 
ATOM   771   N  N    . GLY   A  1  53  ? 15.159  19.753  45.013  1.000 34.524  0 108  GLY   A N    1 ? 1 
ATOM   772   C  CA   . GLY   A  1  53  ? 16.189  20.605  45.575  1.000 36.313  0 108  GLY   A CA   1 ? 1 
ATOM   773   C  C    . GLY   A  1  53  ? 17.230  19.795  46.344  1.000 40.204  0 108  GLY   A C    1 ? 1 
ATOM   774   O  O    . GLY   A  1  53  ? 17.816  20.288  47.309  1.000 42.768  0 108  GLY   A O    1 ? 1 
ATOM   775   H  H    . GLY   A  1  53  ? 15.146  19.625  44.108  1.000 33.648  0 108  GLY   A H    1 c 1 
ATOM   776   H  HA2  . GLY   A  1  53  ? 16.634  21.100  44.842  1.000 36.487  0 108  GLY   A HA2  1 c 1 
ATOM   777   H  HA3  . GLY   A  1  53  ? 15.769  21.263  46.183  1.000 37.246  0 108  GLY   A HA3  1 c 1 
ATOM   778   N  N    . GLU   A  1  54  ? 17.451  18.544  45.916  1.000 39.461  0 109  GLU   A N    1 ? 1 
ATOM   779   C  CA   . GLU   A  1  54  ? 18.531  17.738  46.460  1.000 40.800  0 109  GLU   A CA   1 ? 1 
ATOM   780   C  C    . GLU   A  1  54  ? 19.889  18.388  46.167  1.000 41.844  0 109  GLU   A C    1 ? 1 
ATOM   781   O  O    . GLU   A  1  54  ? 20.020  19.175  45.236  1.000 39.973  0 109  GLU   A O    1 ? 1 
ATOM   782   C  CB   . GLU   A  1  54  ? 18.479  16.319  45.861  1.000 39.204  0 109  GLU   A CB   1 ? 1 
ATOM   783   C  CG   . GLU   A  1  54  ? 18.715  16.294  44.348  1.000 39.391  0 109  GLU   A CG   1 ? 1 
ATOM   784   C  CD   . GLU   A  1  54  ? 18.376  15.023  43.585  1.000 34.816  0 109  GLU   A CD   1 ? 1 
ATOM   785   O  OE1  . GLU   A  1  54  ? 17.902  14.053  44.212  1.000 30.619  0 109  GLU   A OE1  1 ? 1 
ATOM   786   O  OE2  . GLU   A  1  54  ? 18.576  14.999  42.352  1.000 32.182  0 109  GLU   A OE2  1 ? 1 
ATOM   787   H  H    . GLU   A  1  54  ? 16.910  18.184  45.273  1.000 38.899  0 109  GLU   A H    1 c 1 
ATOM   788   H  HA   . GLU   A  1  54  ? 18.412  17.677  47.436  1.000 41.244  0 109  GLU   A HA   1 c 1 
ATOM   789   H  HB2  . GLU   A  1  54  ? 19.162  15.769  46.299  1.000 40.052  0 109  GLU   A HB2  1 c 1 
ATOM   790   H  HB3  . GLU   A  1  54  ? 17.604  15.926  46.057  1.000 39.380  0 109  GLU   A HB3  1 c 1 
ATOM   791   H  HG2  . GLU   A  1  54  ? 18.203  17.025  43.945  1.000 37.915  0 109  GLU   A HG2  1 c 1 
ATOM   792   H  HG3  . GLU   A  1  54  ? 19.662  16.490  44.185  1.000 38.431  0 109  GLU   A HG3  1 c 1 
ATOM   793   N  N    . VAL   A  1  55  ? 20.909  18.056  46.973  1.000 38.671  0 110  VAL   A N    1 ? 1 
ATOM   794   C  CA   . VAL   A  1  55  ? 22.288  18.145  46.524  1.000 37.511  0 110  VAL   A CA   1 ? 1 
ATOM   795   C  C    . VAL   A  1  55  ? 22.493  17.192  45.344  1.000 41.683  0 110  VAL   A C    1 ? 1 
ATOM   796   O  O    . VAL   A  1  55  ? 22.024  16.055  45.365  1.000 41.682  0 110  VAL   A O    1 ? 1 
ATOM   797   C  CB   . VAL   A  1  55  ? 23.275  17.829  47.664  1.000 38.615  0 110  VAL   A CB   1 ? 1 
ATOM   798   C  CG1  . VAL   A  1  55  ? 24.708  17.919  47.173  1.000 37.469  0 110  VAL   A CG1  1 ? 1 
ATOM   799   C  CG2  . VAL   A  1  55  ? 23.045  18.736  48.852  1.000 38.332  0 110  VAL   A CG2  1 ? 1 
ATOM   800   H  H    . VAL   A  1  55  ? 20.734  17.755  47.818  1.000 39.651  0 110  VAL   A H    1 c 1 
ATOM   801   H  HA   . VAL   A  1  55  ? 22.451  19.056  46.219  1.000 38.766  0 110  VAL   A HA   1 c 1 
ATOM   802   H  HB   . VAL   A  1  55  ? 23.109  16.898  47.954  1.000 38.044  0 110  VAL   A HB   1 c 1 
ATOM   803   H  HG11 . VAL   A  1  55  ? 24.837  18.760  46.700  1.000 37.787  0 110  VAL   A HG11 1 c 1 
ATOM   804   H  HG12 . VAL   A  1  55  ? 24.895  17.177  46.572  1.000 37.387  0 110  VAL   A HG12 1 c 1 
ATOM   805   H  HG13 . VAL   A  1  55  ? 25.315  17.879  47.933  1.000 38.679  0 110  VAL   A HG13 1 c 1 
ATOM   806   H  HG21 . VAL   A  1  55  ? 23.804  18.680  49.457  1.000 39.442  0 110  VAL   A HG21 1 c 1 
ATOM   807   H  HG22 . VAL   A  1  55  ? 22.237  18.462  49.321  1.000 38.703  0 110  VAL   A HG22 1 c 1 
ATOM   808   H  HG23 . VAL   A  1  55  ? 22.945  19.654  48.545  1.000 38.660  0 110  VAL   A HG23 1 c 1 
ATOM   809   N  N    . ARG   A  1  56  ? 23.201  17.665  44.310  1.000 46.960  0 111  ARG   A N    1 ? 1 
ATOM   810   C  CA   . ARG   A  1  56  ? 23.415  16.877  43.108  1.000 40.051  0 111  ARG   A CA   1 ? 1 
ATOM   811   C  C    . ARG   A  1  56  ? 24.293  15.670  43.396  1.000 47.614  0 111  ARG   A C    1 ? 1 
ATOM   812   O  O    . ARG   A  1  56  ? 25.424  15.805  43.870  1.000 38.298  0 111  ARG   A O    1 ? 1 
ATOM   813   C  CB   . ARG   A  1  56  ? 24.090  17.713  42.012  1.000 43.077  0 111  ARG   A CB   1 ? 1 
ATOM   814   C  CG   . ARG   A  1  56  ? 24.532  16.886  40.816  1.000 42.745  0 111  ARG   A CG   1 ? 1 
ATOM   815   C  CD   . ARG   A  1  56  ? 25.119  17.804  39.750  1.000 44.157  0 111  ARG   A CD   1 ? 1 
ATOM   816   N  NE   . ARG   A  1  56  ? 24.129  18.569  38.993  1.000 44.361  0 111  ARG   A NE   1 ? 1 
ATOM   817   C  CZ   . ARG   A  1  56  ? 23.429  18.088  37.968  1.000 39.595  0 111  ARG   A CZ   1 ? 1 
ATOM   818   N  NH1  . ARG   A  1  56  ? 22.283  18.633  37.591  1.000 39.473  0 111  ARG   A NH1  1 ? 1 
ATOM   819   N  NH2  . ARG   A  1  56  ? 23.947  17.102  37.238  1.000 44.861  0 111  ARG   A NH2  1 ? 1 
ATOM   820   H  H    . ARG   A  1  56  ? 23.564  18.503  44.357  1.000 44.275  0 111  ARG   A H    1 c 1 
ATOM   821   H  HA   . ARG   A  1  56  ? 22.539  16.567  42.779  1.000 42.251  0 111  ARG   A HA   1 c 1 
ATOM   822   H  HB2  . ARG   A  1  56  ? 23.462  18.402  41.709  1.000 42.080  0 111  ARG   A HB2  1 c 1 
ATOM   823   H  HB3  . ARG   A  1  56  ? 24.872  18.162  42.395  1.000 43.078  0 111  ARG   A HB3  1 c 1 
ATOM   824   H  HG2  . ARG   A  1  56  ? 25.210  16.234  41.091  1.000 43.358  0 111  ARG   A HG2  1 c 1 
ATOM   825   H  HG3  . ARG   A  1  56  ? 23.764  16.401  40.445  1.000 42.340  0 111  ARG   A HG3  1 c 1 
ATOM   826   H  HD2  . ARG   A  1  56  ? 25.737  18.431  40.181  1.000 44.700  0 111  ARG   A HD2  1 c 1 
ATOM   827   H  HD3  . ARG   A  1  56  ? 25.642  17.262  39.125  1.000 43.943  0 111  ARG   A HD3  1 c 1 
ATOM   828   H  HE   . ARG   A  1  56  ? 23.989  19.394  39.226  1.000 43.531  0 111  ARG   A HE   1 c 1 
ATOM   829   H  HH11 . ARG   A  1  56  ? 21.923  19.276  38.073  1.000 39.743  0 111  ARG   A HH11 1 c 1 
ATOM   830   H  HH12 . ARG   A  1  56  ? 21.881  18.349  36.863  1.000 38.705  0 111  ARG   A HH12 1 c 1 
ATOM   831   H  HH21 . ARG   A  1  56  ? 23.438  16.433  36.985  1.000 42.285  0 111  ARG   A HH21 1 c 1 
ATOM   832   H  HH22 . ARG   A  1  56  ? 24.794  17.127  37.004  1.000 43.209  0 111  ARG   A HH22 1 c 1 
ATOM   833   N  N    . ASN   A  1  57  ? 23.755  14.493  43.090  1.000 41.076  0 112  ASN   A N    1 ? 1 
ATOM   834   C  CA   . ASN   A  1  57  ? 24.570  13.294  43.005  1.000 45.623  0 112  ASN   A CA   1 ? 1 
ATOM   835   C  C    . ASN   A  1  57  ? 24.730  12.913  41.532  1.000 42.610  0 112  ASN   A C    1 ? 1 
ATOM   836   O  O    . ASN   A  1  57  ? 23.734  12.673  40.854  1.000 37.784  0 112  ASN   A O    1 ? 1 
ATOM   837   C  CB   . ASN   A  1  57  ? 23.949  12.158  43.812  1.000 48.300  0 112  ASN   A CB   1 ? 1 
ATOM   838   C  CG   . ASN   A  1  57  ? 24.913  11.025  44.026  1.000 55.751  0 112  ASN   A CG   1 ? 1 
ATOM   839   O  OD1  . ASN   A  1  57  ? 25.639  10.615  43.104  1.000 50.868  0 112  ASN   A OD1  1 ? 1 
ATOM   840   N  ND2  . ASN   A  1  57  ? 24.977  10.521  45.250  1.000 60.427  0 112  ASN   A ND2  1 ? 1 
ATOM   841   H  H    . ASN   A  1  57  ? 22.856  14.429  42.934  1.000 42.787  0 112  ASN   A H    1 c 1 
ATOM   842   H  HA   . ASN   A  1  57  ? 25.459  13.485  43.385  1.000 45.289  0 112  ASN   A HA   1 c 1 
ATOM   843   H  HB2  . ASN   A  1  57  ? 23.659  12.506  44.680  1.000 49.692  0 112  ASN   A HB2  1 c 1 
ATOM   844   H  HB3  . ASN   A  1  57  ? 23.161  11.824  43.338  1.000 48.231  0 112  ASN   A HB3  1 c 1 
ATOM   845   H  HD21 . ASN   A  1  57  ? 24.413  10.794  45.874  1.000 59.212  0 112  ASN   A HD21 1 c 1 
ATOM   846   H  HD22 . ASN   A  1  57  ? 25.584  9.908   45.444  1.000 59.460  0 112  ASN   A HD22 1 c 1 
ATOM   847   N  N    . GLU   A  1  58  ? 25.981  12.835  41.057  1.000 35.586  0 113  GLU   A N    1 ? 1 
ATOM   848   C  CA   . GLU   A  1  58  ? 26.256  12.633  39.642  1.000 41.654  0 113  GLU   A CA   1 ? 1 
ATOM   849   C  C    . GLU   A  1  58  ? 25.897  11.235  39.124  1.000 38.706  0 113  GLU   A C    1 ? 1 
ATOM   850   O  O    . GLU   A  1  58  ? 25.671  11.026  37.930  1.000 39.045  0 113  GLU   A O    1 ? 1 
ATOM   851   C  CB   . GLU   A  1  58  ? 27.746  12.928  39.357  1.000 43.644  0 113  GLU   A CB   1 ? 1 
ATOM   852   C  CG   . GLU   A  1  58  ? 28.159  14.400  39.466  1.000 46.327  0 113  GLU   A CG   1 ? 1 
ATOM   853   C  CD   . GLU   A  1  58  ? 27.517  15.361  38.467  1.000 54.935  0 113  GLU   A CD   1 ? 1 
ATOM   854   O  OE1  . GLU   A  1  58  ? 26.593  14.943  37.736  1.000 48.770  0 113  GLU   A OE1  1 ? 1 
ATOM   855   O  OE2  . GLU   A  1  58  ? 27.947  16.537  38.413  1.000 70.846  0 113  GLU   A OE2  1 ? 1 
ATOM   856   H  H    . GLU   A  1  58  ? 26.685  12.908  41.636  1.000 39.323  0 113  GLU   A H    1 c 1 
ATOM   857   H  HA   . GLU   A  1  58  ? 25.714  13.283  39.143  1.000 39.494  0 113  GLU   A HA   1 c 1 
ATOM   858   H  HB2  . GLU   A  1  58  ? 28.288  12.405  39.983  1.000 44.341  0 113  GLU   A HB2  1 c 1 
ATOM   859   H  HB3  . GLU   A  1  58  ? 27.953  12.614  38.452  1.000 43.314  0 113  GLU   A HB3  1 c 1 
ATOM   860   H  HG2  . GLU   A  1  58  ? 27.947  14.717  40.370  1.000 48.126  0 113  GLU   A HG2  1 c 1 
ATOM   861   H  HG3  . GLU   A  1  58  ? 29.133  14.459  39.360  1.000 48.132  0 113  GLU   A HG3  1 c 1 
ATOM   862   N  N    . GLU   A  1  59  ? 25.793  10.272  40.035  1.000 36.768  0 114  GLU   A N    1 ? 1 
ATOM   863   C  CA   . GLU   A  1  59  ? 25.498  8.909   39.636  1.000 41.661  0 114  GLU   A CA   1 ? 1 
ATOM   864   C  C    . GLU   A  1  59  ? 24.058  8.761   39.131  1.000 38.597  0 114  GLU   A C    1 ? 1 
ATOM   865   O  O    . GLU   A  1  59  ? 23.731  7.754   38.500  1.000 36.223  0 114  GLU   A O    1 ? 1 
ATOM   866   C  CB   . GLU   A  1  59  ? 25.743  7.963   40.810  1.000 41.165  0 114  GLU   A CB   1 ? 1 
ATOM   867   C  CG   . GLU   A  1  59  ? 27.157  8.013   41.359  1.000 64.653  0 114  GLU   A CG   1 ? 1 
ATOM   868   C  CD   . GLU   A  1  59  ? 28.211  7.370   40.485  1.000 80.700  0 114  GLU   A CD   1 ? 1 
ATOM   869   O  OE1  . GLU   A  1  59  ? 28.204  6.122   40.398  1.000 105.237 0 114  GLU   A OE1  1 ? 1 
ATOM   870   O  OE2  . GLU   A  1  59  ? 29.048  8.100   39.902  1.000 99.208  0 114  GLU   A OE2  1 ? 1 
ATOM   871   H  H    . GLU   A  1  59  ? 25.902  10.463  40.921  1.000 39.250  0 114  GLU   A H    1 c 1 
ATOM   872   H  HA   . GLU   A  1  59  ? 26.110  8.664   38.904  1.000 39.820  0 114  GLU   A HA   1 c 1 
ATOM   873   H  HB2  . GLU   A  1  59  ? 25.115  8.188   41.528  1.000 45.510  0 114  GLU   A HB2  1 c 1 
ATOM   874   H  HB3  . GLU   A  1  59  ? 25.548  7.048   40.518  1.000 45.045  0 114  GLU   A HB3  1 c 1 
ATOM   875   H  HG2  . GLU   A  1  59  ? 27.409  8.949   41.506  1.000 60.264  0 114  GLU   A HG2  1 c 1 
ATOM   876   H  HG3  . GLU   A  1  59  ? 27.170  7.567   42.232  1.000 60.751  0 114  GLU   A HG3  1 c 1 
ATOM   877   N  N    . ASN   A  1  60  ? 23.192  9.745   39.439  1.000 35.566  0 115  ASN   A N    1 ? 1 
ATOM   878   C  CA   . ASN   A  1  60  ? 21.772  9.640   39.128  1.000 37.520  0 115  ASN   A CA   1 ? 1 
ATOM   879   C  C    . ASN   A  1  60  ? 21.466  9.739   37.636  1.000 39.492  0 115  ASN   A C    1 ? 1 
ATOM   880   O  O    . ASN   A  1  60  ? 22.067  10.518  36.907  1.000 30.117  0 115  ASN   A O    1 ? 1 
ATOM   881   C  CB   . ASN   A  1  60  ? 20.911  10.697  39.853  1.000 35.994  0 115  ASN   A CB   1 ? 1 
ATOM   882   C  CG   . ASN   A  1  60  ? 20.794  10.414  41.318  1.000 43.070  0 115  ASN   A CG   1 ? 1 
ATOM   883   O  OD1  . ASN   A  1  60  ? 20.632  9.254   41.718  1.000 37.047  0 115  ASN   A OD1  1 ? 1 
ATOM   884   N  ND2  . ASN   A  1  60  ? 20.910  11.474  42.152  1.000 36.899  0 115  ASN   A ND2  1 ? 1 
ATOM   885   H  H    . ASN   A  1  60  ? 23.490  10.496  39.866  1.000 37.276  0 115  ASN   A H    1 c 1 
ATOM   886   H  HA   . ASN   A  1  60  ? 21.468  8.758   39.440  1.000 37.126  0 115  ASN   A HA   1 c 1 
ATOM   887   H  HB2  . ASN   A  1  60  ? 21.315  11.579  39.724  1.000 37.819  0 115  ASN   A HB2  1 c 1 
ATOM   888   H  HB3  . ASN   A  1  60  ? 20.017  10.709  39.455  1.000 37.088  0 115  ASN   A HB3  1 c 1 
ATOM   889   H  HD21 . ASN   A  1  60  ? 21.044  12.284  41.826  1.000 38.697  0 115  ASN   A HD21 1 c 1 
ATOM   890   H  HD22 . ASN   A  1  60  ? 20.850  11.356  43.026  1.000 39.345  0 115  ASN   A HD22 1 c 1 
ATOM   891   N  N    . ALA   A  1  61  ? 20.468  8.960   37.220  1.000 34.931  0 116  ALA   A N    1 ? 1 
ATOM   892   C  CA   . ALA   A  1  61  ? 20.036  8.939   35.838  1.000 34.482  0 116  ALA   A CA   1 ? 1 
ATOM   893   C  C    . ALA   A  1  61  ? 19.608  10.335  35.410  1.000 29.467  0 116  ALA   A C    1 ? 1 
ATOM   894   O  O    . ALA   A  1  61  ? 19.980  10.803  34.341  1.000 28.237  0 116  ALA   A O    1 ? 1 
ATOM   895   C  CB   . ALA   A  1  61  ? 18.880  7.944   35.672  1.000 34.100  0 116  ALA   A CB   1 ? 1 
ATOM   896   H  H    . ALA   A  1  61  ? 20.038  8.423   37.822  1.000 36.044  0 116  ALA   A H    1 c 1 
ATOM   897   H  HA   . ALA   A  1  61  ? 20.792  8.652   35.274  1.000 33.434  0 116  ALA   A HA   1 c 1 
ATOM   898   H  HB1  . ALA   A  1  61  ? 18.610  7.911   34.740  1.000 33.435  0 116  ALA   A HB1  1 c 1 
ATOM   899   H  HB2  . ALA   A  1  61  ? 19.168  7.061   35.956  1.000 34.300  0 116  ALA   A HB2  1 c 1 
ATOM   900   H  HB3  . ALA   A  1  61  ? 18.128  8.229   36.216  1.000 34.078  0 116  ALA   A HB3  1 c 1 
ATOM   901   N  N    . CYS   A  1  62  ? 18.744  10.954  36.213  1.000 27.755  0 117  CYS   A N    1 ? 1 
ATOM   902   C  CA   . CYS   A  1  62  ? 18.286  12.296  35.916  1.000 32.689  0 117  CYS   A CA   1 ? 1 
ATOM   903   C  C    . CYS   A  1  62  ? 18.232  13.068  37.236  1.000 37.337  0 117  CYS   A C    1 ? 1 
ATOM   904   O  O    . CYS   A  1  62  ? 18.340  12.480  38.317  1.000 31.460  0 117  CYS   A O    1 ? 1 
ATOM   905   C  CB   . CYS   A  1  62  ? 16.968  12.284  35.139  1.000 30.764  0 117  CYS   A CB   1 ? 1 
ATOM   906   S  SG   . CYS   A  1  62  ? 15.615  11.428  35.946  1.000 31.543  0 117  CYS   A SG   1 ? 1 
ATOM   907   H  H    . CYS   A  1  62  ? 18.428  10.530  36.958  1.000 29.565  0 117  CYS   A H    1 c 1 
ATOM   908   H  HA   . CYS   A  1  62  ? 18.965  12.725  35.346  1.000 31.862  0 117  CYS   A HA   1 c 1 
ATOM   909   H  HB2  . CYS   A  1  62  ? 16.690  13.208  34.976  1.000 31.152  0 117  CYS   A HB2  1 c 1 
ATOM   910   H  HB3  . CYS   A  1  62  ? 17.119  11.863  34.269  1.000 30.701  0 117  CYS   A HB3  1 c 1 
ATOM   911   N  N    . HIS   A  1  63  ? 18.109  14.399  37.168  1.000 35.272  0 118  HIS   A N    1 ? 1 
ATOM   912   C  CA   . HIS   A  1  63  ? 18.287  15.214  38.364  1.000 29.666  0 118  HIS   A CA   1 ? 1 
ATOM   913   C  C    . HIS   A  1  63  ? 17.098  16.063  38.807  1.000 29.190  0 118  HIS   A C    1 ? 1 
ATOM   914   O  O    . HIS   A  1  63  ? 16.251  16.424  37.996  1.000 29.908  0 118  HIS   A O    1 ? 1 
ATOM   915   C  CB   . HIS   A  1  63  ? 19.538  16.066  38.172  1.000 32.224  0 118  HIS   A CB   1 ? 1 
ATOM   916   C  CG   . HIS   A  1  63  ? 20.766  15.238  37.940  1.000 33.470  0 118  HIS   A CG   1 ? 1 
ATOM   917   N  ND1  . HIS   A  1  63  ? 21.580  14.867  38.969  1.000 29.195  0 118  HIS   A ND1  1 ? 1 
ATOM   918   C  CD2  . HIS   A  1  63  ? 21.252  14.701  36.805  1.000 37.888  0 118  HIS   A CD2  1 ? 1 
ATOM   919   C  CE1  . HIS   A  1  63  ? 22.554  14.147  38.442  1.000 28.626  0 118  HIS   A CE1  1 ? 1 
ATOM   920   N  NE2  . HIS   A  1  63  ? 22.380  13.990  37.153  1.000 33.607  0 118  HIS   A NE2  1 ? 1 
ATOM   921   H  H    . HIS   A  1  63  ? 17.912  14.805  36.373  1.000 33.524  0 118  HIS   A H    1 c 1 
ATOM   922   H  HA   . HIS   A  1  63  ? 18.482  14.590  39.100  1.000 31.364  0 118  HIS   A HA   1 c 1 
ATOM   923   H  HB2  . HIS   A  1  63  ? 19.404  16.661  37.407  1.000 31.601  0 118  HIS   A HB2  1 c 1 
ATOM   924   H  HB3  . HIS   A  1  63  ? 19.672  16.618  38.969  1.000 32.570  0 118  HIS   A HB3  1 c 1 
ATOM   925   H  HD1  . HIS   A  1  63  ? 21.443  15.079  39.820  0.000 7.060   0 118  HIS   A HD1  1 c 1 
ATOM   926   H  HD2  . HIS   A  1  63  ? 20.873  14.775  35.943  1.000 34.646  0 118  HIS   A HD2  1 c 1 
ATOM   927   H  HE1  . HIS   A  1  63  ? 23.260  13.766  38.932  1.000 30.508  0 118  HIS   A HE1  1 c 1 
ATOM   928   H  HE2  . HIS   A  1  63  ? 22.923  13.556  36.599  0.000 12.990  0 118  HIS   A HE2  1 c 1 
ATOM   929   N  N    . CYS   A  1  64  ? 17.045  16.343  40.118  1.000 28.450  0 119  CYS   A N    1 ? 1 
ATOM   930   C  CA   . CYS   A  1  64  ? 15.979  17.139  40.708  1.000 32.840  0 119  CYS   A CA   1 ? 1 
ATOM   931   C  C    . CYS   A  1  64  ? 16.541  18.308  41.512  1.000 32.855  0 119  CYS   A C    1 ? 1 
ATOM   932   O  O    . CYS   A  1  64  ? 15.814  18.933  42.280  1.000 35.956  0 119  CYS   A O    1 ? 1 
ATOM   933   C  CB   . CYS   A  1  64  ? 15.079  16.267  41.573  1.000 32.050  0 119  CYS   A CB   1 ? 1 
ATOM   934   S  SG   . CYS   A  1  64  ? 14.622  14.697  40.795  1.000 35.910  0 119  CYS   A SG   1 ? 1 
ATOM   935   H  H    . CYS   A  1  64  ? 17.691  16.004  40.668  1.000 30.157  0 119  CYS   A H    1 c 1 
ATOM   936   H  HA   . CYS   A  1  64  ? 15.434  17.505  39.976  1.000 31.071  0 119  CYS   A HA   1 c 1 
ATOM   937   H  HB2  . CYS   A  1  64  ? 15.538  16.073  42.415  1.000 33.675  0 119  CYS   A HB2  1 c 1 
ATOM   938   H  HB3  . CYS   A  1  64  ? 14.260  16.761  41.783  1.000 33.136  0 119  CYS   A HB3  1 c 1 
ATOM   939   N  N    . SER   A  1  65  ? 17.841  18.569  41.343  1.000 34.978  0 120  SER   A N    1 ? 1 
ATOM   940   C  CA   . SER   A  1  65  ? 18.506  19.698  41.970  1.000 36.146  0 120  SER   A CA   1 ? 1 
ATOM   941   C  C    . SER   A  1  65  ? 18.212  21.011  41.241  1.000 39.923  0 120  SER   A C    1 ? 1 
ATOM   942   O  O    . SER   A  1  65  ? 17.740  20.995  40.100  1.000 35.683  0 120  SER   A O    1 ? 1 
ATOM   943   C  CB   . SER   A  1  65  ? 20.000  19.432  41.989  1.000 35.487  0 120  SER   A CB   1 ? 1 
ATOM   944   O  OG   . SER   A  1  65  ? 20.546  18.981  40.764  1.000 42.067  0 120  SER   A OG   1 ? 1 
ATOM   945   H  H    . SER   A  1  65  ? 18.336  18.025  40.801  1.000 34.164  0 120  SER   A H    1 c 1 
ATOM   946   H  HA   . SER   A  1  65  ? 18.182  19.775  42.908  1.000 37.041  0 120  SER   A HA   1 c 1 
ATOM   947   H  HB2  . SER   A  1  65  ? 20.463  20.260  42.252  1.000 37.806  0 120  SER   A HB2  1 c 1 
ATOM   948   H  HB3  . SER   A  1  65  ? 20.188  18.759  42.680  1.000 37.554  0 120  SER   A HB3  1 c 1 
ATOM   949   H  HG   . SER   A  1  65  ? 20.738  19.599  40.248  0.000 13.850  0 120  SER   A HG   1 c 1 
ATOM   950   N  N    . GLU   A  1  66  ? 18.515  22.148  41.889  1.000 42.991  0 121  GLU   A N    1 ? 1 
ATOM   951   C  CA   . GLU   A  1  66  ? 18.198  23.453  41.333  1.000 38.831  0 121  GLU   A CA   1 ? 1 
ATOM   952   C  C    . GLU   A  1  66  ? 19.043  23.809  40.113  1.000 36.200  0 121  GLU   A C    1 ? 1 
ATOM   953   O  O    . GLU   A  1  66  ? 18.635  24.637  39.313  1.000 38.700  0 121  GLU   A O    1 ? 1 
ATOM   954   C  CB   . GLU   A  1  66  ? 18.347  24.540  42.398  1.000 52.486  0 121  GLU   A CB   1 ? 1 
ATOM   955   C  CG   . GLU   A  1  66  ? 17.494  25.781  42.143  1.000 67.418  0 121  GLU   A CG   1 ? 1 
ATOM   956   C  CD   . GLU   A  1  66  ? 16.014  25.635  42.466  1.000 80.571  0 121  GLU   A CD   1 ? 1 
ATOM   957   O  OE1  . GLU   A  1  66  ? 15.665  24.744  43.273  1.000 93.312  0 121  GLU   A OE1  1 ? 1 
ATOM   958   O  OE2  . GLU   A  1  66  ? 15.202  26.396  41.894  1.000 64.570  0 121  GLU   A OE2  1 ? 1 
ATOM   959   H  H    . GLU   A  1  66  ? 18.937  22.103  42.699  1.000 42.153  0 121  GLU   A H    1 c 1 
ATOM   960   H  HA   . GLU   A  1  66  ? 17.255  23.432  41.050  1.000 40.590  0 121  GLU   A HA   1 c 1 
ATOM   961   H  HB2  . GLU   A  1  66  ? 18.104  24.160  43.268  1.000 51.744  0 121  GLU   A HB2  1 c 1 
ATOM   962   H  HB3  . GLU   A  1  66  ? 19.289  24.807  42.441  1.000 51.680  0 121  GLU   A HB3  1 c 1 
ATOM   963   H  HG2  . GLU   A  1  66  ? 17.852  26.522  42.678  1.000 66.572  0 121  GLU   A HG2  1 c 1 
ATOM   964   H  HG3  . GLU   A  1  66  ? 17.578  26.034  41.200  1.000 64.982  0 121  GLU   A HG3  1 c 1 
ATOM   965   N  N    . ASP   A  1  67  ? 20.214  23.194  39.975  1.000 37.465  0 122  ASP   A N    1 ? 1 
ATOM   966   C  CA   . ASP   A  1  67  ? 21.031  23.361  38.792  1.000 39.184  0 122  ASP   A CA   1 ? 1 
ATOM   967   C  C    . ASP   A  1  67  ? 20.673  22.467  37.600  1.000 36.471  0 122  ASP   A C    1 ? 1 
ATOM   968   O  O    . ASP   A  1  67  ? 21.332  22.545  36.564  1.000 37.332  0 122  ASP   A O    1 ? 1 
ATOM   969   C  CB   . ASP   A  1  67  ? 22.455  23.080  39.188  1.000 43.814  0 122  ASP   A CB   1 ? 1 
ATOM   970   C  CG   . ASP   A  1  67  ? 22.803  21.629  39.443  1.000 58.182  0 122  ASP   A CG   1 ? 1 
ATOM   971   O  OD1  . ASP   A  1  67  ? 21.867  20.811  39.664  1.000 46.920  0 122  ASP   A OD1  1 ? 1 
ATOM   972   O  OD2  . ASP   A  1  67  ? 24.007  21.305  39.436  1.000 61.793  0 122  ASP   A OD2  1 ? 1 
ATOM   973   H  H    . ASP   A  1  67  ? 20.520  22.657  40.648  1.000 38.102  0 122  ASP   A H    1 c 1 
ATOM   974   H  HA   . ASP   A  1  67  ? 20.975  24.303  38.506  1.000 39.315  0 122  ASP   A HA   1 c 1 
ATOM   975   H  HB2  . ASP   A  1  67  ? 23.043  23.407  38.478  1.000 45.358  0 122  ASP   A HB2  1 c 1 
ATOM   976   H  HB3  . ASP   A  1  67  ? 22.657  23.584  40.002  1.000 46.120  0 122  ASP   A HB3  1 c 1 
ATOM   977   N  N    . CYS   A  1  68  ? 19.640  21.618  37.732  1.000 33.240  0 123  CYS   A N    1 ? 1 
ATOM   978   C  CA   . CYS   A  1  68  ? 19.358  20.612  36.709  1.000 30.513  0 123  CYS   A CA   1 ? 1 
ATOM   979   C  C    . CYS   A  1  68  ? 19.009  21.235  35.361  1.000 30.618  0 123  CYS   A C    1 ? 1 
ATOM   980   O  O    . CYS   A  1  68  ? 19.487  20.769  34.327  1.000 29.916  0 123  CYS   A O    1 ? 1 
ATOM   981   C  CB   . CYS   A  1  68  ? 18.317  19.565  37.154  1.000 30.134  0 123  CYS   A CB   1 ? 1 
ATOM   982   S  SG   . CYS   A  1  68  ? 16.603  20.117  37.270  1.000 33.251  0 123  CYS   A SG   1 ? 1 
ATOM   983   H  H    . CYS   A  1  68  ? 19.102  21.662  38.469  1.000 33.676  0 123  CYS   A H    1 c 1 
ATOM   984   H  HA   . CYS   A  1  68  ? 20.201  20.120  36.577  1.000 31.096  0 123  CYS   A HA   1 c 1 
ATOM   985   H  HB2  . CYS   A  1  68  ? 18.348  18.814  36.527  1.000 30.172  0 123  CYS   A HB2  1 c 1 
ATOM   986   H  HB3  . CYS   A  1  68  ? 18.581  19.222  38.031  1.000 31.195  0 123  CYS   A HB3  1 c 1 
ATOM   987   N  N    . LEU   A  1  69  ? 18.183  22.282  35.370  1.000 30.214  0 124  LEU   A N    1 ? 1 
ATOM   988   C  CA   . LEU   A  1  69  ? 17.861  22.983  34.137  1.000 34.289  0 124  LEU   A CA   1 ? 1 
ATOM   989   C  C    . LEU   A  1  69  ? 19.107  23.528  33.427  1.000 34.257  0 124  LEU   A C    1 ? 1 
ATOM   990   O  O    . LEU   A  1  69  ? 19.257  23.316  32.233  1.000 35.170  0 124  LEU   A O    1 ? 1 
ATOM   991   C  CB   . LEU   A  1  69  ? 16.850  24.096  34.406  1.000 36.536  0 124  LEU   A CB   1 ? 1 
ATOM   992   C  CG   . LEU   A  1  69  ? 15.421  23.637  34.591  1.000 38.301  0 124  LEU   A CG   1 ? 1 
ATOM   993   C  CD1  . LEU   A  1  69  ? 14.542  24.781  34.970  1.000 35.828  0 124  LEU   A CD1  1 ? 1 
ATOM   994   C  CD2  . LEU   A  1  69  ? 14.889  23.002  33.330  1.000 38.233  0 124  LEU   A CD2  1 ? 1 
ATOM   995   H  H    . LEU   A  1  69  ? 17.807  22.562  36.155  1.000 31.690  0 124  LEU   A H    1 c 1 
ATOM   996   H  HA   . LEU   A  1  69  ? 17.446  22.327  33.533  1.000 32.914  0 124  LEU   A HA   1 c 1 
ATOM   997   H  HB2  . LEU   A  1  69  ? 17.129  24.579  35.209  1.000 37.216  0 124  LEU   A HB2  1 c 1 
ATOM   998   H  HB3  . LEU   A  1  69  ? 16.879  24.726  33.658  1.000 36.402  0 124  LEU   A HB3  1 c 1 
ATOM   999   H  HG   . LEU   A  1  69  ? 15.396  22.968  35.318  1.000 37.554  0 124  LEU   A HG   1 c 1 
ATOM   1000  H  HD11 . LEU   A  1  69  ? 13.694  24.443  35.301  1.000 36.804  0 124  LEU   A HD11 1 c 1 
ATOM   1001  H  HD12 . LEU   A  1  69  ? 14.385  25.343  34.191  1.000 36.528  0 124  LEU   A HD12 1 c 1 
ATOM   1002  H  HD13 . LEU   A  1  69  ? 14.973  25.307  35.666  1.000 37.390  0 124  LEU   A HD13 1 c 1 
ATOM   1003  H  HD21 . LEU   A  1  69  ? 15.328  22.147  33.182  1.000 37.562  0 124  LEU   A HD21 1 c 1 
ATOM   1004  H  HD22 . LEU   A  1  69  ? 15.063  23.589  32.573  1.000 37.812  0 124  LEU   A HD22 1 c 1 
ATOM   1005  H  HD23 . LEU   A  1  69  ? 13.930  22.862  33.417  1.000 37.677  0 124  LEU   A HD23 1 c 1 
ATOM   1006  N  N    . SER   A  1  70  ? 20.024  24.171  34.156  1.000 31.056  0 125  SER   A N    1 ? 1 
ATOM   1007  C  CA   . SER   A  1  70  ? 21.231  24.718  33.554  1.000 35.937  0 125  SER   A CA   1 ? 1 
ATOM   1008  C  C    . SER   A  1  70  ? 22.189  23.623  33.113  1.000 35.309  0 125  SER   A C    1 ? 1 
ATOM   1009  O  O    . SER   A  1  70  ? 22.910  23.808  32.140  1.000 42.547  0 125  SER   A O    1 ? 1 
ATOM   1010  C  CB   . SER   A  1  70  ? 21.968  25.646  34.507  1.000 42.395  0 125  SER   A CB   1 ? 1 
ATOM   1011  O  OG   . SER   A  1  70  ? 22.352  24.953  35.687  1.000 72.055  0 125  SER   A OG   1 ? 1 
ATOM   1012  H  H    . SER   A  1  70  ? 19.893  24.274  35.054  1.000 33.365  0 125  SER   A H    1 c 1 
ATOM   1013  H  HA   . SER   A  1  70  ? 20.968  25.237  32.750  1.000 35.400  0 125  SER   A HA   1 c 1 
ATOM   1014  H  HB2  . SER   A  1  70  ? 22.769  26.004  34.061  1.000 46.073  0 125  SER   A HB2  1 c 1 
ATOM   1015  H  HB3  . SER   A  1  70  ? 21.385  26.402  34.744  1.000 46.073  0 125  SER   A HB3  1 c 1 
ATOM   1016  H  HG   . SER   A  1  70  ? 23.141  24.613  35.557  0.000 44.170  0 125  SER   A HG   1 c 1 
ATOM   1017  N  N    . ARG   A  1  71  ? 22.187  22.488  33.820  1.000 35.040  0 126  ARG   A N    1 ? 1 
ATOM   1018  C  CA   . ARG   A  1  71  ? 22.977  21.351  33.374  1.000 37.224  0 126  ARG   A CA   1 ? 1 
ATOM   1019  C  C    . ARG   A  1  71  ? 22.313  20.587  32.229  1.000 30.455  0 126  ARG   A C    1 ? 1 
ATOM   1020  O  O    . ARG   A  1  71  ? 22.977  19.859  31.507  1.000 37.464  0 126  ARG   A O    1 ? 1 
ATOM   1021  C  CB   . ARG   A  1  71  ? 23.282  20.423  34.543  1.000 39.145  0 126  ARG   A CB   1 ? 1 
ATOM   1022  C  CG   . ARG   A  1  71  ? 24.073  21.097  35.678  1.000 47.207  0 126  ARG   A CG   1 ? 1 
ATOM   1023  C  CD   . ARG   A  1  71  ? 25.534  21.283  35.303  1.000 51.005  0 126  ARG   A CD   1 ? 1 
ATOM   1024  N  NE   . ARG   A  1  71  ? 26.160  20.074  34.774  1.000 59.507  0 126  ARG   A NE   1 ? 1 
ATOM   1025  C  CZ   . ARG   A  1  71  ? 26.542  19.031  35.506  1.000 54.786  0 126  ARG   A CZ   1 ? 1 
ATOM   1026  N  NH1  . ARG   A  1  71  ? 26.672  19.115  36.818  1.000 47.646  0 126  ARG   A NH1  1 ? 1 
ATOM   1027  N  NH2  . ARG   A  1  71  ? 26.837  17.885  34.899  1.000 50.999  0 126  ARG   A NH2  1 ? 1 
ATOM   1028  H  H    . ARG   A  1  71  ? 21.698  22.421  34.589  1.000 35.751  0 126  ARG   A H    1 c 1 
ATOM   1029  H  HA   . ARG   A  1  71  ? 23.835  21.701  33.040  1.000 36.216  0 126  ARG   A HA   1 c 1 
ATOM   1030  H  HB2  . ARG   A  1  71  ? 22.436  20.088  34.904  1.000 39.843  0 126  ARG   A HB2  1 c 1 
ATOM   1031  H  HB3  . ARG   A  1  71  ? 23.791  19.656  34.209  1.000 40.002  0 126  ARG   A HB3  1 c 1 
ATOM   1032  H  HG2  . ARG   A  1  71  ? 23.681  21.972  35.878  1.000 46.179  0 126  ARG   A HG2  1 c 1 
ATOM   1033  H  HG3  . ARG   A  1  71  ? 24.017  20.545  36.487  1.000 46.279  0 126  ARG   A HG3  1 c 1 
ATOM   1034  H  HD2  . ARG   A  1  71  ? 25.600  21.993  34.630  1.000 51.869  0 126  ARG   A HD2  1 c 1 
ATOM   1035  H  HD3  . ARG   A  1  71  ? 26.031  21.581  36.094  1.000 52.738  0 126  ARG   A HD3  1 c 1 
ATOM   1036  H  HE   . ARG   A  1  71  ? 26.295  20.032  33.913  1.000 55.638  0 126  ARG   A HE   1 c 1 
ATOM   1037  H  HH11 . ARG   A  1  71  ? 26.820  19.898  37.200  1.000 50.371  0 126  ARG   A HH11 1 c 1 
ATOM   1038  H  HH12 . ARG   A  1  71  ? 26.624  18.384  37.310  1.000 49.855  0 126  ARG   A HH12 1 c 1 
ATOM   1039  H  HH21 . ARG   A  1  71  ? 27.265  17.254  35.339  1.000 52.224  0 126  ARG   A HH21 1 c 1 
ATOM   1040  H  HH22 . ARG   A  1  71  ? 26.605  17.760  34.060  1.000 51.490  0 126  ARG   A HH22 1 c 1 
ATOM   1041  N  N    . GLY   A  1  72  ? 21.007  20.775  32.026  1.000 30.134  0 127  GLY   A N    1 ? 1 
ATOM   1042  C  CA   . GLY   A  1  72  ? 20.300  20.074  30.967  1.000 26.371  0 127  GLY   A CA   1 ? 1 
ATOM   1043  C  C    . GLY   A  1  72  ? 19.990  18.609  31.286  1.000 28.117  0 127  GLY   A C    1 ? 1 
ATOM   1044  O  O    . GLY   A  1  72  ? 20.002  17.758  30.398  1.000 33.884  0 127  GLY   A O    1 ? 1 
ATOM   1045  H  H    . GLY   A  1  72  ? 20.540  21.344  32.567  1.000 29.730  0 127  GLY   A H    1 c 1 
ATOM   1046  H  HA2  . GLY   A  1  72  ? 19.451  20.549  30.789  1.000 27.293  0 127  GLY   A HA2  1 c 1 
ATOM   1047  H  HA3  . GLY   A  1  72  ? 20.843  20.116  30.140  1.000 27.358  0 127  GLY   A HA3  1 c 1 
ATOM   1048  N  N    . ASP   A  1  73  ? 19.664  18.320  32.544  1.000 29.406  0 128  ASP   A N    1 ? 1 
ATOM   1049  C  CA   . ASP   A  1  73  ? 19.498  16.943  32.964  1.000 27.480  0 128  ASP   A CA   1 ? 1 
ATOM   1050  C  C    . ASP   A  1  73  ? 18.451  16.720  34.044  1.000 28.987  0 128  ASP   A C    1 ? 1 
ATOM   1051  O  O    . ASP   A  1  73  ? 18.550  15.755  34.803  1.000 29.503  0 128  ASP   A O    1 ? 1 
ATOM   1052  C  CB   . ASP   A  1  73  ? 20.863  16.401  33.423  1.000 28.527  0 128  ASP   A CB   1 ? 1 
ATOM   1053  C  CG   . ASP   A  1  73  ? 21.567  17.132  34.522  1.000 29.395  0 128  ASP   A CG   1 ? 1 
ATOM   1054  O  OD1  . ASP   A  1  73  ? 20.907  17.910  35.240  1.000 31.916  0 128  ASP   A OD1  1 ? 1 
ATOM   1055  O  OD2  . ASP   A  1  73  ? 22.778  16.928  34.668  1.000 32.699  0 128  ASP   A OD2  1 ? 1 
ATOM   1056  H  H    . ASP   A  1  73  ? 19.549  18.990  33.154  1.000 29.154  0 128  ASP   A H    1 c 1 
ATOM   1057  H  HA   . ASP   A  1  73  ? 19.225  16.419  32.175  1.000 27.645  0 128  ASP   A HA   1 c 1 
ATOM   1058  H  HB2  . ASP   A  1  73  ? 20.748  15.472  33.710  1.000 28.341  0 128  ASP   A HB2  1 c 1 
ATOM   1059  H  HB3  . ASP   A  1  73  ? 21.461  16.398  32.648  1.000 28.276  0 128  ASP   A HB3  1 c 1 
ATOM   1060  N  N    . CYS   A  1  74  ? 17.436  17.582  34.081  1.000 25.294  0 129  CYS   A N    1 ? 1 
ATOM   1061  C  CA   . CYS   A  1  74  ? 16.308  17.352  34.958  1.000 26.214  0 129  CYS   A CA   1 ? 1 
ATOM   1062  C  C    . CYS   A  1  74  ? 15.572  16.114  34.456  1.000 30.499  0 129  CYS   A C    1 ? 1 
ATOM   1063  O  O    . CYS   A  1  74  ? 15.624  15.788  33.275  1.000 25.540  0 129  CYS   A O    1 ? 1 
ATOM   1064  C  CB   . CYS   A  1  74  ? 15.342  18.512  35.000  1.000 26.388  0 129  CYS   A CB   1 ? 1 
ATOM   1065  S  SG   . CYS   A  1  74  ? 16.070  20.125  35.298  1.000 31.012  0 129  CYS   A SG   1 ? 1 
ATOM   1066  H  H    . CYS   A  1  74  ? 17.439  18.323  33.546  1.000 26.211  0 129  CYS   A H    1 c 1 
ATOM   1067  H  HA   . CYS   A  1  74  ? 16.647  17.184  35.864  1.000 27.397  0 129  CYS   A HA   1 c 1 
ATOM   1068  H  HB2  . CYS   A  1  74  ? 14.860  18.550  34.149  1.000 26.527  0 129  CYS   A HB2  1 c 1 
ATOM   1069  H  HB3  . CYS   A  1  74  ? 14.684  18.343  35.703  1.000 27.215  0 129  CYS   A HB3  1 c 1 
ATOM   1070  N  N    . CYS   A  1  75  ? 14.876  15.445  35.369  1.000 26.231  0 130  CYS   A N    1 ? 1 
ATOM   1071  C  CA   . CYS   A  1  75  ? 13.952  14.406  34.987  1.000 27.567  0 130  CYS   A CA   1 ? 1 
ATOM   1072  C  C    . CYS   A  1  75  ? 12.823  15.105  34.246  1.000 26.415  0 130  CYS   A C    1 ? 1 
ATOM   1073  O  O    . CYS   A  1  75  ? 12.576  16.292  34.475  1.000 23.178  0 130  CYS   A O    1 ? 1 
ATOM   1074  C  CB   . CYS   A  1  75  ? 13.448  13.642  36.190  1.000 25.771  0 130  CYS   A CB   1 ? 1 
ATOM   1075  S  SG   . CYS   A  1  75  ? 14.778  12.852  37.182  1.000 32.570  0 130  CYS   A SG   1 ? 1 
ATOM   1076  H  H    . CYS   A  1  75  ? 14.980  15.644  36.255  1.000 28.111  0 130  CYS   A H    1 c 1 
ATOM   1077  H  HA   . CYS   A  1  75  ? 14.409  13.784  34.375  1.000 26.307  0 130  CYS   A HA   1 c 1 
ATOM   1078  H  HB2  . CYS   A  1  75  ? 12.949  14.252  36.768  1.000 27.624  0 130  CYS   A HB2  1 c 1 
ATOM   1079  H  HB3  . CYS   A  1  75  ? 12.832  12.944  35.889  1.000 26.833  0 130  CYS   A HB3  1 c 1 
ATOM   1080  N  N    . THR   A  1  76  ? 12.133  14.356  33.377  1.000 26.942  0 131  THR   A N    1 ? 1 
ATOM   1081  C  CA   . THR   A  1  76  ? 11.038  14.945  32.624  1.000 23.662  0 131  THR   A CA   1 ? 1 
ATOM   1082  C  C    . THR   A  1  76  ? 9.937   15.500  33.529  1.000 24.489  0 131  THR   A C    1 ? 1 
ATOM   1083  O  O    . THR   A  1  76  ? 9.227   16.408  33.111  1.000 29.685  0 131  THR   A O    1 ? 1 
ATOM   1084  C  CB   . THR   A  1  76  ? 10.492  13.982  31.548  1.000 21.640  0 131  THR   A CB   1 ? 1 
ATOM   1085  O  OG1  . THR   A  1  76  ? 9.901   12.845  32.157  1.000 21.481  0 131  THR   A OG1  1 ? 1 
ATOM   1086  C  CG2  . THR   A  1  76  ? 11.545  13.582  30.578  1.000 20.609  0 131  THR   A CG2  1 ? 1 
ATOM   1087  H  H    . THR   A  1  76  ? 12.339  13.473  33.262  1.000 25.678  0 131  THR   A H    1 c 1 
ATOM   1088  H  HA   . THR   A  1  76  ? 11.420  15.715  32.143  1.000 23.972  0 131  THR   A HA   1 c 1 
ATOM   1089  H  HB   . THR   A  1  76  ? 9.788   14.464  31.052  1.000 21.436  0 131  THR   A HB   1 c 1 
ATOM   1090  H  HG1  . THR   A  1  76  ? 10.473  12.446  32.634  0.000 7.210   0 131  THR   A HG1  1 c 1 
ATOM   1091  H  HG21 . THR   A  1  76  ? 11.146  13.049  29.867  1.000 20.342  0 131  THR   A HG21 1 c 1 
ATOM   1092  H  HG22 . THR   A  1  76  ? 12.227  13.057  31.031  1.000 21.172  0 131  THR   A HG22 1 c 1 
ATOM   1093  H  HG23 . THR   A  1  76  ? 11.953  14.379  30.194  1.000 20.901  0 131  THR   A HG23 1 c 1 
ATOM   1094  N  N    . ASN   A  1  77  ? 9.821   15.006  34.774  1.000 26.765  0 132  ASN   A N    1 ? 1 
ATOM   1095  C  CA   . ASN   A  1  77  ? 8.739   15.440  35.655  1.000 25.787  0 132  ASN   A CA   1 ? 1 
ATOM   1096  C  C    . ASN   A  1  77  ? 9.184   16.466  36.696  1.000 24.803  0 132  ASN   A C    1 ? 1 
ATOM   1097  O  O    . ASN   A  1  77  ? 8.488   16.688  37.677  1.000 27.089  0 132  ASN   A O    1 ? 1 
ATOM   1098  C  CB   . ASN   A  1  77  ? 8.086   14.262  36.404  1.000 23.866  0 132  ASN   A CB   1 ? 1 
ATOM   1099  C  CG   . ASN   A  1  77  ? 9.023   13.582  37.374  1.000 26.474  0 132  ASN   A CG   1 ? 1 
ATOM   1100  O  OD1  . ASN   A  1  77  ? 10.260  13.761  37.339  1.000 31.370  0 132  ASN   A OD1  1 ? 1 
ATOM   1101  N  ND2  . ASN   A  1  77  ? 8.478   12.786  38.240  1.000 27.003  0 132  ASN   A ND2  1 ? 1 
ATOM   1102  H  H    . ASN   A  1  77  ? 10.413  14.379  35.076  1.000 26.118  0 132  ASN   A H    1 c 1 
ATOM   1103  H  HA   . ASN   A  1  77  ? 8.038   15.854  35.099  1.000 25.011  0 132  ASN   A HA   1 c 1 
ATOM   1104  H  HB2  . ASN   A  1  77  ? 7.304   14.590  36.892  1.000 25.059  0 132  ASN   A HB2  1 c 1 
ATOM   1105  H  HB3  . ASN   A  1  77  ? 7.779   13.606  35.747  1.000 24.341  0 132  ASN   A HB3  1 c 1 
ATOM   1106  H  HD21 . ASN   A  1  77  ? 7.675   12.447  38.086  1.000 26.717  0 132  ASN   A HD21 1 c 1 
ATOM   1107  H  HD22 . ASN   A  1  77  ? 8.907   12.581  38.985  1.000 27.455  0 132  ASN   A HD22 1 c 1 
ATOM   1108  N  N    . TYR   A  1  78  ? 10.327  17.114  36.463  1.000 31.427  0 133  TYR   A N    1 ? 1 
ATOM   1109  C  CA   . TYR   A  1  78  ? 10.890  18.004  37.465  1.000 27.817  0 133  TYR   A CA   1 ? 1 
ATOM   1110  C  C    . TYR   A  1  78  ? 9.968   19.177  37.786  1.000 30.145  0 133  TYR   A C    1 ? 1 
ATOM   1111  O  O    . TYR   A  1  78  ? 9.700   19.458  38.965  1.000 29.585  0 133  TYR   A O    1 ? 1 
ATOM   1112  C  CB   . TYR   A  1  78  ? 12.255  18.487  37.005  1.000 30.515  0 133  TYR   A CB   1 ? 1 
ATOM   1113  C  CG   . TYR   A  1  78  ? 12.851  19.602  37.834  1.000 33.037  0 133  TYR   A CG   1 ? 1 
ATOM   1114  C  CD1  . TYR   A  1  78  ? 13.379  19.360  39.096  1.000 30.862  0 133  TYR   A CD1  1 ? 1 
ATOM   1115  C  CD2  . TYR   A  1  78  ? 12.924  20.894  37.339  1.000 35.157  0 133  TYR   A CD2  1 ? 1 
ATOM   1116  C  CE1  . TYR   A  1  78  ? 13.943  20.399  39.854  1.000 34.018  0 133  TYR   A CE1  1 ? 1 
ATOM   1117  C  CE2  . TYR   A  1  78  ? 13.484  21.922  38.080  1.000 34.905  0 133  TYR   A CE2  1 ? 1 
ATOM   1118  C  CZ   . TYR   A  1  78  ? 13.986  21.673  39.334  1.000 33.288  0 133  TYR   A CZ   1 ? 1 
ATOM   1119  O  OH   . TYR   A  1  78  ? 14.522  22.719  40.017  1.000 34.619  0 133  TYR   A OH   1 ? 1 
ATOM   1120  H  H    . TYR   A  1  78  ? 10.762  17.010  35.666  1.000 28.092  0 133  TYR   A H    1 c 1 
ATOM   1121  H  HA   . TYR   A  1  78  ? 11.015  17.483  38.299  1.000 29.758  0 133  TYR   A HA   1 c 1 
ATOM   1122  H  HB2  . TYR   A  1  78  ? 12.869  17.724  37.019  1.000 30.110  0 133  TYR   A HB2  1 c 1 
ATOM   1123  H  HB3  . TYR   A  1  78  ? 12.179  18.790  36.079  1.000 29.813  0 133  TYR   A HB3  1 c 1 
ATOM   1124  H  HD1  . TYR   A  1  78  ? 13.346  18.489  39.456  1.000 32.006  0 133  TYR   A HD1  1 c 1 
ATOM   1125  H  HD2  . TYR   A  1  78  ? 12.580  21.080  36.481  1.000 34.007  0 133  TYR   A HD2  1 c 1 
ATOM   1126  H  HE1  . TYR   A  1  78  ? 14.288  20.228  40.713  1.000 33.861  0 133  TYR   A HE1  1 c 1 
ATOM   1127  H  HE2  . TYR   A  1  78  ? 13.513  22.796  37.727  1.000 34.617  0 133  TYR   A HE2  1 c 1 
ATOM   1128  H  HH   . TYR   A  1  78  ? 14.864  22.603  40.792  0.000 11.270  0 133  TYR   A HH   1 c 1 
ATOM   1129  N  N    . GLN   A  1  79  ? 9.518   19.888  36.738  1.000 30.661  0 134  GLN   A N    1 ? 1 
ATOM   1130  C  CA   . GLN   A  1  79  ? 8.677   21.067  36.932  1.000 35.787  0 134  GLN   A CA   1 ? 1 
ATOM   1131  C  C    . GLN   A  1  79  ? 7.351   20.669  37.567  1.000 32.774  0 134  GLN   A C    1 ? 1 
ATOM   1132  O  O    . GLN   A  1  79  ? 6.717   21.505  38.187  1.000 37.853  0 134  GLN   A O    1 ? 1 
ATOM   1133  C  CB   . GLN   A  1  79  ? 8.318   21.836  35.633  1.000 34.411  0 134  GLN   A CB   1 ? 1 
ATOM   1134  C  CG   . GLN   A  1  79  ? 9.476   22.315  34.780  1.000 40.382  0 134  GLN   A CG   1 ? 1 
ATOM   1135  C  CD   . GLN   A  1  79  ? 10.114  23.518  35.369  1.000 54.849  0 134  GLN   A CD   1 ? 1 
ATOM   1136  O  OE1  . GLN   A  1  79  ? 9.449   24.531  35.583  1.000 53.977  0 134  GLN   A OE1  1 ? 1 
ATOM   1137  N  NE2  . GLN   A  1  79  ? 11.416  23.431  35.664  1.000 55.852  0 134  GLN   A NE2  1 ? 1 
ATOM   1138  H  H    . GLN   A  1  79  ? 9.738   19.634  35.888  1.000 30.865  0 134  GLN   A H    1 c 1 
ATOM   1139  H  HA   . GLN   A  1  79  ? 9.145   21.682  37.542  1.000 34.532  0 134  GLN   A HA   1 c 1 
ATOM   1140  H  HB2  . GLN   A  1  79  ? 7.753   21.251  35.085  1.000 35.354  0 134  GLN   A HB2  1 c 1 
ATOM   1141  H  HB3  . GLN   A  1  79  ? 7.774   22.611  35.884  1.000 36.444  0 134  GLN   A HB3  1 c 1 
ATOM   1142  H  HG2  . GLN   A  1  79  ? 10.141  21.602  34.703  1.000 41.048  0 134  GLN   A HG2  1 c 1 
ATOM   1143  H  HG3  . GLN   A  1  79  ? 9.153   22.527  33.879  1.000 40.874  0 134  GLN   A HG3  1 c 1 
ATOM   1144  H  HE21 . GLN   A  1  79  ? 11.959  22.974  35.137  1.000 54.440  0 134  GLN   A HE21 1 c 1 
ATOM   1145  H  HE22 . GLN   A  1  79  ? 11.732  23.828  36.387  1.000 55.795  0 134  GLN   A HE22 1 c 1 
ATOM   1146  N  N    . VAL   A  1  80  ? 6.924   19.414  37.359  1.000 32.288  0 135  VAL   A N    1 ? 1 
ATOM   1147  C  CA   . VAL   A  1  80  ? 5.624   18.942  37.814  1.000 32.061  0 135  VAL   A CA   1 ? 1 
ATOM   1148  C  C    . VAL   A  1  80  ? 5.693   18.658  39.311  1.000 39.888  0 135  VAL   A C    1 ? 1 
ATOM   1149  O  O    . VAL   A  1  80  ? 4.895   19.183  40.089  1.000 42.299  0 135  VAL   A O    1 ? 1 
ATOM   1150  C  CB   . VAL   A  1  80  ? 5.175   17.687  37.000  1.000 34.004  0 135  VAL   A CB   1 ? 1 
ATOM   1151  C  CG1  . VAL   A  1  80  ? 3.966   16.988  37.635  1.000 33.130  0 135  VAL   A CG1  1 ? 1 
ATOM   1152  C  CG2  . VAL   A  1  80  ? 4.900   18.044  35.550  1.000 27.899  0 135  VAL   A CG2  1 ? 1 
ATOM   1153  H  H    . VAL   A  1  80  ? 7.458   18.832  36.899  1.000 31.772  0 135  VAL   A H    1 c 1 
ATOM   1154  H  HA   . VAL   A  1  80  ? 4.976   19.651  37.667  1.000 33.863  0 135  VAL   A HA   1 c 1 
ATOM   1155  H  HB   . VAL   A  1  80  ? 5.928   17.046  37.011  1.000 31.962  0 135  VAL   A HB   1 c 1 
ATOM   1156  H  HG11 . VAL   A  1  80  ? 3.287   17.649  37.857  1.000 33.727  0 135  VAL   A HG11 1 c 1 
ATOM   1157  H  HG12 . VAL   A  1  80  ? 4.244   16.526  38.445  1.000 33.824  0 135  VAL   A HG12 1 c 1 
ATOM   1158  H  HG13 . VAL   A  1  80  ? 3.596   16.344  37.007  1.000 32.883  0 135  VAL   A HG13 1 c 1 
ATOM   1159  H  HG21 . VAL   A  1  80  ? 4.593   17.254  35.073  1.000 28.837  0 135  VAL   A HG21 1 c 1 
ATOM   1160  H  HG22 . VAL   A  1  80  ? 5.717   18.374  35.137  1.000 29.190  0 135  VAL   A HG22 1 c 1 
ATOM   1161  H  HG23 . VAL   A  1  80  ? 4.215   18.733  35.510  1.000 29.483  0 135  VAL   A HG23 1 c 1 
ATOM   1162  N  N    . VAL   A  1  81  ? 6.676   17.837  39.695  1.000 38.152  0 136  VAL   A N    1 ? 1 
ATOM   1163  C  CA   . VAL   A  1  81  ? 6.850   17.430  41.076  1.000 41.687  0 136  VAL   A CA   1 ? 1 
ATOM   1164  C  C    . VAL   A  1  81  ? 7.416   18.572  41.920  1.000 44.936  0 136  VAL   A C    1 ? 1 
ATOM   1165  O  O    . VAL   A  1  81  ? 6.913   18.847  43.010  1.000 35.027  0 136  VAL   A O    1 ? 1 
ATOM   1166  C  CB   . VAL   A  1  81  ? 7.717   16.152  41.124  1.000 38.969  0 136  VAL   A CB   1 ? 1 
ATOM   1167  C  CG1  . VAL   A  1  81  ? 8.044   15.735  42.539  1.000 46.250  0 136  VAL   A CG1  1 ? 1 
ATOM   1168  C  CG2  . VAL   A  1  81  ? 7.031   15.030  40.374  1.000 34.723  0 136  VAL   A CG2  1 ? 1 
ATOM   1169  H  H    . VAL   A  1  81  ? 7.264   17.523  39.069  1.000 38.575  0 136  VAL   A H    1 c 1 
ATOM   1170  H  HA   . VAL   A  1  81  ? 5.971   17.205  41.432  1.000 41.155  0 136  VAL   A HA   1 c 1 
ATOM   1171  H  HB   . VAL   A  1  81  ? 8.568   16.352  40.662  1.000 39.555  0 136  VAL   A HB   1 c 1 
ATOM   1172  H  HG11 . VAL   A  1  81  ? 7.221   15.649  43.051  1.000 44.425  0 136  VAL   A HG11 1 c 1 
ATOM   1173  H  HG12 . VAL   A  1  81  ? 8.614   16.402  42.953  1.000 44.639  0 136  VAL   A HG12 1 c 1 
ATOM   1174  H  HG13 . VAL   A  1  81  ? 8.507   14.879  42.526  1.000 43.957  0 136  VAL   A HG13 1 c 1 
ATOM   1175  H  HG21 . VAL   A  1  81  ? 7.529   14.203  40.499  1.000 35.673  0 136  VAL   A HG21 1 c 1 
ATOM   1176  H  HG22 . VAL   A  1  81  ? 6.996   15.244  39.425  1.000 35.114  0 136  VAL   A HG22 1 c 1 
ATOM   1177  H  HG23 . VAL   A  1  81  ? 6.126   14.917  40.714  1.000 35.847  0 136  VAL   A HG23 1 c 1 
ATOM   1178  N  N    . CYS   A  1  82  ? 8.443   19.260  41.403  1.000 40.727  0 137  CYS   A N    1 ? 1 
ATOM   1179  C  CA   . CYS   A  1  82  ? 9.164   20.238  42.212  1.000 35.140  0 137  CYS   A CA   1 ? 1 
ATOM   1180  C  C    . CYS   A  1  82  ? 8.714   21.688  42.067  1.000 36.308  0 137  CYS   A C    1 ? 1 
ATOM   1181  O  O    . CYS   A  1  82  ? 9.024   22.479  42.950  1.000 41.917  0 137  CYS   A O    1 ? 1 
ATOM   1182  C  CB   . CYS   A  1  82  ? 10.661  20.137  41.963  1.000 31.798  0 137  CYS   A CB   1 ? 1 
ATOM   1183  S  SG   . CYS   A  1  82  ? 11.342  18.504  42.262  1.000 37.470  0 137  CYS   A SG   1 ? 1 
ATOM   1184  H  H    . CYS   A  1  82  ? 8.703   19.118  40.539  1.000 39.329  0 137  CYS   A H    1 c 1 
ATOM   1185  H  HA   . CYS   A  1  82  ? 9.015   19.989  43.152  1.000 36.271  0 137  CYS   A HA   1 c 1 
ATOM   1186  H  HB2  . CYS   A  1  82  ? 10.849  20.386  41.035  1.000 33.002  0 137  CYS   A HB2  1 c 1 
ATOM   1187  H  HB3  . CYS   A  1  82  ? 11.124  20.775  42.543  1.000 34.155  0 137  CYS   A HB3  1 c 1 
ATOM   1188  N  N    . LYS   A  1  83  ? 8.048   22.057  40.961  1.000 33.178  0 138  LYS   A N    1 ? 1 
ATOM   1189  C  CA   . LYS   A  1  83  ? 7.653   23.443  40.742  1.000 31.685  0 138  LYS   A CA   1 ? 1 
ATOM   1190  C  C    . LYS   A  1  83  ? 6.152   23.652  40.574  1.000 33.089  0 138  LYS   A C    1 ? 1 
ATOM   1191  O  O    . LYS   A  1  83  ? 5.737   24.712  40.125  1.000 50.786  0 138  LYS   A O    1 ? 1 
ATOM   1192  C  CB   . LYS   A  1  83  ? 8.369   24.041  39.521  1.000 33.714  0 138  LYS   A CB   1 ? 1 
ATOM   1193  C  CG   . LYS   A  1  83  ? 9.909   24.113  39.649  1.000 38.391  0 138  LYS   A CG   1 ? 1 
ATOM   1194  C  CD   . LYS   A  1  83  ? 10.418  25.014  40.786  1.000 39.329  0 138  LYS   A CD   1 ? 1 
ATOM   1195  C  CE   . LYS   A  1  83  ? 11.925  24.988  40.856  1.000 43.975  0 138  LYS   A CE   1 ? 1 
ATOM   1196  N  NZ   . LYS   A  1  83  ? 12.418  25.537  42.133  1.000 52.787  0 138  LYS   A NZ   1 ? 1 
ATOM   1197  H  H    . LYS   A  1  83  ? 7.841   21.433  40.326  1.000 32.734  0 138  LYS   A H    1 c 1 
ATOM   1198  H  HA   . LYS   A  1  83  ? 7.931   23.958  41.532  1.000 33.562  0 138  LYS   A HA   1 c 1 
ATOM   1199  H  HB2  . LYS   A  1  83  ? 8.146   23.504  38.734  1.000 33.309  0 138  LYS   A HB2  1 c 1 
ATOM   1200  H  HB3  . LYS   A  1  83  ? 8.029   24.948  39.371  1.000 34.260  0 138  LYS   A HB3  1 c 1 
ATOM   1201  H  HG2  . LYS   A  1  83  ? 10.252  23.205  39.790  1.000 37.037  0 138  LYS   A HG2  1 c 1 
ATOM   1202  H  HG3  . LYS   A  1  83  ? 10.277  24.439  38.800  1.000 36.896  0 138  LYS   A HG3  1 c 1 
ATOM   1203  H  HD2  . LYS   A  1  83  ? 10.115  25.935  40.634  1.000 40.530  0 138  LYS   A HD2  1 c 1 
ATOM   1204  H  HD3  . LYS   A  1  83  ? 10.049  24.704  41.640  1.000 40.618  0 138  LYS   A HD3  1 c 1 
ATOM   1205  H  HE2  . LYS   A  1  83  ? 12.242  24.070  40.762  1.000 43.994  0 138  LYS   A HE2  1 c 1 
ATOM   1206  H  HE3  . LYS   A  1  83  ? 12.296  25.513  40.121  1.000 44.224  0 138  LYS   A HE3  1 c 1 
ATOM   1207  H  HZ1  . LYS   A  1  83  ? 12.105  25.039  42.823  1.000 50.313  0 138  LYS   A HZ1  1 c 1 
ATOM   1208  H  HZ2  . LYS   A  1  83  ? 12.132  26.392  42.231  1.000 50.529  0 138  LYS   A HZ2  1 c 1 
ATOM   1209  H  HZ3  . LYS   A  1  83  ? 13.322  25.524  42.144  1.000 50.403  0 138  LYS   A HZ3  1 c 1 
ATOM   1210  N  N    . GLY   A  1  84  ? 5.342   22.656  40.942  1.000 36.802  0 139  GLY   A N    1 ? 1 
ATOM   1211  C  CA   . GLY   A  1  84  ? 3.894   22.810  40.989  1.000 36.200  0 139  GLY   A CA   1 ? 1 
ATOM   1212  C  C    . GLY   A  1  84  ? 3.172   22.830  39.638  1.000 35.962  0 139  GLY   A C    1 ? 1 
ATOM   1213  O  O    . GLY   A  1  84  ? 1.998   23.142  39.568  1.000 37.751  0 139  GLY   A O    1 ? 1 
ATOM   1214  H  H    . GLY   A  1  84  ? 5.702   21.848  41.174  1.000 35.436  0 139  GLY   A H    1 c 1 
ATOM   1215  H  HA2  . GLY   A  1  84  ? 3.523   22.070  41.533  1.000 36.610  0 139  GLY   A HA2  1 c 1 
ATOM   1216  H  HA3  . GLY   A  1  84  ? 3.688   23.651  41.469  1.000 37.157  0 139  GLY   A HA3  1 c 1 
ATOM   1217  N  N    . GLU   A  1  85  ? 3.868   22.507  38.555  1.000 35.707  0 140  GLU   A N    1 ? 1 
ATOM   1218  C  CA   . GLU   A  1  85  ? 3.249   22.505  37.244  1.000 38.065  0 140  GLU   A CA   1 ? 1 
ATOM   1219  C  C    . GLU   A  1  85  ? 2.461   21.219  37.028  1.000 32.020  0 140  GLU   A C    1 ? 1 
ATOM   1220  O  O    . GLU   A  1  85  ? 2.690   20.219  37.706  1.000 30.684  0 140  GLU   A O    1 ? 1 
ATOM   1221  C  CB   . GLU   A  1  85  ? 4.309   22.711  36.164  1.000 40.359  0 140  GLU   A CB   1 ? 1 
ATOM   1222  C  CG   . GLU   A  1  85  ? 4.916   24.113  36.239  1.000 42.239  0 140  GLU   A CG   1 ? 1 
ATOM   1223  C  CD   . GLU   A  1  85  ? 5.784   24.514  35.054  1.000 62.071  0 140  GLU   A CD   1 ? 1 
ATOM   1224  O  OE1  . GLU   A  1  85  ? 5.852   23.743  34.066  1.000 50.841  0 140  GLU   A OE1  1 ? 1 
ATOM   1225  O  OE2  . GLU   A  1  85  ? 6.408   25.600  35.119  1.000 53.717  0 140  GLU   A OE2  1 ? 1 
ATOM   1226  H  H    . GLU   A  1  85  ? 4.748   22.271  38.629  1.000 36.195  0 140  GLU   A H    1 c 1 
ATOM   1227  H  HA   . GLU   A  1  85  ? 2.619   23.262  37.203  1.000 37.017  0 140  GLU   A HA   1 c 1 
ATOM   1228  H  HB2  . GLU   A  1  85  ? 5.017   22.043  36.277  1.000 39.726  0 140  GLU   A HB2  1 c 1 
ATOM   1229  H  HB3  . GLU   A  1  85  ? 3.898   22.580  35.285  1.000 39.408  0 140  GLU   A HB3  1 c 1 
ATOM   1230  H  HG2  . GLU   A  1  85  ? 4.189   24.767  36.320  1.000 45.855  0 140  GLU   A HG2  1 c 1 
ATOM   1231  H  HG3  . GLU   A  1  85  ? 5.459   24.178  37.053  1.000 46.096  0 140  GLU   A HG3  1 c 1 
ATOM   1232  N  N    . SER   A  1  86  ? 1.500   21.266  36.098  1.000 29.548  0 141  SER   A N    1 ? 1 
ATOM   1233  C  CA   . SER   A  1  86  ? 0.690   20.094  35.795  1.000 31.910  0 141  SER   A CA   1 ? 1 
ATOM   1234  C  C    . SER   A  1  86  ? 1.420   19.199  34.800  1.000 27.310  0 141  SER   A C    1 ? 1 
ATOM   1235  O  O    . SER   A  1  86  ? 2.201   19.692  34.001  1.000 34.979  0 141  SER   A O    1 ? 1 
ATOM   1236  C  CB   . SER   A  1  86  ? -0.660  20.518  35.229  1.000 35.688  0 141  SER   A CB   1 ? 1 
ATOM   1237  O  OG   . SER   A  1  86  ? -0.484  21.391  34.117  1.000 32.772  0 141  SER   A OG   1 ? 1 
ATOM   1238  H  H    . SER   A  1  86  ? 1.347   22.043  35.641  1.000 30.735  0 141  SER   A H    1 c 1 
ATOM   1239  H  HA   . SER   A  1  86  ? 0.541   19.585  36.636  1.000 31.535  0 141  SER   A HA   1 c 1 
ATOM   1240  H  HB2  . SER   A  1  86  ? -1.162  19.721  34.946  1.000 33.739  0 141  SER   A HB2  1 c 1 
ATOM   1241  H  HB3  . SER   A  1  86  ? -1.179  20.976  35.929  1.000 34.743  0 141  SER   A HB3  1 c 1 
ATOM   1242  H  HG   . SER   A  1  86  ? -0.452  20.919  33.418  0.000 16.180  0 141  SER   A HG   1 c 1 
ATOM   1243  N  N    . HIS   A  1  87  ? 1.155   17.892  34.826  1.000 26.217  0 142  HIS   A N    1 ? 1 
ATOM   1244  C  CA   . HIS   A  1  87  ? 1.442   17.045  33.670  1.000 27.541  0 142  HIS   A CA   1 ? 1 
ATOM   1245  C  C    . HIS   A  1  87  ? 0.744   17.536  32.395  1.000 23.830  0 142  HIS   A C    1 ? 1 
ATOM   1246  O  O    . HIS   A  1  87  ? -0.369  18.039  32.450  1.000 27.988  0 142  HIS   A O    1 ? 1 
ATOM   1247  C  CB   . HIS   A  1  87  ? 1.011   15.622  33.917  1.000 25.253  0 142  HIS   A CB   1 ? 1 
ATOM   1248  C  CG   . HIS   A  1  87  ? 1.828   14.870  34.917  1.000 27.305  0 142  HIS   A CG   1 ? 1 
ATOM   1249  N  ND1  . HIS   A  1  87  ? 3.120   14.464  34.636  1.000 31.418  0 142  HIS   A ND1  1 ? 1 
ATOM   1250  C  CD2  . HIS   A  1  87  ? 1.492   14.438  36.144  1.000 25.419  0 142  HIS   A CD2  1 ? 1 
ATOM   1251  C  CE1  . HIS   A  1  87  ? 3.534   13.799  35.694  1.000 31.739  0 142  HIS   A CE1  1 ? 1 
ATOM   1252  N  NE2  . HIS   A  1  87  ? 2.577   13.768  36.636  1.000 29.100  0 142  HIS   A NE2  1 ? 1 
ATOM   1253  H  H    . HIS   A  1  87  ? 0.788   17.517  35.574  1.000 27.246  0 142  HIS   A H    1 c 1 
ATOM   1254  H  HA   . HIS   A  1  87  ? 2.417   17.053  33.524  1.000 25.982  0 142  HIS   A HA   1 c 1 
ATOM   1255  H  HB2  . HIS   A  1  87  ? 0.083   15.630  34.219  1.000 26.418  0 142  HIS   A HB2  1 c 1 
ATOM   1256  H  HB3  . HIS   A  1  87  ? 1.043   15.138  33.068  1.000 25.586  0 142  HIS   A HB3  1 c 1 
ATOM   1257  H  HD1  . HIS   A  1  87  ? 3.553   14.605  33.880  0.000 15.550  0 142  HIS   A HD1  1 c 1 
ATOM   1258  H  HD2  . HIS   A  1  87  ? 0.664   14.574  36.580  1.000 27.090  0 142  HIS   A HD2  1 c 1 
ATOM   1259  H  HE1  . HIS   A  1  87  ? 4.391   13.419  35.787  1.000 31.030  0 142  HIS   A HE1  1 c 1 
ATOM   1260  H  HE2  . HIS   A  1  87  ? 2.638   13.373  37.433  0.000 12.080  0 142  HIS   A HE2  1 c 1 
ATOM   1261  N  N    . TRP   A  1  88  ? 1.407   17.386  31.249  1.000 27.717  0 143  TRP   A N    1 ? 1 
ATOM   1262  C  CA   . TRP   A  1  88  ? 0.829   17.722  29.954  1.000 24.599  0 143  TRP   A CA   1 ? 1 
ATOM   1263  C  C    . TRP   A  1  88  ? -0.544  17.073  29.760  1.000 24.948  0 143  TRP   A C    1 ? 1 
ATOM   1264  O  O    . TRP   A  1  88  ? -1.498  17.739  29.366  1.000 32.775  0 143  TRP   A O    1 ? 1 
ATOM   1265  C  CB   . TRP   A  1  88  ? 1.817   17.311  28.819  1.000 26.563  0 143  TRP   A CB   1 ? 1 
ATOM   1266  C  CG   . TRP   A  1  88  ? 1.248   17.428  27.438  1.000 23.652  0 143  TRP   A CG   1 ? 1 
ATOM   1267  C  CD1  . TRP   A  1  88  ? 1.189   18.549  26.669  1.000 30.268  0 143  TRP   A CD1  1 ? 1 
ATOM   1268  C  CD2  . TRP   A  1  88  ? 0.600   16.393  26.689  1.000 26.727  0 143  TRP   A CD2  1 ? 1 
ATOM   1269  N  NE1  . TRP   A  1  88  ? 0.560   18.273  25.469  1.000 31.171  0 143  TRP   A NE1  1 ? 1 
ATOM   1270  C  CE2  . TRP   A  1  88  ? 0.188   16.959  25.458  1.000 28.442  0 143  TRP   A CE2  1 ? 1 
ATOM   1271  C  CE3  . TRP   A  1  88  ? 0.355   15.022  26.918  1.000 22.980  0 143  TRP   A CE3  1 ? 1 
ATOM   1272  C  CZ2  . TRP   A  1  88  ? -0.439  16.206  24.470  1.000 23.745  0 143  TRP   A CZ2  1 ? 1 
ATOM   1273  C  CZ3  . TRP   A  1  88  ? -0.285  14.293  25.942  1.000 25.721  0 143  TRP   A CZ3  1 ? 1 
ATOM   1274  C  CH2  . TRP   A  1  88  ? -0.667  14.871  24.738  1.000 19.648  0 143  TRP   A CH2  1 ? 1 
ATOM   1275  H  H    . TRP   A  1  88  ? 2.260   17.059  31.272  1.000 25.774  0 143  TRP   A H    1 c 1 
ATOM   1276  H  HA   . TRP   A  1  88  ? 0.721   18.702  29.919  1.000 25.906  0 143  TRP   A HA   1 c 1 
ATOM   1277  H  HB2  . TRP   A  1  88  ? 2.614   17.876  28.886  1.000 25.528  0 143  TRP   A HB2  1 c 1 
ATOM   1278  H  HB3  . TRP   A  1  88  ? 2.094   16.385  28.974  1.000 25.175  0 143  TRP   A HB3  1 c 1 
ATOM   1279  H  HD1  . TRP   A  1  88  ? 1.520   19.399  26.918  1.000 29.027  0 143  TRP   A HD1  1 c 1 
ATOM   1280  H  HE1  . TRP   A  1  88  ? 0.423   18.850  24.822  1.000 29.932  0 143  TRP   A HE1  1 c 1 
ATOM   1281  H  HE3  . TRP   A  1  88  ? 0.613   14.618  27.731  1.000 24.696  0 143  TRP   A HE3  1 c 1 
ATOM   1282  H  HZ2  . TRP   A  1  88  ? -0.707  16.596  23.657  1.000 23.429  0 143  TRP   A HZ2  1 c 1 
ATOM   1283  H  HZ3  . TRP   A  1  88  ? -0.462  13.378  26.090  1.000 23.293  0 143  TRP   A HZ3  1 c 1 
ATOM   1284  H  HH2  . TRP   A  1  88  ? -1.109  14.344  24.097  1.000 21.492  0 143  TRP   A HH2  1 c 1 
ATOM   1285  N  N    . VAL   A  1  89  ? -0.647  15.779  30.073  1.000 26.183  0 144  VAL   A N    1 ? 1 
ATOM   1286  C  CA   . VAL   A  1  89  ? -1.903  15.038  29.952  1.000 26.749  0 144  VAL   A CA   1 ? 1 
ATOM   1287  C  C    . VAL   A  1  89  ? -3.058  15.591  30.790  1.000 29.585  0 144  VAL   A C    1 ? 1 
ATOM   1288  O  O    . VAL   A  1  89  ? -4.224  15.350  30.493  1.000 34.528  0 144  VAL   A O    1 ? 1 
ATOM   1289  C  CB   . VAL   A  1  89  ? -1.685  13.537  30.301  1.000 27.556  0 144  VAL   A CB   1 ? 1 
ATOM   1290  C  CG1  . VAL   A  1  89  ? -1.398  13.334  31.801  1.000 27.268  0 144  VAL   A CG1  1 ? 1 
ATOM   1291  C  CG2  . VAL   A  1  89  ? -2.866  12.678  29.825  1.000 29.969  0 144  VAL   A CG2  1 ? 1 
ATOM   1292  H  H    . VAL   A  1  89  ? 0.095   15.334  30.369  1.000 25.978  0 144  VAL   A H    1 c 1 
ATOM   1293  H  HA   . VAL   A  1  89  ? -2.174  15.085  29.018  1.000 26.779  0 144  VAL   A HA   1 c 1 
ATOM   1294  H  HB   . VAL   A  1  89  ? -0.885  13.239  29.806  1.000 27.195  0 144  VAL   A HB   1 c 1 
ATOM   1295  H  HG11 . VAL   A  1  89  ? -2.211  13.486  32.313  1.000 27.952  0 144  VAL   A HG11 1 c 1 
ATOM   1296  H  HG12 . VAL   A  1  89  ? -0.712  13.960  32.089  1.000 27.755  0 144  VAL   A HG12 1 c 1 
ATOM   1297  H  HG13 . VAL   A  1  89  ? -1.088  12.423  31.951  1.000 27.421  0 144  VAL   A HG13 1 c 1 
ATOM   1298  H  HG21 . VAL   A  1  89  ? -2.592  11.746  29.788  1.000 28.863  0 144  VAL   A HG21 1 c 1 
ATOM   1299  H  HG22 . VAL   A  1  89  ? -3.144  12.969  28.939  1.000 28.785  0 144  VAL   A HG22 1 c 1 
ATOM   1300  H  HG23 . VAL   A  1  89  ? -3.610  12.773  30.446  1.000 29.580  0 144  VAL   A HG23 1 c 1 
ATOM   1301  N  N    . ASP   A  1  90  ? -2.745  16.328  31.856  1.000 27.590  0 145  ASP   A N    1 ? 1 
ATOM   1302  C  CA   . ASP   A  1  90  ? -3.798  16.885  32.684  1.000 31.586  0 145  ASP   A CA   1 ? 1 
ATOM   1303  C  C    . ASP   A  1  90  ? -4.283  18.236  32.157  1.000 35.800  0 145  ASP   A C    1 ? 1 
ATOM   1304  O  O    . ASP   A  1  90  ? -5.196  18.818  32.722  1.000 30.649  0 145  ASP   A O    1 ? 1 
ATOM   1305  C  CB   . ASP   A  1  90  ? -3.310  17.002  34.124  1.000 34.455  0 145  ASP   A CB   1 ? 1 
ATOM   1306  C  CG   . ASP   A  1  90  ? -3.035  15.650  34.751  1.000 38.587  0 145  ASP   A CG   1 ? 1 
ATOM   1307  O  OD1  . ASP   A  1  90  ? -3.876  14.722  34.566  1.000 33.150  0 145  ASP   A OD1  1 ? 1 
ATOM   1308  O  OD2  . ASP   A  1  90  ? -2.005  15.517  35.438  1.000 44.910  0 145  ASP   A OD2  1 ? 1 
ATOM   1309  H  H    . ASP   A  1  90  ? -1.872  16.474  32.082  1.000 28.906  0 145  ASP   A H    1 c 1 
ATOM   1310  H  HA   . ASP   A  1  90  ? -4.561  16.261  32.674  1.000 31.931  0 145  ASP   A HA   1 c 1 
ATOM   1311  H  HB2  . ASP   A  1  90  ? -2.487  17.531  34.146  1.000 34.857  0 145  ASP   A HB2  1 c 1 
ATOM   1312  H  HB3  . ASP   A  1  90  ? -3.987  17.462  34.661  1.000 35.346  0 145  ASP   A HB3  1 c 1 
ATOM   1313  N  N    . ASP   A  1  91  ? -3.664  18.745  31.089  1.000 31.066  0 146  ASP   A N    1 ? 1 
ATOM   1314  C  CA   . ASP   A  1  91  ? -4.126  19.971  30.472  1.000 34.334  0 146  ASP   A CA   1 ? 1 
ATOM   1315  C  C    . ASP   A  1  91  ? -5.149  19.621  29.393  1.000 30.437  0 146  ASP   A C    1 ? 1 
ATOM   1316  O  O    . ASP   A  1  91  ? -5.026  18.592  28.737  1.000 40.878  0 146  ASP   A O    1 ? 1 
ATOM   1317  C  CB   . ASP   A  1  91  ? -2.964  20.753  29.879  1.000 38.482  0 146  ASP   A CB   1 ? 1 
ATOM   1318  C  CG   . ASP   A  1  91  ? -1.853  21.082  30.847  1.000 36.127  0 146  ASP   A CG   1 ? 1 
ATOM   1319  O  OD1  . ASP   A  1  91  ? -2.147  21.277  32.034  1.000 36.208  0 146  ASP   A OD1  1 ? 1 
ATOM   1320  O  OD2  . ASP   A  1  91  ? -0.680  21.139  30.409  1.000 37.955  0 146  ASP   A OD2  1 ? 1 
ATOM   1321  H  H    . ASP   A  1  91  ? -2.930  18.327  30.742  1.000 32.193  0 146  ASP   A H    1 c 1 
ATOM   1322  H  HA   . ASP   A  1  91  ? -4.562  20.528  31.159  1.000 34.338  0 146  ASP   A HA   1 c 1 
ATOM   1323  H  HB2  . ASP   A  1  91  ? -2.581  20.235  29.142  1.000 36.193  0 146  ASP   A HB2  1 c 1 
ATOM   1324  H  HB3  . ASP   A  1  91  ? -3.306  21.594  29.512  1.000 36.948  0 146  ASP   A HB3  1 c 1 
ATOM   1325  N  N    . ASP   A  1  92  ? -6.153  20.481  29.210  1.000 38.310  0 147  ASP   A N    1 ? 1 
ATOM   1326  C  CA   . ASP   A  1  92  ? -7.145  20.260  28.167  1.000 39.426  0 147  ASP   A CA   1 ? 1 
ATOM   1327  C  C    . ASP   A  1  92  ? -6.489  20.478  26.810  1.000 34.676  0 147  ASP   A C    1 ? 1 
ATOM   1328  O  O    . ASP   A  1  92  ? -5.520  21.228  26.716  1.000 28.457  0 147  ASP   A O    1 ? 1 
ATOM   1329  C  CB   . ASP   A  1  92  ? -8.344  21.213  28.273  1.000 46.135  0 147  ASP   A CB   1 ? 1 
ATOM   1330  C  CG   . ASP   A  1  92  ? -8.985  21.283  29.603  1.000 57.730  0 147  ASP   A CG   1 ? 1 
ATOM   1331  O  OD1  . ASP   A  1  92  ? -9.365  20.216  30.121  1.000 57.316  0 147  ASP   A OD1  1 ? 1 
ATOM   1332  O  OD2  . ASP   A  1  92  ? -9.115  22.419  30.137  1.000 62.070  0 147  ASP   A OD2  1 ? 1 
ATOM   1333  H  H    . ASP   A  1  92  ? -6.218  21.224  29.738  1.000 37.159  0 147  ASP   A H    1 c 1 
ATOM   1334  H  HA   . ASP   A  1  92  ? -7.468  19.330  28.226  1.000 39.041  0 147  ASP   A HA   1 c 1 
ATOM   1335  H  HB2  . ASP   A  1  92  ? -8.047  22.115  28.034  1.000 47.012  0 147  ASP   A HB2  1 c 1 
ATOM   1336  H  HB3  . ASP   A  1  92  ? -9.023  20.938  27.624  1.000 46.701  0 147  ASP   A HB3  1 c 1 
ATOM   1337  N  N    . CYS   A  1  93  ? -7.043  19.843  25.765  1.000 35.751  0 148  CYS   A N    1 ? 1 
ATOM   1338  C  CA   . CYS   A  1  93  ? -6.669  20.166  24.397  1.000 40.122  0 148  CYS   A CA   1 ? 1 
ATOM   1339  C  C    . CYS   A  1  93  ? -6.637  21.685  24.278  1.000 32.652  0 148  CYS   A C    1 ? 1 
ATOM   1340  O  O    . CYS   A  1  93  ? -7.578  22.349  24.689  1.000 32.615  0 148  CYS   A O    1 ? 1 
ATOM   1341  C  CB   . CYS   A  1  93  ? -7.640  19.572  23.373  1.000 32.394  0 148  CYS   A CB   1 ? 1 
ATOM   1342  S  SG   . CYS   A  1  93  ? -7.842  17.772  23.461  1.000 46.711  0 148  CYS   A SG   1 ? 1 
ATOM   1343  H  H    . CYS   A  1  93  ? -7.669  19.193  25.911  1.000 36.356  0 148  CYS   A H    1 c 1 
ATOM   1344  H  HA   . CYS   A  1  93  ? -5.767  19.810  24.228  1.000 35.795  0 148  CYS   A HA   1 c 1 
ATOM   1345  H  HB2  . CYS   A  1  93  ? -8.519  19.986  23.496  1.000 36.765  0 148  CYS   A HB2  1 c 1 
ATOM   1346  H  HB3  . CYS   A  1  93  ? -7.328  19.800  22.475  1.000 35.973  0 148  CYS   A HB3  1 c 1 
ATOM   1347  N  N    . GLU   A  1  94  ? -5.590  22.232  23.660  1.000 39.624  0 149  GLU   A N    1 ? 1 
ATOM   1348  C  CA   . GLU   A  1  94  ? -5.595  23.637  23.285  1.000 38.651  0 149  GLU   A CA   1 ? 1 
ATOM   1349  C  C    . GLU   A  1  94  ? -5.064  23.763  21.859  1.000 33.945  0 149  GLU   A C    1 ? 1 
ATOM   1350  O  O    . GLU   A  1  94  ? -3.904  23.466  21.618  1.000 46.020  0 149  GLU   A O    1 ? 1 
ATOM   1351  C  CB   . GLU   A  1  94  ? -4.753  24.466  24.258  1.000 43.890  0 149  GLU   A CB   1 ? 1 
ATOM   1352  C  CG   . GLU   A  1  94  ? -5.034  25.954  24.128  1.000 53.074  0 149  GLU   A CG   1 ? 1 
ATOM   1353  C  CD   . GLU   A  1  94  ? -4.069  26.864  24.866  1.000 83.206  0 149  GLU   A CD   1 ? 1 
ATOM   1354  O  OE1  . GLU   A  1  94  ? -3.103  26.353  25.482  1.000 64.304  0 149  GLU   A OE1  1 ? 1 
ATOM   1355  O  OE2  . GLU   A  1  94  ? -4.282  28.098  24.819  1.000 68.767  0 149  GLU   A OE2  1 ? 1 
ATOM   1356  H  H    . GLU   A  1  94  ? -4.855  21.723  23.469  1.000 36.963  0 149  GLU   A H    1 c 1 
ATOM   1357  H  HA   . GLU   A  1  94  ? -6.522  23.966  23.307  1.000 39.055  0 149  GLU   A HA   1 c 1 
ATOM   1358  H  HB2  . GLU   A  1  94  ? -4.951  24.178  25.173  1.000 44.728  0 149  GLU   A HB2  1 c 1 
ATOM   1359  H  HB3  . GLU   A  1  94  ? -3.804  24.297  24.082  1.000 44.188  0 149  GLU   A HB3  1 c 1 
ATOM   1360  H  HG2  . GLU   A  1  94  ? -5.017  26.197  23.178  1.000 55.807  0 149  GLU   A HG2  1 c 1 
ATOM   1361  H  HG3  . GLU   A  1  94  ? -5.939  26.133  24.460  1.000 56.543  0 149  GLU   A HG3  1 c 1 
ATOM   1362  N  N    . GLU   A  1  95  ? -5.914  24.207  20.924  1.000 34.324  0 150  GLU   A N    1 ? 1 
ATOM   1363  C  CA   . GLU   A  1  95  ? -5.511  24.422  19.546  1.000 27.078  0 150  GLU   A CA   1 ? 1 
ATOM   1364  C  C    . GLU   A  1  95  ? -4.219  25.229  19.440  1.000 26.839  0 150  GLU   A C    1 ? 1 
ATOM   1365  O  O    . GLU   A  1  95  ? -4.100  26.327  19.991  1.000 32.555  0 150  GLU   A O    1 ? 1 
ATOM   1366  C  CB   . GLU   A  1  95  ? -6.607  25.143  18.753  1.000 40.025  0 150  GLU   A CB   1 ? 1 
ATOM   1367  C  CG   . GLU   A  1  95  ? -6.352  25.126  17.245  1.000 42.836  0 150  GLU   A CG   1 ? 1 
ATOM   1368  C  CD   . GLU   A  1  95  ? -7.530  25.543  16.382  1.000 44.318  0 150  GLU   A CD   1 ? 1 
ATOM   1369  O  OE1  . GLU   A  1  95  ? -8.502  26.098  16.938  1.000 45.395  0 150  GLU   A OE1  1 ? 1 
ATOM   1370  O  OE2  . GLU   A  1  95  ? -7.484  25.311  15.152  1.000 37.340  0 150  GLU   A OE2  1 ? 1 
ATOM   1371  H  H    . GLU   A  1  95  ? -6.780  24.381  21.158  1.000 32.943  0 150  GLU   A H    1 c 1 
ATOM   1372  H  HA   . GLU   A  1  95  ? -5.361  23.540  19.135  1.000 29.572  0 150  GLU   A HA   1 c 1 
ATOM   1373  H  HB2  . GLU   A  1  95  ? -7.467  24.710  18.938  1.000 36.994  0 150  GLU   A HB2  1 c 1 
ATOM   1374  H  HB3  . GLU   A  1  95  ? -6.661  26.072  19.061  1.000 37.421  0 150  GLU   A HB3  1 c 1 
ATOM   1375  H  HG2  . GLU   A  1  95  ? -5.600  25.725  17.045  1.000 42.281  0 150  GLU   A HG2  1 c 1 
ATOM   1376  H  HG3  . GLU   A  1  95  ? -6.083  24.221  16.980  1.000 41.672  0 150  GLU   A HG3  1 c 1 
ATOM   1377  N  N    . ILE   A  1  96  ? -3.217  24.619  18.803  1.000 28.218  0 151  ILE   A N    1 ? 1 
ATOM   1378  C  CA   . ILE   A  1  96  ? -1.995  25.309  18.441  1.000 30.489  0 151  ILE   A CA   1 ? 1 
ATOM   1379  C  C    . ILE   A  1  96  ? -2.178  25.862  17.030  1.000 26.128  0 151  ILE   A C    1 ? 1 
ATOM   1380  O  O    . ILE   A  1  96  ? -1.968  25.151  16.051  1.000 28.324  0 151  ILE   A O    1 ? 1 
ATOM   1381  C  CB   . ILE   A  1  96  ? -0.785  24.364  18.541  1.000 34.400  0 151  ILE   A CB   1 ? 1 
ATOM   1382  C  CG1  . ILE   A  1  96  ? -0.749  23.611  19.903  1.000 41.518  0 151  ILE   A CG1  1 ? 1 
ATOM   1383  C  CG2  . ILE   A  1  96  ? 0.527   25.177  18.278  1.000 34.884  0 151  ILE   A CG2  1 ? 1 
ATOM   1384  C  CD1  . ILE   A  1  96  ? 0.135   22.409  19.900  1.000 38.877  0 151  ILE   A CD1  1 ? 1 
ATOM   1385  H  H    . ILE   A  1  96  ? -3.302  23.737  18.580  1.000 27.912  0 151  ILE   A H    1 c 1 
ATOM   1386  H  HA   . ILE   A  1  96  ? -1.858  26.052  19.056  1.000 30.353  0 151  ILE   A HA   1 c 1 
ATOM   1387  H  HB   . ILE   A  1  96  ? -0.872  23.685  17.826  1.000 34.160  0 151  ILE   A HB   1 c 1 
ATOM   1388  H  HG12 . ILE   A  1  96  ? -0.437  24.230  20.597  1.000 39.720  0 151  ILE   A HG12 1 c 1 
ATOM   1389  H  HG13 . ILE   A  1  96  ? -1.658  23.330  20.138  1.000 39.176  0 151  ILE   A HG13 1 c 1 
ATOM   1390  H  HG21 . ILE   A  1  96  ? 0.551   25.955  18.861  1.000 35.305  0 151  ILE   A HG21 1 c 1 
ATOM   1391  H  HG22 . ILE   A  1  96  ? 0.550   25.468  17.350  1.000 34.627  0 151  ILE   A HG22 1 c 1 
ATOM   1392  H  HG23 . ILE   A  1  96  ? 1.301   24.616  18.457  1.000 34.600  0 151  ILE   A HG23 1 c 1 
ATOM   1393  H  HD11 . ILE   A  1  96  ? 1.023   22.657  19.590  1.000 39.176  0 151  ILE   A HD11 1 c 1 
ATOM   1394  H  HD12 . ILE   A  1  96  ? -0.236  21.734  19.305  1.000 39.012  0 151  ILE   A HD12 1 c 1 
ATOM   1395  H  HD13 . ILE   A  1  96  ? 0.196   22.047  20.801  1.000 39.549  0 151  ILE   A HD13 1 c 1 
ATOM   1396  N  N    . LYS   A  1  97  ? -2.612  27.122  16.943  1.000 30.130  0 152  LYS   A N    1 ? 1 
ATOM   1397  C  CA   . LYS   A  1  97  ? -2.919  27.761  15.669  1.000 33.426  0 152  LYS   A CA   1 ? 1 
ATOM   1398  C  C    . LYS   A  1  97  ? -1.634  28.149  14.942  1.000 41.187  0 152  LYS   A C    1 ? 1 
ATOM   1399  O  O    . LYS   A  1  97  ? -1.606  28.203  13.722  1.000 47.130  0 152  LYS   A O    1 ? 1 
ATOM   1400  C  CB   . LYS   A  1  97  ? -3.782  29.003  15.875  1.000 41.376  0 152  LYS   A CB   1 ? 1 
ATOM   1401  C  CG   . LYS   A  1  97  ? -5.250  28.732  16.273  1.000 47.972  0 152  LYS   A CG   1 ? 1 
ATOM   1402  C  CD   . LYS   A  1  97  ? -6.108  29.987  16.168  1.000 53.108  0 152  LYS   A CD   1 ? 1 
ATOM   1403  C  CE   . LYS   A  1  97  ? -7.585  29.745  16.303  1.000 57.623  0 152  LYS   A CE   1 ? 1 
ATOM   1404  N  NZ   . LYS   A  1  97  ? -7.983  29.661  17.722  1.000 70.468  0 152  LYS   A NZ   1 ? 1 
ATOM   1405  H  H    . LYS   A  1  97  ? -2.722  27.606  17.710  1.000 30.484  0 152  LYS   A H    1 c 1 
ATOM   1406  H  HA   . LYS   A  1  97  ? -3.415  27.120  15.111  1.000 34.693  0 152  LYS   A HA   1 c 1 
ATOM   1407  H  HB2  . LYS   A  1  97  ? -3.369  29.554  16.572  1.000 41.112  0 152  LYS   A HB2  1 c 1 
ATOM   1408  H  HB3  . LYS   A  1  97  ? -3.778  29.523  15.044  1.000 40.945  0 152  LYS   A HB3  1 c 1 
ATOM   1409  H  HG2  . LYS   A  1  97  ? -5.618  28.038  15.687  1.000 46.940  0 152  LYS   A HG2  1 c 1 
ATOM   1410  H  HG3  . LYS   A  1  97  ? -5.276  28.399  17.195  1.000 47.371  0 152  LYS   A HG3  1 c 1 
ATOM   1411  H  HD2  . LYS   A  1  97  ? -5.829  30.619  16.865  1.000 53.531  0 152  LYS   A HD2  1 c 1 
ATOM   1412  H  HD3  . LYS   A  1  97  ? -5.940  30.411  15.299  1.000 52.951  0 152  LYS   A HD3  1 c 1 
ATOM   1413  H  HE2  . LYS   A  1  97  ? -8.078  30.471  15.876  1.000 59.616  0 152  LYS   A HE2  1 c 1 
ATOM   1414  H  HE3  . LYS   A  1  97  ? -7.824  28.911  15.855  1.000 58.618  0 152  LYS   A HE3  1 c 1 
ATOM   1415  H  HZ1  . LYS   A  1  97  ? -7.835  30.458  18.130  1.000 66.704  0 152  LYS   A HZ1  1 c 1 
ATOM   1416  H  HZ2  . LYS   A  1  97  ? -7.498  29.018  18.139  1.000 65.905  0 152  LYS   A HZ2  1 c 1 
ATOM   1417  H  HZ3  . LYS   A  1  97  ? -8.864  29.456  17.782  1.000 66.395  0 152  LYS   A HZ3  1 c 1 
ATOM   1418  N  N    . VAL   A  1  98  ? -0.573  28.403  15.715  1.000 47.614  0 153  VAL   A N    1 ? 1 
ATOM   1419  C  CA   . VAL   A  1  98  ? 0.733   28.765  15.193  1.000 37.194  0 153  VAL   A CA   1 ? 1 
ATOM   1420  C  C    . VAL   A  1  98  ? 1.828   28.054  15.993  1.000 33.221  0 153  VAL   A C    1 ? 1 
ATOM   1421  O  O    . VAL   A  1  98  ? 1.690   27.873  17.197  1.000 43.011  0 153  VAL   A O    1 ? 1 
ATOM   1422  C  CB   . VAL   A  1  98  ? 0.821   30.312  15.264  1.000 36.250  0 153  VAL   A CB   1 ? 1 
ATOM   1423  C  CG1  . VAL   A  1  98  ? 0.944   30.811  16.685  1.000 27.864  0 153  VAL   A CG1  1 ? 1 
ATOM   1424  C  CG2  . VAL   A  1  98  ? 1.941   30.829  14.436  1.000 55.016  0 153  VAL   A CG2  1 ? 1 
ATOM   1425  H  H    . VAL   A  1  98  ? -0.673  28.354  16.622  1.000 43.040  0 153  VAL   A H    1 c 1 
ATOM   1426  H  HA   . VAL   A  1  98  ? 0.788   28.486  14.262  1.000 37.399  0 153  VAL   A HA   1 c 1 
ATOM   1427  H  HB   . VAL   A  1  98  ? -0.021  30.673  14.890  1.000 37.308  0 153  VAL   A HB   1 c 1 
ATOM   1428  H  HG11 . VAL   A  1  98  ? 1.821   30.582  17.037  1.000 30.127  0 153  VAL   A HG11 1 c 1 
ATOM   1429  H  HG12 . VAL   A  1  98  ? 0.256   30.401  17.237  1.000 30.200  0 153  VAL   A HG12 1 c 1 
ATOM   1430  H  HG13 . VAL   A  1  98  ? 0.834   31.778  16.698  1.000 30.717  0 153  VAL   A HG13 1 c 1 
ATOM   1431  H  HG21 . VAL   A  1  98  ? 1.984   31.798  14.515  1.000 48.568  0 153  VAL   A HG21 1 c 1 
ATOM   1432  H  HG22 . VAL   A  1  98  ? 1.786   30.587  13.508  1.000 47.685  0 153  VAL   A HG22 1 c 1 
ATOM   1433  H  HG23 . VAL   A  1  98  ? 2.779   30.442  14.742  1.000 47.573  0 153  VAL   A HG23 1 c 1 
ATOM   1434  N  N    . PRO   A  1  99  ? 2.959   27.623  15.392  1.000 28.526  0 154  PRO   A N    1 ? 1 
ATOM   1435  C  CA   . PRO   A  1  99  ? 4.065   27.096  16.197  1.000 26.875  0 154  PRO   A CA   1 ? 1 
ATOM   1436  C  C    . PRO   A  1  99  ? 4.607   28.194  17.113  1.000 34.134  0 154  PRO   A C    1 ? 1 
ATOM   1437  O  O    . PRO   A  1  99  ? 4.798   29.323  16.695  1.000 32.632  0 154  PRO   A O    1 ? 1 
ATOM   1438  C  CB   . PRO   A  1  99  ? 5.074   26.610  15.160  1.000 26.008  0 154  PRO   A CB   1 ? 1 
ATOM   1439  C  CG   . PRO   A  1  99  ? 4.709   27.363  13.874  1.000 24.928  0 154  PRO   A CG   1 ? 1 
ATOM   1440  C  CD   . PRO   A  1  99  ? 3.238   27.633  13.948  1.000 24.953  0 154  PRO   A CD   1 ? 1 
ATOM   1441  H  HA   . PRO   A  1  99  ? 3.746   26.328  16.733  1.000 27.936  0 154  PRO   A HA   1 c 1 
ATOM   1442  H  HB2  . PRO   A  1  99  ? 5.991   26.821  15.438  1.000 26.081  0 154  PRO   A HB2  1 c 1 
ATOM   1443  H  HB3  . PRO   A  1  99  ? 5.000   25.642  15.028  1.000 25.360  0 154  PRO   A HB3  1 c 1 
ATOM   1444  H  HG2  . PRO   A  1  99  ? 5.208   28.203  13.814  1.000 25.607  0 154  PRO   A HG2  1 c 1 
ATOM   1445  H  HG3  . PRO   A  1  99  ? 4.917   26.819  13.087  1.000 24.782  0 154  PRO   A HG3  1 c 1 
ATOM   1446  H  HD2  . PRO   A  1  99  ? 3.021   28.497  13.553  1.000 26.332  0 154  PRO   A HD2  1 c 1 
ATOM   1447  H  HD3  . PRO   A  1  99  ? 2.730   26.938  13.490  1.000 25.303  0 154  PRO   A HD3  1 c 1 
ATOM   1448  N  N    . GLU   A  1  100 ? 4.777   27.875  18.393  1.000 32.798  0 155  GLU   A N    1 ? 1 
ATOM   1449  C  CA   . GLU   A  1  100 ? 5.382   28.797  19.335  1.000 35.868  0 155  GLU   A CA   1 ? 1 
ATOM   1450  C  C    . GLU   A  1  100 ? 6.720   28.200  19.750  1.000 28.776  0 155  GLU   A C    1 ? 1 
ATOM   1451  O  O    . GLU   A  1  100 ? 6.763   27.340  20.623  1.000 27.688  0 155  GLU   A O    1 ? 1 
ATOM   1452  C  CB   . GLU   A  1  100 ? 4.448   29.021  20.521  1.000 37.976  0 155  GLU   A CB   1 ? 1 
ATOM   1453  C  CG   . GLU   A  1  100 ? 3.046   29.297  20.048  1.000 54.183  0 155  GLU   A CG   1 ? 1 
ATOM   1454  C  CD   . GLU   A  1  100 ? 2.101   29.713  21.132  1.000 64.022  0 155  GLU   A CD   1 ? 1 
ATOM   1455  O  OE1  . GLU   A  1  100 ? 1.937   28.923  22.090  1.000 67.716  0 155  GLU   A OE1  1 ? 1 
ATOM   1456  O  OE2  . GLU   A  1  100 ? 1.524   30.823  21.023  1.000 71.498  0 155  GLU   A OE2  1 ? 1 
ATOM   1457  H  H    . GLU   A  1  100 ? 4.509   27.054  18.692  1.000 33.229  0 155  GLU   A H    1 c 1 
ATOM   1458  H  HA   . GLU   A  1  100 ? 5.539   29.659  18.886  1.000 34.444  0 155  GLU   A HA   1 c 1 
ATOM   1459  H  HB2  . GLU   A  1  100 ? 4.450   28.224  21.090  1.000 40.193  0 155  GLU   A HB2  1 c 1 
ATOM   1460  H  HB3  . GLU   A  1  100 ? 4.773   29.781  21.048  1.000 41.132  0 155  GLU   A HB3  1 c 1 
ATOM   1461  H  HG2  . GLU   A  1  100 ? 3.072   30.004  19.369  1.000 51.631  0 155  GLU   A HG2  1 c 1 
ATOM   1462  H  HG3  . GLU   A  1  100 ? 2.688   28.490  19.622  1.000 50.689  0 155  GLU   A HG3  1 c 1 
ATOM   1463  N  N    . CYS   A  1  101 ? 7.781   28.652  19.078  1.000 27.933  0 156  CYS   A N    1 ? 1 
ATOM   1464  C  CA   . CYS   A  1  101 ? 9.111   28.100  19.195  1.000 26.122  0 156  CYS   A CA   1 ? 1 
ATOM   1465  C  C    . CYS   A  1  101 ? 10.053  29.171  19.737  1.000 27.805  0 156  CYS   A C    1 ? 1 
ATOM   1466  O  O    . CYS   A  1  101 ? 9.777   30.361  19.620  1.000 30.699  0 156  CYS   A O    1 ? 1 
ATOM   1467  C  CB   . CYS   A  1  101 ? 9.585   27.574  17.846  1.000 23.419  0 156  CYS   A CB   1 ? 1 
ATOM   1468  S  SG   . CYS   A  1  101 ? 8.622   26.173  17.175  1.000 30.902  0 156  CYS   A SG   1 ? 1 
ATOM   1469  H  H    . CYS   A  1  101 ? 7.661   29.353  18.505  1.000 28.047  0 156  CYS   A H    1 c 1 
ATOM   1470  H  HA   . CYS   A  1  101 ? 9.080   27.351  19.831  1.000 26.026  0 156  CYS   A HA   1 c 1 
ATOM   1471  H  HB2  . CYS   A  1  101 ? 9.556   28.304  17.195  1.000 25.432  0 156  CYS   A HB2  1 c 1 
ATOM   1472  H  HB3  . CYS   A  1  101 ? 10.519  27.290  17.930  1.000 25.254  0 156  CYS   A HB3  1 c 1 
ATOM   1473  N  N    . PRO   A  1  102 ? 11.215  28.804  20.326  1.000 29.052  0 157  PRO   A N    1 ? 1 
ATOM   1474  C  CA   . PRO   A  1  102 ? 12.213  29.807  20.716  1.000 27.614  0 157  PRO   A CA   1 ? 1 
ATOM   1475  C  C    . PRO   A  1  102 ? 12.772  30.539  19.496  1.000 28.467  0 157  PRO   A C    1 ? 1 
ATOM   1476  O  O    . PRO   A  1  102 ? 12.671  30.049  18.372  1.000 27.466  0 157  PRO   A O    1 ? 1 
ATOM   1477  C  CB   . PRO   A  1  102 ? 13.321  28.980  21.409  1.000 27.676  0 157  PRO   A CB   1 ? 1 
ATOM   1478  C  CG   . PRO   A  1  102 ? 12.746  27.642  21.712  1.000 26.217  0 157  PRO   A CG   1 ? 1 
ATOM   1479  C  CD   . PRO   A  1  102 ? 11.621  27.431  20.671  1.000 30.582  0 157  PRO   A CD   1 ? 1 
ATOM   1480  H  HA   . PRO   A  1  102 ? 11.815  30.447  21.358  1.000 28.617  0 157  PRO   A HA   1 c 1 
ATOM   1481  H  HB2  . PRO   A  1  102 ? 14.101  28.889  20.821  1.000 27.458  0 157  PRO   A HB2  1 c 1 
ATOM   1482  H  HB3  . PRO   A  1  102 ? 13.610  29.420  22.236  1.000 28.001  0 157  PRO   A HB3  1 c 1 
ATOM   1483  H  HG2  . PRO   A  1  102 ? 13.429  26.945  21.629  1.000 27.159  0 157  PRO   A HG2  1 c 1 
ATOM   1484  H  HG3  . PRO   A  1  102 ? 12.384  27.619  22.622  1.000 27.544  0 157  PRO   A HG3  1 c 1 
ATOM   1485  H  HD2  . PRO   A  1  102 ? 11.950  26.955  19.887  1.000 28.493  0 157  PRO   A HD2  1 c 1 
ATOM   1486  H  HD3  . PRO   A  1  102 ? 10.878  26.932  21.057  1.000 28.531  0 157  PRO   A HD3  1 c 1 
ATOM   1487  N  N    . ALA   A  1  103 ? 13.421  31.682  19.728  1.000 33.184  0 158  ALA   A N    1 ? 1 
ATOM   1488  C  CA   . ALA   A  1  103 ? 14.190  32.328  18.683  1.000 33.284  0 158  ALA   A CA   1 ? 1 
ATOM   1489  C  C    . ALA   A  1  103 ? 15.248  31.347  18.189  1.000 34.714  0 158  ALA   A C    1 ? 1 
ATOM   1490  O  O    . ALA   A  1  103 ? 15.760  30.499  18.934  1.000 50.241  0 158  ALA   A O    1 ? 1 
ATOM   1491  C  CB   . ALA   A  1  103 ? 14.863  33.589  19.208  1.000 37.218  0 158  ALA   A CB   1 ? 1 
ATOM   1492  H  H    . ALA   A  1  103 ? 13.383  32.067  20.557  1.000 32.501  0 158  ALA   A H    1 c 1 
ATOM   1493  H  HA   . ALA   A  1  103 ? 13.588  32.561  17.938  1.000 33.984  0 158  ALA   A HA   1 c 1 
ATOM   1494  H  HB1  . ALA   A  1  103 ? 15.371  34.008  18.493  1.000 36.535  0 158  ALA   A HB1  1 c 1 
ATOM   1495  H  HB2  . ALA   A  1  103 ? 14.187  34.209  19.530  1.000 36.589  0 158  ALA   A HB2  1 c 1 
ATOM   1496  H  HB3  . ALA   A  1  103 ? 15.463  33.358  19.937  1.000 36.500  0 158  ALA   A HB3  1 c 1 
ATOM   1497  N  N    . GLY   A  1  104 ? 15.570  31.474  16.913  1.000 36.898  0 159  GLY   A N    1 ? 1 
ATOM   1498  C  CA   . GLY   A  1  104 ? 16.596  30.638  16.328  1.000 36.104  0 159  GLY   A CA   1 ? 1 
ATOM   1499  C  C    . GLY   A  1  104 ? 15.980  29.473  15.573  1.000 32.270  0 159  GLY   A C    1 ? 1 
ATOM   1500  O  O    . GLY   A  1  104 ? 16.567  29.024  14.596  1.000 45.952  0 159  GLY   A O    1 ? 1 
ATOM   1501  H  H    . GLY   A  1  104 ? 15.148  32.093  16.390  1.000 36.299  0 159  GLY   A H    1 c 1 
ATOM   1502  H  HA2  . GLY   A  1  104 ? 17.140  31.183  15.708  1.000 36.015  0 159  GLY   A HA2  1 c 1 
ATOM   1503  H  HA3  . GLY   A  1  104 ? 17.187  30.295  17.041  1.000 35.905  0 159  GLY   A HA3  1 c 1 
ATOM   1504  N  N    . PHE   A  1  105 ? 14.804  29.014  16.035  1.000 29.178  0 160  PHE   A N    1 ? 1 
ATOM   1505  C  CA   . PHE   A  1  105 ? 14.089  27.920  15.392  1.000 34.693  0 160  PHE   A CA   1 ? 1 
ATOM   1506  C  C    . PHE   A  1  105 ? 13.559  28.353  14.026  1.000 30.342  0 160  PHE   A C    1 ? 1 
ATOM   1507  O  O    . PHE   A  1  105 ? 12.699  29.222  13.939  1.000 43.667  0 160  PHE   A O    1 ? 1 
ATOM   1508  C  CB   . PHE   A  1  105 ? 12.938  27.413  16.276  1.000 28.387  0 160  PHE   A CB   1 ? 1 
ATOM   1509  C  CG   . PHE   A  1  105 ? 13.312  26.394  17.315  1.000 24.294  0 160  PHE   A CG   1 ? 1 
ATOM   1510  C  CD1  . PHE   A  1  105 ? 14.212  26.700  18.318  1.000 31.030  0 160  PHE   A CD1  1 ? 1 
ATOM   1511  C  CD2  . PHE   A  1  105 ? 12.758  25.126  17.296  1.000 26.015  0 160  PHE   A CD2  1 ? 1 
ATOM   1512  C  CE1  . PHE   A  1  105 ? 14.570  25.742  19.285  1.000 26.341  0 160  PHE   A CE1  1 ? 1 
ATOM   1513  C  CE2  . PHE   A  1  105 ? 13.100  24.177  18.260  1.000 31.165  0 160  PHE   A CE2  1 ? 1 
ATOM   1514  C  CZ   . PHE   A  1  105 ? 14.005  24.490  19.253  1.000 25.050  0 160  PHE   A CZ   1 ? 1 
ATOM   1515  H  H    . PHE   A  1  105 ? 14.440  29.391  16.783  1.000 31.338  0 160  PHE   A H    1 c 1 
ATOM   1516  H  HA   . PHE   A  1  105 ? 14.726  27.175  15.256  1.000 31.191  0 160  PHE   A HA   1 c 1 
ATOM   1517  H  HB2  . PHE   A  1  105 ? 12.534  28.183  16.725  1.000 28.841  0 160  PHE   A HB2  1 c 1 
ATOM   1518  H  HB3  . PHE   A  1  105 ? 12.254  27.024  15.691  1.000 28.018  0 160  PHE   A HB3  1 c 1 
ATOM   1519  H  HD1  . PHE   A  1  105 ? 14.604  27.558  18.344  1.000 28.777  0 160  PHE   A HD1  1 c 1 
ATOM   1520  H  HD2  . PHE   A  1  105 ? 12.137  24.902  16.622  1.000 26.080  0 160  PHE   A HD2  1 c 1 
ATOM   1521  H  HE1  . PHE   A  1  105 ? 15.186  25.965  19.965  1.000 27.573  0 160  PHE   A HE1  1 c 1 
ATOM   1522  H  HE2  . PHE   A  1  105 ? 12.713  23.318  18.231  1.000 27.531  0 160  PHE   A HE2  1 c 1 
ATOM   1523  H  HZ   . PHE   A  1  105 ? 14.238  23.847  19.904  1.000 26.505  0 160  PHE   A HZ   1 c 1 
ATOM   1524  N  N    . VAL   A  1  106 ? 14.068  27.736  12.962  1.000 26.387  0 161  VAL   A N    1 ? 1 
ATOM   1525  C  CA   . VAL   A  1  106 ? 13.661  28.101  11.618  1.000 28.419  0 161  VAL   A CA   1 ? 1 
ATOM   1526  C  C    . VAL   A  1  106 ? 12.533  27.216  11.087  1.000 32.426  0 161  VAL   A C    1 ? 1 
ATOM   1527  O  O    . VAL   A  1  106 ? 11.970  27.500  10.049  1.000 33.729  0 161  VAL   A O    1 ? 1 
ATOM   1528  C  CB   . VAL   A  1  106 ? 14.888  28.098  10.687  1.000 33.201  0 161  VAL   A CB   1 ? 1 
ATOM   1529  C  CG1  . VAL   A  1  106 ? 16.018  28.935  11.290  1.000 37.374  0 161  VAL   A CG1  1 ? 1 
ATOM   1530  C  CG2  . VAL   A  1  106 ? 15.357  26.684  10.368  1.000 32.961  0 161  VAL   A CG2  1 ? 1 
ATOM   1531  H  H    . VAL   A  1  106 ? 14.685  27.071  13.075  1.000 27.657  0 161  VAL   A H    1 c 1 
ATOM   1532  H  HA   . VAL   A  1  106 ? 13.323  29.013  11.650  1.000 29.976  0 161  VAL   A HA   1 c 1 
ATOM   1533  H  HB   . VAL   A  1  106 ? 14.616  28.525  9.838   1.000 32.954  0 161  VAL   A HB   1 c 1 
ATOM   1534  H  HG11 . VAL   A  1  106 ? 16.415  28.456  12.038  1.000 36.264  0 161  VAL   A HG11 1 c 1 
ATOM   1535  H  HG12 . VAL   A  1  106 ? 15.663  29.786  11.601  1.000 36.698  0 161  VAL   A HG12 1 c 1 
ATOM   1536  H  HG13 . VAL   A  1  106 ? 16.699  29.096  10.613  1.000 36.563  0 161  VAL   A HG13 1 c 1 
ATOM   1537  H  HG21 . VAL   A  1  106 ? 16.193  26.725  9.873   1.000 33.105  0 161  VAL   A HG21 1 c 1 
ATOM   1538  H  HG22 . VAL   A  1  106 ? 14.685  26.231  9.830   1.000 32.429  0 161  VAL   A HG22 1 c 1 
ATOM   1539  H  HG23 . VAL   A  1  106 ? 15.495  26.192  11.195  1.000 32.787  0 161  VAL   A HG23 1 c 1 
ATOM   1540  N  N    . ARG   A  1  107 ? 12.205  26.133  11.791  1.000 29.271  0 162  ARG   A N    1 ? 1 
ATOM   1541  C  CA   . ARG   A  1  107 ? 11.037  25.342  11.456  1.000 26.082  0 162  ARG   A CA   1 ? 1 
ATOM   1542  C  C    . ARG   A  1  107 ? 10.631  24.577  12.720  1.000 28.972  0 162  ARG   A C    1 ? 1 
ATOM   1543  O  O    . ARG   A  1  107 ? 11.452  24.363  13.608  1.000 22.894  0 162  ARG   A O    1 ? 1 
ATOM   1544  C  CB   . ARG   A  1  107 ? 11.377  24.390  10.311  1.000 25.350  0 162  ARG   A CB   1 ? 1 
ATOM   1545  C  CG   . ARG   A  1  107 ? 12.395  23.300  10.707  1.000 30.695  0 162  ARG   A CG   1 ? 1 
ATOM   1546  C  CD   . ARG   A  1  107 ? 12.985  22.513  9.520   1.000 31.257  0 162  ARG   A CD   1 ? 1 
ATOM   1547  N  NE   . ARG   A  1  107 ? 13.791  23.361  8.649   1.000 29.788  0 162  ARG   A NE   1 ? 1 
ATOM   1548  C  CZ   . ARG   A  1  107 ? 15.099  23.547  8.779   1.000 34.612  0 162  ARG   A CZ   1 ? 1 
ATOM   1549  N  NH1  . ARG   A  1  107 ? 15.745  23.191  9.883   1.000 31.188  0 162  ARG   A NH1  1 ? 1 
ATOM   1550  N  NH2  . ARG   A  1  107 ? 15.767  24.154  7.803   1.000 41.162  0 162  ARG   A NH2  1 ? 1 
ATOM   1551  H  H    . ARG   A  1  107 ? 12.729  25.872  12.494  1.000 29.253  0 162  ARG   A H    1 c 1 
ATOM   1552  H  HA   . ARG   A  1  107 ? 10.305  25.943  11.184  1.000 27.189  0 162  ARG   A HA   1 c 1 
ATOM   1553  H  HB2  . ARG   A  1  107 ? 10.552  23.959  10.006  1.000 26.129  0 162  ARG   A HB2  1 c 1 
ATOM   1554  H  HB3  . ARG   A  1  107 ? 11.740  24.910  9.565   1.000 26.809  0 162  ARG   A HB3  1 c 1 
ATOM   1555  H  HG2  . ARG   A  1  107 ? 13.132  23.719  11.200  1.000 29.862  0 162  ARG   A HG2  1 c 1 
ATOM   1556  H  HG3  . ARG   A  1  107 ? 11.959  22.664  11.313  1.000 29.161  0 162  ARG   A HG3  1 c 1 
ATOM   1557  H  HD2  . ARG   A  1  107 ? 13.539  21.778  9.862   1.000 30.485  0 162  ARG   A HD2  1 c 1 
ATOM   1558  H  HD3  . ARG   A  1  107 ? 12.253  22.120  8.998   1.000 30.212  0 162  ARG   A HD3  1 c 1 
ATOM   1559  H  HE   . ARG   A  1  107 ? 13.386  23.777  7.998   1.000 31.335  0 162  ARG   A HE   1 c 1 
ATOM   1560  H  HH11 . ARG   A  1  107 ? 15.415  23.403  10.673  1.000 32.264  0 162  ARG   A HH11 1 c 1 
ATOM   1561  H  HH12 . ARG   A  1  107 ? 16.504  22.746  9.822   1.000 32.277  0 162  ARG   A HH12 1 c 1 
ATOM   1562  H  HH21 . ARG   A  1  107 ? 16.618  24.347  7.910   1.000 39.373  0 162  ARG   A HH21 1 c 1 
ATOM   1563  H  HH22 . ARG   A  1  107 ? 15.358  24.361  7.053   1.000 38.882  0 162  ARG   A HH22 1 c 1 
ATOM   1564  N  N    . PRO   A  1  108 ? 9.367   24.140  12.858  1.000 21.318  0 163  PRO   A N    1 ? 1 
ATOM   1565  C  CA   . PRO   A  1  108 ? 8.999   23.268  13.973  1.000 22.670  0 163  PRO   A CA   1 ? 1 
ATOM   1566  C  C    . PRO   A  1  108 ? 9.706   21.920  13.851  1.000 22.562  0 163  PRO   A C    1 ? 1 
ATOM   1567  O  O    . PRO   A  1  108 ? 9.710   21.308  12.780  1.000 25.351  0 163  PRO   A O    1 ? 1 
ATOM   1568  C  CB   . PRO   A  1  108 ? 7.453   23.169  13.873  1.000 24.593  0 163  PRO   A CB   1 ? 1 
ATOM   1569  C  CG   . PRO   A  1  108 ? 7.097   23.673  12.492  1.000 23.832  0 163  PRO   A CG   1 ? 1 
ATOM   1570  C  CD   . PRO   A  1  108 ? 8.239   24.484  11.973  1.000 25.318  0 163  PRO   A CD   1 ? 1 
ATOM   1571  H  HA   . PRO   A  1  108 ? 9.241   23.709  14.824  1.000 23.133  0 163  PRO   A HA   1 c 1 
ATOM   1572  H  HB2  . PRO   A  1  108 ? 7.155   22.241  13.990  1.000 23.532  0 163  PRO   A HB2  1 c 1 
ATOM   1573  H  HB3  . PRO   A  1  108 ? 7.026   23.723  14.558  1.000 24.247  0 163  PRO   A HB3  1 c 1 
ATOM   1574  H  HG2  . PRO   A  1  108 ? 6.923   22.918  11.894  1.000 23.813  0 163  PRO   A HG2  1 c 1 
ATOM   1575  H  HG3  . PRO   A  1  108 ? 6.287   24.222  12.533  1.000 24.393  0 163  PRO   A HG3  1 c 1 
ATOM   1576  H  HD2  . PRO   A  1  108 ? 8.439   24.250  11.048  1.000 23.825  0 163  PRO   A HD2  1 c 1 
ATOM   1577  H  HD3  . PRO   A  1  108 ? 8.039   25.437  12.021  1.000 24.408  0 163  PRO   A HD3  1 c 1 
ATOM   1578  N  N    . PRO   A  1  109 ? 10.374  21.413  14.916  1.000 24.250  0 164  PRO   A N    1 ? 1 
ATOM   1579  C  CA   . PRO   A  1  109 ? 10.939  20.063  14.862  1.000 21.319  0 164  PRO   A CA   1 ? 1 
ATOM   1580  C  C    . PRO   A  1  109 ? 9.853   19.027  14.610  1.000 17.499  0 164  PRO   A C    1 ? 1 
ATOM   1581  O  O    . PRO   A  1  109 ? 8.694   19.240  14.967  1.000 20.434  0 164  PRO   A O    1 ? 1 
ATOM   1582  C  CB   . PRO   A  1  109 ? 11.541  19.844  16.253  1.000 21.897  0 164  PRO   A CB   1 ? 1 
ATOM   1583  C  CG   . PRO   A  1  109 ? 11.704  21.288  16.817  1.000 24.952  0 164  PRO   A CG   1 ? 1 
ATOM   1584  C  CD   . PRO   A  1  109 ? 10.601  22.092  16.201  1.000 23.129  0 164  PRO   A CD   1 ? 1 
ATOM   1585  H  HA   . PRO   A  1  109 ? 11.643  20.017  14.170  1.000 21.162  0 164  PRO   A HA   1 c 1 
ATOM   1586  H  HB2  . PRO   A  1  109 ? 10.943  19.312  16.820  1.000 22.127  0 164  PRO   A HB2  1 c 1 
ATOM   1587  H  HB3  . PRO   A  1  109 ? 12.410  19.391  16.194  1.000 22.348  0 164  PRO   A HB3  1 c 1 
ATOM   1588  H  HG2  . PRO   A  1  109 ? 11.627  21.288  17.793  1.000 24.208  0 164  PRO   A HG2  1 c 1 
ATOM   1589  H  HG3  . PRO   A  1  109 ? 12.577  21.657  16.572  1.000 24.265  0 164  PRO   A HG3  1 c 1 
ATOM   1590  H  HD2  . PRO   A  1  109 ? 9.798   22.073  16.754  1.000 23.893  0 164  PRO   A HD2  1 c 1 
ATOM   1591  H  HD3  . PRO   A  1  109 ? 10.875  23.018  16.067  1.000 24.275  0 164  PRO   A HD3  1 c 1 
ATOM   1592  N  N    . LEU   A  1  110 ? 10.280  17.859  14.148  1.000 17.581  0 165  LEU   A N    1 ? 1 
ATOM   1593  C  CA   . LEU   A  1  110 ? 9.407   16.700  14.096  1.000 20.080  0 165  LEU   A CA   1 ? 1 
ATOM   1594  C  C    . LEU   A  1  110 ? 10.010  15.582  14.930  1.000 17.463  0 165  LEU   A C    1 ? 1 
ATOM   1595  O  O    . LEU   A  1  110 ? 11.167  15.242  14.717  1.000 19.858  0 165  LEU   A O    1 ? 1 
ATOM   1596  C  CB   . LEU   A  1  110 ? 9.277   16.213  12.651  1.000 17.818  0 165  LEU   A CB   1 ? 1 
ATOM   1597  C  CG   . LEU   A  1  110 ? 8.610   14.874  12.454  1.000 18.541  0 165  LEU   A CG   1 ? 1 
ATOM   1598  C  CD1  . LEU   A  1  110 ? 7.208   14.900  12.946  1.000 19.710  0 165  LEU   A CD1  1 ? 1 
ATOM   1599  C  CD2  . LEU   A  1  110 ? 8.654   14.482  10.983  1.000 20.304  0 165  LEU   A CD2  1 ? 1 
ATOM   1600  H  H    . LEU   A  1  110 ? 11.141  17.776  13.854  1.000 18.191  0 165  LEU   A H    1 c 1 
ATOM   1601  H  HA   . LEU   A  1  110 ? 8.525   16.940  14.453  1.000 18.636  0 165  LEU   A HA   1 c 1 
ATOM   1602  H  HB2  . LEU   A  1  110 ? 8.773   16.884  12.148  1.000 18.522  0 165  LEU   A HB2  1 c 1 
ATOM   1603  H  HB3  . LEU   A  1  110 ? 10.173  16.170  12.262  1.000 18.581  0 165  LEU   A HB3  1 c 1 
ATOM   1604  H  HG   . LEU   A  1  110 ? 9.110   14.195  12.969  1.000 18.875  0 165  LEU   A HG   1 c 1 
ATOM   1605  H  HD11 . LEU   A  1  110 ? 6.809   14.018  12.834  1.000 19.031  0 165  LEU   A HD11 1 c 1 
ATOM   1606  H  HD12 . LEU   A  1  110 ? 6.696   15.553  12.437  1.000 19.335  0 165  LEU   A HD12 1 c 1 
ATOM   1607  H  HD13 . LEU   A  1  110 ? 7.196   15.141  13.887  1.000 19.541  0 165  LEU   A HD13 1 c 1 
ATOM   1608  H  HD21 . LEU   A  1  110 ? 9.580   14.430  10.688  1.000 19.764  0 165  LEU   A HD21 1 c 1 
ATOM   1609  H  HD22 . LEU   A  1  110 ? 8.183   15.149  10.454  1.000 19.683  0 165  LEU   A HD22 1 c 1 
ATOM   1610  H  HD23 . LEU   A  1  110 ? 8.228   13.615  10.865  1.000 19.369  0 165  LEU   A HD23 1 c 1 
ATOM   1611  N  N    . ILE   A  1  111 ? 9.191   14.990  15.817  1.000 18.609  0 166  ILE   A N    1 ? 1 
ATOM   1612  C  CA   . ILE   A  1  111 ? 9.554   13.786  16.555  1.000 17.877  0 166  ILE   A CA   1 ? 1 
ATOM   1613  C  C    . ILE   A  1  111 ? 8.605   12.659  16.153  1.000 17.512  0 166  ILE   A C    1 ? 1 
ATOM   1614  O  O    . ILE   A  1  111 ? 7.401   12.741  16.376  1.000 18.156  0 166  ILE   A O    1 ? 1 
ATOM   1615  C  CB   . ILE   A  1  111 ? 9.503   14.019  18.052  1.000 19.472  0 166  ILE   A CB   1 ? 1 
ATOM   1616  C  CG1  . ILE   A  1  111 ? 10.365  15.237  18.447  1.000 23.303  0 166  ILE   A CG1  1 ? 1 
ATOM   1617  C  CG2  . ILE   A  1  111 ? 9.901   12.767  18.762  1.000 22.318  0 166  ILE   A CG2  1 ? 1 
ATOM   1618  C  CD1  . ILE   A  1  111 ? 10.282  15.611  19.941  1.000 28.395  0 166  ILE   A CD1  1 ? 1 
ATOM   1619  H  H    . ILE   A  1  111 ? 8.367   15.357  15.967  1.000 18.159  0 166  ILE   A H    1 c 1 
ATOM   1620  H  HA   . ILE   A  1  111 ? 10.462  13.533  16.315  1.000 18.326  0 166  ILE   A HA   1 c 1 
ATOM   1621  H  HB   . ILE   A  1  111 ? 8.566   14.222  18.294  1.000 20.236  0 166  ILE   A HB   1 c 1 
ATOM   1622  H  HG12 . ILE   A  1  111 ? 11.301  15.045  18.223  1.000 23.441  0 166  ILE   A HG12 1 c 1 
ATOM   1623  H  HG13 . ILE   A  1  111 ? 10.083  16.011  17.915  1.000 23.378  0 166  ILE   A HG13 1 c 1 
ATOM   1624  H  HG21 . ILE   A  1  111 ? 10.775  12.477  18.446  1.000 21.420  0 166  ILE   A HG21 1 c 1 
ATOM   1625  H  HG22 . ILE   A  1  111 ? 9.247   12.068  18.589  1.000 21.098  0 166  ILE   A HG22 1 c 1 
ATOM   1626  H  HG23 . ILE   A  1  111 ? 9.945   12.933  19.719  1.000 21.747  0 166  ILE   A HG23 1 c 1 
ATOM   1627  H  HD11 . ILE   A  1  111 ? 10.807  14.981  20.465  1.000 26.971  0 166  ILE   A HD11 1 c 1 
ATOM   1628  H  HD12 . ILE   A  1  111 ? 9.354   15.579  20.234  1.000 26.828  0 166  ILE   A HD12 1 c 1 
ATOM   1629  H  HD13 . ILE   A  1  111 ? 10.630  16.509  20.072  1.000 27.229  0 166  ILE   A HD13 1 c 1 
ATOM   1630  N  N    . ILE   A  1  112 ? 9.173   11.606  15.575  1.000 20.730  0 167  ILE   A N    1 ? 1 
ATOM   1631  C  CA   . ILE   A  1  112 ? 8.456   10.380  15.261  1.000 18.559  0 167  ILE   A CA   1 ? 1 
ATOM   1632  C  C    . ILE   A  1  112 ? 8.623   9.414   16.416  1.000 21.439  0 167  ILE   A C    1 ? 1 
ATOM   1633  O  O    . ILE   A  1  112 ? 9.734   8.988   16.705  1.000 19.473  0 167  ILE   A O    1 ? 1 
ATOM   1634  C  CB   . ILE   A  1  112 ? 8.988   9.736   13.942  1.000 22.175  0 167  ILE   A CB   1 ? 1 
ATOM   1635  C  CG1  . ILE   A  1  112 ? 9.128   10.760  12.813  1.000 24.526  0 167  ILE   A CG1  1 ? 1 
ATOM   1636  C  CG2  . ILE   A  1  112 ? 8.103   8.596   13.499  1.000 22.525  0 167  ILE   A CG2  1 ? 1 
ATOM   1637  C  CD1  . ILE   A  1  112 ? 10.138  10.381  11.798  1.000 23.749  0 167  ILE   A CD1  1 ? 1 
ATOM   1638  H  H    . ILE   A  1  112 ? 10.062  11.649  15.369  1.000 19.557  0 167  ILE   A H    1 c 1 
ATOM   1639  H  HA   . ILE   A  1  112 ? 7.511   10.585  15.149  1.000 19.923  0 167  ILE   A HA   1 c 1 
ATOM   1640  H  HB   . ILE   A  1  112 ? 9.887   9.368   14.127  1.000 22.048  0 167  ILE   A HB   1 c 1 
ATOM   1641  H  HG12 . ILE   A  1  112 ? 8.259   10.865  12.371  1.000 23.568  0 167  ILE   A HG12 1 c 1 
ATOM   1642  H  HG13 . ILE   A  1  112 ? 9.378   11.627  13.196  1.000 23.948  0 167  ILE   A HG13 1 c 1 
ATOM   1643  H  HG21 . ILE   A  1  112 ? 7.175   8.890   13.487  1.000 22.249  0 167  ILE   A HG21 1 c 1 
ATOM   1644  H  HG22 . ILE   A  1  112 ? 8.197   7.850   14.117  1.000 22.384  0 167  ILE   A HG22 1 c 1 
ATOM   1645  H  HG23 . ILE   A  1  112 ? 8.360   8.310   12.608  1.000 22.316  0 167  ILE   A HG23 1 c 1 
ATOM   1646  H  HD11 . ILE   A  1  112 ? 9.868   9.555   11.362  1.000 23.825  0 167  ILE   A HD11 1 c 1 
ATOM   1647  H  HD12 . ILE   A  1  112 ? 11.001  10.252  12.229  1.000 24.202  0 167  ILE   A HD12 1 c 1 
ATOM   1648  H  HD13 . ILE   A  1  112 ? 10.212  11.087  11.133  1.000 24.025  0 167  ILE   A HD13 1 c 1 
ATOM   1649  N  N    . PHE   A  1  113 ? 7.505   9.116   17.082  1.000 26.040  0 168  PHE   A N    1 ? 1 
ATOM   1650  C  CA   . PHE   A  1  113 ? 7.448   8.097   18.109  1.000 22.292  0 168  PHE   A CA   1 ? 1 
ATOM   1651  C  C    . PHE   A  1  113 ? 6.928   6.798   17.475  1.000 20.099  0 168  PHE   A C    1 ? 1 
ATOM   1652  O  O    . PHE   A  1  113 ? 5.731   6.653   17.255  1.000 18.751  0 168  PHE   A O    1 ? 1 
ATOM   1653  C  CB   . PHE   A  1  113 ? 6.547   8.634   19.229  1.000 21.702  0 168  PHE   A CB   1 ? 1 
ATOM   1654  C  CG   . PHE   A  1  113 ? 6.650   7.938   20.552  1.000 18.299  0 168  PHE   A CG   1 ? 1 
ATOM   1655  C  CD1  . PHE   A  1  113 ? 6.180   6.646   20.713  1.000 17.981  0 168  PHE   A CD1  1 ? 1 
ATOM   1656  C  CD2  . PHE   A  1  113 ? 7.270   8.560   21.636  1.000 21.466  0 168  PHE   A CD2  1 ? 1 
ATOM   1657  C  CE1  . PHE   A  1  113 ? 6.274   6.002   21.952  1.000 21.941  0 168  PHE   A CE1  1 ? 1 
ATOM   1658  C  CE2  . PHE   A  1  113 ? 7.377   7.920   22.854  1.000 20.456  0 168  PHE   A CE2  1 ? 1 
ATOM   1659  C  CZ   . PHE   A  1  113 ? 6.886   6.635   23.012  1.000 21.955  0 168  PHE   A CZ   1 ? 1 
ATOM   1660  H  H    . PHE   A  1  113 ? 6.739   9.575   16.885  1.000 23.737  0 168  PHE   A H    1 c 1 
ATOM   1661  H  HA   . PHE   A  1  113 ? 8.357   7.942   18.470  1.000 22.615  0 168  PHE   A HA   1 c 1 
ATOM   1662  H  HB2  . PHE   A  1  113 ? 6.758   9.582   19.359  1.000 21.099  0 168  PHE   A HB2  1 c 1 
ATOM   1663  H  HB3  . PHE   A  1  113 ? 5.617   8.582   18.923  1.000 20.715  0 168  PHE   A HB3  1 c 1 
ATOM   1664  H  HD1  . PHE   A  1  113 ? 5.756   6.211   19.991  1.000 18.537  0 168  PHE   A HD1  1 c 1 
ATOM   1665  H  HD2  . PHE   A  1  113 ? 7.607   9.437   21.538  1.000 20.611  0 168  PHE   A HD2  1 c 1 
ATOM   1666  H  HE1  . PHE   A  1  113 ? 5.942   5.123   22.053  1.000 20.850  0 168  PHE   A HE1  1 c 1 
ATOM   1667  H  HE2  . PHE   A  1  113 ? 7.790   8.359   23.580  1.000 21.473  0 168  PHE   A HE2  1 c 1 
ATOM   1668  H  HZ   . PHE   A  1  113 ? 6.959   6.200   23.846  1.000 21.919  0 168  PHE   A HZ   1 c 1 
ATOM   1669  N  N    . SER   A  1  114 ? 7.827   5.855   17.208  1.000 19.846  0 169  SER   A N    1 ? 1 
ATOM   1670  C  CA   . SER   A  1  114 ? 7.472   4.624   16.534  1.000 23.649  0 169  SER   A CA   1 ? 1 
ATOM   1671  C  C    . SER   A  1  114 ? 7.443   3.463   17.518  1.000 25.168  0 169  SER   A C    1 ? 1 
ATOM   1672  O  O    . SER   A  1  114 ? 8.368   3.249   18.318  1.000 21.080  0 169  SER   A O    1 ? 1 
ATOM   1673  C  CB   . SER   A  1  114 ? 8.422   4.326   15.373  1.000 22.848  0 169  SER   A CB   1 ? 1 
ATOM   1674  O  OG   . SER   A  1  114 ? 9.737   4.105   15.834  1.000 23.364  0 169  SER   A OG   1 ? 1 
ATOM   1675  H  H    . SER   A  1  114 ? 8.698   5.983   17.455  1.000 20.961  0 169  SER   A H    1 c 1 
ATOM   1676  H  HA   . SER   A  1  114 ? 6.562   4.736   16.162  1.000 22.481  0 169  SER   A HA   1 c 1 
ATOM   1677  H  HB2  . SER   A  1  114 ? 8.107   3.528   14.890  1.000 22.851  0 169  SER   A HB2  1 c 1 
ATOM   1678  H  HB3  . SER   A  1  114 ? 8.418   5.084   14.746  1.000 22.929  0 169  SER   A HB3  1 c 1 
ATOM   1679  H  HG   . SER   A  1  114 ? 9.832   3.268   15.999  0.000 16.190  0 169  SER   A HG   1 c 1 
ATOM   1680  N  N    . VAL   A  1  115 ? 6.367   2.690   17.412  1.000 16.957  0 170  VAL   A N    1 ? 1 
ATOM   1681  C  CA   . VAL   A  1  115 ? 6.093   1.624   18.356  1.000 19.040  0 170  VAL   A CA   1 ? 1 
ATOM   1682  C  C    . VAL   A  1  115 ? 5.932   0.337   17.547  1.000 22.022  0 170  VAL   A C    1 ? 1 
ATOM   1683  O  O    . VAL   A  1  115 ? 5.160   0.288   16.598  1.000 22.939  0 170  VAL   A O    1 ? 1 
ATOM   1684  C  CB   . VAL   A  1  115 ? 4.855   1.926   19.255  1.000 22.382  0 170  VAL   A CB   1 ? 1 
ATOM   1685  C  CG1  . VAL   A  1  115 ? 5.240   2.800   20.427  1.000 22.825  0 170  VAL   A CG1  1 ? 1 
ATOM   1686  C  CG2  . VAL   A  1  115 ? 3.695   2.547   18.482  1.000 19.480  0 170  VAL   A CG2  1 ? 1 
ATOM   1687  H  H    . VAL   A  1  115 ? 5.786   2.822   16.719  1.000 18.785  0 170  VAL   A H    1 c 1 
ATOM   1688  H  HA   . VAL   A  1  115 ? 6.869   1.522   18.934  1.000 20.018  0 170  VAL   A HA   1 c 1 
ATOM   1689  H  HB   . VAL   A  1  115 ? 4.541   1.062   19.619  1.000 21.369  0 170  VAL   A HB   1 c 1 
ATOM   1690  H  HG11 . VAL   A  1  115 ? 5.605   3.640   20.100  1.000 22.742  0 170  VAL   A HG11 1 c 1 
ATOM   1691  H  HG12 . VAL   A  1  115 ? 5.909   2.345   20.967  1.000 23.031  0 170  VAL   A HG12 1 c 1 
ATOM   1692  H  HG13 . VAL   A  1  115 ? 4.453   2.980   20.971  1.000 22.936  0 170  VAL   A HG13 1 c 1 
ATOM   1693  H  HG21 . VAL   A  1  115 ? 2.912   2.599   19.057  1.000 20.349  0 170  VAL   A HG21 1 c 1 
ATOM   1694  H  HG22 . VAL   A  1  115 ? 3.489   1.997   17.706  1.000 19.975  0 170  VAL   A HG22 1 c 1 
ATOM   1695  H  HG23 . VAL   A  1  115 ? 3.941   3.441   18.188  1.000 20.120  0 170  VAL   A HG23 1 c 1 
ATOM   1696  N  N    . ASP   A  1  116 ? 6.682   -0.699  17.919  1.000 18.069  0 171  ASP   A N    1 ? 1 
ATOM   1697  C  CA   . ASP   A  1  116 ? 6.703   -1.928  17.162  1.000 21.731  0 171  ASP   A CA   1 ? 1 
ATOM   1698  C  C    . ASP   A  1  116 ? 5.478   -2.768  17.505  1.000 21.276  0 171  ASP   A C    1 ? 1 
ATOM   1699  O  O    . ASP   A  1  116 ? 5.186   -3.005  18.671  1.000 20.581  0 171  ASP   A O    1 ? 1 
ATOM   1700  C  CB   . ASP   A  1  116 ? 7.976   -2.681  17.420  1.000 18.892  0 171  ASP   A CB   1 ? 1 
ATOM   1701  C  CG   . ASP   A  1  116 ? 8.298   -3.583  16.274  1.000 21.966  0 171  ASP   A CG   1 ? 1 
ATOM   1702  O  OD1  . ASP   A  1  116 ? 7.406   -4.419  15.902  1.000 23.189  0 171  ASP   A OD1  1 ? 1 
ATOM   1703  O  OD2  . ASP   A  1  116 ? 9.410   -3.394  15.641  1.000 17.799  0 171  ASP   A OD2  1 ? 1 
ATOM   1704  H  H    . ASP   A  1  116 ? 7.195   -0.637  18.674  1.000 20.049  0 171  ASP   A H    1 c 1 
ATOM   1705  H  HA   . ASP   A  1  116 ? 6.672   -1.699  16.205  1.000 19.938  0 171  ASP   A HA   1 c 1 
ATOM   1706  H  HB2  . ASP   A  1  116 ? 8.714   -2.050  17.538  1.000 20.306  0 171  ASP   A HB2  1 c 1 
ATOM   1707  H  HB3  . ASP   A  1  116 ? 7.888   -3.216  18.235  1.000 20.543  0 171  ASP   A HB3  1 c 1 
ATOM   1708  N  N    . GLY   A  1  117 ? 4.778   -3.238  16.465  1.000 19.643  0 172  GLY   A N    1 ? 1 
ATOM   1709  C  CA   . GLY   A  1  117 ? 3.651   -4.148  16.648  1.000 20.192  0 172  GLY   A CA   1 ? 1 
ATOM   1710  C  C    . GLY   A  1  117 ? 2.421   -3.586  17.360  1.000 20.359  0 172  GLY   A C    1 ? 1 
ATOM   1711  O  O    . GLY   A  1  117 ? 1.653   -4.358  17.964  1.000 21.645  0 172  GLY   A O    1 ? 1 
ATOM   1712  H  H    . GLY   A  1  117 ? 5.006   -2.986  15.617  1.000 19.835  0 172  GLY   A H    1 c 1 
ATOM   1713  H  HA2  . GLY   A  1  117 ? 3.376   -4.480  15.758  1.000 19.880  0 172  GLY   A HA2  1 c 1 
ATOM   1714  H  HA3  . GLY   A  1  117 ? 3.973   -4.934  17.156  1.000 20.371  0 172  GLY   A HA3  1 c 1 
ATOM   1715  N  N    . PHE   A  1  118 ? 2.260   -2.245  17.281  1.000 16.673  0 173  PHE   A N    1 ? 1 
ATOM   1716  C  CA   . PHE   A  1  118 ? 1.130   -1.546  17.871  1.000 17.274  0 173  PHE   A CA   1 ? 1 
ATOM   1717  C  C    . PHE   A  1  118 ? -0.090  -1.702  16.954  1.000 27.228  0 173  PHE   A C    1 ? 1 
ATOM   1718  O  O    . PHE   A  1  118 ? -0.313  -0.930  16.026  1.000 23.827  0 173  PHE   A O    1 ? 1 
ATOM   1719  C  CB   . PHE   A  1  118 ? 1.467   -0.060  18.133  1.000 23.078  0 173  PHE   A CB   1 ? 1 
ATOM   1720  C  CG   . PHE   A  1  118 ? 0.586   0.596   19.167  1.000 18.677  0 173  PHE   A CG   1 ? 1 
ATOM   1721  C  CD1  . PHE   A  1  118 ? -0.723  0.915   18.878  1.000 18.238  0 173  PHE   A CD1  1 ? 1 
ATOM   1722  C  CD2  . PHE   A  1  118 ? 1.068   0.854   20.446  1.000 22.927  0 173  PHE   A CD2  1 ? 1 
ATOM   1723  C  CE1  . PHE   A  1  118 ? -1.525  1.497   19.833  1.000 24.265  0 173  PHE   A CE1  1 ? 1 
ATOM   1724  C  CE2  . PHE   A  1  118 ? 0.262   1.431   21.403  1.000 20.955  0 173  PHE   A CE2  1 ? 1 
ATOM   1725  C  CZ   . PHE   A  1  118 ? -1.036  1.747   21.092  1.000 32.334  0 173  PHE   A CZ   1 ? 1 
ATOM   1726  H  H    . PHE   A  1  118 ? 2.884   -1.753  16.830  1.000 17.470  0 173  PHE   A H    1 c 1 
ATOM   1727  H  HA   . PHE   A  1  118 ? 0.919   -1.973  18.740  1.000 19.957  0 173  PHE   A HA   1 c 1 
ATOM   1728  H  HB2  . PHE   A  1  118 ? 2.400   -0.003  18.429  1.000 20.541  0 173  PHE   A HB2  1 c 1 
ATOM   1729  H  HB3  . PHE   A  1  118 ? 1.391   0.433   17.290  1.000 20.216  0 173  PHE   A HB3  1 c 1 
ATOM   1730  H  HD1  . PHE   A  1  118 ? -1.068  0.743   18.017  1.000 19.409  0 173  PHE   A HD1  1 c 1 
ATOM   1731  H  HD2  . PHE   A  1  118 ? 1.959   0.631   20.660  1.000 21.555  0 173  PHE   A HD2  1 c 1 
ATOM   1732  H  HE1  . PHE   A  1  118 ? -2.419  1.718   19.624  1.000 24.067  0 173  PHE   A HE1  1 c 1 
ATOM   1733  H  HE2  . PHE   A  1  118 ? 0.602   1.608   22.265  1.000 23.930  0 173  PHE   A HE2  1 c 1 
ATOM   1734  H  HZ   . PHE   A  1  118 ? -1.590  2.151   21.741  1.000 27.311  0 173  PHE   A HZ   1 c 1 
ATOM   1735  N  N    . ARG   A  1  119 ? -0.865  -2.749  17.221  1.000 27.383  0 174  ARG   A N    1 ? 1 
ATOM   1736  C  CA   . ARG   A  1  119 ? -2.104  -3.021  16.518  1.000 23.928  0 174  ARG   A CA   1 ? 1 
ATOM   1737  C  C    . ARG   A  1  119 ? -3.099  -1.874  16.678  1.000 19.876  0 174  ARG   A C    1 ? 1 
ATOM   1738  O  O    . ARG   A  1  119 ? -3.207  -1.275  17.745  1.000 23.874  0 174  ARG   A O    1 ? 1 
ATOM   1739  C  CB   . ARG   A  1  119 ? -2.665  -4.331  17.109  1.000 24.035  0 174  ARG   A CB   1 ? 1 
ATOM   1740  C  CG   . ARG   A  1  119 ? -3.906  -4.795  16.471  1.000 33.807  0 174  ARG   A CG   1 ? 1 
ATOM   1741  C  CD   . ARG   A  1  119 ? -4.417  -6.052  17.097  1.000 27.314  0 174  ARG   A CD   1 ? 1 
ATOM   1742  N  NE   . ARG   A  1  119 ? -5.716  -6.358  16.506  1.000 27.668  0 174  ARG   A NE   1 ? 1 
ATOM   1743  C  CZ   . ARG   A  1  119 ? -6.152  -7.564  16.222  1.000 23.776  0 174  ARG   A CZ   1 ? 1 
ATOM   1744  N  NH1  . ARG   A  1  119 ? -5.359  -8.609  16.263  1.000 26.213  0 174  ARG   A NH1  1 ? 1 
ATOM   1745  N  NH2  . ARG   A  1  119 ? -7.425  -7.726  15.894  1.000 38.435  0 174  ARG   A NH2  1 ? 1 
ATOM   1746  H  H    . ARG   A  1  119 ? -0.602  -3.331  17.875  1.000 26.598  0 174  ARG   A H    1 c 1 
ATOM   1747  H  HA   . ARG   A  1  119 ? -1.906  -3.152  15.563  1.000 23.318  0 174  ARG   A HA   1 c 1 
ATOM   1748  H  HB2  . ARG   A  1  119 ? -1.985  -5.030  17.020  1.000 26.079  0 174  ARG   A HB2  1 c 1 
ATOM   1749  H  HB3  . ARG   A  1  119 ? -2.834  -4.194  18.065  1.000 26.359  0 174  ARG   A HB3  1 c 1 
ATOM   1750  H  HG2  . ARG   A  1  119 ? -4.591  -4.100  16.548  1.000 29.420  0 174  ARG   A HG2  1 c 1 
ATOM   1751  H  HG3  . ARG   A  1  119 ? -3.741  -4.956  15.517  1.000 29.219  0 174  ARG   A HG3  1 c 1 
ATOM   1752  H  HD2  . ARG   A  1  119 ? -3.788  -6.785  16.934  1.000 28.597  0 174  ARG   A HD2  1 c 1 
ATOM   1753  H  HD3  . ARG   A  1  119 ? -4.511  -5.929  18.066  1.000 29.064  0 174  ARG   A HD3  1 c 1 
ATOM   1754  H  HE   . ARG   A  1  119 ? -6.246  -5.688  16.328  1.000 26.663  0 174  ARG   A HE   1 c 1 
ATOM   1755  H  HH11 . ARG   A  1  119 ? -4.575  -8.582  15.864  1.000 25.252  0 174  ARG   A HH11 1 c 1 
ATOM   1756  H  HH12 . ARG   A  1  119 ? -5.614  -9.336  16.690  1.000 25.776  0 174  ARG   A HH12 1 c 1 
ATOM   1757  H  HH21 . ARG   A  1  119 ? -7.717  -8.520  15.654  1.000 32.945  0 174  ARG   A HH21 1 c 1 
ATOM   1758  H  HH22 . ARG   A  1  119 ? -7.976  -7.042  15.916  1.000 32.829  0 174  ARG   A HH22 1 c 1 
ATOM   1759  N  N    . ALA   A  1  120 ? -3.845  -1.579  15.608  1.000 28.777  0 175  ALA   A N    1 ? 1 
ATOM   1760  C  CA   . ALA   A  1  120 ? -4.745  -0.431  15.562  1.000 25.841  0 175  ALA   A CA   1 ? 1 
ATOM   1761  C  C    . ALA   A  1  120 ? -5.799  -0.494  16.660  1.000 20.934  0 175  ALA   A C    1 ? 1 
ATOM   1762  O  O    . ALA   A  1  120 ? -6.079  0.504   17.305  1.000 21.138  0 175  ALA   A O    1 ? 1 
ATOM   1763  C  CB   . ALA   A  1  120 ? -5.424  -0.298  14.177  1.000 22.584  0 175  ALA   A CB   1 ? 1 
ATOM   1764  H  H    . ALA   A  1  120 ? -3.793  -2.119  14.872  1.000 25.282  0 175  ALA   A H    1 c 1 
ATOM   1765  H  HA   . ALA   A  1  120 ? -4.209  0.373   15.713  1.000 24.540  0 175  ALA   A HA   1 c 1 
ATOM   1766  H  HB1  . ALA   A  1  120 ? -5.932  0.530   14.141  1.000 23.443  0 175  ALA   A HB1  1 c 1 
ATOM   1767  H  HB2  . ALA   A  1  120 ? -4.746  -0.291  13.481  1.000 23.114  0 175  ALA   A HB2  1 c 1 
ATOM   1768  H  HB3  . ALA   A  1  120 ? -6.023  -1.050  14.035  1.000 23.477  0 175  ALA   A HB3  1 c 1 
ATOM   1769  N  N    . SER   A  1  121 ? -6.309  -1.692  16.933  1.000 19.582  0 176  SER   A N    1 ? 1 
ATOM   1770  C  CA   . SER   A  1  121 ? -7.339  -1.847  17.944  1.000 26.966  0 176  SER   A CA   1 ? 1 
ATOM   1771  C  C    . SER   A  1  121 ? -6.886  -1.601  19.377  1.000 29.101  0 176  SER   A C    1 ? 1 
ATOM   1772  O  O    . SER   A  1  121 ? -7.733  -1.391  20.247  1.000 26.217  0 176  SER   A O    1 ? 1 
ATOM   1773  C  CB   . SER   A  1  121 ? -7.990  -3.219  17.829  1.000 27.336  0 176  SER   A CB   1 ? 1 
ATOM   1774  O  OG   . SER   A  1  121 ? -7.011  -4.197  17.573  1.000 31.542  0 176  SER   A OG   1 ? 1 
ATOM   1775  H  H    . SER   A  1  121 ? -6.023  -2.428  16.473  1.000 21.324  0 176  SER   A H    1 c 1 
ATOM   1776  H  HA   . SER   A  1  121 ? -8.042  -1.171  17.743  1.000 25.676  0 176  SER   A HA   1 c 1 
ATOM   1777  H  HB2  . SER   A  1  121 ? -8.463  -3.434  18.665  1.000 28.683  0 176  SER   A HB2  1 c 1 
ATOM   1778  H  HB3  . SER   A  1  121 ? -8.645  -3.207  17.098  1.000 28.321  0 176  SER   A HB3  1 c 1 
ATOM   1779  H  HG   . SER   A  1  121 ? -6.733  -4.499  18.307  0.000 24.500  0 176  SER   A HG   1 c 1 
ATOM   1780  N  N    . TYR   A  1  122 ? -5.571  -1.577  19.622  1.000 26.142  0 177  TYR   A N    1 ? 1 
ATOM   1781  C  CA   . TYR   A  1  122 ? -5.086  -1.193  20.942  1.000 29.380  0 177  TYR   A CA   1 ? 1 
ATOM   1782  C  C    . TYR   A  1  122 ? -5.553  0.212   21.337  1.000 27.531  0 177  TYR   A C    1 ? 1 
ATOM   1783  O  O    . TYR   A  1  122 ? -5.681  0.486   22.523  1.000 27.951  0 177  TYR   A O    1 ? 1 
ATOM   1784  C  CB   . TYR   A  1  122 ? -3.542  -1.286  21.038  1.000 25.188  0 177  TYR   A CB   1 ? 1 
ATOM   1785  C  CG   . TYR   A  1  122 ? -2.900  -2.670  20.955  1.000 23.805  0 177  TYR   A CG   1 ? 1 
ATOM   1786  C  CD1  . TYR   A  1  122 ? -3.619  -3.820  21.254  1.000 24.436  0 177  TYR   A CD1  1 ? 1 
ATOM   1787  C  CD2  . TYR   A  1  122 ? -1.565  -2.821  20.589  1.000 27.298  0 177  TYR   A CD2  1 ? 1 
ATOM   1788  C  CE1  . TYR   A  1  122 ? -3.023  -5.083  21.198  1.000 26.730  0 177  TYR   A CE1  1 ? 1 
ATOM   1789  C  CE2  . TYR   A  1  122 ? -0.965  -4.073  20.519  1.000 22.891  0 177  TYR   A CE2  1 ? 1 
ATOM   1790  C  CZ   . TYR   A  1  122 ? -1.709  -5.207  20.796  1.000 28.635  0 177  TYR   A CZ   1 ? 1 
ATOM   1791  O  OH   . TYR   A  1  122 ? -1.116  -6.440  20.703  1.000 27.771  0 177  TYR   A OH   1 ? 1 
ATOM   1792  H  H    . TYR   A  1  122 ? -4.971  -1.813  18.974  1.000 26.994  0 177  TYR   A H    1 c 1 
ATOM   1793  H  HA   . TYR   A  1  122 ? -5.471  -1.826  21.599  1.000 27.965  0 177  TYR   A HA   1 c 1 
ATOM   1794  H  HB2  . TYR   A  1  122 ? -3.166  -0.735  20.321  1.000 25.348  0 177  TYR   A HB2  1 c 1 
ATOM   1795  H  HB3  . TYR   A  1  122 ? -3.272  -0.878  21.887  1.000 25.950  0 177  TYR   A HB3  1 c 1 
ATOM   1796  H  HD1  . TYR   A  1  122 ? -4.522  -3.750  21.513  1.000 25.144  0 177  TYR   A HD1  1 c 1 
ATOM   1797  H  HD2  . TYR   A  1  122 ? -1.056  -2.055  20.381  1.000 25.105  0 177  TYR   A HD2  1 c 1 
ATOM   1798  H  HE1  . TYR   A  1  122 ? -3.533  -5.852  21.379  1.000 26.889  0 177  TYR   A HE1  1 c 1 
ATOM   1799  H  HE2  . TYR   A  1  122 ? -0.065  -4.154  20.248  1.000 24.908  0 177  TYR   A HE2  1 c 1 
ATOM   1800  H  HH   . TYR   A  1  122 ? -1.566  -7.143  20.914  0.000 18.900  0 177  TYR   A HH   1 c 1 
ATOM   1801  N  N    . MET   A  1  123 ? -5.859  1.099   20.365  1.000 33.106  0 178  MET   A N    1 ? 1 
ATOM   1802  C  CA   . MET   A  1  123 ? -6.415  2.413   20.686  1.000 27.645  0 178  MET   A CA   1 ? 1 
ATOM   1803  C  C    . MET   A  1  123 ? -7.766  2.384   21.415  1.000 43.129  0 178  MET   A C    1 ? 1 
ATOM   1804  O  O    . MET   A  1  123 ? -8.114  3.351   22.088  1.000 35.344  0 178  MET   A O    1 ? 1 
ATOM   1805  C  CB   . MET   A  1  123 ? -6.574  3.301   19.442  1.000 28.942  0 178  MET   A CB   1 ? 1 
ATOM   1806  C  CG   . MET   A  1  123 ? -5.279  3.797   18.893  1.000 33.412  0 178  MET   A CG   1 ? 1 
ATOM   1807  S  SD   . MET   A  1  123 ? -4.173  4.691   20.093  1.000 34.761  0 178  MET   A SD   1 ? 1 
ATOM   1808  C  CE   . MET   A  1  123 ? -2.907  5.192   18.942  1.000 43.328  0 178  MET   A CE   1 ? 1 
ATOM   1809  H  H    . MET   A  1  123 ? -5.702  0.888   19.489  1.000 29.869  0 178  MET   A H    1 c 1 
ATOM   1810  H  HA   . MET   A  1  123 ? -5.774  2.848   21.292  1.000 31.393  0 178  MET   A HA   1 c 1 
ATOM   1811  H  HB2  . MET   A  1  123 ? -7.038  2.790   18.749  1.000 29.441  0 178  MET   A HB2  1 c 1 
ATOM   1812  H  HB3  . MET   A  1  123 ? -7.136  4.068   19.672  1.000 29.879  0 178  MET   A HB3  1 c 1 
ATOM   1813  H  HG2  . MET   A  1  123 ? -4.782  3.033   18.530  1.000 32.085  0 178  MET   A HG2  1 c 1 
ATOM   1814  H  HG3  . MET   A  1  123 ? -5.470  4.402   18.145  1.000 32.122  0 178  MET   A HG3  1 c 1 
ATOM   1815  H  HE1  . MET   A  1  123 ? -2.516  4.410   18.535  1.000 40.512  0 178  MET   A HE1  1 c 1 
ATOM   1816  H  HE2  . MET   A  1  123 ? -3.298  5.749   18.258  1.000 40.593  0 178  MET   A HE2  1 c 1 
ATOM   1817  H  HE3  . MET   A  1  123 ? -2.225  5.688   19.410  1.000 40.689  0 178  MET   A HE3  1 c 1 
ATOM   1818  N  N    . LYS   A  1  124 ? -8.515  1.276   21.313  1.000 37.443  0 179  LYS   A N    1 ? 1 
ATOM   1819  C  CA   . LYS   A  1  124 ? -9.785  1.141   22.011  1.000 35.959  0 179  LYS   A CA   1 ? 1 
ATOM   1820  C  C    . LYS   A  1  124 ? -9.613  1.007   23.522  1.000 38.528  0 179  LYS   A C    1 ? 1 
ATOM   1821  O  O    . LYS   A  1  124 ? -10.546 1.318   24.261  1.000 44.773  0 179  LYS   A O    1 ? 1 
ATOM   1822  C  CB   . LYS   A  1  124 ? -10.566 -0.077  21.495  1.000 36.958  0 179  LYS   A CB   1 ? 1 
ATOM   1823  C  CG   . LYS   A  1  124 ? -11.116 0.040   20.092  1.000 46.765  0 179  LYS   A CG   1 ? 1 
ATOM   1824  C  CD   . LYS   A  1  124 ? -12.015 -1.192  19.699  1.000 51.479  0 179  LYS   A CD   1 ? 1 
ATOM   1825  C  CE   . LYS   A  1  124 ? -12.569 -1.127  18.273  1.000 72.372  0 179  LYS   A CE   1 ? 1 
ATOM   1826  N  NZ   . LYS   A  1  124 ? -11.498 -1.186  17.222  1.000 64.141  0 179  LYS   A NZ   1 ? 1 
ATOM   1827  H  H    . LYS   A  1  124 ? -8.232  0.589   20.781  1.000 37.743  0 179  LYS   A H    1 c 1 
ATOM   1828  H  HA   . LYS   A  1  124 ? -10.318 1.949   21.831  1.000 36.987  0 179  LYS   A HA   1 c 1 
ATOM   1829  H  HB2  . LYS   A  1  124 ? -9.976  -0.859  21.532  1.000 38.620  0 179  LYS   A HB2  1 c 1 
ATOM   1830  H  HB3  . LYS   A  1  124 ? -11.314 -0.243  22.106  1.000 39.254  0 179  LYS   A HB3  1 c 1 
ATOM   1831  H  HG2  . LYS   A  1  124 ? -11.647 0.862   20.024  1.000 45.118  0 179  LYS   A HG2  1 c 1 
ATOM   1832  H  HG3  . LYS   A  1  124 ? -10.368 0.108   19.461  1.000 44.663  0 179  LYS   A HG3  1 c 1 
ATOM   1833  H  HD2  . LYS   A  1  124 ? -11.487 -2.013  19.794  1.000 54.446  0 179  LYS   A HD2  1 c 1 
ATOM   1834  H  HD3  . LYS   A  1  124 ? -12.768 -1.247  20.326  1.000 54.989  0 179  LYS   A HD3  1 c 1 
ATOM   1835  H  HE2  . LYS   A  1  124 ? -13.186 -1.870  18.133  1.000 65.279  0 179  LYS   A HE2  1 c 1 
ATOM   1836  H  HE3  . LYS   A  1  124 ? -13.072 -0.298  18.161  1.000 65.184  0 179  LYS   A HE3  1 c 1 
ATOM   1837  H  HZ1  . LYS   A  1  124 ? -10.955 -1.896  17.376  1.000 66.230  0 179  LYS   A HZ1  1 c 1 
ATOM   1838  H  HZ2  . LYS   A  1  124 ? -11.005 -0.425  17.241  1.000 65.895  0 179  LYS   A HZ2  1 c 1 
ATOM   1839  H  HZ3  . LYS   A  1  124 ? -11.876 -1.274  16.402  1.000 66.153  0 179  LYS   A HZ3  1 c 1 
ATOM   1840  N  N    . LYS   A  1  125 ? -8.427  0.548   23.961  1.000 47.767  0 180  LYS   A N    1 ? 1 
ATOM   1841  C  CA   . LYS   A  1  125 ? -8.131  0.337   25.372  1.000 38.515  0 180  LYS   A CA   1 ? 1 
ATOM   1842  C  C    . LYS   A  1  125 ? -8.421  1.558   26.242  1.000 40.829  0 180  LYS   A C    1 ? 1 
ATOM   1843  O  O    . LYS   A  1  125 ? -8.884  1.390   27.358  1.000 43.133  0 180  LYS   A O    1 ? 1 
ATOM   1844  C  CB   . LYS   A  1  125 ? -6.675  -0.099  25.604  1.000 42.165  0 180  LYS   A CB   1 ? 1 
ATOM   1845  C  CG   . LYS   A  1  125 ? -6.429  -1.601  25.597  1.000 43.426  0 180  LYS   A CG   1 ? 1 
ATOM   1846  C  CD   . LYS   A  1  125 ? -6.965  -2.288  26.883  1.000 71.859  0 180  LYS   A CD   1 ? 1 
ATOM   1847  C  CE   . LYS   A  1  125 ? -6.156  -3.496  27.320  1.000 83.530  0 180  LYS   A CE   1 ? 1 
ATOM   1848  N  NZ   . LYS   A  1  125 ? -6.219  -4.616  26.332  1.000 80.023  0 180  LYS   A NZ   1 ? 1 
ATOM   1849  H  H    . LYS   A  1  125 ? -7.779  0.346   23.350  1.000 42.484  0 180  LYS   A H    1 c 1 
ATOM   1850  H  HA   . LYS   A  1  125 ? -8.715  -0.393  25.683  1.000 41.704  0 180  LYS   A HA   1 c 1 
ATOM   1851  H  HB2  . LYS   A  1  125 ? -6.116  0.309   24.912  1.000 41.027  0 180  LYS   A HB2  1 c 1 
ATOM   1852  H  HB3  . LYS   A  1  125 ? -6.380  0.256   26.468  1.000 41.944  0 180  LYS   A HB3  1 c 1 
ATOM   1853  H  HG2  . LYS   A  1  125 ? -6.869  -1.994  24.813  1.000 47.834  0 180  LYS   A HG2  1 c 1 
ATOM   1854  H  HG3  . LYS   A  1  125 ? -5.465  -1.767  25.519  1.000 47.987  0 180  LYS   A HG3  1 c 1 
ATOM   1855  H  HD2  . LYS   A  1  125 ? -6.973  -1.635  27.614  1.000 65.812  0 180  LYS   A HD2  1 c 1 
ATOM   1856  H  HD3  . LYS   A  1  125 ? -7.891  -2.571  26.727  1.000 66.149  0 180  LYS   A HD3  1 c 1 
ATOM   1857  H  HE2  . LYS   A  1  125 ? -5.224  -3.235  27.440  1.000 79.883  0 180  LYS   A HE2  1 c 1 
ATOM   1858  H  HE3  . LYS   A  1  125 ? -6.491  -3.816  28.179  1.000 80.543  0 180  LYS   A HE3  1 c 1 
ATOM   1859  H  HZ1  . LYS   A  1  125 ? -5.812  -4.369  25.560  1.000 80.255  0 180  LYS   A HZ1  1 c 1 
ATOM   1860  H  HZ2  . LYS   A  1  125 ? -7.084  -4.825  26.159  1.000 81.039  0 180  LYS   A HZ2  1 c 1 
ATOM   1861  H  HZ3  . LYS   A  1  125 ? -5.798  -5.346  26.668  1.000 81.114  0 180  LYS   A HZ3  1 c 1 
ATOM   1862  N  N    . GLY   A  1  126 ? -8.136  2.772   25.757  1.000 38.533  0 181  GLY   A N    1 ? 1 
ATOM   1863  C  CA   . GLY   A  1  126 ? -8.687  3.978   26.359  1.000 41.747  0 181  GLY   A CA   1 ? 1 
ATOM   1864  C  C    . GLY   A  1  126 ? -7.809  4.671   27.406  1.000 38.028  0 181  GLY   A C    1 ? 1 
ATOM   1865  O  O    . GLY   A  1  126 ? -6.714  4.214   27.711  1.000 35.481  0 181  GLY   A O    1 ? 1 
ATOM   1866  H  H    . GLY   A  1  126 ? -7.581  2.852   25.036  1.000 39.208  0 181  GLY   A H    1 c 1 
ATOM   1867  H  HA2  . GLY   A  1  126 ? -8.880  4.623   25.634  1.000 39.882  0 181  GLY   A HA2  1 c 1 
ATOM   1868  H  HA3  . GLY   A  1  126 ? -9.556  3.750   26.777  1.000 40.565  0 181  GLY   A HA3  1 c 1 
ATOM   1869  N  N    . SER   A  1  127 ? -8.334  5.777   27.954  1.000 43.271  0 182  SER   A N    1 ? 1 
ATOM   1870  C  CA   . SER   A  1  127 ? -7.601  6.726   28.780  1.000 40.351  0 182  SER   A CA   1 ? 1 
ATOM   1871  C  C    . SER   A  1  127 ? -7.168  6.199   30.147  1.000 60.612  0 182  SER   A C    1 ? 1 
ATOM   1872  O  O    . SER   A  1  127 ? -6.263  6.744   30.774  1.000 38.757  0 182  SER   A O    1 ? 1 
ATOM   1873  C  CB   . SER   A  1  127 ? -8.457  7.971   28.996  1.000 45.943  0 182  SER   A CB   1 ? 1 
ATOM   1874  O  OG   . SER   A  1  127 ? -9.486  7.706   29.943  1.000 53.755  0 182  SER   A OG   1 ? 1 
ATOM   1875  H  H    . SER   A  1  127 ? -9.220  5.945   27.799  1.000 41.555  0 182  SER   A H    1 c 1 
ATOM   1876  H  HA   . SER   A  1  127 ? -6.783  6.993   28.281  1.000 44.522  0 182  SER   A HA   1 c 1 
ATOM   1877  H  HB2  . SER   A  1  127 ? -7.890  8.706   29.323  1.000 46.338  0 182  SER   A HB2  1 c 1 
ATOM   1878  H  HB3  . SER   A  1  127 ? -8.858  8.248   28.141  1.000 45.927  0 182  SER   A HB3  1 c 1 
ATOM   1879  H  HG   . SER   A  1  127 ? -9.180  7.907   30.698  0.000 38.180  0 182  SER   A HG   1 c 1 
ATOM   1880  N  N    . LYS   A  1  128 ? -7.825  5.139   30.619  1.000 49.012  0 183  LYS   A N    1 ? 1 
ATOM   1881  C  CA   . LYS   A  1  128 ? -7.433  4.532   31.873  1.000 48.975  0 183  LYS   A CA   1 ? 1 
ATOM   1882  C  C    . LYS   A  1  128 ? -6.136  3.742   31.677  1.000 37.265  0 183  LYS   A C    1 ? 1 
ATOM   1883  O  O    . LYS   A  1  128 ? -5.341  3.658   32.598  1.000 51.291  0 183  LYS   A O    1 ? 1 
ATOM   1884  C  CB   . LYS   A  1  128 ? -8.619  3.677   32.384  1.000 73.463  0 183  LYS   A CB   1 ? 1 
ATOM   1885  C  CG   . LYS   A  1  128 ? -8.479  3.091   33.776  1.000 80.516  0 183  LYS   A CG   1 ? 1 
ATOM   1886  C  CD   . LYS   A  1  128 ? -8.246  4.107   34.878  1.000 86.330  0 183  LYS   A CD   1 ? 1 
ATOM   1887  C  CE   . LYS   A  1  128 ? -8.448  3.465   36.236  1.000 72.420  0 183  LYS   A CE   1 ? 1 
ATOM   1888  N  NZ   . LYS   A  1  128 ? -8.057  4.370   37.343  1.000 83.695  0 183  LYS   A NZ   1 ? 1 
ATOM   1889  H  H    . LYS   A  1  128 ? -8.534  4.793   30.159  1.000 51.254  0 183  LYS   A H    1 c 1 
ATOM   1890  H  HA   . LYS   A  1  128 ? -7.264  5.252   32.524  1.000 50.419  0 183  LYS   A HA   1 c 1 
ATOM   1891  H  HB2  . LYS   A  1  128 ? -9.426  4.233   32.366  1.000 68.305  0 183  LYS   A HB2  1 c 1 
ATOM   1892  H  HB3  . LYS   A  1  128 ? -8.757  2.939   31.754  1.000 67.759  0 183  LYS   A HB3  1 c 1 
ATOM   1893  H  HG2  . LYS   A  1  128 ? -9.294  2.585   33.983  1.000 80.371  0 183  LYS   A HG2  1 c 1 
ATOM   1894  H  HG3  . LYS   A  1  128 ? -7.732  2.456   33.772  1.000 79.624  0 183  LYS   A HG3  1 c 1 
ATOM   1895  H  HD2  . LYS   A  1  128 ? -7.332  4.456   34.815  1.000 81.226  0 183  LYS   A HD2  1 c 1 
ATOM   1896  H  HD3  . LYS   A  1  128 ? -8.873  4.854   34.774  1.000 81.610  0 183  LYS   A HD3  1 c 1 
ATOM   1897  H  HE2  . LYS   A  1  128 ? -9.386  3.220   36.344  1.000 78.267  0 183  LYS   A HE2  1 c 1 
ATOM   1898  H  HE3  . LYS   A  1  128 ? -7.915  2.649   36.292  1.000 77.839  0 183  LYS   A HE3  1 c 1 
ATOM   1899  H  HZ1  . LYS   A  1  128 ? -8.562  5.123   37.316  1.000 80.352  0 183  LYS   A HZ1  1 c 1 
ATOM   1900  H  HZ2  . LYS   A  1  128 ? -7.182  4.595   37.262  1.000 79.945  0 183  LYS   A HZ2  1 c 1 
ATOM   1901  H  HZ3  . LYS   A  1  128 ? -8.185  3.955   38.139  1.000 80.759  0 183  LYS   A HZ3  1 c 1 
ATOM   1902  N  N    . VAL   A  1  129 ? -5.898  3.178   30.477  1.000 43.601  0 184  VAL   A N    1 ? 1 
ATOM   1903  C  CA   . VAL   A  1  129 ? -4.653  2.464   30.197  1.000 30.659  0 184  VAL   A CA   1 ? 1 
ATOM   1904  C  C    . VAL   A  1  129 ? -3.585  3.393   29.623  1.000 30.735  0 184  VAL   A C    1 ? 1 
ATOM   1905  O  O    . VAL   A  1  129 ? -2.418  3.332   30.020  1.000 30.077  0 184  VAL   A O    1 ? 1 
ATOM   1906  C  CB   . VAL   A  1  129 ? -4.896  1.250   29.277  1.000 38.433  0 184  VAL   A CB   1 ? 1 
ATOM   1907  C  CG1  . VAL   A  1  129 ? -3.604  0.483   28.965  1.000 32.400  0 184  VAL   A CG1  1 ? 1 
ATOM   1908  C  CG2  . VAL   A  1  129 ? -5.941  0.292   29.886  1.000 45.741  0 184  VAL   A CG2  1 ? 1 
ATOM   1909  H  H    . VAL   A  1  129 ? -6.531  3.231   29.820  1.000 38.347  0 184  VAL   A H    1 c 1 
ATOM   1910  H  HA   . VAL   A  1  129 ? -4.316  2.122   31.044  1.000 34.666  0 184  VAL   A HA   1 c 1 
ATOM   1911  H  HB   . VAL   A  1  129 ? -5.260  1.591   28.423  1.000 36.245  0 184  VAL   A HB   1 c 1 
ATOM   1912  H  HG11 . VAL   A  1  129 ? -3.194  0.187   29.796  1.000 34.320  0 184  VAL   A HG11 1 c 1 
ATOM   1913  H  HG12 . VAL   A  1  129 ? -2.985  1.062   28.489  1.000 33.567  0 184  VAL   A HG12 1 c 1 
ATOM   1914  H  HG13 . VAL   A  1  129 ? -3.811  -0.291  28.413  1.000 33.775  0 184  VAL   A HG13 1 c 1 
ATOM   1915  H  HG21 . VAL   A  1  129 ? -5.983  -0.522  29.356  1.000 43.448  0 184  VAL   A HG21 1 c 1 
ATOM   1916  H  HG22 . VAL   A  1  129 ? -6.814  0.721   29.889  1.000 43.780  0 184  VAL   A HG22 1 c 1 
ATOM   1917  H  HG23 . VAL   A  1  129 ? -5.685  0.070   30.798  1.000 44.066  0 184  VAL   A HG23 1 c 1 
ATOM   1918  N  N    . MET   A  1  130 ? -3.987  4.245   28.676  1.000 28.323  0 185  MET   A N    1 ? 1 
ATOM   1919  C  CA   . MET   A  1  130 ? -3.029  5.031   27.918  1.000 26.120  0 185  MET   A CA   1 ? 1 
ATOM   1920  C  C    . MET   A  1  130 ? -3.481  6.485   27.877  1.000 23.199  0 185  MET   A C    1 ? 1 
ATOM   1921  O  O    . MET   A  1  130 ? -3.841  6.994   26.828  1.000 20.554  0 185  MET   A O    1 ? 1 
ATOM   1922  C  CB   . MET   A  1  130 ? -2.890  4.503   26.501  1.000 25.742  0 185  MET   A CB   1 ? 1 
ATOM   1923  C  CG   . MET   A  1  130 ? -2.406  3.055   26.407  1.000 31.252  0 185  MET   A CG   1 ? 1 
ATOM   1924  S  SD   . MET   A  1  130 ? -2.242  2.421   24.676  1.000 32.283  0 185  MET   A SD   1 ? 1 
ATOM   1925  C  CE   . MET   A  1  130 ? -3.900  2.593   24.082  1.000 31.103  0 185  MET   A CE   1 ? 1 
ATOM   1926  H  H    . MET   A  1  130 ? -4.878  4.336   28.493  1.000 28.525  0 185  MET   A H    1 c 1 
ATOM   1927  H  HA   . MET   A  1  130 ? -2.159  4.984   28.370  1.000 26.013  0 185  MET   A HA   1 c 1 
ATOM   1928  H  HB2  . MET   A  1  130 ? -3.758  4.574   26.058  1.000 26.706  0 185  MET   A HB2  1 c 1 
ATOM   1929  H  HB3  . MET   A  1  130 ? -2.263  5.075   26.015  1.000 26.410  0 185  MET   A HB3  1 c 1 
ATOM   1930  H  HG2  . MET   A  1  130 ? -1.535  2.980   26.852  1.000 30.146  0 185  MET   A HG2  1 c 1 
ATOM   1931  H  HG3  . MET   A  1  130 ? -3.037  2.479   26.889  1.000 30.318  0 185  MET   A HG3  1 c 1 
ATOM   1932  H  HE1  . MET   A  1  130 ? -4.495  2.075   24.637  1.000 31.674  0 185  MET   A HE1  1 c 1 
ATOM   1933  H  HE2  . MET   A  1  130 ? -4.158  3.522   24.111  1.000 31.352  0 185  MET   A HE2  1 c 1 
ATOM   1934  H  HE3  . MET   A  1  130 ? -3.947  2.275   23.172  1.000 30.981  0 185  MET   A HE3  1 c 1 
ATOM   1935  N  N    . PRO   A  1  131 ? -3.486  7.216   29.009  1.000 28.037  0 186  PRO   A N    1 ? 1 
ATOM   1936  C  CA   . PRO   A  1  131 ? -3.992  8.593   29.015  1.000 24.001  0 186  PRO   A CA   1 ? 1 
ATOM   1937  C  C    . PRO   A  1  131 ? -3.279  9.563   28.062  1.000 24.838  0 186  PRO   A C    1 ? 1 
ATOM   1938  O  O    . PRO   A  1  131 ? -3.930  10.420  27.455  1.000 23.085  0 186  PRO   A O    1 ? 1 
ATOM   1939  C  CB   . PRO   A  1  131 ? -3.839  9.005   30.492  1.000 24.874  0 186  PRO   A CB   1 ? 1 
ATOM   1940  C  CG   . PRO   A  1  131 ? -2.832  8.054   31.061  1.000 24.861  0 186  PRO   A CG   1 ? 1 
ATOM   1941  C  CD   . PRO   A  1  131 ? -3.043  6.757   30.338  1.000 26.024  0 186  PRO   A CD   1 ? 1 
ATOM   1942  H  HA   . PRO   A  1  131 ? -4.957  8.572   28.793  1.000 25.046  0 186  PRO   A HA   1 c 1 
ATOM   1943  H  HB2  . PRO   A  1  131 ? -3.522  9.929   30.567  1.000 24.988  0 186  PRO   A HB2  1 c 1 
ATOM   1944  H  HB3  . PRO   A  1  131 ? -4.694  8.927   30.966  1.000 25.272  0 186  PRO   A HB3  1 c 1 
ATOM   1945  H  HG2  . PRO   A  1  131 ? -1.923  8.387   30.915  1.000 25.072  0 186  PRO   A HG2  1 c 1 
ATOM   1946  H  HG3  . PRO   A  1  131 ? -2.972  7.939   32.023  1.000 25.742  0 186  PRO   A HG3  1 c 1 
ATOM   1947  H  HD2  . PRO   A  1  131 ? -2.216  6.243   30.282  1.000 26.030  0 186  PRO   A HD2  1 c 1 
ATOM   1948  H  HD3  . PRO   A  1  131 ? -3.728  6.216   30.772  1.000 26.521  0 186  PRO   A HD3  1 c 1 
ATOM   1949  N  N    . ASN   A  1  132 ? -1.952  9.428   27.951  1.000 19.500  0 187  ASN   A N    1 ? 1 
ATOM   1950  C  CA   . ASN   A  1  132 ? -1.136  10.309  27.128  1.000 21.003  0 187  ASN   A CA   1 ? 1 
ATOM   1951  C  C    . ASN   A  1  132 ? -1.413  10.088  25.651  1.000 20.082  0 187  ASN   A C    1 ? 1 
ATOM   1952  O  O    . ASN   A  1  132 ? -1.679  11.048  24.929  1.000 23.427  0 187  ASN   A O    1 ? 1 
ATOM   1953  C  CB   . ASN   A  1  132 ? 0.332   10.127  27.404  1.000 22.545  0 187  ASN   A CB   1 ? 1 
ATOM   1954  C  CG   . ASN   A  1  132 ? 0.735   10.712  28.737  1.000 23.104  0 187  ASN   A CG   1 ? 1 
ATOM   1955  O  OD1  . ASN   A  1  132 ? 0.893   11.940  28.914  1.000 20.861  0 187  ASN   A OD1  1 ? 1 
ATOM   1956  N  ND2  . ASN   A  1  132 ? 0.922   9.855   29.694  1.000 23.812  0 187  ASN   A ND2  1 ? 1 
ATOM   1957  H  H    . ASN   A  1  132 ? -1.535  8.765   28.422  1.000 21.142  0 187  ASN   A H    1 c 1 
ATOM   1958  H  HA   . ASN   A  1  132 ? -1.369  11.241  27.353  1.000 21.149  0 187  ASN   A HA   1 c 1 
ATOM   1959  H  HB2  . ASN   A  1  132 ? 0.546   9.173   27.389  1.000 22.007  0 187  ASN   A HB2  1 c 1 
ATOM   1960  H  HB3  . ASN   A  1  132 ? 0.844   10.564  26.695  1.000 21.869  0 187  ASN   A HB3  1 c 1 
ATOM   1961  H  HD21 . ASN   A  1  132 ? 0.540   9.058   29.657  1.000 23.586  0 187  ASN   A HD21 1 c 1 
ATOM   1962  H  HD22 . ASN   A  1  132 ? 1.430   10.070  30.386  1.000 24.011  0 187  ASN   A HD22 1 c 1 
ATOM   1963  N  N    . ILE   A  1  133 ? -1.355  8.826   25.211  1.000 20.756  0 188  ILE   A N    1 ? 1 
ATOM   1964  C  CA   . ILE   A  1  133 ? -1.627  8.518   23.807  1.000 22.736  0 188  ILE   A CA   1 ? 1 
ATOM   1965  C  C    . ILE   A  1  133 ? -3.036  8.949   23.394  1.000 24.211  0 188  ILE   A C    1 ? 1 
ATOM   1966  O  O    . ILE   A  1  133 ? -3.242  9.408   22.266  1.000 23.526  0 188  ILE   A O    1 ? 1 
ATOM   1967  C  CB   . ILE   A  1  133 ? -1.382  7.039   23.502  1.000 21.890  0 188  ILE   A CB   1 ? 1 
ATOM   1968  C  CG1  . ILE   A  1  133 ? 0.093   6.669   23.682  1.000 25.065  0 188  ILE   A CG1  1 ? 1 
ATOM   1969  C  CG2  . ILE   A  1  133 ? -1.843  6.655   22.091  1.000 20.073  0 188  ILE   A CG2  1 ? 1 
ATOM   1970  C  CD1  . ILE   A  1  133 ? 0.330   5.140   23.850  1.000 23.283  0 188  ILE   A CD1  1 ? 1 
ATOM   1971  H  H    . ILE   A  1  133 ? -1.149  8.147   25.788  1.000 21.194  0 188  ILE   A H    1 c 1 
ATOM   1972  H  HA   . ILE   A  1  133 ? -0.996  9.031   23.272  1.000 22.128  0 188  ILE   A HA   1 c 1 
ATOM   1973  H  HB   . ILE   A  1  133 ? -1.907  6.507   24.149  1.000 22.560  0 188  ILE   A HB   1 c 1 
ATOM   1974  H  HG12 . ILE   A  1  133 ? 0.595   6.983   22.900  1.000 23.545  0 188  ILE   A HG12 1 c 1 
ATOM   1975  H  HG13 . ILE   A  1  133 ? 0.444   7.131   24.472  1.000 24.115  0 188  ILE   A HG13 1 c 1 
ATOM   1976  H  HG21 . ILE   A  1  133 ? -1.493  7.296   21.447  1.000 20.252  0 188  ILE   A HG21 1 c 1 
ATOM   1977  H  HG22 . ILE   A  1  133 ? -2.816  6.658   22.051  1.000 20.548  0 188  ILE   A HG22 1 c 1 
ATOM   1978  H  HG23 . ILE   A  1  133 ? -1.517  5.766   21.869  1.000 20.315  0 188  ILE   A HG23 1 c 1 
ATOM   1979  H  HD11 . ILE   A  1  133 ? 0.072   4.678   23.034  1.000 23.416  0 188  ILE   A HD11 1 c 1 
ATOM   1980  H  HD12 . ILE   A  1  133 ? -0.204  4.808   24.593  1.000 24.069  0 188  ILE   A HD12 1 c 1 
ATOM   1981  H  HD13 . ILE   A  1  133 ? 1.271   4.976   24.030  1.000 23.797  0 188  ILE   A HD13 1 c 1 
ATOM   1982  N  N    . GLU   A  1  134 ? -4.012  8.784   24.310  1.000 23.210  0 189  GLU   A N    1 ? 1 
ATOM   1983  C  CA   . GLU   A  1  134 ? -5.396  9.095   23.993  1.000 21.984  0 189  GLU   A CA   1 ? 1 
ATOM   1984  C  C    . GLU   A  1  134 ? -5.559  10.609  23.905  1.000 26.005  0 189  GLU   A C    1 ? 1 
ATOM   1985  O  O    . GLU   A  1  134 ? -6.411  11.101  23.176  1.000 20.455  0 189  GLU   A O    1 ? 1 
ATOM   1986  C  CB   . GLU   A  1  134 ? -6.385  8.525   25.016  1.000 23.674  0 189  GLU   A CB   1 ? 1 
ATOM   1987  C  CG   . GLU   A  1  134 ? -6.434  7.010   25.114  1.000 34.985  0 189  GLU   A CG   1 ? 1 
ATOM   1988  C  CD   . GLU   A  1  134 ? -6.871  6.196   23.893  1.000 47.694  0 189  GLU   A CD   1 ? 1 
ATOM   1989  O  OE1  . GLU   A  1  134 ? -7.279  6.768   22.850  1.000 29.750  0 189  GLU   A OE1  1 ? 1 
ATOM   1990  O  OE2  . GLU   A  1  134 ? -6.803  4.948   24.002  1.000 38.330  0 189  GLU   A OE2  1 ? 1 
ATOM   1991  H  H    . GLU   A  1  134 ? -3.808  8.467   25.143  1.000 23.454  0 189  GLU   A H    1 c 1 
ATOM   1992  H  HA   . GLU   A  1  134 ? -5.601  8.709   23.110  1.000 22.848  0 189  GLU   A HA   1 c 1 
ATOM   1993  H  HB2  . GLU   A  1  134 ? -6.155  8.886   25.898  1.000 25.844  0 189  GLU   A HB2  1 c 1 
ATOM   1994  H  HB3  . GLU   A  1  134 ? -7.281  8.851   24.790  1.000 25.606  0 189  GLU   A HB3  1 c 1 
ATOM   1995  H  HG2  . GLU   A  1  134 ? -5.543  6.696   25.367  1.000 33.634  0 189  GLU   A HG2  1 c 1 
ATOM   1996  H  HG3  . GLU   A  1  134 ? -7.034  6.778   25.851  1.000 34.301  0 189  GLU   A HG3  1 c 1 
ATOM   1997  N  N    . LYS   A  1  135 ? -4.745  11.371  24.653  1.000 23.807  0 190  LYS   A N    1 ? 1 
ATOM   1998  C  CA   . LYS   A  1  135 ? -4.811  12.812  24.507  1.000 25.565  0 190  LYS   A CA   1 ? 1 
ATOM   1999  C  C    . LYS   A  1  135 ? -4.274  13.221  23.140  1.000 22.574  0 190  LYS   A C    1 ? 1 
ATOM   2000  O  O    . LYS   A  1  135 ? -4.897  14.050  22.480  1.000 25.860  0 190  LYS   A O    1 ? 1 
ATOM   2001  C  CB   . LYS   A  1  135 ? -4.078  13.573  25.620  1.000 25.708  0 190  LYS   A CB   1 ? 1 
ATOM   2002  C  CG   . LYS   A  1  135 ? -4.170  15.102  25.401  1.000 30.502  0 190  LYS   A CG   1 ? 1 
ATOM   2003  C  CD   . LYS   A  1  135 ? -3.616  15.926  26.524  1.000 34.886  0 190  LYS   A CD   1 ? 1 
ATOM   2004  C  CE   . LYS   A  1  135 ? -3.577  17.389  26.133  1.000 32.983  0 190  LYS   A CE   1 ? 1 
ATOM   2005  N  NZ   . LYS   A  1  135 ? -2.842  18.199  27.133  1.000 31.152  0 190  LYS   A NZ   1 ? 1 
ATOM   2006  H  H    . LYS   A  1  135 ? -4.165  11.000  25.253  1.000 24.748  0 190  LYS   A H    1 c 1 
ATOM   2007  H  HA   . LYS   A  1  135 ? -5.761  13.070  24.546  1.000 24.951  0 190  LYS   A HA   1 c 1 
ATOM   2008  H  HB2  . LYS   A  1  135 ? -4.478  13.345  26.485  1.000 27.092  0 190  LYS   A HB2  1 c 1 
ATOM   2009  H  HB3  . LYS   A  1  135 ? -3.136  13.303  25.631  1.000 26.515  0 190  LYS   A HB3  1 c 1 
ATOM   2010  H  HG2  . LYS   A  1  135 ? -3.692  15.332  24.576  1.000 29.848  0 190  LYS   A HG2  1 c 1 
ATOM   2011  H  HG3  . LYS   A  1  135 ? -5.113  15.339  25.276  1.000 30.392  0 190  LYS   A HG3  1 c 1 
ATOM   2012  H  HD2  . LYS   A  1  135 ? -4.177  15.816  27.321  1.000 33.872  0 190  LYS   A HD2  1 c 1 
ATOM   2013  H  HD3  . LYS   A  1  135 ? -2.708  15.621  26.738  1.000 33.318  0 190  LYS   A HD3  1 c 1 
ATOM   2014  H  HE2  . LYS   A  1  135 ? -3.141  17.485  25.265  1.000 32.434  0 190  LYS   A HE2  1 c 1 
ATOM   2015  H  HE3  . LYS   A  1  135 ? -4.487  17.731  26.054  1.000 33.061  0 190  LYS   A HE3  1 c 1 
ATOM   2016  H  HZ1  . LYS   A  1  135 ? -1.962  17.981  27.118  1.000 31.663  0 190  LYS   A HZ1  1 c 1 
ATOM   2017  H  HZ2  . LYS   A  1  135 ? -3.173  18.038  27.961  1.000 32.223  0 190  LYS   A HZ2  1 c 1 
ATOM   2018  H  HZ3  . LYS   A  1  135 ? -2.933  19.081  26.941  1.000 32.062  0 190  LYS   A HZ3  1 c 1 
ATOM   2019  N  N    . LEU   A  1  136 ? -3.103  12.682  22.761  1.000 23.627  0 191  LEU   A N    1 ? 1 
ATOM   2020  C  CA   . LEU   A  1  136 ? -2.547  12.905  21.436  1.000 23.704  0 191  LEU   A CA   1 ? 1 
ATOM   2021  C  C    . LEU   A  1  136 ? -3.608  12.605  20.377  1.000 30.887  0 191  LEU   A C    1 ? 1 
ATOM   2022  O  O    . LEU   A  1  136 ? -3.837  13.398  19.466  1.000 23.151  0 191  LEU   A O    1 ? 1 
ATOM   2023  C  CB   . LEU   A  1  136 ? -1.343  11.986  21.156  1.000 31.334  0 191  LEU   A CB   1 ? 1 
ATOM   2024  C  CG   . LEU   A  1  136 ? -0.061  12.278  21.903  1.000 32.511  0 191  LEU   A CG   1 ? 1 
ATOM   2025  C  CD1  . LEU   A  1  136 ? 1.006   11.280  21.528  1.000 33.628  0 191  LEU   A CD1  1 ? 1 
ATOM   2026  C  CD2  . LEU   A  1  136 ? 0.413   13.668  21.618  1.000 38.536  0 191  LEU   A CD2  1 ? 1 
ATOM   2027  H  H    . LEU   A  1  136 ? -2.637  12.163  23.352  1.000 23.497  0 191  LEU   A H    1 c 1 
ATOM   2028  H  HA   . LEU   A  1  136 ? -2.276  13.847  21.360  1.000 26.284  0 191  LEU   A HA   1 c 1 
ATOM   2029  H  HB2  . LEU   A  1  136 ? -1.610  11.068  21.359  1.000 29.282  0 191  LEU   A HB2  1 c 1 
ATOM   2030  H  HB3  . LEU   A  1  136 ? -1.150  12.025  20.198  1.000 29.054  0 191  LEU   A HB3  1 c 1 
ATOM   2031  H  HG   . LEU   A  1  136 ? -0.238  12.199  22.873  1.000 33.952  0 191  LEU   A HG   1 c 1 
ATOM   2032  H  HD11 . LEU   A  1  136 ? 1.750   11.350  22.151  1.000 33.386  0 191  LEU   A HD11 1 c 1 
ATOM   2033  H  HD12 . LEU   A  1  136 ? 1.321   11.464  20.626  1.000 32.920  0 191  LEU   A HD12 1 c 1 
ATOM   2034  H  HD13 . LEU   A  1  136 ? 0.638   10.380  21.564  1.000 33.022  0 191  LEU   A HD13 1 c 1 
ATOM   2035  H  HD21 . LEU   A  1  136 ? -0.203  14.311  22.007  1.000 36.394  0 191  LEU   A HD21 1 c 1 
ATOM   2036  H  HD22 . LEU   A  1  136 ? 0.458   13.804  20.656  1.000 36.215  0 191  LEU   A HD22 1 c 1 
ATOM   2037  H  HD23 . LEU   A  1  136 ? 1.298   13.794  22.003  1.000 36.618  0 191  LEU   A HD23 1 c 1 
ATOM   2038  N  N    . ARG   A  1  137 ? -4.255  11.446  20.513  1.000 25.155  0 192  ARG   A N    1 ? 1 
ATOM   2039  C  CA   . ARG   A  1  137 ? -5.233  10.999  19.538  1.000 29.567  0 192  ARG   A CA   1 ? 1 
ATOM   2040  C  C    . ARG   A  1  137 ? -6.419  11.952  19.463  1.000 24.414  0 192  ARG   A C    1 ? 1 
ATOM   2041  O  O    . ARG   A  1  137 ? -6.805  12.395  18.380  1.000 23.971  0 192  ARG   A O    1 ? 1 
ATOM   2042  C  CB   . ARG   A  1  137 ? -5.708  9.581   19.853  1.000 24.823  0 192  ARG   A CB   1 ? 1 
ATOM   2043  C  CG   . ARG   A  1  137 ? -6.513  8.932   18.737  1.000 29.195  0 192  ARG   A CG   1 ? 1 
ATOM   2044  C  CD   . ARG   A  1  137 ? -7.042  7.632   19.220  1.000 34.494  0 192  ARG   A CD   1 ? 1 
ATOM   2045  N  NE   . ARG   A  1  137 ? -8.158  7.863   20.123  1.000 54.371  0 192  ARG   A NE   1 ? 1 
ATOM   2046  C  CZ   . ARG   A  1  137 ? -9.340  8.329   19.747  1.000 51.838  0 192  ARG   A CZ   1 ? 1 
ATOM   2047  N  NH1  . ARG   A  1  137 ? -9.759  8.225   18.495  1.000 54.942  0 192  ARG   A NH1  1 ? 1 
ATOM   2048  N  NH2  . ARG   A  1  137 ? -10.142 8.874   20.656  1.000 57.045  0 192  ARG   A NH2  1 ? 1 
ATOM   2049  H  H    . ARG   A  1  137 ? -4.078  10.914  21.235  1.000 27.420  0 192  ARG   A H    1 c 1 
ATOM   2050  H  HA   . ARG   A  1  137 ? -4.794  10.988  18.656  1.000 26.253  0 192  ARG   A HA   1 c 1 
ATOM   2051  H  HB2  . ARG   A  1  137 ? -4.923  9.024   20.041  1.000 26.746  0 192  ARG   A HB2  1 c 1 
ATOM   2052  H  HB3  . ARG   A  1  137 ? -6.257  9.610   20.664  1.000 27.328  0 192  ARG   A HB3  1 c 1 
ATOM   2053  H  HG2  . ARG   A  1  137 ? -7.256  9.515   18.475  1.000 29.297  0 192  ARG   A HG2  1 c 1 
ATOM   2054  H  HG3  . ARG   A  1  137 ? -5.939  8.784   17.955  1.000 28.737  0 192  ARG   A HG3  1 c 1 
ATOM   2055  H  HD2  . ARG   A  1  137 ? -7.338  7.091   18.457  1.000 36.636  0 192  ARG   A HD2  1 c 1 
ATOM   2056  H  HD3  . ARG   A  1  137 ? -6.334  7.140   19.689  1.000 36.577  0 192  ARG   A HD3  1 c 1 
ATOM   2057  H  HE   . ARG   A  1  137 ? -8.043  7.682   20.969  1.000 48.576  0 192  ARG   A HE   1 c 1 
ATOM   2058  H  HH11 . ARG   A  1  137 ? -9.541  7.517   18.014  1.000 53.229  0 192  ARG   A HH11 1 c 1 
ATOM   2059  H  HH12 . ARG   A  1  137 ? -10.261 8.864   18.148  1.000 53.919  0 192  ARG   A HH12 1 c 1 
ATOM   2060  H  HH21 . ARG   A  1  137 ? -10.971 9.075   20.443  1.000 55.750  0 192  ARG   A HH21 1 c 1 
ATOM   2061  H  HH22 . ARG   A  1  137 ? -9.842  9.034   21.467  1.000 55.749  0 192  ARG   A HH22 1 c 1 
ATOM   2062  N  N    . SER   A  1  138 ? -6.982  12.316  20.609  1.000 23.836  0 193  SER   A N    1 ? 1 
ATOM   2063  C  CA   . SER   A  1  138 ? -8.190  13.110  20.535  1.000 26.585  0 193  SER   A CA   1 ? 1 
ATOM   2064  C  C    . SER   A  1  138 ? -7.973  14.617  20.359  1.000 26.387  0 193  SER   A C    1 ? 1 
ATOM   2065  O  O    . SER   A  1  138 ? -8.855  15.312  19.844  1.000 29.561  0 193  SER   A O    1 ? 1 
ATOM   2066  C  CB   . SER   A  1  138 ? -9.095  12.781  21.705  1.000 32.522  0 193  SER   A CB   1 ? 1 
ATOM   2067  O  OG   . SER   A  1  138 ? -8.706  13.419  22.877  1.000 31.048  0 193  SER   A OG   1 ? 1 
ATOM   2068  H  H    . SER   A  1  138 ? -6.631  12.078  21.419  1.000 24.843  0 193  SER   A H    1 c 1 
ATOM   2069  H  HA   . SER   A  1  138 ? -8.672  12.806  19.720  1.000 26.658  0 193  SER   A HA   1 c 1 
ATOM   2070  H  HB2  . SER   A  1  138 ? -10.016 13.048  21.483  1.000 30.945  0 193  SER   A HB2  1 c 1 
ATOM   2071  H  HB3  . SER   A  1  138 ? -9.091  11.808  21.851  1.000 30.536  0 193  SER   A HB3  1 c 1 
ATOM   2072  H  HG   . SER   A  1  138 ? -9.088  14.189  22.921  0.000 20.050  0 193  SER   A HG   1 c 1 
ATOM   2073  N  N    . CYS   A  1  139 ? -6.799  15.144  20.728  1.000 25.671  0 194  CYS   A N    1 ? 1 
ATOM   2074  C  CA   . CYS   A  1  139 ? -6.518  16.566  20.531  1.000 22.749  0 194  CYS   A CA   1 ? 1 
ATOM   2075  C  C    . CYS   A  1  139 ? -5.988  16.836  19.132  1.000 26.640  0 194  CYS   A C    1 ? 1 
ATOM   2076  O  O    . CYS   A  1  139 ? -6.150  17.945  18.630  1.000 21.941  0 194  CYS   A O    1 ? 1 
ATOM   2077  C  CB   . CYS   A  1  139 ? -5.517  17.122  21.547  1.000 27.621  0 194  CYS   A CB   1 ? 1 
ATOM   2078  S  SG   . CYS   A  1  139 ? -6.016  16.971  23.277  1.000 45.845  0 194  CYS   A SG   1 ? 1 
ATOM   2079  H  H    . CYS   A  1  139 ? -6.162  14.615  21.115  1.000 24.928  0 194  CYS   A H    1 c 1 
ATOM   2080  H  HA   . CYS   A  1  139 ? -7.364  17.057  20.638  1.000 25.337  0 194  CYS   A HA   1 c 1 
ATOM   2081  H  HB2  . CYS   A  1  139 ? -4.665  16.656  21.434  1.000 28.488  0 194  CYS   A HB2  1 c 1 
ATOM   2082  H  HB3  . CYS   A  1  139 ? -5.365  18.070  21.354  1.000 29.006  0 194  CYS   A HB3  1 c 1 
ATOM   2083  N  N    . GLY   A  1  140 ? -5.274  15.854  18.570  1.000 24.155  0 195  GLY   A N    1 ? 1 
ATOM   2084  C  CA   . GLY   A  1  140 ? -4.569  16.022  17.309  1.000 23.539  0 195  GLY   A CA   1 ? 1 
ATOM   2085  C  C    . GLY   A  1  140 ? -5.347  15.488  16.115  1.000 21.717  0 195  GLY   A C    1 ? 1 
ATOM   2086  O  O    . GLY   A  1  140 ? -6.583  15.537  16.112  1.000 19.630  0 195  GLY   A O    1 ? 1 
ATOM   2087  H  H    . GLY   A  1  140 ? -5.219  15.045  18.992  1.000 24.424  0 195  GLY   A H    1 c 1 
ATOM   2088  H  HA2  . GLY   A  1  140 ? -4.380  16.983  17.170  1.000 23.445  0 195  GLY   A HA2  1 c 1 
ATOM   2089  H  HA3  . GLY   A  1  140 ? -3.701  15.550  17.368  1.000 22.986  0 195  GLY   A HA3  1 c 1 
ATOM   2090  N  N    . THR   A  1  141 ? -4.600  15.005  15.114  1.000 21.798  0 196  THR   A N    1 ? 1 
ATOM   2091  C  CA   . THR   A  1  141 ? -5.145  14.348  13.939  1.000 19.662  0 196  THR   A CA   1 ? 1 
ATOM   2092  C  C    . THR   A  1  141 ? -4.853  12.851  14.009  1.000 22.725  0 196  THR   A C    1 ? 1 
ATOM   2093  O  O    . THR   A  1  141 ? -3.718  12.459  14.256  1.000 20.859  0 196  THR   A O    1 ? 1 
ATOM   2094  C  CB   . THR   A  1  141 ? -4.516  14.977  12.682  1.000 20.512  0 196  THR   A CB   1 ? 1 
ATOM   2095  O  OG1  . THR   A  1  141 ? -4.888  16.342  12.584  1.000 23.606  0 196  THR   A OG1  1 ? 1 
ATOM   2096  C  CG2  . THR   A  1  141 ? -4.926  14.311  11.403  1.000 29.871  0 196  THR   A CG2  1 ? 1 
ATOM   2097  H  H    . THR   A  1  141 ? -3.692  15.096  15.170  1.000 21.169  0 196  THR   A H    1 c 1 
ATOM   2098  H  HA   . THR   A  1  141 ? -6.116  14.491  13.918  1.000 20.986  0 196  THR   A HA   1 c 1 
ATOM   2099  H  HB   . THR   A  1  141 ? -3.534  14.921  12.768  1.000 22.161  0 196  THR   A HB   1 c 1 
ATOM   2100  H  HG1  . THR   A  1  141 ? -5.735  16.397  12.537  0.000 15.690  0 196  THR   A HG1  1 c 1 
ATOM   2101  H  HG21 . THR   A  1  141 ? -4.632  14.850  10.647  1.000 26.301  0 196  THR   A HG21 1 c 1 
ATOM   2102  H  HG22 . THR   A  1  141 ? -5.896  14.222  11.379  1.000 26.469  0 196  THR   A HG22 1 c 1 
ATOM   2103  H  HG23 . THR   A  1  141 ? -4.518  13.428  11.348  1.000 26.042  0 196  THR   A HG23 1 c 1 
ATOM   2104  N  N    . HIS   A  1  142 ? -5.880  12.021  13.734  1.000 20.531  0 197  HIS   A N    1 ? 1 
ATOM   2105  C  CA   . HIS   A  1  142 ? -5.739  10.579  13.778  1.000 20.392  0 197  HIS   A CA   1 ? 1 
ATOM   2106  C  C    . HIS   A  1  142 ? -6.579  9.887   12.699  1.000 24.443  0 197  HIS   A C    1 ? 1 
ATOM   2107  O  O    . HIS   A  1  142 ? -7.586  10.421  12.248  1.000 21.818  0 197  HIS   A O    1 ? 1 
ATOM   2108  C  CB   . HIS   A  1  142 ? -6.125  10.085  15.149  1.000 23.799  0 197  HIS   A CB   1 ? 1 
ATOM   2109  C  CG   . HIS   A  1  142 ? -7.601  9.931   15.345  1.000 32.140  0 197  HIS   A CG   1 ? 1 
ATOM   2110  N  ND1  . HIS   A  1  142 ? -8.391  10.992  15.710  1.000 33.349  0 197  HIS   A ND1  1 ? 1 
ATOM   2111  C  CD2  . HIS   A  1  142 ? -8.372  8.824   15.235  1.000 43.257  0 197  HIS   A CD2  1 ? 1 
ATOM   2112  C  CE1  . HIS   A  1  142 ? -9.627  10.511  15.810  1.000 30.425  0 197  HIS   A CE1  1 ? 1 
ATOM   2113  N  NE2  . HIS   A  1  142 ? -9.654  9.203   15.544  1.000 41.059  0 197  HIS   A NE2  1 ? 1 
ATOM   2114  H  H    . HIS   A  1  142 ? -6.693  12.374  13.511  1.000 21.219  0 197  HIS   A H    1 c 1 
ATOM   2115  H  HA   . HIS   A  1  142 ? -4.789  10.361  13.627  1.000 21.414  0 197  HIS   A HA   1 c 1 
ATOM   2116  H  HB2  . HIS   A  1  142 ? -5.696  9.218   15.303  1.000 24.389  0 197  HIS   A HB2  1 c 1 
ATOM   2117  H  HB3  . HIS   A  1  142 ? -5.783  10.713  15.818  1.000 24.764  0 197  HIS   A HB3  1 c 1 
ATOM   2118  H  HD1  . HIS   A  1  142 ? -8.114  11.816  15.855  0.000 26.410  0 197  HIS   A HD1  1 c 1 
ATOM   2119  H  HD2  . HIS   A  1  142 ? -8.078  7.956   15.007  1.000 39.270  0 197  HIS   A HD2  1 c 1 
ATOM   2120  H  HE1  . HIS   A  1  142 ? -10.382 11.024  16.047  1.000 33.763  0 197  HIS   A HE1  1 c 1 
ATOM   2121  H  HE2  . HIS   A  1  142 ? -10.380 8.686   15.555  0.000 33.720  0 197  HIS   A HE2  1 c 1 
ATOM   2122  N  N    . ALA   A  1  143 ? -6.085  8.730   12.263  1.000 23.158  0 198  ALA   A N    1 ? 1 
ATOM   2123  C  CA   . ALA   A  1  143 ? -6.815  7.810   11.413  1.000 21.609  0 198  ALA   A CA   1 ? 1 
ATOM   2124  C  C    . ALA   A  1  143 ? -7.274  6.594   12.214  1.000 27.443  0 198  ALA   A C    1 ? 1 
ATOM   2125  O  O    . ALA   A  1  143 ? -6.655  6.231   13.213  1.000 23.050  0 198  ALA   A O    1 ? 1 
ATOM   2126  C  CB   . ALA   A  1  143 ? -5.930  7.376   10.300  1.000 18.085  0 198  ALA   A CB   1 ? 1 
ATOM   2127  H  H    . ALA   A  1  143 ? -5.237  8.499   12.513  1.000 22.853  0 198  ALA   A H    1 c 1 
ATOM   2128  H  HA   . ALA   A  1  143 ? -7.601  8.270   11.044  1.000 22.312  0 198  ALA   A HA   1 c 1 
ATOM   2129  H  HB1  . ALA   A  1  143 ? -6.409  6.755   9.727   1.000 18.921  0 198  ALA   A HB1  1 c 1 
ATOM   2130  H  HB2  . ALA   A  1  143 ? -5.658  8.151   9.779   1.000 18.947  0 198  ALA   A HB2  1 c 1 
ATOM   2131  H  HB3  . ALA   A  1  143 ? -5.142  6.938   10.662  1.000 18.862  0 198  ALA   A HB3  1 c 1 
ATOM   2132  N  N    . PRO   A  1  144 ? -8.397  5.947   11.837  1.000 30.309  0 199  PRO   A N    1 ? 1 
ATOM   2133  C  CA   . PRO   A  1  144 ? -8.811  4.733   12.525  1.000 30.814  0 199  PRO   A CA   1 ? 1 
ATOM   2134  C  C    . PRO   A  1  144 ? -7.710  3.684   12.501  1.000 23.577  0 199  PRO   A C    1 ? 1 
ATOM   2135  O  O    . PRO   A  1  144 ? -7.596  2.877   13.413  1.000 21.565  0 199  PRO   A O    1 ? 1 
ATOM   2136  C  CB   . PRO   A  1  144 ? -10.047 4.276   11.726  1.000 27.102  0 199  PRO   A CB   1 ? 1 
ATOM   2137  C  CG   . PRO   A  1  144 ? -10.523 5.500   11.020  1.000 30.108  0 199  PRO   A CG   1 ? 1 
ATOM   2138  C  CD   . PRO   A  1  144 ? -9.324  6.345   10.756  1.000 24.840  0 199  PRO   A CD   1 ? 1 
ATOM   2139  H  HA   . PRO   A  1  144 ? -9.071  4.945   13.456  1.000 28.904  0 199  PRO   A HA   1 c 1 
ATOM   2140  H  HB2  . PRO   A  1  144 ? -9.806  3.577   11.081  1.000 28.290  0 199  PRO   A HB2  1 c 1 
ATOM   2141  H  HB3  . PRO   A  1  144 ? -10.735 3.927   12.319  1.000 28.832  0 199  PRO   A HB3  1 c 1 
ATOM   2142  H  HG2  . PRO   A  1  144 ? -10.961 5.260   10.178  1.000 28.147  0 199  PRO   A HG2  1 c 1 
ATOM   2143  H  HG3  . PRO   A  1  144 ? -11.166 5.985   11.575  1.000 28.687  0 199  PRO   A HG3  1 c 1 
ATOM   2144  H  HD2  . PRO   A  1  144 ? -8.944  6.158   9.878   1.000 26.810  0 199  PRO   A HD2  1 c 1 
ATOM   2145  H  HD3  . PRO   A  1  144 ? -9.546  7.292   10.816  1.000 27.186  0 199  PRO   A HD3  1 c 1 
ATOM   2146  N  N    . TYR   A  1  145 ? -6.949  3.651   11.410  1.000 17.053  0 200  TYR   A N    1 ? 1 
ATOM   2147  C  CA   . TYR   A  1  145 ? -5.829  2.748   11.296  1.000 17.693  0 200  TYR   A CA   1 ? 1 
ATOM   2148  C  C    . TYR   A  1  145 ? -4.979  3.222   10.129  1.000 17.831  0 200  TYR   A C    1 ? 1 
ATOM   2149  O  O    . TYR   A  1  145 ? -5.396  4.063   9.338   1.000 22.675  0 200  TYR   A O    1 ? 1 
ATOM   2150  C  CB   . TYR   A  1  145 ? -6.289  1.272   11.131  1.000 22.145  0 200  TYR   A CB   1 ? 1 
ATOM   2151  C  CG   . TYR   A  1  145 ? -7.037  0.980   9.855   1.000 19.924  0 200  TYR   A CG   1 ? 1 
ATOM   2152  C  CD1  . TYR   A  1  145 ? -6.355  0.710   8.679   1.000 26.829  0 200  TYR   A CD1  1 ? 1 
ATOM   2153  C  CD2  . TYR   A  1  145 ? -8.426  1.023   9.812   1.000 24.239  0 200  TYR   A CD2  1 ? 1 
ATOM   2154  C  CE1  . TYR   A  1  145 ? -7.026  0.449   7.499   1.000 29.287  0 200  TYR   A CE1  1 ? 1 
ATOM   2155  C  CE2  . TYR   A  1  145 ? -9.114  0.786   8.630   1.000 25.943  0 200  TYR   A CE2  1 ? 1 
ATOM   2156  C  CZ   . TYR   A  1  145 ? -8.404  0.500   7.468   1.000 34.795  0 200  TYR   A CZ   1 ? 1 
ATOM   2157  O  OH   . TYR   A  1  145 ? -8.999  0.244   6.240   1.000 34.487  0 200  TYR   A OH   1 ? 1 
ATOM   2158  H  H    . TYR   A  1  145 ? -7.146  4.198   10.704  1.000 18.605  0 200  TYR   A H    1 c 1 
ATOM   2159  H  HA   . TYR   A  1  145 ? -5.287  2.817   12.122  1.000 18.410  0 200  TYR   A HA   1 c 1 
ATOM   2160  H  HB2  . TYR   A  1  145 ? -5.495  0.700   11.167  1.000 20.420  0 200  TYR   A HB2  1 c 1 
ATOM   2161  H  HB3  . TYR   A  1  145 ? -6.859  1.037   11.891  1.000 20.806  0 200  TYR   A HB3  1 c 1 
ATOM   2162  H  HD1  . TYR   A  1  145 ? -5.413  0.676   8.689   1.000 25.295  0 200  TYR   A HD1  1 c 1 
ATOM   2163  H  HD2  . TYR   A  1  145 ? -8.909  1.224   10.597  1.000 23.951  0 200  TYR   A HD2  1 c 1 
ATOM   2164  H  HE1  . TYR   A  1  145 ? -6.543  0.264   6.710   1.000 29.459  0 200  TYR   A HE1  1 c 1 
ATOM   2165  H  HE2  . TYR   A  1  145 ? -10.057 0.811   8.615   1.000 27.516  0 200  TYR   A HE2  1 c 1 
ATOM   2166  H  HH   . TYR   A  1  145 ? -8.505  0.068   5.557   0.000 28.350  0 200  TYR   A HH   1 c 1 
ATOM   2167  N  N    . MET   A  1  146 ? -3.761  2.684   10.086  1.000 15.597  0 201  MET   A N    1 ? 1 
ATOM   2168  C  CA   . MET   A  1  146 ? -2.826  2.920   9.018   1.000 15.475  0 201  MET   A CA   1 ? 1 
ATOM   2169  C  C    . MET   A  1  146 ? -2.433  1.530   8.517   1.000 16.851  0 201  MET   A C    1 ? 1 
ATOM   2170  O  O    . MET   A  1  146 ? -2.086  0.639   9.300   1.000 16.994  0 201  MET   A O    1 ? 1 
ATOM   2171  C  CB   . MET   A  1  146 ? -1.643  3.749   9.492   1.000 13.871  0 201  MET   A CB   1 ? 1 
ATOM   2172  C  CG   . MET   A  1  146 ? -0.631  3.988   8.355   1.000 18.273  0 201  MET   A CG   1 ? 1 
ATOM   2173  S  SD   . MET   A  1  146 ? 0.845   4.938   8.809   1.000 19.404  0 201  MET   A SD   1 ? 1 
ATOM   2174  C  CE   . MET   A  1  146 ? 1.636   3.647   9.843   1.000 17.997  0 201  MET   A CE   1 ? 1 
ATOM   2175  H  H    . MET   A  1  146 ? -3.503  2.137   10.771  1.000 16.211  0 201  MET   A H    1 c 1 
ATOM   2176  H  HA   . MET   A  1  146 ? -3.292  3.397   8.295   1.000 15.420  0 201  MET   A HA   1 c 1 
ATOM   2177  H  HB2  . MET   A  1  146 ? -1.967  4.610   9.825   1.000 15.263  0 201  MET   A HB2  1 c 1 
ATOM   2178  H  HB3  . MET   A  1  146 ? -1.200  3.284   10.230  1.000 15.224  0 201  MET   A HB3  1 c 1 
ATOM   2179  H  HG2  . MET   A  1  146 ? -0.339  3.119   8.006   1.000 17.085  0 201  MET   A HG2  1 c 1 
ATOM   2180  H  HG3  . MET   A  1  146 ? -1.086  4.458   7.625   1.000 17.125  0 201  MET   A HG3  1 c 1 
ATOM   2181  H  HE1  . MET   A  1  146 ? 1.218   3.630   10.712  1.000 18.538  0 201  MET   A HE1  1 c 1 
ATOM   2182  H  HE2  . MET   A  1  146 ? 1.531   2.787   9.419   1.000 18.280  0 201  MET   A HE2  1 c 1 
ATOM   2183  H  HE3  . MET   A  1  146 ? 2.574   3.844   9.940   1.000 18.521  0 201  MET   A HE3  1 c 1 
ATOM   2184  N  N    . ARG   A  1  147 ? -2.479  1.350   7.188   1.000 17.835  0 202  ARG   A N    1 ? 1 
ATOM   2185  C  CA   . ARG   A  1  147 ? -2.174  0.061   6.598   1.000 16.507  0 202  ARG   A CA   1 ? 1 
ATOM   2186  C  C    . ARG   A  1  147 ? -0.680  -0.059  6.335   1.000 14.327  0 202  ARG   A C    1 ? 1 
ATOM   2187  O  O    . ARG   A  1  147 ? -0.082  0.803   5.685   1.000 17.387  0 202  ARG   A O    1 ? 1 
ATOM   2188  C  CB   . ARG   A  1  147 ? -2.963  -0.147  5.279   1.000 17.335  0 202  ARG   A CB   1 ? 1 
ATOM   2189  C  CG   . ARG   A  1  147 ? -2.625  -1.444  4.525   1.000 20.751  0 202  ARG   A CG   1 ? 1 
ATOM   2190  C  CD   . ARG   A  1  147 ? -3.721  -1.836  3.494   1.000 24.947  0 202  ARG   A CD   1 ? 1 
ATOM   2191  N  NE   . ARG   A  1  147 ? -4.147  -0.717  2.667   1.000 42.358  0 202  ARG   A NE   1 ? 1 
ATOM   2192  C  CZ   . ARG   A  1  147 ? -5.285  -0.046  2.808   1.000 49.780  0 202  ARG   A CZ   1 ? 1 
ATOM   2193  N  NH1  . ARG   A  1  147 ? -6.295  -0.537  3.513   1.000 43.737  0 202  ARG   A NH1  1 ? 1 
ATOM   2194  N  NH2  . ARG   A  1  147 ? -5.414  1.143   2.211   1.000 43.777  0 202  ARG   A NH2  1 ? 1 
ATOM   2195  H  H    . ARG   A  1  147 ? -2.704  2.047   6.641   1.000 17.195  0 202  ARG   A H    1 c 1 
ATOM   2196  H  HA   . ARG   A  1  147 ? -2.440  -0.635  7.233   1.000 16.650  0 202  ARG   A HA   1 c 1 
ATOM   2197  H  HB2  . ARG   A  1  147 ? -3.921  -0.145  5.486   1.000 17.931  0 202  ARG   A HB2  1 c 1 
ATOM   2198  H  HB3  . ARG   A  1  147 ? -2.784  0.614   4.688   1.000 17.768  0 202  ARG   A HB3  1 c 1 
ATOM   2199  H  HG2  . ARG   A  1  147 ? -1.773  -1.331  4.053   1.000 20.599  0 202  ARG   A HG2  1 c 1 
ATOM   2200  H  HG3  . ARG   A  1  147 ? -2.518  -2.175  5.171   1.000 20.791  0 202  ARG   A HG3  1 c 1 
ATOM   2201  H  HD2  . ARG   A  1  147 ? -3.372  -2.546  2.913   1.000 27.183  0 202  ARG   A HD2  1 c 1 
ATOM   2202  H  HD3  . ARG   A  1  147 ? -4.495  -2.199  3.973   1.000 27.529  0 202  ARG   A HD3  1 c 1 
ATOM   2203  H  HE   . ARG   A  1  147 ? -3.613  -0.467  2.024   1.000 38.528  0 202  ARG   A HE   1 c 1 
ATOM   2204  H  HH11 . ARG   A  1  147 ? -6.523  -1.381  3.422   1.000 45.195  0 202  ARG   A HH11 1 c 1 
ATOM   2205  H  HH12 . ARG   A  1  147 ? -6.738  -0.014  4.068   1.000 45.560  0 202  ARG   A HH12 1 c 1 
ATOM   2206  H  HH21 . ARG   A  1  147 ? -5.873  1.782   2.604   1.000 45.588  0 202  ARG   A HH21 1 c 1 
ATOM   2207  H  HH22 . ARG   A  1  147 ? -5.043  1.282   1.426   1.000 45.311  0 202  ARG   A HH22 1 c 1 
ATOM   2208  N  N    . PRO   A  1  148 ? -0.051  -1.170  6.791   1.000 16.712  0 203  PRO   A N    1 ? 1 
ATOM   2209  C  CA   . PRO   A  1  148 ? 1.360   -1.444  6.514   1.000 18.387  0 203  PRO   A CA   1 ? 1 
ATOM   2210  C  C    . PRO   A  1  148 ? 1.555   -2.004  5.119   1.000 17.424  0 203  PRO   A C    1 ? 1 
ATOM   2211  O  O    . PRO   A  1  148 ? 0.577   -2.322  4.460   1.000 21.890  0 203  PRO   A O    1 ? 1 
ATOM   2212  C  CB   . PRO   A  1  148 ? 1.704   -2.502  7.575   1.000 22.069  0 203  PRO   A CB   1 ? 1 
ATOM   2213  C  CG   . PRO   A  1  148 ? 0.359   -3.278  7.692   1.000 22.888  0 203  PRO   A CG   1 ? 1 
ATOM   2214  C  CD   . PRO   A  1  148 ? -0.668  -2.198  7.659   1.000 22.785  0 203  PRO   A CD   1 ? 1 
ATOM   2215  H  HA   . PRO   A  1  148 ? 1.903   -0.628  6.652   1.000 18.442  0 203  PRO   A HA   1 c 1 
ATOM   2216  H  HB2  . PRO   A  1  148 ? 2.429   -3.091  7.275   1.000 21.335  0 203  PRO   A HB2  1 c 1 
ATOM   2217  H  HB3  . PRO   A  1  148 ? 1.952   -2.087  8.428   1.000 21.417  0 203  PRO   A HB3  1 c 1 
ATOM   2218  H  HG2  . PRO   A  1  148 ? 0.241   -3.895  6.942   1.000 22.566  0 203  PRO   A HG2  1 c 1 
ATOM   2219  H  HG3  . PRO   A  1  148 ? 0.315   -3.781  8.530   1.000 22.814  0 203  PRO   A HG3  1 c 1 
ATOM   2220  H  HD2  . PRO   A  1  148 ? -1.504  -2.526  7.279   1.000 21.136  0 203  PRO   A HD2  1 c 1 
ATOM   2221  H  HD3  . PRO   A  1  148 ? -0.840  -1.847  8.552   1.000 21.301  0 203  PRO   A HD3  1 c 1 
ATOM   2222  N  N    . VAL   A  1  149 ? 2.815   -2.123  4.687   1.000 17.171  0 204  VAL   A N    1 ? 1 
ATOM   2223  C  CA   . VAL   A  1  149 ? 3.147   -2.839  3.464   1.000 17.949  0 204  VAL   A CA   1 ? 1 
ATOM   2224  C  C    . VAL   A  1  149 ? 3.362   -4.311  3.773   1.000 17.342  0 204  VAL   A C    1 ? 1 
ATOM   2225  O  O    . VAL   A  1  149 ? 3.696   -4.683  4.912   1.000 17.376  0 204  VAL   A O    1 ? 1 
ATOM   2226  C  CB   . VAL   A  1  149 ? 4.404   -2.267  2.767   1.000 20.522  0 204  VAL   A CB   1 ? 1 
ATOM   2227  C  CG1  . VAL   A  1  149 ? 4.159   -0.923  2.160   1.000 21.687  0 204  VAL   A CG1  1 ? 1 
ATOM   2228  C  CG2  . VAL   A  1  149 ? 5.594   -2.210  3.741   1.000 26.001  0 204  VAL   A CG2  1 ? 1 
ATOM   2229  H  H    . VAL   A  1  149 ? 3.488   -1.747  5.177   1.000 17.589  0 204  VAL   A H    1 c 1 
ATOM   2230  H  HA   . VAL   A  1  149 ? 2.395   -2.762  2.849   1.000 17.968  0 204  VAL   A HA   1 c 1 
ATOM   2231  H  HB   . VAL   A  1  149 ? 4.644   -2.887  2.035   1.000 21.088  0 204  VAL   A HB   1 c 1 
ATOM   2232  H  HG11 . VAL   A  1  149 ? 3.901   -0.295  2.856   1.000 21.270  0 204  VAL   A HG11 1 c 1 
ATOM   2233  H  HG12 . VAL   A  1  149 ? 3.445   -0.988  1.503   1.000 21.219  0 204  VAL   A HG12 1 c 1 
ATOM   2234  H  HG13 . VAL   A  1  149 ? 4.971   -0.609  1.726   1.000 21.367  0 204  VAL   A HG13 1 c 1 
ATOM   2235  H  HG21 . VAL   A  1  149 ? 6.418   -2.088  3.238   1.000 24.228  0 204  VAL   A HG21 1 c 1 
ATOM   2236  H  HG22 . VAL   A  1  149 ? 5.646   -3.039  4.247   1.000 24.236  0 204  VAL   A HG22 1 c 1 
ATOM   2237  H  HG23 . VAL   A  1  149 ? 5.479   -1.464  4.354   1.000 24.074  0 204  VAL   A HG23 1 c 1 
ATOM   2238  N  N    . TYR   A  1  150 ? 3.192   -5.133  2.736   1.000 13.784  0 205  TYR   A N    1 ? 1 
ATOM   2239  C  CA   . TYR   A  1  150 ? 3.502   -6.550  2.797   1.000 17.086  0 205  TYR   A CA   1 ? 1 
ATOM   2240  C  C    . TYR   A  1  150 ? 4.959   -6.772  2.428   1.000 15.435  0 205  TYR   A C    1 ? 1 
ATOM   2241  O  O    . TYR   A  1  150 ? 5.488   -6.064  1.562   1.000 16.845  0 205  TYR   A O    1 ? 1 
ATOM   2242  C  CB   . TYR   A  1  150 ? 2.647   -7.321  1.794   1.000 16.623  0 205  TYR   A CB   1 ? 1 
ATOM   2243  C  CG   . TYR   A  1  150 ? 2.828   -8.810  1.848   1.000 15.459  0 205  TYR   A CG   1 ? 1 
ATOM   2244  C  CD1  . TYR   A  1  150 ? 2.208   -9.576  2.832   1.000 21.241  0 205  TYR   A CD1  1 ? 1 
ATOM   2245  C  CD2  . TYR   A  1  150 ? 3.602   -9.461  0.917   1.000 17.432  0 205  TYR   A CD2  1 ? 1 
ATOM   2246  C  CE1  . TYR   A  1  150 ? 2.373   -10.948 2.886   1.000 15.887  0 205  TYR   A CE1  1 ? 1 
ATOM   2247  C  CE2  . TYR   A  1  150 ? 3.749   -10.833 0.943   1.000 19.942  0 205  TYR   A CE2  1 ? 1 
ATOM   2248  C  CZ   . TYR   A  1  150 ? 3.142   -11.576 1.937   1.000 17.369  0 205  TYR   A CZ   1 ? 1 
ATOM   2249  O  OH   . TYR   A  1  150 ? 3.364   -12.932 1.953   1.000 18.054  0 205  TYR   A OH   1 ? 1 
ATOM   2250  H  HA   . TYR   A  1  150 ? 3.328   -6.888  3.708   1.000 16.132  0 205  TYR   A HA   1 c 1 
ATOM   2251  H  HB2  . TYR   A  1  150 ? 1.705   -7.110  1.964   1.000 16.289  0 205  TYR   A HB2  1 c 1 
ATOM   2252  H  HB3  . TYR   A  1  150 ? 2.866   -7.006  0.892   1.000 16.327  0 205  TYR   A HB3  1 c 1 
ATOM   2253  H  HD1  . TYR   A  1  150 ? 1.679   -9.149  3.486   1.000 18.208  0 205  TYR   A HD1  1 c 1 
ATOM   2254  H  HD2  . TYR   A  1  150 ? 4.018   -8.965  0.231   1.000 17.399  0 205  TYR   A HD2  1 c 1 
ATOM   2255  H  HE1  . TYR   A  1  150 ? 1.955   -11.451 3.565   1.000 17.479  0 205  TYR   A HE1  1 c 1 
ATOM   2256  H  HE2  . TYR   A  1  150 ? 4.297   -11.261 0.305   1.000 18.852  0 205  TYR   A HE2  1 c 1 
ATOM   2257  H  HH   . TYR   A  1  150 ? 3.008   -13.413 2.585   0.000 12.320  0 205  TYR   A HH   1 c 1 
ATOM   2258  N  N    . PRO   A  1  151 ? 5.686   -7.687  3.101   1.000 18.270  0 206  PRO   A N    1 ? 1 
ATOM   2259  C  CA   . PRO   A  1  151 ? 5.211   -8.369  4.310   1.000 18.327  0 206  PRO   A CA   1 ? 1 
ATOM   2260  C  C    . PRO   A  1  151 ? 5.113   -7.478  5.544   1.000 19.021  0 206  PRO   A C    1 ? 1 
ATOM   2261  O  O    . PRO   A  1  151 ? 5.901   -6.563  5.722   1.000 20.940  0 206  PRO   A O    1 ? 1 
ATOM   2262  C  CB   . PRO   A  1  151 ? 6.271   -9.466  4.546   1.000 18.598  0 206  PRO   A CB   1 ? 1 
ATOM   2263  C  CG   . PRO   A  1  151 ? 7.474   -9.036  3.829   1.000 22.158  0 206  PRO   A CG   1 ? 1 
ATOM   2264  C  CD   . PRO   A  1  151 ? 7.030   -8.114  2.696   1.000 20.036  0 206  PRO   A CD   1 ? 1 
ATOM   2265  H  HA   . PRO   A  1  151 ? 4.338   -8.796  4.128   1.000 18.376  0 206  PRO   A HA   1 c 1 
ATOM   2266  H  HB2  . PRO   A  1  151 ? 6.460   -9.566  5.503   1.000 19.527  0 206  PRO   A HB2  1 c 1 
ATOM   2267  H  HB3  . PRO   A  1  151 ? 5.957   -10.329 4.200   1.000 19.495  0 206  PRO   A HB3  1 c 1 
ATOM   2268  H  HG2  . PRO   A  1  151 ? 8.078   -8.560  4.435   1.000 20.918  0 206  PRO   A HG2  1 c 1 
ATOM   2269  H  HG3  . PRO   A  1  151 ? 7.949   -9.811  3.468   1.000 21.091  0 206  PRO   A HG3  1 c 1 
ATOM   2270  H  HD2  . PRO   A  1  151 ? 7.628   -7.350  2.609   1.000 20.006  0 206  PRO   A HD2  1 c 1 
ATOM   2271  H  HD3  . PRO   A  1  151 ? 7.000   -8.593  1.848   1.000 20.104  0 206  PRO   A HD3  1 c 1 
ATOM   2272  N  N    . THR   A  1  152 ? 4.147   -7.783  6.419   1.000 14.648  0 207  THR   A N    1 ? 1 
ATOM   2273  C  CA   . THR   A  1  152 ? 3.854   -6.969  7.577   1.000 13.488  0 207  THR   A CA   1 ? 1 
ATOM   2274  C  C    . THR   A  1  152 ? 4.820   -7.370  8.695   1.000 16.549  0 207  THR   A C    1 ? 1 
ATOM   2275  O  O    . THR   A  1  152 ? 4.422   -7.904  9.739   1.000 14.427  0 207  THR   A O    1 ? 1 
ATOM   2276  C  CB   . THR   A  1  152 ? 2.381   -7.108  7.906   1.000 17.486  0 207  THR   A CB   1 ? 1 
ATOM   2277  O  OG1  . THR   A  1  152 ? 2.087   -8.493  7.996   1.000 14.776  0 207  THR   A OG1  1 ? 1 
ATOM   2278  C  CG2  . THR   A  1  152 ? 1.484   -6.436  6.912   1.000 17.911  0 207  THR   A CG2  1 ? 1 
ATOM   2279  H  H    . THR   A  1  152 ? 3.651   -8.538  6.281   1.000 15.402  0 207  THR   A H    1 c 1 
ATOM   2280  H  HA   . THR   A  1  152 ? 4.028   -6.031  7.339   1.000 14.734  0 207  THR   A HA   1 c 1 
ATOM   2281  H  HB   . THR   A  1  152 ? 2.228   -6.698  8.790   1.000 16.177  0 207  THR   A HB   1 c 1 
ATOM   2282  H  HG1  . THR   A  1  152 ? 2.264   -8.879  7.255   0.000 8.780   0 207  THR   A HG1  1 c 1 
ATOM   2283  H  HG21 . THR   A  1  152 ? 0.576   -6.405  7.261   1.000 17.732  0 207  THR   A HG21 1 c 1 
ATOM   2284  H  HG22 . THR   A  1  152 ? 1.493   -6.935  6.076   1.000 17.669  0 207  THR   A HG22 1 c 1 
ATOM   2285  H  HG23 . THR   A  1  152 ? 1.801   -5.529  6.751   1.000 17.597  0 207  THR   A HG23 1 c 1 
ATOM   2286  N  N    . LYS   A  1  153 ? 6.110   -7.171  8.394   1.000 18.832  0 208  LYS   A N    1 ? 1 
ATOM   2287  C  CA   . LYS   A  1  153 ? 7.247   -7.393  9.268   1.000 19.392  0 208  LYS   A CA   1 ? 1 
ATOM   2288  C  C    . LYS   A  1  153 ? 7.912   -6.035  9.527   1.000 19.977  0 208  LYS   A C    1 ? 1 
ATOM   2289  O  O    . LYS   A  1  153 ? 7.693   -5.048  8.800   1.000 16.797  0 208  LYS   A O    1 ? 1 
ATOM   2290  C  CB   . LYS   A  1  153 ? 8.258   -8.313  8.603   1.000 21.659  0 208  LYS   A CB   1 ? 1 
ATOM   2291  C  CG   . LYS   A  1  153 ? 7.778   -9.694  8.235   1.000 22.329  0 208  LYS   A CG   1 ? 1 
ATOM   2292  C  CD   . LYS   A  1  153 ? 7.645   -10.577 9.362   1.000 27.723  0 208  LYS   A CD   1 ? 1 
ATOM   2293  C  CE   . LYS   A  1  153 ? 7.630   -11.998 8.931   1.000 25.964  0 208  LYS   A CE   1 ? 1 
ATOM   2294  N  NZ   . LYS   A  1  153 ? 7.515   -12.839 10.092  1.000 37.731  0 208  LYS   A NZ   1 ? 1 
ATOM   2295  H  H    . LYS   A  1  153 ? 6.292   -6.843  7.561   1.000 18.130  0 208  LYS   A H    1 c 1 
ATOM   2296  H  HA   . LYS   A  1  153 ? 6.942   -7.785  10.118  1.000 19.890  0 208  LYS   A HA   1 c 1 
ATOM   2297  H  HB2  . LYS   A  1  153 ? 8.575   -7.874  7.786   1.000 21.149  0 208  LYS   A HB2  1 c 1 
ATOM   2298  H  HB3  . LYS   A  1  153 ? 9.027   -8.405  9.203   1.000 21.515  0 208  LYS   A HB3  1 c 1 
ATOM   2299  H  HG2  . LYS   A  1  153 ? 6.908   -9.617  7.788   1.000 23.025  0 208  LYS   A HG2  1 c 1 
ATOM   2300  H  HG3  . LYS   A  1  153 ? 8.409   -10.085 7.594   1.000 23.443  0 208  LYS   A HG3  1 c 1 
ATOM   2301  H  HD2  . LYS   A  1  153 ? 8.395   -10.435 9.979   1.000 26.128  0 208  LYS   A HD2  1 c 1 
ATOM   2302  H  HD3  . LYS   A  1  153 ? 6.812   -10.374 9.838   1.000 25.862  0 208  LYS   A HD3  1 c 1 
ATOM   2303  H  HE2  . LYS   A  1  153 ? 6.875   -12.159 8.335   1.000 28.556  0 208  LYS   A HE2  1 c 1 
ATOM   2304  H  HE3  . LYS   A  1  153 ? 8.454   -12.213 8.455   1.000 28.846  0 208  LYS   A HE3  1 c 1 
ATOM   2305  H  HZ1  . LYS   A  1  153 ? 6.750   -12.644 10.540  1.000 33.413  0 208  LYS   A HZ1  1 c 1 
ATOM   2306  H  HZ2  . LYS   A  1  153 ? 8.224   -12.706 10.642  1.000 33.702  0 208  LYS   A HZ2  1 c 1 
ATOM   2307  H  HZ3  . LYS   A  1  153 ? 7.495   -13.710 9.840   1.000 33.791  0 208  LYS   A HZ3  1 c 1 
ATOM   2308  N  N    . THR   A  1  154 ? 8.782   -6.014  10.534  1.000 14.770  0 209  THR   A N    1 ? 1 
ATOM   2309  C  CA   . THR   A  1  154 ? 9.407   -4.786  11.008  1.000 14.613  0 209  THR   A CA   1 ? 1 
ATOM   2310  C  C    . THR   A  1  154 ? 10.300  -4.068  10.015  1.000 15.468  0 209  THR   A C    1 ? 1 
ATOM   2311  O  O    . THR   A  1  154 ? 10.046  -2.912  9.697   1.000 18.676  0 209  THR   A O    1 ? 1 
ATOM   2312  C  CB   . THR   A  1  154 ? 10.275  -5.094  12.223  1.000 20.669  0 209  THR   A CB   1 ? 1 
ATOM   2313  O  OG1  . THR   A  1  154 ? 9.371   -5.747  13.141  1.000 18.747  0 209  THR   A OG1  1 ? 1 
ATOM   2314  C  CG2  . THR   A  1  154 ? 10.898  -3.872  12.831  1.000 22.513  0 209  THR   A CG2  1 ? 1 
ATOM   2315  H  H    . THR   A  1  154 ? 8.998   -6.801  10.947  1.000 16.171  0 209  THR   A H    1 c 1 
ATOM   2316  H  HA   . THR   A  1  154 ? 8.691   -4.171  11.283  1.000 15.545  0 209  THR   A HA   1 c 1 
ATOM   2317  H  HB   . THR   A  1  154 ? 10.984  -5.727  11.958  1.000 19.488  0 209  THR   A HB   1 c 1 
ATOM   2318  H  HG1  . THR   A  1  154 ? 8.756   -5.224  13.333  0.000 11.430  0 209  THR   A HG1  1 c 1 
ATOM   2319  H  HG21 . THR   A  1  154 ? 11.290  -4.103  13.692  1.000 22.267  0 209  THR   A HG21 1 c 1 
ATOM   2320  H  HG22 . THR   A  1  154 ? 10.216  -3.188  12.959  1.000 21.767  0 209  THR   A HG22 1 c 1 
ATOM   2321  H  HG23 . THR   A  1  154 ? 11.594  -3.530  12.242  1.000 21.992  0 209  THR   A HG23 1 c 1 
ATOM   2322  N  N    . PHE   A  1  155 ? 11.352  -4.741  9.546   1.000 19.987  0 210  PHE   A N    1 ? 1 
ATOM   2323  C  CA   . PHE   A  1  155 ? 12.339  -4.032  8.742   1.000 16.766  0 210  PHE   A CA   1 ? 1 
ATOM   2324  C  C    . PHE   A  1  155 ? 11.707  -3.524  7.446   1.000 16.253  0 210  PHE   A C    1 ? 1 
ATOM   2325  O  O    . PHE   A  1  155 ? 11.890  -2.358  7.078   1.000 18.586  0 210  PHE   A O    1 ? 1 
ATOM   2326  C  CB   . PHE   A  1  155 ? 13.612  -4.836  8.521   1.000 21.353  0 210  PHE   A CB   1 ? 1 
ATOM   2327  C  CG   . PHE   A  1  155 ? 14.692  -4.652  9.597   1.000 26.551  0 210  PHE   A CG   1 ? 1 
ATOM   2328  C  CD1  . PHE   A  1  155 ? 14.349  -4.498  10.952  1.000 36.470  0 210  PHE   A CD1  1 ? 1 
ATOM   2329  C  CD2  . PHE   A  1  155 ? 16.030  -4.701  9.270   1.000 46.035  0 210  PHE   A CD2  1 ? 1 
ATOM   2330  C  CE1  . PHE   A  1  155 ? 15.343  -4.349  11.951  1.000 27.506  0 210  PHE   A CE1  1 ? 1 
ATOM   2331  C  CE2  . PHE   A  1  155 ? 17.018  -4.546  10.262  1.000 61.549  0 210  PHE   A CE2  1 ? 1 
ATOM   2332  C  CZ   . PHE   A  1  155 ? 16.664  -4.362  11.598  1.000 38.445  0 210  PHE   A CZ   1 ? 1 
ATOM   2333  H  H    . PHE   A  1  155 ? 11.455  -5.634  9.713   1.000 18.282  0 210  PHE   A H    1 c 1 
ATOM   2334  H  HA   . PHE   A  1  155 ? 12.599  -3.227  9.259   1.000 18.149  0 210  PHE   A HA   1 c 1 
ATOM   2335  H  HB2  . PHE   A  1  155 ? 13.375  -5.784  8.473   1.000 21.177  0 210  PHE   A HB2  1 c 1 
ATOM   2336  H  HB3  . PHE   A  1  155 ? 13.989  -4.582  7.655   1.000 21.109  0 210  PHE   A HB3  1 c 1 
ATOM   2337  H  HD1  . PHE   A  1  155 ? 13.439  -4.477  11.198  1.000 31.143  0 210  PHE   A HD1  1 c 1 
ATOM   2338  H  HD2  . PHE   A  1  155 ? 16.283  -4.808  8.369   1.000 42.003  0 210  PHE   A HD2  1 c 1 
ATOM   2339  H  HE1  . PHE   A  1  155 ? 15.093  -4.227  12.853  1.000 31.867  0 210  PHE   A HE1  1 c 1 
ATOM   2340  H  HE2  . PHE   A  1  155 ? 17.930  -4.560  10.018  1.000 50.963  0 210  PHE   A HE2  1 c 1 
ATOM   2341  H  HZ   . PHE   A  1  155 ? 17.333  -4.270  12.258  1.000 39.713  0 210  PHE   A HZ   1 c 1 
ATOM   2342  N  N    . PRO   A  1  156 ? 10.924  -4.325  6.698   1.000 14.045  0 211  PRO   A N    1 ? 1 
ATOM   2343  C  CA   . PRO   A  1  156 ? 10.230  -3.764  5.530   1.000 15.884  0 211  PRO   A CA   1 ? 1 
ATOM   2344  C  C    . PRO   A  1  156 ? 9.376   -2.541  5.865   1.000 12.868  0 211  PRO   A C    1 ? 1 
ATOM   2345  O  O    . PRO   A  1  156 ? 9.403   -1.553  5.147   1.000 17.505  0 211  PRO   A O    1 ? 1 
ATOM   2346  C  CB   . PRO   A  1  156 ? 9.424   -4.973  5.015   1.000 15.905  0 211  PRO   A CB   1 ? 1 
ATOM   2347  C  CG   . PRO   A  1  156 ? 10.271  -6.156  5.470   1.000 13.905  0 211  PRO   A CG   1 ? 1 
ATOM   2348  C  CD   . PRO   A  1  156 ? 10.743  -5.777  6.823   1.000 15.272  0 211  PRO   A CD   1 ? 1 
ATOM   2349  H  HA   . PRO   A  1  156 ? 10.904  -3.516  4.848   1.000 15.011  0 211  PRO   A HA   1 c 1 
ATOM   2350  H  HB2  . PRO   A  1  156 ? 8.530   -5.002  5.418   1.000 15.123  0 211  PRO   A HB2  1 c 1 
ATOM   2351  H  HB3  . PRO   A  1  156 ? 9.338   -4.954  4.038   1.000 15.209  0 211  PRO   A HB3  1 c 1 
ATOM   2352  H  HG2  . PRO   A  1  156 ? 9.736   -6.975  5.505   1.000 14.671  0 211  PRO   A HG2  1 c 1 
ATOM   2353  H  HG3  . PRO   A  1  156 ? 11.027  -6.297  4.865   1.000 14.820  0 211  PRO   A HG3  1 c 1 
ATOM   2354  H  HD2  . PRO   A  1  156 ? 10.079  -5.993  7.503   1.000 14.710  0 211  PRO   A HD2  1 c 1 
ATOM   2355  H  HD3  . PRO   A  1  156 ? 11.583  -6.221  7.042   1.000 15.097  0 211  PRO   A HD3  1 c 1 
ATOM   2356  N  N    . ASN   A  1  157 ? 8.605   -2.589  6.971   1.000 15.183  0 212  ASN   A N    1 ? 1 
ATOM   2357  C  CA   . ASN   A  1  157 ? 7.720   -1.481  7.293   1.000 15.423  0 212  ASN   A CA   1 ? 1 
ATOM   2358  C  C    . ASN   A  1  157 ? 8.449   -0.269  7.860   1.000 15.432  0 212  ASN   A C    1 ? 1 
ATOM   2359  O  O    . ASN   A  1  157 ? 8.113   0.854   7.503   1.000 16.730  0 212  ASN   A O    1 ? 1 
ATOM   2360  C  CB   . ASN   A  1  157 ? 6.541   -1.919  8.194   1.000 14.127  0 212  ASN   A CB   1 ? 1 
ATOM   2361  C  CG   . ASN   A  1  157 ? 5.442   -2.552  7.332   1.000 16.882  0 212  ASN   A CG   1 ? 1 
ATOM   2362  O  OD1  . ASN   A  1  157 ? 4.604   -1.847  6.783   1.000 14.325  0 212  ASN   A OD1  1 ? 1 
ATOM   2363  N  ND2  . ASN   A  1  157 ? 5.487   -3.845  7.128   1.000 12.743  0 212  ASN   A ND2  1 ? 1 
ATOM   2364  H  H    . ASN   A  1  157 ? 8.631   -3.318  7.522   1.000 14.777  0 212  ASN   A H    1 c 1 
ATOM   2365  H  HA   . ASN   A  1  157 ? 7.313   -1.192  6.442   1.000 14.924  0 212  ASN   A HA   1 c 1 
ATOM   2366  H  HB2  . ASN   A  1  157 ? 6.857   -2.566  8.856   1.000 15.184  0 212  ASN   A HB2  1 c 1 
ATOM   2367  H  HB3  . ASN   A  1  157 ? 6.182   -1.139  8.664   1.000 14.978  0 212  ASN   A HB3  1 c 1 
ATOM   2368  H  HD21 . ASN   A  1  157 ? 5.867   -4.375  7.726   1.000 14.058  0 212  ASN   A HD21 1 c 1 
ATOM   2369  H  HD22 . ASN   A  1  157 ? 5.137   -4.189  6.392   1.000 13.802  0 212  ASN   A HD22 1 c 1 
ATOM   2370  N  N    . LEU   A  1  158 ? 9.444   -0.469  8.723   1.000 13.826  0 213  LEU   A N    1 ? 1 
ATOM   2371  C  CA   . LEU   A  1  158 ? 10.220  0.683   9.172   1.000 14.771  0 213  LEU   A CA   1 ? 1 
ATOM   2372  C  C    . LEU   A  1  158 ? 10.865  1.435   8.008   1.000 12.344  0 213  LEU   A C    1 ? 1 
ATOM   2373  O  O    . LEU   A  1  158 ? 10.879  2.681   7.977   1.000 14.289  0 213  LEU   A O    1 ? 1 
ATOM   2374  C  CB   . LEU   A  1  158 ? 11.287  0.291   10.213  1.000 13.893  0 213  LEU   A CB   1 ? 1 
ATOM   2375  C  CG   . LEU   A  1  158 ? 10.721  -0.085  11.586  1.000 14.640  0 213  LEU   A CG   1 ? 1 
ATOM   2376  C  CD1  . LEU   A  1  158 ? 11.806  -0.448  12.575  1.000 16.039  0 213  LEU   A CD1  1 ? 1 
ATOM   2377  C  CD2  . LEU   A  1  158 ? 9.877   1.017   12.163  1.000 16.298  0 213  LEU   A CD2  1 ? 1 
ATOM   2378  H  H    . LEU   A  1  158 ? 9.642   -1.305  9.036   1.000 14.544  0 213  LEU   A H    1 c 1 
ATOM   2379  H  HA   . LEU   A  1  158 ? 9.588   1.304   9.601   1.000 13.842  0 213  LEU   A HA   1 c 1 
ATOM   2380  H  HB2  . LEU   A  1  158 ? 11.798  -0.467  9.865   1.000 14.438  0 213  LEU   A HB2  1 c 1 
ATOM   2381  H  HB3  . LEU   A  1  158 ? 11.904  1.042   10.324  1.000 14.534  0 213  LEU   A HB3  1 c 1 
ATOM   2382  H  HG   . LEU   A  1  158 ? 10.142  -0.878  11.467  1.000 14.907  0 213  LEU   A HG   1 c 1 
ATOM   2383  H  HD11 . LEU   A  1  158 ? 11.409  -0.888  13.346  1.000 15.838  0 213  LEU   A HD11 1 c 1 
ATOM   2384  H  HD12 . LEU   A  1  158 ? 12.266  0.360   12.863  1.000 15.898  0 213  LEU   A HD12 1 c 1 
ATOM   2385  H  HD13 . LEU   A  1  158 ? 12.443  -1.049  12.151  1.000 15.927  0 213  LEU   A HD13 1 c 1 
ATOM   2386  H  HD21 . LEU   A  1  158 ? 9.007   1.025   11.726  1.000 15.469  0 213  LEU   A HD21 1 c 1 
ATOM   2387  H  HD22 . LEU   A  1  158 ? 10.318  1.873   12.021  1.000 15.772  0 213  LEU   A HD22 1 c 1 
ATOM   2388  H  HD23 . LEU   A  1  158 ? 9.757   0.869   13.117  1.000 15.882  0 213  LEU   A HD23 1 c 1 
ATOM   2389  N  N    . TYR   A  1  159 ? 11.445  0.691   7.064   1.000 14.465  0 214  TYR   A N    1 ? 1 
ATOM   2390  C  CA   . TYR   A  1  159 ? 12.124  1.337   5.960   1.000 12.047  0 214  TYR   A CA   1 ? 1 
ATOM   2391  C  C    . TYR   A  1  159 ? 11.116  1.950   4.987   1.000 14.667  0 214  TYR   A C    1 ? 1 
ATOM   2392  O  O    . TYR   A  1  159 ? 11.389  2.997   4.381   1.000 15.412  0 214  TYR   A O    1 ? 1 
ATOM   2393  C  CB   . TYR   A  1  159 ? 13.090  0.428   5.289   1.000 16.500  0 214  TYR   A CB   1 ? 1 
ATOM   2394  C  CG   . TYR   A  1  159 ? 14.248  1.151   4.607   1.000 18.194  0 214  TYR   A CG   1 ? 1 
ATOM   2395  C  CD1  . TYR   A  1  159 ? 15.005  2.111   5.293   1.000 18.922  0 214  TYR   A CD1  1 ? 1 
ATOM   2396  C  CD2  . TYR   A  1  159 ? 14.584  0.878   3.288   1.000 17.311  0 214  TYR   A CD2  1 ? 1 
ATOM   2397  C  CE1  . TYR   A  1  159 ? 16.067  2.769   4.677   1.000 18.368  0 214  TYR   A CE1  1 ? 1 
ATOM   2398  C  CE2  . TYR   A  1  159 ? 15.618  1.568   2.642   1.000 16.721  0 214  TYR   A CE2  1 ? 1 
ATOM   2399  C  CZ   . TYR   A  1  159 ? 16.370  2.491   3.349   1.000 19.639  0 214  TYR   A CZ   1 ? 1 
ATOM   2400  O  OH   . TYR   A  1  159 ? 17.399  3.119   2.718   1.000 17.704  0 214  TYR   A OH   1 ? 1 
ATOM   2401  H  H    . TYR   A  1  159 ? 11.421  -0.222  7.109   1.000 13.395  0 214  TYR   A H    1 c 1 
ATOM   2402  H  HA   . TYR   A  1  159 ? 12.645  2.087   6.341   1.000 13.919  0 214  TYR   A HA   1 c 1 
ATOM   2403  H  HB2  . TYR   A  1  159 ? 13.453  -0.190  5.957   1.000 15.713  0 214  TYR   A HB2  1 c 1 
ATOM   2404  H  HB3  . TYR   A  1  159 ? 12.607  -0.102  4.621   1.000 15.416  0 214  TYR   A HB3  1 c 1 
ATOM   2405  H  HD1  . TYR   A  1  159 ? 14.808  2.300   6.195   1.000 18.471  0 214  TYR   A HD1  1 c 1 
ATOM   2406  H  HD2  . TYR   A  1  159 ? 14.074  0.253   2.802   1.000 17.179  0 214  TYR   A HD2  1 c 1 
ATOM   2407  H  HE1  . TYR   A  1  159 ? 16.569  3.410   5.153   1.000 19.022  0 214  TYR   A HE1  1 c 1 
ATOM   2408  H  HE2  . TYR   A  1  159 ? 15.840  1.362   1.750   1.000 17.640  0 214  TYR   A HE2  1 c 1 
ATOM   2409  H  HH   . TYR   A  1  159 ? 17.871  3.705   3.140   0.000 9.470   0 214  TYR   A HH   1 c 1 
ATOM   2410  N  N    . THR   A  1  160 ? 9.921   1.351   4.858   1.000 16.221  0 215  THR   A N    1 ? 1 
ATOM   2411  C  CA   . THR   A  1  160 ? 8.898   1.997   4.040   1.000 16.054  0 215  THR   A CA   1 ? 1 
ATOM   2412  C  C    . THR   A  1  160 ? 8.499   3.341   4.635   1.000 15.515  0 215  THR   A C    1 ? 1 
ATOM   2413  O  O    . THR   A  1  160 ? 8.366   4.328   3.902   1.000 15.985  0 215  THR   A O    1 ? 1 
ATOM   2414  C  CB   . THR   A  1  160 ? 7.692   1.083   3.810   1.000 15.065  0 215  THR   A CB   1 ? 1 
ATOM   2415  O  OG1  . THR   A  1  160 ? 8.074   0.054   2.859   1.000 12.260  0 215  THR   A OG1  1 ? 1 
ATOM   2416  C  CG2  . THR   A  1  160 ? 6.507   1.856   3.349   1.000 20.261  0 215  THR   A CG2  1 ? 1 
ATOM   2417  H  H    . THR   A  1  160 ? 9.744   0.551   5.262   1.000 15.744  0 215  THR   A H    1 c 1 
ATOM   2418  H  HA   . THR   A  1  160 ? 9.304   2.172   3.160   1.000 15.821  0 215  THR   A HA   1 c 1 
ATOM   2419  H  HB   . THR   A  1  160 ? 7.469   0.651   4.669   1.000 15.388  0 215  THR   A HB   1 c 1 
ATOM   2420  H  HG1  . THR   A  1  160 ? 8.301   0.420   2.134   0.000 7.680   0 215  THR   A HG1  1 c 1 
ATOM   2421  H  HG21 . THR   A  1  160 ? 5.829   1.241   3.017   1.000 18.279  0 215  THR   A HG21 1 c 1 
ATOM   2422  H  HG22 . THR   A  1  160 ? 6.770   2.462   2.633   1.000 18.401  0 215  THR   A HG22 1 c 1 
ATOM   2423  H  HG23 . THR   A  1  160 ? 6.140   2.369   4.091   1.000 18.351  0 215  THR   A HG23 1 c 1 
ATOM   2424  N  N    . LEU   A  1  161 ? 8.257   3.350   5.957   1.000 17.418  0 216  LEU   A N    1 ? 1 
ATOM   2425  C  CA   . LEU   A  1  161 ? 7.926   4.555   6.704   1.000 19.716  0 216  LEU   A CA   1 ? 1 
ATOM   2426  C  C    . LEU   A  1  161 ? 8.939   5.639   6.366   1.000 18.729  0 216  LEU   A C    1 ? 1 
ATOM   2427  O  O    . LEU   A  1  161 ? 8.560   6.775   6.098   1.000 18.162  0 216  LEU   A O    1 ? 1 
ATOM   2428  C  CB   . LEU   A  1  161 ? 7.896   4.328   8.260   1.000 20.884  0 216  LEU   A CB   1 ? 1 
ATOM   2429  C  CG   . LEU   A  1  161 ? 6.680   3.489   8.805   1.000 26.241  0 216  LEU   A CG   1 ? 1 
ATOM   2430  C  CD1  . LEU   A  1  161 ? 6.854   3.084   10.255  1.000 25.573  0 216  LEU   A CD1  1 ? 1 
ATOM   2431  C  CD2  . LEU   A  1  161 ? 5.386   4.225   8.697   1.000 27.456  0 216  LEU   A CD2  1 ? 1 
ATOM   2432  H  H    . LEU   A  1  161 ? 8.296   2.559   6.413   1.000 17.422  0 216  LEU   A H    1 c 1 
ATOM   2433  H  HA   . LEU   A  1  161 ? 7.038   4.860   6.408   1.000 19.110  0 216  LEU   A HA   1 c 1 
ATOM   2434  H  HB2  . LEU   A  1  161 ? 8.723   3.878   8.521   1.000 21.810  0 216  LEU   A HB2  1 c 1 
ATOM   2435  H  HB3  . LEU   A  1  161 ? 7.887   5.203   8.697   1.000 21.798  0 216  LEU   A HB3  1 c 1 
ATOM   2436  H  HG   . LEU   A  1  161 ? 6.607   2.666   8.264   1.000 25.042  0 216  LEU   A HG   1 c 1 
ATOM   2437  H  HD11 . LEU   A  1  161 ? 6.187   2.415   10.488  1.000 25.769  0 216  LEU   A HD11 1 c 1 
ATOM   2438  H  HD12 . LEU   A  1  161 ? 6.744   3.864   10.827  1.000 25.947  0 216  LEU   A HD12 1 c 1 
ATOM   2439  H  HD13 . LEU   A  1  161 ? 7.744   2.713   10.383  1.000 25.976  0 216  LEU   A HD13 1 c 1 
ATOM   2440  H  HD21 . LEU   A  1  161 ? 5.233   4.479   7.771   1.000 26.748  0 216  LEU   A HD21 1 c 1 
ATOM   2441  H  HD22 . LEU   A  1  161 ? 5.419   5.025   9.250   1.000 27.093  0 216  LEU   A HD22 1 c 1 
ATOM   2442  H  HD23 . LEU   A  1  161 ? 4.661   3.652   8.999   1.000 26.851  0 216  LEU   A HD23 1 c 1 
ATOM   2443  N  N    . ALA   A  1  162 ? 10.207  5.226   6.311   1.000 21.622  0 217  ALA   A N    1 ? 1 
ATOM   2444  C  CA   . ALA   A  1  162 ? 11.341  6.115   6.131   1.000 20.997  0 217  ALA   A CA   1 ? 1 
ATOM   2445  C  C    . ALA   A  1  162 ? 11.570  6.573   4.686   1.000 23.865  0 217  ALA   A C    1 ? 1 
ATOM   2446  O  O    . ALA   A  1  162 ? 12.238  7.584   4.477   1.000 16.959  0 217  ALA   A O    1 ? 1 
ATOM   2447  C  CB   . ALA   A  1  162 ? 12.602  5.423   6.638   1.000 22.665  0 217  ALA   A CB   1 ? 1 
ATOM   2448  H  H    . ALA   A  1  162 ? 10.378  4.334   6.410   1.000 20.631  0 217  ALA   A H    1 c 1 
ATOM   2449  H  HA   . ALA   A  1  162 ? 11.187  6.919   6.682   1.000 21.962  0 217  ALA   A HA   1 c 1 
ATOM   2450  H  HB1  . ALA   A  1  162 ? 13.365  6.017   6.531   1.000 22.512  0 217  ALA   A HB1  1 c 1 
ATOM   2451  H  HB2  . ALA   A  1  162 ? 12.496  5.200   7.578   1.000 22.282  0 217  ALA   A HB2  1 c 1 
ATOM   2452  H  HB3  . ALA   A  1  162 ? 12.754  4.609   6.128   1.000 22.211  0 217  ALA   A HB3  1 c 1 
ATOM   2453  N  N    . THR   A  1  163 ? 11.053  5.825   3.698   1.000 16.089  0 218  THR   A N    1 ? 1 
ATOM   2454  C  CA   . THR   A  1  163 ? 11.409  6.077   2.300   1.000 15.734  0 218  THR   A CA   1 ? 1 
ATOM   2455  C  C    . THR   A  1  163 ? 10.225  6.391   1.374   1.000 15.178  0 218  THR   A C    1 ? 1 
ATOM   2456  O  O    . THR   A  1  163 ? 10.416  6.969   0.304   1.000 15.502  0 218  THR   A O    1 ? 1 
ATOM   2457  C  CB   . THR   A  1  163 ? 12.184  4.878   1.700   1.000 16.054  0 218  THR   A CB   1 ? 1 
ATOM   2458  O  OG1  . THR   A  1  163 ? 11.307  3.760   1.660   1.000 13.808  0 218  THR   A OG1  1 ? 1 
ATOM   2459  C  CG2  . THR   A  1  163 ? 13.470  4.562   2.427   1.000 17.148  0 218  THR   A CG2  1 ? 1 
ATOM   2460  H  H    . THR   A  1  163 ? 10.490  5.134   3.896   1.000 17.322  0 218  THR   A H    1 c 1 
ATOM   2461  H  HA   . THR   A  1  163 ? 12.011  6.857   2.286   1.000 16.075  0 218  THR   A HA   1 c 1 
ATOM   2462  H  HB   . THR   A  1  163 ? 12.415  5.115   0.770   1.000 15.838  0 218  THR   A HB   1 c 1 
ATOM   2463  H  HG1  . THR   A  1  163 ? 11.050  3.578   2.446   0.000 8.110   0 218  THR   A HG1  1 c 1 
ATOM   2464  H  HG21 . THR   A  1  163 ? 13.873  3.763   2.043   1.000 16.998  0 218  THR   A HG21 1 c 1 
ATOM   2465  H  HG22 . THR   A  1  163 ? 13.284  4.409   3.370   1.000 16.850  0 218  THR   A HG22 1 c 1 
ATOM   2466  H  HG23 . THR   A  1  163 ? 14.087  5.310   2.336   1.000 17.153  0 218  THR   A HG23 1 c 1 
ATOM   2467  N  N    . GLY   A  1  164 ? 9.011   6.049   1.817   1.000 17.891  0 219  GLY   A N    1 ? 1 
ATOM   2468  C  CA   . GLY   A  1  164 ? 7.803   6.174   1.013   1.000 19.626  0 219  GLY   A CA   1 ? 1 
ATOM   2469  C  C    . GLY   A  1  164 ? 7.662   5.132   -0.100  1.000 16.469  0 219  GLY   A C    1 ? 1 
ATOM   2470  O  O    . GLY   A  1  164 ? 6.787   5.264   -0.959  1.000 16.419  0 219  GLY   A O    1 ? 1 
ATOM   2471  H  H    . GLY   A  1  164 ? 8.927   5.722   2.666   1.000 17.404  0 219  GLY   A H    1 c 1 
ATOM   2472  H  HA2  . GLY   A  1  164 ? 7.020   6.107   1.612   1.000 18.255  0 219  GLY   A HA2  1 c 1 
ATOM   2473  H  HA3  . GLY   A  1  164 ? 7.788   7.077   0.609   1.000 18.456  0 219  GLY   A HA3  1 c 1 
ATOM   2474  N  N    . LEU   A  1  165 ? 8.562   4.141   -0.102  1.000 16.911  0 220  LEU   A N    1 ? 1 
ATOM   2475  C  CA   . LEU   A  1  165 ? 8.696   3.160   -1.166  1.000 15.217  0 220  LEU   A CA   1 ? 1 
ATOM   2476  C  C    . LEU   A  1  165 ? 8.155   1.812   -0.708  1.000 19.484  0 220  LEU   A C    1 ? 1 
ATOM   2477  O  O    . LEU   A  1  165 ? 8.199   1.470   0.478   1.000 16.145  0 220  LEU   A O    1 ? 1 
ATOM   2478  C  CB   . LEU   A  1  165 ? 10.138  2.970   -1.554  1.000 15.297  0 220  LEU   A CB   1 ? 1 
ATOM   2479  C  CG   . LEU   A  1  165 ? 10.857  4.132   -2.187  1.000 15.054  0 220  LEU   A CG   1 ? 1 
ATOM   2480  C  CD1  . LEU   A  1  165 ? 12.336  3.887   -2.242  1.000 14.397  0 220  LEU   A CD1  1 ? 1 
ATOM   2481  C  CD2  . LEU   A  1  165 ? 10.379  4.423   -3.620  1.000 18.297  0 220  LEU   A CD2  1 ? 1 
ATOM   2482  H  H    . LEU   A  1  165 ? 9.117   4.060   0.618   1.000 16.520  0 220  LEU   A H    1 c 1 
ATOM   2483  H  HA   . LEU   A  1  165 ? 8.182   3.467   -1.944  1.000 16.186  0 220  LEU   A HA   1 c 1 
ATOM   2484  H  HB2  . LEU   A  1  165 ? 10.630  2.714   -0.749  1.000 15.313  0 220  LEU   A HB2  1 c 1 
ATOM   2485  H  HB3  . LEU   A  1  165 ? 10.186  2.214   -2.173  1.000 15.283  0 220  LEU   A HB3  1 c 1 
ATOM   2486  H  HG   . LEU   A  1  165 ? 10.695  4.937   -1.636  1.000 15.444  0 220  LEU   A HG   1 c 1 
ATOM   2487  H  HD11 . LEU   A  1  165 ? 12.789  4.701   -2.523  1.000 14.925  0 220  LEU   A HD11 1 c 1 
ATOM   2488  H  HD12 . LEU   A  1  165 ? 12.524  3.175   -2.877  1.000 14.816  0 220  LEU   A HD12 1 c 1 
ATOM   2489  H  HD13 . LEU   A  1  165 ? 12.656  3.628   -1.360  1.000 14.752  0 220  LEU   A HD13 1 c 1 
ATOM   2490  H  HD21 . LEU   A  1  165 ? 9.414   4.549   -3.622  1.000 17.072  0 220  LEU   A HD21 1 c 1 
ATOM   2491  H  HD22 . LEU   A  1  165 ? 10.608  3.675   -4.198  1.000 17.327  0 220  LEU   A HD22 1 c 1 
ATOM   2492  H  HD23 . LEU   A  1  165 ? 10.812  5.230   -3.948  1.000 17.540  0 220  LEU   A HD23 1 c 1 
ATOM   2493  N  N    . TYR   A  1  166 ? 7.571   1.093   -1.674  1.000 17.895  0 221  TYR   A N    1 ? 1 
ATOM   2494  C  CA   . TYR   A  1  166 ? 7.283   -0.322  -1.549  1.000 15.503  0 221  TYR   A CA   1 ? 1 
ATOM   2495  C  C    . TYR   A  1  166 ? 8.576   -1.080  -1.261  1.000 15.808  0 221  TYR   A C    1 ? 1 
ATOM   2496  O  O    . TYR   A  1  166 ? 9.644   -0.745  -1.777  1.000 21.291  0 221  TYR   A O    1 ? 1 
ATOM   2497  C  CB   . TYR   A  1  166 ? 6.654   -0.870  -2.836  1.000 14.056  0 221  TYR   A CB   1 ? 1 
ATOM   2498  C  CG   . TYR   A  1  166 ? 5.288   -0.283  -3.139  1.000 15.062  0 221  TYR   A CG   1 ? 1 
ATOM   2499  C  CD1  . TYR   A  1  166 ? 4.231   -0.410  -2.239  1.000 16.783  0 221  TYR   A CD1  1 ? 1 
ATOM   2500  C  CD2  . TYR   A  1  166 ? 5.047   0.391   -4.332  1.000 16.663  0 221  TYR   A CD2  1 ? 1 
ATOM   2501  C  CE1  . TYR   A  1  166 ? 2.975   0.144   -2.511  1.000 15.625  0 221  TYR   A CE1  1 ? 1 
ATOM   2502  C  CE2  . TYR   A  1  166 ? 3.793   0.937   -4.620  1.000 17.535  0 221  TYR   A CE2  1 ? 1 
ATOM   2503  C  CZ   . TYR   A  1  166 ? 2.761   0.793   -3.723  1.000 17.518  0 221  TYR   A CZ   1 ? 1 
ATOM   2504  O  OH   . TYR   A  1  166 ? 1.571   1.359   -4.047  1.000 19.458  0 221  TYR   A OH   1 ? 1 
ATOM   2505  H  H    . TYR   A  1  166 ? 7.342   1.513   -2.453  1.000 17.587  0 221  TYR   A H    1 c 1 
ATOM   2506  H  HA   . TYR   A  1  166 ? 6.654   -0.455  -0.799  1.000 15.533  0 221  TYR   A HA   1 c 1 
ATOM   2507  H  HB2  . TYR   A  1  166 ? 7.258   -0.680  -3.585  1.000 14.817  0 221  TYR   A HB2  1 c 1 
ATOM   2508  H  HB3  . TYR   A  1  166 ? 6.572   -1.844  -2.754  1.000 14.660  0 221  TYR   A HB3  1 c 1 
ATOM   2509  H  HD1  . TYR   A  1  166 ? 4.371   -0.859  -1.422  1.000 16.066  0 221  TYR   A HD1  1 c 1 
ATOM   2510  H  HD2  . TYR   A  1  166 ? 5.745   0.485   -4.959  1.000 16.651  0 221  TYR   A HD2  1 c 1 
ATOM   2511  H  HE1  . TYR   A  1  166 ? 2.269   0.047   -1.895  1.000 16.288  0 221  TYR   A HE1  1 c 1 
ATOM   2512  H  HE2  . TYR   A  1  166 ? 3.650   1.390   -5.435  1.000 17.394  0 221  TYR   A HE2  1 c 1 
ATOM   2513  H  HH   . TYR   A  1  166 ? 0.919   1.324   -3.485  0.000 14.370  0 221  TYR   A HH   1 c 1 
ATOM   2514  N  N    . PRO   A  1  167 ? 8.525   -2.131  -0.426  1.000 14.749  0 222  PRO   A N    1 ? 1 
ATOM   2515  C  CA   . PRO   A  1  167 ? 9.684   -2.995  -0.220  1.000 19.087  0 222  PRO   A CA   1 ? 1 
ATOM   2516  C  C    . PRO   A  1  167 ? 10.439  -3.456  -1.464  1.000 16.721  0 222  PRO   A C    1 ? 1 
ATOM   2517  O  O    . PRO   A  1  167 ? 11.678  -3.504  -1.467  1.000 15.154  0 222  PRO   A O    1 ? 1 
ATOM   2518  C  CB   . PRO   A  1  167 ? 9.051   -4.147  0.517   1.000 19.590  0 222  PRO   A CB   1 ? 1 
ATOM   2519  C  CG   . PRO   A  1  167 ? 7.941   -3.480  1.333   1.000 18.031  0 222  PRO   A CG   1 ? 1 
ATOM   2520  C  CD   . PRO   A  1  167 ? 7.378   -2.490  0.422   1.000 17.518  0 222  PRO   A CD   1 ? 1 
ATOM   2521  H  HA   . PRO   A  1  167 ? 10.313  -2.537  0.387   1.000 17.913  0 222  PRO   A HA   1 c 1 
ATOM   2522  H  HB2  . PRO   A  1  167 ? 8.682   -4.807  -0.106  1.000 19.185  0 222  PRO   A HB2  1 c 1 
ATOM   2523  H  HB3  . PRO   A  1  167 ? 9.701   -4.590  1.104   1.000 19.311  0 222  PRO   A HB3  1 c 1 
ATOM   2524  H  HG2  . PRO   A  1  167 ? 7.263   -4.133  1.602   1.000 18.158  0 222  PRO   A HG2  1 c 1 
ATOM   2525  H  HG3  . PRO   A  1  167 ? 8.305   -3.050  2.134   1.000 18.295  0 222  PRO   A HG3  1 c 1 
ATOM   2526  H  HD2  . PRO   A  1  167 ? 6.652   -2.868  -0.108  1.000 16.784  0 222  PRO   A HD2  1 c 1 
ATOM   2527  H  HD3  . PRO   A  1  167 ? 7.045   -1.715  0.911   1.000 16.717  0 222  PRO   A HD3  1 c 1 
ATOM   2528  N  N    . GLU   A  1  168 ? 9.708   -3.756  -2.551  1.000 19.604  0 223  GLU   A N    1 ? 1 
ATOM   2529  C  CA   . GLU   A  1  168 ? 10.351  -4.233  -3.765  1.000 16.831  0 223  GLU   A CA   1 ? 1 
ATOM   2530  C  C    . GLU   A  1  168 ? 11.245  -3.148  -4.376  1.000 17.299  0 223  GLU   A C    1 ? 1 
ATOM   2531  O  O    . GLU   A  1  168 ? 12.176  -3.457  -5.113  1.000 18.884  0 223  GLU   A O    1 ? 1 
ATOM   2532  C  CB   . GLU   A  1  168 ? 9.303   -4.730  -4.796  1.000 18.980  0 223  GLU   A CB   1 ? 1 
ATOM   2533  C  CG   . GLU   A  1  168 ? 8.563   -3.619  -5.503  1.000 17.021  0 223  GLU   A CG   1 ? 1 
ATOM   2534  C  CD   . GLU   A  1  168 ? 7.528   -4.078  -6.509  1.000 30.750  0 223  GLU   A CD   1 ? 1 
ATOM   2535  O  OE1  . GLU   A  1  168 ? 7.419   -5.300  -6.757  1.000 19.516  0 223  GLU   A OE1  1 ? 1 
ATOM   2536  O  OE2  . GLU   A  1  168 ? 6.805   -3.199  -7.022  1.000 20.268  0 223  GLU   A OE2  1 ? 1 
ATOM   2537  H  H    . GLU   A  1  168 ? 8.799   -3.667  -2.533  1.000 17.879  0 223  GLU   A H    1 c 1 
ATOM   2538  H  HA   . GLU   A  1  168 ? 10.924  -4.997  -3.520  1.000 18.014  0 223  GLU   A HA   1 c 1 
ATOM   2539  H  HB2  . GLU   A  1  168 ? 9.761   -5.281  -5.465  1.000 18.276  0 223  GLU   A HB2  1 c 1 
ATOM   2540  H  HB3  . GLU   A  1  168 ? 8.654   -5.299  -4.332  1.000 17.894  0 223  GLU   A HB3  1 c 1 
ATOM   2541  H  HG2  . GLU   A  1  168 ? 8.114   -3.062  -4.832  1.000 19.649  0 223  GLU   A HG2  1 c 1 
ATOM   2542  H  HG3  . GLU   A  1  168 ? 9.211   -3.051  -5.971  1.000 20.012  0 223  GLU   A HG3  1 c 1 
ATOM   2543  N  N    . SER   A  1  169 ? 10.906  -1.878  -4.118  1.000 15.872  0 224  SER   A N    1 ? 1 
ATOM   2544  C  CA   . SER   A  1  169 ? 11.704  -0.750  -4.560  1.000 19.754  0 224  SER   A CA   1 ? 1 
ATOM   2545  C  C    . SER   A  1  169 ? 12.786  -0.339  -3.552  1.000 20.192  0 224  SER   A C    1 ? 1 
ATOM   2546  O  O    . SER   A  1  169 ? 13.877  -0.006  -3.961  1.000 20.388  0 224  SER   A O    1 ? 1 
ATOM   2547  C  CB   . SER   A  1  169 ? 10.816  0.467   -4.856  1.000 20.444  0 224  SER   A CB   1 ? 1 
ATOM   2548  O  OG   . SER   A  1  169 ? 9.939   0.215   -5.943  1.000 18.084  0 224  SER   A OG   1 ? 1 
ATOM   2549  H  H    . SER   A  1  169 ? 10.134  -1.709  -3.659  1.000 16.698  0 224  SER   A H    1 c 1 
ATOM   2550  H  HA   . SER   A  1  169 ? 12.159  -1.011  -5.405  1.000 19.368  0 224  SER   A HA   1 c 1 
ATOM   2551  H  HB2  . SER   A  1  169 ? 10.288  0.688   -4.055  1.000 19.441  0 224  SER   A HB2  1 c 1 
ATOM   2552  H  HB3  . SER   A  1  169 ? 11.385  1.242   -5.069  1.000 19.848  0 224  SER   A HB3  1 c 1 
ATOM   2553  H  HG   . SER   A  1  169 ? 9.224   -0.117  -5.642  0.000 12.060  0 224  SER   A HG   1 c 1 
ATOM   2554  N  N    . HIS   A  1  170 ? 12.499  -0.328  -2.244  1.000 17.193  0 225  HIS   A N    1 ? 1 
ATOM   2555  C  CA   . HIS   A  1  170 ? 13.541  0.039   -1.287  1.000 18.315  0 225  HIS   A CA   1 ? 1 
ATOM   2556  C  C    . HIS   A  1  170 ? 14.506  -1.112  -1.004  1.000 22.427  0 225  HIS   A C    1 ? 1 
ATOM   2557  O  O    . HIS   A  1  170 ? 15.672  -0.873  -0.707  1.000 18.488  0 225  HIS   A O    1 ? 1 
ATOM   2558  C  CB   . HIS   A  1  170 ? 12.959  0.714   -0.024  1.000 19.220  0 225  HIS   A CB   1 ? 1 
ATOM   2559  C  CG   . HIS   A  1  170 ? 12.123  -0.132  0.878   1.000 18.816  0 225  HIS   A CG   1 ? 1 
ATOM   2560  N  ND1  . HIS   A  1  170 ? 12.514  -1.381  1.280   1.000 21.456  0 225  HIS   A ND1  1 ? 1 
ATOM   2561  C  CD2  . HIS   A  1  170 ? 10.970  0.179   1.492   1.000 21.752  0 225  HIS   A CD2  1 ? 1 
ATOM   2562  C  CE1  . HIS   A  1  170 ? 11.579  -1.780  2.142   1.000 18.093  0 225  HIS   A CE1  1 ? 1 
ATOM   2563  N  NE2  . HIS   A  1  170 ? 10.630  -0.880  2.273   1.000 18.086  0 225  HIS   A NE2  1 ? 1 
ATOM   2564  H  H    . HIS   A  1  170 ? 11.662  -0.543  -1.946  1.000 17.746  0 225  HIS   A H    1 c 1 
ATOM   2565  H  HA   . HIS   A  1  170 ? 14.074  0.738   -1.733  1.000 19.185  0 225  HIS   A HA   1 c 1 
ATOM   2566  H  HB2  . HIS   A  1  170 ? 13.706  1.068   0.500   1.000 19.114  0 225  HIS   A HB2  1 c 1 
ATOM   2567  H  HB3  . HIS   A  1  170 ? 12.419  1.476   -0.311  1.000 18.709  0 225  HIS   A HB3  1 c 1 
ATOM   2568  H  HD1  . HIS   A  1  170 ? 13.259  -1.780  1.059   0.000 14.440  0 225  HIS   A HD1  1 c 1 
ATOM   2569  H  HD2  . HIS   A  1  170 ? 10.491  0.987   1.400   1.000 19.909  0 225  HIS   A HD2  1 c 1 
ATOM   2570  H  HE1  . HIS   A  1  170 ? 11.565  -2.624  2.555   1.000 18.831  0 225  HIS   A HE1  1 c 1 
ATOM   2571  H  HE2  . HIS   A  1  170 ? 9.908   -0.954  2.793   0.000 12.590  0 225  HIS   A HE2  1 c 1 
ATOM   2572  N  N    . GLY   A  1  171 ? 14.075  -2.354  -1.242  1.000 16.324  0 226  GLY   A N    1 ? 1 
ATOM   2573  C  CA   . GLY   A  1  171 ? 14.973  -3.490  -1.237  1.000 15.231  0 226  GLY   A CA   1 ? 1 
ATOM   2574  C  C    . GLY   A  1  171 ? 14.960  -4.310  0.051   1.000 16.432  0 226  GLY   A C    1 ? 1 
ATOM   2575  O  O    . GLY   A  1  171 ? 15.573  -5.381  0.145   1.000 18.211  0 226  GLY   A O    1 ? 1 
ATOM   2576  H  H    . GLY   A  1  171 ? 13.188  -2.498  -1.404  1.000 16.882  0 226  GLY   A H    1 c 1 
ATOM   2577  H  HA2  . GLY   A  1  171 ? 14.730  -4.082  -1.992  1.000 15.861  0 226  GLY   A HA2  1 c 1 
ATOM   2578  H  HA3  . GLY   A  1  171 ? 15.895  -3.170  -1.403  1.000 16.191  0 226  GLY   A HA3  1 c 1 
ATOM   2579  N  N    . ILE   A  1  172 ? 14.251  -3.821  1.062   1.000 21.010  0 227  ILE   A N    1 ? 1 
ATOM   2580  C  CA   . ILE   A  1  172 ? 14.175  -4.580  2.297   1.000 17.347  0 227  ILE   A CA   1 ? 1 
ATOM   2581  C  C    . ILE   A  1  172 ? 12.888  -5.387  2.202   1.000 13.996  0 227  ILE   A C    1 ? 1 
ATOM   2582  O  O    . ILE   A  1  172 ? 11.857  -4.973  2.718   1.000 12.792  0 227  ILE   A O    1 ? 1 
ATOM   2583  C  CB   . ILE   A  1  172 ? 14.256  -3.666  3.518   1.000 19.913  0 227  ILE   A CB   1 ? 1 
ATOM   2584  C  CG1  . ILE   A  1  172 ? 15.503  -2.717  3.440   1.000 19.794  0 227  ILE   A CG1  1 ? 1 
ATOM   2585  C  CG2  . ILE   A  1  172 ? 14.207  -4.478  4.789   1.000 20.432  0 227  ILE   A CG2  1 ? 1 
ATOM   2586  C  CD1  . ILE   A  1  172 ? 16.842  -3.403  3.264   1.000 18.089  0 227  ILE   A CD1  1 ? 1 
ATOM   2587  H  H    . ILE   A  1  172 ? 13.817  -3.020  0.995   1.000 18.557  0 227  ILE   A H    1 c 1 
ATOM   2588  H  HA   . ILE   A  1  172 ? 14.926  -5.198  2.332   1.000 18.061  0 227  ILE   A HA   1 c 1 
ATOM   2589  H  HB   . ILE   A  1  172 ? 13.456  -3.091  3.508   1.000 19.014  0 227  ILE   A HB   1 c 1 
ATOM   2590  H  HG12 . ILE   A  1  172 ? 15.373  -2.096  2.692   1.000 19.224  0 227  ILE   A HG12 1 c 1 
ATOM   2591  H  HG13 . ILE   A  1  172 ? 15.534  -2.186  4.262   1.000 19.300  0 227  ILE   A HG13 1 c 1 
ATOM   2592  H  HG21 . ILE   A  1  172 ? 14.857  -5.200  4.740   1.000 20.600  0 227  ILE   A HG21 1 c 1 
ATOM   2593  H  HG22 . ILE   A  1  172 ? 13.316  -4.852  4.906   1.000 19.991  0 227  ILE   A HG22 1 c 1 
ATOM   2594  H  HG23 . ILE   A  1  172 ? 14.417  -3.906  5.547   1.000 20.341  0 227  ILE   A HG23 1 c 1 
ATOM   2595  H  HD11 . ILE   A  1  172 ? 16.882  -3.823  2.387   1.000 18.763  0 227  ILE   A HD11 1 c 1 
ATOM   2596  H  HD12 . ILE   A  1  172 ? 16.953  -4.082  3.952   1.000 18.848  0 227  ILE   A HD12 1 c 1 
ATOM   2597  H  HD13 . ILE   A  1  172 ? 17.557  -2.747  3.341   1.000 18.935  0 227  ILE   A HD13 1 c 1 
ATOM   2598  N  N    . VAL   A  1  173 ? 12.982  -6.532  1.517   1.000 17.288  0 228  VAL   A N    1 ? 1 
ATOM   2599  C  CA   . VAL   A  1  173 ? 11.800  -7.293  1.142   1.000 22.975  0 228  VAL   A CA   1 ? 1 
ATOM   2600  C  C    . VAL   A  1  173 ? 11.418  -8.304  2.222   1.000 24.750  0 228  VAL   A C    1 ? 1 
ATOM   2601  O  O    . VAL   A  1  173 ? 10.373  -8.944  2.126   1.000 23.649  0 228  VAL   A O    1 ? 1 
ATOM   2602  C  CB   . VAL   A  1  173 ? 12.018  -7.980  -0.209  1.000 17.110  0 228  VAL   A CB   1 ? 1 
ATOM   2603  C  CG1  . VAL   A  1  173 ? 12.362  -6.951  -1.279  1.000 21.197  0 228  VAL   A CG1  1 ? 1 
ATOM   2604  C  CG2  . VAL   A  1  173 ? 13.097  -9.058  -0.154  1.000 23.460  0 228  VAL   A CG2  1 ? 1 
ATOM   2605  H  H    . VAL   A  1  173 ? 13.806  -6.846  1.277   1.000 17.878  0 228  VAL   A H    1 c 1 
ATOM   2606  H  HA   . VAL   A  1  173 ? 11.060  -6.668  1.042   1.000 20.223  0 228  VAL   A HA   1 c 1 
ATOM   2607  H  HB   . VAL   A  1  173 ? 11.167  -8.414  -0.465  1.000 19.650  0 228  VAL   A HB   1 c 1 
ATOM   2608  H  HG11 . VAL   A  1  173 ? 13.227  -6.552  -1.082  1.000 20.019  0 228  VAL   A HG11 1 c 1 
ATOM   2609  H  HG12 . VAL   A  1  173 ? 11.681  -6.257  -1.292  1.000 19.530  0 228  VAL   A HG12 1 c 1 
ATOM   2610  H  HG13 . VAL   A  1  173 ? 12.398  -7.386  -2.148  1.000 19.958  0 228  VAL   A HG13 1 c 1 
ATOM   2611  H  HG21 . VAL   A  1  173 ? 13.113  -9.542  -0.999  1.000 21.597  0 228  VAL   A HG21 1 c 1 
ATOM   2612  H  HG22 . VAL   A  1  173 ? 12.906  -9.679  0.569   1.000 21.542  0 228  VAL   A HG22 1 c 1 
ATOM   2613  H  HG23 . VAL   A  1  173 ? 13.963  -8.644  -0.006  1.000 21.657  0 228  VAL   A HG23 1 c 1 
ATOM   2614  N  N    . GLY   A  1  174 ? 12.280  -8.468  3.234   1.000 19.075  0 229  GLY   A N    1 ? 1 
ATOM   2615  C  CA   . GLY   A  1  174 ? 11.956  -9.284  4.402   1.000 24.440  0 229  GLY   A CA   1 ? 1 
ATOM   2616  C  C    . GLY   A  1  174 ? 12.927  -9.006  5.553   1.000 30.970  0 229  GLY   A C    1 ? 1 
ATOM   2617  O  O    . GLY   A  1  174 ? 13.968  -8.389  5.337   1.000 22.834  0 229  GLY   A O    1 ? 1 
ATOM   2618  H  H    . GLY   A  1  174 ? 13.102  -8.070  3.194   1.000 21.532  0 229  GLY   A H    1 c 1 
ATOM   2619  H  HA2  . GLY   A  1  174 ? 11.032  -9.083  4.693   1.000 23.887  0 229  GLY   A HA2  1 c 1 
ATOM   2620  H  HA3  . GLY   A  1  174 ? 12.004  -10.241 4.152   1.000 24.367  0 229  GLY   A HA3  1 c 1 
ATOM   2621  N  N    . ASN   A  1  175 ? 12.612  -9.502  6.753   1.000 26.584  0 230  ASN   A N    1 ? 1 
ATOM   2622  C  CA   . ASN   A  1  175 ? 13.573  -9.459  7.850   1.000 29.380  0 230  ASN   A CA   1 ? 1 
ATOM   2623  C  C    . ASN   A  1  175 ? 14.737  -10.392 7.520   1.000 27.614  0 230  ASN   A C    1 ? 1 
ATOM   2624  O  O    . ASN   A  1  175 ? 15.843  -10.207 8.028   1.000 36.341  0 230  ASN   A O    1 ? 1 
ATOM   2625  C  CB   . ASN   A  1  175 ? 12.933  -9.861  9.188   1.000 25.850  0 230  ASN   A CB   1 ? 1 
ATOM   2626  C  CG   . ASN   A  1  175 ? 12.064  -8.829  9.793   1.000 25.069  0 230  ASN   A CG   1 ? 1 
ATOM   2627  O  OD1  . ASN   A  1  175 ? 12.145  -7.645  9.481   1.000 26.529  0 230  ASN   A OD1  1 ? 1 
ATOM   2628  N  ND2  . ASN   A  1  175 ? 11.195  -9.269  10.696  1.000 23.587  0 230  ASN   A ND2  1 ? 1 
ATOM   2629  H  H    . ASN   A  1  175 ? 11.782  -9.855  6.899   1.000 27.929  0 230  ASN   A H    1 c 1 
ATOM   2630  H  HA   . ASN   A  1  175 ? 13.916  -8.539  7.936   1.000 27.673  0 230  ASN   A HA   1 c 1 
ATOM   2631  H  HB2  . ASN   A  1  175 ? 12.402  -10.671 9.046   1.000 26.567  0 230  ASN   A HB2  1 c 1 
ATOM   2632  H  HB3  . ASN   A  1  175 ? 13.644  -10.082 9.819   1.000 27.154  0 230  ASN   A HB3  1 c 1 
ATOM   2633  H  HD21 . ASN   A  1  175 ? 11.264  -10.092 11.014  1.000 24.364  0 230  ASN   A HD21 1 c 1 
ATOM   2634  H  HD22 . ASN   A  1  175 ? 10.548  -8.739  10.982  1.000 24.000  0 230  ASN   A HD22 1 c 1 
ATOM   2635  N  N    . SER   A  1  176 ? 14.457  -11.413 6.692   1.000 27.133  0 231  SER   A N    1 ? 1 
ATOM   2636  C  CA   . SER   A  1  176 ? 15.477  -12.272 6.125   1.000 25.002  0 231  SER   A CA   1 ? 1 
ATOM   2637  C  C    . SER   A  1  176 ? 15.408  -12.265 4.602   1.000 25.497  0 231  SER   A C    1 ? 1 
ATOM   2638  O  O    . SER   A  1  176 ? 14.318  -12.356 4.045   1.000 24.978  0 231  SER   A O    1 ? 1 
ATOM   2639  C  CB   . SER   A  1  176 ? 15.322  -13.705 6.633   1.000 31.832  0 231  SER   A CB   1 ? 1 
ATOM   2640  O  OG   . SER   A  1  176 ? 15.744  -13.772 7.982   1.000 49.474  0 231  SER   A OG   1 ? 1 
ATOM   2641  H  H    . SER   A  1  176 ? 13.584  -11.590 6.488   1.000 26.432  0 231  SER   A H    1 c 1 
ATOM   2642  H  HA   . SER   A  1  176 ? 16.365  -11.931 6.403   1.000 26.980  0 231  SER   A HA   1 c 1 
ATOM   2643  H  HB2  . SER   A  1  176 ? 14.380  -13.982 6.564   1.000 33.100  0 231  SER   A HB2  1 c 1 
ATOM   2644  H  HB3  . SER   A  1  176 ? 15.866  -14.314 6.083   1.000 33.651  0 231  SER   A HB3  1 c 1 
ATOM   2645  H  HG   . SER   A  1  176 ? 15.080  -13.615 8.485   0.000 40.630  0 231  SER   A HG   1 c 1 
ATOM   2646  N  N    . MET   A  1  177 ? 16.581  -12.256 3.954   1.000 27.417  0 232  MET   A N    1 ? 1 
ATOM   2647  C  CA   . MET   A  1  177 ? 16.691  -12.056 2.517   1.000 29.895  0 232  MET   A CA   1 ? 1 
ATOM   2648  C  C    . MET   A  1  177 ? 17.968  -12.692 2.009   1.000 31.648  0 232  MET   A C    1 ? 1 
ATOM   2649  O  O    . MET   A  1  177 ? 18.986  -12.642 2.709   1.000 28.143  0 232  MET   A O    1 ? 1 
ATOM   2650  C  CB   . MET   A  1  177 ? 16.860  -10.570 2.126   1.000 30.120  0 232  MET   A CB   1 ? 1 
ATOM   2651  C  CG   . MET   A  1  177 ? 15.767  -9.711  2.505   1.000 24.130  0 232  MET   A CG   1 ? 1 
ATOM   2652  S  SD   . MET   A  1  177 ? 15.946  -8.064  1.835   1.000 26.249  0 232  MET   A SD   1 ? 1 
ATOM   2653  C  CE   . MET   A  1  177 ? 17.178  -7.298  2.931   1.000 30.601  0 232  MET   A CE   1 ? 1 
ATOM   2654  H  H    . MET   A  1  177 ? 17.349  -12.383 4.434   1.000 27.945  0 232  MET   A H    1 c 1 
ATOM   2655  H  HA   . MET   A  1  177 ? 15.913  -12.452 2.064   1.000 29.275  0 232  MET   A HA   1 c 1 
ATOM   2656  H  HB2  . MET   A  1  177 ? 17.679  -10.232 2.536   1.000 28.824  0 232  MET   A HB2  1 c 1 
ATOM   2657  H  HB3  . MET   A  1  177 ? 16.975  -10.517 1.156   1.000 28.606  0 232  MET   A HB3  1 c 1 
ATOM   2658  H  HG2  . MET   A  1  177 ? 14.924  -10.096 2.185   1.000 25.568  0 232  MET   A HG2  1 c 1 
ATOM   2659  H  HG3  . MET   A  1  177 ? 15.723  -9.653  3.484   1.000 25.786  0 232  MET   A HG3  1 c 1 
ATOM   2660  H  HE1  . MET   A  1  177 ? 16.870  -7.347  3.844   1.000 29.410  0 232  MET   A HE1  1 c 1 
ATOM   2661  H  HE2  . MET   A  1  177 ? 18.017  -7.768  2.847   1.000 29.925  0 232  MET   A HE2  1 c 1 
ATOM   2662  H  HE3  . MET   A  1  177 ? 17.300  -6.374  2.680   1.000 29.409  0 232  MET   A HE3  1 c 1 
ATOM   2663  N  N    . TYR   A  1  178 ? 17.901  -13.194 0.765   1.000 22.748  0 233  TYR   A N    1 ? 1 
ATOM   2664  C  CA   . TYR   A  1  178 ? 19.082  -13.571 0.020   1.000 22.974  0 233  TYR   A CA   1 ? 1 
ATOM   2665  C  C    . TYR   A  1  178 ? 19.151  -12.756 -1.266  1.000 24.628  0 233  TYR   A C    1 ? 1 
ATOM   2666  O  O    . TYR   A  1  178 ? 18.136  -12.582 -1.938  1.000 22.427  0 233  TYR   A O    1 ? 1 
ATOM   2667  C  CB   . TYR   A  1  178 ? 19.107  -15.071 -0.294  1.000 27.389  0 233  TYR   A CB   1 ? 1 
ATOM   2668  C  CG   . TYR   A  1  178 ? 20.286  -15.466 -1.159  1.000 26.327  0 233  TYR   A CG   1 ? 1 
ATOM   2669  C  CD1  . TYR   A  1  178 ? 21.564  -15.579 -0.627  1.000 24.263  0 233  TYR   A CD1  1 ? 1 
ATOM   2670  C  CD2  . TYR   A  1  178 ? 20.122  -15.707 -2.520  1.000 29.686  0 233  TYR   A CD2  1 ? 1 
ATOM   2671  C  CE1  . TYR   A  1  178 ? 22.646  -15.911 -1.435  1.000 30.450  0 233  TYR   A CE1  1 ? 1 
ATOM   2672  C  CE2  . TYR   A  1  178 ? 21.189  -16.048 -3.327  1.000 26.532  0 233  TYR   A CE2  1 ? 1 
ATOM   2673  C  CZ   . TYR   A  1  178 ? 22.446  -16.152 -2.789  1.000 33.057  0 233  TYR   A CZ   1 ? 1 
ATOM   2674  O  OH   . TYR   A  1  178 ? 23.452  -16.479 -3.665  1.000 32.633  0 233  TYR   A OH   1 ? 1 
ATOM   2675  H  H    . TYR   A  1  178 ? 17.083  -13.304 0.371   1.000 24.183  0 233  TYR   A H    1 c 1 
ATOM   2676  H  HA   . TYR   A  1  178 ? 19.880  -13.355 0.566   1.000 24.366  0 233  TYR   A HA   1 c 1 
ATOM   2677  H  HB2  . TYR   A  1  178 ? 19.144  -15.569 0.549   1.000 26.171  0 233  TYR   A HB2  1 c 1 
ATOM   2678  H  HB3  . TYR   A  1  178 ? 18.275  -15.311 -0.753  1.000 25.739  0 233  TYR   A HB3  1 c 1 
ATOM   2679  H  HD1  . TYR   A  1  178 ? 21.704  -15.410 0.291   1.000 26.073  0 233  TYR   A HD1  1 c 1 
ATOM   2680  H  HD2  . TYR   A  1  178 ? 19.262  -15.632 -2.901  1.000 27.501  0 233  TYR   A HD2  1 c 1 
ATOM   2681  H  HE1  . TYR   A  1  178 ? 23.510  -15.985 -1.065  1.000 29.962  0 233  TYR   A HE1  1 c 1 
ATOM   2682  H  HE2  . TYR   A  1  178 ? 21.056  -16.203 -4.247  1.000 28.680  0 233  TYR   A HE2  1 c 1 
ATOM   2683  H  HH   . TYR   A  1  178 ? 24.265  -16.539 -3.388  0.000 17.850  0 233  TYR   A HH   1 c 1 
ATOM   2684  N  N    . ASP   A  1  179 ? 20.360  -12.263 -1.581  1.000 21.971  0 234  ASP   A N    1 ? 1 
ATOM   2685  C  CA   . ASP   A  1  179 ? 20.590  -11.437 -2.760  1.000 23.323  0 234  ASP   A CA   1 ? 1 
ATOM   2686  C  C    . ASP   A  1  179 ? 21.565  -12.195 -3.646  1.000 21.557  0 234  ASP   A C    1 ? 1 
ATOM   2687  O  O    . ASP   A  1  179 ? 22.708  -12.414 -3.247  1.000 23.919  0 234  ASP   A O    1 ? 1 
ATOM   2688  C  CB   . ASP   A  1  179 ? 21.130  -10.021 -2.412  1.000 26.606  0 234  ASP   A CB   1 ? 1 
ATOM   2689  C  CG   . ASP   A  1  179 ? 21.217  -9.080  -3.609  1.000 23.389  0 234  ASP   A CG   1 ? 1 
ATOM   2690  O  OD1  . ASP   A  1  179 ? 21.762  -9.488  -4.625  1.000 30.853  0 234  ASP   A OD1  1 ? 1 
ATOM   2691  O  OD2  . ASP   A  1  179 ? 20.727  -7.916  -3.503  1.000 23.564  0 234  ASP   A OD2  1 ? 1 
ATOM   2692  H  H    . ASP   A  1  179 ? 21.071  -12.453 -1.039  1.000 23.351  0 234  ASP   A H    1 c 1 
ATOM   2693  H  HA   . ASP   A  1  179 ? 19.737  -11.331 -3.240  1.000 22.674  0 234  ASP   A HA   1 c 1 
ATOM   2694  H  HB2  . ASP   A  1  179 ? 20.544  -9.614  -1.744  1.000 24.566  0 234  ASP   A HB2  1 c 1 
ATOM   2695  H  HB3  . ASP   A  1  179 ? 22.024  -10.108 -2.022  1.000 25.461  0 234  ASP   A HB3  1 c 1 
ATOM   2696  N  N    . PRO   A  1  180 ? 21.143  -12.660 -4.846  1.000 21.789  0 235  PRO   A N    1 ? 1 
ATOM   2697  C  CA   . PRO   A  1  180 ? 22.023  -13.471 -5.682  1.000 33.083  0 235  PRO   A CA   1 ? 1 
ATOM   2698  C  C    . PRO   A  1  180 ? 23.175  -12.654 -6.275  1.000 30.584  0 235  PRO   A C    1 ? 1 
ATOM   2699  O  O    . PRO   A  1  180 ? 24.221  -13.207 -6.536  1.000 28.398  0 235  PRO   A O    1 ? 1 
ATOM   2700  C  CB   . PRO   A  1  180 ? 21.073  -14.078 -6.727  1.000 31.165  0 235  PRO   A CB   1 ? 1 
ATOM   2701  C  CG   . PRO   A  1  180 ? 19.922  -13.167 -6.815  1.000 25.780  0 235  PRO   A CG   1 ? 1 
ATOM   2702  C  CD   . PRO   A  1  180 ? 19.820  -12.428 -5.455  1.000 24.138  0 235  PRO   A CD   1 ? 1 
ATOM   2703  H  HA   . PRO   A  1  180 ? 22.395  -14.204 -5.131  1.000 29.834  0 235  PRO   A HA   1 c 1 
ATOM   2704  H  HB2  . PRO   A  1  180 ? 21.520  -14.153 -7.597  1.000 30.715  0 235  PRO   A HB2  1 c 1 
ATOM   2705  H  HB3  . PRO   A  1  180 ? 20.782  -14.973 -6.449  1.000 30.411  0 235  PRO   A HB3  1 c 1 
ATOM   2706  H  HG2  . PRO   A  1  180 ? 20.052  -12.524 -7.542  1.000 26.457  0 235  PRO   A HG2  1 c 1 
ATOM   2707  H  HG3  . PRO   A  1  180 ? 19.101  -13.670 -6.991  1.000 26.227  0 235  PRO   A HG3  1 c 1 
ATOM   2708  H  HD2  . PRO   A  1  180 ? 19.656  -11.475 -5.583  1.000 23.293  0 235  PRO   A HD2  1 c 1 
ATOM   2709  H  HD3  . PRO   A  1  180 ? 19.109  -12.803 -4.904  1.000 23.298  0 235  PRO   A HD3  1 c 1 
ATOM   2710  N  N    . VAL   A  1  181 ? 22.996  -11.338 -6.445  1.000 31.511  0 236  VAL   A N    1 ? 1 
ATOM   2711  C  CA   . VAL   A  1  181 ? 24.055  -10.484 -6.967  1.000 27.865  0 236  VAL   A CA   1 ? 1 
ATOM   2712  C  C    . VAL   A  1  181 ? 25.168  -10.272 -5.938  1.000 26.753  0 236  VAL   A C    1 ? 1 
ATOM   2713  O  O    . VAL   A  1  181 ? 26.341  -10.292 -6.284  1.000 28.848  0 236  VAL   A O    1 ? 1 
ATOM   2714  C  CB   . VAL   A  1  181 ? 23.444  -9.170  -7.477  1.000 29.217  0 236  VAL   A CB   1 ? 1 
ATOM   2715  C  CG1  . VAL   A  1  181 ? 24.484  -8.032  -7.599  1.000 33.093  0 236  VAL   A CG1  1 ? 1 
ATOM   2716  C  CG2  . VAL   A  1  181 ? 22.716  -9.390  -8.795  1.000 27.727  0 236  VAL   A CG2  1 ? 1 
ATOM   2717  H  H    . VAL   A  1  181 ? 22.189  -10.963 -6.237  1.000 29.469  0 236  VAL   A H    1 c 1 
ATOM   2718  H  HA   . VAL   A  1  181 ? 24.448  -10.941 -7.732  1.000 29.083  0 236  VAL   A HA   1 c 1 
ATOM   2719  H  HB   . VAL   A  1  181 ? 22.772  -8.883  -6.813  1.000 28.647  0 236  VAL   A HB   1 c 1 
ATOM   2720  H  HG11 . VAL   A  1  181 ? 25.276  -8.361  -8.059  1.000 32.594  0 236  VAL   A HG11 1 c 1 
ATOM   2721  H  HG12 . VAL   A  1  181 ? 24.731  -7.718  -6.711  1.000 31.907  0 236  VAL   A HG12 1 c 1 
ATOM   2722  H  HG13 . VAL   A  1  181 ? 24.100  -7.295  -8.105  1.000 31.738  0 236  VAL   A HG13 1 c 1 
ATOM   2723  H  HG21 . VAL   A  1  181 ? 22.285  -8.562  -9.070  1.000 27.775  0 236  VAL   A HG21 1 c 1 
ATOM   2724  H  HG22 . VAL   A  1  181 ? 22.043  -10.083 -8.683  1.000 27.880  0 236  VAL   A HG22 1 c 1 
ATOM   2725  H  HG23 . VAL   A  1  181 ? 23.353  -9.665  -9.476  1.000 28.671  0 236  VAL   A HG23 1 c 1 
ATOM   2726  N  N    . PHE   A  1  182 ? 24.808  -10.078 -4.668  1.000 29.548  0 237  PHE   A N    1 ? 1 
ATOM   2727  C  CA   . PHE   A  1  182 ? 25.801  -10.049 -3.600  1.000 32.735  0 237  PHE   A CA   1 ? 1 
ATOM   2728  C  C    . PHE   A  1  182 ? 26.302  -11.439 -3.197  1.000 38.990  0 237  PHE   A C    1 ? 1 
ATOM   2729  O  O    . PHE   A  1  182 ? 27.411  -11.587 -2.677  1.000 33.350  0 237  PHE   A O    1 ? 1 
ATOM   2730  C  CB   . PHE   A  1  182 ? 25.226  -9.404  -2.336  1.000 30.021  0 237  PHE   A CB   1 ? 1 
ATOM   2731  C  CG   . PHE   A  1  182 ? 24.664  -8.007  -2.449  1.000 31.057  0 237  PHE   A CG   1 ? 1 
ATOM   2732  C  CD1  . PHE   A  1  182 ? 24.960  -7.203  -3.538  1.000 25.175  0 237  PHE   A CD1  1 ? 1 
ATOM   2733  C  CD2  . PHE   A  1  182 ? 23.815  -7.502  -1.468  1.000 27.273  0 237  PHE   A CD2  1 ? 1 
ATOM   2734  C  CE1  . PHE   A  1  182 ? 24.438  -5.904  -3.625  1.000 23.701  0 237  PHE   A CE1  1 ? 1 
ATOM   2735  C  CE2  . PHE   A  1  182 ? 23.316  -6.200  -1.552  1.000 23.512  0 237  PHE   A CE2  1 ? 1 
ATOM   2736  C  CZ   . PHE   A  1  182 ? 23.630  -5.415  -2.635  1.000 20.186  0 237  PHE   A CZ   1 ? 1 
ATOM   2737  H  H    . PHE   A  1  182 ? 23.926  -9.957  -4.459  1.000 28.717  0 237  PHE   A H    1 c 1 
ATOM   2738  H  HA   . PHE   A  1  182 ? 26.578  -9.513  -3.901  1.000 32.929  0 237  PHE   A HA   1 c 1 
ATOM   2739  H  HB2  . PHE   A  1  182 ? 24.516  -9.990  -2.000  1.000 30.571  0 237  PHE   A HB2  1 c 1 
ATOM   2740  H  HB3  . PHE   A  1  182 ? 25.934  -9.392  -1.659  1.000 31.210  0 237  PHE   A HB3  1 c 1 
ATOM   2741  H  HD1  . PHE   A  1  182 ? 25.529  -7.524  -4.218  1.000 26.667  0 237  PHE   A HD1  1 c 1 
ATOM   2742  H  HD2  . PHE   A  1  182 ? 23.611  -8.032  -0.714  1.000 26.917  0 237  PHE   A HD2  1 c 1 
ATOM   2743  H  HE1  . PHE   A  1  182 ? 24.655  -5.361  -4.366  1.000 23.356  0 237  PHE   A HE1  1 c 1 
ATOM   2744  H  HE2  . PHE   A  1  182 ? 22.746  -5.869  -0.876  1.000 22.837  0 237  PHE   A HE2  1 c 1 
ATOM   2745  H  HZ   . PHE   A  1  182 ? 23.274  -4.544  -2.705  1.000 21.381  0 237  PHE   A HZ   1 c 1 
ATOM   2746  N  N    . ASP   A  1  183 ? 25.475  -12.460 -3.446  1.000 40.779  0 238  ASP   A N    1 ? 1 
ATOM   2747  C  CA   . ASP   A  1  183 ? 25.670  -13.796 -2.900  1.000 37.096  0 238  ASP   A CA   1 ? 1 
ATOM   2748  C  C    . ASP   A  1  183 ? 25.878  -13.745 -1.385  1.000 35.268  0 238  ASP   A C    1 ? 1 
ATOM   2749  O  O    . ASP   A  1  183 ? 26.884  -14.202 -0.845  1.000 37.361  0 238  ASP   A O    1 ? 1 
ATOM   2750  C  CB   . ASP   A  1  183 ? 26.825  -14.517 -3.603  1.000 40.138  0 238  ASP   A CB   1 ? 1 
ATOM   2751  C  CG   . ASP   A  1  183 ? 26.806  -16.019 -3.366  1.000 41.055  0 238  ASP   A CG   1 ? 1 
ATOM   2752  O  OD1  . ASP   A  1  183 ? 25.770  -16.544 -2.885  1.000 36.257  0 238  ASP   A OD1  1 ? 1 
ATOM   2753  O  OD2  . ASP   A  1  183 ? 27.797  -16.649 -3.636  1.000 37.927  0 238  ASP   A OD2  1 ? 1 
ATOM   2754  H  H    . ASP   A  1  183 ? 24.747  -12.316 -3.979  1.000 38.614  0 238  ASP   A H    1 c 1 
ATOM   2755  H  HA   . ASP   A  1  183 ? 24.847  -14.308 -3.075  1.000 37.499  0 238  ASP   A HA   1 c 1 
ATOM   2756  H  HB2  . ASP   A  1  183 ? 26.767  -14.354 -4.566  1.000 39.774  0 238  ASP   A HB2  1 c 1 
ATOM   2757  H  HB3  . ASP   A  1  183 ? 27.678  -14.161 -3.282  1.000 40.111  0 238  ASP   A HB3  1 c 1 
ATOM   2758  N  N    . ALA   A  1  184 ? 24.876  -13.197 -0.706  1.000 29.822  0 239  ALA   A N    1 ? 1 
ATOM   2759  C  CA   . ALA   A  1  184 ? 24.938  -12.912 0.706   1.000 25.475  0 239  ALA   A CA   1 ? 1 
ATOM   2760  C  C    . ALA   A  1  184 ? 23.519  -12.899 1.250   1.000 24.761  0 239  ALA   A C    1 ? 1 
ATOM   2761  O  O    . ALA   A  1  184 ? 22.564  -12.656 0.526   1.000 30.062  0 239  ALA   A O    1 ? 1 
ATOM   2762  C  CB   . ALA   A  1  184 ? 25.614  -11.555 0.933   1.000 33.729  0 239  ALA   A CB   1 ? 1 
ATOM   2763  H  H    . ALA   A  1  184 ? 24.108  -12.988 -1.157  1.000 29.246  0 239  ALA   A H    1 c 1 
ATOM   2764  H  HA   . ALA   A  1  184 ? 25.454  -13.619 1.160   1.000 28.077  0 239  ALA   A HA   1 c 1 
ATOM   2765  H  HB1  . ALA   A  1  184 ? 25.656  -11.368 1.886   1.000 30.789  0 239  ALA   A HB1  1 c 1 
ATOM   2766  H  HB2  . ALA   A  1  184 ? 26.514  -11.574 0.567   1.000 31.400  0 239  ALA   A HB2  1 c 1 
ATOM   2767  H  HB3  . ALA   A  1  184 ? 25.101  -10.858 0.490   1.000 30.361  0 239  ALA   A HB3  1 c 1 
ATOM   2768  N  N    . SER   A  1  185 ? 23.406  -13.137 2.545   1.000 24.036  0 240  SER   A N    1 ? 1 
ATOM   2769  C  CA   . SER   A  1  185 ? 22.131  -13.131 3.222   1.000 26.671  0 240  SER   A CA   1 ? 1 
ATOM   2770  C  C    . SER   A  1  185 ? 22.083  -11.976 4.206   1.000 28.375  0 240  SER   A C    1 ? 1 
ATOM   2771  O  O    . SER   A  1  185 ? 23.099  -11.558 4.740   1.000 35.210  0 240  SER   A O    1 ? 1 
ATOM   2772  C  CB   . SER   A  1  185 ? 21.904  -14.437 3.961   1.000 27.537  0 240  SER   A CB   1 ? 1 
ATOM   2773  O  OG   . SER   A  1  185 ? 21.859  -15.501 3.044   1.000 34.059  0 240  SER   A OG   1 ? 1 
ATOM   2774  H  H    . SER   A  1  185 ? 24.159  -13.310 3.033   1.000 25.389  0 240  SER   A H    1 c 1 
ATOM   2775  H  HA   . SER   A  1  185 ? 21.412  -13.011 2.548   1.000 26.042  0 240  SER   A HA   1 c 1 
ATOM   2776  H  HB2  . SER   A  1  185 ? 22.634  -14.583 4.605   1.000 29.170  0 240  SER   A HB2  1 c 1 
ATOM   2777  H  HB3  . SER   A  1  185 ? 21.056  -14.391 4.459   1.000 28.295  0 240  SER   A HB3  1 c 1 
ATOM   2778  H  HG   . SER   A  1  185 ? 22.639  -15.813 2.936   0.000 20.400  0 240  SER   A HG   1 c 1 
ATOM   2779  N  N    . PHE   A  1  186 ? 20.863  -11.497 4.400   1.000 28.768  0 241  PHE   A N    1 ? 1 
ATOM   2780  C  CA   . PHE   A  1  186 ? 20.499  -10.479 5.349   1.000 32.576  0 241  PHE   A CA   1 ? 1 
ATOM   2781  C  C    . PHE   A  1  186 ? 19.599  -11.129 6.400   1.000 28.855  0 241  PHE   A C    1 ? 1 
ATOM   2782  O  O    . PHE   A  1  186 ? 18.659  -11.833 6.056   1.000 25.975  0 241  PHE   A O    1 ? 1 
ATOM   2783  C  CB   . PHE   A  1  186 ? 19.787  -9.399  4.558   1.000 26.567  0 241  PHE   A CB   1 ? 1 
ATOM   2784  C  CG   . PHE   A  1  186 ? 19.258  -8.237  5.348   1.000 25.599  0 241  PHE   A CG   1 ? 1 
ATOM   2785  C  CD1  . PHE   A  1  186 ? 18.157  -8.377  6.166   1.000 25.542  0 241  PHE   A CD1  1 ? 1 
ATOM   2786  C  CD2  . PHE   A  1  186 ? 19.840  -6.999  5.249   1.000 21.817  0 241  PHE   A CD2  1 ? 1 
ATOM   2787  C  CE1  . PHE   A  1  186 ? 17.667  -7.310  6.863   1.000 22.395  0 241  PHE   A CE1  1 ? 1 
ATOM   2788  C  CE2  . PHE   A  1  186 ? 19.332  -5.934  5.931   1.000 21.105  0 241  PHE   A CE2  1 ? 1 
ATOM   2789  C  CZ   . PHE   A  1  186 ? 18.237  -6.084  6.720   1.000 27.233  0 241  PHE   A CZ   1 ? 1 
ATOM   2790  H  H    . PHE   A  1  186 ? 20.191  -11.847 3.888   1.000 29.043  0 241  PHE   A H    1 c 1 
ATOM   2791  H  HA   . PHE   A  1  186 ? 21.311  -10.107 5.778   1.000 30.352  0 241  PHE   A HA   1 c 1 
ATOM   2792  H  HB2  . PHE   A  1  186 ? 20.408  -9.059  3.882   1.000 27.594  0 241  PHE   A HB2  1 c 1 
ATOM   2793  H  HB3  . PHE   A  1  186 ? 19.039  -9.816  4.086   1.000 27.285  0 241  PHE   A HB3  1 c 1 
ATOM   2794  H  HD1  . PHE   A  1  186 ? 17.737  -9.218  6.243   1.000 24.764  0 241  PHE   A HD1  1 c 1 
ATOM   2795  H  HD2  . PHE   A  1  186 ? 20.583  -6.879  4.684   1.000 22.914  0 241  PHE   A HD2  1 c 1 
ATOM   2796  H  HE1  . PHE   A  1  186 ? 16.907  -7.416  7.413   1.000 23.805  0 241  PHE   A HE1  1 c 1 
ATOM   2797  H  HE2  . PHE   A  1  186 ? 19.743  -5.088  5.854   1.000 22.602  0 241  PHE   A HE2  1 c 1 
ATOM   2798  H  HZ   . PHE   A  1  186 ? 17.913  -5.352  7.216   1.000 24.262  0 241  PHE   A HZ   1 c 1 
ATOM   2799  N  N    . HIS   A  1  187 ? 19.898  -10.865 7.672   1.000 31.228  0 242  HIS   A N    1 ? 1 
ATOM   2800  C  CA   . HIS   A  1  187 ? 19.225  -11.440 8.828   1.000 31.840  0 242  HIS   A CA   1 ? 1 
ATOM   2801  C  C    . HIS   A  1  187 ? 19.149  -10.370 9.918   1.000 34.411  0 242  HIS   A C    1 ? 1 
ATOM   2802  O  O    . HIS   A  1  187 ? 20.047  -9.538  10.019  1.000 34.761  0 242  HIS   A O    1 ? 1 
ATOM   2803  C  CB   . HIS   A  1  187 ? 19.990  -12.661 9.337   1.000 29.922  0 242  HIS   A CB   1 ? 1 
ATOM   2804  C  CG   . HIS   A  1  187 ? 19.881  -13.862 8.455   1.000 34.263  0 242  HIS   A CG   1 ? 1 
ATOM   2805  N  ND1  . HIS   A  1  187 ? 18.634  -14.321 8.000   1.000 52.269  0 242  HIS   A ND1  1 ? 1 
ATOM   2806  C  CD2  . HIS   A  1  187 ? 20.850  -14.634 7.919   1.000 37.030  0 242  HIS   A CD2  1 ? 1 
ATOM   2807  C  CE1  . HIS   A  1  187 ? 18.885  -15.382 7.230   1.000 39.134  0 242  HIS   A CE1  1 ? 1 
ATOM   2808  N  NE2  . HIS   A  1  187 ? 20.205  -15.615 7.154   1.000 50.759  0 242  HIS   A NE2  1 ? 1 
ATOM   2809  H  H    . HIS   A  1  187 ? 20.579  -10.276 7.832   1.000 31.031  0 242  HIS   A H    1 c 1 
ATOM   2810  H  HA   . HIS   A  1  187 ? 18.314  -11.712 8.567   1.000 31.383  0 242  HIS   A HA   1 c 1 
ATOM   2811  H  HB2  . HIS   A  1  187 ? 20.935  -12.423 9.428   1.000 31.801  0 242  HIS   A HB2  1 c 1 
ATOM   2812  H  HB3  . HIS   A  1  187 ? 19.652  -12.894 10.226  1.000 31.476  0 242  HIS   A HB3  1 c 1 
ATOM   2813  H  HD1  . HIS   A  1  187 ? 17.848  -13.953 8.156   0.000 38.060  0 242  HIS   A HD1  1 c 1 
ATOM   2814  H  HD2  . HIS   A  1  187 ? 21.781  -14.546 8.061   1.000 39.511  0 242  HIS   A HD2  1 c 1 
ATOM   2815  H  HE1  . HIS   A  1  187 ? 18.225  -15.898 6.798   1.000 43.960  0 242  HIS   A HE1  1 c 1 
ATOM   2816  H  HE2  . HIS   A  1  187 ? 20.599  -16.278 6.701   0.000 35.470  0 242  HIS   A HE2  1 c 1 
ATOM   2817  N  N    . LEU   A  1  188 ? 18.068  -10.370 10.714  1.000 35.497  0 243  LEU   A N    1 ? 1 
ATOM   2818  C  CA   . LEU   A  1  188 ? 17.893  -9.373  11.760  1.000 51.618  0 243  LEU   A CA   1 ? 1 
ATOM   2819  C  C    . LEU   A  1  188 ? 19.050  -9.389  12.761  1.000 69.905  0 243  LEU   A C    1 ? 1 
ATOM   2820  O  O    . LEU   A  1  188 ? 19.370  -8.355  13.345  1.000 56.361  0 243  LEU   A O    1 ? 1 
ATOM   2821  C  CB   . LEU   A  1  188 ? 16.573  -9.581  12.520  1.000 46.041  0 243  LEU   A CB   1 ? 1 
ATOM   2822  C  CG   . LEU   A  1  188 ? 15.295  -9.188  11.811  1.000 59.887  0 243  LEU   A CG   1 ? 1 
ATOM   2823  C  CD1  . LEU   A  1  188 ? 14.214  -8.903  12.811  1.000 62.713  0 243  LEU   A CD1  1 ? 1 
ATOM   2824  C  CD2  . LEU   A  1  188 ? 15.479  -7.971  10.866  1.000 56.248  0 243  LEU   A CD2  1 ? 1 
ATOM   2825  H  H    . LEU   A  1  188 ? 17.425  -11.010 10.601  1.000 38.072  0 243  LEU   A H    1 c 1 
ATOM   2826  H  HA   . LEU   A  1  188 ? 17.881  -8.489  11.330  1.000 49.222  0 243  LEU   A HA   1 c 1 
ATOM   2827  H  HB2  . LEU   A  1  188 ? 16.509  -10.527 12.758  1.000 50.416  0 243  LEU   A HB2  1 c 1 
ATOM   2828  H  HB3  . LEU   A  1  188 ? 16.625  -9.076  13.356  1.000 50.459  0 243  LEU   A HB3  1 c 1 
ATOM   2829  H  HG   . LEU   A  1  188 ? 15.007  -9.958  11.265  1.000 56.252  0 243  LEU   A HG   1 c 1 
ATOM   2830  H  HD11 . LEU   A  1  188 ? 13.351  -8.890  12.362  1.000 61.072  0 243  LEU   A HD11 1 c 1 
ATOM   2831  H  HD12 . LEU   A  1  188 ? 14.376  -8.038  13.227  1.000 61.622  0 243  LEU   A HD12 1 c 1 
ATOM   2832  H  HD13 . LEU   A  1  188 ? 14.213  -9.595  13.495  1.000 61.882  0 243  LEU   A HD13 1 c 1 
ATOM   2833  H  HD21 . LEU   A  1  188 ? 15.974  -8.245  10.074  1.000 57.030  0 243  LEU   A HD21 1 c 1 
ATOM   2834  H  HD22 . LEU   A  1  188 ? 15.969  -7.269  11.329  1.000 57.030  0 243  LEU   A HD22 1 c 1 
ATOM   2835  H  HD23 . LEU   A  1  188 ? 14.606  -7.633  10.599  1.000 56.226  0 243  LEU   A HD23 1 c 1 
ATOM   2836  N  N    . ARG   A  1  189 ? 19.664  -10.567 12.942  1.000 54.134  0 244  ARG   A N    1 ? 1 
ATOM   2837  C  CA   . ARG   A  1  189 ? 20.785  -10.733 13.851  1.000 72.865  0 244  ARG   A CA   1 ? 1 
ATOM   2838  C  C    . ARG   A  1  189 ? 22.069  -10.897 13.040  1.000 75.898  0 244  ARG   A C    1 ? 1 
ATOM   2839  O  O    . ARG   A  1  189 ? 22.053  -11.484 11.955  1.000 65.104  0 244  ARG   A O    1 ? 1 
ATOM   2840  C  CB   . ARG   A  1  189 ? 20.504  -11.923 14.798  1.000 80.458  0 244  ARG   A CB   1 ? 1 
ATOM   2841  C  CG   . ARG   A  1  189 ? 19.134  -11.820 15.518  1.000 86.930  0 244  ARG   A CG   1 ? 1 
ATOM   2842  C  CD   . ARG   A  1  189 ? 19.024  -10.579 16.415  1.000 97.264  0 244  ARG   A CD   1 ? 1 
ATOM   2843  N  NE   . ARG   A  1  189 ? 17.664  -10.051 16.499  1.000 97.805  0 244  ARG   A NE   1 ? 1 
ATOM   2844  C  CZ   . ARG   A  1  189 ? 17.337  -8.878  17.043  1.000 96.195  0 244  ARG   A CZ   1 ? 1 
ATOM   2845  N  NH1  . ARG   A  1  189 ? 18.248  -8.087  17.590  1.000 89.741  0 244  ARG   A NH1  1 ? 1 
ATOM   2846  N  NH2  . ARG   A  1  189 ? 16.066  -8.484  17.026  1.000 62.462  0 244  ARG   A NH2  1 ? 1 
ATOM   2847  H  H    . ARG   A  1  189 ? 19.359  -11.302 12.493  1.000 60.831  0 244  ARG   A H    1 c 1 
ATOM   2848  H  HA   . ARG   A  1  189 ? 20.867  -9.916  14.392  1.000 70.437  0 244  ARG   A HA   1 c 1 
ATOM   2849  H  HB2  . ARG   A  1  189 ? 20.530  -12.753 14.278  1.000 80.375  0 244  ARG   A HB2  1 c 1 
ATOM   2850  H  HB3  . ARG   A  1  189 ? 21.215  -11.965 15.471  1.000 80.721  0 244  ARG   A HB3  1 c 1 
ATOM   2851  H  HG2  . ARG   A  1  189 ? 18.418  -11.794 14.848  1.000 86.901  0 244  ARG   A HG2  1 c 1 
ATOM   2852  H  HG3  . ARG   A  1  189 ? 18.999  -12.621 16.068  1.000 87.828  0 244  ARG   A HG3  1 c 1 
ATOM   2853  H  HD2  . ARG   A  1  189 ? 19.329  -10.811 17.317  1.000 95.255  0 244  ARG   A HD2  1 c 1 
ATOM   2854  H  HD3  . ARG   A  1  189 ? 19.616  -9.878  16.073  1.000 94.538  0 244  ARG   A HD3  1 c 1 
ATOM   2855  H  HE   . ARG   A  1  189 ? 17.018  -10.538 16.173  1.000 96.275  0 244  ARG   A HE   1 c 1 
ATOM   2856  H  HH11 . ARG   A  1  189 ? 18.907  -8.435  18.065  1.000 92.224  0 244  ARG   A HH11 1 c 1 
ATOM   2857  H  HH12 . ARG   A  1  189 ? 18.190  -7.212  17.481  1.000 91.354  0 244  ARG   A HH12 1 c 1 
ATOM   2858  H  HH21 . ARG   A  1  189 ? 15.838  -7.726  17.409  1.000 71.292  0 244  ARG   A HH21 1 c 1 
ATOM   2859  H  HH22 . ARG   A  1  189 ? 15.456  -8.980  16.632  1.000 71.308  0 244  ARG   A HH22 1 c 1 
ATOM   2860  N  N    . GLY   A  1  190 ? 23.166  -10.337 13.573  1.000 65.543  0 245  GLY   A N    1 ? 1 
ATOM   2861  C  CA   . GLY   A  1  190 ? 24.424  -10.208 12.853  1.000 59.909  0 245  GLY   A CA   1 ? 1 
ATOM   2862  C  C    . GLY   A  1  190 ? 24.588  -8.789  12.321  1.000 48.324  0 245  GLY   A C    1 ? 1 
ATOM   2863  O  O    . GLY   A  1  190 ? 23.628  -8.022  12.326  1.000 49.507  0 245  GLY   A O    1 ? 1 
ATOM   2864  H  H    . GLY   A  1  190 ? 23.126  -10.023 14.431  1.000 66.588  0 245  GLY   A H    1 c 1 
ATOM   2865  H  HA2  . GLY   A  1  190 ? 25.172  -10.421 13.465  1.000 59.034  0 245  GLY   A HA2  1 c 1 
ATOM   2866  H  HA3  . GLY   A  1  190 ? 24.441  -10.850 12.100  1.000 58.608  0 245  GLY   A HA3  1 c 1 
ATOM   2867  N  N    . ARG   A  1  191 ? 25.809  -8.453  11.889  1.000 47.307  0 246  ARG   A N    1 ? 1 
ATOM   2868  C  CA   . ARG   A  1  191 ? 26.158  -7.079  11.564  1.000 52.217  0 246  ARG   A CA   1 ? 1 
ATOM   2869  C  C    . ARG   A  1  191 ? 25.928  -6.748  10.090  1.000 48.139  0 246  ARG   A C    1 ? 1 
ATOM   2870  O  O    . ARG   A  1  191 ? 25.987  -5.583  9.711   1.000 37.983  0 246  ARG   A O    1 ? 1 
ATOM   2871  C  CB   . ARG   A  1  191 ? 27.622  -6.790  11.947  1.000 65.837  0 246  ARG   A CB   1 ? 1 
ATOM   2872  C  CG   . ARG   A  1  191 ? 27.827  -5.322  12.363  1.000 80.983  0 246  ARG   A CG   1 ? 1 
ATOM   2873  C  CD   . ARG   A  1  191 ? 29.099  -5.026  13.131  1.000 74.660  0 246  ARG   A CD   1 ? 1 
ATOM   2874  N  NE   . ARG   A  1  191 ? 29.539  -6.120  14.004  1.000 72.449  0 246  ARG   A NE   1 ? 1 
ATOM   2875  C  CZ   . ARG   A  1  191 ? 30.408  -5.997  15.007  1.000 96.463  0 246  ARG   A CZ   1 ? 1 
ATOM   2876  N  NH1  . ARG   A  1  191 ? 30.127  -6.424  16.234  1.000 104.729 0 246  ARG   A NH1  1 ? 1 
ATOM   2877  N  NH2  . ARG   A  1  191 ? 31.649  -5.604  14.731  1.000 70.629  0 246  ARG   A NH2  1 ? 1 
ATOM   2878  H  H    . ARG   A  1  191 ? 26.446  -9.103  11.795  1.000 49.394  0 246  ARG   A H    1 c 1 
ATOM   2879  H  HA   . ARG   A  1  191 ? 25.580  -6.489  12.099  1.000 52.441  0 246  ARG   A HA   1 c 1 
ATOM   2880  H  HB2  . ARG   A  1  191 ? 27.873  -7.378  12.686  1.000 65.875  0 246  ARG   A HB2  1 c 1 
ATOM   2881  H  HB3  . ARG   A  1  191 ? 28.200  -6.993  11.182  1.000 65.714  0 246  ARG   A HB3  1 c 1 
ATOM   2882  H  HG2  . ARG   A  1  191 ? 27.820  -4.764  11.556  1.000 75.309  0 246  ARG   A HG2  1 c 1 
ATOM   2883  H  HG3  . ARG   A  1  191 ? 27.066  -5.043  12.915  1.000 74.945  0 246  ARG   A HG3  1 c 1 
ATOM   2884  H  HD2  . ARG   A  1  191 ? 29.815  -4.827  12.490  1.000 75.852  0 246  ARG   A HD2  1 c 1 
ATOM   2885  H  HD3  . ARG   A  1  191 ? 28.960  -4.223  13.676  1.000 75.391  0 246  ARG   A HD3  1 c 1 
ATOM   2886  H  HE   . ARG   A  1  191 ? 29.209  -6.910  13.863  1.000 77.731  0 246  ARG   A HE   1 c 1 
ATOM   2887  H  HH11 . ARG   A  1  191 ? 29.359  -6.826  16.393  1.000 101.373 0 246  ARG   A HH11 1 c 1 
ATOM   2888  H  HH12 . ARG   A  1  191 ? 30.709  -6.306  16.886  1.000 102.037 0 246  ARG   A HH12 1 c 1 
ATOM   2889  H  HH21 . ARG   A  1  191 ? 32.177  -5.329  15.379  1.000 78.529  0 246  ARG   A HH21 1 c 1 
ATOM   2890  H  HH22 . ARG   A  1  191 ? 31.938  -5.619  13.901  1.000 77.859  0 246  ARG   A HH22 1 c 1 
ATOM   2891  N  N    . GLU   A  1  192 ? 25.646  -7.777  9.277   1.000 41.614  0 247  GLU   A N    1 ? 1 
ATOM   2892  C  CA   . GLU   A  1  192 ? 25.396  -7.597  7.852   1.000 46.371  0 247  GLU   A CA   1 ? 1 
ATOM   2893  C  C    . GLU   A  1  192 ? 24.421  -6.447  7.598   1.000 33.932  0 247  GLU   A C    1 ? 1 
ATOM   2894  O  O    . GLU   A  1  192 ? 24.682  -5.573  6.771   1.000 49.660  0 247  GLU   A O    1 ? 1 
ATOM   2895  C  CB   . GLU   A  1  192 ? 24.869  -8.920  7.221   1.000 38.270  0 247  GLU   A CB   1 ? 1 
ATOM   2896  C  CG   . GLU   A  1  192 ? 24.822  -8.932  5.698   1.000 45.122  0 247  GLU   A CG   1 ? 1 
ATOM   2897  C  CD   . GLU   A  1  192 ? 26.118  -8.554  4.988   1.000 50.582  0 247  GLU   A CD   1 ? 1 
ATOM   2898  O  OE1  . GLU   A  1  192 ? 27.176  -9.119  5.342   1.000 63.308  0 247  GLU   A OE1  1 ? 1 
ATOM   2899  O  OE2  . GLU   A  1  192 ? 26.081  -7.676  4.093   1.000 37.435  0 247  GLU   A OE2  1 ? 1 
ATOM   2900  H  H    . GLU   A  1  192 ? 25.614  -8.623  9.620   1.000 44.428  0 247  GLU   A H    1 c 1 
ATOM   2901  H  HA   . GLU   A  1  192 ? 26.253  -7.370  7.425   1.000 41.868  0 247  GLU   A HA   1 c 1 
ATOM   2902  H  HB2  . GLU   A  1  192 ? 25.440  -9.657  7.524   1.000 42.001  0 247  GLU   A HB2  1 c 1 
ATOM   2903  H  HB3  . GLU   A  1  192 ? 23.967  -9.085  7.559   1.000 41.151  0 247  GLU   A HB3  1 c 1 
ATOM   2904  H  HG2  . GLU   A  1  192 ? 24.568  -9.829  5.402   1.000 44.237  0 247  GLU   A HG2  1 c 1 
ATOM   2905  H  HG3  . GLU   A  1  192 ? 24.118  -8.318  5.402   1.000 43.219  0 247  GLU   A HG3  1 c 1 
ATOM   2906  N  N    . LYS   A  1  193 ? 23.318  -6.452  8.351   1.000 36.851  0 248  LYS   A N    1 ? 1 
ATOM   2907  C  CA   . LYS   A  1  193 ? 22.217  -5.530  8.172   1.000 37.120  0 248  LYS   A CA   1 ? 1 
ATOM   2908  C  C    . LYS   A  1  193 ? 22.609  -4.053  8.209   1.000 38.218  0 248  LYS   A C    1 ? 1 
ATOM   2909  O  O    . LYS   A  1  193 ? 21.872  -3.205  7.717   1.000 41.763  0 248  LYS   A O    1 ? 1 
ATOM   2910  C  CB   . LYS   A  1  193 ? 21.148  -5.855  9.249   1.000 34.523  0 248  LYS   A CB   1 ? 1 
ATOM   2911  C  CG   . LYS   A  1  193 ? 21.558  -5.602  10.688  1.000 50.775  0 248  LYS   A CG   1 ? 1 
ATOM   2912  C  CD   . LYS   A  1  193 ? 20.412  -5.791  11.691  1.000 38.514  0 248  LYS   A CD   1 ? 1 
ATOM   2913  C  CE   . LYS   A  1  193 ? 20.858  -5.641  13.128  1.000 38.539  0 248  LYS   A CE   1 ? 1 
ATOM   2914  N  NZ   . LYS   A  1  193 ? 21.750  -6.770  13.548  1.000 35.112  0 248  LYS   A NZ   1 ? 1 
ATOM   2915  H  H    . LYS   A  1  193 ? 23.248  -7.082  9.010   1.000 36.608  0 248  LYS   A H    1 c 1 
ATOM   2916  H  HA   . LYS   A  1  193 ? 21.821  -5.712  7.289   1.000 36.361  0 248  LYS   A HA   1 c 1 
ATOM   2917  H  HB2  . LYS   A  1  193 ? 20.349  -5.320  9.058   1.000 37.636  0 248  LYS   A HB2  1 c 1 
ATOM   2918  H  HB3  . LYS   A  1  193 ? 20.901  -6.799  9.160   1.000 38.137  0 248  LYS   A HB3  1 c 1 
ATOM   2919  H  HG2  . LYS   A  1  193 ? 22.288  -6.213  10.920  1.000 43.979  0 248  LYS   A HG2  1 c 1 
ATOM   2920  H  HG3  . LYS   A  1  193 ? 21.898  -4.686  10.765  1.000 43.622  0 248  LYS   A HG3  1 c 1 
ATOM   2921  H  HD2  . LYS   A  1  193 ? 19.712  -5.130  11.506  1.000 40.396  0 248  LYS   A HD2  1 c 1 
ATOM   2922  H  HD3  . LYS   A  1  193 ? 20.024  -6.683  11.568  1.000 40.783  0 248  LYS   A HD3  1 c 1 
ATOM   2923  H  HE2  . LYS   A  1  193 ? 21.340  -4.799  13.235  1.000 37.715  0 248  LYS   A HE2  1 c 1 
ATOM   2924  H  HE3  . LYS   A  1  193 ? 20.077  -5.619  13.713  1.000 37.366  0 248  LYS   A HE3  1 c 1 
ATOM   2925  H  HZ1  . LYS   A  1  193 ? 22.572  -6.667  13.180  1.000 36.746  0 248  LYS   A HZ1  1 c 1 
ATOM   2926  H  HZ2  . LYS   A  1  193 ? 21.398  -7.560  13.275  1.000 36.332  0 248  LYS   A HZ2  1 c 1 
ATOM   2927  H  HZ3  . LYS   A  1  193 ? 21.830  -6.779  14.452  1.000 36.569  0 248  LYS   A HZ3  1 c 1 
ATOM   2928  N  N    . PHE   A  1  194 ? 23.759  -3.737  8.812   1.000 30.585  0 249  PHE   A N    1 ? 1 
ATOM   2929  C  CA   . PHE   A  1  194 ? 24.199  -2.356  8.878   1.000 45.057  0 249  PHE   A CA   1 ? 1 
ATOM   2930  C  C    . PHE   A  1  194 ? 24.834  -1.898  7.561   1.000 40.915  0 249  PHE   A C    1 ? 1 
ATOM   2931  O  O    . PHE   A  1  194 ? 24.985  -0.702  7.344   1.000 46.630  0 249  PHE   A O    1 ? 1 
ATOM   2932  C  CB   . PHE   A  1  194 ? 25.201  -2.158  10.049  1.000 52.508  0 249  PHE   A CB   1 ? 1 
ATOM   2933  C  CG   . PHE   A  1  194 ? 24.585  -2.268  11.433  1.000 68.262  0 249  PHE   A CG   1 ? 1 
ATOM   2934  C  CD1  . PHE   A  1  194 ? 23.869  -1.211  11.983  1.000 47.624  0 249  PHE   A CD1  1 ? 1 
ATOM   2935  C  CD2  . PHE   A  1  194 ? 24.702  -3.438  12.172  1.000 77.750  0 249  PHE   A CD2  1 ? 1 
ATOM   2936  C  CE1  . PHE   A  1  194 ? 23.295  -1.320  13.243  1.000 68.924  0 249  PHE   A CE1  1 ? 1 
ATOM   2937  C  CE2  . PHE   A  1  194 ? 24.130  -3.538  13.439  1.000 80.760  0 249  PHE   A CE2  1 ? 1 
ATOM   2938  C  CZ   . PHE   A  1  194 ? 23.424  -2.482  13.963  1.000 83.674  0 249  PHE   A CZ   1 ? 1 
ATOM   2939  H  H    . PHE   A  1  194 ? 24.267  -4.385  9.207   1.000 35.737  0 249  PHE   A H    1 c 1 
ATOM   2940  H  HA   . PHE   A  1  194 ? 23.408  -1.785  9.050   1.000 41.299  0 249  PHE   A HA   1 c 1 
ATOM   2941  H  HB2  . PHE   A  1  194 ? 25.911  -2.828  9.965   1.000 54.489  0 249  PHE   A HB2  1 c 1 
ATOM   2942  H  HB3  . PHE   A  1  194 ? 25.613  -1.273  9.957   1.000 54.049  0 249  PHE   A HB3  1 c 1 
ATOM   2943  H  HD1  . PHE   A  1  194 ? 23.771  -0.411  11.492  1.000 56.328  0 249  PHE   A HD1  1 c 1 
ATOM   2944  H  HD2  . PHE   A  1  194 ? 25.183  -4.167  11.815  1.000 75.285  0 249  PHE   A HD2  1 c 1 
ATOM   2945  H  HE1  . PHE   A  1  194 ? 22.814  -0.594  13.605  1.000 65.205  0 249  PHE   A HE1  1 c 1 
ATOM   2946  H  HE2  . PHE   A  1  194 ? 24.219  -4.338  13.933  1.000 80.552  0 249  PHE   A HE2  1 c 1 
ATOM   2947  H  HZ   . PHE   A  1  194 ? 23.038  -2.552  14.822  1.000 78.765  0 249  PHE   A HZ   1 c 1 
ATOM   2948  N  N    . ASN   A  1  195 ? 25.264  -2.853  6.720   1.000 32.435  0 250  ASN   A N    1 ? 1 
ATOM   2949  C  CA   . ASN   A  1  195 ? 25.980  -2.533  5.494   1.000 33.029  0 250  ASN   A CA   1 ? 1 
ATOM   2950  C  C    . ASN   A  1  195 ? 25.044  -1.814  4.519   1.000 30.248  0 250  ASN   A C    1 ? 1 
ATOM   2951  O  O    . ASN   A  1  195 ? 23.932  -2.286  4.254   1.000 21.586  0 250  ASN   A O    1 ? 1 
ATOM   2952  C  CB   . ASN   A  1  195 ? 26.561  -3.792  4.863   1.000 31.192  0 250  ASN   A CB   1 ? 1 
ATOM   2953  C  CG   . ASN   A  1  195 ? 27.383  -3.495  3.617   1.000 62.981  0 250  ASN   A CG   1 ? 1 
ATOM   2954  O  OD1  . ASN   A  1  195 ? 27.326  -2.396  3.013   1.000 44.189  0 250  ASN   A OD1  1 ? 1 
ATOM   2955  N  ND2  . ASN   A  1  195 ? 28.152  -4.478  3.162   1.000 75.223  0 250  ASN   A ND2  1 ? 1 
ATOM   2956  H  H    . ASN   A  1  195 ? 25.112  -3.731  6.921   1.000 34.392  0 250  ASN   A H    1 c 1 
ATOM   2957  H  HA   . ASN   A  1  195 ? 26.727  -1.936  5.719   1.000 32.570  0 250  ASN   A HA   1 c 1 
ATOM   2958  H  HB2  . ASN   A  1  195 ? 27.128  -4.244  5.521   1.000 37.281  0 250  ASN   A HB2  1 c 1 
ATOM   2959  H  HB3  . ASN   A  1  195 ? 25.829  -4.396  4.627   1.000 36.541  0 250  ASN   A HB3  1 c 1 
ATOM   2960  H  HD21 . ASN   A  1  195 ? 28.169  -5.257  3.579   1.000 70.879  0 250  ASN   A HD21 1 c 1 
ATOM   2961  H  HD22 . ASN   A  1  195 ? 28.647  -4.354  2.440   1.000 71.279  0 250  ASN   A HD22 1 c 1 
ATOM   2962  N  N    . HIS   A  1  196 ? 25.510  -0.680  3.979   1.000 24.190  0 251  HIS   A N    1 ? 1 
ATOM   2963  C  CA   . HIS   A  1  196 ? 24.644  0.208   3.214   1.000 25.652  0 251  HIS   A CA   1 ? 1 
ATOM   2964  C  C    . HIS   A  1  196 ? 24.160  -0.449  1.927   1.000 20.106  0 251  HIS   A C    1 ? 1 
ATOM   2965  O  O    . HIS   A  1  196 ? 23.134  -0.064  1.373   1.000 21.374  0 251  HIS   A O    1 ? 1 
ATOM   2966  C  CB   . HIS   A  1  196 ? 25.338  1.556   2.910   1.000 31.034  0 251  HIS   A CB   1 ? 1 
ATOM   2967  C  CG   . HIS   A  1  196 ? 26.508  1.458   1.977   1.000 32.351  0 251  HIS   A CG   1 ? 1 
ATOM   2968  N  ND1  . HIS   A  1  196 ? 26.327  1.360   0.620   1.000 28.058  0 251  HIS   A ND1  1 ? 1 
ATOM   2969  C  CD2  . HIS   A  1  196 ? 27.838  1.479   2.241   1.000 35.426  0 251  HIS   A CD2  1 ? 1 
ATOM   2970  C  CE1  . HIS   A  1  196 ? 27.544  1.281   0.093   1.000 32.090  0 251  HIS   A CE1  1 ? 1 
ATOM   2971  N  NE2  . HIS   A  1  196 ? 28.485  1.378   1.035   1.000 36.969  0 251  HIS   A NE2  1 ? 1 
ATOM   2972  H  H    . HIS   A  1  196 ? 26.393  -0.465  4.073   1.000 26.669  0 251  HIS   A H    1 c 1 
ATOM   2973  H  HA   . HIS   A  1  196 ? 23.855  0.399   3.774   1.000 24.405  0 251  HIS   A HA   1 c 1 
ATOM   2974  H  HB2  . HIS   A  1  196 ? 24.679  2.165   2.520   1.000 29.560  0 251  HIS   A HB2  1 c 1 
ATOM   2975  H  HB3  . HIS   A  1  196 ? 25.643  1.947   3.753   1.000 30.203  0 251  HIS   A HB3  1 c 1 
ATOM   2976  H  HD1  . HIS   A  1  196 ? 25.553  1.347   0.214   0.000 14.560  0 251  HIS   A HD1  1 c 1 
ATOM   2977  H  HD2  . HIS   A  1  196 ? 28.239  1.556   3.089   1.000 35.384  0 251  HIS   A HD2  1 c 1 
ATOM   2978  H  HE1  . HIS   A  1  196 ? 27.722  1.215   -0.826  1.000 32.386  0 251  HIS   A HE1  1 c 1 
ATOM   2979  H  HE2  . HIS   A  1  196 ? 29.362  1.376   0.921   0.000 21.320  0 251  HIS   A HE2  1 c 1 
ATOM   2980  N  N    . ARG   A  1  197 ? 24.874  -1.472  1.455   1.000 24.337  0 252  ARG   A N    1 ? 1 
ATOM   2981  C  CA   . ARG   A  1  197 ? 24.529  -2.072  0.171   1.000 26.211  0 252  ARG   A CA   1 ? 1 
ATOM   2982  C  C    . ARG   A  1  197 ? 23.086  -2.575  0.104   1.000 23.345  0 252  ARG   A C    1 ? 1 
ATOM   2983  O  O    . ARG   A  1  197 ? 22.520  -2.619  -0.978  1.000 28.961  0 252  ARG   A O    1 ? 1 
ATOM   2984  C  CB   . ARG   A  1  197 ? 25.518  -3.190  -0.168  1.000 25.110  0 252  ARG   A CB   1 ? 1 
ATOM   2985  C  CG   . ARG   A  1  197 ? 25.420  -4.419  0.710   1.000 25.720  0 252  ARG   A CG   1 ? 1 
ATOM   2986  C  CD   . ARG   A  1  197 ? 26.390  -5.427  0.218   1.000 29.606  0 252  ARG   A CD   1 ? 1 
ATOM   2987  N  NE   . ARG   A  1  197 ? 26.456  -6.570  1.113   1.000 33.541  0 252  ARG   A NE   1 ? 1 
ATOM   2988  C  CZ   . ARG   A  1  197 ? 27.121  -7.688  0.870   1.000 23.692  0 252  ARG   A CZ   1 ? 1 
ATOM   2989  N  NH1  . ARG   A  1  197 ? 27.751  -7.898  -0.278  1.000 24.106  0 252  ARG   A NH1  1 ? 1 
ATOM   2990  N  NH2  . ARG   A  1  197 ? 27.180  -8.611  1.817   1.000 27.448  0 252  ARG   A NH2  1 ? 1 
ATOM   2991  H  H    . ARG   A  1  197 ? 25.592  -1.793  1.919   1.000 24.185  0 252  ARG   A H    1 c 1 
ATOM   2992  H  HA   . ARG   A  1  197 ? 24.628  -1.370  -0.512  1.000 25.094  0 252  ARG   A HA   1 c 1 
ATOM   2993  H  HB2  . ARG   A  1  197 ? 25.373  -3.459  -1.099  1.000 25.660  0 252  ARG   A HB2  1 c 1 
ATOM   2994  H  HB3  . ARG   A  1  197 ? 26.427  -2.829  -0.101  1.000 26.157  0 252  ARG   A HB3  1 c 1 
ATOM   2995  H  HG2  . ARG   A  1  197 ? 25.626  -4.185  1.639   1.000 26.440  0 252  ARG   A HG2  1 c 1 
ATOM   2996  H  HG3  . ARG   A  1  197 ? 24.513  -4.790  0.673   1.000 25.796  0 252  ARG   A HG3  1 c 1 
ATOM   2997  H  HD2  . ARG   A  1  197 ? 26.121  -5.729  -0.676  1.000 29.440  0 252  ARG   A HD2  1 c 1 
ATOM   2998  H  HD3  . ARG   A  1  197 ? 27.279  -5.018  0.147   1.000 30.043  0 252  ARG   A HD3  1 c 1 
ATOM   2999  H  HE   . ARG   A  1  197 ? 26.026  -6.517  1.870   1.000 29.138  0 252  ARG   A HE   1 c 1 
ATOM   3000  H  HH11 . ARG   A  1  197 ? 28.025  -7.213  -0.764  1.000 24.296  0 252  ARG   A HH11 1 c 1 
ATOM   3001  H  HH12 . ARG   A  1  197 ? 27.899  -8.725  -0.551  1.000 24.458  0 252  ARG   A HH12 1 c 1 
ATOM   3002  H  HH21 . ARG   A  1  197 ? 27.907  -9.105  1.902   1.000 26.830  0 252  ARG   A HH21 1 c 1 
ATOM   3003  H  HH22 . ARG   A  1  197 ? 26.491  -8.733  2.351   1.000 26.008  0 252  ARG   A HH22 1 c 1 
ATOM   3004  N  N    . TRP   A  1  198 ? 22.447  -2.877  1.249   1.000 19.455  0 253  TRP   A N    1 ? 1 
ATOM   3005  C  CA   . TRP   A  1  198 ? 21.120  -3.485  1.219   1.000 18.109  0 253  TRP   A CA   1 ? 1 
ATOM   3006  C  C    . TRP   A  1  198 ? 20.018  -2.459  1.096   1.000 22.045  0 253  TRP   A C    1 ? 1 
ATOM   3007  O  O    . TRP   A  1  198 ? 18.912  -2.823  0.705   1.000 19.368  0 253  TRP   A O    1 ? 1 
ATOM   3008  C  CB   . TRP   A  1  198 ? 20.825  -4.315  2.504   1.000 20.646  0 253  TRP   A CB   1 ? 1 
ATOM   3009  C  CG   . TRP   A  1  198 ? 21.728  -5.479  2.660   1.000 20.256  0 253  TRP   A CG   1 ? 1 
ATOM   3010  C  CD1  . TRP   A  1  198 ? 22.882  -5.548  3.388   1.000 21.010  0 253  TRP   A CD1  1 ? 1 
ATOM   3011  C  CD2  . TRP   A  1  198 ? 21.504  -6.777  2.129   1.000 23.013  0 253  TRP   A CD2  1 ? 1 
ATOM   3012  N  NE1  . TRP   A  1  198 ? 23.432  -6.796  3.271   1.000 21.941  0 253  TRP   A NE1  1 ? 1 
ATOM   3013  C  CE2  . TRP   A  1  198 ? 22.598  -7.577  2.496   1.000 23.069  0 253  TRP   A CE2  1 ? 1 
ATOM   3014  C  CE3  . TRP   A  1  198 ? 20.505  -7.334  1.333   1.000 19.371  0 253  TRP   A CE3  1 ? 1 
ATOM   3015  C  CZ2  . TRP   A  1  198 ? 22.694  -8.915  2.122   1.000 22.860  0 253  TRP   A CZ2  1 ? 1 
ATOM   3016  C  CZ3  . TRP   A  1  198 ? 20.621  -8.660  0.961   1.000 23.269  0 253  TRP   A CZ3  1 ? 1 
ATOM   3017  C  CH2  . TRP   A  1  198 ? 21.694  -9.432  1.371   1.000 20.435  0 253  TRP   A CH2  1 ? 1 
ATOM   3018  H  H    . TRP   A  1  198 ? 22.845  -2.720  2.056   1.000 20.210  0 253  TRP   A H    1 c 1 
ATOM   3019  H  HA   . TRP   A  1  198 ? 21.078  -4.095  0.447   1.000 19.551  0 253  TRP   A HA   1 c 1 
ATOM   3020  H  HB2  . TRP   A  1  198 ? 20.916  -3.728  3.282   1.000 19.760  0 253  TRP   A HB2  1 c 1 
ATOM   3021  H  HB3  . TRP   A  1  198 ? 19.898  -4.628  2.468   1.000 19.403  0 253  TRP   A HB3  1 c 1 
ATOM   3022  H  HD1  . TRP   A  1  198 ? 23.288  -4.823  3.836   1.000 21.224  0 253  TRP   A HD1  1 c 1 
ATOM   3023  H  HE1  . TRP   A  1  198 ? 24.180  -7.057  3.639   1.000 22.898  0 253  TRP   A HE1  1 c 1 
ATOM   3024  H  HE3  . TRP   A  1  198 ? 19.767  -6.815  1.053   1.000 20.372  0 253  TRP   A HE3  1 c 1 
ATOM   3025  H  HZ2  . TRP   A  1  198 ? 23.422  -9.445  2.399   1.000 22.962  0 253  TRP   A HZ2  1 c 1 
ATOM   3026  H  HZ3  . TRP   A  1  198 ? 19.948  -9.052  0.428   1.000 21.269  0 253  TRP   A HZ3  1 c 1 
ATOM   3027  H  HH2  . TRP   A  1  198 ? 21.745  -10.328 1.095   1.000 21.929  0 253  TRP   A HH2  1 c 1 
ATOM   3028  N  N    . TRP   A  1  199 ? 20.336  -1.201  1.448   1.000 23.786  0 254  TRP   A N    1 ? 1 
ATOM   3029  C  CA   . TRP   A  1  199 ? 19.332  -0.187  1.727   1.000 19.129  0 254  TRP   A CA   1 ? 1 
ATOM   3030  C  C    . TRP   A  1  199 ? 19.238  0.771   0.545   1.000 20.484  0 254  TRP   A C    1 ? 1 
ATOM   3031  O  O    . TRP   A  1  199 ? 20.174  1.520   0.279   1.000 19.726  0 254  TRP   A O    1 ? 1 
ATOM   3032  C  CB   . TRP   A  1  199 ? 19.653  0.575   3.046   1.000 20.181  0 254  TRP   A CB   1 ? 1 
ATOM   3033  C  CG   . TRP   A  1  199 ? 19.825  -0.351  4.226   1.000 19.782  0 254  TRP   A CG   1 ? 1 
ATOM   3034  C  CD1  . TRP   A  1  199 ? 20.947  -1.040  4.555   1.000 20.736  0 254  TRP   A CD1  1 ? 1 
ATOM   3035  C  CD2  . TRP   A  1  199 ? 18.817  -0.766  5.148   1.000 17.198  0 254  TRP   A CD2  1 ? 1 
ATOM   3036  N  NE1  . TRP   A  1  199 ? 20.709  -1.843  5.631   1.000 21.270  0 254  TRP   A NE1  1 ? 1 
ATOM   3037  C  CE2  . TRP   A  1  199 ? 19.411  -1.696  6.023   1.000 19.715  0 254  TRP   A CE2  1 ? 1 
ATOM   3038  C  CE3  . TRP   A  1  199 ? 17.469  -0.462  5.309   1.000 16.848  0 254  TRP   A CE3  1 ? 1 
ATOM   3039  C  CZ2  . TRP   A  1  199 ? 18.714  -2.282  7.079   1.000 24.762  0 254  TRP   A CZ2  1 ? 1 
ATOM   3040  C  CZ3  . TRP   A  1  199 ? 16.781  -1.020  6.364   1.000 19.940  0 254  TRP   A CZ3  1 ? 1 
ATOM   3041  C  CH2  . TRP   A  1  199 ? 17.396  -1.940  7.226   1.000 20.210  0 254  TRP   A CH2  1 ? 1 
ATOM   3042  H  H    . TRP   A  1  199 ? 21.216  -0.967  1.515   1.000 22.654  0 254  TRP   A H    1 c 1 
ATOM   3043  H  HA   . TRP   A  1  199 ? 18.463  -0.639  1.844   1.000 19.937  0 254  TRP   A HA   1 c 1 
ATOM   3044  H  HB2  . TRP   A  1  199 ? 20.474  1.092   2.916   1.000 20.201  0 254  TRP   A HB2  1 c 1 
ATOM   3045  H  HB3  . TRP   A  1  199 ? 18.926  1.201   3.229   1.000 19.509  0 254  TRP   A HB3  1 c 1 
ATOM   3046  H  HD1  . TRP   A  1  199 ? 21.774  -0.979  4.104   1.000 21.142  0 254  TRP   A HD1  1 c 1 
ATOM   3047  H  HE1  . TRP   A  1  199 ? 21.307  -2.348  6.027   1.000 21.260  0 254  TRP   A HE1  1 c 1 
ATOM   3048  H  HE3  . TRP   A  1  199 ? 17.050  0.160   4.739   1.000 17.380  0 254  TRP   A HE3  1 c 1 
ATOM   3049  H  HZ2  . TRP   A  1  199 ? 19.134  -2.891  7.662   1.000 22.605  0 254  TRP   A HZ2  1 c 1 
ATOM   3050  H  HZ3  . TRP   A  1  199 ? 15.867  -0.815  6.483   1.000 18.732  0 254  TRP   A HZ3  1 c 1 
ATOM   3051  H  HH2  . TRP   A  1  199 ? 16.897  -2.322  7.926   1.000 20.999  0 254  TRP   A HH2  1 c 1 
ATOM   3052  N  N    . GLY   A  1  200 ? 18.105  0.723   -0.166  1.000 21.562  0 255  GLY   A N    1 ? 1 
ATOM   3053  C  CA   . GLY   A  1  200 ? 17.861  1.549   -1.348  1.000 17.556  0 255  GLY   A CA   1 ? 1 
ATOM   3054  C  C    . GLY   A  1  200 ? 16.966  2.739   -1.019  1.000 17.680  0 255  GLY   A C    1 ? 1 
ATOM   3055  O  O    . GLY   A  1  200 ? 16.707  3.072   0.147   1.000 25.054  0 255  GLY   A O    1 ? 1 
ATOM   3056  H  H    . GLY   A  1  200 ? 17.448  0.144   0.097   1.000 19.906  0 255  GLY   A H    1 c 1 
ATOM   3057  H  HA2  . GLY   A  1  200 ? 18.724  1.874   -1.705  1.000 18.934  0 255  GLY   A HA2  1 c 1 
ATOM   3058  H  HA3  . GLY   A  1  200 ? 17.427  0.997   -2.043  1.000 18.540  0 255  GLY   A HA3  1 c 1 
ATOM   3059  N  N    . GLY   A  1  201 ? 16.502  3.394   -2.072  1.000 15.592  0 256  GLY   A N    1 ? 1 
ATOM   3060  C  CA   . GLY   A  1  201 ? 15.791  4.646   -1.957  1.000 15.918  0 256  GLY   A CA   1 ? 1 
ATOM   3061  C  C    . GLY   A  1  201 ? 16.604  5.686   -1.208  1.000 18.097  0 256  GLY   A C    1 ? 1 
ATOM   3062  O  O    . GLY   A  1  201 ? 17.834  5.703   -1.239  1.000 19.845  0 256  GLY   A O    1 ? 1 
ATOM   3063  H  H    . GLY   A  1  201 ? 16.635  3.044   -2.906  1.000 16.295  0 256  GLY   A H    1 c 1 
ATOM   3064  H  HA2  . GLY   A  1  201 ? 15.581  4.983   -2.864  1.000 16.208  0 256  GLY   A HA2  1 c 1 
ATOM   3065  H  HA3  . GLY   A  1  201 ? 14.939  4.487   -1.481  1.000 15.855  0 256  GLY   A HA3  1 c 1 
ATOM   3066  N  N    . GLN   A  1  202 ? 15.874  6.555   -0.530  1.000 20.165  0 257  GLN   A N    1 ? 1 
ATOM   3067  C  CA   . GLN   A  1  202 ? 16.482  7.651   0.187   1.000 21.704  0 257  GLN   A CA   1 ? 1 
ATOM   3068  C  C    . GLN   A  1  202 ? 15.628  7.889   1.428   1.000 17.612  0 257  GLN   A C    1 ? 1 
ATOM   3069  O  O    . GLN   A  1  202 ? 14.596  8.550   1.385   1.000 20.834  0 257  GLN   A O    1 ? 1 
ATOM   3070  C  CB   . GLN   A  1  202 ? 16.594  8.912   -0.675  1.000 23.440  0 257  GLN   A CB   1 ? 1 
ATOM   3071  C  CG   . GLN   A  1  202 ? 17.332  10.024  0.043   1.000 22.428  0 257  GLN   A CG   1 ? 1 
ATOM   3072  C  CD   . GLN   A  1  202 ? 17.387  11.258  -0.771  1.000 24.300  0 257  GLN   A CD   1 ? 1 
ATOM   3073  O  OE1  . GLN   A  1  202 ? 18.212  11.370  -1.642  1.000 29.697  0 257  GLN   A OE1  1 ? 1 
ATOM   3074  N  NE2  . GLN   A  1  202 ? 16.536  12.197  -0.526  1.000 19.785  0 257  GLN   A NE2  1 ? 1 
ATOM   3075  H  H    . GLN   A  1  202 ? 14.964  6.468   -0.516  1.000 19.420  0 257  GLN   A H    1 c 1 
ATOM   3076  H  HA   . GLN   A  1  202 ? 17.383  7.381   0.466   1.000 21.146  0 257  GLN   A HA   1 c 1 
ATOM   3077  H  HB2  . GLN   A  1  202 ? 17.069  8.688   -1.503  1.000 22.979  0 257  GLN   A HB2  1 c 1 
ATOM   3078  H  HB3  . GLN   A  1  202 ? 15.694  9.217   -0.912  1.000 22.497  0 257  GLN   A HB3  1 c 1 
ATOM   3079  H  HG2  . GLN   A  1  202 ? 16.883  10.219  0.893   1.000 22.801  0 257  GLN   A HG2  1 c 1 
ATOM   3080  H  HG3  . GLN   A  1  202 ? 18.245  9.730   0.244   1.000 23.307  0 257  GLN   A HG3  1 c 1 
ATOM   3081  H  HE21 . GLN   A  1  202 ? 15.737  11.998  -0.206  1.000 20.765  0 257  GLN   A HE21 1 c 1 
ATOM   3082  H  HE22 . GLN   A  1  202 ? 16.755  13.041  -0.673  1.000 21.700  0 257  GLN   A HE22 1 c 1 
ATOM   3083  N  N    . PRO   A  1  203 ? 16.076  7.395   2.594   1.000 17.731  0 258  PRO   A N    1 ? 1 
ATOM   3084  C  CA   . PRO   A  1  203 ? 15.335  7.578   3.828   1.000 17.251  0 258  PRO   A CA   1 ? 1 
ATOM   3085  C  C    . PRO   A  1  203 ? 15.317  9.044   4.284   1.000 15.873  0 258  PRO   A C    1 ? 1 
ATOM   3086  O  O    . PRO   A  1  203 ? 16.143  9.843   3.880   1.000 14.118  0 258  PRO   A O    1 ? 1 
ATOM   3087  C  CB   . PRO   A  1  203 ? 16.078  6.632   4.793   1.000 17.797  0 258  PRO   A CB   1 ? 1 
ATOM   3088  C  CG   . PRO   A  1  203 ? 17.429  6.492   4.266   1.000 17.480  0 258  PRO   A CG   1 ? 1 
ATOM   3089  C  CD   . PRO   A  1  203 ? 17.332  6.657   2.790   1.000 19.205  0 258  PRO   A CD   1 ? 1 
ATOM   3090  H  HA   . PRO   A  1  203 ? 14.411  7.252   3.699   1.000 16.750  0 258  PRO   A HA   1 c 1 
ATOM   3091  H  HB2  . PRO   A  1  203 ? 16.099  7.009   5.698   1.000 17.593  0 258  PRO   A HB2  1 c 1 
ATOM   3092  H  HB3  . PRO   A  1  203 ? 15.632  5.758   4.831   1.000 17.295  0 258  PRO   A HB3  1 c 1 
ATOM   3093  H  HG2  . PRO   A  1  203 ? 18.017  7.176   4.647   1.000 18.358  0 258  PRO   A HG2  1 c 1 
ATOM   3094  H  HG3  . PRO   A  1  203 ? 17.793  5.611   4.488   1.000 18.120  0 258  PRO   A HG3  1 c 1 
ATOM   3095  H  HD2  . PRO   A  1  203 ? 18.092  7.163   2.448   1.000 18.914  0 258  PRO   A HD2  1 c 1 
ATOM   3096  H  HD3  . PRO   A  1  203 ? 17.301  5.792   2.342   1.000 18.451  0 258  PRO   A HD3  1 c 1 
ATOM   3097  N  N    . LEU   A  1  204 ? 14.338  9.373   5.130   1.000 17.770  0 259  LEU   A N    1 ? 1 
ATOM   3098  C  CA   . LEU   A  1  204 ? 14.117  10.715  5.644   1.000 19.534  0 259  LEU   A CA   1 ? 1 
ATOM   3099  C  C    . LEU   A  1  204 ? 15.334  11.367  6.294   1.000 16.485  0 259  LEU   A C    1 ? 1 
ATOM   3100  O  O    . LEU   A  1  204 ? 15.549  12.560  6.116   1.000 17.585  0 259  LEU   A O    1 ? 1 
ATOM   3101  C  CB   . LEU   A  1  204 ? 12.982  10.676  6.684   1.000 21.649  0 259  LEU   A CB   1 ? 1 
ATOM   3102  C  CG   . LEU   A  1  204 ? 12.522  12.030  7.179   1.000 22.890  0 259  LEU   A CG   1 ? 1 
ATOM   3103  C  CD1  . LEU   A  1  204 ? 11.806  12.821  6.110   1.000 28.193  0 259  LEU   A CD1  1 ? 1 
ATOM   3104  C  CD2  . LEU   A  1  204 ? 11.605  11.857  8.372   1.000 26.689  0 259  LEU   A CD2  1 ? 1 
ATOM   3105  H  H    . LEU   A  1  204 ? 13.770  8.711   5.405   1.000 17.331  0 259  LEU   A H    1 c 1 
ATOM   3106  H  HA   . LEU   A  1  204 ? 13.838  11.279  4.888   1.000 18.896  0 259  LEU   A HA   1 c 1 
ATOM   3107  H  HB2  . LEU   A  1  204 ? 12.216  10.213  6.289   1.000 20.979  0 259  LEU   A HB2  1 c 1 
ATOM   3108  H  HB3  . LEU   A  1  204 ? 13.283  10.149  7.451   1.000 21.392  0 259  LEU   A HB3  1 c 1 
ATOM   3109  H  HG   . LEU   A  1  204 ? 13.313  12.546  7.470   1.000 24.489  0 259  LEU   A HG   1 c 1 
ATOM   3110  H  HD11 . LEU   A  1  204 ? 11.643  13.725  6.431   1.000 26.574  0 259  LEU   A HD11 1 c 1 
ATOM   3111  H  HD12 . LEU   A  1  204 ? 10.957  12.393  5.904   1.000 26.093  0 259  LEU   A HD12 1 c 1 
ATOM   3112  H  HD13 . LEU   A  1  204 ? 12.354  12.857  5.307   1.000 26.414  0 259  LEU   A HD13 1 c 1 
ATOM   3113  H  HD21 . LEU   A  1  204 ? 12.078  11.386  9.080   1.000 25.507  0 259  LEU   A HD21 1 c 1 
ATOM   3114  H  HD22 . LEU   A  1  204 ? 10.823  11.342  8.109   1.000 25.119  0 259  LEU   A HD22 1 c 1 
ATOM   3115  H  HD23 . LEU   A  1  204 ? 11.324  12.730  8.696   1.000 25.559  0 259  LEU   A HD23 1 c 1 
ATOM   3116  N  N    . TRP   A  1  205 ? 16.159  10.590  6.987   1.000 16.658  0 260  TRP   A N    1 ? 1 
ATOM   3117  C  CA   . TRP   A  1  205 ? 17.354  11.167  7.587   1.000 21.039  0 260  TRP   A CA   1 ? 1 
ATOM   3118  C  C    . TRP   A  1  205 ? 18.354  11.608  6.512   1.000 20.341  0 260  TRP   A C    1 ? 1 
ATOM   3119  O  O    . TRP   A  1  205 ? 19.038  12.605  6.702   1.000 18.453  0 260  TRP   A O    1 ? 1 
ATOM   3120  C  CB   . TRP   A  1  205 ? 18.036  10.233  8.615   1.000 23.752  0 260  TRP   A CB   1 ? 1 
ATOM   3121  C  CG   . TRP   A  1  205 ? 18.337  8.845   8.120   1.000 20.662  0 260  TRP   A CG   1 ? 1 
ATOM   3122  C  CD1  . TRP   A  1  205 ? 19.498  8.408   7.570   1.000 18.409  0 260  TRP   A CD1  1 ? 1 
ATOM   3123  C  CD2  . TRP   A  1  205 ? 17.482  7.693   8.237   1.000 16.641  0 260  TRP   A CD2  1 ? 1 
ATOM   3124  N  NE1  . TRP   A  1  205 ? 19.409  7.079   7.285   1.000 23.339  0 260  TRP   A NE1  1 ? 1 
ATOM   3125  C  CE2  . TRP   A  1  205 ? 18.173  6.613   7.665   1.000 19.892  0 260  TRP   A CE2  1 ? 1 
ATOM   3126  C  CE3  . TRP   A  1  205 ? 16.185  7.493   8.739   1.000 14.395  0 260  TRP   A CE3  1 ? 1 
ATOM   3127  C  CZ2  . TRP   A  1  205 ? 17.626  5.338   7.585   1.000 16.724  0 260  TRP   A CZ2  1 ? 1 
ATOM   3128  C  CZ3  . TRP   A  1  205 ? 15.605  6.241   8.613   1.000 15.775  0 260  TRP   A CZ3  1 ? 1 
ATOM   3129  C  CH2  . TRP   A  1  205 ? 16.325  5.163   8.075   1.000 16.497  0 260  TRP   A CH2  1 ? 1 
ATOM   3130  H  H    . TRP   A  1  205 ? 15.980  9.701   7.094   1.000 17.226  0 260  TRP   A H    1 c 1 
ATOM   3131  H  HA   . TRP   A  1  205 ? 17.068  11.972  8.080   1.000 20.422  0 260  TRP   A HA   1 c 1 
ATOM   3132  H  HB2  . TRP   A  1  205 ? 18.872  10.655  8.901   1.000 22.826  0 260  TRP   A HB2  1 c 1 
ATOM   3133  H  HB3  . TRP   A  1  205 ? 17.453  10.169  9.400   1.000 22.262  0 260  TRP   A HB3  1 c 1 
ATOM   3134  H  HD1  . TRP   A  1  205 ? 20.253  8.946   7.387   1.000 20.365  0 260  TRP   A HD1  1 c 1 
ATOM   3135  H  HE1  . TRP   A  1  205 ? 20.037  6.602   6.901   1.000 21.328  0 260  TRP   A HE1  1 c 1 
ATOM   3136  H  HE3  . TRP   A  1  205 ? 15.691  8.218   9.087   1.000 15.313  0 260  TRP   A HE3  1 c 1 
ATOM   3137  H  HZ2  . TRP   A  1  205 ? 18.110  4.623   7.209   1.000 17.518  0 260  TRP   A HZ2  1 c 1 
ATOM   3138  H  HZ3  . TRP   A  1  205 ? 14.739  6.093   8.958   1.000 15.264  0 260  TRP   A HZ3  1 c 1 
ATOM   3139  H  HH2  . TRP   A  1  205 ? 15.925  4.313   8.033   1.000 16.144  0 260  TRP   A HH2  1 c 1 
ATOM   3140  N  N    . ILE   A  1  206 ? 18.425  10.887  5.383   1.000 18.813  0 261  ILE   A N    1 ? 1 
ATOM   3141  C  CA   . ILE   A  1  206 ? 19.270  11.301  4.265   1.000 18.506  0 261  ILE   A CA   1 ? 1 
ATOM   3142  C  C    . ILE   A  1  206 ? 18.667  12.471  3.496   1.000 19.186  0 261  ILE   A C    1 ? 1 
ATOM   3143  O  O    . ILE   A  1  206 ? 19.378  13.387  3.095   1.000 19.453  0 261  ILE   A O    1 ? 1 
ATOM   3144  C  CB   . ILE   A  1  206 ? 19.596  10.135  3.336   1.000 18.386  0 261  ILE   A CB   1 ? 1 
ATOM   3145  C  CG1  . ILE   A  1  206 ? 20.367  8.993   4.071   1.000 21.031  0 261  ILE   A CG1  1 ? 1 
ATOM   3146  C  CG2  . ILE   A  1  206 ? 20.330  10.537  2.073   1.000 19.104  0 261  ILE   A CG2  1 ? 1 
ATOM   3147  C  CD1  . ILE   A  1  206 ? 21.564  9.290   4.556   1.000 31.707  0 261  ILE   A CD1  1 ? 1 
ATOM   3148  H  H    . ILE   A  1  206 ? 17.941  10.115  5.308   1.000 18.639  0 261  ILE   A H    1 c 1 
ATOM   3149  H  HA   . ILE   A  1  206 ? 20.113  11.610  4.640   1.000 19.265  0 261  ILE   A HA   1 c 1 
ATOM   3150  H  HB   . ILE   A  1  206 ? 18.729  9.752   3.051   1.000 18.429  0 261  ILE   A HB   1 c 1 
ATOM   3151  H  HG12 . ILE   A  1  206 ? 19.809  8.677   4.812   1.000 21.946  0 261  ILE   A HG12 1 c 1 
ATOM   3152  H  HG13 . ILE   A  1  206 ? 20.470  8.245   3.445   1.000 22.206  0 261  ILE   A HG13 1 c 1 
ATOM   3153  H  HG21 . ILE   A  1  206 ? 21.074  11.122  2.300   1.000 19.507  0 261  ILE   A HG21 1 c 1 
ATOM   3154  H  HG22 . ILE   A  1  206 ? 19.723  11.007  1.475   1.000 18.905  0 261  ILE   A HG22 1 c 1 
ATOM   3155  H  HG23 . ILE   A  1  206 ? 20.669  9.743   1.625   1.000 19.111  0 261  ILE   A HG23 1 c 1 
ATOM   3156  H  HD11 . ILE   A  1  206 ? 21.475  9.935   5.278   1.000 27.760  0 261  ILE   A HD11 1 c 1 
ATOM   3157  H  HD12 . ILE   A  1  206 ? 22.120  9.666   3.853   1.000 28.027  0 261  ILE   A HD12 1 c 1 
ATOM   3158  H  HD13 . ILE   A  1  206 ? 21.984  8.481   4.899   1.000 27.913  0 261  ILE   A HD13 1 c 1 
ATOM   3159  N  N    . THR   A  1  207 ? 17.361  12.427  3.271   1.000 20.736  0 262  THR   A N    1 ? 1 
ATOM   3160  C  CA   . THR   A  1  207 ? 16.683  13.527  2.612   1.000 21.904  0 262  THR   A CA   1 ? 1 
ATOM   3161  C  C    . THR   A  1  207 ? 16.914  14.841  3.366   1.000 22.021  0 262  THR   A C    1 ? 1 
ATOM   3162  O  O    . THR   A  1  207 ? 17.214  15.845  2.734   1.000 21.560  0 262  THR   A O    1 ? 1 
ATOM   3163  C  CB   . THR   A  1  207 ? 15.206  13.233  2.513   1.000 19.857  0 262  THR   A CB   1 ? 1 
ATOM   3164  O  OG1  . THR   A  1  207 ? 15.046  11.946  1.909   1.000 17.535  0 262  THR   A OG1  1 ? 1 
ATOM   3165  C  CG2  . THR   A  1  207 ? 14.439  14.289  1.743   1.000 19.393  0 262  THR   A CG2  1 ? 1 
ATOM   3166  H  H    . THR   A  1  207 ? 16.878  11.694  3.527   1.000 20.091  0 262  THR   A H    1 c 1 
ATOM   3167  H  HA   . THR   A  1  207 ? 17.050  13.614  1.703   1.000 21.516  0 262  THR   A HA   1 c 1 
ATOM   3168  H  HB   . THR   A  1  207 ? 14.844  13.193  3.431   1.000 19.467  0 262  THR   A HB   1 c 1 
ATOM   3169  H  HG1  . THR   A  1  207 ? 15.396  11.956  1.135   0.000 10.490  0 262  THR   A HG1  1 c 1 
ATOM   3170  H  HG21 . THR   A  1  207 ? 13.508  14.016  1.655   1.000 19.218  0 262  THR   A HG21 1 c 1 
ATOM   3171  H  HG22 . THR   A  1  207 ? 14.829  14.395  0.858   1.000 19.830  0 262  THR   A HG22 1 c 1 
ATOM   3172  H  HG23 . THR   A  1  207 ? 14.481  15.138  2.219   1.000 19.785  0 262  THR   A HG23 1 c 1 
ATOM   3173  N  N    . ALA   A  1  208 ? 16.717  14.833  4.692   1.000 19.162  0 263  ALA   A N    1 ? 1 
ATOM   3174  C  CA   . ALA   A  1  208 ? 16.922  16.012  5.524   1.000 21.425  0 263  ALA   A CA   1 ? 1 
ATOM   3175  C  C    . ALA   A  1  208 ? 18.337  16.552  5.363   1.000 20.147  0 263  ALA   A C    1 ? 1 
ATOM   3176  O  O    . ALA   A  1  208 ? 18.529  17.725  5.006   1.000 20.046  0 263  ALA   A O    1 ? 1 
ATOM   3177  C  CB   . ALA   A  1  208 ? 16.645  15.685  6.967   1.000 27.641  0 263  ALA   A CB   1 ? 1 
ATOM   3178  H  H    . ALA   A  1  208 ? 16.439  14.060  5.092   1.000 19.961  0 263  ALA   A H    1 c 1 
ATOM   3179  H  HA   . ALA   A  1  208 ? 16.291  16.709  5.232   1.000 21.624  0 263  ALA   A HA   1 c 1 
ATOM   3180  H  HB1  . ALA   A  1  208 ? 16.693  16.497  7.499   1.000 25.640  0 263  ALA   A HB1  1 c 1 
ATOM   3181  H  HB2  . ALA   A  1  208 ? 15.756  15.301  7.047   1.000 25.017  0 263  ALA   A HB2  1 c 1 
ATOM   3182  H  HB3  . ALA   A  1  208 ? 17.302  15.047  7.290   1.000 25.419  0 263  ALA   A HB3  1 c 1 
ATOM   3183  N  N    . THR   A  1  209 ? 19.304  15.673  5.605   1.000 19.313  0 264  THR   A N    1 ? 1 
ATOM   3184  C  CA   . THR   A  1  209 ? 20.726  16.014  5.522   1.000 23.640  0 264  THR   A CA   1 ? 1 
ATOM   3185  C  C    . THR   A  1  209 ? 21.144  16.570  4.161   1.000 25.107  0 264  THR   A C    1 ? 1 
ATOM   3186  O  O    . THR   A  1  209 ? 21.858  17.570  4.074   1.000 20.514  0 264  THR   A O    1 ? 1 
ATOM   3187  C  CB   . THR   A  1  209 ? 21.589  14.777  5.897   1.000 24.579  0 264  THR   A CB   1 ? 1 
ATOM   3188  O  OG1  . THR   A  1  209 ? 21.278  14.428  7.267   1.000 25.736  0 264  THR   A OG1  1 ? 1 
ATOM   3189  C  CG2  . THR   A  1  209 ? 23.041  15.020  5.746   1.000 32.766  0 264  THR   A CG2  1 ? 1 
ATOM   3190  H  H    . THR   A  1  209 ? 19.077  14.817  5.830   1.000 20.077  0 264  THR   A H    1 c 1 
ATOM   3191  H  HA   . THR   A  1  209 ? 20.896  16.713  6.195   1.000 23.438  0 264  THR   A HA   1 c 1 
ATOM   3192  H  HB   . THR   A  1  209 ? 21.329  14.028  5.309   1.000 25.566  0 264  THR   A HB   1 c 1 
ATOM   3193  H  HG1  . THR   A  1  209 ? 21.455  15.079  7.771   0.000 15.740  0 264  THR   A HG1  1 c 1 
ATOM   3194  H  HG21 . THR   A  1  209 ? 23.536  14.302  6.181   1.000 30.233  0 264  THR   A HG21 1 c 1 
ATOM   3195  H  HG22 . THR   A  1  209 ? 23.273  15.871  6.160   1.000 30.486  0 264  THR   A HG22 1 c 1 
ATOM   3196  H  HG23 . THR   A  1  209 ? 23.273  15.044  4.800   1.000 30.249  0 264  THR   A HG23 1 c 1 
ATOM   3197  N  N    . LYS   A  1  210 ? 20.651  15.960  3.085   1.000 25.621  0 265  LYS   A N    1 ? 1 
ATOM   3198  C  CA   . LYS   A  1  210 ? 20.959  16.457  1.754   1.000 23.086  0 265  LYS   A CA   1 ? 1 
ATOM   3199  C  C    . LYS   A  1  210 ? 20.416  17.874  1.518   1.000 23.581  0 265  LYS   A C    1 ? 1 
ATOM   3200  O  O    . LYS   A  1  210 ? 20.945  18.598  0.697   1.000 22.403  0 265  LYS   A O    1 ? 1 
ATOM   3201  C  CB   . LYS   A  1  210 ? 20.436  15.469  0.673   1.000 22.066  0 265  LYS   A CB   1 ? 1 
ATOM   3202  C  CG   . LYS   A  1  210 ? 21.380  14.276  0.419   1.000 26.281  0 265  LYS   A CG   1 ? 1 
ATOM   3203  C  CD   . LYS   A  1  210 ? 20.838  13.344  -0.659  1.000 34.483  0 265  LYS   A CD   1 ? 1 
ATOM   3204  C  CE   . LYS   A  1  210 ? 21.728  12.163  -1.013  1.000 34.463  0 265  LYS   A CE   1 ? 1 
ATOM   3205  N  NZ   . LYS   A  1  210 ? 23.084  12.564  -1.509  1.000 30.620  0 265  LYS   A NZ   1 ? 1 
ATOM   3206  H  H    . LYS   A  1  210 ? 20.120  15.222  3.177   1.000 24.209  0 265  LYS   A H    1 c 1 
ATOM   3207  H  HA   . LYS   A  1  210 ? 21.941  16.497  1.675   1.000 24.006  0 265  LYS   A HA   1 c 1 
ATOM   3208  H  HB2  . LYS   A  1  210 ? 19.562  15.126  0.954   1.000 22.544  0 265  LYS   A HB2  1 c 1 
ATOM   3209  H  HB3  . LYS   A  1  210 ? 20.313  15.957  -0.168  1.000 23.171  0 265  LYS   A HB3  1 c 1 
ATOM   3210  H  HG2  . LYS   A  1  210 ? 22.258  14.615  0.144   1.000 27.362  0 265  LYS   A HG2  1 c 1 
ATOM   3211  H  HG3  . LYS   A  1  210 ? 21.494  13.774  1.254   1.000 26.693  0 265  LYS   A HG3  1 c 1 
ATOM   3212  H  HD2  . LYS   A  1  210 ? 19.969  12.998  -0.363  1.000 31.611  0 265  LYS   A HD2  1 c 1 
ATOM   3213  H  HD3  . LYS   A  1  210 ? 20.683  13.868  -1.474  1.000 32.242  0 265  LYS   A HD3  1 c 1 
ATOM   3214  H  HE2  . LYS   A  1  210 ? 21.839  11.598  -0.224  1.000 33.205  0 265  LYS   A HE2  1 c 1 
ATOM   3215  H  HE3  . LYS   A  1  210 ? 21.291  11.627  -1.701  1.000 33.086  0 265  LYS   A HE3  1 c 1 
ATOM   3216  H  HZ1  . LYS   A  1  210 ? 23.573  12.908  -0.827  1.000 32.145  0 265  LYS   A HZ1  1 c 1 
ATOM   3217  H  HZ2  . LYS   A  1  210 ? 23.002  13.188  -2.162  1.000 32.104  0 265  LYS   A HZ2  1 c 1 
ATOM   3218  H  HZ3  . LYS   A  1  210 ? 23.512  11.838  -1.842  1.000 32.049  0 265  LYS   A HZ3  1 c 1 
ATOM   3219  N  N    . GLN   A  1  211 ? 19.358  18.276  2.227   1.000 22.831  0 266  GLN   A N    1 ? 1 
ATOM   3220  C  CA   . GLN   A  1  211 ? 18.742  19.576  2.030   1.000 25.180  0 266  GLN   A CA   1 ? 1 
ATOM   3221  C  C    . GLN   A  1  211 ? 19.049  20.533  3.181   1.000 27.363  0 266  GLN   A C    1 ? 1 
ATOM   3222  O  O    . GLN   A  1  211 ? 18.388  21.554  3.318   1.000 25.275  0 266  GLN   A O    1 ? 1 
ATOM   3223  C  CB   . GLN   A  1  211 ? 17.220  19.424  1.826   1.000 21.386  0 266  GLN   A CB   1 ? 1 
ATOM   3224  C  CG   . GLN   A  1  211 ? 16.916  18.809  0.529   1.000 22.021  0 266  GLN   A CG   1 ? 1 
ATOM   3225  C  CD   . GLN   A  1  211 ? 15.446  18.426  0.332   1.000 25.091  0 266  GLN   A CD   1 ? 1 
ATOM   3226  O  OE1  . GLN   A  1  211 ? 14.543  19.260  0.458   1.000 26.699  0 266  GLN   A OE1  1 ? 1 
ATOM   3227  N  NE2  . GLN   A  1  211 ? 15.174  17.130  0.047   1.000 25.332  0 266  GLN   A NE2  1 ? 1 
ATOM   3228  H  H    . GLN   A  1  211 ? 18.996  17.713  2.847   1.000 23.041  0 266  GLN   A H    1 c 1 
ATOM   3229  H  HA   . GLN   A  1  211 ? 19.118  19.966  1.208   1.000 24.706  0 266  GLN   A HA   1 c 1 
ATOM   3230  H  HB2  . GLN   A  1  211 ? 16.856  18.869  2.546   1.000 21.955  0 266  GLN   A HB2  1 c 1 
ATOM   3231  H  HB3  . GLN   A  1  211 ? 16.799  20.307  1.876   1.000 22.439  0 266  GLN   A HB3  1 c 1 
ATOM   3232  H  HG2  . GLN   A  1  211 ? 17.173  19.434  -0.182  1.000 22.919  0 266  GLN   A HG2  1 c 1 
ATOM   3233  H  HG3  . GLN   A  1  211 ? 17.466  18.004  0.425   1.000 22.540  0 266  GLN   A HG3  1 c 1 
ATOM   3234  H  HE21 . GLN   A  1  211 ? 15.834  16.550  -0.058  1.000 25.091  0 266  GLN   A HE21 1 c 1 
ATOM   3235  H  HE22 . GLN   A  1  211 ? 14.336  16.862  -0.034  1.000 24.754  0 266  GLN   A HE22 1 c 1 
ATOM   3236  N  N    . GLY   A  1  212 ? 20.096  20.231  3.953   1.000 28.686  0 267  GLY   A N    1 ? 1 
ATOM   3237  C  CA   . GLY   A  1  212 ? 20.606  21.144  4.970   1.000 25.560  0 267  GLY   A CA   1 ? 1 
ATOM   3238  C  C    . GLY   A  1  212 ? 19.819  21.139  6.277   1.000 28.377  0 267  GLY   A C    1 ? 1 
ATOM   3239  O  O    . GLY   A  1  212 ? 19.903  22.090  7.035   1.000 29.256  0 267  GLY   A O    1 ? 1 
ATOM   3240  H  H    . GLY   A  1  212 ? 20.512  19.424  3.847   1.000 27.370  0 267  GLY   A H    1 c 1 
ATOM   3241  H  HA2  . GLY   A  1  212 ? 21.547  20.905  5.163   1.000 27.367  0 267  GLY   A HA2  1 c 1 
ATOM   3242  H  HA3  . GLY   A  1  212 ? 20.605  22.063  4.600   1.000 27.390  0 267  GLY   A HA3  1 c 1 
ATOM   3243  N  N    . VAL   A  1  213 ? 19.062  20.062  6.530   1.000 23.352  0 268  VAL   A N    1 ? 1 
ATOM   3244  C  CA   . VAL   A  1  213 ? 18.242  19.906  7.722   1.000 22.504  0 268  VAL   A CA   1 ? 1 
ATOM   3245  C  C    . VAL   A  1  213 ? 18.830  18.748  8.522   1.000 27.116  0 268  VAL   A C    1 ? 1 
ATOM   3246  O  O    . VAL   A  1  213 ? 18.965  17.625  8.020   1.000 20.252  0 268  VAL   A O    1 ? 1 
ATOM   3247  C  CB   . VAL   A  1  213 ? 16.775  19.635  7.320   1.000 29.353  0 268  VAL   A CB   1 ? 1 
ATOM   3248  C  CG1  . VAL   A  1  213 ? 15.919  19.282  8.530   1.000 28.331  0 268  VAL   A CG1  1 ? 1 
ATOM   3249  C  CG2  . VAL   A  1  213 ? 16.186  20.821  6.527   1.000 25.082  0 268  VAL   A CG2  1 ? 1 
ATOM   3250  H  H    . VAL   A  1  213 ? 19.064  19.380  5.922   1.000 23.931  0 268  VAL   A H    1 c 1 
ATOM   3251  H  HA   . VAL   A  1  213 ? 18.284  20.721  8.252   1.000 24.952  0 268  VAL   A HA   1 c 1 
ATOM   3252  H  HB   . VAL   A  1  213 ? 16.777  18.849  6.720   1.000 26.386  0 268  VAL   A HB   1 c 1 
ATOM   3253  H  HG11 . VAL   A  1  213 ? 16.047  19.954  9.221   1.000 28.777  0 268  VAL   A HG11 1 c 1 
ATOM   3254  H  HG12 . VAL   A  1  213 ? 16.179  18.410  8.873   1.000 28.323  0 268  VAL   A HG12 1 c 1 
ATOM   3255  H  HG13 . VAL   A  1  213 ? 14.982  19.260  8.269   1.000 28.174  0 268  VAL   A HG13 1 c 1 
ATOM   3256  H  HG21 . VAL   A  1  213 ? 15.234  20.678  6.386   1.000 25.936  0 268  VAL   A HG21 1 c 1 
ATOM   3257  H  HG22 . VAL   A  1  213 ? 16.634  20.892  5.667   1.000 26.426  0 268  VAL   A HG22 1 c 1 
ATOM   3258  H  HG23 . VAL   A  1  213 ? 16.318  21.644  7.029   1.000 26.719  0 268  VAL   A HG23 1 c 1 
ATOM   3259  N  N    . ARG   A  1  214 ? 19.220  19.036  9.772   1.000 28.132  0 269  ARG   A N    1 ? 1 
ATOM   3260  C  CA   . ARG   A  1  214 ? 19.933  18.059  10.583  1.000 29.969  0 269  ARG   A CA   1 ? 1 
ATOM   3261  C  C    . ARG   A  1  214 ? 18.971  17.030  11.181  1.000 21.967  0 269  ARG   A C    1 ? 1 
ATOM   3262  O  O    . ARG   A  1  214 ? 17.852  17.369  11.543  1.000 20.937  0 269  ARG   A O    1 ? 1 
ATOM   3263  C  CB   . ARG   A  1  214 ? 20.780  18.780  11.646  1.000 37.177  0 269  ARG   A CB   1 ? 1 
ATOM   3264  C  CG   . ARG   A  1  214 ? 21.773  17.835  12.305  1.000 71.731  0 269  ARG   A CG   1 ? 1 
ATOM   3265  C  CD   . ARG   A  1  214 ? 22.934  18.535  12.967  1.000 68.048  0 269  ARG   A CD   1 ? 1 
ATOM   3266  N  NE   . ARG   A  1  214 ? 23.937  17.568  13.393  1.000 72.094  0 269  ARG   A NE   1 ? 1 
ATOM   3267  C  CZ   . ARG   A  1  214 ? 24.923  17.833  14.235  1.000 61.983  0 269  ARG   A CZ   1 ? 1 
ATOM   3268  N  NH1  . ARG   A  1  214 ? 24.954  18.959  14.925  1.000 55.540  0 269  ARG   A NH1  1 ? 1 
ATOM   3269  N  NH2  . ARG   A  1  214 ? 25.887  16.932  14.409  1.000 60.329  0 269  ARG   A NH2  1 ? 1 
ATOM   3270  H  H    . ARG   A  1  214 ? 19.034  19.857  10.129  1.000 28.540  0 269  ARG   A H    1 c 1 
ATOM   3271  H  HA   . ARG   A  1  214 ? 20.551  17.580  9.986   1.000 28.983  0 269  ARG   A HA   1 c 1 
ATOM   3272  H  HB2  . ARG   A  1  214 ? 21.267  19.514  11.218  1.000 41.583  0 269  ARG   A HB2  1 c 1 
ATOM   3273  H  HB3  . ARG   A  1  214 ? 20.189  19.159  12.326  1.000 40.788  0 269  ARG   A HB3  1 c 1 
ATOM   3274  H  HG2  . ARG   A  1  214 ? 21.303  17.300  12.980  1.000 59.515  0 269  ARG   A HG2  1 c 1 
ATOM   3275  H  HG3  . ARG   A  1  214 ? 22.124  17.218  11.629  1.000 59.225  0 269  ARG   A HG3  1 c 1 
ATOM   3276  H  HD2  . ARG   A  1  214 ? 23.340  19.162  12.335  1.000 69.824  0 269  ARG   A HD2  1 c 1 
ATOM   3277  H  HD3  . ARG   A  1  214 ? 22.611  19.042  13.741  1.000 69.093  0 269  ARG   A HD3  1 c 1 
ATOM   3278  H  HE   . ARG   A  1  214 ? 23.885  16.758  13.073  1.000 68.002  0 269  ARG   A HE   1 c 1 
ATOM   3279  H  HH11 . ARG   A  1  214 ? 24.548  19.675  14.612  1.000 56.884  0 269  ARG   A HH11 1 c 1 
ATOM   3280  H  HH12 . ARG   A  1  214 ? 25.387  18.989  15.696  1.000 57.809  0 269  ARG   A HH12 1 c 1 
ATOM   3281  H  HH21 . ARG   A  1  214 ? 26.535  17.091  14.982  1.000 61.359  0 269  ARG   A HH21 1 c 1 
ATOM   3282  H  HH22 . ARG   A  1  214 ? 25.876  16.182  13.952  1.000 60.786  0 269  ARG   A HH22 1 c 1 
ATOM   3283  N  N    . ALA   A  1  215 ? 19.374  15.751  11.183  1.000 20.228  0 270  ALA   A N    1 ? 1 
ATOM   3284  C  CA   . ALA   A  1  215 ? 18.593  14.699  11.819  1.000 19.820  0 270  ALA   A CA   1 ? 1 
ATOM   3285  C  C    . ALA   A  1  215 ? 19.315  14.152  13.047  1.000 19.804  0 270  ALA   A C    1 ? 1 
ATOM   3286  O  O    . ALA   A  1  215 ? 20.541  14.116  13.089  1.000 21.445  0 270  ALA   A O    1 ? 1 
ATOM   3287  C  CB   . ALA   A  1  215 ? 18.316  13.578  10.866  1.000 23.489  0 270  ALA   A CB   1 ? 1 
ATOM   3288  H  H    . ALA   A  1  215 ? 20.161  15.528  10.775  1.000 20.914  0 270  ALA   A H    1 c 1 
ATOM   3289  H  HA   . ALA   A  1  215 ? 17.734  15.081  12.110  1.000 20.227  0 270  ALA   A HA   1 c 1 
ATOM   3290  H  HB1  . ALA   A  1  215 ? 17.770  12.904  11.305  1.000 21.775  0 270  ALA   A HB1  1 c 1 
ATOM   3291  H  HB2  . ALA   A  1  215 ? 17.843  13.920  10.089  1.000 21.879  0 270  ALA   A HB2  1 c 1 
ATOM   3292  H  HB3  . ALA   A  1  215 ? 19.155  13.178  10.582  1.000 22.292  0 270  ALA   A HB3  1 c 1 
ATOM   3293  N  N    . GLY   A  1  216 ? 18.547  13.810  14.076  1.000 19.272  0 271  GLY   A N    1 ? 1 
ATOM   3294  C  CA   . GLY   A  1  216 ? 19.060  12.992  15.172  1.000 21.641  0 271  GLY   A CA   1 ? 1 
ATOM   3295  C  C    . GLY   A  1  216 ? 19.169  11.546  14.691  1.000 22.602  0 271  GLY   A C    1 ? 1 
ATOM   3296  O  O    . GLY   A  1  216 ? 18.524  11.168  13.720  1.000 29.245  0 271  GLY   A O    1 ? 1 
ATOM   3297  H  H    . GLY   A  1  216 ? 17.677  14.092  14.105  1.000 19.551  0 271  GLY   A H    1 c 1 
ATOM   3298  H  HA2  . GLY   A  1  216 ? 19.949  13.325  15.450  1.000 21.930  0 271  GLY   A HA2  1 c 1 
ATOM   3299  H  HA3  . GLY   A  1  216 ? 18.441  13.045  15.943  1.000 21.296  0 271  GLY   A HA3  1 c 1 
ATOM   3300  N  N    . THR   A  1  217 ? 19.972  10.737  15.380  1.000 31.447  0 272  THR   A N    1 ? 1 
ATOM   3301  C  CA   . THR   A  1  217 ? 20.082  9.332   15.040  1.000 27.515  0 272  THR   A CA   1 ? 1 
ATOM   3302  C  C    . THR   A  1  217 ? 18.742  8.670   15.352  1.000 27.818  0 272  THR   A C    1 ? 1 
ATOM   3303  O  O    . THR   A  1  217 ? 18.242  8.761   16.474  1.000 28.770  0 272  THR   A O    1 ? 1 
ATOM   3304  C  CB   . THR   A  1  217 ? 21.267  8.711   15.782  1.000 29.688  0 272  THR   A CB   1 ? 1 
ATOM   3305  O  OG1  . THR   A  1  217 ? 22.439  9.513   15.554  1.000 31.796  0 272  THR   A OG1  1 ? 1 
ATOM   3306  C  CG2  . THR   A  1  217 ? 21.523  7.275   15.333  1.000 30.710  0 272  THR   A CG2  1 ? 1 
ATOM   3307  H  H    . THR   A  1  217 ? 20.462  11.067  16.077  1.000 28.466  0 272  THR   A H    1 c 1 
ATOM   3308  H  HA   . THR   A  1  217 ? 20.251  9.265   14.072  1.000 28.532  0 272  THR   A HA   1 c 1 
ATOM   3309  H  HB   . THR   A  1  217 ? 21.063  8.712   16.746  1.000 29.954  0 272  THR   A HB   1 c 1 
ATOM   3310  H  HG1  . THR   A  1  217 ? 22.592  9.530   14.710  0.000 21.020  0 272  THR   A HG1  1 c 1 
ATOM   3311  H  HG21 . THR   A  1  217 ? 22.367  6.965   15.705  1.000 30.913  0 272  THR   A HG21 1 c 1 
ATOM   3312  H  HG22 . THR   A  1  217 ? 21.563  7.239   14.361  1.000 30.234  0 272  THR   A HG22 1 c 1 
ATOM   3313  H  HG23 . THR   A  1  217 ? 20.802  6.702   15.649  1.000 30.114  0 272  THR   A HG23 1 c 1 
ATOM   3314  N  N    . PHE   A  1  218 ? 18.139  8.067   14.325  1.000 27.466  0 273  PHE   A N    1 ? 1 
ATOM   3315  C  CA   . PHE   A  1  218 ? 16.856  7.382   14.437  1.000 29.575  0 273  PHE   A CA   1 ? 1 
ATOM   3316  C  C    . PHE   A  1  218 ? 16.920  6.013   15.108  1.000 31.150  0 273  PHE   A C    1 ? 1 
ATOM   3317  O  O    . PHE   A  1  218 ? 15.884  5.471   15.500  1.000 22.737  0 273  PHE   A O    1 ? 1 
ATOM   3318  C  CB   . PHE   A  1  218 ? 16.267  7.129   13.036  1.000 26.693  0 273  PHE   A CB   1 ? 1 
ATOM   3319  C  CG   . PHE   A  1  218 ? 15.500  8.265   12.386  1.000 28.192  0 273  PHE   A CG   1 ? 1 
ATOM   3320  C  CD1  . PHE   A  1  218 ? 15.934  9.568   12.500  1.000 29.099  0 273  PHE   A CD1  1 ? 1 
ATOM   3321  C  CD2  . PHE   A  1  218 ? 14.372  8.007   11.607  1.000 30.521  0 273  PHE   A CD2  1 ? 1 
ATOM   3322  C  CE1  . PHE   A  1  218 ? 15.238  10.601  11.899  1.000 31.442  0 273  PHE   A CE1  1 ? 1 
ATOM   3323  C  CE2  . PHE   A  1  218 ? 13.686  9.040   11.001  1.000 31.661  0 273  PHE   A CE2  1 ? 1 
ATOM   3324  C  CZ   . PHE   A  1  218 ? 14.118  10.333  11.163  1.000 29.572  0 273  PHE   A CZ   1 ? 1 
ATOM   3325  H  H    . PHE   A  1  218 ? 18.550  8.082   13.509  1.000 27.997  0 273  PHE   A H    1 c 1 
ATOM   3326  H  HA   . PHE   A  1  218 ? 16.231  7.956   14.948  1.000 28.744  0 273  PHE   A HA   1 c 1 
ATOM   3327  H  HB2  . PHE   A  1  218 ? 17.004  6.878   12.441  1.000 27.751  0 273  PHE   A HB2  1 c 1 
ATOM   3328  H  HB3  . PHE   A  1  218 ? 15.669  6.355   13.095  1.000 27.385  0 273  PHE   A HB3  1 c 1 
ATOM   3329  H  HD1  . PHE   A  1  218 ? 16.695  9.761   13.018  1.000 29.865  0 273  PHE   A HD1  1 c 1 
ATOM   3330  H  HD2  . PHE   A  1  218 ? 14.067  7.119   11.507  1.000 29.872  0 273  PHE   A HD2  1 c 1 
ATOM   3331  H  HE1  . PHE   A  1  218 ? 15.535  11.491  12.000  1.000 30.756  0 273  PHE   A HE1  1 c 1 
ATOM   3332  H  HE2  . PHE   A  1  218 ? 12.912  8.859   10.492  1.000 30.418  0 273  PHE   A HE2  1 c 1 
ATOM   3333  H  HZ   . PHE   A  1  218 ? 13.653  11.038  10.744  1.000 30.306  0 273  PHE   A HZ   1 c 1 
ATOM   3334  N  N    . PHE   A  1  219 ? 18.131  5.437   15.182  1.000 32.935  0 274  PHE   A N    1 ? 1 
ATOM   3335  C  CA   . PHE   A  1  219 ? 18.290  4.056   15.610  1.000 30.501  0 274  PHE   A CA   1 ? 1 
ATOM   3336  C  C    . PHE   A  1  219 ? 18.854  4.045   17.033  1.000 28.166  0 274  PHE   A C    1 ? 1 
ATOM   3337  O  O    . PHE   A  1  219 ? 19.599  4.941   17.416  1.000 23.360  0 274  PHE   A O    1 ? 1 
ATOM   3338  C  CB   . PHE   A  1  219 ? 19.195  3.293   14.628  1.000 33.337  0 274  PHE   A CB   1 ? 1 
ATOM   3339  C  CG   . PHE   A  1  219 ? 19.158  3.878   13.237  1.000 33.618  0 274  PHE   A CG   1 ? 1 
ATOM   3340  C  CD1  . PHE   A  1  219 ? 18.076  3.671   12.409  1.000 34.459  0 274  PHE   A CD1  1 ? 1 
ATOM   3341  C  CD2  . PHE   A  1  219 ? 20.188  4.670   12.779  1.000 28.521  0 274  PHE   A CD2  1 ? 1 
ATOM   3342  C  CE1  . PHE   A  1  219 ? 18.028  4.251   11.155  1.000 30.508  0 274  PHE   A CE1  1 ? 1 
ATOM   3343  C  CE2  . PHE   A  1  219 ? 20.142  5.241   11.519  1.000 33.829  0 274  PHE   A CE2  1 ? 1 
ATOM   3344  C  CZ   . PHE   A  1  219 ? 19.063  5.020   10.714  1.000 26.868  0 274  PHE   A CZ   1 ? 1 
ATOM   3345  H  H    . PHE   A  1  219 ? 18.876  5.919   14.967  1.000 32.158  0 274  PHE   A H    1 c 1 
ATOM   3346  H  HA   . PHE   A  1  219 ? 17.401  3.620   15.622  1.000 30.348  0 274  PHE   A HA   1 c 1 
ATOM   3347  H  HB2  . PHE   A  1  219 ? 20.116  3.313   14.964  1.000 33.197  0 274  PHE   A HB2  1 c 1 
ATOM   3348  H  HB3  . PHE   A  1  219 ? 18.904  2.358   14.593  1.000 32.688  0 274  PHE   A HB3  1 c 1 
ATOM   3349  H  HD1  . PHE   A  1  219 ? 17.359  3.146   12.708  1.000 32.954  0 274  PHE   A HD1  1 c 1 
ATOM   3350  H  HD2  . PHE   A  1  219 ? 20.932  4.831   13.337  1.000 31.365  0 274  PHE   A HD2  1 c 1 
ATOM   3351  H  HE1  . PHE   A  1  219 ? 17.287  4.090   10.592  1.000 29.931  0 274  PHE   A HE1  1 c 1 
ATOM   3352  H  HE2  . PHE   A  1  219 ? 20.860  5.774   11.215  1.000 31.182  0 274  PHE   A HE2  1 c 1 
ATOM   3353  H  HZ   . PHE   A  1  219 ? 19.036  5.399   9.853   1.000 28.933  0 274  PHE   A HZ   1 c 1 
ATOM   3354  N  N    . TRP   A  1  220 ? 18.495  3.011   17.798  1.000 25.920  0 275  TRP   A N    1 ? 1 
ATOM   3355  C  CA   . TRP   A  1  220 ? 18.872  2.894   19.200  1.000 21.575  0 275  TRP   A CA   1 ? 1 
ATOM   3356  C  C    . TRP   A  1  220 ? 19.208  1.440   19.516  1.000 22.978  0 275  TRP   A C    1 ? 1 
ATOM   3357  O  O    . TRP   A  1  220 ? 18.404  0.565   19.224  1.000 23.605  0 275  TRP   A O    1 ? 1 
ATOM   3358  C  CB   . TRP   A  1  220 ? 17.712  3.330   20.098  1.000 20.393  0 275  TRP   A CB   1 ? 1 
ATOM   3359  C  CG   . TRP   A  1  220 ? 17.217  4.718   19.837  1.000 20.929  0 275  TRP   A CG   1 ? 1 
ATOM   3360  C  CD1  . TRP   A  1  220 ? 16.283  5.094   18.915  1.000 20.524  0 275  TRP   A CD1  1 ? 1 
ATOM   3361  C  CD2  . TRP   A  1  220 ? 17.663  5.919   20.471  1.000 17.909  0 275  TRP   A CD2  1 ? 1 
ATOM   3362  N  NE1  . TRP   A  1  220 ? 16.107  6.452   18.949  1.000 20.674  0 275  TRP   A NE1  1 ? 1 
ATOM   3363  C  CE2  . TRP   A  1  220 ? 16.957  6.988   19.883  1.000 23.500  0 275  TRP   A CE2  1 ? 1 
ATOM   3364  C  CE3  . TRP   A  1  220 ? 18.630  6.206   21.442  1.000 24.078  0 275  TRP   A CE3  1 ? 1 
ATOM   3365  C  CZ2  . TRP   A  1  220 ? 17.152  8.313   20.270  1.000 22.061  0 275  TRP   A CZ2  1 ? 1 
ATOM   3366  C  CZ3  . TRP   A  1  220 ? 18.816  7.519   21.838  1.000 22.810  0 275  TRP   A CZ3  1 ? 1 
ATOM   3367  C  CH2  . TRP   A  1  220 ? 18.091  8.561   21.235  1.000 23.174  0 275  TRP   A CH2  1 ? 1 
ATOM   3368  H  H    . TRP   A  1  220 ? 17.990  2.345   17.428  1.000 24.917  0 275  TRP   A H    1 c 1 
ATOM   3369  H  HA   . TRP   A  1  220 ? 19.653  3.468   19.378  1.000 22.796  0 275  TRP   A HA   1 c 1 
ATOM   3370  H  HB2  . TRP   A  1  220 ? 16.973  2.700   19.974  1.000 20.521  0 275  TRP   A HB2  1 c 1 
ATOM   3371  H  HB3  . TRP   A  1  220 ? 18.006  3.266   21.030  1.000 21.179  0 275  TRP   A HB3  1 c 1 
ATOM   3372  H  HD1  . TRP   A  1  220 ? 15.799  4.504   18.358  1.000 20.195  0 275  TRP   A HD1  1 c 1 
ATOM   3373  H  HE1  . TRP   A  1  220 ? 15.546  6.904   18.449  1.000 20.828  0 275  TRP   A HE1  1 c 1 
ATOM   3374  H  HE3  . TRP   A  1  220 ? 19.121  5.509   21.848  1.000 22.499  0 275  TRP   A HE3  1 c 1 
ATOM   3375  H  HZ2  . TRP   A  1  220 ? 16.660  9.012   19.874  1.000 22.296  0 275  TRP   A HZ2  1 c 1 
ATOM   3376  H  HZ3  . TRP   A  1  220 ? 19.455  7.721   22.503  1.000 23.753  0 275  TRP   A HZ3  1 c 1 
ATOM   3377  H  HH2  . TRP   A  1  220 ? 18.232  9.447   21.521  1.000 23.107  0 275  TRP   A HH2  1 c 1 
ATOM   3378  N  N    . SER   A  1  221 ? 20.398  1.191   20.083  1.000 23.512  0 276  SER   A N    1 ? 1 
ATOM   3379  C  CA   . SER   A  1  221 ? 20.736  -0.124  20.601  1.000 23.860  0 276  SER   A CA   1 ? 1 
ATOM   3380  C  C    . SER   A  1  221 ? 19.724  -0.580  21.650  1.000 25.344  0 276  SER   A C    1 ? 1 
ATOM   3381  O  O    . SER   A  1  221 ? 19.233  0.244   22.420  1.000 24.460  0 276  SER   A O    1 ? 1 
ATOM   3382  C  CB   . SER   A  1  221 ? 22.145  -0.136  21.181  1.000 27.427  0 276  SER   A CB   1 ? 1 
ATOM   3383  O  OG   . SER   A  1  221 ? 23.074  0.179   20.161  1.000 41.991  0 276  SER   A OG   1 ? 1 
ATOM   3384  H  H    . SER   A  1  221 ? 21.016  1.862   20.145  1.000 23.797  0 276  SER   A H    1 c 1 
ATOM   3385  H  HA   . SER   A  1  221 ? 20.705  -0.765  19.843  1.000 24.588  0 276  SER   A HA   1 c 1 
ATOM   3386  H  HB2  . SER   A  1  221 ? 22.211  0.524   21.908  1.000 29.623  0 276  SER   A HB2  1 c 1 
ATOM   3387  H  HB3  . SER   A  1  221 ? 22.344  -1.024  21.548  1.000 29.852  0 276  SER   A HB3  1 c 1 
ATOM   3388  H  HG   . SER   A  1  221 ? 23.191  1.011   20.150  0.000 27.930  0 276  SER   A HG   1 c 1 
ATOM   3389  N  N    . VAL   A  1  222 ? 19.420  -1.890  21.671  1.000 29.525  0 277  VAL   A N    1 ? 1 
ATOM   3390  C  CA   . VAL   A  1  222 ? 18.355  -2.424  22.515  1.000 37.290  0 277  VAL   A CA   1 ? 1 
ATOM   3391  C  C    . VAL   A  1  222 ? 18.603  -2.151  23.997  1.000 32.476  0 277  VAL   A C    1 ? 1 
ATOM   3392  O  O    . VAL   A  1  222 ? 17.684  -1.820  24.731  1.000 37.618  0 277  VAL   A O    1 ? 1 
ATOM   3393  C  CB   . VAL   A  1  222 ? 18.130  -3.947  22.300  1.000 44.120  0 277  VAL   A CB   1 ? 1 
ATOM   3394  C  CG1  . VAL   A  1  222 ? 17.080  -4.477  23.255  1.000 51.361  0 277  VAL   A CG1  1 ? 1 
ATOM   3395  C  CG2  . VAL   A  1  222 ? 17.711  -4.245  20.888  1.000 57.865  0 277  VAL   A CG2  1 ? 1 
ATOM   3396  H  H    . VAL   A  1  222 ? 19.900  -2.467  21.150  1.000 30.180  0 277  VAL   A H    1 c 1 
ATOM   3397  H  HA   . VAL   A  1  222 ? 17.531  -1.967  22.266  1.000 34.956  0 277  VAL   A HA   1 c 1 
ATOM   3398  H  HB   . VAL   A  1  222 ? 18.983  -4.414  22.481  1.000 46.735  0 277  VAL   A HB   1 c 1 
ATOM   3399  H  HG11 . VAL   A  1  222 ? 16.322  -3.867  23.277  1.000 48.720  0 277  VAL   A HG11 1 c 1 
ATOM   3400  H  HG12 . VAL   A  1  222 ? 17.460  -4.555  24.148  1.000 49.439  0 277  VAL   A HG12 1 c 1 
ATOM   3401  H  HG13 . VAL   A  1  222 ? 16.780  -5.354  22.955  1.000 49.059  0 277  VAL   A HG13 1 c 1 
ATOM   3402  H  HG21 . VAL   A  1  222 ? 17.651  -5.208  20.763  1.000 52.981  0 277  VAL   A HG21 1 c 1 
ATOM   3403  H  HG22 . VAL   A  1  222 ? 18.365  -3.881  20.269  1.000 52.613  0 277  VAL   A HG22 1 c 1 
ATOM   3404  H  HG23 . VAL   A  1  222 ? 16.843  -3.842  20.715  1.000 52.487  0 277  VAL   A HG23 1 c 1 
ATOM   3405  N  N    . SER   A  1  223 ? 19.863  -2.211  24.417  1.000 28.075  0 278  SER   A N    1 ? 1 
ATOM   3406  C  CA   . SER   A  1  223 ? 20.207  -2.013  25.814  1.000 30.641  0 278  SER   A CA   1 ? 1 
ATOM   3407  C  C    . SER   A  1  223 ? 20.029  -0.585  26.321  1.000 32.880  0 278  SER   A C    1 ? 1 
ATOM   3408  O  O    . SER   A  1  223 ? 20.208  -0.355  27.505  1.000 33.191  0 278  SER   A O    1 ? 1 
ATOM   3409  C  CB   . SER   A  1  223 ? 21.647  -2.444  26.067  1.000 29.937  0 278  SER   A CB   1 ? 1 
ATOM   3410  O  OG   . SER   A  1  223 ? 22.594  -1.651  25.368  1.000 32.163  0 278  SER   A OG   1 ? 1 
ATOM   3411  H  H    . SER   A  1  223 ? 20.532  -2.377  23.818  1.000 29.948  0 278  SER   A H    1 c 1 
ATOM   3412  H  HA   . SER   A  1  223 ? 19.613  -2.601  26.354  1.000 30.464  0 278  SER   A HA   1 c 1 
ATOM   3413  H  HB2  . SER   A  1  223 ? 21.832  -2.389  27.031  1.000 31.250  0 278  SER   A HB2  1 c 1 
ATOM   3414  H  HB3  . SER   A  1  223 ? 21.752  -3.383  25.795  1.000 30.834  0 278  SER   A HB3  1 c 1 
ATOM   3415  H  HG   . SER   A  1  223 ? 22.821  -1.020  25.857  0.000 16.670  0 278  SER   A HG   1 c 1 
ATOM   3416  N  N    . ILE   A  1  224 ? 19.700  0.379   25.442  1.000 28.641  0 279  ILE   A N    1 ? 1 
ATOM   3417  C  CA   . ILE   A  1  224 ? 19.476  1.746   25.887  1.000 22.555  0 279  ILE   A CA   1 ? 1 
ATOM   3418  C  C    . ILE   A  1  224 ? 18.039  1.829   26.377  1.000 24.804  0 279  ILE   A C    1 ? 1 
ATOM   3419  O  O    . ILE   A  1  224 ? 17.135  1.689   25.574  1.000 25.347  0 279  ILE   A O    1 ? 1 
ATOM   3420  C  CB   . ILE   A  1  224 ? 19.760  2.812   24.810  1.000 22.914  0 279  ILE   A CB   1 ? 1 
ATOM   3421  C  CG1  . ILE   A  1  224 ? 21.178  2.721   24.275  1.000 26.187  0 279  ILE   A CG1  1 ? 1 
ATOM   3422  C  CG2  . ILE   A  1  224 ? 19.470  4.230   25.350  1.000 21.762  0 279  ILE   A CG2  1 ? 1 
ATOM   3423  C  CD1  . ILE   A  1  224 ? 21.426  3.461   23.030  1.000 28.103  0 279  ILE   A CD1  1 ? 1 
ATOM   3424  H  H    . ILE   A  1  224 ? 19.629  0.187   24.552  1.000 27.393  0 279  ILE   A H    1 c 1 
ATOM   3425  H  HA   . ILE   A  1  224 ? 20.068  1.921   26.637  1.000 24.757  0 279  ILE   A HA   1 c 1 
ATOM   3426  H  HB   . ILE   A  1  224 ? 19.144  2.645   24.054  1.000 22.530  0 279  ILE   A HB   1 c 1 
ATOM   3427  H  HG12 . ILE   A  1  224 ? 21.791  3.057   24.963  1.000 26.516  0 279  ILE   A HG12 1 c 1 
ATOM   3428  H  HG13 . ILE   A  1  224 ? 21.394  1.777   24.122  1.000 26.044  0 279  ILE   A HG13 1 c 1 
ATOM   3429  H  HG21 . ILE   A  1  224 ? 20.005  4.391   26.146  1.000 22.635  0 279  ILE   A HG21 1 c 1 
ATOM   3430  H  HG22 . ILE   A  1  224 ? 18.527  4.310   25.574  1.000 21.864  0 279  ILE   A HG22 1 c 1 
ATOM   3431  H  HG23 . ILE   A  1  224 ? 19.694  4.892   24.673  1.000 22.009  0 279  ILE   A HG23 1 c 1 
ATOM   3432  H  HD11 . ILE   A  1  224 ? 21.158  4.389   23.139  1.000 27.234  0 279  ILE   A HD11 1 c 1 
ATOM   3433  H  HD12 . ILE   A  1  224 ? 20.914  3.061   22.306  1.000 26.911  0 279  ILE   A HD12 1 c 1 
ATOM   3434  H  HD13 . ILE   A  1  224 ? 22.374  3.424   22.812  1.000 27.715  0 279  ILE   A HD13 1 c 1 
ATOM   3435  N  N    . PRO   A  1  225 ? 17.770  2.070   27.679  1.000 24.420  0 280  PRO   A N    1 ? 1 
ATOM   3436  C  CA   . PRO   A  1  225 ? 16.392  2.065   28.162  1.000 25.683  0 280  PRO   A CA   1 ? 1 
ATOM   3437  C  C    . PRO   A  1  225 ? 15.598  3.082   27.353  1.000 28.877  0 280  PRO   A C    1 ? 1 
ATOM   3438  O  O    . PRO   A  1  225 ? 16.144  4.093   26.904  1.000 24.888  0 280  PRO   A O    1 ? 1 
ATOM   3439  C  CB   . PRO   A  1  225 ? 16.506  2.470   29.643  1.000 27.734  0 280  PRO   A CB   1 ? 1 
ATOM   3440  C  CG   . PRO   A  1  225 ? 17.940  2.430   29.988  1.000 25.386  0 280  PRO   A CG   1 ? 1 
ATOM   3441  C  CD   . PRO   A  1  225 ? 18.748  2.430   28.723  1.000 25.974  0 280  PRO   A CD   1 ? 1 
ATOM   3442  H  HA   . PRO   A  1  225 ? 16.003  1.158   28.080  1.000 26.115  0 280  PRO   A HA   1 c 1 
ATOM   3443  H  HB2  . PRO   A  1  225 ? 16.148  3.373   29.782  1.000 26.628  0 280  PRO   A HB2  1 c 1 
ATOM   3444  H  HB3  . PRO   A  1  225 ? 16.002  1.848   30.209  1.000 26.818  0 280  PRO   A HB3  1 c 1 
ATOM   3445  H  HG2  . PRO   A  1  225 ? 18.175  3.208   30.534  1.000 26.537  0 280  PRO   A HG2  1 c 1 
ATOM   3446  H  HG3  . PRO   A  1  225 ? 18.136  1.625   30.509  1.000 26.575  0 280  PRO   A HG3  1 c 1 
ATOM   3447  H  HD2  . PRO   A  1  225 ? 19.133  3.309   28.552  1.000 25.635  0 280  PRO   A HD2  1 c 1 
ATOM   3448  H  HD3  . PRO   A  1  225 ? 19.468  1.773   28.770  1.000 25.926  0 280  PRO   A HD3  1 c 1 
ATOM   3449  N  N    . HIS   A  1  226 ? 14.303  2.819   27.215  1.000 23.779  0 281  HIS   A N    1 ? 1 
ATOM   3450  C  CA   . HIS   A  1  226 ? 13.411  3.733   26.536  1.000 24.449  0 281  HIS   A CA   1 ? 1 
ATOM   3451  C  C    . HIS   A  1  226 ? 13.499  5.137   27.148  1.000 23.922  0 281  HIS   A C    1 ? 1 
ATOM   3452  O  O    . HIS   A  1  226 ? 13.509  6.135   26.428  1.000 21.591  0 281  HIS   A O    1 ? 1 
ATOM   3453  C  CB   . HIS   A  1  226 ? 11.983  3.136   26.562  1.000 22.766  0 281  HIS   A CB   1 ? 1 
ATOM   3454  C  CG   . HIS   A  1  226 ? 11.902  1.808   25.878  1.000 27.627  0 281  HIS   A CG   1 ? 1 
ATOM   3455  N  ND1  . HIS   A  1  226 ? 11.070  0.786   26.347  1.000 36.021  0 281  HIS   A ND1  1 ? 1 
ATOM   3456  C  CD2  . HIS   A  1  226 ? 12.540  1.368   24.779  1.000 31.575  0 281  HIS   A CD2  1 ? 1 
ATOM   3457  C  CE1  . HIS   A  1  226 ? 11.227  -0.234  25.515  1.000 41.793  0 281  HIS   A CE1  1 ? 1 
ATOM   3458  N  NE2  . HIS   A  1  226 ? 12.087  0.064   24.546  1.000 29.807  0 281  HIS   A NE2  1 ? 1 
ATOM   3459  H  H    . HIS   A  1  226 ? 13.962  2.047   27.565  1.000 25.138  0 281  HIS   A H    1 c 1 
ATOM   3460  H  HA   . HIS   A  1  226 ? 13.702  3.787   25.595  1.000 23.529  0 281  HIS   A HA   1 c 1 
ATOM   3461  H  HB2  . HIS   A  1  226 ? 11.698  3.033   27.493  1.000 24.468  0 281  HIS   A HB2  1 c 1 
ATOM   3462  H  HB3  . HIS   A  1  226 ? 11.370  3.759   26.121  1.000 23.819  0 281  HIS   A HB3  1 c 1 
ATOM   3463  H  HD1  . HIS   A  1  226 ? 10.527  0.841   27.033  0.000 24.090  0 281  HIS   A HD1  1 c 1 
ATOM   3464  H  HD2  . HIS   A  1  226 ? 13.154  1.857   24.253  1.000 30.111  0 281  HIS   A HD2  1 c 1 
ATOM   3465  H  HE1  . HIS   A  1  226 ? 10.781  -1.061  25.596  1.000 37.021  0 281  HIS   A HE1  1 c 1 
ATOM   3466  H  HE2  . HIS   A  1  226 ? 12.341  -0.478  23.884  0.000 18.920  0 281  HIS   A HE2  1 c 1 
ATOM   3467  N  N    . GLU   A  1  227 ? 13.574  5.223   28.482  1.000 23.765  0 282  GLU   A N    1 ? 1 
ATOM   3468  C  CA   . GLU   A  1  227 ? 13.550  6.513   29.160  1.000 23.696  0 282  GLU   A CA   1 ? 1 
ATOM   3469  C  C    . GLU   A  1  227 ? 14.771  7.342   28.793  1.000 21.404  0 282  GLU   A C    1 ? 1 
ATOM   3470  O  O    . GLU   A  1  227 ? 14.666  8.550   28.703  1.000 27.548  0 282  GLU   A O    1 ? 1 
ATOM   3471  C  CB   . GLU   A  1  227 ? 13.453  6.353   30.675  1.000 27.191  0 282  GLU   A CB   1 ? 1 
ATOM   3472  C  CG   . GLU   A  1  227 ? 12.234  5.605   31.103  1.000 34.209  0 282  GLU   A CG   1 ? 1 
ATOM   3473  C  CD   . GLU   A  1  227 ? 12.352  4.086   31.197  1.000 36.560  0 282  GLU   A CD   1 ? 1 
ATOM   3474  O  OE1  . GLU   A  1  227 ? 13.317  3.450   30.687  1.000 27.727  0 282  GLU   A OE1  1 ? 1 
ATOM   3475  O  OE2  . GLU   A  1  227 ? 11.445  3.546   31.866  1.000 35.447  0 282  GLU   A OE2  1 ? 1 
ATOM   3476  H  H    . GLU   A  1  227 ? 13.653  4.461   28.980  1.000 24.217  0 282  GLU   A H    1 c 1 
ATOM   3477  H  HA   . GLU   A  1  227 ? 12.749  6.998   28.852  1.000 23.466  0 282  GLU   A HA   1 c 1 
ATOM   3478  H  HB2  . GLU   A  1  227 ? 14.248  5.878   30.990  1.000 28.243  0 282  GLU   A HB2  1 c 1 
ATOM   3479  H  HB3  . GLU   A  1  227 ? 13.446  7.242   31.087  1.000 28.108  0 282  GLU   A HB3  1 c 1 
ATOM   3480  H  HG2  . GLU   A  1  227 ? 11.959  5.940   31.983  1.000 33.109  0 282  GLU   A HG2  1 c 1 
ATOM   3481  H  HG3  . GLU   A  1  227 ? 11.507  5.812   30.477  1.000 32.153  0 282  GLU   A HG3  1 c 1 
ATOM   3482  N  N    . ARG   A  1  228 ? 15.900  6.666   28.556  1.000 24.123  0 283  ARG   A N    1 ? 1 
ATOM   3483  C  CA   . ARG   A  1  228 ? 17.151  7.297   28.166  1.000 22.894  0 283  ARG   A CA   1 ? 1 
ATOM   3484  C  C    . ARG   A  1  228 ? 17.049  7.794   26.727  1.000 26.549  0 283  ARG   A C    1 ? 1 
ATOM   3485  O  O    . ARG   A  1  228 ? 17.510  8.896   26.417  1.000 21.405  0 283  ARG   A O    1 ? 1 
ATOM   3486  C  CB   . ARG   A  1  228 ? 18.326  6.315   28.395  1.000 23.540  0 283  ARG   A CB   1 ? 1 
ATOM   3487  C  CG   . ARG   A  1  228 ? 19.690  6.751   27.908  1.000 27.694  0 283  ARG   A CG   1 ? 1 
ATOM   3488  C  CD   . ARG   A  1  228 ? 20.172  8.062   28.520  1.000 33.068  0 283  ARG   A CD   1 ? 1 
ATOM   3489  N  NE   . ARG   A  1  228 ? 20.344  7.980   29.964  1.000 33.272  0 283  ARG   A NE   1 ? 1 
ATOM   3490  C  CZ   . ARG   A  1  228 ? 20.490  9.037   30.754  1.000 46.126  0 283  ARG   A CZ   1 ? 1 
ATOM   3491  N  NH1  . ARG   A  1  228 ? 20.370  10.272  30.281  1.000 36.151  0 283  ARG   A NH1  1 ? 1 
ATOM   3492  N  NH2  . ARG   A  1  228 ? 20.786  8.853   32.041  1.000 35.057  0 283  ARG   A NH2  1 ? 1 
ATOM   3493  H  H    . ARG   A  1  228 ? 15.892  5.758   28.655  1.000 23.156  0 283  ARG   A H    1 c 1 
ATOM   3494  H  HA   . ARG   A  1  228 ? 17.288  8.079   28.749  1.000 24.321  0 283  ARG   A HA   1 c 1 
ATOM   3495  H  HB2  . ARG   A  1  228 ? 18.387  6.138   29.357  1.000 24.719  0 283  ARG   A HB2  1 c 1 
ATOM   3496  H  HB3  . ARG   A  1  228 ? 18.102  5.469   27.956  1.000 23.999  0 283  ARG   A HB3  1 c 1 
ATOM   3497  H  HG2  . ARG   A  1  228 ? 20.342  6.049   28.119  1.000 27.932  0 283  ARG   A HG2  1 c 1 
ATOM   3498  H  HG3  . ARG   A  1  228 ? 19.666  6.849   26.932  1.000 27.219  0 283  ARG   A HG3  1 c 1 
ATOM   3499  H  HD2  . ARG   A  1  228 ? 21.027  8.312   28.109  1.000 31.933  0 283  ARG   A HD2  1 c 1 
ATOM   3500  H  HD3  . ARG   A  1  228 ? 19.523  8.768   28.313  1.000 31.473  0 283  ARG   A HD3  1 c 1 
ATOM   3501  H  HE   . ARG   A  1  228 ? 20.350  7.190   30.334  1.000 35.884  0 283  ARG   A HE   1 c 1 
ATOM   3502  H  HH11 . ARG   A  1  228 ? 20.852  10.526  29.588  1.000 38.687  0 283  ARG   A HH11 1 c 1 
ATOM   3503  H  HH12 . ARG   A  1  228 ? 19.811  10.835  30.666  1.000 38.828  0 283  ARG   A HH12 1 c 1 
ATOM   3504  H  HH21 . ARG   A  1  228 ? 20.749  9.533   32.599  1.000 38.432  0 283  ARG   A HH21 1 c 1 
ATOM   3505  H  HH22 . ARG   A  1  228 ? 21.017  8.055   32.330  1.000 38.269  0 283  ARG   A HH22 1 c 1 
ATOM   3506  N  N    . ARG   A  1  229 ? 16.372  7.017   25.869  1.000 24.592  0 284  ARG   A N    1 ? 1 
ATOM   3507  C  CA   . ARG   A  1  229 ? 16.152  7.438   24.497  1.000 21.040  0 284  ARG   A CA   1 ? 1 
ATOM   3508  C  C    . ARG   A  1  229 ? 15.419  8.778   24.476  1.000 20.346  0 284  ARG   A C    1 ? 1 
ATOM   3509  O  O    . ARG   A  1  229 ? 15.800  9.697   23.750  1.000 22.714  0 284  ARG   A O    1 ? 1 
ATOM   3510  C  CB   . ARG   A  1  229 ? 15.354  6.366   23.731  1.000 21.064  0 284  ARG   A CB   1 ? 1 
ATOM   3511  C  CG   . ARG   A  1  229 ? 16.089  5.046   23.711  1.000 24.077  0 284  ARG   A CG   1 ? 1 
ATOM   3512  C  CD   . ARG   A  1  229 ? 15.334  3.922   22.998  1.000 22.423  0 284  ARG   A CD   1 ? 1 
ATOM   3513  N  NE   . ARG   A  1  229 ? 15.861  2.601   23.349  1.000 19.971  0 284  ARG   A NE   1 ? 1 
ATOM   3514  C  CZ   . ARG   A  1  229 ? 15.640  1.480   22.675  1.000 22.492  0 284  ARG   A CZ   1 ? 1 
ATOM   3515  N  NH1  . ARG   A  1  229 ? 14.873  1.464   21.591  1.000 29.006  0 284  ARG   A NH1  1 ? 1 
ATOM   3516  N  NH2  . ARG   A  1  229 ? 16.180  0.341   23.112  1.000 21.987  0 284  ARG   A NH2  1 ? 1 
ATOM   3517  H  H    . ARG   A  1  229 ? 16.035  6.215   26.150  1.000 24.069  0 284  ARG   A H    1 c 1 
ATOM   3518  H  HA   . ARG   A  1  229 ? 17.029  7.552   24.064  1.000 21.702  0 284  ARG   A HA   1 c 1 
ATOM   3519  H  HB2  . ARG   A  1  229 ? 14.481  6.247   24.158  1.000 21.443  0 284  ARG   A HB2  1 c 1 
ATOM   3520  H  HB3  . ARG   A  1  229 ? 15.210  6.671   22.811  1.000 21.178  0 284  ARG   A HB3  1 c 1 
ATOM   3521  H  HG2  . ARG   A  1  229 ? 16.954  5.171   23.269  1.000 23.232  0 284  ARG   A HG2  1 c 1 
ATOM   3522  H  HG3  . ARG   A  1  229 ? 16.267  4.765   24.631  1.000 23.481  0 284  ARG   A HG3  1 c 1 
ATOM   3523  H  HD2  . ARG   A  1  229 ? 14.384  3.965   23.240  1.000 21.766  0 284  ARG   A HD2  1 c 1 
ATOM   3524  H  HD3  . ARG   A  1  229 ? 15.404  4.051   22.028  1.000 21.693  0 284  ARG   A HD3  1 c 1 
ATOM   3525  H  HE   . ARG   A  1  229 ? 16.361  2.545   24.062  1.000 21.644  0 284  ARG   A HE   1 c 1 
ATOM   3526  H  HH11 . ARG   A  1  229 ? 14.207  2.037   21.512  1.000 26.121  0 284  ARG   A HH11 1 c 1 
ATOM   3527  H  HH12 . ARG   A  1  229 ? 15.030  0.874   20.954  1.000 26.248  0 284  ARG   A HH12 1 c 1 
ATOM   3528  H  HH21 . ARG   A  1  229 ? 15.821  -0.428  22.883  1.000 22.227  0 284  ARG   A HH21 1 c 1 
ATOM   3529  H  HH22 . ARG   A  1  229 ? 16.893  0.363   23.626  1.000 22.671  0 284  ARG   A HH22 1 c 1 
ATOM   3530  N  N    . ILE   A  1  230 ? 14.364  8.888   25.285  1.000 19.238  0 285  ILE   A N    1 ? 1 
ATOM   3531  C  CA   . ILE   A  1  230 ? 13.573  10.107  25.348  1.000 21.727  0 285  ILE   A CA   1 ? 1 
ATOM   3532  C  C    . ILE   A  1  230 ? 14.380  11.280  25.893  1.000 18.888  0 285  ILE   A C    1 ? 1 
ATOM   3533  O  O    . ILE   A  1  230 ? 14.287  12.387  25.385  1.000 18.946  0 285  ILE   A O    1 ? 1 
ATOM   3534  C  CB   . ILE   A  1  230 ? 12.262  9.857   26.173  1.000 21.509  0 285  ILE   A CB   1 ? 1 
ATOM   3535  C  CG1  . ILE   A  1  230 ? 11.316  8.957   25.374  1.000 22.532  0 285  ILE   A CG1  1 ? 1 
ATOM   3536  C  CG2  . ILE   A  1  230 ? 11.591  11.131  26.624  1.000 19.877  0 285  ILE   A CG2  1 ? 1 
ATOM   3537  C  CD1  . ILE   A  1  230 ? 10.975  9.548   23.967  1.000 21.697  0 285  ILE   A CD1  1 ? 1 
ATOM   3538  H  H    . ILE   A  1  230 ? 14.124  8.179   25.810  1.000 20.145  0 285  ILE   A H    1 c 1 
ATOM   3539  H  HA   . ILE   A  1  230 ? 13.312  10.333  24.440  1.000 20.107  0 285  ILE   A HA   1 c 1 
ATOM   3540  H  HB   . ILE   A  1  230 ? 12.520  9.358   26.987  1.000 21.761  0 285  ILE   A HB   1 c 1 
ATOM   3541  H  HG12 . ILE   A  1  230 ? 11.734  8.077   25.258  1.000 22.021  0 285  ILE   A HG12 1 c 1 
ATOM   3542  H  HG13 . ILE   A  1  230 ? 10.484  8.836   25.880  1.000 22.085  0 285  ILE   A HG13 1 c 1 
ATOM   3543  H  HG21 . ILE   A  1  230 ? 11.555  11.762  25.883  1.000 20.197  0 285  ILE   A HG21 1 c 1 
ATOM   3544  H  HG22 . ILE   A  1  230 ? 12.094  11.525  27.358  1.000 20.848  0 285  ILE   A HG22 1 c 1 
ATOM   3545  H  HG23 . ILE   A  1  230 ? 10.687  10.935  26.924  1.000 20.346  0 285  ILE   A HG23 1 c 1 
ATOM   3546  H  HD11 . ILE   A  1  230 ? 11.711  9.376   23.353  1.000 21.652  0 285  ILE   A HD11 1 c 1 
ATOM   3547  H  HD12 . ILE   A  1  230 ? 10.832  10.508  24.041  1.000 21.862  0 285  ILE   A HD12 1 c 1 
ATOM   3548  H  HD13 . ILE   A  1  230 ? 10.167  9.127   23.626  1.000 21.449  0 285  ILE   A HD13 1 c 1 
ATOM   3549  N  N    . LEU   A  1  231 ? 15.139  11.036  26.958  1.000 25.752  0 286  LEU   A N    1 ? 1 
ATOM   3550  C  CA   . LEU   A  1  231 ? 15.917  12.096  27.600  1.000 22.124  0 286  LEU   A CA   1 ? 1 
ATOM   3551  C  C    . LEU   A  1  231 ? 16.952  12.618  26.607  1.000 20.550  0 286  LEU   A C    1 ? 1 
ATOM   3552  O  O    . LEU   A  1  231 ? 17.182  13.815  26.554  1.000 20.569  0 286  LEU   A O    1 ? 1 
ATOM   3553  C  CB   . LEU   A  1  231 ? 16.584  11.627  28.870  1.000 23.339  0 286  LEU   A CB   1 ? 1 
ATOM   3554  C  CG   . LEU   A  1  231 ? 15.772  11.807  30.150  1.000 34.221  0 286  LEU   A CG   1 ? 1 
ATOM   3555  C  CD1  . LEU   A  1  231 ? 16.504  11.245  31.340  1.000 40.123  0 286  LEU   A CD1  1 ? 1 
ATOM   3556  C  CD2  . LEU   A  1  231 ? 15.462  13.266  30.424  1.000 30.360  0 286  LEU   A CD2  1 ? 1 
ATOM   3557  H  H    . LEU   A  1  231 ? 15.173  10.190  27.303  1.000 22.953  0 286  LEU   A H    1 c 1 
ATOM   3558  H  HA   . LEU   A  1  231 ? 15.301  12.832  27.813  1.000 22.712  0 286  LEU   A HA   1 c 1 
ATOM   3559  H  HB2  . LEU   A  1  231 ? 16.800  10.678  28.772  1.000 24.989  0 286  LEU   A HB2  1 c 1 
ATOM   3560  H  HB3  . LEU   A  1  231 ? 17.428  12.110  28.971  1.000 25.401  0 286  LEU   A HB3  1 c 1 
ATOM   3561  H  HG   . LEU   A  1  231 ? 14.918  11.320  30.050  1.000 31.322  0 286  LEU   A HG   1 c 1 
ATOM   3562  H  HD11 . LEU   A  1  231 ? 15.897  11.189  32.098  1.000 38.549  0 286  LEU   A HD11 1 c 1 
ATOM   3563  H  HD12 . LEU   A  1  231 ? 17.251  11.826  31.566  1.000 38.738  0 286  LEU   A HD12 1 c 1 
ATOM   3564  H  HD13 . LEU   A  1  231 ? 16.838  10.357  31.126  1.000 38.057  0 286  LEU   A HD13 1 c 1 
ATOM   3565  H  HD21 . LEU   A  1  231 ? 14.800  13.585  29.786  1.000 30.958  0 286  LEU   A HD21 1 c 1 
ATOM   3566  H  HD22 . LEU   A  1  231 ? 16.276  13.793  30.338  1.000 31.752  0 286  LEU   A HD22 1 c 1 
ATOM   3567  H  HD23 . LEU   A  1  231 ? 15.110  13.359  31.327  1.000 31.843  0 286  LEU   A HD23 1 c 1 
ATOM   3568  N  N    . THR   A  1  232 ? 17.489  11.713  25.778  1.000 19.746  0 287  THR   A N    1 ? 1 
ATOM   3569  C  CA   . THR   A  1  232 ? 18.489  12.052  24.792  1.000 22.632  0 287  THR   A CA   1 ? 1 
ATOM   3570  C  C    . THR   A  1  232 ? 17.892  12.958  23.718  1.000 24.876  0 287  THR   A C    1 ? 1 
ATOM   3571  O  O    . THR   A  1  232 ? 18.522  13.955  23.324  1.000 21.965  0 287  THR   A O    1 ? 1 
ATOM   3572  C  CB   . THR   A  1  232 ? 19.110  10.796  24.224  1.000 22.319  0 287  THR   A CB   1 ? 1 
ATOM   3573  O  OG1  . THR   A  1  232 ? 19.723  10.056  25.302  1.000 18.842  0 287  THR   A OG1  1 ? 1 
ATOM   3574  C  CG2  . THR   A  1  232 ? 20.136  11.100  23.138  1.000 21.807  0 287  THR   A CG2  1 ? 1 
ATOM   3575  H  H    . THR   A  1  232 ? 17.224  10.841  25.844  1.000 20.321  0 287  THR   A H    1 c 1 
ATOM   3576  H  HA   . THR   A  1  232 ? 19.198  12.557  25.253  1.000 22.869  0 287  THR   A HA   1 c 1 
ATOM   3577  H  HB   . THR   A  1  232 ? 18.390  10.247  23.832  1.000 20.829  0 287  THR   A HB   1 c 1 
ATOM   3578  H  HG1  . THR   A  1  232 ? 20.319  10.554  25.670  0.000 5.470   0 287  THR   A HG1  1 c 1 
ATOM   3579  H  HG21 . THR   A  1  232 ? 20.611  10.283  22.903  1.000 22.040  0 287  THR   A HG21 1 c 1 
ATOM   3580  H  HG22 . THR   A  1  232 ? 20.773  11.760  23.467  1.000 22.450  0 287  THR   A HG22 1 c 1 
ATOM   3581  H  HG23 . THR   A  1  232 ? 19.685  11.449  22.349  1.000 21.626  0 287  THR   A HG23 1 c 1 
ATOM   3582  N  N    . ILE   A  1  233 ? 16.660  12.641  23.288  1.000 20.693  0 288  ILE   A N    1 ? 1 
ATOM   3583  C  CA   . ILE   A  1  233 ? 16.016  13.434  22.259  1.000 20.827  0 288  ILE   A CA   1 ? 1 
ATOM   3584  C  C    . ILE   A  1  233 ? 15.808  14.849  22.787  1.000 25.570  0 288  ILE   A C    1 ? 1 
ATOM   3585  O  O    . ILE   A  1  233 ? 16.147  15.834  22.108  1.000 22.362  0 288  ILE   A O    1 ? 1 
ATOM   3586  C  CB   . ILE   A  1  233 ? 14.727  12.776  21.806  1.000 20.691  0 288  ILE   A CB   1 ? 1 
ATOM   3587  C  CG1  . ILE   A  1  233 ? 15.083  11.529  20.946  1.000 21.727  0 288  ILE   A CG1  1 ? 1 
ATOM   3588  C  CG2  . ILE   A  1  233 ? 13.827  13.753  21.056  1.000 21.886  0 288  ILE   A CG2  1 ? 1 
ATOM   3589  C  CD1  . ILE   A  1  233 ? 13.882  10.577  20.733  1.000 22.786  0 288  ILE   A CD1  1 ? 1 
ATOM   3590  H  H    . ILE   A  1  233 ? 16.222  11.919  23.636  1.000 21.416  0 288  ILE   A H    1 c 1 
ATOM   3591  H  HA   . ILE   A  1  233 ? 16.616  13.481  21.493  1.000 21.482  0 288  ILE   A HA   1 c 1 
ATOM   3592  H  HB   . ILE   A  1  233 ? 14.242  12.465  22.609  1.000 21.166  0 288  ILE   A HB   1 c 1 
ATOM   3593  H  HG12 . ILE   A  1  233 ? 15.409  11.829  20.071  1.000 21.613  0 288  ILE   A HG12 1 c 1 
ATOM   3594  H  HG13 . ILE   A  1  233 ? 15.806  11.034  21.386  1.000 21.972  0 288  ILE   A HG13 1 c 1 
ATOM   3595  H  HG21 . ILE   A  1  233 ? 14.344  14.213  20.371  1.000 21.484  0 288  ILE   A HG21 1 c 1 
ATOM   3596  H  HG22 . ILE   A  1  233 ? 13.462  14.406  21.677  1.000 21.690  0 288  ILE   A HG22 1 c 1 
ATOM   3597  H  HG23 . ILE   A  1  233 ? 13.096  13.268  20.636  1.000 21.056  0 288  ILE   A HG23 1 c 1 
ATOM   3598  H  HD11 . ILE   A  1  233 ? 13.190  11.032  20.222  1.000 22.032  0 288  ILE   A HD11 1 c 1 
ATOM   3599  H  HD12 . ILE   A  1  233 ? 13.521  10.309  21.596  1.000 22.434  0 288  ILE   A HD12 1 c 1 
ATOM   3600  H  HD13 . ILE   A  1  233 ? 14.175  9.787   20.247  1.000 22.126  0 288  ILE   A HD13 1 c 1 
ATOM   3601  N  N    . LEU   A  1  234 ? 15.232  14.904  23.997  1.000 24.056  0 289  LEU   A N    1 ? 1 
ATOM   3602  C  CA   . LEU   A  1  234 ? 14.947  16.152  24.680  1.000 25.393  0 289  LEU   A CA   1 ? 1 
ATOM   3603  C  C    . LEU   A  1  234 ? 16.226  16.958  24.855  1.000 21.177  0 289  LEU   A C    1 ? 1 
ATOM   3604  O  O    . LEU   A  1  234 ? 16.216  18.160  24.654  1.000 19.082  0 289  LEU   A O    1 ? 1 
ATOM   3605  C  CB   . LEU   A  1  234 ? 14.317  15.895  26.042  1.000 24.456  0 289  LEU   A CB   1 ? 1 
ATOM   3606  C  CG   . LEU   A  1  234 ? 12.898  15.377  26.038  1.000 24.986  0 289  LEU   A CG   1 ? 1 
ATOM   3607  C  CD1  . LEU   A  1  234 ? 12.495  14.961  27.460  1.000 23.714  0 289  LEU   A CD1  1 ? 1 
ATOM   3608  C  CD2  . LEU   A  1  234 ? 11.929  16.423  25.440  1.000 25.680  0 289  LEU   A CD2  1 ? 1 
ATOM   3609  H  H    . LEU   A  1  234 ? 15.001  14.122  24.410  1.000 24.506  0 289  LEU   A H    1 c 1 
ATOM   3610  H  HA   . LEU   A  1  234 ? 14.324  16.673  24.123  1.000 23.693  0 289  LEU   A HA   1 c 1 
ATOM   3611  H  HB2  . LEU   A  1  234 ? 14.877  15.252  26.519  1.000 25.082  0 289  LEU   A HB2  1 c 1 
ATOM   3612  H  HB3  . LEU   A  1  234 ? 14.335  16.731  26.549  1.000 25.315  0 289  LEU   A HB3  1 c 1 
ATOM   3613  H  HG   . LEU   A  1  234 ? 12.868  14.572  25.465  1.000 24.187  0 289  LEU   A HG   1 c 1 
ATOM   3614  H  HD11 . LEU   A  1  234 ? 11.616  14.545  27.440  1.000 23.909  0 289  LEU   A HD11 1 c 1 
ATOM   3615  H  HD12 . LEU   A  1  234 ? 12.470  15.747  28.033  1.000 24.590  0 289  LEU   A HD12 1 c 1 
ATOM   3616  H  HD13 . LEU   A  1  234 ? 13.146  14.328  27.810  1.000 24.333  0 289  LEU   A HD13 1 c 1 
ATOM   3617  H  HD21 . LEU   A  1  234 ? 12.092  16.510  24.485  1.000 25.111  0 289  LEU   A HD21 1 c 1 
ATOM   3618  H  HD22 . LEU   A  1  234 ? 12.072  17.282  25.874  1.000 25.831  0 289  LEU   A HD22 1 c 1 
ATOM   3619  H  HD23 . LEU   A  1  234 ? 11.011  16.135  25.586  1.000 25.228  0 289  LEU   A HD23 1 c 1 
ATOM   3620  N  N    . GLN   A  1  235 ? 17.327  16.277  25.183  1.000 25.637  0 290  GLN   A N    1 ? 1 
ATOM   3621  C  CA   . GLN   A  1  235 ? 18.607  16.950  25.382  1.000 32.034  0 290  GLN   A CA   1 ? 1 
ATOM   3622  C  C    . GLN   A  1  235 ? 19.201  17.467  24.074  1.000 28.693  0 290  GLN   A C    1 ? 1 
ATOM   3623  O  O    . GLN   A  1  235 ? 19.743  18.567  24.037  1.000 26.771  0 290  GLN   A O    1 ? 1 
ATOM   3624  C  CB   . GLN   A  1  235 ? 19.574  16.039  26.110  1.000 29.936  0 290  GLN   A CB   1 ? 1 
ATOM   3625  C  CG   . GLN   A  1  235 ? 19.219  16.000  27.612  1.000 28.860  0 290  GLN   A CG   1 ? 1 
ATOM   3626  C  CD   . GLN   A  1  235 ? 19.914  14.897  28.373  1.000 37.674  0 290  GLN   A CD   1 ? 1 
ATOM   3627  O  OE1  . GLN   A  1  235 ? 20.696  14.111  27.850  1.000 37.390  0 290  GLN   A OE1  1 ? 1 
ATOM   3628  N  NE2  . GLN   A  1  235 ? 19.657  14.820  29.650  1.000 47.344  0 290  GLN   A NE2  1 ? 1 
ATOM   3629  H  H    . GLN   A  1  235 ? 17.282  15.371  25.293  1.000 25.356  0 290  GLN   A H    1 c 1 
ATOM   3630  H  HA   . GLN   A  1  235 ? 18.441  17.731  25.960  1.000 29.886  0 290  GLN   A HA   1 c 1 
ATOM   3631  H  HB2  . GLN   A  1  235 ? 19.519  15.137  25.730  1.000 29.756  0 290  GLN   A HB2  1 c 1 
ATOM   3632  H  HB3  . GLN   A  1  235 ? 20.488  16.373  25.992  1.000 30.492  0 290  GLN   A HB3  1 c 1 
ATOM   3633  H  HG2  . GLN   A  1  235 ? 19.460  16.860  28.016  1.000 31.314  0 290  GLN   A HG2  1 c 1 
ATOM   3634  H  HG3  . GLN   A  1  235 ? 18.250  15.889  27.709  1.000 30.468  0 290  GLN   A HG3  1 c 1 
ATOM   3635  H  HE21 . GLN   A  1  235 ? 19.102  15.397  30.026  1.000 43.814  0 290  GLN   A HE21 1 c 1 
ATOM   3636  H  HE22 . GLN   A  1  235 ? 20.037  14.191  30.142  1.000 44.227  0 290  GLN   A HE22 1 c 1 
ATOM   3637  N  N    . TRP   A  1  236 ? 19.028  16.701  22.995  1.000 24.927  0 291  TRP   A N    1 ? 1 
ATOM   3638  C  CA   . TRP   A  1  236 ? 19.423  17.160  21.680  1.000 29.676  0 291  TRP   A CA   1 ? 1 
ATOM   3639  C  C    . TRP   A  1  236 ? 18.650  18.412  21.264  1.000 25.946  0 291  TRP   A C    1 ? 1 
ATOM   3640  O  O    . TRP   A  1  236 ? 19.168  19.249  20.539  1.000 28.771  0 291  TRP   A O    1 ? 1 
ATOM   3641  C  CB   . TRP   A  1  236 ? 19.199  16.072  20.621  1.000 26.732  0 291  TRP   A CB   1 ? 1 
ATOM   3642  C  CG   . TRP   A  1  236 ? 20.193  14.962  20.568  1.000 26.926  0 291  TRP   A CG   1 ? 1 
ATOM   3643  C  CD1  . TRP   A  1  236 ? 21.471  14.971  21.044  1.000 26.637  0 291  TRP   A CD1  1 ? 1 
ATOM   3644  C  CD2  . TRP   A  1  236 ? 19.988  13.670  19.996  1.000 24.117  0 291  TRP   A CD2  1 ? 1 
ATOM   3645  N  NE1  . TRP   A  1  236 ? 22.062  13.769  20.800  1.000 25.099  0 291  TRP   A NE1  1 ? 1 
ATOM   3646  C  CE2  . TRP   A  1  236 ? 21.181  12.953  20.148  1.000 24.367  0 291  TRP   A CE2  1 ? 1 
ATOM   3647  C  CE3  . TRP   A  1  236 ? 18.903  13.039  19.382  1.000 20.800  0 291  TRP   A CE3  1 ? 1 
ATOM   3648  C  CZ2  . TRP   A  1  236 ? 21.316  11.627  19.723  1.000 24.365  0 291  TRP   A CZ2  1 ? 1 
ATOM   3649  C  CZ3  . TRP   A  1  236 ? 19.047  11.727  18.962  1.000 19.671  0 291  TRP   A CZ3  1 ? 1 
ATOM   3650  C  CH2  . TRP   A  1  236 ? 20.240  11.039  19.141  1.000 18.591  0 291  TRP   A CH2  1 ? 1 
ATOM   3651  H  H    . TRP   A  1  236 ? 18.661  15.868  23.082  1.000 26.362  0 291  TRP   A H    1 c 1 
ATOM   3652  H  HA   . TRP   A  1  236 ? 20.385  17.373  21.706  1.000 27.912  0 291  TRP   A HA   1 c 1 
ATOM   3653  H  HB2  . TRP   A  1  236 ? 18.313  15.687  20.771  1.000 26.826  0 291  TRP   A HB2  1 c 1 
ATOM   3654  H  HB3  . TRP   A  1  236 ? 19.181  16.510  19.746  1.000 27.072  0 291  TRP   A HB3  1 c 1 
ATOM   3655  H  HD1  . TRP   A  1  236 ? 21.898  15.707  21.453  1.000 27.041  0 291  TRP   A HD1  1 c 1 
ATOM   3656  H  HE1  . TRP   A  1  236 ? 22.888  13.561  21.012  1.000 25.777  0 291  TRP   A HE1  1 c 1 
ATOM   3657  H  HE3  . TRP   A  1  236 ? 18.087  13.495  19.266  1.000 20.978  0 291  TRP   A HE3  1 c 1 
ATOM   3658  H  HZ2  . TRP   A  1  236 ? 22.123  11.158  19.844  1.000 23.216  0 291  TRP   A HZ2  1 c 1 
ATOM   3659  H  HZ3  . TRP   A  1  236 ? 18.327  11.296  18.533  1.000 19.135  0 291  TRP   A HZ3  1 c 1 
ATOM   3660  H  HH2  . TRP   A  1  236 ? 20.316  10.158  18.823  1.000 19.896  0 291  TRP   A HH2  1 c 1 
ATOM   3661  N  N    . LEU   A  1  237 ? 17.396  18.512  21.709  1.000 25.229  0 292  LEU   A N    1 ? 1 
ATOM   3662  C  CA   . LEU   A  1  237 ? 16.561  19.656  21.388  1.000 30.026  0 292  LEU   A CA   1 ? 1 
ATOM   3663  C  C    . LEU   A  1  237 ? 17.040  20.956  22.039  1.000 26.759  0 292  LEU   A C    1 ? 1 
ATOM   3664  O  O    . LEU   A  1  237 ? 16.622  22.022  21.620  1.000 26.612  0 292  LEU   A O    1 ? 1 
ATOM   3665  C  CB   . LEU   A  1  237 ? 15.098  19.381  21.803  1.000 26.654  0 292  LEU   A CB   1 ? 1 
ATOM   3666  C  CG   . LEU   A  1  237 ? 14.214  18.802  20.699  1.000 26.404  0 292  LEU   A CG   1 ? 1 
ATOM   3667  C  CD1  . LEU   A  1  237 ? 12.930  18.176  21.331  1.000 29.914  0 292  LEU   A CD1  1 ? 1 
ATOM   3668  C  CD2  . LEU   A  1  237 ? 13.867  19.885  19.643  1.000 22.665  0 292  LEU   A CD2  1 ? 1 
ATOM   3669  H  H    . LEU   A  1  237 ? 17.044  17.839  22.218  1.000 26.142  0 292  LEU   A H    1 c 1 
ATOM   3670  H  HA   . LEU   A  1  237 ? 16.592  19.780  20.412  1.000 27.396  0 292  LEU   A HA   1 c 1 
ATOM   3671  H  HB2  . LEU   A  1  237 ? 15.100  18.760  22.558  1.000 27.341  0 292  LEU   A HB2  1 c 1 
ATOM   3672  H  HB3  . LEU   A  1  237 ? 14.699  20.219  22.111  1.000 27.607  0 292  LEU   A HB3  1 c 1 
ATOM   3673  H  HG   . LEU   A  1  237 ? 14.718  18.081  20.246  1.000 25.947  0 292  LEU   A HG   1 c 1 
ATOM   3674  H  HD11 . LEU   A  1  237 ? 12.468  17.643  20.662  1.000 28.262  0 292  LEU   A HD11 1 c 1 
ATOM   3675  H  HD12 . LEU   A  1  237 ? 12.343  18.886  21.643  1.000 28.892  0 292  LEU   A HD12 1 c 1 
ATOM   3676  H  HD13 . LEU   A  1  237 ? 13.179  17.609  22.081  1.000 28.825  0 292  LEU   A HD13 1 c 1 
ATOM   3677  H  HD21 . LEU   A  1  237 ? 14.684  20.200  19.218  1.000 23.862  0 292  LEU   A HD21 1 c 1 
ATOM   3678  H  HD22 . LEU   A  1  237 ? 13.421  20.632  20.079  1.000 23.898  0 292  LEU   A HD22 1 c 1 
ATOM   3679  H  HD23 . LEU   A  1  237 ? 13.278  19.505  18.969  1.000 23.201  0 292  LEU   A HD23 1 c 1 
ATOM   3680  N  N    . SER   A  1  238 ? 17.880  20.864  23.072  1.000 26.913  0 293  SER   A N    1 ? 1 
ATOM   3681  C  CA   . SER   A  1  238 ? 18.414  22.047  23.725  1.000 30.417  0 293  SER   A CA   1 ? 1 
ATOM   3682  C  C    . SER   A  1  238 ? 19.794  22.428  23.193  1.000 27.485  0 293  SER   A C    1 ? 1 
ATOM   3683  O  O    . SER   A  1  238 ? 20.398  23.368  23.694  1.000 32.995  0 293  SER   A O    1 ? 1 
ATOM   3684  C  CB   . SER   A  1  238 ? 18.463  21.841  25.238  1.000 36.566  0 293  SER   A CB   1 ? 1 
ATOM   3685  O  OG   . SER   A  1  238 ? 17.160  21.510  25.695  1.000 42.350  0 293  SER   A OG   1 ? 1 
ATOM   3686  H  H    . SER   A  1  238 ? 18.116  20.042  23.394  1.000 27.510  0 293  SER   A H    1 c 1 
ATOM   3687  H  HA   . SER   A  1  238 ? 17.797  22.804  23.539  1.000 30.031  0 293  SER   A HA   1 c 1 
ATOM   3688  H  HB2  . SER   A  1  238 ? 19.089  21.114  25.456  1.000 36.432  0 293  SER   A HB2  1 c 1 
ATOM   3689  H  HB3  . SER   A  1  238 ? 18.772  22.665  25.678  1.000 36.921  0 293  SER   A HB3  1 c 1 
ATOM   3690  H  HG   . SER   A  1  238 ? 17.090  20.650  25.677  0.000 24.490  0 293  SER   A HG   1 c 1 
ATOM   3691  N  N    . LEU   A  1  239 ? 20.292  21.699  22.185  1.000 26.876  0 294  LEU   A N    1 ? 1 
ATOM   3692  C  CA   . LEU   A  1  239 ? 21.535  22.064  21.514  1.000 34.035  0 294  LEU   A CA   1 ? 1 
ATOM   3693  C  C    . LEU   A  1  239 ? 21.438  23.453  20.877  1.000 36.088  0 294  LEU   A C    1 ? 1 
ATOM   3694  O  O    . LEU   A  1  239 ? 20.332  23.893  20.549  1.000 27.426  0 294  LEU   A O    1 ? 1 
ATOM   3695  C  CB   . LEU   A  1  239 ? 21.885  21.069  20.413  1.000 29.784  0 294  LEU   A CB   1 ? 1 
ATOM   3696  C  CG   . LEU   A  1  239 ? 22.496  19.746  20.859  1.000 28.587  0 294  LEU   A CG   1 ? 1 
ATOM   3697  C  CD1  . LEU   A  1  239 ? 22.676  18.833  19.656  1.000 29.999  0 294  LEU   A CD1  1 ? 1 
ATOM   3698  C  CD2  . LEU   A  1  239 ? 23.826  19.943  21.574  1.000 29.368  0 294  LEU   A CD2  1 ? 1 
ATOM   3699  H  H    . LEU   A  1  239 ? 19.852  20.947  21.911  1.000 27.753  0 294  LEU   A H    1 c 1 
ATOM   3700  H  HA   . LEU   A  1  239 ? 22.251  22.075  22.187  1.000 32.539  0 294  LEU   A HA   1 c 1 
ATOM   3701  H  HB2  . LEU   A  1  239 ? 21.070  20.876  19.907  1.000 29.747  0 294  LEU   A HB2  1 c 1 
ATOM   3702  H  HB3  . LEU   A  1  239 ? 22.512  21.501  19.799  1.000 30.581  0 294  LEU   A HB3  1 c 1 
ATOM   3703  H  HG   . LEU   A  1  239 ? 21.868  19.311  21.487  1.000 28.886  0 294  LEU   A HG   1 c 1 
ATOM   3704  H  HD11 . LEU   A  1  239 ? 22.881  17.932  19.960  1.000 29.320  0 294  LEU   A HD11 1 c 1 
ATOM   3705  H  HD12 . LEU   A  1  239 ? 23.408  19.163  19.105  1.000 29.710  0 294  LEU   A HD12 1 c 1 
ATOM   3706  H  HD13 . LEU   A  1  239 ? 21.857  18.819  19.132  1.000 28.918  0 294  LEU   A HD13 1 c 1 
ATOM   3707  H  HD21 . LEU   A  1  239 ? 23.670  20.330  22.453  1.000 29.767  0 294  LEU   A HD21 1 c 1 
ATOM   3708  H  HD22 . LEU   A  1  239 ? 24.390  20.540  21.053  1.000 29.884  0 294  LEU   A HD22 1 c 1 
ATOM   3709  H  HD23 . LEU   A  1  239 ? 24.271  19.083  21.675  1.000 29.428  0 294  LEU   A HD23 1 c 1 
ATOM   3710  N  N    . PRO   A  1  240 ? 22.577  24.167  20.656  1.000 35.323  0 295  PRO   A N    1 ? 1 
ATOM   3711  C  CA   . PRO   A  1  240 ? 22.551  25.481  20.009  1.000 30.800  0 295  PRO   A CA   1 ? 1 
ATOM   3712  C  C    . PRO   A  1  240 ? 22.052  25.404  18.574  1.000 32.653  0 295  PRO   A C    1 ? 1 
ATOM   3713  O  O    . PRO   A  1  240 ? 22.082  24.330  17.981  1.000 30.756  0 295  PRO   A O    1 ? 1 
ATOM   3714  C  CB   . PRO   A  1  240 ? 24.011  25.956  20.042  1.000 33.849  0 295  PRO   A CB   1 ? 1 
ATOM   3715  C  CG   . PRO   A  1  240 ? 24.716  24.999  20.975  1.000 39.690  0 295  PRO   A CG   1 ? 1 
ATOM   3716  C  CD   . PRO   A  1  240 ? 23.943  23.729  20.988  1.000 35.615  0 295  PRO   A CD   1 ? 1 
ATOM   3717  H  HA   . PRO   A  1  240 ? 21.986  26.100  20.537  1.000 32.652  0 295  PRO   A HA   1 c 1 
ATOM   3718  H  HB2  . PRO   A  1  240 ? 24.410  25.924  19.147  1.000 34.520  0 295  PRO   A HB2  1 c 1 
ATOM   3719  H  HB3  . PRO   A  1  240 ? 24.070  26.875  20.380  1.000 34.989  0 295  PRO   A HB3  1 c 1 
ATOM   3720  H  HG2  . PRO   A  1  240 ? 25.630  24.836  20.664  1.000 37.826  0 295  PRO   A HG2  1 c 1 
ATOM   3721  H  HG3  . PRO   A  1  240 ? 24.762  25.376  21.877  1.000 37.929  0 295  PRO   A HG3  1 c 1 
ATOM   3722  H  HD2  . PRO   A  1  240 ? 24.282  23.102  20.322  1.000 36.112  0 295  PRO   A HD2  1 c 1 
ATOM   3723  H  HD3  . PRO   A  1  240 ? 23.976  23.309  21.867  1.000 36.423  0 295  PRO   A HD3  1 c 1 
ATOM   3724  N  N    . ASP   A  1  241 ? 21.619  26.560  18.043  1.000 35.775  0 296  ASP   A N    1 ? 1 
ATOM   3725  C  CA   . ASP   A  1  241 ? 20.932  26.636  16.764  1.000 38.599  0 296  ASP   A CA   1 ? 1 
ATOM   3726  C  C    . ASP   A  1  241 ? 21.716  25.907  15.684  1.000 38.602  0 296  ASP   A C    1 ? 1 
ATOM   3727  O  O    . ASP   A  1  241 ? 21.129  25.213  14.875  1.000 39.222  0 296  ASP   A O    1 ? 1 
ATOM   3728  C  CB   . ASP   A  1  241 ? 20.698  28.084  16.331  1.000 40.772  0 296  ASP   A CB   1 ? 1 
ATOM   3729  C  CG   . ASP   A  1  241 ? 19.634  28.814  17.113  1.000 55.306  0 296  ASP   A CG   1 ? 1 
ATOM   3730  O  OD1  . ASP   A  1  241 ? 18.748  28.140  17.685  1.000 67.822  0 296  ASP   A OD1  1 ? 1 
ATOM   3731  O  OD2  . ASP   A  1  241 ? 19.701  30.064  17.186  1.000 59.003  0 296  ASP   A OD2  1 ? 1 
ATOM   3732  H  H    . ASP   A  1  241 ? 21.762  27.335  18.505  1.000 36.261  0 296  ASP   A H    1 c 1 
ATOM   3733  H  HA   . ASP   A  1  241 ? 20.058  26.196  16.861  1.000 37.819  0 296  ASP   A HA   1 c 1 
ATOM   3734  H  HB2  . ASP   A  1  241 ? 21.538  28.580  16.424  1.000 43.770  0 296  ASP   A HB2  1 c 1 
ATOM   3735  H  HB3  . ASP   A  1  241 ? 20.442  28.095  15.387  1.000 42.898  0 296  ASP   A HB3  1 c 1 
ATOM   3736  N  N    . ASN   A  1  242 ? 23.043  26.019  15.703  1.000 36.049  0 297  ASN   A N    1 ? 1 
ATOM   3737  C  CA   . ASN   A  1  242 ? 23.833  25.497  14.599  1.000 36.337  0 297  ASN   A CA   1 ? 1 
ATOM   3738  C  C    . ASN   A  1  242 ? 24.054  23.993  14.735  1.000 36.674  0 297  ASN   A C    1 ? 1 
ATOM   3739  O  O    . ASN   A  1  242 ? 24.583  23.373  13.820  1.000 53.074  0 297  ASN   A O    1 ? 1 
ATOM   3740  C  CB   . ASN   A  1  242 ? 25.177  26.246  14.487  1.000 48.408  0 297  ASN   A CB   1 ? 1 
ATOM   3741  C  CG   . ASN   A  1  242 ? 26.126  25.937  15.632  1.000 56.497  0 297  ASN   A CG   1 ? 1 
ATOM   3742  O  OD1  . ASN   A  1  242 ? 25.760  26.024  16.809  1.000 59.493  0 297  ASN   A OD1  1 ? 1 
ATOM   3743  N  ND2  . ASN   A  1  242 ? 27.349  25.541  15.324  1.000 71.645  0 297  ASN   A ND2  1 ? 1 
ATOM   3744  H  H    . ASN   A  1  242 ? 23.464  26.434  16.399  1.000 37.450  0 297  ASN   A H    1 c 1 
ATOM   3745  H  HA   . ASN   A  1  242 ? 23.337  25.661  13.763  1.000 37.892  0 297  ASN   A HA   1 c 1 
ATOM   3746  H  HB2  . ASN   A  1  242 ? 25.605  26.002  13.641  1.000 47.110  0 297  ASN   A HB2  1 c 1 
ATOM   3747  H  HB3  . ASN   A  1  242 ? 25.002  27.209  14.470  1.000 47.343  0 297  ASN   A HB3  1 c 1 
ATOM   3748  H  HD21 . ASN   A  1  242 ? 27.635  25.591  14.489  1.000 66.276  0 297  ASN   A HD21 1 c 1 
ATOM   3749  H  HD22 . ASN   A  1  242 ? 27.884  25.227  15.955  1.000 66.712  0 297  ASN   A HD22 1 c 1 
ATOM   3750  N  N    . GLU   A  1  243 ? 23.664  23.402  15.874  1.000 34.986  0 298  GLU   A N    1 ? 1 
ATOM   3751  C  CA   . GLU   A  1  243 ? 23.799  21.967  16.058  1.000 34.411  0 298  GLU   A CA   1 ? 1 
ATOM   3752  C  C    . GLU   A  1  243 ? 22.485  21.193  16.162  1.000 27.452  0 298  GLU   A C    1 ? 1 
ATOM   3753  O  O    . GLU   A  1  243 ? 22.484  19.964  16.079  1.000 26.376  0 298  GLU   A O    1 ? 1 
ATOM   3754  C  CB   . GLU   A  1  243 ? 24.593  21.698  17.325  1.000 39.085  0 298  GLU   A CB   1 ? 1 
ATOM   3755  C  CG   . GLU   A  1  243 ? 26.021  22.209  17.291  1.000 47.590  0 298  GLU   A CG   1 ? 1 
ATOM   3756  C  CD   . GLU   A  1  243 ? 26.824  21.847  18.528  1.000 59.472  0 298  GLU   A CD   1 ? 1 
ATOM   3757  O  OE1  . GLU   A  1  243 ? 26.290  21.117  19.391  1.000 75.750  0 298  GLU   A OE1  1 ? 1 
ATOM   3758  O  OE2  . GLU   A  1  243 ? 27.984  22.299  18.642  1.000 68.036  0 298  GLU   A OE2  1 ? 1 
ATOM   3759  H  H    . GLU   A  1  243 ? 23.331  23.904  16.559  1.000 35.353  0 298  GLU   A H    1 c 1 
ATOM   3760  H  HA   . GLU   A  1  243 ? 24.306  21.609  15.296  1.000 34.020  0 298  GLU   A HA   1 c 1 
ATOM   3761  H  HB2  . GLU   A  1  243 ? 24.126  22.116  18.078  1.000 39.627  0 298  GLU   A HB2  1 c 1 
ATOM   3762  H  HB3  . GLU   A  1  243 ? 24.608  20.731  17.482  1.000 39.236  0 298  GLU   A HB3  1 c 1 
ATOM   3763  H  HG2  . GLU   A  1  243 ? 26.476  21.840  16.504  1.000 47.781  0 298  GLU   A HG2  1 c 1 
ATOM   3764  H  HG3  . GLU   A  1  243 ? 26.012  23.185  17.200  1.000 48.093  0 298  GLU   A HG3  1 c 1 
ATOM   3765  N  N    . ARG   A  1  244 ? 21.387  21.901  16.439  1.000 23.945  0 299  ARG   A N    1 ? 1 
ATOM   3766  C  CA   . ARG   A  1  244 ? 20.165  21.260  16.884  1.000 25.096  0 299  ARG   A CA   1 ? 1 
ATOM   3767  C  C    . ARG   A  1  244 ? 19.474  20.596  15.693  1.000 23.233  0 299  ARG   A C    1 ? 1 
ATOM   3768  O  O    . ARG   A  1  244 ? 19.114  21.252  14.727  1.000 23.908  0 299  ARG   A O    1 ? 1 
ATOM   3769  C  CB   . ARG   A  1  244 ? 19.233  22.289  17.517  1.000 28.259  0 299  ARG   A CB   1 ? 1 
ATOM   3770  C  CG   . ARG   A  1  244 ? 17.953  21.728  18.105  1.000 30.151  0 299  ARG   A CG   1 ? 1 
ATOM   3771  C  CD   . ARG   A  1  244 ? 16.908  22.818  18.305  1.000 32.226  0 299  ARG   A CD   1 ? 1 
ATOM   3772  N  NE   . ARG   A  1  244 ? 17.454  23.930  19.070  1.000 43.279  0 299  ARG   A NE   1 ? 1 
ATOM   3773  C  CZ   . ARG   A  1  244 ? 17.717  25.143  18.588  1.000 38.764  0 299  ARG   A CZ   1 ? 1 
ATOM   3774  N  NH1  . ARG   A  1  244 ? 17.376  25.498  17.357  1.000 32.591  0 299  ARG   A NH1  1 ? 1 
ATOM   3775  N  NH2  . ARG   A  1  244 ? 18.310  26.035  19.378  1.000 42.013  0 299  ARG   A NH2  1 ? 1 
ATOM   3776  H  H    . ARG   A  1  244 ? 21.396  22.809  16.339  1.000 25.557  0 299  ARG   A H    1 c 1 
ATOM   3777  H  HA   . ARG   A  1  244 ? 20.391  20.578  17.555  1.000 25.022  0 299  ARG   A HA   1 c 1 
ATOM   3778  H  HB2  . ARG   A  1  244 ? 19.725  22.753  18.226  1.000 28.560  0 299  ARG   A HB2  1 c 1 
ATOM   3779  H  HB3  . ARG   A  1  244 ? 18.999  22.952  16.835  1.000 28.044  0 299  ARG   A HB3  1 c 1 
ATOM   3780  H  HG2  . ARG   A  1  244 ? 17.589  21.041  17.509  1.000 29.419  0 299  ARG   A HG2  1 c 1 
ATOM   3781  H  HG3  . ARG   A  1  244 ? 18.148  21.309  18.971  1.000 30.086  0 299  ARG   A HG3  1 c 1 
ATOM   3782  H  HD2  . ARG   A  1  244 ? 16.599  23.135  17.430  1.000 33.628  0 299  ARG   A HD2  1 c 1 
ATOM   3783  H  HD3  . ARG   A  1  244 ? 16.136  22.444  18.781  1.000 33.534  0 299  ARG   A HD3  1 c 1 
ATOM   3784  H  HE   . ARG   A  1  244 ? 17.622  23.791  19.915  1.000 39.547  0 299  ARG   A HE   1 c 1 
ATOM   3785  H  HH11 . ARG   A  1  244 ? 16.635  25.184  16.995  1.000 33.834  0 299  ARG   A HH11 1 c 1 
ATOM   3786  H  HH12 . ARG   A  1  244 ? 17.883  26.064  16.909  1.000 34.690  0 299  ARG   A HH12 1 c 1 
ATOM   3787  H  HH21 . ARG   A  1  244 ? 18.437  26.856  19.092  1.000 41.452  0 299  ARG   A HH21 1 c 1 
ATOM   3788  H  HH22 . ARG   A  1  244 ? 18.574  25.802  20.184  1.000 41.398  0 299  ARG   A HH22 1 c 1 
ATOM   3789  N  N    . PRO   A  1  245 ? 19.233  19.275  15.717  1.000 24.220  0 300  PRO   A N    1 ? 1 
ATOM   3790  C  CA   . PRO   A  1  245 ? 18.432  18.659  14.656  1.000 25.909  0 300  PRO   A CA   1 ? 1 
ATOM   3791  C  C    . PRO   A  1  245 ? 16.992  19.175  14.594  1.000 27.576  0 300  PRO   A C    1 ? 1 
ATOM   3792  O  O    . PRO   A  1  245 ? 16.450  19.679  15.579  1.000 24.660  0 300  PRO   A O    1 ? 1 
ATOM   3793  C  CB   . PRO   A  1  245 ? 18.525  17.152  14.959  1.000 27.482  0 300  PRO   A CB   1 ? 1 
ATOM   3794  C  CG   . PRO   A  1  245 ? 19.675  17.012  15.962  1.000 28.294  0 300  PRO   A CG   1 ? 1 
ATOM   3795  C  CD   . PRO   A  1  245 ? 19.735  18.320  16.717  1.000 24.886  0 300  PRO   A CD   1 ? 1 
ATOM   3796  H  HA   . PRO   A  1  245 ? 18.874  18.832  13.789  1.000 26.282  0 300  PRO   A HA   1 c 1 
ATOM   3797  H  HB2  . PRO   A  1  245 ? 17.686  16.821  15.346  1.000 26.754  0 300  PRO   A HB2  1 c 1 
ATOM   3798  H  HB3  . PRO   A  1  245 ? 18.715  16.645  14.142  1.000 26.834  0 300  PRO   A HB3  1 c 1 
ATOM   3799  H  HG2  . PRO   A  1  245 ? 19.508  16.268  16.577  1.000 27.119  0 300  PRO   A HG2  1 c 1 
ATOM   3800  H  HG3  . PRO   A  1  245 ? 20.519  16.848  15.495  1.000 27.512  0 300  PRO   A HG3  1 c 1 
ATOM   3801  H  HD2  . PRO   A  1  245 ? 19.164  18.301  17.507  1.000 25.461  0 300  PRO   A HD2  1 c 1 
ATOM   3802  H  HD3  . PRO   A  1  245 ? 20.648  18.530  16.985  1.000 25.998  0 300  PRO   A HD3  1 c 1 
ATOM   3803  N  N    . SER   A  1  246 ? 16.388  19.062  13.401  1.000 29.779  0 301  SER   A N    1 ? 1 
ATOM   3804  C  CA   . SER   A  1  246 ? 14.974  19.343  13.193  1.000 22.112  0 301  SER   A CA   1 ? 1 
ATOM   3805  C  C    . SER   A  1  246 ? 14.122  18.077  13.196  1.000 21.427  0 301  SER   A C    1 ? 1 
ATOM   3806  O  O    . SER   A  1  246 ? 12.915  18.184  13.382  1.000 27.080  0 301  SER   A O    1 ? 1 
ATOM   3807  C  CB   . SER   A  1  246 ? 14.757  20.092  11.885  1.000 21.871  0 301  SER   A CB   1 ? 1 
ATOM   3808  O  OG   . SER   A  1  246 ? 15.311  21.389  11.931  1.000 24.762  0 301  SER   A OG   1 ? 1 
ATOM   3809  H  H    . SER   A  1  246 ? 16.888  18.803  12.680  1.000 27.125  0 301  SER   A H    1 c 1 
ATOM   3810  H  HA   . SER   A  1  246 ? 14.662  19.924  13.937  1.000 23.478  0 301  SER   A HA   1 c 1 
ATOM   3811  H  HB2  . SER   A  1  246 ? 15.171  19.586  11.153  1.000 22.361  0 301  SER   A HB2  1 c 1 
ATOM   3812  H  HB3  . SER   A  1  246 ? 13.792  20.156  11.703  1.000 22.177  0 301  SER   A HB3  1 c 1 
ATOM   3813  H  HG   . SER   A  1  246 ? 16.115  21.343  11.653  0.000 13.430  0 301  SER   A HG   1 c 1 
ATOM   3814  N  N    . VAL   A  1  247 ? 14.742  16.902  12.972  1.000 23.949  0 302  VAL   A N    1 ? 1 
ATOM   3815  C  CA   . VAL   A  1  247 ? 14.001  15.649  12.873  1.000 20.687  0 302  VAL   A CA   1 ? 1 
ATOM   3816  C  C    . VAL   A  1  247 ? 14.617  14.584  13.779  1.000 19.884  0 302  VAL   A C    1 ? 1 
ATOM   3817  O  O    . VAL   A  1  247 ? 15.838  14.376  13.780  1.000 24.315  0 302  VAL   A O    1 ? 1 
ATOM   3818  C  CB   . VAL   A  1  247 ? 13.847  15.154  11.401  1.000 18.591  0 302  VAL   A CB   1 ? 1 
ATOM   3819  C  CG1  . VAL   A  1  247 ? 15.166  14.749  10.780  1.000 17.230  0 302  VAL   A CG1  1 ? 1 
ATOM   3820  C  CG2  . VAL   A  1  247 ? 12.838  14.013  11.296  1.000 17.187  0 302  VAL   A CG2  1 ? 1 
ATOM   3821  H  H    . VAL   A  1  247 ? 15.650  16.881  12.875  1.000 22.928  0 302  VAL   A H    1 c 1 
ATOM   3822  H  HA   . VAL   A  1  247 ? 13.105  15.823  13.206  1.000 20.531  0 302  VAL   A HA   1 c 1 
ATOM   3823  H  HB   . VAL   A  1  247 ? 13.492  15.913  10.875  1.000 18.430  0 302  VAL   A HB   1 c 1 
ATOM   3824  H  HG11 . VAL   A  1  247 ? 15.484  13.929  11.195  1.000 17.690  0 302  VAL   A HG11 1 c 1 
ATOM   3825  H  HG12 . VAL   A  1  247 ? 15.819  15.457  10.915  1.000 18.111  0 302  VAL   A HG12 1 c 1 
ATOM   3826  H  HG13 . VAL   A  1  247 ? 15.043  14.601  9.826   1.000 17.513  0 302  VAL   A HG13 1 c 1 
ATOM   3827  H  HG21 . VAL   A  1  247 ? 12.705  13.782  10.360  1.000 17.228  0 302  VAL   A HG21 1 c 1 
ATOM   3828  H  HG22 . VAL   A  1  247 ? 11.990  14.291  11.684  1.000 17.341  0 302  VAL   A HG22 1 c 1 
ATOM   3829  H  HG23 . VAL   A  1  247 ? 13.174  13.235  11.775  1.000 17.416  0 302  VAL   A HG23 1 c 1 
ATOM   3830  N  N    . TYR   A  1  248 ? 13.743  13.941  14.567  1.000 19.438  0 303  TYR   A N    1 ? 1 
ATOM   3831  C  CA   . TYR   A  1  248 ? 14.094  12.904  15.518  1.000 19.233  0 303  TYR   A CA   1 ? 1 
ATOM   3832  C  C    . TYR   A  1  248 ? 13.176  11.691  15.382  1.000 24.594  0 303  TYR   A C    1 ? 1 
ATOM   3833  O  O    . TYR   A  1  248 ? 12.060  11.833  14.887  1.000 24.177  0 303  TYR   A O    1 ? 1 
ATOM   3834  C  CB   . TYR   A  1  248 ? 13.942  13.434  16.958  1.000 24.664  0 303  TYR   A CB   1 ? 1 
ATOM   3835  C  CG   . TYR   A  1  248 ? 14.665  14.729  17.238  1.000 22.056  0 303  TYR   A CG   1 ? 1 
ATOM   3836  C  CD1  . TYR   A  1  248 ? 14.106  15.942  16.898  1.000 20.906  0 303  TYR   A CD1  1 ? 1 
ATOM   3837  C  CD2  . TYR   A  1  248 ? 15.919  14.737  17.835  1.000 23.120  0 303  TYR   A CD2  1 ? 1 
ATOM   3838  C  CE1  . TYR   A  1  248 ? 14.765  17.143  17.158  1.000 25.458  0 303  TYR   A CE1  1 ? 1 
ATOM   3839  C  CE2  . TYR   A  1  248 ? 16.584  15.932  18.104  1.000 22.924  0 303  TYR   A CE2  1 ? 1 
ATOM   3840  C  CZ   . TYR   A  1  248 ? 16.000  17.133  17.761  1.000 22.537  0 303  TYR   A CZ   1 ? 1 
ATOM   3841  O  OH   . TYR   A  1  248 ? 16.612  18.332  17.989  1.000 21.687  0 303  TYR   A OH   1 ? 1 
ATOM   3842  H  H    . TYR   A  1  248 ? 12.860  14.169  14.500  1.000 19.279  0 303  TYR   A H    1 c 1 
ATOM   3843  H  HA   . TYR   A  1  248 ? 15.032  12.620  15.369  1.000 21.231  0 303  TYR   A HA   1 c 1 
ATOM   3844  H  HB2  . TYR   A  1  248 ? 12.988  13.561  17.140  1.000 22.457  0 303  TYR   A HB2  1 c 1 
ATOM   3845  H  HB3  . TYR   A  1  248 ? 14.274  12.749  17.575  1.000 22.717  0 303  TYR   A HB3  1 c 1 
ATOM   3846  H  HD1  . TYR   A  1  248 ? 13.256  15.961  16.491  1.000 21.738  0 303  TYR   A HD1  1 c 1 
ATOM   3847  H  HD2  . TYR   A  1  248 ? 16.320  13.920  18.077  1.000 22.796  0 303  TYR   A HD2  1 c 1 
ATOM   3848  H  HE1  . TYR   A  1  248 ? 14.364  17.963  16.922  1.000 23.643  0 303  TYR   A HE1  1 c 1 
ATOM   3849  H  HE2  . TYR   A  1  248 ? 17.433  15.920  18.510  1.000 23.399  0 303  TYR   A HE2  1 c 1 
ATOM   3850  H  HH   . TYR   A  1  248 ? 16.222  19.067  17.754  0.000 9.100   0 303  TYR   A HH   1 c 1 
ATOM   3851  N  N    . ALA   A  1  249 ? 13.666  10.523  15.831  1.000 21.966  0 304  ALA   A N    1 ? 1 
ATOM   3852  C  CA   . ALA   A  1  249 ? 12.847  9.338   16.014  1.000 23.477  0 304  ALA   A CA   1 ? 1 
ATOM   3853  C  C    . ALA   A  1  249 ? 13.204  8.586   17.291  1.000 23.033  0 304  ALA   A C    1 ? 1 
ATOM   3854  O  O    . ALA   A  1  249 ? 14.374  8.287   17.521  1.000 21.673  0 304  ALA   A O    1 ? 1 
ATOM   3855  C  CB   . ALA   A  1  249 ? 13.001  8.380   14.851  1.000 23.417  0 304  ALA   A CB   1 ? 1 
ATOM   3856  H  H    . ALA   A  1  249 ? 14.556  10.469  16.031  1.000 23.201  0 304  ALA   A H    1 c 1 
ATOM   3857  H  HA   . ALA   A  1  249 ? 11.906  9.617   16.068  1.000 22.782  0 304  ALA   A HA   1 c 1 
ATOM   3858  H  HB1  . ALA   A  1  249 ? 12.399  7.626   14.969  1.000 23.136  0 304  ALA   A HB1  1 c 1 
ATOM   3859  H  HB2  . ALA   A  1  249 ? 12.786  8.838   14.022  1.000 23.183  0 304  ALA   A HB2  1 c 1 
ATOM   3860  H  HB3  . ALA   A  1  249 ? 13.917  8.058   14.814  1.000 23.582  0 304  ALA   A HB3  1 c 1 
ATOM   3861  N  N    . PHE   A  1  250 ? 12.170  8.323   18.098  1.000 20.338  0 305  PHE   A N    1 ? 1 
ATOM   3862  C  CA   . PHE   A  1  250 ? 12.154  7.281   19.106  1.000 17.901  0 305  PHE   A CA   1 ? 1 
ATOM   3863  C  C    . PHE   A  1  250 ? 11.612  5.986   18.511  1.000 20.044  0 305  PHE   A C    1 ? 1 
ATOM   3864  O  O    . PHE   A  1  250 ? 10.680  6.007   17.720  1.000 17.853  0 305  PHE   A O    1 ? 1 
ATOM   3865  C  CB   . PHE   A  1  250 ? 11.260  7.738   20.259  1.000 19.561  0 305  PHE   A CB   1 ? 1 
ATOM   3866  C  CG   . PHE   A  1  250 ? 11.004  6.673   21.284  1.000 23.481  0 305  PHE   A CG   1 ? 1 
ATOM   3867  C  CD1  . PHE   A  1  250 ? 11.879  6.486   22.352  1.000 21.040  0 305  PHE   A CD1  1 ? 1 
ATOM   3868  C  CD2  . PHE   A  1  250 ? 9.902   5.840   21.174  1.000 21.365  0 305  PHE   A CD2  1 ? 1 
ATOM   3869  C  CE1  . PHE   A  1  250 ? 11.658  5.483   23.286  1.000 27.284  0 305  PHE   A CE1  1 ? 1 
ATOM   3870  C  CE2  . PHE   A  1  250 ? 9.662   4.841   22.135  1.000 22.009  0 305  PHE   A CE2  1 ? 1 
ATOM   3871  C  CZ   . PHE   A  1  250 ? 10.546  4.658   23.174  1.000 27.100  0 305  PHE   A CZ   1 ? 1 
ATOM   3872  H  H    . PHE   A  1  250 ? 11.420  8.838   18.009  1.000 20.134  0 305  PHE   A H    1 c 1 
ATOM   3873  H  HA   . PHE   A  1  250 ? 13.074  7.131   19.442  1.000 19.417  0 305  PHE   A HA   1 c 1 
ATOM   3874  H  HB2  . PHE   A  1  250 ? 11.683  8.506   20.697  1.000 20.261  0 305  PHE   A HB2  1 c 1 
ATOM   3875  H  HB3  . PHE   A  1  250 ? 10.402  8.036   19.890  1.000 19.722  0 305  PHE   A HB3  1 c 1 
ATOM   3876  H  HD1  . PHE   A  1  250 ? 12.643  7.036   22.429  1.000 23.178  0 305  PHE   A HD1  1 c 1 
ATOM   3877  H  HD2  . PHE   A  1  250 ? 9.297   5.959   20.460  1.000 21.564  0 305  PHE   A HD2  1 c 1 
ATOM   3878  H  HE1  . PHE   A  1  250 ? 12.258  5.371   24.006  1.000 25.942  0 305  PHE   A HE1  1 c 1 
ATOM   3879  H  HE2  . PHE   A  1  250 ? 8.909   4.279   22.051  1.000 22.729  0 305  PHE   A HE2  1 c 1 
ATOM   3880  H  HZ   . PHE   A  1  250 ? 10.387  3.987   23.818  1.000 26.161  0 305  PHE   A HZ   1 c 1 
ATOM   3881  N  N    . TYR   A  1  251 ? 12.213  4.869   18.904  1.000 19.329  0 306  TYR   A N    1 ? 1 
ATOM   3882  C  CA   . TYR   A  1  251 ? 11.749  3.543   18.545  1.000 20.567  0 306  TYR   A CA   1 ? 1 
ATOM   3883  C  C    . TYR   A  1  251 ? 11.596  2.711   19.820  1.000 19.436  0 306  TYR   A C    1 ? 1 
ATOM   3884  O  O    . TYR   A  1  251 ? 12.417  2.794   20.747  1.000 19.257  0 306  TYR   A O    1 ? 1 
ATOM   3885  C  CB   . TYR   A  1  251 ? 12.714  2.825   17.587  1.000 16.320  0 306  TYR   A CB   1 ? 1 
ATOM   3886  C  CG   . TYR   A  1  251 ? 12.377  1.356   17.378  1.000 19.459  0 306  TYR   A CG   1 ? 1 
ATOM   3887  C  CD1  . TYR   A  1  251 ? 11.301  0.968   16.579  1.000 24.160  0 306  TYR   A CD1  1 ? 1 
ATOM   3888  C  CD2  . TYR   A  1  251 ? 13.136  0.363   17.965  1.000 19.125  0 306  TYR   A CD2  1 ? 1 
ATOM   3889  C  CE1  . TYR   A  1  251 ? 10.982  -0.368  16.416  1.000 22.590  0 306  TYR   A CE1  1 ? 1 
ATOM   3890  C  CE2  . TYR   A  1  251 ? 12.827  -0.966  17.820  1.000 17.595  0 306  TYR   A CE2  1 ? 1 
ATOM   3891  C  CZ   . TYR   A  1  251 ? 11.747  -1.334  17.044  1.000 24.132  0 306  TYR   A CZ   1 ? 1 
ATOM   3892  O  OH   . TYR   A  1  251 ? 11.501  -2.654  16.903  1.000 16.443  0 306  TYR   A OH   1 ? 1 
ATOM   3893  H  H    . TYR   A  1  251 ? 12.959  4.936   19.428  1.000 20.170  0 306  TYR   A H    1 c 1 
ATOM   3894  H  HA   . TYR   A  1  251 ? 10.866  3.618   18.109  1.000 18.861  0 306  TYR   A HA   1 c 1 
ATOM   3895  H  HB2  . TYR   A  1  251 ? 12.694  3.284   16.722  1.000 17.633  0 306  TYR   A HB2  1 c 1 
ATOM   3896  H  HB3  . TYR   A  1  251 ? 13.623  2.898   17.947  1.000 18.196  0 306  TYR   A HB3  1 c 1 
ATOM   3897  H  HD1  . TYR   A  1  251 ? 10.764  1.627   16.170  1.000 22.104  0 306  TYR   A HD1  1 c 1 
ATOM   3898  H  HD2  . TYR   A  1  251 ? 13.862  0.606   18.515  1.000 19.296  0 306  TYR   A HD2  1 c 1 
ATOM   3899  H  HE1  . TYR   A  1  251 ? 10.247  -0.620  15.882  1.000 22.728  0 306  TYR   A HE1  1 c 1 
ATOM   3900  H  HE2  . TYR   A  1  251 ? 13.359  -1.624  18.234  1.000 19.707  0 306  TYR   A HE2  1 c 1 
ATOM   3901  H  HH   . TYR   A  1  251 ? 10.854  -2.921  16.397  0.000 7.840   0 306  TYR   A HH   1 c 1 
ATOM   3902  N  N    . SER   A  1  252 ? 10.536  1.898   19.855  1.000 19.732  0 307  SER   A N    1 ? 1 
ATOM   3903  C  CA   . SER   A  1  252 ? 10.341  0.927   20.919  1.000 22.285  0 307  SER   A CA   1 ? 1 
ATOM   3904  C  C    . SER   A  1  252 ? 10.024  -0.439  20.325  1.000 19.010  0 307  SER   A C    1 ? 1 
ATOM   3905  O  O    . SER   A  1  252 ? 9.243   -0.540  19.389  1.000 16.945  0 307  SER   A O    1 ? 1 
ATOM   3906  C  CB   . SER   A  1  252 ? 9.244   1.370   21.885  1.000 27.313  0 307  SER   A CB   1 ? 1 
ATOM   3907  O  OG   . SER   A  1  252 ? 8.822   0.301   22.726  1.000 21.009  0 307  SER   A OG   1 ? 1 
ATOM   3908  H  H    . SER   A  1  252 ? 9.910   1.950   19.191  1.000 19.744  0 307  SER   A H    1 c 1 
ATOM   3909  H  HA   . SER   A  1  252 ? 11.192  0.852   21.428  1.000 22.206  0 307  SER   A HA   1 c 1 
ATOM   3910  H  HB2  . SER   A  1  252 ? 9.581   2.105   22.441  1.000 24.581  0 307  SER   A HB2  1 c 1 
ATOM   3911  H  HB3  . SER   A  1  252 ? 8.474   1.704   21.371  1.000 24.055  0 307  SER   A HB3  1 c 1 
ATOM   3912  H  HG   . SER   A  1  252 ? 9.306   0.310   23.426  0.000 12.150  0 307  SER   A HG   1 c 1 
ATOM   3913  N  N    . GLU   A  1  253 ? 10.582  -1.480  20.944  1.000 17.880  0 308  GLU   A N    1 ? 1 
ATOM   3914  C  CA   . GLU   A  1  253 ? 10.374  -2.868  20.563  1.000 18.590  0 308  GLU   A CA   1 ? 1 
ATOM   3915  C  C    . GLU   A  1  253 ? 9.030   -3.366  21.093  1.000 22.090  0 308  GLU   A C    1 ? 1 
ATOM   3916  O  O    . GLU   A  1  253 ? 8.571   -4.448  20.721  1.000 19.494  0 308  GLU   A O    1 ? 1 
ATOM   3917  C  CB   . GLU   A  1  253 ? 11.506  -3.763  21.094  1.000 22.389  0 308  GLU   A CB   1 ? 1 
ATOM   3918  C  CG   . GLU   A  1  253 ? 12.896  -3.192  20.794  1.000 33.584  0 308  GLU   A CG   1 ? 1 
ATOM   3919  C  CD   . GLU   A  1  253 ? 13.403  -2.159  21.800  1.000 51.993  0 308  GLU   A CD   1 ? 1 
ATOM   3920  O  OE1  . GLU   A  1  253 ? 12.682  -1.909  22.814  1.000 31.513  0 308  GLU   A OE1  1 ? 1 
ATOM   3921  O  OE2  . GLU   A  1  253 ? 14.527  -1.629  21.581  1.000 31.137  0 308  GLU   A OE2  1 ? 1 
ATOM   3922  H  H    . GLU   A  1  253 ? 11.103  -1.311  21.675  1.000 19.001  0 308  GLU   A H    1 c 1 
ATOM   3923  H  HA   . GLU   A  1  253 ? 10.364  -2.921  19.580  1.000 19.234  0 308  GLU   A HA   1 c 1 
ATOM   3924  H  HB2  . GLU   A  1  253 ? 11.400  -3.870  22.062  1.000 23.911  0 308  GLU   A HB2  1 c 1 
ATOM   3925  H  HB3  . GLU   A  1  253 ? 11.427  -4.649  20.681  1.000 23.456  0 308  GLU   A HB3  1 c 1 
ATOM   3926  H  HG2  . GLU   A  1  253 ? 13.540  -3.931  20.761  1.000 33.534  0 308  GLU   A HG2  1 c 1 
ATOM   3927  H  HG3  . GLU   A  1  253 ? 12.881  -2.778  19.909  1.000 32.622  0 308  GLU   A HG3  1 c 1 
ATOM   3928  N  N    . GLN   A  1  254 ? 8.399   -2.566  21.956  1.000 18.341  0 309  GLN   A N    1 ? 1 
ATOM   3929  C  CA   . GLN   A  1  254 ? 7.063   -2.833  22.463  1.000 22.009  0 309  GLN   A CA   1 ? 1 
ATOM   3930  C  C    . GLN   A  1  254 ? 5.978   -2.069  21.696  1.000 23.002  0 309  GLN   A C    1 ? 1 
ATOM   3931  O  O    . GLN   A  1  254 ? 6.205   -0.952  21.233  1.000 22.143  0 309  GLN   A O    1 ? 1 
ATOM   3932  C  CB   . GLN   A  1  254 ? 7.029   -2.463  23.963  1.000 19.856  0 309  GLN   A CB   1 ? 1 
ATOM   3933  C  CG   . GLN   A  1  254 ? 7.857   -3.436  24.828  1.000 25.897  0 309  GLN   A CG   1 ? 1 
ATOM   3934  C  CD   . GLN   A  1  254 ? 7.173   -4.811  25.013  1.000 28.450  0 309  GLN   A CD   1 ? 1 
ATOM   3935  O  OE1  . GLN   A  1  254 ? 6.457   -5.334  24.136  1.000 26.333  0 309  GLN   A OE1  1 ? 1 
ATOM   3936  N  NE2  . GLN   A  1  254 ? 7.372   -5.400  26.149  1.000 26.180  0 309  GLN   A NE2  1 ? 1 
ATOM   3937  H  HA   . GLN   A  1  254 ? 6.890   -3.795  22.372  1.000 21.050  0 309  GLN   A HA   1 c 1 
ATOM   3938  H  HB2  . GLN   A  1  254 ? 7.380   -1.554  24.071  1.000 21.521  0 309  GLN   A HB2  1 c 1 
ATOM   3939  H  HB3  . GLN   A  1  254 ? 6.099   -2.467  24.270  1.000 21.600  0 309  GLN   A HB3  1 c 1 
ATOM   3940  H  HG2  . GLN   A  1  254 ? 8.734   -3.571  24.410  1.000 24.864  0 309  GLN   A HG2  1 c 1 
ATOM   3941  H  HG3  . GLN   A  1  254 ? 8.006   -3.032  25.709  1.000 25.316  0 309  GLN   A HG3  1 c 1 
ATOM   3942  H  HE21 . GLN   A  1  254 ? 7.963   -5.074  26.721  1.000 27.276  0 309  GLN   A HE21 1 c 1 
ATOM   3943  H  HE22 . GLN   A  1  254 ? 6.918   -6.131  26.354  1.000 27.179  0 309  GLN   A HE22 1 c 1 
ATOM   3944  N  N    . PRO   A  1  255 ? 4.724   -2.573  21.618  1.000 21.939  0 310  PRO   A N    1 ? 1 
ATOM   3945  C  CA   . PRO   A  1  255 ? 4.311   -3.817  22.281  1.000 22.284  0 310  PRO   A CA   1 ? 1 
ATOM   3946  C  C    . PRO   A  1  255 ? 4.532   -5.132  21.534  1.000 19.036  0 310  PRO   A C    1 ? 1 
ATOM   3947  O  O    . PRO   A  1  255 ? 4.072   -6.169  21.985  1.000 22.779  0 310  PRO   A O    1 ? 1 
ATOM   3948  C  CB   . PRO   A  1  255 ? 2.819   -3.588  22.465  1.000 20.861  0 310  PRO   A CB   1 ? 1 
ATOM   3949  C  CG   . PRO   A  1  255 ? 2.422   -2.681  21.325  1.000 24.496  0 310  PRO   A CG   1 ? 1 
ATOM   3950  C  CD   . PRO   A  1  255 ? 3.592   -1.861  20.989  1.000 22.444  0 310  PRO   A CD   1 ? 1 
ATOM   3951  H  HA   . PRO   A  1  255 ? 4.735   -3.865  23.173  1.000 21.776  0 310  PRO   A HA   1 c 1 
ATOM   3952  H  HB2  . PRO   A  1  255 ? 2.324   -4.433  22.423  1.000 22.145  0 310  PRO   A HB2  1 c 1 
ATOM   3953  H  HB3  . PRO   A  1  255 ? 2.636   -3.160  23.328  1.000 22.317  0 310  PRO   A HB3  1 c 1 
ATOM   3954  H  HG2  . PRO   A  1  255 ? 2.145   -3.210  20.549  1.000 22.790  0 310  PRO   A HG2  1 c 1 
ATOM   3955  H  HG3  . PRO   A  1  255 ? 1.673   -2.109  21.590  1.000 23.047  0 310  PRO   A HG3  1 c 1 
ATOM   3956  H  HD2  . PRO   A  1  255 ? 3.710   -1.800  20.023  1.000 22.329  0 310  PRO   A HD2  1 c 1 
ATOM   3957  H  HD3  . PRO   A  1  255 ? 3.503   -0.961  21.350  1.000 22.773  0 310  PRO   A HD3  1 c 1 
ATOM   3958  N  N    . ASP   A  1  256 ? 5.292   -5.109  20.443  1.000 15.484  0 311  ASP   A N    1 ? 1 
ATOM   3959  C  CA   . ASP   A  1  256 ? 5.569   -6.308  19.689  1.000 18.986  0 311  ASP   A CA   1 ? 1 
ATOM   3960  C  C    . ASP   A  1  256 ? 6.179   -7.444  20.501  1.000 21.072  0 311  ASP   A C    1 ? 1 
ATOM   3961  O  O    . ASP   A  1  256 ? 5.759   -8.586  20.399  1.000 17.836  0 311  ASP   A O    1 ? 1 
ATOM   3962  C  CB   . ASP   A  1  256 ? 6.540   -5.953  18.561  1.000 22.683  0 311  ASP   A CB   1 ? 1 
ATOM   3963  C  CG   . ASP   A  1  256 ? 6.865   -7.100  17.639  1.000 26.091  0 311  ASP   A CG   1 ? 1 
ATOM   3964  O  OD1  . ASP   A  1  256 ? 6.045   -7.414  16.774  1.000 19.734  0 311  ASP   A OD1  1 ? 1 
ATOM   3965  O  OD2  . ASP   A  1  256 ? 7.923   -7.695  17.802  1.000 22.469  0 311  ASP   A OD2  1 ? 1 
ATOM   3966  H  H    . ASP   A  1  256 ? 5.650   -4.318  20.157  1.000 16.876  0 311  ASP   A H    1 c 1 
ATOM   3967  H  HA   . ASP   A  1  256 ? 4.725   -6.624  19.288  1.000 18.885  0 311  ASP   A HA   1 c 1 
ATOM   3968  H  HB2  . ASP   A  1  256 ? 6.150   -5.239  18.023  1.000 21.972  0 311  ASP   A HB2  1 c 1 
ATOM   3969  H  HB3  . ASP   A  1  256 ? 7.375   -5.623  18.947  1.000 22.493  0 311  ASP   A HB3  1 c 1 
ATOM   3970  N  N    . PHE   A  1  257 ? 7.220   -7.137  21.262  1.000 16.710  0 312  PHE   A N    1 ? 1 
ATOM   3971  C  CA   . PHE   A  1  257 ? 7.901   -8.156  22.029  1.000 19.803  0 312  PHE   A CA   1 ? 1 
ATOM   3972  C  C    . PHE   A  1  257 ? 6.926   -8.960  22.905  1.000 24.286  0 312  PHE   A C    1 ? 1 
ATOM   3973  O  O    . PHE   A  1  257 ? 6.914   -10.189 22.862  1.000 25.900  0 312  PHE   A O    1 ? 1 
ATOM   3974  C  CB   . PHE   A  1  257 ? 8.981   -7.475  22.844  1.000 23.327  0 312  PHE   A CB   1 ? 1 
ATOM   3975  C  CG   . PHE   A  1  257 ? 9.761   -8.375  23.774  1.000 33.927  0 312  PHE   A CG   1 ? 1 
ATOM   3976  C  CD1  . PHE   A  1  257 ? 10.822  -9.132  23.307  1.000 36.643  0 312  PHE   A CD1  1 ? 1 
ATOM   3977  C  CD2  . PHE   A  1  257 ? 9.465   -8.421  25.131  1.000 51.821  0 312  PHE   A CD2  1 ? 1 
ATOM   3978  C  CE1  . PHE   A  1  257 ? 11.574  -9.918  24.182  1.000 49.855  0 312  PHE   A CE1  1 ? 1 
ATOM   3979  C  CE2  . PHE   A  1  257 ? 10.226  -9.200  26.002  1.000 61.072  0 312  PHE   A CE2  1 ? 1 
ATOM   3980  C  CZ   . PHE   A  1  257 ? 11.271  -9.946  25.520  1.000 54.031  0 312  PHE   A CZ   1 ? 1 
ATOM   3981  H  H    . PHE   A  1  257 ? 7.517   -6.273  21.302  1.000 18.163  0 312  PHE   A H    1 c 1 
ATOM   3982  H  HA   . PHE   A  1  257 ? 8.336   -8.783  21.396  1.000 20.381  0 312  PHE   A HA   1 c 1 
ATOM   3983  H  HB2  . PHE   A  1  257 ? 9.608   -7.048  22.224  1.000 24.100  0 312  PHE   A HB2  1 c 1 
ATOM   3984  H  HB3  . PHE   A  1  257 ? 8.562   -6.766  23.374  1.000 24.442  0 312  PHE   A HB3  1 c 1 
ATOM   3985  H  HD1  . PHE   A  1  257 ? 11.048  -9.103  22.390  1.000 38.314  0 312  PHE   A HD1  1 c 1 
ATOM   3986  H  HD2  . PHE   A  1  257 ? 8.759   -7.894  25.470  1.000 47.767  0 312  PHE   A HD2  1 c 1 
ATOM   3987  H  HE1  . PHE   A  1  257 ? 12.290  -10.436 23.850  1.000 47.358  0 312  PHE   A HE1  1 c 1 
ATOM   3988  H  HE2  . PHE   A  1  257 ? 10.008  -9.230  26.920  1.000 57.059  0 312  PHE   A HE2  1 c 1 
ATOM   3989  H  HZ   . PHE   A  1  257 ? 11.768  -10.496 26.104  1.000 54.834  0 312  PHE   A HZ   1 c 1 
ATOM   3990  N  N    . SER   A  1  258 ? 6.054   -8.268  23.653  1.000 22.389  0 313  SER   A N    1 ? 1 
ATOM   3991  C  CA   . SER   A  1  258 ? 5.073   -8.938  24.487  1.000 25.746  0 313  SER   A CA   1 ? 1 
ATOM   3992  C  C    . SER   A  1  258 ? 4.006   -9.628  23.645  1.000 23.579  0 313  SER   A C    1 ? 1 
ATOM   3993  O  O    . SER   A  1  258 ? 3.625   -10.769 23.937  1.000 22.386  0 313  SER   A O    1 ? 1 
ATOM   3994  C  CB   . SER   A  1  258 ? 4.450   -7.964  25.483  1.000 29.187  0 313  SER   A CB   1 ? 1 
ATOM   3995  O  OG   . SER   A  1  258 ? 5.475   -7.420  26.306  1.000 26.458  0 313  SER   A OG   1 ? 1 
ATOM   3996  H  H    . SER   A  1  258 ? 6.076   -7.355  23.642  1.000 23.224  0 313  SER   A H    1 c 1 
ATOM   3997  H  HA   . SER   A  1  258 ? 5.550   -9.641  25.006  1.000 25.720  0 313  SER   A HA   1 c 1 
ATOM   3998  H  HB2  . SER   A  1  258 ? 3.991   -7.240  24.999  1.000 27.270  0 313  SER   A HB2  1 c 1 
ATOM   3999  H  HB3  . SER   A  1  258 ? 3.789   -8.435  26.040  1.000 27.969  0 313  SER   A HB3  1 c 1 
ATOM   4000  H  HG   . SER   A  1  258 ? 5.753   -6.707  25.934  0.000 15.540  0 313  SER   A HG   1 c 1 
ATOM   4001  N  N    . GLY   A  1  259 ? 3.558   -8.936  22.592  1.000 20.100  0 314  GLY   A N    1 ? 1 
ATOM   4002  C  CA   . GLY   A  1  259 ? 2.519   -9.464  21.727  1.000 20.972  0 314  GLY   A CA   1 ? 1 
ATOM   4003  C  C    . GLY   A  1  259 ? 2.837   -10.873 21.240  1.000 17.318  0 314  GLY   A C    1 ? 1 
ATOM   4004  O  O    . GLY   A  1  259 ? 1.944   -11.707 21.128  1.000 21.500  0 314  GLY   A O    1 ? 1 
ATOM   4005  H  H    . GLY   A  1  259 ? 3.905   -8.110  22.411  1.000 20.781  0 314  GLY   A H    1 c 1 
ATOM   4006  H  HA2  . GLY   A  1  259 ? 1.663   -9.476  22.223  1.000 19.925  0 314  GLY   A HA2  1 c 1 
ATOM   4007  H  HA3  . GLY   A  1  259 ? 2.414   -8.863  20.949  1.000 19.359  0 314  GLY   A HA3  1 c 1 
ATOM   4008  N  N    . HIS   A  1  260 ? 4.109   -11.109 20.893  1.000 20.023  0 315  HIS   A N    1 ? 1 
ATOM   4009  C  CA   . HIS   A  1  260 ? 4.546   -12.413 20.420  1.000 22.266  0 315  HIS   A CA   1 ? 1 
ATOM   4010  C  C    . HIS   A  1  260 ? 4.415   -13.433 21.536  1.000 20.495  0 315  HIS   A C    1 ? 1 
ATOM   4011  O  O    . HIS   A  1  260 ? 4.092   -14.578 21.280  1.000 20.195  0 315  HIS   A O    1 ? 1 
ATOM   4012  C  CB   . HIS   A  1  260 ? 6.020   -12.417 19.938  1.000 21.262  0 315  HIS   A CB   1 ? 1 
ATOM   4013  C  CG   . HIS   A  1  260 ? 6.236   -11.799 18.582  1.000 28.692  0 315  HIS   A CG   1 ? 1 
ATOM   4014  N  ND1  . HIS   A  1  260 ? 5.824   -12.428 17.434  1.000 23.814  0 315  HIS   A ND1  1 ? 1 
ATOM   4015  C  CD2  . HIS   A  1  260 ? 6.853   -10.642 18.237  1.000 23.823  0 315  HIS   A CD2  1 ? 1 
ATOM   4016  C  CE1  . HIS   A  1  260 ? 6.183   -11.646 16.432  1.000 28.158  0 315  HIS   A CE1  1 ? 1 
ATOM   4017  N  NE2  . HIS   A  1  260 ? 6.821   -10.563 16.873  1.000 26.521  0 315  HIS   A NE2  1 ? 1 
ATOM   4018  H  H    . HIS   A  1  260 ? 4.722   -10.433 20.944  1.000 19.645  0 315  HIS   A H    1 c 1 
ATOM   4019  H  HA   . HIS   A  1  260 ? 3.967   -12.679 19.669  1.000 20.954  0 315  HIS   A HA   1 c 1 
ATOM   4020  H  HB2  . HIS   A  1  260 ? 6.562   -11.932 20.593  1.000 23.171  0 315  HIS   A HB2  1 c 1 
ATOM   4021  H  HB3  . HIS   A  1  260 ? 6.338   -13.343 19.913  1.000 23.328  0 315  HIS   A HB3  1 c 1 
ATOM   4022  H  HD1  . HIS   A  1  260 ? 5.424   -13.221 17.405  0.000 14.300  0 315  HIS   A HD1  1 c 1 
ATOM   4023  H  HD2  . HIS   A  1  260 ? 7.247   -10.021 18.829  1.000 25.434  0 315  HIS   A HD2  1 c 1 
ATOM   4024  H  HE1  . HIS   A  1  260 ? 6.016   -11.831 15.525  1.000 26.230  0 315  HIS   A HE1  1 c 1 
ATOM   4025  H  HE2  . HIS   A  1  260 ? 7.141   -9.917  16.371  0.000 17.230  0 315  HIS   A HE2  1 c 1 
ATOM   4026  N  N    . LYS   A  1  261 ? 4.696   -13.017 22.778  1.000 21.337  0 316  LYS   A N    1 ? 1 
ATOM   4027  C  CA   . LYS   A  1  261 ? 4.669   -13.960 23.896  1.000 26.740  0 316  LYS   A CA   1 ? 1 
ATOM   4028  C  C    . LYS   A  1  261 ? 3.247   -14.305 24.346  1.000 26.468  0 316  LYS   A C    1 ? 1 
ATOM   4029  O  O    . LYS   A  1  261 ? 2.911   -15.482 24.563  1.000 23.259  0 316  LYS   A O    1 ? 1 
ATOM   4030  C  CB   . LYS   A  1  261 ? 5.491   -13.435 25.074  1.000 28.487  0 316  LYS   A CB   1 ? 1 
ATOM   4031  C  CG   . LYS   A  1  261 ? 5.626   -14.407 26.260  1.000 48.091  0 316  LYS   A CG   1 ? 1 
ATOM   4032  C  CD   . LYS   A  1  261 ? 6.386   -15.711 25.893  1.000 80.831  0 316  LYS   A CD   1 ? 1 
ATOM   4033  C  CE   . LYS   A  1  261 ? 6.246   -16.830 26.911  1.000 78.149  0 316  LYS   A CE   1 ? 1 
ATOM   4034  N  NZ   . LYS   A  1  261 ? 6.790   -16.425 28.233  1.000 70.767  0 316  LYS   A NZ   1 ? 1 
ATOM   4035  H  H    . LYS   A  1  261 ? 4.921   -12.145 22.934  1.000 21.983  0 316  LYS   A H    1 c 1 
ATOM   4036  H  HA   . LYS   A  1  261 ? 5.091   -14.792 23.584  1.000 26.298  0 316  LYS   A HA   1 c 1 
ATOM   4037  H  HB2  . LYS   A  1  261 ? 6.390   -13.214 24.750  1.000 31.241  0 316  LYS   A HB2  1 c 1 
ATOM   4038  H  HB3  . LYS   A  1  261 ? 5.078   -12.607 25.395  1.000 31.201  0 316  LYS   A HB3  1 c 1 
ATOM   4039  H  HG2  . LYS   A  1  261 ? 6.103   -13.953 26.987  1.000 47.331  0 316  LYS   A HG2  1 c 1 
ATOM   4040  H  HG3  . LYS   A  1  261 ? 4.731   -14.638 26.588  1.000 47.138  0 316  LYS   A HG3  1 c 1 
ATOM   4041  H  HD2  . LYS   A  1  261 ? 6.062   -16.033 25.028  1.000 69.101  0 316  LYS   A HD2  1 c 1 
ATOM   4042  H  HD3  . LYS   A  1  261 ? 7.339   -15.500 25.792  1.000 70.487  0 316  LYS   A HD3  1 c 1 
ATOM   4043  H  HE2  . LYS   A  1  261 ? 5.304   -17.065 27.012  1.000 77.007  0 316  LYS   A HE2  1 c 1 
ATOM   4044  H  HE3  . LYS   A  1  261 ? 6.724   -17.621 26.597  1.000 77.189  0 316  LYS   A HE3  1 c 1 
ATOM   4045  H  HZ1  . LYS   A  1  261 ? 6.236   -15.822 28.623  1.000 72.861  0 316  LYS   A HZ1  1 c 1 
ATOM   4046  H  HZ2  . LYS   A  1  261 ? 7.610   -16.051 28.127  1.000 73.023  0 316  LYS   A HZ2  1 c 1 
ATOM   4047  H  HZ3  . LYS   A  1  261 ? 6.863   -17.152 28.771  1.000 73.640  0 316  LYS   A HZ3  1 c 1 
ATOM   4048  N  N    . TYR   A  1  262 ? 2.395   -13.283 24.432  1.000 26.106  0 317  TYR   A N    1 ? 1 
ATOM   4049  C  CA   . TYR   A  1  262 ? 1.081   -13.444 25.037  1.000 27.528  0 317  TYR   A CA   1 ? 1 
ATOM   4050  C  C    . TYR   A  1  262 ? -0.080  -13.427 24.053  1.000 23.558  0 317  TYR   A C    1 ? 1 
ATOM   4051  O  O    . TYR   A  1  262 ? -1.214  -13.597 24.455  1.000 22.323  0 317  TYR   A O    1 ? 1 
ATOM   4052  C  CB   . TYR   A  1  262 ? 0.868   -12.305 26.054  1.000 27.364  0 317  TYR   A CB   1 ? 1 
ATOM   4053  C  CG   . TYR   A  1  262 ? 1.925   -12.271 27.133  1.000 29.779  0 317  TYR   A CG   1 ? 1 
ATOM   4054  C  CD1  . TYR   A  1  262 ? 2.165   -13.380 27.934  1.000 34.586  0 317  TYR   A CD1  1 ? 1 
ATOM   4055  C  CD2  . TYR   A  1  262 ? 2.681   -11.122 27.363  1.000 30.318  0 317  TYR   A CD2  1 ? 1 
ATOM   4056  C  CE1  . TYR   A  1  262 ? 3.115   -13.351 28.945  1.000 40.607  0 317  TYR   A CE1  1 ? 1 
ATOM   4057  C  CE2  . TYR   A  1  262 ? 3.649   -11.094 28.353  1.000 36.459  0 317  TYR   A CE2  1 ? 1 
ATOM   4058  C  CZ   . TYR   A  1  262 ? 3.862   -12.209 29.141  1.000 43.602  0 317  TYR   A CZ   1 ? 1 
ATOM   4059  O  OH   . TYR   A  1  262 ? 4.810   -12.165 30.134  1.000 50.269  0 317  TYR   A OH   1 ? 1 
ATOM   4060  H  H    . TYR   A  1  262 ? 2.637   -12.462 24.113  1.000 25.930  0 317  TYR   A H    1 c 1 
ATOM   4061  H  HA   . TYR   A  1  262 ? 1.059   -14.306 25.525  1.000 27.074  0 317  TYR   A HA   1 c 1 
ATOM   4062  H  HB2  . TYR   A  1  262 ? 0.870   -11.451 25.573  1.000 27.411  0 317  TYR   A HB2  1 c 1 
ATOM   4063  H  HB3  . TYR   A  1  262 ? -0.012  -12.416 26.471  1.000 28.074  0 317  TYR   A HB3  1 c 1 
ATOM   4064  H  HD1  . TYR   A  1  262 ? 1.654   -14.162 27.805  1.000 34.846  0 317  TYR   A HD1  1 c 1 
ATOM   4065  H  HD2  . TYR   A  1  262 ? 2.543   -10.358 26.827  1.000 30.950  0 317  TYR   A HD2  1 c 1 
ATOM   4066  H  HE1  . TYR   A  1  262 ? 3.266   -14.114 29.478  1.000 40.315  0 317  TYR   A HE1  1 c 1 
ATOM   4067  H  HE2  . TYR   A  1  262 ? 4.154   -10.311 28.500  1.000 36.165  0 317  TYR   A HE2  1 c 1 
ATOM   4068  H  HH   . TYR   A  1  262 ? 4.956   -12.841 30.635  0.000 34.890  0 317  TYR   A HH   1 c 1 
ATOM   4069  N  N    . GLY   A  1  263 ? 0.191   -13.131 22.780  1.000 25.724  0 318  GLY   A N    1 ? 1 
ATOM   4070  C  CA   . GLY   A  1  263 ? -0.870  -12.856 21.838  1.000 20.428  0 318  GLY   A CA   1 ? 1 
ATOM   4071  C  C    . GLY   A  1  263 ? -1.364  -11.421 21.968  1.000 22.466  0 318  GLY   A C    1 ? 1 
ATOM   4072  O  O    . GLY   A  1  263 ? -1.223  -10.808 23.020  1.000 26.234  0 318  GLY   A O    1 ? 1 
ATOM   4073  H  H    . GLY   A  1  263 ? 1.057   -13.105 22.491  1.000 23.698  0 318  GLY   A H    1 c 1 
ATOM   4074  H  HA2  . GLY   A  1  263 ? -0.530  -13.007 20.920  1.000 21.628  0 318  GLY   A HA2  1 c 1 
ATOM   4075  H  HA3  . GLY   A  1  263 ? -1.621  -13.482 21.996  1.000 22.247  0 318  GLY   A HA3  1 c 1 
ATOM   4076  N  N    . PRO   A  1  264 ? -2.008  -10.851 20.922  1.000 20.193  0 319  PRO   A N    1 ? 1 
ATOM   4077  C  CA   . PRO   A  1  264 ? -2.348  -9.426  20.931  1.000 20.708  0 319  PRO   A CA   1 ? 1 
ATOM   4078  C  C    . PRO   A  1  264 ? -3.381  -9.063  21.990  1.000 25.445  0 319  PRO   A C    1 ? 1 
ATOM   4079  O  O    . PRO   A  1  264 ? -3.380  -7.935  22.459  1.000 31.308  0 319  PRO   A O    1 ? 1 
ATOM   4080  C  CB   . PRO   A  1  264 ? -2.879  -9.148  19.506  1.000 24.618  0 319  PRO   A CB   1 ? 1 
ATOM   4081  C  CG   . PRO   A  1  264 ? -3.249  -10.544 18.962  1.000 22.556  0 319  PRO   A CG   1 ? 1 
ATOM   4082  C  CD   . PRO   A  1  264 ? -2.335  -11.530 19.657  1.000 18.198  0 319  PRO   A CD   1 ? 1 
ATOM   4083  H  HA   . PRO   A  1  264 ? -1.523  -8.900  21.077  1.000 21.876  0 319  PRO   A HA   1 c 1 
ATOM   4084  H  HB2  . PRO   A  1  264 ? -3.666  -8.563  19.531  1.000 22.974  0 319  PRO   A HB2  1 c 1 
ATOM   4085  H  HB3  . PRO   A  1  264 ? -2.190  -8.729  18.950  1.000 22.644  0 319  PRO   A HB3  1 c 1 
ATOM   4086  H  HG2  . PRO   A  1  264 ? -4.186  -10.750 19.156  1.000 21.903  0 319  PRO   A HG2  1 c 1 
ATOM   4087  H  HG3  . PRO   A  1  264 ? -3.117  -10.581 17.993  1.000 21.327  0 319  PRO   A HG3  1 c 1 
ATOM   4088  H  HD2  . PRO   A  1  264 ? -2.790  -12.375 19.821  1.000 19.956  0 319  PRO   A HD2  1 c 1 
ATOM   4089  H  HD3  . PRO   A  1  264 ? -1.532  -11.697 19.131  1.000 19.355  0 319  PRO   A HD3  1 c 1 
ATOM   4090  N  N    . PHE   A  1  265 ? -4.248  -10.020 22.344  1.000 24.191  0 320  PHE   A N    1 ? 1 
ATOM   4091  C  CA   . PHE   A  1  265 ? -5.302  -9.821  23.328  1.000 31.607  0 320  PHE   A CA   1 ? 1 
ATOM   4092  C  C    . PHE   A  1  265 ? -4.976  -10.486 24.658  1.000 28.123  0 320  PHE   A C    1 ? 1 
ATOM   4093  O  O    . PHE   A  1  265 ? -5.848  -10.586 25.494  1.000 23.426  0 320  PHE   A O    1 ? 1 
ATOM   4094  C  CB   . PHE   A  1  265 ? -6.642  -10.441 22.883  1.000 37.833  0 320  PHE   A CB   1 ? 1 
ATOM   4095  C  CG   . PHE   A  1  265 ? -7.002  -10.165 21.439  1.000 62.026  0 320  PHE   A CG   1 ? 1 
ATOM   4096  C  CD1  . PHE   A  1  265 ? -7.218  -8.866  20.996  1.000 63.879  0 320  PHE   A CD1  1 ? 1 
ATOM   4097  C  CD2  . PHE   A  1  265 ? -7.110  -11.203 20.522  1.000 78.373  0 320  PHE   A CD2  1 ? 1 
ATOM   4098  C  CE1  . PHE   A  1  265 ? -7.539  -8.614  19.665  1.000 49.207  0 320  PHE   A CE1  1 ? 1 
ATOM   4099  C  CE2  . PHE   A  1  265 ? -7.435  -10.946 19.199  1.000 65.955  0 320  PHE   A CE2  1 ? 1 
ATOM   4100  C  CZ   . PHE   A  1  265 ? -7.636  -9.651  18.776  1.000 66.938  0 320  PHE   A CZ   1 ? 1 
ATOM   4101  H  H    . PHE   A  1  265 ? -4.185  -10.839 21.943  1.000 25.899  0 320  PHE   A H    1 c 1 
ATOM   4102  H  HA   . PHE   A  1  265 ? -5.430  -8.850  23.479  1.000 30.002  0 320  PHE   A HA   1 c 1 
ATOM   4103  H  HB2  . PHE   A  1  265 ? -6.597  -11.411 23.018  1.000 40.927  0 320  PHE   A HB2  1 c 1 
ATOM   4104  H  HB3  . PHE   A  1  265 ? -7.353  -10.091 23.458  1.000 40.757  0 320  PHE   A HB3  1 c 1 
ATOM   4105  H  HD1  . PHE   A  1  265 ? -7.143  -8.148  21.604  1.000 59.719  0 320  PHE   A HD1  1 c 1 
ATOM   4106  H  HD2  . PHE   A  1  265 ? -6.966  -12.093 20.804  1.000 70.773  0 320  PHE   A HD2  1 c 1 
ATOM   4107  H  HE1  . PHE   A  1  265 ? -7.683  -7.727  19.375  1.000 55.905  0 320  PHE   A HE1  1 c 1 
ATOM   4108  H  HE2  . PHE   A  1  265 ? -7.506  -11.659 18.584  1.000 68.315  0 320  PHE   A HE2  1 c 1 
ATOM   4109  H  HZ   . PHE   A  1  265 ? -7.863  -9.480  17.876  1.000 61.369  0 320  PHE   A HZ   1 c 1 
ATOM   4110  N  N    . GLY   A  1  266 ? -3.747  -10.961 24.863  1.000 24.793  0 321  GLY   A N    1 ? 1 
ATOM   4111  C  CA   . GLY   A  1  266 ? -3.427  -11.515 26.170  1.000 27.004  0 321  GLY   A CA   1 ? 1 
ATOM   4112  C  C    . GLY   A  1  266 ? -3.595  -10.433 27.230  1.000 25.676  0 321  GLY   A C    1 ? 1 
ATOM   4113  O  O    . GLY   A  1  266 ? -3.236  -9.299  26.984  1.000 24.912  0 321  GLY   A O    1 ? 1 
ATOM   4114  H  H    . GLY   A  1  266 ? -3.112  -10.943 24.206  1.000 25.503  0 321  GLY   A H    1 c 1 
ATOM   4115  H  HA2  . GLY   A  1  266 ? -4.030  -12.275 26.361  1.000 26.649  0 321  GLY   A HA2  1 c 1 
ATOM   4116  H  HA3  . GLY   A  1  266 ? -2.492  -11.841 26.169  1.000 26.277  0 321  GLY   A HA3  1 c 1 
ATOM   4117  N  N    . PRO   A  1  267 ? -4.144  -10.723 28.429  1.000 31.643  0 322  PRO   A N    1 ? 1 
ATOM   4118  C  CA   . PRO   A  1  267 ? -4.301  -9.688  29.448  1.000 33.792  0 322  PRO   A CA   1 ? 1 
ATOM   4119  C  C    . PRO   A  1  267 ? -2.985  -9.063  29.890  1.000 27.423  0 322  PRO   A C    1 ? 1 
ATOM   4120  O  O    . PRO   A  1  267 ? -2.986  -7.950  30.412  1.000 26.240  0 322  PRO   A O    1 ? 1 
ATOM   4121  C  CB   . PRO   A  1  267 ? -4.968  -10.418 30.635  1.000 33.944  0 322  PRO   A CB   1 ? 1 
ATOM   4122  C  CG   . PRO   A  1  267 ? -4.907  -11.860 30.317  1.000 32.027  0 322  PRO   A CG   1 ? 1 
ATOM   4123  C  CD   . PRO   A  1  267 ? -4.629  -12.043 28.860  1.000 26.317  0 322  PRO   A CD   1 ? 1 
ATOM   4124  H  HA   . PRO   A  1  267 ? -4.912  -8.987  29.109  1.000 31.729  0 322  PRO   A HA   1 c 1 
ATOM   4125  H  HB2  . PRO   A  1  267 ? -4.490  -10.231 31.471  1.000 33.897  0 322  PRO   A HB2  1 c 1 
ATOM   4126  H  HB3  . PRO   A  1  267 ? -5.899  -10.129 30.738  1.000 33.720  0 322  PRO   A HB3  1 c 1 
ATOM   4127  H  HG2  . PRO   A  1  267 ? -4.201  -12.287 30.844  1.000 31.494  0 322  PRO   A HG2  1 c 1 
ATOM   4128  H  HG3  . PRO   A  1  267 ? -5.756  -12.288 30.548  1.000 31.569  0 322  PRO   A HG3  1 c 1 
ATOM   4129  H  HD2  . PRO   A  1  267 ? -3.952  -12.729 28.716  1.000 28.657  0 322  PRO   A HD2  1 c 1 
ATOM   4130  H  HD3  . PRO   A  1  267 ? -5.439  -12.291 28.378  1.000 28.542  0 322  PRO   A HD3  1 c 1 
ATOM   4131  N  N    . GLU   A  1  268 ? -1.869  -9.768  29.661  1.000 29.941  0 323  GLU   A N    1 ? 1 
ATOM   4132  C  CA   . GLU   A  1  268 ? -0.547  -9.270  30.025  1.000 32.871  0 323  GLU   A CA   1 ? 1 
ATOM   4133  C  C    . GLU   A  1  268 ? -0.144  -8.056  29.173  1.000 34.503  0 323  GLU   A C    1 ? 1 
ATOM   4134  O  O    . GLU   A  1  268 ? 0.808   -7.343  29.484  1.000 30.915  0 323  GLU   A O    1 ? 1 
ATOM   4135  C  CB   . GLU   A  1  268 ? 0.517   -10.375 29.869  1.000 31.498  0 323  GLU   A CB   1 ? 1 
ATOM   4136  C  CG   . GLU   A  1  268 ? 0.206   -11.736 30.500  1.000 50.220  0 323  GLU   A CG   1 ? 1 
ATOM   4137  C  CD   . GLU   A  1  268 ? -0.767  -12.713 29.811  1.000 52.913  0 323  GLU   A CD   1 ? 1 
ATOM   4138  O  OE1  . GLU   A  1  268 ? -1.374  -12.403 28.750  1.000 35.414  0 323  GLU   A OE1  1 ? 1 
ATOM   4139  O  OE2  . GLU   A  1  268 ? -0.908  -13.827 30.369  1.000 67.677  0 323  GLU   A OE2  1 ? 1 
ATOM   4140  H  H    . GLU   A  1  268 ? -1.933  -10.587 29.263  1.000 30.108  0 323  GLU   A H    1 c 1 
ATOM   4141  H  HA   . GLU   A  1  268 ? -0.574  -8.992  30.970  1.000 32.748  0 323  GLU   A HA   1 c 1 
ATOM   4142  H  HB2  . GLU   A  1  268 ? 0.667   -10.510 28.912  1.000 34.589  0 323  GLU   A HB2  1 c 1 
ATOM   4143  H  HB3  . GLU   A  1  268 ? 1.356   -10.043 30.252  1.000 35.178  0 323  GLU   A HB3  1 c 1 
ATOM   4144  H  HG2  . GLU   A  1  268 ? 1.057   -12.210 30.616  1.000 45.485  0 323  GLU   A HG2  1 c 1 
ATOM   4145  H  HG3  . GLU   A  1  268 ? -0.144  -11.571 31.402  1.000 45.782  0 323  GLU   A HG3  1 c 1 
ATOM   4146  N  N    . MET   A  1  269 ? -0.888  -7.801  28.088  1.000 28.586  0 324  MET   A N    1 ? 1 
ATOM   4147  C  CA   . MET   A  1  269 ? -0.563  -6.717  27.173  1.000 21.904  0 324  MET   A CA   1 ? 1 
ATOM   4148  C  C    . MET   A  1  269 ? -0.857  -5.339  27.752  1.000 23.436  0 324  MET   A C    1 ? 1 
ATOM   4149  O  O    . MET   A  1  269 ? -0.395  -4.329  27.227  1.000 22.918  0 324  MET   A O    1 ? 1 
ATOM   4150  C  CB   . MET   A  1  269 ? -1.360  -6.900  25.887  1.000 25.109  0 324  MET   A CB   1 ? 1 
ATOM   4151  C  CG   . MET   A  1  269 ? -0.892  -8.087  25.090  1.000 23.679  0 324  MET   A CG   1 ? 1 
ATOM   4152  S  SD   . MET   A  1  269 ? 0.880   -8.032  24.642  1.000 24.411  0 324  MET   A SD   1 ? 1 
ATOM   4153  C  CE   . MET   A  1  269 ? 0.903   -6.680  23.441  1.000 28.553  0 324  MET   A CE   1 ? 1 
ATOM   4154  H  H    . MET   A  1  269 ? -1.609  -8.329  27.900  1.000 28.064  0 324  MET   A H    1 c 1 
ATOM   4155  H  HA   . MET   A  1  269 ? 0.398   -6.767  26.971  1.000 23.778  0 324  MET   A HA   1 c 1 
ATOM   4156  H  HB2  . MET   A  1  269 ? -2.305  -7.011  26.110  1.000 24.100  0 324  MET   A HB2  1 c 1 
ATOM   4157  H  HB3  . MET   A  1  269 ? -1.273  -6.092  25.341  1.000 23.508  0 324  MET   A HB3  1 c 1 
ATOM   4158  H  HG2  . MET   A  1  269 ? -1.058  -8.904  25.607  1.000 24.601  0 324  MET   A HG2  1 c 1 
ATOM   4159  H  HG3  . MET   A  1  269 ? -1.421  -8.146  24.265  1.000 23.887  0 324  MET   A HG3  1 c 1 
ATOM   4160  H  HE1  . MET   A  1  269 ? 0.326   -6.900  22.701  1.000 26.926  0 324  MET   A HE1  1 c 1 
ATOM   4161  H  HE2  . MET   A  1  269 ? 0.594   -5.869  23.863  1.000 27.176  0 324  MET   A HE2  1 c 1 
ATOM   4162  H  HE3  . MET   A  1  269 ? 1.803   -6.554  23.120  1.000 26.962  0 324  MET   A HE3  1 c 1 
ATOM   4163  N  N    . THR   A  1  270 ? -1.645  -5.294  28.827  1.000 20.792  0 325  THR   A N    1 ? 1 
ATOM   4164  C  CA   . THR   A  1  270 ? -1.982  -4.026  29.437  1.000 23.549  0 325  THR   A CA   1 ? 1 
ATOM   4165  C  C    . THR   A  1  270 ? -0.737  -3.341  30.002  1.000 25.872  0 325  THR   A C    1 ? 1 
ATOM   4166  O  O    . THR   A  1  270 ? -0.638  -2.113  29.954  1.000 24.490  0 325  THR   A O    1 ? 1 
ATOM   4167  C  CB   . THR   A  1  270 ? -3.052  -4.268  30.493  1.000 25.248  0 325  THR   A CB   1 ? 1 
ATOM   4168  O  OG1  . THR   A  1  270 ? -4.222  -4.629  29.792  1.000 33.553  0 325  THR   A OG1  1 ? 1 
ATOM   4169  C  CG2  . THR   A  1  270 ? -3.345  -3.069  31.343  1.000 26.667  0 325  THR   A CG2  1 ? 1 
ATOM   4170  H  H    . THR   A  1  270 ? -1.991  -6.063  29.178  1.000 22.523  0 325  THR   A H    1 c 1 
ATOM   4171  H  HA   . THR   A  1  270 ? -2.364  -3.447  28.737  1.000 23.182  0 325  THR   A HA   1 c 1 
ATOM   4172  H  HB   . THR   A  1  270 ? -2.769  -5.017  31.070  1.000 26.973  0 325  THR   A HB   1 c 1 
ATOM   4173  H  HG1  . THR   A  1  270 ? -4.445  -4.022  29.286  0.000 20.660  0 325  THR   A HG1  1 c 1 
ATOM   4174  H  HG21 . THR   A  1  270 ? -4.145  -3.235  31.874  1.000 26.761  0 325  THR   A HG21 1 c 1 
ATOM   4175  H  HG22 . THR   A  1  270 ? -3.491  -2.293  30.772  1.000 25.960  0 325  THR   A HG22 1 c 1 
ATOM   4176  H  HG23 . THR   A  1  270 ? -2.593  -2.897  31.938  1.000 26.551  0 325  THR   A HG23 1 c 1 
ATOM   4177  N  N    . ASN   A  1  271 ? 0.186   -4.136  30.552  1.000 23.040  0 326  ASN   A N    1 ? 1 
ATOM   4178  C  CA   . ASN   A  1  271 ? 1.390   -3.587  31.160  1.000 28.545  0 326  ASN   A CA   1 ? 1 
ATOM   4179  C  C    . ASN   A  1  271 ? 2.276   -2.900  30.128  1.000 26.489  0 326  ASN   A C    1 ? 1 
ATOM   4180  O  O    . ASN   A  1  271 ? 2.634   -1.746  30.320  1.000 28.598  0 326  ASN   A O    1 ? 1 
ATOM   4181  C  CB   . ASN   A  1  271 ? 2.215   -4.637  31.905  1.000 33.523  0 326  ASN   A CB   1 ? 1 
ATOM   4182  C  CG   . ASN   A  1  271 ? 1.438   -5.315  33.000  1.000 49.683  0 326  ASN   A CG   1 ? 1 
ATOM   4183  O  OD1  . ASN   A  1  271 ? 1.144   -6.518  32.929  1.000 69.507  0 326  ASN   A OD1  1 ? 1 
ATOM   4184  N  ND2  . ASN   A  1  271 ? 1.056   -4.563  34.019  1.000 58.077  0 326  ASN   A ND2  1 ? 1 
ATOM   4185  H  H    . ASN   A  1  271 ? 0.064   -5.041  30.552  1.000 25.045  0 326  ASN   A H    1 c 1 
ATOM   4186  H  HA   . ASN   A  1  271 ? 1.112   -2.911  31.822  1.000 28.228  0 326  ASN   A HA   1 c 1 
ATOM   4187  H  HB2  . ASN   A  1  271 ? 2.524   -5.313  31.273  1.000 35.121  0 326  ASN   A HB2  1 c 1 
ATOM   4188  H  HB3  . ASN   A  1  271 ? 3.003   -4.204  32.293  1.000 35.318  0 326  ASN   A HB3  1 c 1 
ATOM   4189  H  HD21 . ASN   A  1  271 ? 0.570   -3.837  33.877  1.000 54.660  0 326  ASN   A HD21 1 c 1 
ATOM   4190  H  HD22 . ASN   A  1  271 ? 1.285   -4.786  34.844  1.000 55.834  0 326  ASN   A HD22 1 c 1 
ATOM   4191  N  N    . PRO   A  1  272 ? 2.674   -3.566  29.021  1.000 29.961  0 327  PRO   A N    1 ? 1 
ATOM   4192  C  CA   . PRO   A  1  272 ? 3.448   -2.879  27.991  1.000 29.950  0 327  PRO   A CA   1 ? 1 
ATOM   4193  C  C    . PRO   A  1  272 ? 2.734   -1.635  27.474  1.000 26.740  0 327  PRO   A C    1 ? 1 
ATOM   4194  O  O    . PRO   A  1  272 ? 3.374   -0.621  27.217  1.000 28.474  0 327  PRO   A O    1 ? 1 
ATOM   4195  C  CB   . PRO   A  1  272 ? 3.642   -3.940  26.896  1.000 36.499  0 327  PRO   A CB   1 ? 1 
ATOM   4196  C  CG   . PRO   A  1  272 ? 3.337   -5.266  27.558  1.000 41.113  0 327  PRO   A CG   1 ? 1 
ATOM   4197  C  CD   . PRO   A  1  272 ? 2.454   -4.997  28.719  1.000 35.773  0 327  PRO   A CD   1 ? 1 
ATOM   4198  H  HA   . PRO   A  1  272 ? 4.332   -2.629  28.362  1.000 30.552  0 327  PRO   A HA   1 c 1 
ATOM   4199  H  HB2  . PRO   A  1  272 ? 3.031   -3.782  26.144  1.000 35.150  0 327  PRO   A HB2  1 c 1 
ATOM   4200  H  HB3  . PRO   A  1  272 ? 4.563   -3.927  26.558  1.000 35.467  0 327  PRO   A HB3  1 c 1 
ATOM   4201  H  HG2  . PRO   A  1  272 ? 2.891   -5.866  26.926  1.000 38.491  0 327  PRO   A HG2  1 c 1 
ATOM   4202  H  HG3  . PRO   A  1  272 ? 4.165   -5.694  27.856  1.000 38.870  0 327  PRO   A HG3  1 c 1 
ATOM   4203  H  HD2  . PRO   A  1  272 ? 1.522   -5.166  28.496  1.000 35.033  0 327  PRO   A HD2  1 c 1 
ATOM   4204  H  HD3  . PRO   A  1  272 ? 2.704   -5.557  29.476  1.000 35.811  0 327  PRO   A HD3  1 c 1 
ATOM   4205  N  N    . LEU   A  1  273 ? 1.409   -1.707  27.305  1.000 23.901  0 328  LEU   A N    1 ? 1 
ATOM   4206  C  CA   . LEU   A  1  273 ? 0.695   -0.546  26.792  1.000 27.931  0 328  LEU   A CA   1 ? 1 
ATOM   4207  C  C    . LEU   A  1  273 ? 0.792   0.601   27.805  1.000 25.959  0 328  LEU   A C    1 ? 1 
ATOM   4208  O  O    . LEU   A  1  273 ? 0.984   1.750   27.424  1.000 23.751  0 328  LEU   A O    1 ? 1 
ATOM   4209  C  CB   . LEU   A  1  273 ? -0.742  -0.883  26.478  1.000 21.412  0 328  LEU   A CB   1 ? 1 
ATOM   4210  C  CG   . LEU   A  1  273 ? -0.982  -1.809  25.265  1.000 21.833  0 328  LEU   A CG   1 ? 1 
ATOM   4211  C  CD1  . LEU   A  1  273 ? -2.512  -2.034  25.035  1.000 23.620  0 328  LEU   A CD1  1 ? 1 
ATOM   4212  C  CD2  . LEU   A  1  273 ? -0.378  -1.259  24.005  1.000 21.386  0 328  LEU   A CD2  1 ? 1 
ATOM   4213  H  H    . LEU   A  1  273 ? 0.951   -2.473  27.500  1.000 25.622  0 328  LEU   A H    1 c 1 
ATOM   4214  H  HA   . LEU   A  1  273 ? 1.142   -0.258  25.964  1.000 24.824  0 328  LEU   A HA   1 c 1 
ATOM   4215  H  HB2  . LEU   A  1  273 ? -1.135  -1.305  27.268  1.000 23.324  0 328  LEU   A HB2  1 c 1 
ATOM   4216  H  HB3  . LEU   A  1  273 ? -1.225  -0.046  26.325  1.000 22.825  0 328  LEU   A HB3  1 c 1 
ATOM   4217  H  HG   . LEU   A  1  273 ? -0.563  -2.684  25.452  1.000 22.133  0 328  LEU   A HG   1 c 1 
ATOM   4218  H  HD11 . LEU   A  1  273 ? -2.644  -2.789  24.437  1.000 22.925  0 328  LEU   A HD11 1 c 1 
ATOM   4219  H  HD12 . LEU   A  1  273 ? -2.902  -1.235  24.639  1.000 22.903  0 328  LEU   A HD12 1 c 1 
ATOM   4220  H  HD13 . LEU   A  1  273 ? -2.945  -2.216  25.887  1.000 23.535  0 328  LEU   A HD13 1 c 1 
ATOM   4221  H  HD21 . LEU   A  1  273 ? 0.590   -1.344  24.043  1.000 21.364  0 328  LEU   A HD21 1 c 1 
ATOM   4222  H  HD22 . LEU   A  1  273 ? -0.618  -0.320  23.912  1.000 21.263  0 328  LEU   A HD22 1 c 1 
ATOM   4223  H  HD23 . LEU   A  1  273 ? -0.715  -1.756  23.239  1.000 21.103  0 328  LEU   A HD23 1 c 1 
ATOM   4224  N  N    . ARG   A  1  274 ? 0.672   0.290   29.104  1.000 25.981  0 329  ARG   A N    1 ? 1 
ATOM   4225  C  CA   . ARG   A  1  274 ? 0.856   1.299   30.132  1.000 25.295  0 329  ARG   A CA   1 ? 1 
ATOM   4226  C  C    . ARG   A  1  274 ? 2.261   1.908   30.113  1.000 22.776  0 329  ARG   A C    1 ? 1 
ATOM   4227  O  O    . ARG   A  1  274 ? 2.420   3.112   30.309  1.000 25.317  0 329  ARG   A O    1 ? 1 
ATOM   4228  C  CB   . ARG   A  1  274 ? 0.572   0.724   31.530  1.000 30.179  0 329  ARG   A CB   1 ? 1 
ATOM   4229  C  CG   . ARG   A  1  274 ? -0.923  0.563   31.815  1.000 53.561  0 329  ARG   A CG   1 ? 1 
ATOM   4230  C  CD   . ARG   A  1  274 ? -1.156  0.287   33.299  1.000 67.456  0 329  ARG   A CD   1 ? 1 
ATOM   4231  N  NE   . ARG   A  1  274 ? -2.524  -0.123  33.607  1.000 79.218  0 329  ARG   A NE   1 ? 1 
ATOM   4232  C  CZ   . ARG   A  1  274 ? -2.972  -0.383  34.835  1.000 121.484 0 329  ARG   A CZ   1 ? 1 
ATOM   4233  N  NH1  . ARG   A  1  274 ? -2.321  0.033   35.912  1.000 105.752 0 329  ARG   A NH1  1 ? 1 
ATOM   4234  N  NH2  . ARG   A  1  274 ? -4.105  -1.069  34.985  1.000 105.551 0 329  ARG   A NH2  1 ? 1 
ATOM   4235  H  H    . ARG   A  1  274 ? 0.464   -0.565  29.351  1.000 26.111  0 329  ARG   A H    1 c 1 
ATOM   4236  H  HA   . ARG   A  1  274 ? 0.209   2.021   29.961  1.000 25.700  0 329  ARG   A HA   1 c 1 
ATOM   4237  H  HB2  . ARG   A  1  274 ? 1.008   -0.150  31.609  1.000 32.870  0 329  ARG   A HB2  1 c 1 
ATOM   4238  H  HB3  . ARG   A  1  274 ? 0.962   1.320   32.203  1.000 33.106  0 329  ARG   A HB3  1 c 1 
ATOM   4239  H  HG2  . ARG   A  1  274 ? -1.398  1.383   31.560  1.000 47.915  0 329  ARG   A HG2  1 c 1 
ATOM   4240  H  HG3  . ARG   A  1  274 ? -1.284  -0.178  31.286  1.000 47.923  0 329  ARG   A HG3  1 c 1 
ATOM   4241  H  HD2  . ARG   A  1  274 ? -0.540  -0.418  33.591  1.000 66.802  0 329  ARG   A HD2  1 c 1 
ATOM   4242  H  HD3  . ARG   A  1  274 ? -0.944  1.098   33.808  1.000 67.172  0 329  ARG   A HD3  1 c 1 
ATOM   4243  H  HE   . ARG   A  1  274 ? -3.087  -0.200  32.945  1.000 83.982  0 329  ARG   A HE   1 c 1 
ATOM   4244  H  HH11 . ARG   A  1  274 ? -1.719  0.676   35.845  1.000 109.419 0 329  ARG   A HH11 1 c 1 
ATOM   4245  H  HH12 . ARG   A  1  274 ? -2.494  -0.334  36.697  1.000 110.775 0 329  ARG   A HH12 1 c 1 
ATOM   4246  H  HH21 . ARG   A  1  274 ? -4.428  -1.210  35.790  1.000 110.675 0 329  ARG   A HH21 1 c 1 
ATOM   4247  H  HH22 . ARG   A  1  274 ? -4.527  -1.379  34.279  1.000 109.415 0 329  ARG   A HH22 1 c 1 
ATOM   4248  N  N    . GLU   A  1  275 ? 3.279   1.078   29.884  1.000 24.461  0 330  GLU   A N    1 ? 1 
ATOM   4249  C  CA   . GLU   A  1  275 ? 4.667   1.522   29.916  1.000 27.085  0 330  GLU   A CA   1 ? 1 
ATOM   4250  C  C    . GLU   A  1  275 ? 5.005   2.419   28.723  1.000 25.780  0 330  GLU   A C    1 ? 1 
ATOM   4251  O  O    . GLU   A  1  275 ? 5.704   3.439   28.834  1.000 17.851  0 330  GLU   A O    1 ? 1 
ATOM   4252  C  CB   . GLU   A  1  275 ? 5.635   0.324   29.978  1.000 26.267  0 330  GLU   A CB   1 ? 1 
ATOM   4253  C  CG   . GLU   A  1  275 ? 5.617   -0.389  31.335  1.000 33.677  0 330  GLU   A CG   1 ? 1 
ATOM   4254  C  CD   . GLU   A  1  275 ? 5.975   0.516   32.519  1.000 53.528  0 330  GLU   A CD   1 ? 1 
ATOM   4255  O  OE1  . GLU   A  1  275 ? 7.019   1.205   32.435  1.000 44.636  0 330  GLU   A OE1  1 ? 1 
ATOM   4256  O  OE2  . GLU   A  1  275 ? 5.213   0.549   33.518  1.000 52.465  0 330  GLU   A OE2  1 ? 1 
ATOM   4257  H  H    . GLU   A  1  275 ? 3.106   0.198   29.707  1.000 24.558  0 330  GLU   A H    1 c 1 
ATOM   4258  H  HA   . GLU   A  1  275 ? 4.788   2.056   30.734  1.000 26.701  0 330  GLU   A HA   1 c 1 
ATOM   4259  H  HB2  . GLU   A  1  275 ? 5.390   -0.316  29.277  1.000 27.475  0 330  GLU   A HB2  1 c 1 
ATOM   4260  H  HB3  . GLU   A  1  275 ? 6.543   0.642   29.796  1.000 27.765  0 330  GLU   A HB3  1 c 1 
ATOM   4261  H  HG2  . GLU   A  1  275 ? 4.724   -0.763  31.489  1.000 35.248  0 330  GLU   A HG2  1 c 1 
ATOM   4262  H  HG3  . GLU   A  1  275 ? 6.252   -1.137  31.312  1.000 35.254  0 330  GLU   A HG3  1 c 1 
ATOM   4263  N  N    . ILE   A  1  276 ? 4.479   2.041   27.569  1.000 22.616  0 331  ILE   A N    1 ? 1 
ATOM   4264  C  CA   . ILE   A  1  276 ? 4.611   2.868   26.388  1.000 19.699  0 331  ILE   A CA   1 ? 1 
ATOM   4265  C  C    . ILE   A  1  276 ? 4.001   4.241   26.628  1.000 23.906  0 331  ILE   A C    1 ? 1 
ATOM   4266  O  O    . ILE   A  1  276 ? 4.570   5.249   26.211  1.000 24.575  0 331  ILE   A O    1 ? 1 
ATOM   4267  C  CB   . ILE   A  1  276 ? 3.967   2.176   25.201  1.000 22.886  0 331  ILE   A CB   1 ? 1 
ATOM   4268  C  CG1  . ILE   A  1  276 ? 4.736   0.930   24.819  1.000 25.967  0 331  ILE   A CG1  1 ? 1 
ATOM   4269  C  CG2  . ILE   A  1  276 ? 3.838   3.127   24.002  1.000 25.233  0 331  ILE   A CG2  1 ? 1 
ATOM   4270  C  CD1  . ILE   A  1  276 ? 3.945   0.005   23.881  1.000 32.602  0 331  ILE   A CD1  1 ? 1 
ATOM   4271  H  H    . ILE   A  1  276 ? 4.026   1.249   27.511  1.000 22.665  0 331  ILE   A H    1 c 1 
ATOM   4272  H  HA   . ILE   A  1  276 ? 5.558   2.982   26.198  1.000 21.617  0 331  ILE   A HA   1 c 1 
ATOM   4273  H  HB   . ILE   A  1  276 ? 3.057   1.899   25.469  1.000 23.165  0 331  ILE   A HB   1 c 1 
ATOM   4274  H  HG12 . ILE   A  1  276 ? 5.568   1.196   24.373  1.000 26.508  0 331  ILE   A HG12 1 c 1 
ATOM   4275  H  HG13 . ILE   A  1  276 ? 4.973   0.435   25.630  1.000 26.788  0 331  ILE   A HG13 1 c 1 
ATOM   4276  H  HG21 . ILE   A  1  276 ? 4.711   3.502   23.788  1.000 24.323  0 331  ILE   A HG21 1 c 1 
ATOM   4277  H  HG22 . ILE   A  1  276 ? 3.224   3.848   24.220  1.000 24.427  0 331  ILE   A HG22 1 c 1 
ATOM   4278  H  HG23 . ILE   A  1  276 ? 3.500   2.641   23.232  1.000 24.107  0 331  ILE   A HG23 1 c 1 
ATOM   4279  H  HD11 . ILE   A  1  276 ? 3.842   0.432   23.013  1.000 29.747  0 331  ILE   A HD11 1 c 1 
ATOM   4280  H  HD12 . ILE   A  1  276 ? 3.066   -0.170  24.261  1.000 30.347  0 331  ILE   A HD12 1 c 1 
ATOM   4281  H  HD13 . ILE   A  1  276 ? 4.423   -0.835  23.772  1.000 30.122  0 331  ILE   A HD13 1 c 1 
ATOM   4282  N  N    . ASP   A  1  277 ? 2.820   4.264   27.263  1.000 23.959  0 332  ASP   A N    1 ? 1 
ATOM   4283  C  CA   . ASP   A  1  277 ? 2.123   5.515   27.484  1.000 22.267  0 332  ASP   A CA   1 ? 1 
ATOM   4284  C  C    . ASP   A  1  277 ? 2.930   6.406   28.425  1.000 26.929  0 332  ASP   A C    1 ? 1 
ATOM   4285  O  O    . ASP   A  1  277 ? 2.993   7.621   28.260  1.000 21.665  0 332  ASP   A O    1 ? 1 
ATOM   4286  C  CB   . ASP   A  1  277 ? 0.749   5.267   28.093  1.000 21.565  0 332  ASP   A CB   1 ? 1 
ATOM   4287  C  CG   . ASP   A  1  277 ? -0.100  6.521   28.083  1.000 26.286  0 332  ASP   A CG   1 ? 1 
ATOM   4288  O  OD1  . ASP   A  1  277 ? -0.557  6.923   26.981  1.000 20.584  0 332  ASP   A OD1  1 ? 1 
ATOM   4289  O  OD2  . ASP   A  1  277 ? -0.313  7.111   29.178  1.000 24.131  0 332  ASP   A OD2  1 ? 1 
ATOM   4290  H  H    . ASP   A  1  277 ? 2.442   3.485   27.556  1.000 23.634  0 332  ASP   A H    1 c 1 
ATOM   4291  H  HA   . ASP   A  1  277 ? 2.012   5.975   26.618  1.000 22.766  0 332  ASP   A HA   1 c 1 
ATOM   4292  H  HB2  . ASP   A  1  277 ? 0.288   4.569   27.585  1.000 22.499  0 332  ASP   A HB2  1 c 1 
ATOM   4293  H  HB3  . ASP   A  1  277 ? 0.851   4.961   29.018  1.000 23.177  0 332  ASP   A HB3  1 c 1 
ATOM   4294  N  N    . LYS   A  1  278 ? 3.527   5.775   29.438  1.000 23.781  0 333  LYS   A N    1 ? 1 
ATOM   4295  C  CA   . LYS   A  1  278 ? 4.359   6.495   30.378  1.000 25.046  0 333  LYS   A CA   1 ? 1 
ATOM   4296  C  C    . LYS   A  1  278 ? 5.537   7.140   29.638  1.000 23.795  0 333  LYS   A C    1 ? 1 
ATOM   4297  O  O    . LYS   A  1  278 ? 5.906   8.272   29.939  1.000 25.305  0 333  LYS   A O    1 ? 1 
ATOM   4298  C  CB   . LYS   A  1  278 ? 4.834   5.578   31.482  1.000 25.945  0 333  LYS   A CB   1 ? 1 
ATOM   4299  C  CG   . LYS   A  1  278 ? 3.804   5.336   32.577  1.000 60.474  0 333  LYS   A CG   1 ? 1 
ATOM   4300  C  CD   . LYS   A  1  278 ? 4.201   4.224   33.626  1.000 71.832  0 333  LYS   A CD   1 ? 1 
ATOM   4301  C  CE   . LYS   A  1  278 ? 5.604   4.371   34.196  1.000 100.488 0 333  LYS   A CE   1 ? 1 
ATOM   4302  N  NZ   . LYS   A  1  278 ? 5.841   5.711   34.812  1.000 140.640 0 333  LYS   A NZ   1 ? 1 
ATOM   4303  H  H    . LYS   A  1  278 ? 3.403   4.876   29.551  1.000 24.784  0 333  LYS   A H    1 c 1 
ATOM   4304  H  HA   . LYS   A  1  278 ? 3.816   7.211   30.780  1.000 25.133  0 333  LYS   A HA   1 c 1 
ATOM   4305  H  HB2  . LYS   A  1  278 ? 5.083   4.716   31.089  1.000 30.614  0 333  LYS   A HB2  1 c 1 
ATOM   4306  H  HB3  . LYS   A  1  278 ? 5.637   5.967   31.886  1.000 31.577  0 333  LYS   A HB3  1 c 1 
ATOM   4307  H  HG2  . LYS   A  1  278 ? 3.655   6.180   33.056  1.000 49.433  0 333  LYS   A HG2  1 c 1 
ATOM   4308  H  HG3  . LYS   A  1  278 ? 2.955   5.082   32.156  1.000 48.906  0 333  LYS   A HG3  1 c 1 
ATOM   4309  H  HD2  . LYS   A  1  278 ? 3.559   4.245   34.366  1.000 75.080  0 333  LYS   A HD2  1 c 1 
ATOM   4310  H  HD3  . LYS   A  1  278 ? 4.129   3.346   33.195  1.000 74.433  0 333  LYS   A HD3  1 c 1 
ATOM   4311  H  HE2  . LYS   A  1  278 ? 5.750   3.684   34.874  1.000 100.552 0 333  LYS   A HE2  1 c 1 
ATOM   4312  H  HE3  . LYS   A  1  278 ? 6.259   4.232   33.486  1.000 98.859  0 333  LYS   A HE3  1 c 1 
ATOM   4313  H  HZ1  . LYS   A  1  278 ? 5.157   5.918   35.371  1.000 126.370 0 333  LYS   A HZ1  1 c 1 
ATOM   4314  H  HZ2  . LYS   A  1  278 ? 5.899   6.344   34.165  1.000 123.708 0 333  LYS   A HZ2  1 c 1 
ATOM   4315  H  HZ3  . LYS   A  1  278 ? 6.616   5.700   35.284  1.000 126.392 0 333  LYS   A HZ3  1 c 1 
ATOM   4316  N  N    . THR   A  1  279 ? 6.109   6.410   28.679  1.000 26.035  0 334  THR   A N    1 ? 1 
ATOM   4317  C  CA   . THR   A  1  279 ? 7.205   6.912   27.868  1.000 24.733  0 334  THR   A CA   1 ? 1 
ATOM   4318  C  C    . THR   A  1  279 ? 6.707   8.114   27.083  1.000 24.125  0 334  THR   A C    1 ? 1 
ATOM   4319  O  O    . THR   A  1  279 ? 7.442   9.074   26.922  1.000 20.559  0 334  THR   A O    1 ? 1 
ATOM   4320  C  CB   . THR   A  1  279 ? 7.786   5.794   26.991  1.000 22.356  0 334  THR   A CB   1 ? 1 
ATOM   4321  O  OG1  . THR   A  1  279 ? 8.183   4.726   27.841  1.000 22.253  0 334  THR   A OG1  1 ? 1 
ATOM   4322  C  CG2  . THR   A  1  279 ? 8.989   6.224   26.205  1.000 24.945  0 334  THR   A CG2  1 ? 1 
ATOM   4323  H  H    . THR   A  1  279 ? 5.809   5.560   28.529  1.000 24.942  0 334  THR   A H    1 c 1 
ATOM   4324  H  HA   . THR   A  1  279 ? 7.913   7.218   28.481  1.000 24.821  0 334  THR   A HA   1 c 1 
ATOM   4325  H  HB   . THR   A  1  279 ? 7.087   5.478   26.371  1.000 22.732  0 334  THR   A HB   1 c 1 
ATOM   4326  H  HG1  . THR   A  1  279 ? 8.770   4.995   28.397  0.000 12.320  0 334  THR   A HG1  1 c 1 
ATOM   4327  H  HG21 . THR   A  1  279 ? 9.361   5.456   25.735  1.000 23.894  0 334  THR   A HG21 1 c 1 
ATOM   4328  H  HG22 . THR   A  1  279 ? 9.659   6.589   26.810  1.000 24.440  0 334  THR   A HG22 1 c 1 
ATOM   4329  H  HG23 . THR   A  1  279 ? 8.731   6.905   25.558  1.000 23.809  0 334  THR   A HG23 1 c 1 
ATOM   4330  N  N    . VAL   A  1  280 ? 5.454   8.047   26.608  1.000 20.410  0 335  VAL   A N    1 ? 1 
ATOM   4331  C  CA   . VAL   A  1  280 ? 4.893   9.135   25.826  1.000 22.030  0 335  VAL   A CA   1 ? 1 
ATOM   4332  C  C    . VAL   A  1  280 ? 4.703   10.340  26.731  1.000 18.868  0 335  VAL   A C    1 ? 1 
ATOM   4333  O  O    . VAL   A  1  280 ? 4.887   11.460  26.280  1.000 19.809  0 335  VAL   A O    1 ? 1 
ATOM   4334  C  CB   . VAL   A  1  280 ? 3.549   8.786   25.103  1.000 21.954  0 335  VAL   A CB   1 ? 1 
ATOM   4335  C  CG1  . VAL   A  1  280 ? 2.891   10.043  24.522  1.000 21.922  0 335  VAL   A CG1  1 ? 1 
ATOM   4336  C  CG2  . VAL   A  1  280 ? 3.749   7.730   24.036  1.000 20.476  0 335  VAL   A CG2  1 ? 1 
ATOM   4337  H  H    . VAL   A  1  280 ? 4.947   7.303   26.759  1.000 21.598  0 335  VAL   A H    1 c 1 
ATOM   4338  H  HA   . VAL   A  1  280 ? 5.544   9.375   25.142  1.000 20.709  0 335  VAL   A HA   1 c 1 
ATOM   4339  H  HB   . VAL   A  1  280 ? 2.936   8.413   25.783  1.000 21.942  0 335  VAL   A HB   1 c 1 
ATOM   4340  H  HG11 . VAL   A  1  280 ? 3.553   10.557  24.028  1.000 21.788  0 335  VAL   A HG11 1 c 1 
ATOM   4341  H  HG12 . VAL   A  1  280 ? 2.531   10.588  25.243  1.000 22.218  0 335  VAL   A HG12 1 c 1 
ATOM   4342  H  HG13 . VAL   A  1  280 ? 2.169   9.784   23.923  1.000 21.624  0 335  VAL   A HG13 1 c 1 
ATOM   4343  H  HG21 . VAL   A  1  280 ? 2.890   7.503   23.639  1.000 20.565  0 335  VAL   A HG21 1 c 1 
ATOM   4344  H  HG22 . VAL   A  1  280 ? 4.141   6.935   24.434  1.000 20.867  0 335  VAL   A HG22 1 c 1 
ATOM   4345  H  HG23 . VAL   A  1  280 ? 4.343   8.074   23.347  1.000 20.551  0 335  VAL   A HG23 1 c 1 
ATOM   4346  N  N    . GLY   A  1  281 ? 4.252   10.100  27.965  1.000 21.867  0 336  GLY   A N    1 ? 1 
ATOM   4347  C  CA   . GLY   A  1  281 ? 4.083   11.151  28.955  1.000 21.619  0 336  GLY   A CA   1 ? 1 
ATOM   4348  C  C    . GLY   A  1  281 ? 5.393   11.842  29.330  1.000 23.519  0 336  GLY   A C    1 ? 1 
ATOM   4349  O  O    . GLY   A  1  281 ? 5.431   13.020  29.639  1.000 25.896  0 336  GLY   A O    1 ? 1 
ATOM   4350  H  H    . GLY   A  1  281 ? 4.032   9.244   28.198  1.000 21.030  0 336  GLY   A H    1 c 1 
ATOM   4351  H  HA2  . GLY   A  1  281 ? 3.453   11.825  28.597  1.000 22.083  0 336  GLY   A HA2  1 c 1 
ATOM   4352  H  HA3  . GLY   A  1  281 ? 3.677   10.759  29.769  1.000 22.468  0 336  GLY   A HA3  1 c 1 
ATOM   4353  N  N    . GLN   A  1  282 ? 6.469   11.076  29.351  1.000 22.678  0 337  GLN   A N    1 ? 1 
ATOM   4354  C  CA   . GLN   A  1  282 ? 7.767   11.619  29.662  1.000 26.433  0 337  GLN   A CA   1 ? 1 
ATOM   4355  C  C    . GLN   A  1  282 ? 8.210   12.534  28.523  1.000 25.465  0 337  GLN   A C    1 ? 1 
ATOM   4356  O  O    . GLN   A  1  282 ? 8.769   13.610  28.765  1.000 20.511  0 337  GLN   A O    1 ? 1 
ATOM   4357  C  CB   . GLN   A  1  282 ? 8.767   10.483  29.903  1.000 25.886  0 337  GLN   A CB   1 ? 1 
ATOM   4358  C  CG   . GLN   A  1  282 ? 8.560   9.808   31.262  1.000 30.930  0 337  GLN   A CG   1 ? 1 
ATOM   4359  C  CD   . GLN   A  1  282 ? 9.519   8.670   31.476  1.000 33.823  0 337  GLN   A CD   1 ? 1 
ATOM   4360  O  OE1  . GLN   A  1  282 ? 10.382  8.361   30.628  1.000 32.213  0 337  GLN   A OE1  1 ? 1 
ATOM   4361  N  NE2  . GLN   A  1  282 ? 9.397   8.032   32.618  1.000 41.251  0 337  GLN   A NE2  1 ? 1 
ATOM   4362  H  H    . GLN   A  1  282 ? 6.394   10.183  29.172  1.000 23.378  0 337  GLN   A H    1 c 1 
ATOM   4363  H  HA   . GLN   A  1  282 ? 7.692   12.154  30.486  1.000 25.928  0 337  GLN   A HA   1 c 1 
ATOM   4364  H  HB2  . GLN   A  1  282 ? 8.669   9.817   29.190  1.000 26.493  0 337  GLN   A HB2  1 c 1 
ATOM   4365  H  HB3  . GLN   A  1  282 ? 9.676   10.846  29.856  1.000 27.106  0 337  GLN   A HB3  1 c 1 
ATOM   4366  H  HG2  . GLN   A  1  282 ? 8.683   10.471  31.974  1.000 30.734  0 337  GLN   A HG2  1 c 1 
ATOM   4367  H  HG3  . GLN   A  1  282 ? 7.642   9.471   31.321  1.000 30.220  0 337  GLN   A HG3  1 c 1 
ATOM   4368  H  HE21 . GLN   A  1  282 ? 8.715   8.202   33.149  1.000 39.196  0 337  GLN   A HE21 1 c 1 
ATOM   4369  H  HE22 . GLN   A  1  282 ? 9.999   7.428   32.853  1.000 39.041  0 337  GLN   A HE22 1 c 1 
ATOM   4370  N  N    . LEU   A  1  283 ? 7.930   12.127  27.276  1.000 20.717  0 338  LEU   A N    1 ? 1 
ATOM   4371  C  CA   . LEU   A  1  283 ? 8.234   12.995  26.147  1.000 20.218  0 338  LEU   A CA   1 ? 1 
ATOM   4372  C  C    . LEU   A  1  283 ? 7.468   14.313  26.237  1.000 20.326  0 338  LEU   A C    1 ? 1 
ATOM   4373  O  O    . LEU   A  1  283 ? 8.053   15.390  26.103  1.000 21.768  0 338  LEU   A O    1 ? 1 
ATOM   4374  C  CB   . LEU   A  1  283 ? 7.938   12.327  24.800  1.000 20.239  0 338  LEU   A CB   1 ? 1 
ATOM   4375  C  CG   . LEU   A  1  283 ? 8.155   13.260  23.593  1.000 22.147  0 338  LEU   A CG   1 ? 1 
ATOM   4376  C  CD1  . LEU   A  1  283 ? 9.610   13.564  23.431  1.000 25.187  0 338  LEU   A CD1  1 ? 1 
ATOM   4377  C  CD2  . LEU   A  1  283 ? 7.617   12.672  22.363  1.000 27.250  0 338  LEU   A CD2  1 ? 1 
ATOM   4378  H  H    . LEU   A  1  283 ? 7.559   11.306  27.126  1.000 21.313  0 338  LEU   A H    1 c 1 
ATOM   4379  H  HA   . LEU   A  1  283 ? 9.195   13.202  26.189  1.000 20.610  0 338  LEU   A HA   1 c 1 
ATOM   4380  H  HB2  . LEU   A  1  283 ? 8.515   11.544  24.703  1.000 20.426  0 338  LEU   A HB2  1 c 1 
ATOM   4381  H  HB3  . LEU   A  1  283 ? 7.010   12.019  24.798  1.000 20.395  0 338  LEU   A HB3  1 c 1 
ATOM   4382  H  HG   . LEU   A  1  283 ? 7.678   14.109  23.761  1.000 23.294  0 338  LEU   A HG   1 c 1 
ATOM   4383  H  HD11 . LEU   A  1  283 ? 9.729   14.201  22.705  1.000 24.160  0 338  LEU   A HD11 1 c 1 
ATOM   4384  H  HD12 . LEU   A  1  283 ? 10.092  12.744  23.223  1.000 24.102  0 338  LEU   A HD12 1 c 1 
ATOM   4385  H  HD13 . LEU   A  1  283 ? 9.960   13.944  24.255  1.000 24.626  0 338  LEU   A HD13 1 c 1 
ATOM   4386  H  HD21 . LEU   A  1  283 ? 6.662   12.517  22.467  1.000 25.174  0 338  LEU   A HD21 1 c 1 
ATOM   4387  H  HD22 . LEU   A  1  283 ? 8.064   11.826  22.185  1.000 25.106  0 338  LEU   A HD22 1 c 1 
ATOM   4388  H  HD23 . LEU   A  1  283 ? 7.768   13.280  21.618  1.000 25.157  0 338  LEU   A HD23 1 c 1 
ATOM   4389  N  N    . MET   A  1  284 ? 6.154   14.229  26.480  1.000 20.292  0 339  MET   A N    1 ? 1 
ATOM   4390  C  CA   . MET   A  1  284 ? 5.310   15.414  26.422  1.000 22.021  0 339  MET   A CA   1 ? 1 
ATOM   4391  C  C    . MET   A  1  284 ? 5.620   16.329  27.617  1.000 25.238  0 339  MET   A C    1 ? 1 
ATOM   4392  O  O    . MET   A  1  284 ? 5.769   17.543  27.454  1.000 22.570  0 339  MET   A O    1 ? 1 
ATOM   4393  C  CB   . MET   A  1  284 ? 3.839   15.027  26.373  1.000 21.700  0 339  MET   A CB   1 ? 1 
ATOM   4394  C  CG   . MET   A  1  284 ? 3.461   14.150  25.139  1.000 18.508  0 339  MET   A CG   1 ? 1 
ATOM   4395  S  SD   . MET   A  1  284 ? 4.134   14.742  23.578  1.000 20.855  0 339  MET   A SD   1 ? 1 
ATOM   4396  C  CE   . MET   A  1  284 ? 3.310   16.245  23.480  1.000 17.498  0 339  MET   A CE   1 ? 1 
ATOM   4397  H  H    . MET   A  1  284 ? 5.776   13.422  26.683  1.000 20.507  0 339  MET   A H    1 c 1 
ATOM   4398  H  HA   . MET   A  1  284 ? 5.538   15.906  25.600  1.000 21.874  0 339  MET   A HA   1 c 1 
ATOM   4399  H  HB2  . MET   A  1  284 ? 3.616   14.539  27.191  1.000 21.351  0 339  MET   A HB2  1 c 1 
ATOM   4400  H  HB3  . MET   A  1  284 ? 3.304   15.843  26.358  1.000 21.319  0 339  MET   A HB3  1 c 1 
ATOM   4401  H  HG2  . MET   A  1  284 ? 3.778   13.236  25.288  1.000 19.413  0 339  MET   A HG2  1 c 1 
ATOM   4402  H  HG3  . MET   A  1  284 ? 2.483   14.116  25.063  1.000 19.501  0 339  MET   A HG3  1 c 1 
ATOM   4403  H  HE1  . MET   A  1  284 ? 2.360   16.095  23.554  1.000 18.331  0 339  MET   A HE1  1 c 1 
ATOM   4404  H  HE2  . MET   A  1  284 ? 3.603   16.819  24.197  1.000 18.779  0 339  MET   A HE2  1 c 1 
ATOM   4405  H  HE3  . MET   A  1  284 ? 3.505   16.663  22.632  1.000 18.159  0 339  MET   A HE3  1 c 1 
ATOM   4406  N  N    . ASP   A  1  285 ? 5.733   15.742  28.820  1.000 22.046  0 340  ASP   A N    1 ? 1 
ATOM   4407  C  CA   . ASP   A  1  285 ? 6.152   16.505  29.989  1.000 26.129  0 340  ASP   A CA   1 ? 1 
ATOM   4408  C  C    . ASP   A  1  285 ? 7.497   17.172  29.724  1.000 27.605  0 340  ASP   A C    1 ? 1 
ATOM   4409  O  O    . ASP   A  1  285 ? 7.721   18.306  30.136  1.000 28.329  0 340  ASP   A O    1 ? 1 
ATOM   4410  C  CB   . ASP   A  1  285 ? 6.283   15.595  31.221  1.000 24.490  0 340  ASP   A CB   1 ? 1 
ATOM   4411  C  CG   . ASP   A  1  285 ? 4.966   15.197  31.854  1.000 29.058  0 340  ASP   A CG   1 ? 1 
ATOM   4412  O  OD1  . ASP   A  1  285 ? 3.900   15.653  31.367  1.000 31.181  0 340  ASP   A OD1  1 ? 1 
ATOM   4413  O  OD2  . ASP   A  1  285 ? 4.993   14.414  32.805  1.000 30.804  0 340  ASP   A OD2  1 ? 1 
ATOM   4414  H  H    . ASP   A  1  285 ? 5.540   14.854  28.914  1.000 23.341  0 340  ASP   A H    1 c 1 
ATOM   4415  H  HA   . ASP   A  1  285 ? 5.479   17.202  30.172  1.000 25.504  0 340  ASP   A HA   1 c 1 
ATOM   4416  H  HB2  . ASP   A  1  285 ? 6.761   14.780  30.966  1.000 25.620  0 340  ASP   A HB2  1 c 1 
ATOM   4417  H  HB3  . ASP   A  1  285 ? 6.816   16.058  31.900  1.000 26.355  0 340  ASP   A HB3  1 c 1 
ATOM   4418  N  N    . GLY   A  1  286 ? 8.383   16.437  29.035  1.000 26.700  0 341  GLY   A N    1 ? 1 
ATOM   4419  C  CA   . GLY   A  1  286 ? 9.722   16.923  28.763  1.000 24.525  0 341  GLY   A CA   1 ? 1 
ATOM   4420  C  C    . GLY   A  1  286 ? 9.656   18.153  27.877  1.000 24.933  0 341  GLY   A C    1 ? 1 
ATOM   4421  O  O    . GLY   A  1  286 ? 10.273  19.185  28.163  1.000 18.954  0 341  GLY   A O    1 ? 1 
ATOM   4422  H  H    . GLY   A  1  286 ? 8.149   15.604  28.739  1.000 25.824  0 341  GLY   A H    1 c 1 
ATOM   4423  H  HA2  . GLY   A  1  286 ? 10.169  17.149  29.616  1.000 25.649  0 341  GLY   A HA2  1 c 1 
ATOM   4424  H  HA3  . GLY   A  1  286 ? 10.239  16.215  28.310  1.000 24.846  0 341  GLY   A HA3  1 c 1 
ATOM   4425  N  N    . LEU   A  1  287 ? 8.877   18.026  26.799  1.000 20.399  0 342  LEU   A N    1 ? 1 
ATOM   4426  C  CA   . LEU   A  1  287 ? 8.692   19.128  25.875  1.000 21.120  0 342  LEU   A CA   1 ? 1 
ATOM   4427  C  C    . LEU   A  1  287 ? 8.075   20.328  26.581  1.000 23.327  0 342  LEU   A C    1 ? 1 
ATOM   4428  O  O    . LEU   A  1  287 ? 8.562   21.433  26.433  1.000 23.868  0 342  LEU   A O    1 ? 1 
ATOM   4429  C  CB   . LEU   A  1  287 ? 7.813   18.677  24.694  1.000 21.791  0 342  LEU   A CB   1 ? 1 
ATOM   4430  C  CG   . LEU   A  1  287 ? 8.435   17.665  23.759  1.000 22.940  0 342  LEU   A CG   1 ? 1 
ATOM   4431  C  CD1  . LEU   A  1  287 ? 7.391   17.190  22.716  1.000 20.832  0 342  LEU   A CD1  1 ? 1 
ATOM   4432  C  CD2  . LEU   A  1  287 ? 9.655   18.224  23.062  1.000 20.140  0 342  LEU   A CD2  1 ? 1 
ATOM   4433  H  H    . LEU   A  1  287 ? 8.456   17.232  26.633  1.000 21.122  0 342  LEU   A H    1 c 1 
ATOM   4434  H  HA   . LEU   A  1  287 ? 9.578   19.392  25.537  1.000 21.563  0 342  LEU   A HA   1 c 1 
ATOM   4435  H  HB2  . LEU   A  1  287 ? 6.987   18.297  25.055  1.000 21.776  0 342  LEU   A HB2  1 c 1 
ATOM   4436  H  HB3  . LEU   A  1  287 ? 7.569   19.469  24.174  1.000 21.866  0 342  LEU   A HB3  1 c 1 
ATOM   4437  H  HG   . LEU   A  1  287 ? 8.717   16.883  24.292  1.000 21.743  0 342  LEU   A HG   1 c 1 
ATOM   4438  H  HD11 . LEU   A  1  287 ? 7.725   16.398  22.260  1.000 20.916  0 342  LEU   A HD11 1 c 1 
ATOM   4439  H  HD12 . LEU   A  1  287 ? 7.238   17.898  22.065  1.000 21.218  0 342  LEU   A HD12 1 c 1 
ATOM   4440  H  HD13 . LEU   A  1  287 ? 6.555   16.977  23.165  1.000 21.260  0 342  LEU   A HD13 1 c 1 
ATOM   4441  H  HD21 . LEU   A  1  287 ? 10.377  18.335  23.705  1.000 21.273  0 342  LEU   A HD21 1 c 1 
ATOM   4442  H  HD22 . LEU   A  1  287 ? 9.438   19.087  22.667  1.000 21.016  0 342  LEU   A HD22 1 c 1 
ATOM   4443  H  HD23 . LEU   A  1  287 ? 9.938   17.611  22.361  1.000 20.554  0 342  LEU   A HD23 1 c 1 
ATOM   4444  N  N    . LYS   A  1  288 ? 7.022   20.096  27.380  1.000 24.355  0 343  LYS   A N    1 ? 1 
ATOM   4445  C  CA   . LYS   A  1  288 ? 6.397   21.166  28.141  1.000 28.194  0 343  LYS   A CA   1 ? 1 
ATOM   4446  C  C    . LYS   A  1  288 ? 7.387   21.864  29.072  1.000 29.674  0 343  LYS   A C    1 ? 1 
ATOM   4447  O  O    . LYS   A  1  288 ? 7.427   23.097  29.157  1.000 26.152  0 343  LYS   A O    1 ? 1 
ATOM   4448  C  CB   . LYS   A  1  288 ? 5.186   20.626  28.969  1.000 29.319  0 343  LYS   A CB   1 ? 1 
ATOM   4449  C  CG   . LYS   A  1  288 ? 4.425   21.721  29.668  1.000 31.694  0 343  LYS   A CG   1 ? 1 
ATOM   4450  C  CD   . LYS   A  1  288 ? 3.219   21.252  30.410  1.000 31.396  0 343  LYS   A CD   1 ? 1 
ATOM   4451  C  CE   . LYS   A  1  288 ? 2.686   22.396  31.261  1.000 32.897  0 343  LYS   A CE   1 ? 1 
ATOM   4452  N  NZ   . LYS   A  1  288 ? 1.517   21.958  32.094  1.000 33.732  0 343  LYS   A NZ   1 ? 1 
ATOM   4453  H  H    . LYS   A  1  288 ? 6.684   19.249  27.447  1.000 24.490  0 343  LYS   A H    1 c 1 
ATOM   4454  H  HA   . LYS   A  1  288 ? 6.061   21.830  27.502  1.000 27.725  0 343  LYS   A HA   1 c 1 
ATOM   4455  H  HB2  . LYS   A  1  288 ? 4.577   20.148  28.367  1.000 29.026  0 343  LYS   A HB2  1 c 1 
ATOM   4456  H  HB3  . LYS   A  1  288 ? 5.517   19.990  29.638  1.000 29.566  0 343  LYS   A HB3  1 c 1 
ATOM   4457  H  HG2  . LYS   A  1  288 ? 5.028   22.169  30.298  1.000 31.642  0 343  LYS   A HG2  1 c 1 
ATOM   4458  H  HG3  . LYS   A  1  288 ? 4.147   22.384  29.000  1.000 31.120  0 343  LYS   A HG3  1 c 1 
ATOM   4459  H  HD2  . LYS   A  1  288 ? 2.529   20.964  29.775  1.000 31.275  0 343  LYS   A HD2  1 c 1 
ATOM   4460  H  HD3  . LYS   A  1  288 ? 3.456   20.494  30.985  1.000 31.668  0 343  LYS   A HD3  1 c 1 
ATOM   4461  H  HE2  . LYS   A  1  288 ? 3.392   22.722  31.850  1.000 33.251  0 343  LYS   A HE2  1 c 1 
ATOM   4462  H  HE3  . LYS   A  1  288 ? 2.408   23.132  30.684  1.000 32.874  0 343  LYS   A HE3  1 c 1 
ATOM   4463  H  HZ1  . LYS   A  1  288 ? 1.782   21.324  32.686  1.000 33.630  0 343  LYS   A HZ1  1 c 1 
ATOM   4464  H  HZ2  . LYS   A  1  288 ? 0.871   21.614  31.560  1.000 33.232  0 343  LYS   A HZ2  1 c 1 
ATOM   4465  H  HZ3  . LYS   A  1  288 ? 1.181   22.667  32.549  1.000 34.082  0 343  LYS   A HZ3  1 c 1 
ATOM   4466  N  N    . GLN   A  1  289 ? 8.191   21.048  29.760  1.000 24.342  0 344  GLN   A N    1 ? 1 
ATOM   4467  C  CA   . GLN   A  1  289 ? 9.279   21.561  30.573  1.000 26.094  0 344  GLN   A CA   1 ? 1 
ATOM   4468  C  C    . GLN   A  1  289 ? 10.246  22.445  29.781  1.000 23.291  0 344  GLN   A C    1 ? 1 
ATOM   4469  O  O    . GLN   A  1  289 ? 10.741  23.453  30.291  1.000 25.759  0 344  GLN   A O    1 ? 1 
ATOM   4470  C  CB   . GLN   A  1  289 ? 10.021  20.381  31.222  1.000 25.952  0 344  GLN   A CB   1 ? 1 
ATOM   4471  C  CG   . GLN   A  1  289 ? 11.308  20.832  31.979  1.000 32.258  0 344  GLN   A CG   1 ? 1 
ATOM   4472  C  CD   . GLN   A  1  289 ? 11.709  19.739  32.957  1.000 34.003  0 344  GLN   A CD   1 ? 1 
ATOM   4473  O  OE1  . GLN   A  1  289 ? 11.186  19.672  34.069  1.000 35.664  0 344  GLN   A OE1  1 ? 1 
ATOM   4474  N  NE2  . GLN   A  1  289 ? 12.610  18.844  32.531  1.000 36.375  0 344  GLN   A NE2  1 ? 1 
ATOM   4475  H  H    . GLN   A  1  289 ? 8.051   20.146  29.728  1.000 25.400  0 344  GLN   A H    1 c 1 
ATOM   4476  H  HA   . GLN   A  1  289 ? 8.884   22.108  31.291  1.000 25.740  0 344  GLN   A HA   1 c 1 
ATOM   4477  H  HB2  . GLN   A  1  289 ? 9.415   19.935  31.849  1.000 27.151  0 344  GLN   A HB2  1 c 1 
ATOM   4478  H  HB3  . GLN   A  1  289 ? 10.264  19.738  30.526  1.000 26.506  0 344  GLN   A HB3  1 c 1 
ATOM   4479  H  HG2  . GLN   A  1  289 ? 12.036  20.989  31.341  1.000 30.955  0 344  GLN   A HG2  1 c 1 
ATOM   4480  H  HG3  . GLN   A  1  289 ? 11.134  21.666  32.466  1.000 31.547  0 344  GLN   A HG3  1 c 1 
ATOM   4481  H  HE21 . GLN   A  1  289 ? 13.016  18.958  31.754  1.000 35.150  0 344  GLN   A HE21 1 c 1 
ATOM   4482  H  HE22 . GLN   A  1  289 ? 12.799  18.137  33.028  1.000 35.454  0 344  GLN   A HE22 1 c 1 
ATOM   4483  N  N    . LEU   A  1  290 ? 10.486  22.078  28.527  1.000 20.933  0 345  LEU   A N    1 ? 1 
ATOM   4484  C  CA   . LEU   A  1  290 ? 11.311  22.859  27.621  1.000 22.909  0 345  LEU   A CA   1 ? 1 
ATOM   4485  C  C    . LEU   A  1  290 ? 10.509  23.953  26.914  1.000 28.779  0 345  LEU   A C    1 ? 1 
ATOM   4486  O  O    . LEU   A  1  290 ? 11.064  24.739  26.151  1.000 21.799  0 345  LEU   A O    1 ? 1 
ATOM   4487  C  CB   . LEU   A  1  290 ? 11.950  21.931  26.580  1.000 21.219  0 345  LEU   A CB   1 ? 1 
ATOM   4488  C  CG   . LEU   A  1  290 ? 12.949  20.914  27.134  1.000 23.488  0 345  LEU   A CG   1 ? 1 
ATOM   4489  C  CD1  . LEU   A  1  290 ? 13.495  19.992  26.053  1.000 22.841  0 345  LEU   A CD1  1 ? 1 
ATOM   4490  C  CD2  . LEU   A  1  290 ? 14.104  21.617  27.837  1.000 24.769  0 345  LEU   A CD2  1 ? 1 
ATOM   4491  H  H    . LEU   A  1  290 ? 10.130  21.294  28.222  1.000 21.357  0 345  LEU   A H    1 c 1 
ATOM   4492  H  HA   . LEU   A  1  290 ? 12.021  23.291  28.148  1.000 23.648  0 345  LEU   A HA   1 c 1 
ATOM   4493  H  HB2  . LEU   A  1  290 ? 11.236  21.445  26.120  1.000 21.453  0 345  LEU   A HB2  1 c 1 
ATOM   4494  H  HB3  . LEU   A  1  290 ? 12.408  22.482  25.914  1.000 21.978  0 345  LEU   A HB3  1 c 1 
ATOM   4495  H  HG   . LEU   A  1  290 ? 12.480  20.357  27.802  1.000 23.057  0 345  LEU   A HG   1 c 1 
ATOM   4496  H  HD11 . LEU   A  1  290 ? 13.936  19.231  26.468  1.000 22.881  0 345  LEU   A HD11 1 c 1 
ATOM   4497  H  HD12 . LEU   A  1  290 ? 14.136  20.478  25.505  1.000 22.965  0 345  LEU   A HD12 1 c 1 
ATOM   4498  H  HD13 . LEU   A  1  290 ? 12.764  19.678  25.494  1.000 22.391  0 345  LEU   A HD13 1 c 1 
ATOM   4499  H  HD21 . LEU   A  1  290 ? 13.794  21.989  28.682  1.000 25.001  0 345  LEU   A HD21 1 c 1 
ATOM   4500  H  HD22 . LEU   A  1  290 ? 14.441  22.334  27.272  1.000 24.723  0 345  LEU   A HD22 1 c 1 
ATOM   4501  H  HD23 . LEU   A  1  290 ? 14.817  20.977  28.009  1.000 24.636  0 345  LEU   A HD23 1 c 1 
ATOM   4502  N  N    . ARG   A  1  291 ? 9.200   24.007  27.183  1.000 25.774  0 346  ARG   A N    1 ? 1 
ATOM   4503  C  CA   . ARG   A  1  291 ? 8.343   24.987  26.542  1.000 27.278  0 346  ARG   A CA   1 ? 1 
ATOM   4504  C  C    . ARG   A  1  291 ? 8.385   24.825  25.027  1.000 23.269  0 346  ARG   A C    1 ? 1 
ATOM   4505  O  O    . ARG   A  1  291 ? 8.258   25.815  24.308  1.000 23.762  0 346  ARG   A O    1 ? 1 
ATOM   4506  C  CB   . ARG   A  1  291 ? 8.693   26.423  26.954  1.000 30.747  0 346  ARG   A CB   1 ? 1 
ATOM   4507  C  CG   . ARG   A  1  291 ? 8.233   26.765  28.380  1.000 38.956  0 346  ARG   A CG   1 ? 1 
ATOM   4508  C  CD   . ARG   A  1  291 ? 9.045   26.044  29.421  1.000 43.688  0 346  ARG   A CD   1 ? 1 
ATOM   4509  N  NE   . ARG   A  1  291 ? 8.781   26.544  30.761  1.000 44.863  0 346  ARG   A NE   1 ? 1 
ATOM   4510  C  CZ   . ARG   A  1  291 ? 8.019   25.953  31.671  1.000 43.616  0 346  ARG   A CZ   1 ? 1 
ATOM   4511  N  NH1  . ARG   A  1  291 ? 7.442   24.783  31.448  1.000 40.426  0 346  ARG   A NH1  1 ? 1 
ATOM   4512  N  NH2  . ARG   A  1  291 ? 7.801   26.577  32.824  1.000 54.908  0 346  ARG   A NH2  1 ? 1 
ATOM   4513  H  H    . ARG   A  1  291 ? 8.828   23.415  27.768  1.000 26.673  0 346  ARG   A H    1 c 1 
ATOM   4514  H  HA   . ARG   A  1  291 ? 7.421   24.807  26.837  1.000 26.700  0 346  ARG   A HA   1 c 1 
ATOM   4515  H  HB2  . ARG   A  1  291 ? 9.662   26.548  26.893  1.000 31.594  0 346  ARG   A HB2  1 c 1 
ATOM   4516  H  HB3  . ARG   A  1  291 ? 8.268   27.046  26.329  1.000 31.402  0 346  ARG   A HB3  1 c 1 
ATOM   4517  H  HG2  . ARG   A  1  291 ? 8.314   27.732  28.525  1.000 38.372  0 346  ARG   A HG2  1 c 1 
ATOM   4518  H  HG3  . ARG   A  1  291 ? 7.289   26.520  28.485  1.000 37.643  0 346  ARG   A HG3  1 c 1 
ATOM   4519  H  HD2  . ARG   A  1  291 ? 8.840   25.088  29.386  1.000 41.537  0 346  ARG   A HD2  1 c 1 
ATOM   4520  H  HD3  . ARG   A  1  291 ? 9.997   26.154  29.219  1.000 42.534  0 346  ARG   A HD3  1 c 1 
ATOM   4521  H  HE   . ARG   A  1  291 ? 9.164   27.289  30.989  1.000 45.038  0 346  ARG   A HE   1 c 1 
ATOM   4522  H  HH11 . ARG   A  1  291 ? 6.963   24.660  30.716  1.000 40.784  0 346  ARG   A HH11 1 c 1 
ATOM   4523  H  HH12 . ARG   A  1  291 ? 7.535   24.130  32.035  1.000 41.213  0 346  ARG   A HH12 1 c 1 
ATOM   4524  H  HH21 . ARG   A  1  291 ? 7.314   26.191  33.444  1.000 51.342  0 346  ARG   A HH21 1 c 1 
ATOM   4525  H  HH22 . ARG   A  1  291 ? 8.144   27.374  32.965  1.000 51.633  0 346  ARG   A HH22 1 c 1 
ATOM   4526  N  N    . LEU   A  1  292 ? 8.493   23.562  24.581  1.000 20.288  0 347  LEU   A N    1 ? 1 
ATOM   4527  C  CA   . LEU   A  1  292 ? 8.430   23.183  23.183  1.000 20.098  0 347  LEU   A CA   1 ? 1 
ATOM   4528  C  C    . LEU   A  1  292 ? 7.174   22.386  22.833  1.000 22.242  0 347  LEU   A C    1 ? 1 
ATOM   4529  O  O    . LEU   A  1  292 ? 7.038   21.881  21.718  1.000 22.929  0 347  LEU   A O    1 ? 1 
ATOM   4530  C  CB   . LEU   A  1  292 ? 9.626   22.356  22.871  1.000 21.689  0 347  LEU   A CB   1 ? 1 
ATOM   4531  C  CG   . LEU   A  1  292 ? 10.961  23.054  22.907  1.000 21.684  0 347  LEU   A CG   1 ? 1 
ATOM   4532  C  CD1  . LEU   A  1  292 ? 12.082  22.009  22.735  1.000 21.301  0 347  LEU   A CD1  1 ? 1 
ATOM   4533  C  CD2  . LEU   A  1  292 ? 11.086  24.109  21.793  1.000 22.703  0 347  LEU   A CD2  1 ? 1 
ATOM   4534  H  H    . LEU   A  1  292 ? 8.602   22.895  25.196  1.000 20.983  0 347  LEU   A H    1 c 1 
ATOM   4535  H  HA   . LEU   A  1  292 ? 8.444   24.000  22.635  1.000 20.951  0 347  LEU   A HA   1 c 1 
ATOM   4536  H  HB2  . LEU   A  1  292 ? 9.652   21.612  23.505  1.000 21.049  0 347  LEU   A HB2  1 c 1 
ATOM   4537  H  HB3  . LEU   A  1  292 ? 9.509   21.973  21.979  1.000 20.718  0 347  LEU   A HB3  1 c 1 
ATOM   4538  H  HG   . LEU   A  1  292 ? 11.069  23.498  23.783  1.000 22.367  0 347  LEU   A HG   1 c 1 
ATOM   4539  H  HD11 . LEU   A  1  292 ? 12.941  22.419  22.935  1.000 21.738  0 347  LEU   A HD11 1 c 1 
ATOM   4540  H  HD12 . LEU   A  1  292 ? 12.085  21.684  21.818  1.000 20.943  0 347  LEU   A HD12 1 c 1 
ATOM   4541  H  HD13 . LEU   A  1  292 ? 11.929  21.265  23.342  1.000 21.245  0 347  LEU   A HD13 1 c 1 
ATOM   4542  H  HD21 . LEU   A  1  292 ? 10.448  24.826  21.951  1.000 22.671  0 347  LEU   A HD21 1 c 1 
ATOM   4543  H  HD22 . LEU   A  1  292 ? 10.903  23.696  20.932  1.000 21.975  0 347  LEU   A HD22 1 c 1 
ATOM   4544  H  HD23 . LEU   A  1  292 ? 11.988  24.474  21.792  1.000 22.745  0 347  LEU   A HD23 1 c 1 
ATOM   4545  N  N    . HIS   A  1  293 ? 6.236   22.314  23.781  1.000 24.297  0 348  HIS   A N    1 ? 1 
ATOM   4546  C  CA   . HIS   A  1  293 ? 5.043   21.500  23.622  1.000 24.726  0 348  HIS   A CA   1 ? 1 
ATOM   4547  C  C    . HIS   A  1  293 ? 4.018   22.105  22.664  1.000 21.864  0 348  HIS   A C    1 ? 1 
ATOM   4548  O  O    . HIS   A  1  293 ? 3.048   21.462  22.316  1.000 23.267  0 348  HIS   A O    1 ? 1 
ATOM   4549  C  CB   . HIS   A  1  293 ? 4.436   21.213  25.011  1.000 23.653  0 348  HIS   A CB   1 ? 1 
ATOM   4550  C  CG   . HIS   A  1  293 ? 4.036   22.450  25.750  1.000 29.021  0 348  HIS   A CG   1 ? 1 
ATOM   4551  N  ND1  . HIS   A  1  293 ? 2.745   22.640  26.191  1.000 30.187  0 348  HIS   A ND1  1 ? 1 
ATOM   4552  C  CD2  . HIS   A  1  293 ? 4.768   23.526  26.082  1.000 22.930  0 348  HIS   A CD2  1 ? 1 
ATOM   4553  C  CE1  . HIS   A  1  293 ? 2.736   23.833  26.760  1.000 27.753  0 348  HIS   A CE1  1 ? 1 
ATOM   4554  N  NE2  . HIS   A  1  293 ? 3.925   24.403  26.690  1.000 26.386  0 348  HIS   A NE2  1 ? 1 
ATOM   4555  H  H    . HIS   A  1  293 ? 6.358   22.772  24.559  1.000 24.331  0 348  HIS   A H    1 c 1 
ATOM   4556  H  HA   . HIS   A  1  293 ? 5.332   20.635  23.245  1.000 23.310  0 348  HIS   A HA   1 c 1 
ATOM   4557  H  HB2  . HIS   A  1  293 ? 3.648   20.642  24.899  1.000 24.684  0 348  HIS   A HB2  1 c 1 
ATOM   4558  H  HB3  . HIS   A  1  293 ? 5.092   20.722  25.547  1.000 24.985  0 348  HIS   A HB3  1 c 1 
ATOM   4559  H  HD1  . HIS   A  1  293 ? 2.072   22.084  26.080  0.000 15.850  0 348  HIS   A HD1  1 c 1 
ATOM   4560  H  HD2  . HIS   A  1  293 ? 5.677   23.670  25.889  1.000 24.908  0 348  HIS   A HD2  1 c 1 
ATOM   4561  H  HE1  . HIS   A  1  293 ? 1.978   24.229  27.158  1.000 28.345  0 348  HIS   A HE1  1 c 1 
ATOM   4562  H  HE2  . HIS   A  1  293 ? 4.142   25.204  27.009  0.000 11.600  0 348  HIS   A HE2  1 c 1 
ATOM   4563  N  N    . ARG   A  1  294 ? 4.226   23.349  22.245  1.000 21.443  0 349  ARG   A N    1 ? 1 
ATOM   4564  C  CA   . ARG   A  1  294 ? 3.424   23.974  21.200  1.000 23.497  0 349  ARG   A CA   1 ? 1 
ATOM   4565  C  C    . ARG   A  1  294 ? 4.303   24.353  19.996  1.000 23.504  0 349  ARG   A C    1 ? 1 
ATOM   4566  O  O    . ARG   A  1  294 ? 3.965   25.208  19.170  1.000 25.492  0 349  ARG   A O    1 ? 1 
ATOM   4567  C  CB   . ARG   A  1  294 ? 2.701   25.193  21.818  1.000 29.753  0 349  ARG   A CB   1 ? 1 
ATOM   4568  C  CG   . ARG   A  1  294 ? 1.776   24.818  23.002  1.000 30.811  0 349  ARG   A CG   1 ? 1 
ATOM   4569  C  CD   . ARG   A  1  294 ? 1.255   26.020  23.768  1.000 36.505  0 349  ARG   A CD   1 ? 1 
ATOM   4570  N  NE   . ARG   A  1  294 ? 0.337   26.808  22.958  1.000 40.238  0 349  ARG   A NE   1 ? 1 
ATOM   4571  C  CZ   . ARG   A  1  294 ? -0.884  26.419  22.594  1.000 56.088  0 349  ARG   A CZ   1 ? 1 
ATOM   4572  N  NH1  . ARG   A  1  294 ? -1.447  25.330  23.098  1.000 56.382  0 349  ARG   A NH1  1 ? 1 
ATOM   4573  N  NH2  . ARG   A  1  294 ? -1.568  27.153  21.719  1.000 55.814  0 349  ARG   A NH2  1 ? 1 
ATOM   4574  H  H    . ARG   A  1  294 ? 4.884   23.846  22.638  1.000 22.460  0 349  ARG   A H    1 c 1 
ATOM   4575  H  HA   . ARG   A  1  294 ? 2.747   23.328  20.898  1.000 23.617  0 349  ARG   A HA   1 c 1 
ATOM   4576  H  HB2  . ARG   A  1  294 ? 3.373   25.834  22.130  1.000 28.817  0 349  ARG   A HB2  1 c 1 
ATOM   4577  H  HB3  . ARG   A  1  294 ? 2.166   25.629  21.122  1.000 28.430  0 349  ARG   A HB3  1 c 1 
ATOM   4578  H  HG2  . ARG   A  1  294 ? 1.013   24.305  22.661  1.000 31.478  0 349  ARG   A HG2  1 c 1 
ATOM   4579  H  HG3  . ARG   A  1  294 ? 2.268   24.241  23.623  1.000 31.496  0 349  ARG   A HG3  1 c 1 
ATOM   4580  H  HD2  . ARG   A  1  294 ? 0.795   25.716  24.579  1.000 36.428  0 349  ARG   A HD2  1 c 1 
ATOM   4581  H  HD3  . ARG   A  1  294 ? 2.011   26.583  24.041  1.000 36.423  0 349  ARG   A HD3  1 c 1 
ATOM   4582  H  HE   . ARG   A  1  294 ? 0.605   27.595  22.692  1.000 42.885  0 349  ARG   A HE   1 c 1 
ATOM   4583  H  HH11 . ARG   A  1  294 ? -1.338  25.132  23.952  1.000 55.978  0 349  ARG   A HH11 1 c 1 
ATOM   4584  H  HH12 . ARG   A  1  294 ? -1.937  24.810  22.578  1.000 55.747  0 349  ARG   A HH12 1 c 1 
ATOM   4585  H  HH21 . ARG   A  1  294 ? -2.390  26.926  21.505  1.000 55.801  0 349  ARG   A HH21 1 c 1 
ATOM   4586  H  HH22 . ARG   A  1  294 ? -1.198  27.864  21.357  1.000 55.842  0 349  ARG   A HH22 1 c 1 
ATOM   4587  N  N    . CYS   A  1  295 ? 5.461   23.696  19.909  1.000 20.897  0 350  CYS   A N    1 ? 1 
ATOM   4588  C  CA   . CYS   A  1  295 ? 6.458   23.965  18.897  1.000 22.420  0 350  CYS   A CA   1 ? 1 
ATOM   4589  C  C    . CYS   A  1  295 ? 6.679   22.740  18.012  1.000 21.728  0 350  CYS   A C    1 ? 1 
ATOM   4590  O  O    . CYS   A  1  295 ? 6.887   22.887  16.812  1.000 28.242  0 350  CYS   A O    1 ? 1 
ATOM   4591  C  CB   . CYS   A  1  295 ? 7.748   24.419  19.578  1.000 23.226  0 350  CYS   A CB   1 ? 1 
ATOM   4592  S  SG   . CYS   A  1  295 ? 9.141   24.575  18.470  1.000 35.152  0 350  CYS   A SG   1 ? 1 
ATOM   4593  H  H    . CYS   A  1  295 ? 5.641   23.048  20.527  1.000 21.718  0 350  CYS   A H    1 c 1 
ATOM   4594  H  HA   . CYS   A  1  295 ? 6.132   24.702  18.332  1.000 22.332  0 350  CYS   A HA   1 c 1 
ATOM   4595  H  HB2  . CYS   A  1  295 ? 7.596   25.283  20.005  1.000 25.392  0 350  CYS   A HB2  1 c 1 
ATOM   4596  H  HB3  . CYS   A  1  295 ? 7.982   23.778  20.278  1.000 24.853  0 350  CYS   A HB3  1 c 1 
ATOM   4597  N  N    . VAL   A  1  296 ? 6.662   21.549  18.631  1.000 22.101  0 351  VAL   A N    1 ? 1 
ATOM   4598  C  CA   . VAL   A  1  296 ? 7.089   20.301  18.021  1.000 21.349  0 351  VAL   A CA   1 ? 1 
ATOM   4599  C  C    . VAL   A  1  296 ? 5.892   19.538  17.448  1.000 23.511  0 351  VAL   A C    1 ? 1 
ATOM   4600  O  O    . VAL   A  1  296 ? 4.864   19.424  18.097  1.000 21.352  0 351  VAL   A O    1 ? 1 
ATOM   4601  C  CB   . VAL   A  1  296 ? 7.871   19.451  19.038  1.000 22.293  0 351  VAL   A CB   1 ? 1 
ATOM   4602  C  CG1  . VAL   A  1  296 ? 8.182   18.098  18.509  1.000 28.066  0 351  VAL   A CG1  1 ? 1 
ATOM   4603  C  CG2  . VAL   A  1  296 ? 9.172   20.133  19.450  1.000 27.287  0 351  VAL   A CG2  1 ? 1 
ATOM   4604  H  H    . VAL   A  1  296 ? 6.368   21.515  19.495  1.000 22.076  0 351  VAL   A H    1 c 1 
ATOM   4605  H  HA   . VAL   A  1  296 ? 7.690   20.517  17.286  1.000 21.968  0 351  VAL   A HA   1 c 1 
ATOM   4606  H  HB   . VAL   A  1  296 ? 7.308   19.347  19.844  1.000 24.019  0 351  VAL   A HB   1 c 1 
ATOM   4607  H  HG11 . VAL   A  1  296 ? 8.565   18.177  17.619  1.000 25.722  0 351  VAL   A HG11 1 c 1 
ATOM   4608  H  HG12 . VAL   A  1  296 ? 7.366   17.569  18.466  1.000 25.596  0 351  VAL   A HG12 1 c 1 
ATOM   4609  H  HG13 . VAL   A  1  296 ? 8.819   17.659  19.098  1.000 25.979  0 351  VAL   A HG13 1 c 1 
ATOM   4610  H  HG21 . VAL   A  1  296 ? 9.640   19.577  20.097  1.000 25.863  0 351  VAL   A HG21 1 c 1 
ATOM   4611  H  HG22 . VAL   A  1  296 ? 8.974   20.997  19.850  1.000 26.112  0 351  VAL   A HG22 1 c 1 
ATOM   4612  H  HG23 . VAL   A  1  296 ? 9.734   20.260  18.666  1.000 25.701  0 351  VAL   A HG23 1 c 1 
ATOM   4613  N  N    . ASN   A  1  297 ? 6.030   19.055  16.211  1.000 18.603  0 352  ASN   A N    1 ? 1 
ATOM   4614  C  CA   . ASN   A  1  297 ? 5.081   18.101  15.656  1.000 24.503  0 352  ASN   A CA   1 ? 1 
ATOM   4615  C  C    . ASN   A  1  297 ? 5.486   16.692  16.066  1.000 20.584  0 352  ASN   A C    1 ? 1 
ATOM   4616  O  O    . ASN   A  1  297 ? 6.648   16.325  15.951  1.000 22.822  0 352  ASN   A O    1 ? 1 
ATOM   4617  C  CB   . ASN   A  1  297 ? 4.996   18.198  14.150  1.000 20.711  0 352  ASN   A CB   1 ? 1 
ATOM   4618  C  CG   . ASN   A  1  297 ? 4.266   19.423  13.694  1.000 20.594  0 352  ASN   A CG   1 ? 1 
ATOM   4619  O  OD1  . ASN   A  1  297 ? 3.124   19.647  14.095  1.000 20.541  0 352  ASN   A OD1  1 ? 1 
ATOM   4620  N  ND2  . ASN   A  1  297 ? 4.899   20.244  12.862  1.000 19.860  0 352  ASN   A ND2  1 ? 1 
ATOM   4621  H  H    . ASN   A  1  297 ? 6.734   19.327  15.695  1.000 20.866  0 352  ASN   A H    1 c 1 
ATOM   4622  H  HA   . ASN   A  1  297 ? 4.190   18.297  16.023  1.000 21.742  0 352  ASN   A HA   1 c 1 
ATOM   4623  H  HB2  . ASN   A  1  297 ? 5.903   18.206  13.781  1.000 21.314  0 352  ASN   A HB2  1 c 1 
ATOM   4624  H  HB3  . ASN   A  1  297 ? 4.536   17.405  13.806  1.000 20.996  0 352  ASN   A HB3  1 c 1 
ATOM   4625  H  HD21 . ASN   A  1  297 ? 5.634   19.977  12.449  1.000 20.047  0 352  ASN   A HD21 1 c 1 
ATOM   4626  H  HD22 . ASN   A  1  297 ? 4.585   21.058  12.721  1.000 20.399  0 352  ASN   A HD22 1 c 1 
ATOM   4627  N  N    . VAL   A  1  298 ? 4.511   15.919  16.551  1.000 18.399  0 353  VAL   A N    1 ? 1 
ATOM   4628  C  CA   . VAL   A  1  298 ? 4.750   14.581  17.061  1.000 19.202  0 353  VAL   A CA   1 ? 1 
ATOM   4629  C  C    . VAL   A  1  298 ? 3.882   13.633  16.253  1.000 20.056  0 353  VAL   A C    1 ? 1 
ATOM   4630  O  O    . VAL   A  1  298 ? 2.696   13.879  16.103  1.000 22.326  0 353  VAL   A O    1 ? 1 
ATOM   4631  C  CB   . VAL   A  1  298 ? 4.428   14.449  18.555  1.000 18.980  0 353  VAL   A CB   1 ? 1 
ATOM   4632  C  CG1  . VAL   A  1  298 ? 4.693   13.046  19.055  1.000 24.543  0 353  VAL   A CG1  1 ? 1 
ATOM   4633  C  CG2  . VAL   A  1  298 ? 5.221   15.463  19.380  1.000 26.954  0 353  VAL   A CG2  1 ? 1 
ATOM   4634  H  H    . VAL   A  1  298 ? 3.656   16.241  16.562  1.000 19.200  0 353  VAL   A H    1 c 1 
ATOM   4635  H  HA   . VAL   A  1  298 ? 5.683   14.353  16.921  1.000 19.181  0 353  VAL   A HA   1 c 1 
ATOM   4636  H  HB   . VAL   A  1  298 ? 3.465   14.641  18.675  1.000 21.252  0 353  VAL   A HB   1 c 1 
ATOM   4637  H  HG11 . VAL   A  1  298 ? 5.584   12.766  18.781  1.000 22.504  0 353  VAL   A HG11 1 c 1 
ATOM   4638  H  HG12 . VAL   A  1  298 ? 4.033   12.436  18.682  1.000 22.312  0 353  VAL   A HG12 1 c 1 
ATOM   4639  H  HG13 . VAL   A  1  298 ? 4.633   13.030  20.026  1.000 22.880  0 353  VAL   A HG13 1 c 1 
ATOM   4640  H  HG21 . VAL   A  1  298 ? 5.047   15.320  20.327  1.000 24.543  0 353  VAL   A HG21 1 c 1 
ATOM   4641  H  HG22 . VAL   A  1  298 ? 4.951   16.365  19.135  1.000 24.441  0 353  VAL   A HG22 1 c 1 
ATOM   4642  H  HG23 . VAL   A  1  298 ? 6.172   15.351  19.206  1.000 24.309  0 353  VAL   A HG23 1 c 1 
ATOM   4643  N  N    . ILE   A  1  299 ? 4.515   12.608  15.686  1.000 25.050  0 354  ILE   A N    1 ? 1 
ATOM   4644  C  CA   . ILE   A  1  299 ? 3.824   11.525  15.000  1.000 22.966  0 354  ILE   A CA   1 ? 1 
ATOM   4645  C  C    . ILE   A  1  299 ? 3.969   10.290  15.866  1.000 21.639  0 354  ILE   A C    1 ? 1 
ATOM   4646  O  O    . ILE   A  1  299 ? 5.086   9.896   16.191  1.000 21.925  0 354  ILE   A O    1 ? 1 
ATOM   4647  C  CB   . ILE   A  1  299 ? 4.439   11.293  13.620  1.000 20.216  0 354  ILE   A CB   1 ? 1 
ATOM   4648  C  CG1  . ILE   A  1  299 ? 4.058   12.480  12.708  1.000 26.118  0 354  ILE   A CG1  1 ? 1 
ATOM   4649  C  CG2  . ILE   A  1  299 ? 4.055   9.890   13.016  1.000 22.420  0 354  ILE   A CG2  1 ? 1 
ATOM   4650  C  CD1  . ILE   A  1  299 ? 4.683   12.428  11.325  1.000 26.655  0 354  ILE   A CD1  1 ? 1 
ATOM   4651  H  H    . ILE   A  1  299 ? 5.428   12.580  15.727  1.000 23.214  0 354  ILE   A H    1 c 1 
ATOM   4652  H  HA   . ILE   A  1  299 ? 2.884   11.750  14.900  1.000 22.461  0 354  ILE   A HA   1 c 1 
ATOM   4653  H  HB   . ILE   A  1  299 ? 5.422   11.310  13.729  1.000 22.197  0 354  ILE   A HB   1 c 1 
ATOM   4654  H  HG12 . ILE   A  1  299 ? 3.082   12.499  12.611  1.000 24.701  0 354  ILE   A HG12 1 c 1 
ATOM   4655  H  HG13 . ILE   A  1  299 ? 4.332   13.314  13.145  1.000 25.033  0 354  ILE   A HG13 1 c 1 
ATOM   4656  H  HG21 . ILE   A  1  299 ? 3.087   9.792   13.011  1.000 21.586  0 354  ILE   A HG21 1 c 1 
ATOM   4657  H  HG22 . ILE   A  1  299 ? 4.448   9.182   13.554  1.000 21.669  0 354  ILE   A HG22 1 c 1 
ATOM   4658  H  HG23 . ILE   A  1  299 ? 4.389   9.823   12.105  1.000 21.534  0 354  ILE   A HG23 1 c 1 
ATOM   4659  H  HD11 . ILE   A  1  299 ? 4.284   11.704  10.812  1.000 26.124  0 354  ILE   A HD11 1 c 1 
ATOM   4660  H  HD12 . ILE   A  1  299 ? 5.641   12.277  11.406  1.000 26.482  0 354  ILE   A HD12 1 c 1 
ATOM   4661  H  HD13 . ILE   A  1  299 ? 4.527   13.272  10.866  1.000 26.525  0 354  ILE   A HD13 1 c 1 
ATOM   4662  N  N    . PHE   A  1  300 ? 2.830   9.707   16.243  1.000 20.477  0 355  PHE   A N    1 ? 1 
ATOM   4663  C  CA   . PHE   A  1  300 ? 2.799   8.405   16.891  1.000 19.048  0 355  PHE   A CA   1 ? 1 
ATOM   4664  C  C    . PHE   A  1  300 ? 2.359   7.370   15.847  1.000 20.264  0 355  PHE   A C    1 ? 1 
ATOM   4665  O  O    . PHE   A  1  300 ? 1.284   7.473   15.248  1.000 19.670  0 355  PHE   A O    1 ? 1 
ATOM   4666  C  CB   . PHE   A  1  300 ? 1.851   8.477   18.138  1.000 21.055  0 355  PHE   A CB   1 ? 1 
ATOM   4667  C  CG   . PHE   A  1  300 ? 1.785   7.244   19.001  1.000 18.967  0 355  PHE   A CG   1 ? 1 
ATOM   4668  C  CD1  . PHE   A  1  300 ? 2.685   7.050   20.038  1.000 17.843  0 355  PHE   A CD1  1 ? 1 
ATOM   4669  C  CD2  . PHE   A  1  300 ? 0.844   6.252   18.758  1.000 19.057  0 355  PHE   A CD2  1 ? 1 
ATOM   4670  C  CE1  . PHE   A  1  300 ? 2.641   5.904   20.789  1.000 17.773  0 355  PHE   A CE1  1 ? 1 
ATOM   4671  C  CE2  . PHE   A  1  300 ? 0.807   5.110   19.526  1.000 16.124  0 355  PHE   A CE2  1 ? 1 
ATOM   4672  C  CZ   . PHE   A  1  300 ? 1.721   4.922   20.510  1.000 15.363  0 355  PHE   A CZ   1 ? 1 
ATOM   4673  H  H    . PHE   A  1  300 ? 2.038   10.139  16.095  1.000 20.448  0 355  PHE   A H    1 c 1 
ATOM   4674  H  HA   . PHE   A  1  300 ? 3.711   8.178   17.200  1.000 20.000  0 355  PHE   A HA   1 c 1 
ATOM   4675  H  HB2  . PHE   A  1  300 ? 2.140   9.229   18.695  1.000 20.391  0 355  PHE   A HB2  1 c 1 
ATOM   4676  H  HB3  . PHE   A  1  300 ? 0.949   8.678   17.819  1.000 20.065  0 355  PHE   A HB3  1 c 1 
ATOM   4677  H  HD1  . PHE   A  1  300 ? 3.345   7.702   20.212  1.000 18.227  0 355  PHE   A HD1  1 c 1 
ATOM   4678  H  HD2  . PHE   A  1  300 ? 0.228   6.359   18.050  1.000 17.977  0 355  PHE   A HD2  1 c 1 
ATOM   4679  H  HE1  . PHE   A  1  300 ? 3.262   5.780   21.489  1.000 17.508  0 355  PHE   A HE1  1 c 1 
ATOM   4680  H  HE2  . PHE   A  1  300 ? 0.166   4.442   19.344  1.000 16.450  0 355  PHE   A HE2  1 c 1 
ATOM   4681  H  HZ   . PHE   A  1  300 ? 1.674   4.153   21.055  1.000 16.302  0 355  PHE   A HZ   1 c 1 
ATOM   4682  N  N    . VAL   A  1  301 ? 3.207   6.373   15.624  1.000 20.760  0 356  VAL   A N    1 ? 1 
ATOM   4683  C  CA   . VAL   A  1  301 ? 3.046   5.504   14.476  1.000 16.762  0 356  VAL   A CA   1 ? 1 
ATOM   4684  C  C    . VAL   A  1  301 ? 3.619   4.128   14.776  1.000 14.212  0 356  VAL   A C    1 ? 1 
ATOM   4685  O  O    . VAL   A  1  301 ? 4.639   4.015   15.452  1.000 16.536  0 356  VAL   A O    1 ? 1 
ATOM   4686  C  CB   . VAL   A  1  301 ? 3.718   6.149   13.221  1.000 20.507  0 356  VAL   A CB   1 ? 1 
ATOM   4687  C  CG1  . VAL   A  1  301 ? 5.218   6.334   13.368  1.000 16.530  0 356  VAL   A CG1  1 ? 1 
ATOM   4688  C  CG2  . VAL   A  1  301 ? 3.427   5.354   11.987  1.000 25.847  0 356  VAL   A CG2  1 ? 1 
ATOM   4689  H  H    . VAL   A  1  301 ? 3.902   6.226   16.199  1.000 19.805  0 356  VAL   A H    1 c 1 
ATOM   4690  H  HA   . VAL   A  1  301 ? 2.096   5.406   14.298  1.000 17.422  0 356  VAL   A HA   1 c 1 
ATOM   4691  H  HB   . VAL   A  1  301 ? 3.317   7.045   13.101  1.000 19.767  0 356  VAL   A HB   1 c 1 
ATOM   4692  H  HG11 . VAL   A  1  301 ? 5.652   5.464   13.408  1.000 17.579  0 356  VAL   A HG11 1 c 1 
ATOM   4693  H  HG12 . VAL   A  1  301 ? 5.407   6.828   14.185  1.000 17.858  0 356  VAL   A HG12 1 c 1 
ATOM   4694  H  HG13 . VAL   A  1  301 ? 5.560   6.830   12.604  1.000 17.549  0 356  VAL   A HG13 1 c 1 
ATOM   4695  H  HG21 . VAL   A  1  301 ? 3.767   5.827   11.208  1.000 23.829  0 356  VAL   A HG21 1 c 1 
ATOM   4696  H  HG22 . VAL   A  1  301 ? 2.466   5.235   11.899  1.000 23.758  0 356  VAL   A HG22 1 c 1 
ATOM   4697  H  HG23 . VAL   A  1  301 ? 3.857   4.483   12.049  1.000 23.829  0 356  VAL   A HG23 1 c 1 
ATOM   4698  N  N    . GLY   A  1  302 ? 2.938   3.095   14.269  1.000 17.884  0 357  GLY   A N    1 ? 1 
ATOM   4699  C  CA   . GLY   A  1  302 ? 3.411   1.730   14.377  1.000 14.271  0 357  GLY   A CA   1 ? 1 
ATOM   4700  C  C    . GLY   A  1  302 ? 3.802   1.174   13.009  1.000 19.704  0 357  GLY   A C    1 ? 1 
ATOM   4701  O  O    . GLY   A  1  302 ? 3.482   1.746   11.961  1.000 21.121  0 357  GLY   A O    1 ? 1 
ATOM   4702  H  H    . GLY   A  1  302 ? 2.147   3.250   13.837  1.000 15.871  0 357  GLY   A H    1 c 1 
ATOM   4703  H  HA2  . GLY   A  1  302 ? 4.196   1.704   14.976  1.000 16.380  0 357  GLY   A HA2  1 c 1 
ATOM   4704  H  HA3  . GLY   A  1  302 ? 2.702   1.169   14.774  1.000 16.232  0 357  GLY   A HA3  1 c 1 
ATOM   4705  N  N    . ASP   A  1  303 ? 4.545   0.075   13.042  1.000 18.300  0 358  ASP   A N    1 ? 1 
ATOM   4706  C  CA   . ASP   A  1  303 ? 5.039   -0.560  11.833  1.000 17.125  0 358  ASP   A CA   1 ? 1 
ATOM   4707  C  C    . ASP   A  1  303 ? 4.088   -1.618  11.293  1.000 18.905  0 358  ASP   A C    1 ? 1 
ATOM   4708  O  O    . ASP   A  1  303 ? 4.040   -1.824  10.086  1.000 15.944  0 358  ASP   A O    1 ? 1 
ATOM   4709  C  CB   . ASP   A  1  303 ? 6.400   -1.186  12.075  1.000 19.447  0 358  ASP   A CB   1 ? 1 
ATOM   4710  C  CG   . ASP   A  1  303 ? 6.515   -2.208  13.160  1.000 16.633  0 358  ASP   A CG   1 ? 1 
ATOM   4711  O  OD1  . ASP   A  1  303 ? 5.594   -2.249  14.089  1.000 15.505  0 358  ASP   A OD1  1 ? 1 
ATOM   4712  O  OD2  . ASP   A  1  303 ? 7.498   -2.969  13.119  1.000 20.208  0 358  ASP   A OD2  1 ? 1 
ATOM   4713  H  H    . ASP   A  1  303 ? 4.752   -0.297  13.851  1.000 18.525  0 358  ASP   A H    1 c 1 
ATOM   4714  H  HA   . ASP   A  1  303 ? 5.149   0.136   11.145  1.000 17.921  0 358  ASP   A HA   1 c 1 
ATOM   4715  H  HB2  . ASP   A  1  303 ? 6.694   -1.608  11.242  1.000 18.095  0 358  ASP   A HB2  1 c 1 
ATOM   4716  H  HB3  . ASP   A  1  303 ? 7.032   -0.467  12.282  1.000 18.254  0 358  ASP   A HB3  1 c 1 
ATOM   4717  N  N    . HIS   A  1  304 ? 3.372   -2.299  12.197  1.000 14.821  0 359  HIS   A N    1 ? 1 
ATOM   4718  C  CA   . HIS   A  1  304 ? 2.365   -3.282  11.821  1.000 17.042  0 359  HIS   A CA   1 ? 1 
ATOM   4719  C  C    . HIS   A  1  304 ? 1.587   -3.704  13.065  1.000 19.686  0 359  HIS   A C    1 ? 1 
ATOM   4720  O  O    . HIS   A  1  304 ? 1.946   -3.313  14.180  1.000 19.244  0 359  HIS   A O    1 ? 1 
ATOM   4721  C  CB   . HIS   A  1  304 ? 3.037   -4.519  11.181  1.000 16.890  0 359  HIS   A CB   1 ? 1 
ATOM   4722  C  CG   . HIS   A  1  304 ? 4.095   -5.097  12.061  1.000 16.734  0 359  HIS   A CG   1 ? 1 
ATOM   4723  N  ND1  . HIS   A  1  304 ? 3.767   -5.818  13.197  1.000 18.250  0 359  HIS   A ND1  1 ? 1 
ATOM   4724  C  CD2  . HIS   A  1  304 ? 5.446   -4.958  11.998  1.000 16.354  0 359  HIS   A CD2  1 ? 1 
ATOM   4725  C  CE1  . HIS   A  1  304 ? 4.931   -6.093  13.798  1.000 18.546  0 359  HIS   A CE1  1 ? 1 
ATOM   4726  N  NE2  . HIS   A  1  304 ? 5.962   -5.631  13.098  1.000 16.912  0 359  HIS   A NE2  1 ? 1 
ATOM   4727  H  H    . HIS   A  1  304 ? 3.525   -2.151  13.086  1.000 16.449  0 359  HIS   A H    1 c 1 
ATOM   4728  H  HA   . HIS   A  1  304 ? 1.750   -2.873  11.168  1.000 16.726  0 359  HIS   A HA   1 c 1 
ATOM   4729  H  HB2  . HIS   A  1  304 ? 2.359   -5.201  11.006  1.000 16.831  0 359  HIS   A HB2  1 c 1 
ATOM   4730  H  HB3  . HIS   A  1  304 ? 3.438   -4.261  10.327  1.000 16.668  0 359  HIS   A HB3  1 c 1 
ATOM   4731  H  HD1  . HIS   A  1  304 ? 2.955   -5.990  13.479  0.000 11.960  0 359  HIS   A HD1  1 c 1 
ATOM   4732  H  HD2  . HIS   A  1  304 ? 5.934   -4.509  11.325  1.000 16.394  0 359  HIS   A HD2  1 c 1 
ATOM   4733  H  HE1  . HIS   A  1  304 ? 5.012   -6.611  14.581  1.000 18.413  0 359  HIS   A HE1  1 c 1 
ATOM   4734  H  HE2  . HIS   A  1  304 ? 6.822   -5.715  13.318  0.000 11.070  0 359  HIS   A HE2  1 c 1 
ATOM   4735  N  N    . GLY   A  1  305 ? 0.602   -4.589  12.869  1.000 15.552  0 360  GLY   A N    1 ? 1 
ATOM   4736  C  CA   . GLY   A  1  305 ? -0.163  -5.149  13.962  1.000 20.132  0 360  GLY   A CA   1 ? 1 
ATOM   4737  C  C    . GLY   A  1  305 ? 0.360   -6.503  14.446  1.000 18.069  0 360  GLY   A C    1 ? 1 
ATOM   4738  O  O    . GLY   A  1  305 ? 1.550   -6.818  14.326  1.000 15.093  0 360  GLY   A O    1 ? 1 
ATOM   4739  H  H    . GLY   A  1  305 ? 0.400   -4.848  12.016  1.000 17.190  0 360  GLY   A H    1 c 1 
ATOM   4740  H  HA2  . GLY   A  1  305 ? -0.156  -4.511  14.719  1.000 18.603  0 360  GLY   A HA2  1 c 1 
ATOM   4741  H  HA3  . GLY   A  1  305 ? -1.101  -5.250  13.668  1.000 18.444  0 360  GLY   A HA3  1 c 1 
ATOM   4742  N  N    . MET   A  1  306 ? -0.574  -7.287  15.008  1.000 19.324  0 361  MET   A N    1 ? 1 
ATOM   4743  C  CA   . MET   A  1  306 ? -0.288  -8.564  15.628  1.000 17.059  0 361  MET   A CA   1 ? 1 
ATOM   4744  C  C    . MET   A  1  306 ? -1.525  -9.462  15.637  1.000 19.516  0 361  MET   A C    1 ? 1 
ATOM   4745  O  O    . MET   A  1  306 ? -2.614  -9.026  16.032  1.000 15.159  0 361  MET   A O    1 ? 1 
ATOM   4746  C  CB   . MET   A  1  306 ? 0.176   -8.317  17.082  1.000 18.050  0 361  MET   A CB   1 ? 1 
ATOM   4747  C  CG   . MET   A  1  306 ? 0.612   -9.616  17.823  1.000 18.116  0 361  MET   A CG   1 ? 1 
ATOM   4748  S  SD   . MET   A  1  306 ? 2.205   -10.270 17.275  1.000 21.151  0 361  MET   A SD   1 ? 1 
ATOM   4749  C  CE   . MET   A  1  306 ? 3.327   -8.964  17.855  1.000 25.519  0 361  MET   A CE   1 ? 1 
ATOM   4750  H  H    . MET   A  1  306 ? -1.442  -6.998  15.003  1.000 18.440  0 361  MET   A H    1 c 1 
ATOM   4751  H  HA   . MET   A  1  306 ? 0.429   -9.008  15.120  1.000 18.009  0 361  MET   A HA   1 c 1 
ATOM   4752  H  HB2  . MET   A  1  306 ? 0.925   -7.690  17.070  1.000 17.749  0 361  MET   A HB2  1 c 1 
ATOM   4753  H  HB3  . MET   A  1  306 ? -0.554  -7.898  17.577  1.000 17.930  0 361  MET   A HB3  1 c 1 
ATOM   4754  H  HG2  . MET   A  1  306 ? 0.666   -9.430  18.785  1.000 19.015  0 361  MET   A HG2  1 c 1 
ATOM   4755  H  HG3  . MET   A  1  306 ? -0.071  -10.307 17.692  1.000 18.879  0 361  MET   A HG3  1 c 1 
ATOM   4756  H  HE1  . MET   A  1  306 ? 3.148   -8.148  17.372  1.000 23.892  0 361  MET   A HE1  1 c 1 
ATOM   4757  H  HE2  . MET   A  1  306 ? 3.189   -8.818  18.798  1.000 24.481  0 361  MET   A HE2  1 c 1 
ATOM   4758  H  HE3  . MET   A  1  306 ? 4.241   -9.235  17.702  1.000 24.339  0 361  MET   A HE3  1 c 1 
ATOM   4759  N  N    . GLU   A  1  307 ? -1.306  -10.731 15.251  1.000 20.359  0 362  GLU   A N    1 ? 1 
ATOM   4760  C  CA   . GLU   A  1  307 ? -2.361  -11.712 15.092  1.000 18.496  0 362  GLU   A CA   1 ? 1 
ATOM   4761  C  C    . GLU   A  1  307 ? -2.103  -12.848 16.066  1.000 19.009  0 362  GLU   A C    1 ? 1 
ATOM   4762  O  O    . GLU   A  1  307 ? -0.964  -13.063 16.472  1.000 21.120  0 362  GLU   A O    1 ? 1 
ATOM   4763  C  CB   . GLU   A  1  307 ? -2.347  -12.187 13.655  1.000 16.477  0 362  GLU   A CB   1 ? 1 
ATOM   4764  C  CG   . GLU   A  1  307 ? -3.324  -13.254 13.281  1.000 21.875  0 362  GLU   A CG   1 ? 1 
ATOM   4765  C  CD   . GLU   A  1  307 ? -4.770  -12.894 13.539  1.000 21.462  0 362  GLU   A CD   1 ? 1 
ATOM   4766  O  OE1  . GLU   A  1  307 ? -5.189  -12.986 14.706  1.000 23.279  0 362  GLU   A OE1  1 ? 1 
ATOM   4767  O  OE2  . GLU   A  1  307 ? -5.466  -12.462 12.598  1.000 24.251  0 362  GLU   A OE2  1 ? 1 
ATOM   4768  H  H    . GLU   A  1  307 ? -0.447  -10.993 15.081  1.000 19.652  0 362  GLU   A H    1 c 1 
ATOM   4769  H  HA   . GLU   A  1  307 ? -3.228  -11.294 15.296  1.000 18.552  0 362  GLU   A HA   1 c 1 
ATOM   4770  H  HB2  . GLU   A  1  307 ? -2.510  -11.411 13.083  1.000 17.615  0 362  GLU   A HB2  1 c 1 
ATOM   4771  H  HB3  . GLU   A  1  307 ? -1.446  -12.512 13.455  1.000 17.921  0 362  GLU   A HB3  1 c 1 
ATOM   4772  H  HG2  . GLU   A  1  307 ? -3.222  -13.457 12.327  1.000 20.171  0 362  GLU   A HG2  1 c 1 
ATOM   4773  H  HG3  . GLU   A  1  307 ? -3.113  -14.071 13.780  1.000 20.703  0 362  GLU   A HG3  1 c 1 
ATOM   4774  N  N    . ASP   A  1  308 ? -3.167  -13.572 16.419  1.000 21.432  0 363  ASP   A N    1 ? 1 
ATOM   4775  C  CA   . ASP   A  1  308 ? -3.054  -14.805 17.178  1.000 24.341  0 363  ASP   A CA   1 ? 1 
ATOM   4776  C  C    . ASP   A  1  308 ? -2.520  -15.942 16.313  1.000 26.577  0 363  ASP   A C    1 ? 1 
ATOM   4777  O  O    . ASP   A  1  308 ? -3.166  -16.351 15.359  1.000 23.469  0 363  ASP   A O    1 ? 1 
ATOM   4778  C  CB   . ASP   A  1  308 ? -4.430  -15.222 17.754  1.000 35.987  0 363  ASP   A CB   1 ? 1 
ATOM   4779  C  CG   . ASP   A  1  308 ? -4.876  -14.365 18.912  1.000 41.380  0 363  ASP   A CG   1 ? 1 
ATOM   4780  O  OD1  . ASP   A  1  308 ? -4.120  -14.293 19.930  1.000 45.636  0 363  ASP   A OD1  1 ? 1 
ATOM   4781  O  OD2  . ASP   A  1  308 ? -5.983  -13.759 18.816  1.000 48.063  0 363  ASP   A OD2  1 ? 1 
ATOM   4782  H  H    . ASP   A  1  308 ? -4.000  -13.280 16.184  1.000 21.408  0 363  ASP   A H    1 c 1 
ATOM   4783  H  HA   . ASP   A  1  308 ? -2.433  -14.655 17.928  1.000 25.964  0 363  ASP   A HA   1 c 1 
ATOM   4784  H  HB2  . ASP   A  1  308 ? -5.105  -15.167 17.047  1.000 33.652  0 363  ASP   A HB2  1 c 1 
ATOM   4785  H  HB3  . ASP   A  1  308 ? -4.382  -16.152 18.059  1.000 34.235  0 363  ASP   A HB3  1 c 1 
ATOM   4786  N  N    . VAL   A  1  309 ? -1.354  -16.469 16.684  1.000 22.443  0 364  VAL   A N    1 ? 1 
ATOM   4787  C  CA   . VAL   A  1  309 ? -0.672  -17.499 15.929  1.000 22.223  0 364  VAL   A CA   1 ? 1 
ATOM   4788  C  C    . VAL   A  1  309 ? 0.023   -18.403 16.950  1.000 31.855  0 364  VAL   A C    1 ? 1 
ATOM   4789  O  O    . VAL   A  1  309 ? 0.848   -17.910 17.721  1.000 28.146  0 364  VAL   A O    1 ? 1 
ATOM   4790  C  CB   . VAL   A  1  309 ? 0.352   -16.870 14.958  1.000 26.101  0 364  VAL   A CB   1 ? 1 
ATOM   4791  C  CG1  . VAL   A  1  309 ? 0.947   -17.932 14.044  1.000 34.907  0 364  VAL   A CG1  1 ? 1 
ATOM   4792  C  CG2  . VAL   A  1  309 ? -0.245  -15.714 14.142  1.000 23.463  0 364  VAL   A CG2  1 ? 1 
ATOM   4793  H  H    . VAL   A  1  309 ? -0.961  -16.165 17.451  1.000 23.480  0 364  VAL   A H    1 c 1 
ATOM   4794  H  HA   . VAL   A  1  309 ? -1.324  -18.019 15.425  1.000 24.562  0 364  VAL   A HA   1 c 1 
ATOM   4795  H  HB   . VAL   A  1  309 ? 1.087   -16.500 15.506  1.000 26.163  0 364  VAL   A HB   1 c 1 
ATOM   4796  H  HG11 . VAL   A  1  309 ? 0.271   -18.229 13.411  1.000 32.151  0 364  VAL   A HG11 1 c 1 
ATOM   4797  H  HG12 . VAL   A  1  309 ? 1.252   -18.688 14.574  1.000 32.702  0 364  VAL   A HG12 1 c 1 
ATOM   4798  H  HG13 . VAL   A  1  309 ? 1.700   -17.554 13.557  1.000 31.817  0 364  VAL   A HG13 1 c 1 
ATOM   4799  H  HG21 . VAL   A  1  309 ? 0.376   -15.462 13.436  1.000 23.743  0 364  VAL   A HG21 1 c 1 
ATOM   4800  H  HG22 . VAL   A  1  309 ? -0.399  -14.949 14.723  1.000 23.895  0 364  VAL   A HG22 1 c 1 
ATOM   4801  H  HG23 . VAL   A  1  309 ? -1.086  -15.995 13.746  1.000 23.978  0 364  VAL   A HG23 1 c 1 
ATOM   4802  N  N    . THR   A  1  310 ? -0.277  -19.711 16.913  1.000 33.973  0 365  THR   A N    1 ? 1 
ATOM   4803  C  CA   . THR   A  1  310 ? 0.315   -20.704 17.804  1.000 40.819  0 365  THR   A CA   1 ? 1 
ATOM   4804  C  C    . THR   A  1  310 ? 0.982   -21.812 16.995  1.000 37.454  0 365  THR   A C    1 ? 1 
ATOM   4805  O  O    . THR   A  1  310 ? 0.626   -22.030 15.843  1.000 31.115  0 365  THR   A O    1 ? 1 
ATOM   4806  C  CB   . THR   A  1  310 ? -0.749  -21.355 18.727  1.000 38.798  0 365  THR   A CB   1 ? 1 
ATOM   4807  O  OG1  . THR   A  1  310 ? -1.670  -22.011 17.886  1.000 37.710  0 365  THR   A OG1  1 ? 1 
ATOM   4808  C  CG2  . THR   A  1  310 ? -1.473  -20.361 19.585  1.000 43.909  0 365  THR   A CG2  1 ? 1 
ATOM   4809  H  H    . THR   A  1  310 ? -0.886  -19.999 16.296  1.000 34.553  0 365  THR   A H    1 c 1 
ATOM   4810  H  HA   . THR   A  1  310 ? 0.996   -20.263 18.362  1.000 38.284  0 365  THR   A HA   1 c 1 
ATOM   4811  H  HB   . THR   A  1  310 ? -0.303  -22.020 19.304  1.000 40.449  0 365  THR   A HB   1 c 1 
ATOM   4812  H  HG1  . THR   A  1  310 ? -2.029  -21.443 17.347  0.000 25.880  0 365  THR   A HG1  1 c 1 
ATOM   4813  H  HG21 . THR   A  1  310 ? -2.106  -20.827 20.160  1.000 42.692  0 365  THR   A HG21 1 c 1 
ATOM   4814  H  HG22 . THR   A  1  310 ? -1.955  -19.731 19.019  1.000 41.749  0 365  THR   A HG22 1 c 1 
ATOM   4815  H  HG23 . THR   A  1  310 ? -0.832  -19.877 20.135  1.000 42.214  0 365  THR   A HG23 1 c 1 
ATOM   4816  N  N    . CYS   A  1  311 ? 1.911   -22.545 17.625  1.000 37.870  0 366  CYS   A N    1 ? 1 
ATOM   4817  C  CA   . CYS   A  1  311 ? 2.754   -23.497 16.915  1.000 38.079  0 366  CYS   A CA   1 ? 1 
ATOM   4818  C  C    . CYS   A  1  311 ? 1.936   -24.682 16.398  1.000 36.312  0 366  CYS   A C    1 ? 1 
ATOM   4819  O  O    . CYS   A  1  311 ? 2.310   -25.304 15.398  1.000 34.848  0 366  CYS   A O    1 ? 1 
ATOM   4820  C  CB   . CYS   A  1  311 ? 3.956   -23.943 17.767  1.000 44.616  0 366  CYS   A CB   1 ? 1 
ATOM   4821  S  SG   . CYS   A  1  311 ? 3.501   -24.728 19.325  1.000 63.594  0 366  CYS   A SG   1 ? 1 
ATOM   4822  H  H    . CYS   A  1  311 ? 2.021   -22.448 18.527  1.000 38.218  0 366  CYS   A H    1 c 1 
ATOM   4823  H  HA   . CYS   A  1  311 ? 3.116   -23.025 16.129  1.000 38.176  0 366  CYS   A HA   1 c 1 
ATOM   4824  H  HB2  . CYS   A  1  311 ? 4.497   -24.574 17.250  1.000 46.082  0 366  CYS   A HB2  1 c 1 
ATOM   4825  H  HB3  . CYS   A  1  311 ? 4.513   -23.163 17.965  1.000 45.598  0 366  CYS   A HB3  1 c 1 
ATOM   4826  N  N    . ASP   A  1  312 ? 0.780   -24.960 17.016  1.000 31.164  0 367  ASP   A N    1 ? 1 
ATOM   4827  C  CA   . ASP   A  1  312 ? -0.080  -26.016 16.505  1.000 31.400  0 367  ASP   A CA   1 ? 1 
ATOM   4828  C  C    . ASP   A  1  312 ? -0.724  -25.657 15.166  1.000 29.496  0 367  ASP   A C    1 ? 1 
ATOM   4829  O  O    . ASP   A  1  312 ? -1.082  -26.553 14.413  1.000 28.112  0 367  ASP   A O    1 ? 1 
ATOM   4830  C  CB   . ASP   A  1  312 ? -1.127  -26.460 17.543  1.000 51.902  0 367  ASP   A CB   1 ? 1 
ATOM   4831  C  CG   . ASP   A  1  312 ? -2.343  -25.585 17.681  1.000 54.840  0 367  ASP   A CG   1 ? 1 
ATOM   4832  O  OD1  . ASP   A  1  312 ? -2.180  -24.413 18.041  1.000 77.178  0 367  ASP   A OD1  1 ? 1 
ATOM   4833  O  OD2  . ASP   A  1  312 ? -3.474  -26.092 17.452  1.000 72.584  0 367  ASP   A OD2  1 ? 1 
ATOM   4834  H  H    . ASP   A  1  312 ? 0.531   -24.502 17.767  1.000 32.516  0 367  ASP   A H    1 c 1 
ATOM   4835  H  HA   . ASP   A  1  312 ? 0.496   -26.800 16.346  1.000 34.360  0 367  ASP   A HA   1 c 1 
ATOM   4836  H  HB2  . ASP   A  1  312 ? -1.431  -27.361 17.310  1.000 47.015  0 367  ASP   A HB2  1 c 1 
ATOM   4837  H  HB3  . ASP   A  1  312 ? -0.693  -26.508 18.419  1.000 46.813  0 367  ASP   A HB3  1 c 1 
ATOM   4838  N  N    . ARG   A  1  313 ? -0.839  -24.362 14.846  1.000 24.249  0 368  ARG   A N    1 ? 1 
ATOM   4839  C  CA   . ARG   A  1  313 ? -1.337  -23.961 13.538  1.000 26.017  0 368  ARG   A CA   1 ? 1 
ATOM   4840  C  C    . ARG   A  1  313 ? -0.171  -23.775 12.572  1.000 28.034  0 368  ARG   A C    1 ? 1 
ATOM   4841  O  O    . ARG   A  1  313 ? 0.105   -22.669 12.107  1.000 21.749  0 368  ARG   A O    1 ? 1 
ATOM   4842  C  CB   . ARG   A  1  313 ? -2.230  -22.691 13.649  1.000 22.924  0 368  ARG   A CB   1 ? 1 
ATOM   4843  C  CG   . ARG   A  1  313 ? -3.555  -22.996 14.409  1.000 23.654  0 368  ARG   A CG   1 ? 1 
ATOM   4844  C  CD   . ARG   A  1  313 ? -4.547  -21.844 14.341  1.000 23.068  0 368  ARG   A CD   1 ? 1 
ATOM   4845  N  NE   . ARG   A  1  313 ? -3.995  -20.609 14.898  1.000 23.330  0 368  ARG   A NE   1 ? 1 
ATOM   4846  C  CZ   . ARG   A  1  313 ? -4.281  -20.135 16.102  1.000 22.286  0 368  ARG   A CZ   1 ? 1 
ATOM   4847  N  NH1  . ARG   A  1  313 ? -4.952  -20.852 16.971  1.000 21.193  0 368  ARG   A NH1  1 ? 1 
ATOM   4848  N  NH2  . ARG   A  1  313 ? -3.863  -18.921 16.451  1.000 25.086  0 368  ARG   A NH2  1 ? 1 
ATOM   4849  H  H    . ARG   A  1  313 ? -0.615  -23.717 15.453  1.000 25.718  0 368  ARG   A H    1 c 1 
ATOM   4850  H  HA   . ARG   A  1  313 ? -1.899  -24.692 13.194  1.000 25.741  0 368  ARG   A HA   1 c 1 
ATOM   4851  H  HB2  . ARG   A  1  313 ? -1.739  -21.996 14.131  1.000 23.560  0 368  ARG   A HB2  1 c 1 
ATOM   4852  H  HB3  . ARG   A  1  313 ? -2.438  -22.360 12.752  1.000 23.179  0 368  ARG   A HB3  1 c 1 
ATOM   4853  H  HG2  . ARG   A  1  313 ? -3.971  -23.796 14.025  1.000 23.869  0 368  ARG   A HG2  1 c 1 
ATOM   4854  H  HG3  . ARG   A  1  313 ? -3.352  -23.185 15.350  1.000 23.920  0 368  ARG   A HG3  1 c 1 
ATOM   4855  H  HD2  . ARG   A  1  313 ? -4.797  -21.690 13.405  1.000 22.938  0 368  ARG   A HD2  1 c 1 
ATOM   4856  H  HD3  . ARG   A  1  313 ? -5.360  -22.088 14.832  1.000 23.561  0 368  ARG   A HD3  1 c 1 
ATOM   4857  H  HE   . ARG   A  1  313 ? -3.438  -20.153 14.405  1.000 22.500  0 368  ARG   A HE   1 c 1 
ATOM   4858  H  HH11 . ARG   A  1  313 ? -4.722  -21.690 17.120  1.000 22.175  0 368  ARG   A HH11 1 c 1 
ATOM   4859  H  HH12 . ARG   A  1  313 ? -5.627  -20.493 17.407  1.000 21.992  0 368  ARG   A HH12 1 c 1 
ATOM   4860  H  HH21 . ARG   A  1  313 ? -3.635  -18.759 17.286  1.000 24.161  0 368  ARG   A HH21 1 c 1 
ATOM   4861  H  HH22 . ARG   A  1  313 ? -3.819  -18.286 15.845  1.000 23.562  0 368  ARG   A HH22 1 c 1 
ATOM   4862  N  N    . THR   A  1  314 ? 0.510   -24.887 12.273  1.000 25.680  0 369  THR   A N    1 ? 1 
ATOM   4863  C  CA   . THR   A  1  314 ? 1.606   -24.889 11.319  1.000 27.615  0 369  THR   A CA   1 ? 1 
ATOM   4864  C  C    . THR   A  1  314 ? 1.343   -25.886 10.196  1.000 23.688  0 369  THR   A C    1 ? 1 
ATOM   4865  O  O    . THR   A  1  314 ? 1.113   -27.052 10.471  1.000 25.990  0 369  THR   A O    1 ? 1 
ATOM   4866  C  CB   . THR   A  1  314 ? 2.938   -25.258 11.989  1.000 26.895  0 369  THR   A CB   1 ? 1 
ATOM   4867  O  OG1  . THR   A  1  314 ? 3.146   -24.459 13.131  1.000 24.711  0 369  THR   A OG1  1 ? 1 
ATOM   4868  C  CG2  . THR   A  1  314 ? 4.107   -25.056 11.067  1.000 26.089  0 369  THR   A CG2  1 ? 1 
ATOM   4869  H  H    . THR   A  1  314 ? 0.277   -25.675 12.672  1.000 27.298  0 369  THR   A H    1 c 1 
ATOM   4870  H  HA   . THR   A  1  314 ? 1.687   -23.989 10.933  1.000 25.538  0 369  THR   A HA   1 c 1 
ATOM   4871  H  HB   . THR   A  1  314 ? 2.902   -26.207 12.261  1.000 27.103  0 369  THR   A HB   1 c 1 
ATOM   4872  H  HG1  . THR   A  1  314 ? 3.161   -23.645 12.904  0.000 12.220  0 369  THR   A HG1  1 c 1 
ATOM   4873  H  HG21 . THR   A  1  314 ? 4.937   -25.172 11.564  1.000 26.535  0 369  THR   A HG21 1 c 1 
ATOM   4874  H  HG22 . THR   A  1  314 ? 4.077   -24.156 10.696  1.000 25.718  0 369  THR   A HG22 1 c 1 
ATOM   4875  H  HG23 . THR   A  1  314 ? 4.071   -25.706 10.343  1.000 26.435  0 369  THR   A HG23 1 c 1 
ATOM   4876  N  N    . GLU   A  1  315 ? 1.352   -25.410 8.952   1.000 23.297  0 370  GLU   A N    1 ? 1 
ATOM   4877  C  CA   . GLU   A  1  315 ? 1.411   -26.260 7.775   1.000 27.888  0 370  GLU   A CA   1 ? 1 
ATOM   4878  C  C    . GLU   A  1  315 ? 2.860   -26.642 7.457   1.000 29.353  0 370  GLU   A C    1 ? 1 
ATOM   4879  O  O    . GLU   A  1  315 ? 3.754   -25.803 7.533   1.000 29.490  0 370  GLU   A O    1 ? 1 
ATOM   4880  C  CB   . GLU   A  1  315 ? 0.796   -25.485 6.578   1.000 27.900  0 370  GLU   A CB   1 ? 1 
ATOM   4881  C  CG   . GLU   A  1  315 ? -0.711  -25.331 6.644   1.000 24.735  0 370  GLU   A CG   1 ? 1 
ATOM   4882  C  CD   . GLU   A  1  315 ? -1.541  -26.416 5.978   1.000 26.549  0 370  GLU   A CD   1 ? 1 
ATOM   4883  O  OE1  . GLU   A  1  315 ? -0.974  -27.460 5.590   1.000 29.333  0 370  GLU   A OE1  1 ? 1 
ATOM   4884  O  OE2  . GLU   A  1  315 ? -2.775  -26.217 5.851   1.000 29.931  0 370  GLU   A OE2  1 ? 1 
ATOM   4885  H  H    . GLU   A  1  315 ? 1.318   -24.505 8.830   1.000 23.739  0 370  GLU   A H    1 c 1 
ATOM   4886  H  HA   . GLU   A  1  315 ? 0.885   -27.075 7.942   1.000 27.656  0 370  GLU   A HA   1 c 1 
ATOM   4887  H  HB2  . GLU   A  1  315 ? 1.203   -24.594 6.542   1.000 26.542  0 370  GLU   A HB2  1 c 1 
ATOM   4888  H  HB3  . GLU   A  1  315 ? 1.032   -25.953 5.750   1.000 27.146  0 370  GLU   A HB3  1 c 1 
ATOM   4889  H  HG2  . GLU   A  1  315 ? -0.977  -25.285 7.587   1.000 25.815  0 370  GLU   A HG2  1 c 1 
ATOM   4890  H  HG3  . GLU   A  1  315 ? -0.952  -24.473 6.235   1.000 25.198  0 370  GLU   A HG3  1 c 1 
ATOM   4891  N  N    . PHE   A  1  316 ? 3.062   -27.901 7.058   1.000 25.779  0 371  PHE   A N    1 ? 1 
ATOM   4892  C  CA   . PHE   A  1  316 ? 4.362   -28.446 6.710   1.000 22.965  0 371  PHE   A CA   1 ? 1 
ATOM   4893  C  C    . PHE   A  1  316 ? 4.406   -28.839 5.243   1.000 25.116  0 371  PHE   A C    1 ? 1 
ATOM   4894  O  O    . PHE   A  1  316 ? 3.590   -29.642 4.787   1.000 24.774  0 371  PHE   A O    1 ? 1 
ATOM   4895  C  CB   . PHE   A  1  316 ? 4.680   -29.673 7.581   1.000 23.924  0 371  PHE   A CB   1 ? 1 
ATOM   4896  C  CG   . PHE   A  1  316 ? 4.855   -29.302 9.030   1.000 27.720  0 371  PHE   A CG   1 ? 1 
ATOM   4897  C  CD1  . PHE   A  1  316 ? 6.016   -28.683 9.469   1.000 33.468  0 371  PHE   A CD1  1 ? 1 
ATOM   4898  C  CD2  . PHE   A  1  316 ? 3.828   -29.502 9.946   1.000 38.858  0 371  PHE   A CD2  1 ? 1 
ATOM   4899  C  CE1  . PHE   A  1  316 ? 6.154   -28.305 10.811  1.000 31.868  0 371  PHE   A CE1  1 ? 1 
ATOM   4900  C  CE2  . PHE   A  1  316 ? 3.975   -29.129 11.279  1.000 34.056  0 371  PHE   A CE2  1 ? 1 
ATOM   4901  C  CZ   . PHE   A  1  316 ? 5.127   -28.520 11.699  1.000 32.160  0 371  PHE   A CZ   1 ? 1 
ATOM   4902  H  H    . PHE   A  1  316 ? 2.338   -28.456 6.999   1.000 26.090  0 371  PHE   A H    1 c 1 
ATOM   4903  H  HA   . PHE   A  1  316 ? 5.051   -27.757 6.875   1.000 23.704  0 371  PHE   A HA   1 c 1 
ATOM   4904  H  HB2  . PHE   A  1  316 ? 3.949   -30.320 7.497   1.000 25.102  0 371  PHE   A HB2  1 c 1 
ATOM   4905  H  HB3  . PHE   A  1  316 ? 5.501   -30.093 7.251   1.000 25.066  0 371  PHE   A HB3  1 c 1 
ATOM   4906  H  HD1  . PHE   A  1  316 ? 6.718   -28.521 8.860   1.000 31.445  0 371  PHE   A HD1  1 c 1 
ATOM   4907  H  HD2  . PHE   A  1  316 ? 3.026   -29.910 9.662   1.000 34.489  0 371  PHE   A HD2  1 c 1 
ATOM   4908  H  HE1  . PHE   A  1  316 ? 6.952   -27.895 11.104  1.000 32.211  0 371  PHE   A HE1  1 c 1 
ATOM   4909  H  HE2  . PHE   A  1  316 ? 3.272   -29.282 11.890  1.000 34.695  0 371  PHE   A HE2  1 c 1 
ATOM   4910  H  HZ   . PHE   A  1  316 ? 5.229   -28.279 12.606  1.000 32.632  0 371  PHE   A HZ   1 c 1 
ATOM   4911  N  N    . LEU   A  1  317 ? 5.380   -28.290 4.520   1.000 24.136  0 372  LEU   A N    1 ? 1 
ATOM   4912  C  CA   . LEU   A  1  317 ? 5.609   -28.618 3.119   1.000 25.867  0 372  LEU   A CA   1 ? 1 
ATOM   4913  C  C    . LEU   A  1  317 ? 5.884   -30.104 2.907   1.000 29.069  0 372  LEU   A C    1 ? 1 
ATOM   4914  O  O    . LEU   A  1  317 ? 5.569   -30.651 1.864   1.000 29.289  0 372  LEU   A O    1 ? 1 
ATOM   4915  C  CB   . LEU   A  1  317 ? 6.816   -27.809 2.594   1.000 23.455  0 372  LEU   A CB   1 ? 1 
ATOM   4916  C  CG   . LEU   A  1  317 ? 6.615   -26.330 2.571   1.000 26.073  0 372  LEU   A CG   1 ? 1 
ATOM   4917  C  CD1  . LEU   A  1  317 ? 7.817   -25.668 1.983   1.000 27.090  0 372  LEU   A CD1  1 ? 1 
ATOM   4918  C  CD2  . LEU   A  1  317 ? 5.354   -25.942 1.816   1.000 33.949  0 372  LEU   A CD2  1 ? 1 
ATOM   4919  H  H    . LEU   A  1  317 ? 5.937   -27.687 4.921   1.000 24.460  0 372  LEU   A H    1 c 1 
ATOM   4920  H  HA   . LEU   A  1  317 ? 4.803   -28.375 2.609   1.000 25.272  0 372  LEU   A HA   1 c 1 
ATOM   4921  H  HB2  . LEU   A  1  317 ? 7.591   -28.010 3.156   1.000 24.981  0 372  LEU   A HB2  1 c 1 
ATOM   4922  H  HB3  . LEU   A  1  317 ? 7.021   -28.111 1.687   1.000 24.844  0 372  LEU   A HB3  1 c 1 
ATOM   4923  H  HG   . LEU   A  1  317 ? 6.521   -26.017 3.503   1.000 26.595  0 372  LEU   A HG   1 c 1 
ATOM   4924  H  HD11 . LEU   A  1  317 ? 7.713   -24.702 2.035   1.000 26.301  0 372  LEU   A HD11 1 c 1 
ATOM   4925  H  HD12 . LEU   A  1  317 ? 7.911   -25.934 1.052   1.000 26.879  0 372  LEU   A HD12 1 c 1 
ATOM   4926  H  HD13 . LEU   A  1  317 ? 8.610   -25.935 2.479   1.000 27.166  0 372  LEU   A HD13 1 c 1 
ATOM   4927  H  HD21 . LEU   A  1  317 ? 4.575   -26.113 2.374   1.000 30.912  0 372  LEU   A HD21 1 c 1 
ATOM   4928  H  HD22 . LEU   A  1  317 ? 5.289   -26.468 1.000   1.000 31.124  0 372  LEU   A HD22 1 c 1 
ATOM   4929  H  HD23 . LEU   A  1  317 ? 5.389   -24.996 1.591   1.000 30.444  0 372  LEU   A HD23 1 c 1 
ATOM   4930  N  N    . SER   A  1  318 ? 6.478   -30.748 3.915   1.000 28.636  0 373  SER   A N    1 ? 1 
ATOM   4931  C  CA   . SER   A  1  318 ? 6.710   -32.175 3.878   1.000 27.012  0 373  SER   A CA   1 ? 1 
ATOM   4932  C  C    . SER   A  1  318 ? 5.441   -33.003 3.739   1.000 26.218  0 373  SER   A C    1 ? 1 
ATOM   4933  O  O    . SER   A  1  318 ? 5.538   -34.159 3.387   1.000 37.836  0 373  SER   A O    1 ? 1 
ATOM   4934  C  CB   . SER   A  1  318 ? 7.475   -32.636 5.120   1.000 29.280  0 373  SER   A CB   1 ? 1 
ATOM   4935  O  OG   . SER   A  1  318 ? 6.834   -32.224 6.315   1.000 34.265  0 373  SER   A OG   1 ? 1 
ATOM   4936  H  H    . SER   A  1  318 ? 6.761   -30.276 4.645   1.000 28.035  0 373  SER   A H    1 c 1 
ATOM   4937  H  HA   . SER   A  1  318 ? 7.279   -32.363 3.084   1.000 27.727  0 373  SER   A HA   1 c 1 
ATOM   4938  H  HB2  . SER   A  1  318 ? 7.548   -33.617 5.111   1.000 30.650  0 373  SER   A HB2  1 c 1 
ATOM   4939  H  HB3  . SER   A  1  318 ? 8.385   -32.264 5.095   1.000 29.921  0 373  SER   A HB3  1 c 1 
ATOM   4940  H  HG   . SER   A  1  318 ? 6.284   -32.825 6.557   0.000 17.120  0 373  SER   A HG   1 c 1 
ATOM   4941  N  N    . ASN   A  1  319 ? 4.271   -32.440 4.042   1.000 26.591  0 374  ASN   A N    1 ? 1 
ATOM   4942  C  CA   . ASN   A  1  319 ? 3.025   -33.157 3.830   1.000 29.013  0 374  ASN   A CA   1 ? 1 
ATOM   4943  C  C    . ASN   A  1  319 ? 2.511   -33.070 2.399   1.000 27.832  0 374  ASN   A C    1 ? 1 
ATOM   4944  O  O    . ASN   A  1  319 ? 1.495   -33.687 2.103   1.000 28.981  0 374  ASN   A O    1 ? 1 
ATOM   4945  C  CB   . ASN   A  1  319 ? 1.897   -32.608 4.717   1.000 30.280  0 374  ASN   A CB   1 ? 1 
ATOM   4946  C  CG   . ASN   A  1  319 ? 2.158   -32.766 6.193   1.000 31.661  0 374  ASN   A CG   1 ? 1 
ATOM   4947  O  OD1  . ASN   A  1  319 ? 2.713   -33.743 6.634   1.000 36.427  0 374  ASN   A OD1  1 ? 1 
ATOM   4948  N  ND2  . ASN   A  1  319 ? 1.786   -31.780 6.955   1.000 33.292  0 374  ASN   A ND2  1 ? 1 
ATOM   4949  H  H    . ASN   A  1  319 ? 4.244   -31.603 4.407   1.000 26.369  0 374  ASN   A H    1 c 1 
ATOM   4950  H  HA   . ASN   A  1  319 ? 3.161   -34.105 4.063   1.000 29.407  0 374  ASN   A HA   1 c 1 
ATOM   4951  H  HB2  . ASN   A  1  319 ? 1.774   -31.659 4.514   1.000 29.492  0 374  ASN   A HB2  1 c 1 
ATOM   4952  H  HB3  . ASN   A  1  319 ? 1.065   -33.073 4.494   1.000 30.316  0 374  ASN   A HB3  1 c 1 
ATOM   4953  H  HD21 . ASN   A  1  319 ? 1.253   -31.149 6.637   1.000 32.058  0 374  ASN   A HD21 1 c 1 
ATOM   4954  H  HD22 . ASN   A  1  319 ? 2.063   -31.741 7.794   1.000 32.742  0 374  ASN   A HD22 1 c 1 
ATOM   4955  N  N    . TYR   A  1  320 ? 3.166   -32.245 1.566   1.000 31.593  0 375  TYR   A N    1 ? 1 
ATOM   4956  C  CA   . TYR   A  1  320 ? 2.731   -31.966 0.202   1.000 27.495  0 375  TYR   A CA   1 ? 1 
ATOM   4957  C  C    . TYR   A  1  320 ? 3.771   -32.432 -0.809  1.000 26.949  0 375  TYR   A C    1 ? 1 
ATOM   4958  O  O    . TYR   A  1  320 ? 3.439   -32.925 -1.887  1.000 30.584  0 375  TYR   A O    1 ? 1 
ATOM   4959  C  CB   . TYR   A  1  320 ? 2.508   -30.461 0.006   1.000 26.477  0 375  TYR   A CB   1 ? 1 
ATOM   4960  C  CG   . TYR   A  1  320 ? 1.415   -29.886 0.874   1.000 26.478  0 375  TYR   A CG   1 ? 1 
ATOM   4961  C  CD1  . TYR   A  1  320 ? 1.650   -29.568 2.211   1.000 25.046  0 375  TYR   A CD1  1 ? 1 
ATOM   4962  C  CD2  . TYR   A  1  320 ? 0.148   -29.650 0.362   1.000 31.927  0 375  TYR   A CD2  1 ? 1 
ATOM   4963  C  CE1  . TYR   A  1  320 ? 0.640   -29.065 3.023   1.000 25.657  0 375  TYR   A CE1  1 ? 1 
ATOM   4964  C  CE2  . TYR   A  1  320 ? -0.864  -29.117 1.152   1.000 32.621  0 375  TYR   A CE2  1 ? 1 
ATOM   4965  C  CZ   . TYR   A  1  320 ? -0.630  -28.843 2.485   1.000 29.863  0 375  TYR   A CZ   1 ? 1 
ATOM   4966  O  OH   . TYR   A  1  320 ? -1.680  -28.334 3.237   1.000 26.089  0 375  TYR   A OH   1 ? 1 
ATOM   4967  H  H    . TYR   A  1  320 ? 3.905   -31.808 1.877   1.000 29.311  0 375  TYR   A H    1 c 1 
ATOM   4968  H  HA   . TYR   A  1  320 ? 1.880   -32.443 0.027   1.000 28.162  0 375  TYR   A HA   1 c 1 
ATOM   4969  H  HB2  . TYR   A  1  320 ? 3.347   -29.995 0.201   1.000 26.417  0 375  TYR   A HB2  1 c 1 
ATOM   4970  H  HB3  . TYR   A  1  320 ? 2.285   -30.299 -0.935  1.000 26.473  0 375  TYR   A HB3  1 c 1 
ATOM   4971  H  HD1  . TYR   A  1  320 ? 2.500   -29.735 2.581   1.000 25.850  0 375  TYR   A HD1  1 c 1 
ATOM   4972  H  HD2  . TYR   A  1  320 ? -0.029  -29.848 -0.543  1.000 30.536  0 375  TYR   A HD2  1 c 1 
ATOM   4973  H  HE1  . TYR   A  1  320 ? 0.812   -28.866 3.928   1.000 26.381  0 375  TYR   A HE1  1 c 1 
ATOM   4974  H  HE2  . TYR   A  1  320 ? -1.724  -28.981 0.788   1.000 31.418  0 375  TYR   A HE2  1 c 1 
ATOM   4975  H  HH   . TYR   A  1  320 ? -1.558  -28.127 4.063   0.000 13.300  0 375  TYR   A HH   1 c 1 
ATOM   4976  N  N    . LEU   A  1  321 ? 5.035   -32.244 -0.429  1.000 27.611  0 376  LEU   A N    1 ? 1 
ATOM   4977  C  CA   . LEU   A  1  321 ? 6.169   -32.416 -1.309  1.000 28.668  0 376  LEU   A CA   1 ? 1 
ATOM   4978  C  C    . LEU   A  1  321 ? 6.993   -33.585 -0.797  1.000 33.558  0 376  LEU   A C    1 ? 1 
ATOM   4979  O  O    . LEU   A  1  321 ? 7.196   -33.714 0.405   1.000 34.775  0 376  LEU   A O    1 ? 1 
ATOM   4980  C  CB   . LEU   A  1  321 ? 7.039   -31.150 -1.272  1.000 32.569  0 376  LEU   A CB   1 ? 1 
ATOM   4981  C  CG   . LEU   A  1  321 ? 6.402   -29.859 -1.702  1.000 32.502  0 376  LEU   A CG   1 ? 1 
ATOM   4982  C  CD1  . LEU   A  1  321 ? 7.334   -28.738 -1.475  1.000 30.636  0 376  LEU   A CD1  1 ? 1 
ATOM   4983  C  CD2  . LEU   A  1  321 ? 5.982   -29.924 -3.144  1.000 40.910  0 376  LEU   A CD2  1 ? 1 
ATOM   4984  H  H    . LEU   A  1  321 ? 5.201   -31.987 0.431   1.000 27.590  0 376  LEU   A H    1 c 1 
ATOM   4985  H  HA   . LEU   A  1  321 ? 5.858   -32.598 -2.225  1.000 30.065  0 376  LEU   A HA   1 c 1 
ATOM   4986  H  HB2  . LEU   A  1  321 ? 7.365   -31.038 -0.357  1.000 31.633  0 376  LEU   A HB2  1 c 1 
ATOM   4987  H  HB3  . LEU   A  1  321 ? 7.820   -31.306 -1.840  1.000 31.877  0 376  LEU   A HB3  1 c 1 
ATOM   4988  H  HG   . LEU   A  1  321 ? 5.596   -29.710 -1.150  1.000 33.122  0 376  LEU   A HG   1 c 1 
ATOM   4989  H  HD11 . LEU   A  1  321 ? 6.866   -27.895 -1.612  1.000 30.483  0 376  LEU   A HD11 1 c 1 
ATOM   4990  H  HD12 . LEU   A  1  321 ? 8.076   -28.800 -2.101  1.000 31.301  0 376  LEU   A HD12 1 c 1 
ATOM   4991  H  HD13 . LEU   A  1  321 ? 7.674   -28.775 -0.565  1.000 31.162  0 376  LEU   A HD13 1 c 1 
ATOM   4992  H  HD21 . LEU   A  1  321 ? 5.269   -30.578 -3.247  1.000 38.076  0 376  LEU   A HD21 1 c 1 
ATOM   4993  H  HD22 . LEU   A  1  321 ? 6.743   -30.186 -3.693  1.000 38.308  0 376  LEU   A HD22 1 c 1 
ATOM   4994  H  HD23 . LEU   A  1  321 ? 5.663   -29.050 -3.429  1.000 37.383  0 376  LEU   A HD23 1 c 1 
ATOM   4995  N  N    . THR   A  1  322 ? 7.457   -34.417 -1.723  1.000 33.428  0 377  THR   A N    1 ? 1 
ATOM   4996  C  CA   . THR   A  1  322 ? 8.506   -35.371 -1.433  1.000 38.876  0 377  THR   A CA   1 ? 1 
ATOM   4997  C  C    . THR   A  1  322 ? 9.819   -34.639 -1.692  1.000 51.232  0 377  THR   A C    1 ? 1 
ATOM   4998  O  O    . THR   A  1  322 ? 9.851   -33.644 -2.426  1.000 41.729  0 377  THR   A O    1 ? 1 
ATOM   4999  C  CB   . THR   A  1  322 ? 8.286   -36.599 -2.275  1.000 47.234  0 377  THR   A CB   1 ? 1 
ATOM   5000  O  OG1  . THR   A  1  322 ? 8.448   -36.236 -3.638  1.000 41.507  0 377  THR   A OG1  1 ? 1 
ATOM   5001  C  CG2  . THR   A  1  322 ? 6.882   -37.209 -2.064  1.000 53.779  0 377  THR   A CG2  1 ? 1 
ATOM   5002  H  H    . THR   A  1  322 ? 7.108   -34.389 -2.568  1.000 34.608  0 377  THR   A H    1 c 1 
ATOM   5003  H  HA   . THR   A  1  322 ? 8.455   -35.619 -0.481  1.000 41.128  0 377  THR   A HA   1 c 1 
ATOM   5004  H  HB   . THR   A  1  322 ? 8.969   -37.270 -2.036  1.000 46.179  0 377  THR   A HB   1 c 1 
ATOM   5005  H  HG1  . THR   A  1  322 ? 7.885   -35.639 -3.846  0.000 21.620  0 377  THR   A HG1  1 c 1 
ATOM   5006  H  HG21 . THR   A  1  322 ? 6.820   -38.054 -2.544  1.000 52.317  0 377  THR   A HG21 1 c 1 
ATOM   5007  H  HG22 . THR   A  1  322 ? 6.205   -36.596 -2.400  1.000 50.893  0 377  THR   A HG22 1 c 1 
ATOM   5008  H  HG23 . THR   A  1  322 ? 6.735   -37.366 -1.114  1.000 51.806  0 377  THR   A HG23 1 c 1 
ATOM   5009  N  N    . ASN   A  1  323 ? 10.895  -35.144 -1.080  1.000 43.068  0 378  ASN   A N    1 ? 1 
ATOM   5010  C  CA   . ASN   A  1  323 ? 12.221  -34.558 -1.210  1.000 50.810  0 378  ASN   A CA   1 ? 1 
ATOM   5011  C  C    . ASN   A  1  323 ? 12.201  -33.078 -0.851  1.000 39.294  0 378  ASN   A C    1 ? 1 
ATOM   5012  O  O    . ASN   A  1  323 ? 12.752  -32.253 -1.562  1.000 44.309  0 378  ASN   A O    1 ? 1 
ATOM   5013  C  CB   . ASN   A  1  323 ? 12.816  -34.752 -2.623  1.000 42.912  0 378  ASN   A CB   1 ? 1 
ATOM   5014  C  CG   . ASN   A  1  323 ? 13.059  -36.203 -2.959  1.000 46.125  0 378  ASN   A CG   1 ? 1 
ATOM   5015  O  OD1  . ASN   A  1  323 ? 12.474  -36.777 -3.890  1.000 51.962  0 378  ASN   A OD1  1 ? 1 
ATOM   5016  N  ND2  . ASN   A  1  323 ? 13.936  -36.829 -2.219  1.000 51.118  0 378  ASN   A ND2  1 ? 1 
ATOM   5017  H  H    . ASN   A  1  323 ? 10.797  -35.888 -0.558  1.000 47.036  0 378  ASN   A H    1 c 1 
ATOM   5018  H  HA   . ASN   A  1  323 ? 12.818  -35.020 -0.575  1.000 46.071  0 378  ASN   A HA   1 c 1 
ATOM   5019  H  HB2  . ASN   A  1  323 ? 12.203  -34.368 -3.283  1.000 44.622  0 378  ASN   A HB2  1 c 1 
ATOM   5020  H  HB3  . ASN   A  1  323 ? 13.665  -34.268 -2.679  1.000 45.062  0 378  ASN   A HB3  1 c 1 
ATOM   5021  H  HD21 . ASN   A  1  323 ? 14.456  -36.373 -1.668  1.000 49.562  0 378  ASN   A HD21 1 c 1 
ATOM   5022  H  HD22 . ASN   A  1  323 ? 14.011  -37.708 -2.270  1.000 50.446  0 378  ASN   A HD22 1 c 1 
ATOM   5023  N  N    . VAL   A  1  324 ? 11.621  -32.779 0.307   1.000 44.996  0 379  VAL   A N    1 ? 1 
ATOM   5024  C  CA   . VAL   A  1  324 ? 11.558  -31.426 0.824   1.000 37.675  0 379  VAL   A CA   1 ? 1 
ATOM   5025  C  C    . VAL   A  1  324 ? 12.953  -30.895 1.146   1.000 36.049  0 379  VAL   A C    1 ? 1 
ATOM   5026  O  O    . VAL   A  1  324 ? 13.108  -29.716 1.439   1.000 41.544  0 379  VAL   A O    1 ? 1 
ATOM   5027  C  CB   . VAL   A  1  324 ? 10.635  -31.457 2.057   1.000 37.174  0 379  VAL   A CB   1 ? 1 
ATOM   5028  C  CG1  . VAL   A  1  324 ? 11.367  -31.931 3.316   1.000 44.580  0 379  VAL   A CG1  1 ? 1 
ATOM   5029  C  CG2  . VAL   A  1  324 ? 9.997   -30.152 2.293   1.000 42.263  0 379  VAL   A CG2  1 ? 1 
ATOM   5030  H  H    . VAL   A  1  324 ? 11.258  -33.454 0.804   1.000 42.260  0 379  VAL   A H    1 c 1 
ATOM   5031  H  HA   . VAL   A  1  324 ? 11.156  -30.855 0.145   1.000 37.938  0 379  VAL   A HA   1 c 1 
ATOM   5032  H  HB   . VAL   A  1  324 ? 9.914   -32.108 1.869   1.000 39.715  0 379  VAL   A HB   1 c 1 
ATOM   5033  H  HG11 . VAL   A  1  324 ? 11.962  -31.228 3.632   1.000 42.100  0 379  VAL   A HG11 1 c 1 
ATOM   5034  H  HG12 . VAL   A  1  324 ? 11.887  -32.728 3.110   1.000 43.016  0 379  VAL   A HG12 1 c 1 
ATOM   5035  H  HG13 . VAL   A  1  324 ? 10.717  -32.139 4.010   1.000 42.376  0 379  VAL   A HG13 1 c 1 
ATOM   5036  H  HG21 . VAL   A  1  324 ? 9.441   -30.200 3.089   1.000 40.057  0 379  VAL   A HG21 1 c 1 
ATOM   5037  H  HG22 . VAL   A  1  324 ? 9.445   -29.917 1.527   1.000 39.847  0 379  VAL   A HG22 1 c 1 
ATOM   5038  H  HG23 . VAL   A  1  324 ? 10.682  -29.473 2.417   1.000 39.910  0 379  VAL   A HG23 1 c 1 
ATOM   5039  N  N    . ASP   A  1  325 ? 13.970  -31.772 1.134   1.000 42.718  0 380  ASP   A N    1 ? 1 
ATOM   5040  C  CA   . ASP   A  1  325 ? 15.333  -31.375 1.471   1.000 44.484  0 380  ASP   A CA   1 ? 1 
ATOM   5041  C  C    . ASP   A  1  325 ? 16.044  -30.631 0.337   1.000 46.308  0 380  ASP   A C    1 ? 1 
ATOM   5042  O  O    . ASP   A  1  325 ? 17.115  -30.064 0.531   1.000 47.885  0 380  ASP   A O    1 ? 1 
ATOM   5043  C  CB   . ASP   A  1  325 ? 16.165  -32.592 1.878   1.000 42.376  0 380  ASP   A CB   1 ? 1 
ATOM   5044  C  CG   . ASP   A  1  325 ? 15.794  -33.151 3.229   1.000 52.548  0 380  ASP   A CG   1 ? 1 
ATOM   5045  O  OD1  . ASP   A  1  325 ? 15.883  -32.398 4.226   1.000 53.657  0 380  ASP   A OD1  1 ? 1 
ATOM   5046  O  OD2  . ASP   A  1  325 ? 15.389  -34.327 3.287   1.000 83.846  0 380  ASP   A OD2  1 ? 1 
ATOM   5047  H  H    . ASP   A  1  325 ? 13.809  -32.648 0.932   1.000 42.030  0 380  ASP   A H    1 c 1 
ATOM   5048  H  HA   . ASP   A  1  325 ? 15.286  -30.773 2.247   1.000 43.649  0 380  ASP   A HA   1 c 1 
ATOM   5049  H  HB2  . ASP   A  1  325 ? 16.051  -33.297 1.208   1.000 45.696  0 380  ASP   A HB2  1 c 1 
ATOM   5050  H  HB3  . ASP   A  1  325 ? 17.112  -32.343 1.900   1.000 45.441  0 380  ASP   A HB3  1 c 1 
ATOM   5051  N  N    . ASP   A  1  326 ? 15.434  -30.641 -0.849  1.000 43.047  0 381  ASP   A N    1 ? 1 
ATOM   5052  C  CA   . ASP   A  1  326 ? 15.938  -29.911 -1.997  1.000 46.409  0 381  ASP   A CA   1 ? 1 
ATOM   5053  C  C    . ASP   A  1  326 ? 15.679  -28.410 -1.894  1.000 41.172  0 381  ASP   A C    1 ? 1 
ATOM   5054  O  O    . ASP   A  1  326 ? 16.194  -27.650 -2.703  1.000 50.562  0 381  ASP   A O    1 ? 1 
ATOM   5055  C  CB   . ASP   A  1  326 ? 15.249  -30.441 -3.277  1.000 41.463  0 381  ASP   A CB   1 ? 1 
ATOM   5056  C  CG   . ASP   A  1  326 ? 15.572  -31.868 -3.601  1.000 59.816  0 381  ASP   A CG   1 ? 1 
ATOM   5057  O  OD1  . ASP   A  1  326 ? 16.616  -32.370 -3.085  1.000 49.049  0 381  ASP   A OD1  1 ? 1 
ATOM   5058  O  OD2  . ASP   A  1  326 ? 14.772  -32.506 -4.378  1.000 54.259  0 381  ASP   A OD2  1 ? 1 
ATOM   5059  H  H    . ASP   A  1  326 ? 14.673  -31.136 -0.952  1.000 44.519  0 381  ASP   A H    1 c 1 
ATOM   5060  H  HA   . ASP   A  1  326 ? 16.910  -30.064 -2.069  1.000 44.492  0 381  ASP   A HA   1 c 1 
ATOM   5061  H  HB2  . ASP   A  1  326 ? 14.279  -30.361 -3.172  1.000 45.520  0 381  ASP   A HB2  1 c 1 
ATOM   5062  H  HB3  . ASP   A  1  326 ? 15.520  -29.887 -4.037  1.000 45.778  0 381  ASP   A HB3  1 c 1 
ATOM   5063  N  N    . ILE   A  1  327 ? 14.827  -27.985 -0.951  1.000 37.290  0 382  ILE   A N    1 ? 1 
ATOM   5064  C  CA   . ILE   A  1  327 ? 14.335  -26.620 -0.988  1.000 39.747  0 382  ILE   A CA   1 ? 1 
ATOM   5065  C  C    . ILE   A  1  327 ? 14.815  -25.851 0.233   1.000 38.950  0 382  ILE   A C    1 ? 1 
ATOM   5066  O  O    . ILE   A  1  327 ? 15.030  -26.435 1.297   1.000 32.690  0 382  ILE   A O    1 ? 1 
ATOM   5067  C  CB   . ILE   A  1  327 ? 12.796  -26.511 -1.139  1.000 43.334  0 382  ILE   A CB   1 ? 1 
ATOM   5068  C  CG1  . ILE   A  1  327 ? 12.052  -26.959 0.099   1.000 39.217  0 382  ILE   A CG1  1 ? 1 
ATOM   5069  C  CG2  . ILE   A  1  327 ? 12.296  -27.252 -2.368  1.000 37.162  0 382  ILE   A CG2  1 ? 1 
ATOM   5070  C  CD1  . ILE   A  1  327 ? 10.611  -26.568 0.063   1.000 53.191  0 382  ILE   A CD1  1 ? 1 
ATOM   5071  H  H    . ILE   A  1  327 ? 14.545  -28.545 -0.286  1.000 39.082  0 382  ILE   A H    1 c 1 
ATOM   5072  H  HA   . ILE   A  1  327 ? 14.725  -26.191 -1.769  1.000 39.535  0 382  ILE   A HA   1 c 1 
ATOM   5073  H  HB   . ILE   A  1  327 ? 12.587  -25.554 -1.271  1.000 39.863  0 382  ILE   A HB   1 c 1 
ATOM   5074  H  HG12 . ILE   A  1  327 ? 12.116  -27.933 0.174   1.000 43.586  0 382  ILE   A HG12 1 c 1 
ATOM   5075  H  HG13 . ILE   A  1  327 ? 12.469  -26.561 0.891   1.000 42.889  0 382  ILE   A HG13 1 c 1 
ATOM   5076  H  HG21 . ILE   A  1  327 ? 12.345  -28.212 -2.214  1.000 39.517  0 382  ILE   A HG21 1 c 1 
ATOM   5077  H  HG22 . ILE   A  1  327 ? 12.849  -27.021 -3.133  1.000 39.152  0 382  ILE   A HG22 1 c 1 
ATOM   5078  H  HG23 . ILE   A  1  327 ? 11.373  -27.002 -2.551  1.000 38.634  0 382  ILE   A HG23 1 c 1 
ATOM   5079  H  HD11 . ILE   A  1  327 ? 10.147  -27.089 -0.615  1.000 47.950  0 382  ILE   A HD11 1 c 1 
ATOM   5080  H  HD12 . ILE   A  1  327 ? 10.534  -25.621 -0.147  1.000 47.349  0 382  ILE   A HD12 1 c 1 
ATOM   5081  H  HD13 . ILE   A  1  327 ? 10.208  -26.740 0.932   1.000 47.639  0 382  ILE   A HD13 1 c 1 
ATOM   5082  N  N    . THR   A  1  328 ? 15.007  -24.543 0.021   1.000 31.321  0 383  THR   A N    1 ? 1 
ATOM   5083  C  CA   . THR   A  1  328 ? 15.142  -23.585 1.100   1.000 33.223  0 383  THR   A CA   1 ? 1 
ATOM   5084  C  C    . THR   A  1  328 ? 13.813  -22.860 1.261   1.000 24.111  0 383  THR   A C    1 ? 1 
ATOM   5085  O  O    . THR   A  1  328 ? 13.282  -22.356 0.285   1.000 30.774  0 383  THR   A O    1 ? 1 
ATOM   5086  C  CB   . THR   A  1  328 ? 16.276  -22.627 0.768   1.000 31.649  0 383  THR   A CB   1 ? 1 
ATOM   5087  O  OG1  . THR   A  1  328 ? 17.481  -23.398 0.780   1.000 37.847  0 383  THR   A OG1  1 ? 1 
ATOM   5088  C  CG2  . THR   A  1  328 ? 16.361  -21.446 1.754   1.000 28.406  0 383  THR   A CG2  1 ? 1 
ATOM   5089  H  H    . THR   A  1  328 ? 15.055  -24.237 -0.839  1.000 33.271  0 383  THR   A H    1 c 1 
ATOM   5090  H  HA   . THR   A  1  328 ? 15.356  -24.067 1.930   1.000 31.155  0 383  THR   A HA   1 c 1 
ATOM   5091  H  HB   . THR   A  1  328 ? 16.130  -22.274 -0.142  1.000 32.098  0 383  THR   A HB   1 c 1 
ATOM   5092  H  HG1  . THR   A  1  328 ? 17.589  -23.740 1.557   0.000 23.060  0 383  THR   A HG1  1 c 1 
ATOM   5093  H  HG21 . THR   A  1  328 ? 17.199  -20.968 1.617   1.000 29.287  0 383  THR   A HG21 1 c 1 
ATOM   5094  H  HG22 . THR   A  1  328 ? 16.326  -21.782 2.668   1.000 29.327  0 383  THR   A HG22 1 c 1 
ATOM   5095  H  HG23 . THR   A  1  328 ? 15.615  -20.839 1.603   1.000 28.566  0 383  THR   A HG23 1 c 1 
ATOM   5096  N  N    . LEU   A  1  329 ? 13.289  -22.817 2.491   1.000 31.074  0 384  LEU   A N    1 ? 1 
ATOM   5097  C  CA   . LEU   A  1  329 ? 12.083  -22.059 2.763   1.000 30.103  0 384  LEU   A CA   1 ? 1 
ATOM   5098  C  C    . LEU   A  1  329 ? 12.380  -20.946 3.753   1.000 24.249  0 384  LEU   A C    1 ? 1 
ATOM   5099  O  O    . LEU   A  1  329 ? 12.890  -21.223 4.818   1.000 24.922  0 384  LEU   A O    1 ? 1 
ATOM   5100  C  CB   . LEU   A  1  329 ? 10.991  -22.987 3.325   1.000 31.475  0 384  LEU   A CB   1 ? 1 
ATOM   5101  C  CG   . LEU   A  1  329 ? 9.721   -22.303 3.776   1.000 28.468  0 384  LEU   A CG   1 ? 1 
ATOM   5102  C  CD1  . LEU   A  1  329 ? 8.933   -21.778 2.591   1.000 29.900  0 384  LEU   A CD1  1 ? 1 
ATOM   5103  C  CD2  . LEU   A  1  329 ? 8.862   -23.221 4.606   1.000 28.080  0 384  LEU   A CD2  1 ? 1 
ATOM   5104  H  H    . LEU   A  1  329 ? 13.692  -23.271 3.174   1.000 29.547  0 384  LEU   A H    1 c 1 
ATOM   5105  H  HA   . LEU   A  1  329 ? 11.768  -21.659 1.924   1.000 28.719  0 384  LEU   A HA   1 c 1 
ATOM   5106  H  HB2  . LEU   A  1  329 ? 10.761  -23.643 2.637   1.000 30.829  0 384  LEU   A HB2  1 c 1 
ATOM   5107  H  HB3  . LEU   A  1  329 ? 11.365  -23.476 4.085   1.000 31.009  0 384  LEU   A HB3  1 c 1 
ATOM   5108  H  HG   . LEU   A  1  329 ? 9.970   -21.532 4.340   1.000 28.800  0 384  LEU   A HG   1 c 1 
ATOM   5109  H  HD11 . LEU   A  1  329 ? 8.215   -21.203 2.908   1.000 28.879  0 384  LEU   A HD11 1 c 1 
ATOM   5110  H  HD12 . LEU   A  1  329 ? 8.554   -22.525 2.096   1.000 29.478  0 384  LEU   A HD12 1 c 1 
ATOM   5111  H  HD13 . LEU   A  1  329 ? 9.520   -21.269 2.007   1.000 29.102  0 384  LEU   A HD13 1 c 1 
ATOM   5112  H  HD21 . LEU   A  1  329 ? 9.330   -23.448 5.428   1.000 28.578  0 384  LEU   A HD21 1 c 1 
ATOM   5113  H  HD22 . LEU   A  1  329 ? 8.676   -24.034 4.104   1.000 28.562  0 384  LEU   A HD22 1 c 1 
ATOM   5114  H  HD23 . LEU   A  1  329 ? 8.024   -22.776 4.822   1.000 27.898  0 384  LEU   A HD23 1 c 1 
ATOM   5115  N  N    . VAL   A  1  330 ? 12.060  -19.697 3.393   1.000 24.507  0 385  VAL   A N    1 ? 1 
ATOM   5116  C  CA   . VAL   A  1  330 ? 11.882  -18.641 4.382   1.000 23.292  0 385  VAL   A CA   1 ? 1 
ATOM   5117  C  C    . VAL   A  1  330 ? 10.510  -18.861 4.999   1.000 21.847  0 385  VAL   A C    1 ? 1 
ATOM   5118  O  O    . VAL   A  1  330 ? 9.530   -18.646 4.292   1.000 22.173  0 385  VAL   A O    1 ? 1 
ATOM   5119  C  CB   . VAL   A  1  330 ? 11.941  -17.211 3.801   1.000 23.227  0 385  VAL   A CB   1 ? 1 
ATOM   5120  C  CG1  . VAL   A  1  330 ? 11.597  -16.190 4.864   1.000 21.015  0 385  VAL   A CG1  1 ? 1 
ATOM   5121  C  CG2  . VAL   A  1  330 ? 13.282  -16.941 3.127   1.000 23.340  0 385  VAL   A CG2  1 ? 1 
ATOM   5122  H  H    . VAL   A  1  330 ? 11.952  -19.496 2.508   1.000 23.999  0 385  VAL   A H    1 c 1 
ATOM   5123  H  HA   . VAL   A  1  330 ? 12.564  -18.732 5.069   1.000 23.603  0 385  VAL   A HA   1 c 1 
ATOM   5124  H  HB   . VAL   A  1  330 ? 11.245  -17.154 3.101   1.000 22.478  0 385  VAL   A HB   1 c 1 
ATOM   5125  H  HG11 . VAL   A  1  330 ? 12.064  -16.410 5.689   1.000 21.812  0 385  VAL   A HG11 1 c 1 
ATOM   5126  H  HG12 . VAL   A  1  330 ? 10.636  -16.195 5.023   1.000 21.282  0 385  VAL   A HG12 1 c 1 
ATOM   5127  H  HG13 . VAL   A  1  330 ? 11.869  -15.305 4.563   1.000 21.285  0 385  VAL   A HG13 1 c 1 
ATOM   5128  H  HG21 . VAL   A  1  330 ? 13.297  -16.029 2.788   1.000 23.059  0 385  VAL   A HG21 1 c 1 
ATOM   5129  H  HG22 . VAL   A  1  330 ? 13.406  -17.563 2.389   1.000 23.629  0 385  VAL   A HG22 1 c 1 
ATOM   5130  H  HG23 . VAL   A  1  330 ? 14.000  -17.059 3.774   1.000 23.705  0 385  VAL   A HG23 1 c 1 
ATOM   5131  N  N    . PRO   A  1  331 ? 10.399  -19.310 6.287   1.000 23.526  0 386  PRO   A N    1 ? 1 
ATOM   5132  C  CA   . PRO   A  1  331 ? 9.134   -19.771 6.865   1.000 22.541  0 386  PRO   A CA   1 ? 1 
ATOM   5133  C  C    . PRO   A  1  331 ? 8.349   -18.694 7.608   1.000 23.173  0 386  PRO   A C    1 ? 1 
ATOM   5134  O  O    . PRO   A  1  331 ? 8.739   -17.533 7.609   1.000 27.599  0 386  PRO   A O    1 ? 1 
ATOM   5135  C  CB   . PRO   A  1  331 ? 9.618   -20.809 7.850   1.000 20.912  0 386  PRO   A CB   1 ? 1 
ATOM   5136  C  CG   . PRO   A  1  331 ? 10.818  -20.168 8.451   1.000 21.121  0 386  PRO   A CG   1 ? 1 
ATOM   5137  C  CD   . PRO   A  1  331 ? 11.492  -19.441 7.267   1.000 24.959  0 386  PRO   A CD   1 ? 1 
ATOM   5138  H  HA   . PRO   A  1  331 ? 8.575   -20.199 6.168   1.000 22.410  0 386  PRO   A HA   1 c 1 
ATOM   5139  H  HB2  . PRO   A  1  331 ? 8.940   -20.998 8.533   1.000 21.479  0 386  PRO   A HB2  1 c 1 
ATOM   5140  H  HB3  . PRO   A  1  331 ? 9.856   -21.645 7.395   1.000 21.793  0 386  PRO   A HB3  1 c 1 
ATOM   5141  H  HG2  . PRO   A  1  331 ? 10.564  -19.533 9.152   1.000 21.687  0 386  PRO   A HG2  1 c 1 
ATOM   5142  H  HG3  . PRO   A  1  331 ? 11.418  -20.840 8.834   1.000 22.419  0 386  PRO   A HG3  1 c 1 
ATOM   5143  H  HD2  . PRO   A  1  331 ? 11.829  -18.566 7.535   1.000 23.488  0 386  PRO   A HD2  1 c 1 
ATOM   5144  H  HD3  . PRO   A  1  331 ? 12.228  -19.968 6.906   1.000 24.105  0 386  PRO   A HD3  1 c 1 
ATOM   5145  N  N    . GLY   A  1  332 ? 7.228   -19.102 8.211   1.000 21.245  0 387  GLY   A N    1 ? 1 
ATOM   5146  C  CA   . GLY   A  1  332 ? 6.467   -18.280 9.132   1.000 20.443  0 387  GLY   A CA   1 ? 1 
ATOM   5147  C  C    . GLY   A  1  332 ? 5.100   -17.896 8.594   1.000 18.653  0 387  GLY   A C    1 ? 1 
ATOM   5148  O  O    . GLY   A  1  332 ? 4.332   -18.745 8.144   1.000 26.280  0 387  GLY   A O    1 ? 1 
ATOM   5149  H  H    . GLY   A  1  332 ? 6.918   -19.943 8.030   1.000 21.814  0 387  GLY   A H    1 c 1 
ATOM   5150  H  HA2  . GLY   A  1  332 ? 6.352   -18.777 9.980   1.000 20.585  0 387  GLY   A HA2  1 c 1 
ATOM   5151  H  HA3  . GLY   A  1  332 ? 6.983   -17.460 9.333   1.000 20.142  0 387  GLY   A HA3  1 c 1 
ATOM   5152  N  N    . THR   A  1  333 ? 4.809   -16.600 8.676   1.000 19.895  0 388  THR   A N    1 ? 1 
ATOM   5153  C  CA   . THR   A  1  333 ? 3.548   -16.011 8.259   1.000 19.094  0 388  THR   A CA   1 ? 1 
ATOM   5154  C  C    . THR   A  1  333 ? 3.558   -15.697 6.768   1.000 17.993  0 388  THR   A C    1 ? 1 
ATOM   5155  O  O    . THR   A  1  333 ? 2.609   -15.124 6.244   1.000 19.175  0 388  THR   A O    1 ? 1 
ATOM   5156  C  CB   . THR   A  1  333 ? 3.305   -14.744 9.085   1.000 17.450  0 388  THR   A CB   1 ? 1 
ATOM   5157  O  OG1  . THR   A  1  333 ? 4.434   -13.926 8.863   1.000 17.757  0 388  THR   A OG1  1 ? 1 
ATOM   5158  C  CG2  . THR   A  1  333 ? 3.124   -15.044 10.557  1.000 19.911  0 388  THR   A CG2  1 ? 1 
ATOM   5159  H  H    . THR   A  1  333 ? 5.446   -16.039 9.016   1.000 19.304  0 388  THR   A H    1 c 1 
ATOM   5160  H  HA   . THR   A  1  333 ? 2.826   -16.656 8.445   1.000 18.979  0 388  THR   A HA   1 c 1 
ATOM   5161  H  HB   . THR   A  1  333 ? 2.499   -14.289 8.742   1.000 17.895  0 388  THR   A HB   1 c 1 
ATOM   5162  H  HG1  . THR   A  1  333 ? 5.134   -14.342 9.123   0.000 9.870   0 388  THR   A HG1  1 c 1 
ATOM   5163  H  HG21 . THR   A  1  333 ? 2.843   -14.236 11.023  1.000 19.073  0 388  THR   A HG21 1 c 1 
ATOM   5164  H  HG22 . THR   A  1  333 ? 3.967   -15.357 10.932  1.000 19.514  0 388  THR   A HG22 1 c 1 
ATOM   5165  H  HG23 . THR   A  1  333 ? 2.446   -15.734 10.668  1.000 19.487  0 388  THR   A HG23 1 c 1 
ATOM   5166  N  N    . LEU   A  1  334 ? 4.671   -16.028 6.124   1.000 18.336  0 389  LEU   A N    1 ? 1 
ATOM   5167  C  CA   . LEU   A  1  334 ? 4.759   -16.088 4.684   1.000 19.784  0 389  LEU   A CA   1 ? 1 
ATOM   5168  C  C    . LEU   A  1  334 ? 5.780   -17.161 4.319   1.000 20.805  0 389  LEU   A C    1 ? 1 
ATOM   5169  O  O    . LEU   A  1  334 ? 6.576   -17.611 5.150   1.000 22.683  0 389  LEU   A O    1 ? 1 
ATOM   5170  C  CB   . LEU   A  1  334 ? 5.178   -14.763 4.052   1.000 18.505  0 389  LEU   A CB   1 ? 1 
ATOM   5171  C  CG   . LEU   A  1  334 ? 6.579   -14.280 4.409   1.000 25.325  0 389  LEU   A CG   1 ? 1 
ATOM   5172  C  CD1  . LEU   A  1  334 ? 7.115   -13.345 3.348   1.000 28.587  0 389  LEU   A CD1  1 ? 1 
ATOM   5173  C  CD2  . LEU   A  1  334 ? 6.579   -13.520 5.747   1.000 43.236  0 389  LEU   A CD2  1 ? 1 
ATOM   5174  H  H    . LEU   A  1  334 ? 5.424   -16.207 6.607   1.000 18.962  0 389  LEU   A H    1 c 1 
ATOM   5175  H  HA   . LEU   A  1  334 ? 3.881   -16.356 4.329   1.000 19.376  0 389  LEU   A HA   1 c 1 
ATOM   5176  H  HB2  . LEU   A  1  334 ? 5.119   -14.855 3.081   1.000 20.078  0 389  LEU   A HB2  1 c 1 
ATOM   5177  H  HB3  . LEU   A  1  334 ? 4.535   -14.077 4.322   1.000 19.926  0 389  LEU   A HB3  1 c 1 
ATOM   5178  H  HG   . LEU   A  1  334 ? 7.183   -15.058 4.483   1.000 27.075  0 389  LEU   A HG   1 c 1 
ATOM   5179  H  HD11 . LEU   A  1  334 ? 8.006   -13.044 3.600   1.000 27.569  0 389  LEU   A HD11 1 c 1 
ATOM   5180  H  HD12 . LEU   A  1  334 ? 6.525   -12.576 3.263   1.000 27.112  0 389  LEU   A HD12 1 c 1 
ATOM   5181  H  HD13 . LEU   A  1  334 ? 7.162   -13.814 2.497   1.000 27.334  0 389  LEU   A HD13 1 c 1 
ATOM   5182  H  HD21 . LEU   A  1  334 ? 6.350   -14.129 6.469   1.000 36.277  0 389  LEU   A HD21 1 c 1 
ATOM   5183  H  HD22 . LEU   A  1  334 ? 5.926   -12.800 5.712   1.000 35.935  0 389  LEU   A HD22 1 c 1 
ATOM   5184  H  HD23 . LEU   A  1  334 ? 7.463   -13.147 5.908   1.000 36.347  0 389  LEU   A HD23 1 c 1 
ATOM   5185  N  N    . GLY   A  1  335 ? 5.752   -17.544 3.046   1.000 22.379  0 390  GLY   A N    1 ? 1 
ATOM   5186  C  CA   . GLY   A  1  335 ? 6.704   -18.494 2.510   1.000 20.605  0 390  GLY   A CA   1 ? 1 
ATOM   5187  C  C    . GLY   A  1  335 ? 7.413   -17.928 1.290   1.000 17.843  0 390  GLY   A C    1 ? 1 
ATOM   5188  O  O    . GLY   A  1  335 ? 6.771   -17.391 0.403   1.000 19.028  0 390  GLY   A O    1 ? 1 
ATOM   5189  H  H    . GLY   A  1  335 ? 5.114   -17.200 2.489   1.000 21.183  0 390  GLY   A H    1 c 1 
ATOM   5190  H  HA2  . GLY   A  1  335 ? 7.368   -18.720 3.204   1.000 20.716  0 390  GLY   A HA2  1 c 1 
ATOM   5191  H  HA3  . GLY   A  1  335 ? 6.227   -19.323 2.258   1.000 20.680  0 390  GLY   A HA3  1 c 1 
ATOM   5192  N  N    . ARG   A  1  336 ? 8.731   -18.098 1.244   1.000 21.046  0 391  ARG   A N    1 ? 1 
ATOM   5193  C  CA   . ARG   A  1  336 ? 9.492   -17.924 0.016   1.000 18.596  0 391  ARG   A CA   1 ? 1 
ATOM   5194  C  C    . ARG   A  1  336 ? 10.356  -19.168 -0.164  1.000 19.593  0 391  ARG   A C    1 ? 1 
ATOM   5195  O  O    . ARG   A  1  336 ? 11.075  -19.586 0.744   1.000 19.870  0 391  ARG   A O    1 ? 1 
ATOM   5196  C  CB   . ARG   A  1  336 ? 10.291  -16.625 0.071   1.000 25.157  0 391  ARG   A CB   1 ? 1 
ATOM   5197  C  CG   . ARG   A  1  336 ? 9.430   -15.434 0.467   1.000 28.767  0 391  ARG   A CG   1 ? 1 
ATOM   5198  C  CD   . ARG   A  1  336 ? 10.008  -14.074 0.092   1.000 28.547  0 391  ARG   A CD   1 ? 1 
ATOM   5199  N  NE   . ARG   A  1  336 ? 11.400  -13.969 0.520   1.000 29.328  0 391  ARG   A NE   1 ? 1 
ATOM   5200  C  CZ   . ARG   A  1  336 ? 11.816  -13.385 1.639   1.000 22.920  0 391  ARG   A CZ   1 ? 1 
ATOM   5201  N  NH1  . ARG   A  1  336 ? 10.974  -13.059 2.606   1.000 25.817  0 391  ARG   A NH1  1 ? 1 
ATOM   5202  N  NH2  . ARG   A  1  336 ? 13.119  -13.161 1.804   1.000 19.528  0 391  ARG   A NH2  1 ? 1 
ATOM   5203  H  H    . ARG   A  1  336 ? 9.179   -18.328 2.007   1.000 19.935  0 391  ARG   A H    1 c 1 
ATOM   5204  H  HA   . ARG   A  1  336 ? 8.859   -17.870 -0.735  1.000 19.983  0 391  ARG   A HA   1 c 1 
ATOM   5205  H  HB2  . ARG   A  1  336 ? 11.020  -16.725 0.719   1.000 24.277  0 391  ARG   A HB2  1 c 1 
ATOM   5206  H  HB3  . ARG   A  1  336 ? 10.685  -16.458 -0.809  1.000 24.095  0 391  ARG   A HB3  1 c 1 
ATOM   5207  H  HG2  . ARG   A  1  336 ? 8.552   -15.525 0.041   1.000 27.255  0 391  ARG   A HG2  1 c 1 
ATOM   5208  H  HG3  . ARG   A  1  336 ? 9.290   -15.455 1.438   1.000 27.614  0 391  ARG   A HG3  1 c 1 
ATOM   5209  H  HD2  . ARG   A  1  336 ? 9.956   -13.955 -0.880  1.000 28.589  0 391  ARG   A HD2  1 c 1 
ATOM   5210  H  HD3  . ARG   A  1  336 ? 9.478   -13.365 0.515   1.000 28.246  0 391  ARG   A HD3  1 c 1 
ATOM   5211  H  HE   . ARG   A  1  336 ? 12.007  -14.318 0.001   1.000 27.590  0 391  ARG   A HE   1 c 1 
ATOM   5212  H  HH11 . ARG   A  1  336 ? 10.312  -13.602 2.815   1.000 24.783  0 391  ARG   A HH11 1 c 1 
ATOM   5213  H  HH12 . ARG   A  1  336 ? 11.079  -12.299 3.041   1.000 24.631  0 391  ARG   A HH12 1 c 1 
ATOM   5214  H  HH21 . ARG   A  1  336 ? 13.408  -12.802 2.552   1.000 20.663  0 391  ARG   A HH21 1 c 1 
ATOM   5215  H  HH22 . ARG   A  1  336 ? 13.686  -13.371 1.166   1.000 20.927  0 391  ARG   A HH22 1 c 1 
ATOM   5216  N  N    . ILE   A  1  337 ? 10.227  -19.806 -1.333  1.000 19.626  0 392  ILE   A N    1 ? 1 
ATOM   5217  C  CA   . ILE   A  1  337 ? 10.948  -21.027 -1.634  1.000 20.284  0 392  ILE   A CA   1 ? 1 
ATOM   5218  C  C    . ILE   A  1  337 ? 11.979  -20.775 -2.729  1.000 22.349  0 392  ILE   A C    1 ? 1 
ATOM   5219  O  O    . ILE   A  1  337 ? 11.702  -20.099 -3.707  1.000 20.817  0 392  ILE   A O    1 ? 1 
ATOM   5220  C  CB   . ILE   A  1  337 ? 9.977   -22.132 -2.073  1.000 21.577  0 392  ILE   A CB   1 ? 1 
ATOM   5221  C  CG1  . ILE   A  1  337 ? 9.066   -22.578 -0.920  1.000 22.104  0 392  ILE   A CG1  1 ? 1 
ATOM   5222  C  CG2  . ILE   A  1  337 ? 10.709  -23.334 -2.677  1.000 25.874  0 392  ILE   A CG2  1 ? 1 
ATOM   5223  C  CD1  . ILE   A  1  337 ? 7.914   -23.604 -1.336  1.000 25.210  0 392  ILE   A CD1  1 ? 1 
ATOM   5224  H  H    . ILE   A  1  337 ? 9.667   -19.463 -1.969  1.000 19.398  0 392  ILE   A H    1 c 1 
ATOM   5225  H  HA   . ILE   A  1  337 ? 11.408  -21.324 -0.832  1.000 21.128  0 392  ILE   A HA   1 c 1 
ATOM   5226  H  HB   . ILE   A  1  337 ? 9.396   -21.751 -2.778  1.000 21.756  0 392  ILE   A HB   1 c 1 
ATOM   5227  H  HG12 . ILE   A  1  337 ? 9.622   -22.997 -0.228  1.000 22.879  0 392  ILE   A HG12 1 c 1 
ATOM   5228  H  HG13 . ILE   A  1  337 ? 8.648   -21.783 -0.526  1.000 22.074  0 392  ILE   A HG13 1 c 1 
ATOM   5229  H  HG21 . ILE   A  1  337 ? 11.372  -23.663 -2.045  1.000 25.142  0 392  ILE   A HG21 1 c 1 
ATOM   5230  H  HG22 . ILE   A  1  337 ? 11.153  -23.068 -3.501  1.000 24.789  0 392  ILE   A HG22 1 c 1 
ATOM   5231  H  HG23 . ILE   A  1  337 ? 10.072  -24.042 -2.873  1.000 24.925  0 392  ILE   A HG23 1 c 1 
ATOM   5232  H  HD11 . ILE   A  1  337 ? 8.306   -24.469 -1.548  1.000 24.841  0 392  ILE   A HD11 1 c 1 
ATOM   5233  H  HD12 . ILE   A  1  337 ? 7.441   -23.264 -2.115  1.000 24.073  0 392  ILE   A HD12 1 c 1 
ATOM   5234  H  HD13 . ILE   A  1  337 ? 7.288   -23.706 -0.598  1.000 24.244  0 392  ILE   A HD13 1 c 1 
ATOM   5235  N  N    . ARG   A  1  338 ? 13.164  -21.359 -2.569  1.000 24.243  0 393  ARG   A N    1 ? 1 
ATOM   5236  C  CA   . ARG   A  1  338 ? 14.127  -21.449 -3.656  1.000 33.034  0 393  ARG   A CA   1 ? 1 
ATOM   5237  C  C    . ARG   A  1  338 ? 14.855  -22.772 -3.502  1.000 27.987  0 393  ARG   A C    1 ? 1 
ATOM   5238  O  O    . ARG   A  1  338 ? 14.691  -23.439 -2.490  1.000 26.973  0 393  ARG   A O    1 ? 1 
ATOM   5239  C  CB   . ARG   A  1  338 ? 15.119  -20.268 -3.671  1.000 29.937  0 393  ARG   A CB   1 ? 1 
ATOM   5240  C  CG   . ARG   A  1  338 ? 15.921  -20.147 -2.391  1.000 26.628  0 393  ARG   A CG   1 ? 1 
ATOM   5241  C  CD   . ARG   A  1  338 ? 16.743  -18.900 -2.395  1.000 25.973  0 393  ARG   A CD   1 ? 1 
ATOM   5242  N  NE   . ARG   A  1  338 ? 17.720  -18.941 -1.313  1.000 31.400  0 393  ARG   A NE   1 ? 1 
ATOM   5243  C  CZ   . ARG   A  1  338 ? 17.591  -18.335 -0.137  1.000 43.379  0 393  ARG   A CZ   1 ? 1 
ATOM   5244  N  NH1  . ARG   A  1  338 ? 16.533  -17.585 0.153   1.000 37.869  0 393  ARG   A NH1  1 ? 1 
ATOM   5245  N  NH2  . ARG   A  1  338 ? 18.536  -18.512 0.787   1.000 44.462  0 393  ARG   A NH2  1 ? 1 
ATOM   5246  H  H    . ARG   A  1  338 ? 13.385  -21.711 -1.755  1.000 25.610  0 393  ARG   A H    1 c 1 
ATOM   5247  H  HA   . ARG   A  1  338 ? 13.636  -21.460 -4.509  1.000 29.252  0 393  ARG   A HA   1 c 1 
ATOM   5248  H  HB2  . ARG   A  1  338 ? 15.736  -20.383 -4.423  1.000 30.062  0 393  ARG   A HB2  1 c 1 
ATOM   5249  H  HB3  . ARG   A  1  338 ? 14.619  -19.437 -3.814  1.000 29.157  0 393  ARG   A HB3  1 c 1 
ATOM   5250  H  HG2  . ARG   A  1  338 ? 15.313  -20.130 -1.622  1.000 26.949  0 393  ARG   A HG2  1 c 1 
ATOM   5251  H  HG3  . ARG   A  1  338 ? 16.513  -20.923 -2.298  1.000 27.805  0 393  ARG   A HG3  1 c 1 
ATOM   5252  H  HD2  . ARG   A  1  338 ? 17.210  -18.818 -3.255  1.000 27.422  0 393  ARG   A HD2  1 c 1 
ATOM   5253  H  HD3  . ARG   A  1  338 ? 16.159  -18.119 -2.289  1.000 26.797  0 393  ARG   A HD3  1 c 1 
ATOM   5254  H  HE   . ARG   A  1  338 ? 18.449  -19.400 -1.449  1.000 33.028  0 393  ARG   A HE   1 c 1 
ATOM   5255  H  HH11 . ARG   A  1  338 ? 15.723  -17.847 -0.100  1.000 38.782  0 393  ARG   A HH11 1 c 1 
ATOM   5256  H  HH12 . ARG   A  1  338 ? 16.645  -16.830 0.607   1.000 39.127  0 393  ARG   A HH12 1 c 1 
ATOM   5257  H  HH21 . ARG   A  1  338 ? 18.456  -18.126 1.572   1.000 44.081  0 393  ARG   A HH21 1 c 1 
ATOM   5258  H  HH22 . ARG   A  1  338 ? 19.236  -19.014 0.610   1.000 44.551  0 393  ARG   A HH22 1 c 1 
ATOM   5259  N  N    . ALA   A  1  339 ? 15.584  -23.154 -4.551  1.000 37.065  0 394  ALA   A N    1 ? 1 
ATOM   5260  C  CA   . ALA   A  1  339 ? 16.361  -24.380 -4.572  1.000 36.210  0 394  ALA   A CA   1 ? 1 
ATOM   5261  C  C    . ALA   A  1  339 ? 17.565  -24.197 -3.649  1.000 42.571  0 394  ALA   A C    1 ? 1 
ATOM   5262  O  O    . ALA   A  1  339 ? 17.895  -23.063 -3.299  1.000 44.388  0 394  ALA   A O    1 ? 1 
ATOM   5263  C  CB   . ALA   A  1  339 ? 16.807  -24.669 -6.003  1.000 32.875  0 394  ALA   A CB   1 ? 1 
ATOM   5264  H  H    . ALA   A  1  339 ? 15.598  -22.619 -5.292  1.000 34.065  0 394  ALA   A H    1 c 1 
ATOM   5265  H  HA   . ALA   A  1  339 ? 15.806  -25.125 -4.241  1.000 36.781  0 394  ALA   A HA   1 c 1 
ATOM   5266  H  HB1  . ALA   A  1  339 ? 17.069  -25.602 -6.081  1.000 34.556  0 394  ALA   A HB1  1 c 1 
ATOM   5267  H  HB2  . ALA   A  1  339 ? 16.075  -24.486 -6.614  1.000 33.698  0 394  ALA   A HB2  1 c 1 
ATOM   5268  H  HB3  . ALA   A  1  339 ? 17.564  -24.101 -6.228  1.000 34.070  0 394  ALA   A HB3  1 c 1 
ATOM   5269  N  N    . LYS   A  1  340 ? 18.219  -25.305 -3.270  1.000 53.341  0 395  LYS   A N    1 ? 1 
ATOM   5270  C  CA   . LYS   A  1  340 ? 19.487  -25.238 -2.548  1.000 78.879  0 395  LYS   A CA   1 ? 1 
ATOM   5271  C  C    . LYS   A  1  340 ? 20.729  -25.086 -3.433  1.000 83.517  0 395  LYS   A C    1 ? 1 
ATOM   5272  O  O    . LYS   A  1  340 ? 21.785  -24.712 -2.933  1.000 81.064  0 395  LYS   A O    1 ? 1 
ATOM   5273  C  CB   . LYS   A  1  340 ? 19.684  -26.464 -1.640  1.000 56.772  0 395  LYS   A CB   1 ? 1 
ATOM   5274  C  CG   . LYS   A  1  340 ? 18.774  -26.479 -0.418  1.000 53.946  0 395  LYS   A CG   1 ? 1 
ATOM   5275  C  CD   . LYS   A  1  340 ? 19.400  -27.148 0.767   1.000 53.193  0 395  LYS   A CD   1 ? 1 
ATOM   5276  C  CE   . LYS   A  1  340 ? 20.388  -26.241 1.477   1.000 91.682  0 395  LYS   A CE   1 ? 1 
ATOM   5277  N  NZ   . LYS   A  1  340 ? 20.923  -26.860 2.727   1.000 97.559  0 395  LYS   A NZ   1 ? 1 
ATOM   5278  H  H    . LYS   A  1  340 ? 17.866  -26.124 -3.467  1.000 55.196  0 395  LYS   A H    1 c 1 
ATOM   5279  H  HA   . LYS   A  1  340 ? 19.447  -24.445 -1.966  1.000 68.094  0 395  LYS   A HA   1 c 1 
ATOM   5280  H  HB2  . LYS   A  1  340 ? 19.516  -27.273 -2.167  1.000 60.960  0 395  LYS   A HB2  1 c 1 
ATOM   5281  H  HB3  . LYS   A  1  340 ? 20.617  -26.488 -1.341  1.000 61.369  0 395  LYS   A HB3  1 c 1 
ATOM   5282  H  HG2  . LYS   A  1  340 ? 18.545  -25.556 -0.180  1.000 53.911  0 395  LYS   A HG2  1 c 1 
ATOM   5283  H  HG3  . LYS   A  1  340 ? 17.942  -26.946 -0.647  1.000 54.083  0 395  LYS   A HG3  1 c 1 
ATOM   5284  H  HD2  . LYS   A  1  340 ? 18.697  -27.412 1.398   1.000 60.144  0 395  LYS   A HD2  1 c 1 
ATOM   5285  H  HD3  . LYS   A  1  340 ? 19.865  -27.960 0.472   1.000 60.990  0 395  LYS   A HD3  1 c 1 
ATOM   5286  H  HE2  . LYS   A  1  340 ? 21.134  -26.041 0.880   1.000 81.102  0 395  LYS   A HE2  1 c 1 
ATOM   5287  H  HE3  . LYS   A  1  340 ? 19.951  -25.398 1.704   1.000 80.122  0 395  LYS   A HE3  1 c 1 
ATOM   5288  H  HZ1  . LYS   A  1  340 ? 21.358  -27.630 2.527   1.000 96.572  0 395  LYS   A HZ1  1 c 1 
ATOM   5289  H  HZ2  . LYS   A  1  340 ? 20.240  -27.044 3.295   1.000 95.702  0 395  LYS   A HZ2  1 c 1 
ATOM   5290  H  HZ3  . LYS   A  1  340 ? 21.499  -26.288 3.131   1.000 95.910  0 395  LYS   A HZ3  1 c 1 
ATOM   5291  N  N    . SER   A  1  341 ? 20.613  -25.386 -4.733  1.000 80.653  0 396  SER   A N    1 ? 1 
ATOM   5292  C  CA   . SER   A  1  341 ? 21.724  -25.238 -5.659  1.000 81.595  0 396  SER   A CA   1 ? 1 
ATOM   5293  C  C    . SER   A  1  341 ? 21.528  -24.065 -6.639  1.000 65.431  0 396  SER   A C    1 ? 1 
ATOM   5294  O  O    . SER   A  1  341 ? 21.204  -24.263 -7.805  1.000 68.421  0 396  SER   A O    1 ? 1 
ATOM   5295  C  CB   . SER   A  1  341 ? 21.946  -26.545 -6.406  1.000 86.567  0 396  SER   A CB   1 ? 1 
ATOM   5296  O  OG   . SER   A  1  341 ? 22.448  -27.519 -5.508  1.000 90.594  0 396  SER   A OG   1 ? 1 
ATOM   5297  H  H    . SER   A  1  341 ? 19.816  -25.699 -5.053  1.000 80.956  0 396  SER   A H    1 c 1 
ATOM   5298  H  HA   . SER   A  1  341 ? 22.542  -25.050 -5.126  1.000 79.390  0 396  SER   A HA   1 c 1 
ATOM   5299  H  HB2  . SER   A  1  341 ? 21.097  -26.855 -6.793  1.000 86.113  0 396  SER   A HB2  1 c 1 
ATOM   5300  H  HB3  . SER   A  1  341 ? 22.590  -26.405 -7.137  1.000 86.559  0 396  SER   A HB3  1 c 1 
ATOM   5301  H  HG   . SER   A  1  341 ? 21.895  -27.928 -5.076  0.000 68.560  0 396  SER   A HG   1 c 1 
ATOM   5302  N  N    . LYS   A  1  346 ? 14.347  -33.704 -7.719  1.000 67.313  0 401  LYS   A N    1 ? 1 
ATOM   5303  C  CA   . LYS   A  1  346 ? 15.154  -32.499 -7.626  1.000 61.005  0 401  LYS   A CA   1 ? 1 
ATOM   5304  C  C    . LYS   A  1  346 ? 14.283  -31.294 -7.988  1.000 61.390  0 401  LYS   A C    1 ? 1 
ATOM   5305  O  O    . LYS   A  1  346 ? 13.224  -31.431 -8.600  1.000 60.529  0 401  LYS   A O    1 ? 1 
ATOM   5306  C  CB   . LYS   A  1  346 ? 16.382  -32.629 -8.532  1.000 66.572  0 401  LYS   A CB   1 ? 1 
ATOM   5307  C  CG   . LYS   A  1  346 ? 17.700  -32.384 -7.808  1.000 77.832  0 401  LYS   A CG   1 ? 1 
ATOM   5308  C  CD   . LYS   A  1  346 ? 18.006  -30.895 -7.460  1.000 80.914  0 401  LYS   A CD   1 ? 1 
ATOM   5309  C  CE   . LYS   A  1  346 ? 17.905  -29.929 -8.645  1.000 77.954  0 401  LYS   A CE   1 ? 1 
ATOM   5310  N  NZ   . LYS   A  1  346 ? 18.951  -30.130 -9.674  1.000 67.637  0 401  LYS   A NZ   1 ? 1 
ATOM   5311  H  H    . LYS   A  1  346 ? 14.460  -34.104 -8.534  1.000 65.864  0 401  LYS   A H    1 c 1 
ATOM   5312  H  HA   . LYS   A  1  346 ? 15.456  -32.400 -6.697  1.000 63.286  0 401  LYS   A HA   1 c 1 
ATOM   5313  H  HB2  . LYS   A  1  346 ? 16.400  -33.531 -8.915  1.000 68.332  0 401  LYS   A HB2  1 c 1 
ATOM   5314  H  HB3  . LYS   A  1  346 ? 16.299  -31.992 -9.271  1.000 67.414  0 401  LYS   A HB3  1 c 1 
ATOM   5315  H  HG2  . LYS   A  1  346 ? 17.698  -32.905 -6.976  1.000 76.081  0 401  LYS   A HG2  1 c 1 
ATOM   5316  H  HG3  . LYS   A  1  346 ? 18.428  -32.729 -8.367  1.000 76.554  0 401  LYS   A HG3  1 c 1 
ATOM   5317  H  HD2  . LYS   A  1  346 ? 17.388  -30.601 -6.759  1.000 78.733  0 401  LYS   A HD2  1 c 1 
ATOM   5318  H  HD3  . LYS   A  1  346 ? 18.914  -30.841 -7.093  1.000 79.779  0 401  LYS   A HD3  1 c 1 
ATOM   5319  H  HE2  . LYS   A  1  346 ? 17.032  -30.025 -9.068  1.000 75.065  0 401  LYS   A HE2  1 c 1 
ATOM   5320  H  HE3  . LYS   A  1  346 ? 17.971  -29.013 -8.315  1.000 75.025  0 401  LYS   A HE3  1 c 1 
ATOM   5321  H  HZ1  . LYS   A  1  346 ? 18.926  -30.985 -9.976  1.000 71.409  0 401  LYS   A HZ1  1 c 1 
ATOM   5322  H  HZ2  . LYS   A  1  346 ? 19.768  -29.964 -9.318  1.000 71.087  0 401  LYS   A HZ2  1 c 1 
ATOM   5323  H  HZ3  . LYS   A  1  346 ? 18.810  -29.566 -10.370 1.000 70.538  0 401  LYS   A HZ3  1 c 1 
ATOM   5324  N  N    . TYR   A  1  347 ? 14.737  -30.111 -7.582  1.000 62.720  0 402  TYR   A N    1 ? 1 
ATOM   5325  C  CA   . TYR   A  1  347 ? 13.949  -28.896 -7.686  1.000 59.758  0 402  TYR   A CA   1 ? 1 
ATOM   5326  C  C    . TYR   A  1  347 ? 13.357  -28.646 -9.075  1.000 64.328  0 402  TYR   A C    1 ? 1 
ATOM   5327  O  O    . TYR   A  1  347 ? 14.038  -28.787 -10.089 1.000 68.679  0 402  TYR   A O    1 ? 1 
ATOM   5328  C  CB   . TYR   A  1  347 ? 14.841  -27.716 -7.301  1.000 54.056  0 402  TYR   A CB   1 ? 1 
ATOM   5329  C  CG   . TYR   A  1  347 ? 14.123  -26.423 -7.035  1.000 45.202  0 402  TYR   A CG   1 ? 1 
ATOM   5330  C  CD1  . TYR   A  1  347 ? 13.547  -26.167 -5.795  1.000 52.326  0 402  TYR   A CD1  1 ? 1 
ATOM   5331  C  CD2  . TYR   A  1  347 ? 14.050  -25.433 -8.008  1.000 42.783  0 402  TYR   A CD2  1 ? 1 
ATOM   5332  C  CE1  . TYR   A  1  347 ? 12.903  -24.960 -5.532  1.000 50.647  0 402  TYR   A CE1  1 ? 1 
ATOM   5333  C  CE2  . TYR   A  1  347 ? 13.412  -24.218 -7.757  1.000 42.219  0 402  TYR   A CE2  1 ? 1 
ATOM   5334  C  CZ   . TYR   A  1  347 ? 12.836  -23.990 -6.517  1.000 41.506  0 402  TYR   A CZ   1 ? 1 
ATOM   5335  O  OH   . TYR   A  1  347 ? 12.217  -22.802 -6.246  1.000 32.185  0 402  TYR   A OH   1 ? 1 
ATOM   5336  H  H    . TYR   A  1  347 ? 15.566  -30.061 -7.204  1.000 62.328  0 402  TYR   A H    1 c 1 
ATOM   5337  H  HA   . TYR   A  1  347 ? 13.205  -28.951 -7.034  1.000 59.587  0 402  TYR   A HA   1 c 1 
ATOM   5338  H  HB2  . TYR   A  1  347 ? 15.346  -27.962 -6.498  1.000 53.505  0 402  TYR   A HB2  1 c 1 
ATOM   5339  H  HB3  . TYR   A  1  347 ? 15.488  -27.572 -8.024  1.000 53.398  0 402  TYR   A HB3  1 c 1 
ATOM   5340  H  HD1  . TYR   A  1  347 ? 13.593  -26.822 -5.121  1.000 50.244  0 402  TYR   A HD1  1 c 1 
ATOM   5341  H  HD2  . TYR   A  1  347 ? 14.444  -25.583 -8.851  1.000 43.808  0 402  TYR   A HD2  1 c 1 
ATOM   5342  H  HE1  . TYR   A  1  347 ? 12.516  -24.802 -4.687  1.000 48.068  0 402  TYR   A HE1  1 c 1 
ATOM   5343  H  HE2  . TYR   A  1  347 ? 13.369  -23.558 -8.427  1.000 41.945  0 402  TYR   A HE2  1 c 1 
ATOM   5344  H  HH   . TYR   A  1  347 ? 11.873  -22.662 -5.465  0.000 19.060  0 402  TYR   A HH   1 c 1 
ATOM   5345  N  N    . ASP   A  1  348 ? 12.076  -28.263 -9.102  1.000 59.508  0 403  ASP   A N    1 ? 1 
ATOM   5346  C  CA   . ASP   A  1  348 ? 11.434  -27.793 -10.314 1.000 47.633  0 403  ASP   A CA   1 ? 1 
ATOM   5347  C  C    . ASP   A  1  348 ? 10.201  -26.963 -9.967  1.000 48.233  0 403  ASP   A C    1 ? 1 
ATOM   5348  O  O    . ASP   A  1  348 ? 9.221   -27.505 -9.449  1.000 38.382  0 403  ASP   A O    1 ? 1 
ATOM   5349  C  CB   . ASP   A  1  348 ? 11.030  -28.960 -11.221 1.000 56.649  0 403  ASP   A CB   1 ? 1 
ATOM   5350  C  CG   . ASP   A  1  348 ? 10.336  -28.463 -12.478 1.000 60.840  0 403  ASP   A CG   1 ? 1 
ATOM   5351  O  OD1  . ASP   A  1  348 ? 10.946  -27.631 -13.203 1.000 52.183  0 403  ASP   A OD1  1 ? 1 
ATOM   5352  O  OD2  . ASP   A  1  348 ? 9.168   -28.861 -12.710 1.000 49.739  0 403  ASP   A OD2  1 ? 1 
ATOM   5353  H  H    . ASP   A  1  348 ? 11.584  -28.301 -8.333  1.000 57.167  0 403  ASP   A H    1 c 1 
ATOM   5354  H  HA   . ASP   A  1  348 ? 12.073  -27.230 -10.804 1.000 51.502  0 403  ASP   A HA   1 c 1 
ATOM   5355  H  HB2  . ASP   A  1  348 ? 11.827  -29.467 -11.479 1.000 56.164  0 403  ASP   A HB2  1 c 1 
ATOM   5356  H  HB3  . ASP   A  1  348 ? 10.423  -29.558 -10.738 1.000 55.476  0 403  ASP   A HB3  1 c 1 
ATOM   5357  N  N    . PRO   A  1  349 ? 10.197  -25.646 -10.291 1.000 47.861  0 404  PRO   A N    1 ? 1 
ATOM   5358  C  CA   . PRO   A  1  349 ? 9.108   -24.744 -9.884  1.000 38.450  0 404  PRO   A CA   1 ? 1 
ATOM   5359  C  C    . PRO   A  1  349 ? 7.681   -25.191 -10.201 1.000 41.018  0 404  PRO   A C    1 ? 1 
ATOM   5360  O  O    . PRO   A  1  349 ? 6.790   -25.058 -9.368  1.000 36.198  0 404  PRO   A O    1 ? 1 
ATOM   5361  C  CB   . PRO   A  1  349 ? 9.421   -23.449 -10.632 1.000 45.123  0 404  PRO   A CB   1 ? 1 
ATOM   5362  C  CG   . PRO   A  1  349 ? 10.933  -23.513 -10.913 1.000 48.412  0 404  PRO   A CG   1 ? 1 
ATOM   5363  C  CD   . PRO   A  1  349 ? 11.243  -24.975 -11.086 1.000 49.219  0 404  PRO   A CD   1 ? 1 
ATOM   5364  H  HA   . PRO   A  1  349 ? 9.186   -24.576 -8.911  1.000 41.293  0 404  PRO   A HA   1 c 1 
ATOM   5365  H  HB2  . PRO   A  1  349 ? 8.914   -23.397 -11.470 1.000 43.843  0 404  PRO   A HB2  1 c 1 
ATOM   5366  H  HB3  . PRO   A  1  349 ? 9.203   -22.667 -10.082 1.000 43.423  0 404  PRO   A HB3  1 c 1 
ATOM   5367  H  HG2  . PRO   A  1  349 ? 11.156  -23.014 -11.724 1.000 47.771  0 404  PRO   A HG2  1 c 1 
ATOM   5368  H  HG3  . PRO   A  1  349 ? 11.441  -23.140 -10.164 1.000 47.651  0 404  PRO   A HG3  1 c 1 
ATOM   5369  H  HD2  . PRO   A  1  349 ? 11.192  -25.237 -12.024 1.000 49.226  0 404  PRO   A HD2  1 c 1 
ATOM   5370  H  HD3  . PRO   A  1  349 ? 12.133  -25.183 -10.746 1.000 49.270  0 404  PRO   A HD3  1 c 1 
ATOM   5371  N  N    . LYS   A  1  350 ? 7.454   -25.702 -11.411 1.000 34.008  0 405  LYS   A N    1 ? 1 
ATOM   5372  C  CA   . LYS   A  1  350 ? 6.112   -26.050 -11.846 1.000 40.461  0 405  LYS   A CA   1 ? 1 
ATOM   5373  C  C    . LYS   A  1  350 ? 5.588   -27.246 -11.054 1.000 39.331  0 405  LYS   A C    1 ? 1 
ATOM   5374  O  O    . LYS   A  1  350 ? 4.425   -27.268 -10.670 1.000 34.600  0 405  LYS   A O    1 ? 1 
ATOM   5375  C  CB   . LYS   A  1  350 ? 6.084   -26.381 -13.351 1.000 61.018  0 405  LYS   A CB   1 ? 1 
ATOM   5376  C  CG   . LYS   A  1  350 ? 6.339   -25.199 -14.275 1.000 66.539  0 405  LYS   A CG   1 ? 1 
ATOM   5377  C  CD   . LYS   A  1  350 ? 6.101   -25.566 -15.758 1.000 65.888  0 405  LYS   A CD   1 ? 1 
ATOM   5378  C  CE   . LYS   A  1  350 ? 7.049   -26.629 -16.251 1.000 65.059  0 405  LYS   A CE   1 ? 1 
ATOM   5379  N  NZ   . LYS   A  1  350 ? 6.956   -26.807 -17.722 1.000 76.204  0 405  LYS   A NZ   1 ? 1 
ATOM   5380  H  H    . LYS   A  1  350 ? 8.153   -25.837 -11.983 1.000 37.527  0 405  LYS   A H    1 c 1 
ATOM   5381  H  HA   . LYS   A  1  350 ? 5.522   -25.279 -11.680 1.000 41.031  0 405  LYS   A HA   1 c 1 
ATOM   5382  H  HB2  . LYS   A  1  350 ? 6.761   -27.067 -13.527 1.000 57.112  0 405  LYS   A HB2  1 c 1 
ATOM   5383  H  HB3  . LYS   A  1  350 ? 5.209   -26.763 -13.568 1.000 56.467  0 405  LYS   A HB3  1 c 1 
ATOM   5384  H  HG2  . LYS   A  1  350 ? 5.743   -24.461 -14.024 1.000 64.362  0 405  LYS   A HG2  1 c 1 
ATOM   5385  H  HG3  . LYS   A  1  350 ? 7.265   -24.896 -14.161 1.000 64.936  0 405  LYS   A HG3  1 c 1 
ATOM   5386  H  HD2  . LYS   A  1  350 ? 5.180   -25.885 -15.867 1.000 65.733  0 405  LYS   A HD2  1 c 1 
ATOM   5387  H  HD3  . LYS   A  1  350 ? 6.210   -24.761 -16.310 1.000 65.551  0 405  LYS   A HD3  1 c 1 
ATOM   5388  H  HE2  . LYS   A  1  350 ? 7.964   -26.384 -16.018 1.000 67.812  0 405  LYS   A HE2  1 c 1 
ATOM   5389  H  HE3  . LYS   A  1  350 ? 6.843   -27.478 -15.816 1.000 67.959  0 405  LYS   A HE3  1 c 1 
ATOM   5390  H  HZ1  . LYS   A  1  350 ? 7.104   -26.014 -18.137 1.000 72.414  0 405  LYS   A HZ1  1 c 1 
ATOM   5391  H  HZ2  . LYS   A  1  350 ? 6.130   -27.109 -17.943 1.000 72.706  0 405  LYS   A HZ2  1 c 1 
ATOM   5392  H  HZ3  . LYS   A  1  350 ? 7.576   -27.408 -17.998 1.000 73.227  0 405  LYS   A HZ3  1 c 1 
ATOM   5393  N  N    . THR   A  1  351 ? 6.452   -28.241 -10.833 1.000 35.141  0 406  THR   A N    1 ? 1 
ATOM   5394  C  CA   . THR   A  1  351 ? 6.127   -29.363 -9.969  1.000 36.206  0 406  THR   A CA   1 ? 1 
ATOM   5395  C  C    . THR   A  1  351 ? 5.806   -28.887 -8.556  1.000 29.843  0 406  THR   A C    1 ? 1 
ATOM   5396  O  O    . THR   A  1  351 ? 4.831   -29.338 -7.967  1.000 39.150  0 406  THR   A O    1 ? 1 
ATOM   5397  C  CB   . THR   A  1  351 ? 7.261   -30.373 -10.014 1.000 35.871  0 406  THR   A CB   1 ? 1 
ATOM   5398  O  OG1  . THR   A  1  351 ? 7.481   -30.704 -11.356 1.000 43.391  0 406  THR   A OG1  1 ? 1 
ATOM   5399  C  CG2  . THR   A  1  351 ? 6.987   -31.642 -9.237  1.000 34.676  0 406  THR   A CG2  1 ? 1 
ATOM   5400  H  H    . THR   A  1  351 ? 7.270   -28.223 -11.240 1.000 36.618  0 406  THR   A H    1 c 1 
ATOM   5401  H  HA   . THR   A  1  351 ? 5.321   -29.794 -10.335 1.000 34.827  0 406  THR   A HA   1 c 1 
ATOM   5402  H  HB   . THR   A  1  351 ? 8.073   -29.945 -9.652  1.000 36.871  0 406  THR   A HB   1 c 1 
ATOM   5403  H  HG1  . THR   A  1  351 ? 6.790   -31.030 -11.683 0.000 27.340  0 406  THR   A HG1  1 c 1 
ATOM   5404  H  HG21 . THR   A  1  351 ? 7.711   -32.277 -9.386  1.000 35.776  0 406  THR   A HG21 1 c 1 
ATOM   5405  H  HG22 . THR   A  1  351 ? 6.147   -32.034 -9.537  1.000 35.279  0 406  THR   A HG22 1 c 1 
ATOM   5406  H  HG23 . THR   A  1  351 ? 6.928   -31.438 -8.286  1.000 34.923  0 406  THR   A HG23 1 c 1 
ATOM   5407  N  N    . ILE   A  1  352 ? 6.614   -27.960 -8.027  1.000 29.421  0 407  ILE   A N    1 ? 1 
ATOM   5408  C  CA   . ILE   A  1  352 ? 6.403   -27.440 -6.683  1.000 28.420  0 407  ILE   A CA   1 ? 1 
ATOM   5409  C  C    . ILE   A  1  352 ? 5.083   -26.677 -6.578  1.000 27.361  0 407  ILE   A C    1 ? 1 
ATOM   5410  O  O    . ILE   A  1  352 ? 4.309   -26.891 -5.656  1.000 30.846  0 407  ILE   A O    1 ? 1 
ATOM   5411  C  CB   . ILE   A  1  352 ? 7.599   -26.582 -6.217  1.000 29.532  0 407  ILE   A CB   1 ? 1 
ATOM   5412  C  CG1  . ILE   A  1  352 ? 8.878   -27.445 -6.065  1.000 28.386  0 407  ILE   A CG1  1 ? 1 
ATOM   5413  C  CG2  . ILE   A  1  352 ? 7.285   -25.829 -4.912  1.000 26.609  0 407  ILE   A CG2  1 ? 1 
ATOM   5414  C  CD1  . ILE   A  1  352 ? 10.162  -26.623 -6.240  1.000 33.746  0 407  ILE   A CD1  1 ? 1 
ATOM   5415  H  H    . ILE   A  1  352 ? 7.320   -27.647 -8.515  1.000 29.417  0 407  ILE   A H    1 c 1 
ATOM   5416  H  HA   . ILE   A  1  352 ? 6.346   -28.204 -6.082  1.000 29.103  0 407  ILE   A HA   1 c 1 
ATOM   5417  H  HB   . ILE   A  1  352 ? 7.775   -25.908 -6.919  1.000 28.242  0 407  ILE   A HB   1 c 1 
ATOM   5418  H  HG12 . ILE   A  1  352 ? 8.882   -27.859 -5.176  1.000 30.073  0 407  ILE   A HG12 1 c 1 
ATOM   5419  H  HG13 . ILE   A  1  352 ? 8.865   -28.162 -6.735  1.000 30.362  0 407  ILE   A HG13 1 c 1 
ATOM   5420  H  HG21 . ILE   A  1  352 ? 6.870   -26.437 -4.275  1.000 27.461  0 407  ILE   A HG21 1 c 1 
ATOM   5421  H  HG22 . ILE   A  1  352 ? 6.677   -25.091 -5.097  1.000 26.780  0 407  ILE   A HG22 1 c 1 
ATOM   5422  H  HG23 . ILE   A  1  352 ? 8.109   -25.478 -4.532  1.000 27.276  0 407  ILE   A HG23 1 c 1 
ATOM   5423  H  HD11 . ILE   A  1  352 ? 10.205  -25.936 -5.552  1.000 31.645  0 407  ILE   A HD11 1 c 1 
ATOM   5424  H  HD12 . ILE   A  1  352 ? 10.163  -26.202 -7.117  1.000 31.924  0 407  ILE   A HD12 1 c 1 
ATOM   5425  H  HD13 . ILE   A  1  352 ? 10.936  -27.207 -6.161  1.000 32.609  0 407  ILE   A HD13 1 c 1 
ATOM   5426  N  N    . ILE   A  1  353 ? 4.798   -25.810 -7.540  1.000 26.109  0 408  ILE   A N    1 ? 1 
ATOM   5427  C  CA   . ILE   A  1  353 ? 3.574   -25.048 -7.463  1.000 25.902  0 408  ILE   A CA   1 ? 1 
ATOM   5428  C  C    . ILE   A  1  353 ? 2.393   -26.017 -7.516  1.000 26.727  0 408  ILE   A C    1 ? 1 
ATOM   5429  O  O    . ILE   A  1  353 ? 1.479   -25.921 -6.693  1.000 27.286  0 408  ILE   A O    1 ? 1 
ATOM   5430  C  CB   . ILE   A  1  353 ? 3.566   -23.977 -8.562  1.000 31.973  0 408  ILE   A CB   1 ? 1 
ATOM   5431  C  CG1  . ILE   A  1  353 ? 4.606   -22.881 -8.294  1.000 39.488  0 408  ILE   A CG1  1 ? 1 
ATOM   5432  C  CG2  . ILE   A  1  353 ? 2.159   -23.402 -8.744  1.000 33.295  0 408  ILE   A CG2  1 ? 1 
ATOM   5433  C  CD1  . ILE   A  1  353 ? 4.247   -21.939 -7.196  1.000 46.747  0 408  ILE   A CD1  1 ? 1 
ATOM   5434  H  H    . ILE   A  1  353 ? 5.366   -25.688 -8.245  1.000 26.681  0 408  ILE   A H    1 c 1 
ATOM   5435  H  HA   . ILE   A  1  353 ? 3.554   -24.595 -6.602  1.000 26.827  0 408  ILE   A HA   1 c 1 
ATOM   5436  H  HB   . ILE   A  1  353 ? 3.817   -24.421 -9.410  1.000 32.401  0 408  ILE   A HB   1 c 1 
ATOM   5437  H  HG12 . ILE   A  1  353 ? 5.460   -23.306 -8.071  1.000 39.109  0 408  ILE   A HG12 1 c 1 
ATOM   5438  H  HG13 . ILE   A  1  353 ? 4.736   -22.365 -9.118  1.000 38.900  0 408  ILE   A HG13 1 c 1 
ATOM   5439  H  HG21 . ILE   A  1  353 ? 1.760   -23.234 -7.872  1.000 32.640  0 408  ILE   A HG21 1 c 1 
ATOM   5440  H  HG22 . ILE   A  1  353 ? 1.607   -24.036 -9.235  1.000 33.038  0 408  ILE   A HG22 1 c 1 
ATOM   5441  H  HG23 . ILE   A  1  353 ? 2.210   -22.568 -9.241  1.000 32.482  0 408  ILE   A HG23 1 c 1 
ATOM   5442  H  HD11 . ILE   A  1  353 ? 4.073   -22.438 -6.381  1.000 43.634  0 408  ILE   A HD11 1 c 1 
ATOM   5443  H  HD12 . ILE   A  1  353 ? 3.451   -21.436 -7.443  1.000 43.658  0 408  ILE   A HD12 1 c 1 
ATOM   5444  H  HD13 . ILE   A  1  353 ? 4.983   -21.321 -7.044  1.000 43.856  0 408  ILE   A HD13 1 c 1 
ATOM   5445  N  N    . ALA   A  1  354 ? 2.434   -26.965 -8.463  1.000 26.722  0 409  ALA   A N    1 ? 1 
ATOM   5446  C  CA   . ALA   A  1  354 ? 1.340   -27.902 -8.680  1.000 25.813  0 409  ALA   A CA   1 ? 1 
ATOM   5447  C  C    . ALA   A  1  354 ? 1.100   -28.764 -7.451  1.000 30.389  0 409  ALA   A C    1 ? 1 
ATOM   5448  O  O    . ALA   A  1  354 ? -0.041  -28.952 -7.023  1.000 26.561  0 409  ALA   A O    1 ? 1 
ATOM   5449  C  CB   . ALA   A  1  354 ? 1.609   -28.784 -9.899  1.000 30.099  0 409  ALA   A CB   1 ? 1 
ATOM   5450  H  H    . ALA   A  1  354 ? 3.172   -27.026 -8.999  1.000 26.759  0 409  ALA   A H    1 c 1 
ATOM   5451  H  HA   . ALA   A  1  354 ? 0.522   -27.379 -8.850  1.000 27.087  0 409  ALA   A HA   1 c 1 
ATOM   5452  H  HB1  . ALA   A  1  354 ? 0.869   -29.402 -10.023 1.000 29.226  0 409  ALA   A HB1  1 c 1 
ATOM   5453  H  HB2  . ALA   A  1  354 ? 1.700   -28.226 -10.690 1.000 28.754  0 409  ALA   A HB2  1 c 1 
ATOM   5454  H  HB3  . ALA   A  1  354 ? 2.430   -29.286 -9.762  1.000 29.301  0 409  ALA   A HB3  1 c 1 
ATOM   5455  N  N    . ALA   A  1  355 ? 2.199   -29.222 -6.840  1.000 28.753  0 410  ALA   A N    1 ? 1 
ATOM   5456  C  CA   . ALA   A  1  355 ? 2.103   -30.103 -5.692  1.000 25.653  0 410  ALA   A CA   1 ? 1 
ATOM   5457  C  C    . ALA   A  1  355 ? 1.564   -29.379 -4.449  1.000 27.718  0 410  ALA   A C    1 ? 1 
ATOM   5458  O  O    . ALA   A  1  355 ? 1.130   -30.011 -3.476  1.000 25.739  0 410  ALA   A O    1 ? 1 
ATOM   5459  C  CB   . ALA   A  1  355 ? 3.466   -30.742 -5.464  1.000 28.247  0 410  ALA   A CB   1 ? 1 
ATOM   5460  H  H    . ALA   A  1  355 ? 3.025   -28.984 -7.149  1.000 28.258  0 410  ALA   A H    1 c 1 
ATOM   5461  H  HA   . ALA   A  1  355 ? 1.468   -30.821 -5.918  1.000 27.569  0 410  ALA   A HA   1 c 1 
ATOM   5462  H  HB1  . ALA   A  1  355 ? 3.428   -31.319 -4.683  1.000 27.933  0 410  ALA   A HB1  1 c 1 
ATOM   5463  H  HB2  . ALA   A  1  355 ? 3.713   -31.268 -6.243  1.000 28.024  0 410  ALA   A HB2  1 c 1 
ATOM   5464  N  N    . LEU   A  1  356 ? 1.570   -28.041 -4.485  1.000 23.300  0 411  LEU   A N    1 ? 1 
ATOM   5465  C  CA   . LEU   A  1  356 ? 1.122   -27.229 -3.362  1.000 27.594  0 411  LEU   A CA   1 ? 1 
ATOM   5466  C  C    . LEU   A  1  356 ? -0.263  -26.622 -3.554  1.000 23.287  0 411  LEU   A C    1 ? 1 
ATOM   5467  O  O    . LEU   A  1  356 ? -0.772  -25.933 -2.679  1.000 23.413  0 411  LEU   A O    1 ? 1 
ATOM   5468  C  CB   . LEU   A  1  356 ? 2.117   -26.074 -3.137  1.000 26.124  0 411  LEU   A CB   1 ? 1 
ATOM   5469  C  CG   . LEU   A  1  356 ? 3.502   -26.482 -2.702  1.000 26.198  0 411  LEU   A CG   1 ? 1 
ATOM   5470  C  CD1  . LEU   A  1  356 ? 4.391   -25.281 -2.648  1.000 23.936  0 411  LEU   A CD1  1 ? 1 
ATOM   5471  C  CD2  . LEU   A  1  356 ? 3.470   -27.204 -1.373  1.000 25.894  0 411  LEU   A CD2  1 ? 1 
ATOM   5472  H  H    . LEU   A  1  356 ? 1.885   -27.614 -5.228  1.000 24.974  0 411  LEU   A H    1 c 1 
ATOM   5473  H  HA   . LEU   A  1  356 ? 1.099   -27.796 -2.559  1.000 25.904  0 411  LEU   A HA   1 c 1 
ATOM   5474  H  HB2  . LEU   A  1  356 ? 2.194   -25.571 -3.972  1.000 25.989  0 411  LEU   A HB2  1 c 1 
ATOM   5475  H  HB3  . LEU   A  1  356 ? 1.747   -25.472 -2.463  1.000 25.892  0 411  LEU   A HB3  1 c 1 
ATOM   5476  H  HG   . LEU   A  1  356 ? 3.867   -27.104 -3.377  1.000 26.173  0 411  LEU   A HG   1 c 1 
ATOM   5477  H  HD11 . LEU   A  1  356 ? 5.314   -25.565 -2.531  1.000 24.739  0 411  LEU   A HD11 1 c 1 
ATOM   5478  H  HD12 . LEU   A  1  356 ? 4.129   -24.717 -1.900  1.000 24.124  0 411  LEU   A HD12 1 c 1 
ATOM   5479  H  HD13 . LEU   A  1  356 ? 4.310   -24.778 -3.477  1.000 24.222  0 411  LEU   A HD13 1 c 1 
ATOM   5480  H  HD21 . LEU   A  1  356 ? 3.074   -28.085 -1.489  1.000 26.530  0 411  LEU   A HD21 1 c 1 
ATOM   5481  H  HD22 . LEU   A  1  356 ? 2.940   -26.692 -0.738  1.000 25.776  0 411  LEU   A HD22 1 c 1 
ATOM   5482  H  HD23 . LEU   A  1  356 ? 4.377   -27.300 -1.034  1.000 26.299  0 411  LEU   A HD23 1 c 1 
ATOM   5483  N  N    . THR   A  1  357 ? -0.845  -26.864 -4.727  1.000 24.176  0 412  THR   A N    1 ? 1 
ATOM   5484  C  CA   . THR   A  1  357 ? -2.054  -26.182 -5.144  1.000 21.743  0 412  THR   A CA   1 ? 1 
ATOM   5485  C  C    . THR   A  1  357 ? -3.299  -26.998 -4.846  1.000 21.344  0 412  THR   A C    1 ? 1 
ATOM   5486  O  O    . THR   A  1  357 ? -3.441  -28.082 -5.396  1.000 21.605  0 412  THR   A O    1 ? 1 
ATOM   5487  C  CB   . THR   A  1  357 ? -1.987  -25.941 -6.626  1.000 23.693  0 412  THR   A CB   1 ? 1 
ATOM   5488  O  OG1  . THR   A  1  357 ? -1.005  -24.944 -6.855  1.000 24.527  0 412  THR   A OG1  1 ? 1 
ATOM   5489  C  CG2  . THR   A  1  357 ? -3.303  -25.522 -7.206  1.000 25.041  0 412  THR   A CG2  1 ? 1 
ATOM   5490  H  H    . THR   A  1  357 ? -0.481  -27.487 -5.288  1.000 23.908  0 412  THR   A H    1 c 1 
ATOM   5491  H  HA   . THR   A  1  357 ? -2.109  -25.317 -4.680  1.000 21.952  0 412  THR   A HA   1 c 1 
ATOM   5492  H  HB   . THR   A  1  357 ? -1.701  -26.778 -7.064  1.000 24.251  0 412  THR   A HB   1 c 1 
ATOM   5493  H  HG1  . THR   A  1  357 ? -1.236  -24.231 -6.454  0.000 13.800  0 412  THR   A HG1  1 c 1 
ATOM   5494  H  HG21 . THR   A  1  357 ? -3.169  -25.196 -8.113  1.000 24.622  0 412  THR   A HG21 1 c 1 
ATOM   5495  H  HG22 . THR   A  1  357 ? -3.689  -24.812 -6.661  1.000 24.198  0 412  THR   A HG22 1 c 1 
ATOM   5496  H  HG23 . THR   A  1  357 ? -3.912  -26.282 -7.226  1.000 24.934  0 412  THR   A HG23 1 c 1 
ATOM   5497  N  N    . CYS   A  1  358 ? -4.179  -26.466 -3.984  1.000 23.897  0 413  CYS   A N    1 ? 1 
ATOM   5498  C  CA   . CYS   A  1  358 ? -5.528  -26.994 -3.779  1.000 32.925  0 413  CYS   A CA   1 ? 1 
ATOM   5499  C  C    . CYS   A  1  358 ? -5.495  -28.481 -3.463  1.000 36.797  0 413  CYS   A C    1 ? 1 
ATOM   5500  O  O    . CYS   A  1  358 ? -6.189  -29.260 -4.107  1.000 29.974  0 413  CYS   A O    1 ? 1 
ATOM   5501  C  CB   . CYS   A  1  358 ? -6.448  -26.716 -4.984  1.000 24.745  0 413  CYS   A CB   1 ? 1 
ATOM   5502  S  SG   . CYS   A  1  358 ? -6.606  -24.958 -5.395  1.000 30.150  0 413  CYS   A SG   1 ? 1 
ATOM   5503  H  H    . CYS   A  1  358 ? -3.924  -25.736 -3.495  1.000 24.275  0 413  CYS   A H    1 c 1 
ATOM   5504  H  HA   . CYS   A  1  358 ? -5.907  -26.529 -2.998  1.000 29.483  0 413  CYS   A HA   1 c 1 
ATOM   5505  H  HB2  . CYS   A  1  358 ? -6.099  -27.187 -5.768  1.000 27.732  0 413  CYS   A HB2  1 c 1 
ATOM   5506  H  HB3  . CYS   A  1  358 ? -7.340  -27.069 -4.793  1.000 27.752  0 413  CYS   A HB3  1 c 1 
ATOM   5507  N  N    . LYS   A  1  359 ? -4.681  -28.849 -2.477  1.000 32.188  0 414  LYS   A N    1 ? 1 
ATOM   5508  C  CA   . LYS   A  1  359 ? -4.425  -30.245 -2.185  1.000 29.016  0 414  LYS   A CA   1 ? 1 
ATOM   5509  C  C    . LYS   A  1  359 ? -5.132  -30.748 -0.933  1.000 29.478  0 414  LYS   A C    1 ? 1 
ATOM   5510  O  O    . LYS   A  1  359 ? -5.318  -31.947 -0.786  1.000 30.714  0 414  LYS   A O    1 ? 1 
ATOM   5511  C  CB   . LYS   A  1  359 ? -2.897  -30.502 -2.021  1.000 31.592  0 414  LYS   A CB   1 ? 1 
ATOM   5512  C  CG   . LYS   A  1  359 ? -2.096  -30.442 -3.337  1.000 29.927  0 414  LYS   A CG   1 ? 1 
ATOM   5513  C  CD   . LYS   A  1  359 ? -2.286  -31.646 -4.215  1.000 30.190  0 414  LYS   A CD   1 ? 1 
ATOM   5514  C  CE   . LYS   A  1  359 ? -1.494  -31.579 -5.495  1.000 39.762  0 414  LYS   A CE   1 ? 1 
ATOM   5515  N  NZ   . LYS   A  1  359 ? -2.131  -30.699 -6.493  1.000 42.944  0 414  LYS   A NZ   1 ? 1 
ATOM   5516  H  H    . LYS   A  1  359 ? -4.266  -28.210 -1.972  1.000 31.802  0 414  LYS   A H    1 c 1 
ATOM   5517  H  HA   . LYS   A  1  359 ? -4.744  -30.779 -2.948  1.000 30.538  0 414  LYS   A HA   1 c 1 
ATOM   5518  H  HB2  . LYS   A  1  359 ? -2.534  -29.834 -1.402  1.000 30.261  0 414  LYS   A HB2  1 c 1 
ATOM   5519  H  HB3  . LYS   A  1  359 ? -2.770  -31.386 -1.617  1.000 31.176  0 414  LYS   A HB3  1 c 1 
ATOM   5520  H  HG2  . LYS   A  1  359 ? -2.363  -29.641 -3.832  1.000 29.693  0 414  LYS   A HG2  1 c 1 
ATOM   5521  H  HG3  . LYS   A  1  359 ? -1.146  -30.356 -3.120  1.000 30.103  0 414  LYS   A HG3  1 c 1 
ATOM   5522  H  HD2  . LYS   A  1  359 ? -2.017  -32.448 -3.719  1.000 32.667  0 414  LYS   A HD2  1 c 1 
ATOM   5523  H  HD3  . LYS   A  1  359 ? -3.238  -31.733 -4.436  1.000 32.262  0 414  LYS   A HD3  1 c 1 
ATOM   5524  H  HE2  . LYS   A  1  359 ? -0.599  -31.244 -5.305  1.000 37.575  0 414  LYS   A HE2  1 c 1 
ATOM   5525  H  HE3  . LYS   A  1  359 ? -1.408  -32.474 -5.873  1.000 38.443  0 414  LYS   A HE3  1 c 1 
ATOM   5526  H  HZ1  . LYS   A  1  359 ? -2.176  -29.852 -6.173  1.000 41.055  0 414  LYS   A HZ1  1 c 1 
ATOM   5527  H  HZ2  . LYS   A  1  359 ? -2.970  -30.994 -6.672  1.000 41.809  0 414  LYS   A HZ2  1 c 1 
ATOM   5528  H  HZ3  . LYS   A  1  359 ? -1.646  -30.702 -7.259  1.000 41.762  0 414  LYS   A HZ3  1 c 1 
ATOM   5529  N  N    . LYS   A  1  360 ? -5.499  -29.853 -0.016  1.000 32.985  0 415  LYS   A N    1 ? 1 
ATOM   5530  C  CA   . LYS   A  1  360 ? -6.180  -30.289 1.194   1.000 36.719  0 415  LYS   A CA   1 ? 1 
ATOM   5531  C  C    . LYS   A  1  360 ? -7.410  -29.421 1.399   1.000 33.138  0 415  LYS   A C    1 ? 1 
ATOM   5532  O  O    . LYS   A  1  360 ? -7.378  -28.253 1.043   1.000 33.528  0 415  LYS   A O    1 ? 1 
ATOM   5533  C  CB   . LYS   A  1  360 ? -5.256  -30.244 2.428   1.000 37.268  0 415  LYS   A CB   1 ? 1 
ATOM   5534  C  CG   . LYS   A  1  360 ? -4.036  -31.167 2.295   1.000 59.522  0 415  LYS   A CG   1 ? 1 
ATOM   5535  C  CD   . LYS   A  1  360 ? -3.582  -31.778 3.654   1.000 70.652  0 415  LYS   A CD   1 ? 1 
ATOM   5536  C  CE   . LYS   A  1  360 ? -2.179  -32.340 3.621   1.000 64.919  0 415  LYS   A CE   1 ? 1 
ATOM   5537  N  NZ   . LYS   A  1  360 ? -2.021  -33.409 2.608   1.000 70.134  0 415  LYS   A NZ   1 ? 1 
ATOM   5538  H  H    . LYS   A  1  360 ? -5.323  -28.965 -0.135  1.000 32.079  0 415  LYS   A H    1 c 1 
ATOM   5539  H  HA   . LYS   A  1  360 ? -6.474  -31.218 1.062   1.000 36.287  0 415  LYS   A HA   1 c 1 
ATOM   5540  H  HB2  . LYS   A  1  360 ? -4.946  -29.323 2.558   1.000 40.510  0 415  LYS   A HB2  1 c 1 
ATOM   5541  H  HB3  . LYS   A  1  360 ? -5.771  -30.507 3.219   1.000 41.435  0 415  LYS   A HB3  1 c 1 
ATOM   5542  H  HG2  . LYS   A  1  360 ? -4.255  -31.895 1.675   1.000 54.868  0 415  LYS   A HG2  1 c 1 
ATOM   5543  H  HG3  . LYS   A  1  360 ? -3.292  -30.656 1.909   1.000 54.496  0 415  LYS   A HG3  1 c 1 
ATOM   5544  H  HD2  . LYS   A  1  360 ? -3.628  -31.084 4.346   1.000 66.359  0 415  LYS   A HD2  1 c 1 
ATOM   5545  H  HD3  . LYS   A  1  360 ? -4.203  -32.494 3.904   1.000 67.213  0 415  LYS   A HD3  1 c 1 
ATOM   5546  H  HE2  . LYS   A  1  360 ? -1.547  -31.623 3.423   1.000 66.838  0 415  LYS   A HE2  1 c 1 
ATOM   5547  H  HE3  . LYS   A  1  360 ? -1.955  -32.703 4.499   1.000 67.660  0 415  LYS   A HE3  1 c 1 
ATOM   5548  H  HZ1  . LYS   A  1  360 ? -2.022  -33.048 1.776   1.000 68.310  0 415  LYS   A HZ1  1 c 1 
ATOM   5549  H  HZ2  . LYS   A  1  360 ? -2.704  -34.002 2.677   1.000 69.075  0 415  LYS   A HZ2  1 c 1 
ATOM   5550  H  HZ3  . LYS   A  1  360 ? -1.236  -33.844 2.740   1.000 68.974  0 415  LYS   A HZ3  1 c 1 
ATOM   5551  N  N    . PRO   A  1  361 ? -8.515  -29.951 1.976   1.000 53.720  0 416  PRO   A N    1 ? 1 
ATOM   5552  C  CA   . PRO   A  1  361 ? -9.766  -29.191 2.072   1.000 49.670  0 416  PRO   A CA   1 ? 1 
ATOM   5553  C  C    . PRO   A  1  361 ? -9.599  -27.843 2.767   1.000 43.424  0 416  PRO   A C    1 ? 1 
ATOM   5554  O  O    . PRO   A  1  361 ? -10.199 -26.854 2.364   1.000 58.094  0 416  PRO   A O    1 ? 1 
ATOM   5555  C  CB   . PRO   A  1  361 ? -10.684 -30.107 2.896   1.000 48.437  0 416  PRO   A CB   1 ? 1 
ATOM   5556  C  CG   . PRO   A  1  361 ? -10.054 -31.478 2.837   1.000 56.909  0 416  PRO   A CG   1 ? 1 
ATOM   5557  C  CD   . PRO   A  1  361 ? -8.591  -31.278 2.617   1.000 59.870  0 416  PRO   A CD   1 ? 1 
ATOM   5558  H  HA   . PRO   A  1  361 ? -10.147 -29.065 1.167   1.000 48.817  0 416  PRO   A HA   1 c 1 
ATOM   5559  H  HB2  . PRO   A  1  361 ? -10.744 -29.796 3.824   1.000 50.456  0 416  PRO   A HB2  1 c 1 
ATOM   5560  H  HB3  . PRO   A  1  361 ? -11.587 -30.127 2.513   1.000 50.683  0 416  PRO   A HB3  1 c 1 
ATOM   5561  H  HG2  . PRO   A  1  361 ? -10.209 -31.960 3.675   1.000 56.149  0 416  PRO   A HG2  1 c 1 
ATOM   5562  H  HG3  . PRO   A  1  361 ? -10.441 -31.999 2.104   1.000 56.019  0 416  PRO   A HG3  1 c 1 
ATOM   5563  H  HD2  . PRO   A  1  361 ? -8.104  -31.287 3.461   1.000 57.796  0 416  PRO   A HD2  1 c 1 
ATOM   5564  H  HD3  . PRO   A  1  361 ? -8.230  -31.971 2.034   1.000 57.764  0 416  PRO   A HD3  1 c 1 
ATOM   5565  N  N    . ASP   A  1  362 ? -8.776  -27.823 3.813   1.000 34.586  0 417  ASP   A N    1 ? 1 
ATOM   5566  C  CA   . ASP   A  1  362 ? -8.709  -26.689 4.713   1.000 51.947  0 417  ASP   A CA   1 ? 1 
ATOM   5567  C  C    . ASP   A  1  362 ? -7.367  -25.956 4.603   1.000 39.704  0 417  ASP   A C    1 ? 1 
ATOM   5568  O  O    . ASP   A  1  362 ? -7.046  -25.146 5.464   1.000 42.889  0 417  ASP   A O    1 ? 1 
ATOM   5569  C  CB   . ASP   A  1  362 ? -9.004  -27.213 6.138   1.000 56.769  0 417  ASP   A CB   1 ? 1 
ATOM   5570  C  CG   . ASP   A  1  362 ? -8.272  -28.505 6.563   1.000 99.598  0 417  ASP   A CG   1 ? 1 
ATOM   5571  O  OD1  . ASP   A  1  362 ? -7.558  -29.094 5.724   1.000 66.300  0 417  ASP   A OD1  1 ? 1 
ATOM   5572  O  OD2  . ASP   A  1  362 ? -8.418  -28.920 7.736   1.000 93.944  0 417  ASP   A OD2  1 ? 1 
ATOM   5573  H  H    . ASP   A  1  362 ? -8.230  -28.540 3.968   1.000 40.555  0 417  ASP   A H    1 c 1 
ATOM   5574  H  HA   . ASP   A  1  362 ? -9.426  -26.058 4.470   1.000 45.776  0 417  ASP   A HA   1 c 1 
ATOM   5575  H  HB2  . ASP   A  1  362 ? -8.772  -26.513 6.782   1.000 62.733  0 417  ASP   A HB2  1 c 1 
ATOM   5576  H  HB3  . ASP   A  1  362 ? -9.966  -27.380 6.211   1.000 63.411  0 417  ASP   A HB3  1 c 1 
ATOM   5577  N  N    . GLN   A  1  363 ? -6.638  -26.218 3.504   1.000 28.079  0 418  GLN   A N    1 ? 1 
ATOM   5578  C  CA   . GLN   A  1  363 ? -5.277  -25.761 3.277   1.000 25.066  0 418  GLN   A CA   1 ? 1 
ATOM   5579  C  C    . GLN   A  1  363 ? -5.084  -24.300 3.678   1.000 30.925  0 418  GLN   A C    1 ? 1 
ATOM   5580  O  O    . GLN   A  1  363 ? -5.755  -23.422 3.158   1.000 31.241  0 418  GLN   A O    1 ? 1 
ATOM   5581  C  CB   . GLN   A  1  363 ? -4.926  -25.923 1.791   1.000 26.172  0 418  GLN   A CB   1 ? 1 
ATOM   5582  C  CG   . GLN   A  1  363 ? -3.488  -25.784 1.475   1.000 24.852  0 418  GLN   A CG   1 ? 1 
ATOM   5583  C  CD   . GLN   A  1  363 ? -3.132  -26.193 0.074   1.000 24.925  0 418  GLN   A CD   1 ? 1 
ATOM   5584  O  OE1  . GLN   A  1  363 ? -3.500  -27.285 -0.410  1.000 28.307  0 418  GLN   A OE1  1 ? 1 
ATOM   5585  N  NE2  . GLN   A  1  363 ? -2.350  -25.368 -0.578  1.000 27.789  0 418  GLN   A NE2  1 ? 1 
ATOM   5586  H  H    . GLN   A  1  363 ? -7.031  -26.712 2.844   1.000 29.987  0 418  GLN   A H    1 c 1 
ATOM   5587  H  HA   . GLN   A  1  363 ? -4.668  -26.321 3.812   1.000 27.121  0 418  GLN   A HA   1 c 1 
ATOM   5588  H  HB2  . GLN   A  1  363 ? -5.227  -26.808 1.500   1.000 26.148  0 418  GLN   A HB2  1 c 1 
ATOM   5589  H  HB3  . GLN   A  1  363 ? -5.429  -25.256 1.280   1.000 25.353  0 418  GLN   A HB3  1 c 1 
ATOM   5590  H  HG2  . GLN   A  1  363 ? -3.224  -24.852 1.610   1.000 24.636  0 418  GLN   A HG2  1 c 1 
ATOM   5591  H  HG3  . GLN   A  1  363 ? -2.971  -26.331 2.103   1.000 25.416  0 418  GLN   A HG3  1 c 1 
ATOM   5592  H  HE21 . GLN   A  1  363 ? -1.948  -24.704 -0.153  1.000 26.345  0 418  GLN   A HE21 1 c 1 
ATOM   5593  H  HE22 . GLN   A  1  363 ? -2.220  -25.476 -1.447  1.000 26.717  0 418  GLN   A HE22 1 c 1 
ATOM   5594  N  N    . HIS   A  1  364 ? -4.130  -24.024 4.576   1.000 23.989  0 419  HIS   A N    1 ? 1 
ATOM   5595  C  CA   . HIS   A  1  364 ? -4.013  -22.685 5.117   1.000 20.466  0 419  HIS   A CA   1 ? 1 
ATOM   5596  C  C    . HIS   A  1  364 ? -2.875  -21.891 4.478   1.000 21.987  0 419  HIS   A C    1 ? 1 
ATOM   5597  O  O    . HIS   A  1  364 ? -2.290  -21.012 5.115   1.000 22.051  0 419  HIS   A O    1 ? 1 
ATOM   5598  C  CB   . HIS   A  1  364 ? -3.861  -22.763 6.643   1.000 21.317  0 419  HIS   A CB   1 ? 1 
ATOM   5599  C  CG   . HIS   A  1  364 ? -5.008  -23.450 7.317   1.000 22.609  0 419  HIS   A CG   1 ? 1 
ATOM   5600  N  ND1  . HIS   A  1  364 ? -6.213  -22.793 7.550   1.000 23.274  0 419  HIS   A ND1  1 ? 1 
ATOM   5601  C  CD2  . HIS   A  1  364 ? -5.105  -24.713 7.784   1.000 23.680  0 419  HIS   A CD2  1 ? 1 
ATOM   5602  C  CE1  . HIS   A  1  364 ? -7.008  -23.681 8.127   1.000 21.326  0 419  HIS   A CE1  1 ? 1 
ATOM   5603  N  NE2  . HIS   A  1  364 ? -6.380  -24.857 8.270   1.000 24.854  0 419  HIS   A NE2  1 ? 1 
ATOM   5604  H  H    . HIS   A  1  364 ? -3.549  -24.674 4.851   1.000 24.931  0 419  HIS   A H    1 c 1 
ATOM   5605  H  HA   . HIS   A  1  364 ? -4.856  -22.215 4.928   1.000 21.519  0 419  HIS   A HA   1 c 1 
ATOM   5606  H  HB2  . HIS   A  1  364 ? -3.035  -23.244 6.854   1.000 21.570  0 419  HIS   A HB2  1 c 1 
ATOM   5607  H  HB3  . HIS   A  1  364 ? -3.784  -21.855 7.000   1.000 21.007  0 419  HIS   A HB3  1 c 1 
ATOM   5608  H  HD1  . HIS   A  1  364 ? -6.402  -21.974 7.344   0.000 12.160  0 419  HIS   A HD1  1 c 1 
ATOM   5609  H  HD2  . HIS   A  1  364 ? -4.438  -25.380 7.740   1.000 24.071  0 419  HIS   A HD2  1 c 1 
ATOM   5610  H  HE1  . HIS   A  1  364 ? -7.894  -23.509 8.401   1.000 22.648  0 419  HIS   A HE1  1 c 1 
ATOM   5611  H  HE2  . HIS   A  1  364 ? -6.721  -25.608 8.639   0.000 12.720  0 419  HIS   A HE2  1 c 1 
ATOM   5612  N  N    . PHE   A  1  365 ? -2.535  -22.216 3.227   1.000 19.344  0 420  PHE   A N    1 ? 1 
ATOM   5613  C  CA   . PHE   A  1  365 ? -1.631  -21.373 2.453   1.000 20.358  0 420  PHE   A CA   1 ? 1 
ATOM   5614  C  C    . PHE   A  1  365 ? -1.951  -21.568 0.975   1.000 19.648  0 420  PHE   A C    1 ? 1 
ATOM   5615  O  O    . PHE   A  1  365 ? -2.535  -22.581 0.609   1.000 18.631  0 420  PHE   A O    1 ? 1 
ATOM   5616  C  CB   . PHE   A  1  365 ? -0.143  -21.731 2.746   1.000 19.279  0 420  PHE   A CB   1 ? 1 
ATOM   5617  C  CG   . PHE   A  1  365 ? 0.279   -23.077 2.206   1.000 20.313  0 420  PHE   A CG   1 ? 1 
ATOM   5618  C  CD1  . PHE   A  1  365 ? 0.655   -23.226 0.873   1.000 28.635  0 420  PHE   A CD1  1 ? 1 
ATOM   5619  C  CD2  . PHE   A  1  365 ? 0.231   -24.211 3.004   1.000 21.984  0 420  PHE   A CD2  1 ? 1 
ATOM   5620  C  CE1  . PHE   A  1  365 ? 0.990   -24.478 0.358   1.000 29.753  0 420  PHE   A CE1  1 ? 1 
ATOM   5621  C  CE2  . PHE   A  1  365 ? 0.573   -25.473 2.485   1.000 22.666  0 420  PHE   A CE2  1 ? 1 
ATOM   5622  C  CZ   . PHE   A  1  365 ? 0.940   -25.602 1.163   1.000 26.150  0 420  PHE   A CZ   1 ? 1 
ATOM   5623  H  H    . PHE   A  1  365 ? -2.865  -22.977 2.845   1.000 20.648  0 420  PHE   A H    1 c 1 
ATOM   5624  H  HA   . PHE   A  1  365 ? -1.790  -20.426 2.692   1.000 19.352  0 420  PHE   A HA   1 c 1 
ATOM   5625  H  HB2  . PHE   A  1  365 ? 0.427   -21.038 2.354   1.000 19.353  0 420  PHE   A HB2  1 c 1 
ATOM   5626  H  HB3  . PHE   A  1  365 ? -0.006  -21.721 3.717   1.000 19.744  0 420  PHE   A HB3  1 c 1 
ATOM   5627  H  HD1  . PHE   A  1  365 ? 0.675   -22.469 0.309   1.000 25.820  0 420  PHE   A HD1  1 c 1 
ATOM   5628  H  HD2  . PHE   A  1  365 ? -0.038  -24.134 3.905   1.000 21.872  0 420  PHE   A HD2  1 c 1 
ATOM   5629  H  HE1  . PHE   A  1  365 ? 1.253   -24.557 -0.543  1.000 28.367  0 420  PHE   A HE1  1 c 1 
ATOM   5630  H  HE2  . PHE   A  1  365 ? 0.546   -26.233 3.043   1.000 23.907  0 420  PHE   A HE2  1 c 1 
ATOM   5631  H  HZ   . PHE   A  1  365 ? 1.191   -26.445 0.819   1.000 26.483  0 420  PHE   A HZ   1 c 1 
ATOM   5632  N  N    . LYS   A  1  366 ? -1.585  -20.585 0.150   1.000 18.268  0 421  LYS   A N    1 ? 1 
ATOM   5633  C  CA   . LYS   A  1  366 ? -1.745  -20.675 -1.294  1.000 21.852  0 421  LYS   A CA   1 ? 1 
ATOM   5634  C  C    . LYS   A  1  366 ? -0.407  -20.331 -1.936  1.000 19.643  0 421  LYS   A C    1 ? 1 
ATOM   5635  O  O    . LYS   A  1  366 ? 0.207   -19.351 -1.568  1.000 14.136  0 421  LYS   A O    1 ? 1 
ATOM   5636  C  CB   . LYS   A  1  366 ? -2.822  -19.739 -1.844  1.000 17.861  0 421  LYS   A CB   1 ? 1 
ATOM   5637  C  CG   . LYS   A  1  366 ? -3.124  -19.931 -3.327  1.000 18.293  0 421  LYS   A CG   1 ? 1 
ATOM   5638  C  CD   . LYS   A  1  366 ? -4.338  -19.108 -3.828  1.000 17.948  0 421  LYS   A CD   1 ? 1 
ATOM   5639  C  CE   . LYS   A  1  366 ? -5.614  -19.436 -3.134  1.000 20.841  0 421  LYS   A CE   1 ? 1 
ATOM   5640  N  NZ   . LYS   A  1  366 ? -5.919  -20.858 -3.254  1.000 22.367  0 421  LYS   A NZ   1 ? 1 
ATOM   5641  H  H    . LYS   A  1  366 ? -1.219  -19.824 0.501   1.000 18.940  0 421  LYS   A H    1 c 1 
ATOM   5642  H  HA   . LYS   A  1  366 ? -1.983  -21.599 -1.524  1.000 20.327  0 421  LYS   A HA   1 c 1 
ATOM   5643  H  HB2  . LYS   A  1  366 ? -3.645  -19.882 -1.333  1.000 18.788  0 421  LYS   A HB2  1 c 1 
ATOM   5644  H  HB3  . LYS   A  1  366 ? -2.535  -18.813 -1.699  1.000 18.334  0 421  LYS   A HB3  1 c 1 
ATOM   5645  H  HG2  . LYS   A  1  366 ? -2.332  -19.673 -3.846  1.000 18.117  0 421  LYS   A HG2  1 c 1 
ATOM   5646  H  HG3  . LYS   A  1  366 ? -3.293  -20.882 -3.494  1.000 18.652  0 421  LYS   A HG3  1 c 1 
ATOM   5647  H  HD2  . LYS   A  1  366 ? -4.148  -18.156 -3.698  1.000 18.254  0 421  LYS   A HD2  1 c 1 
ATOM   5648  H  HD3  . LYS   A  1  366 ? -4.452  -19.262 -4.790  1.000 18.675  0 421  LYS   A HD3  1 c 1 
ATOM   5649  H  HE2  . LYS   A  1  366 ? -5.549  -19.199 -2.190  1.000 20.248  0 421  LYS   A HE2  1 c 1 
ATOM   5650  H  HE3  . LYS   A  1  366 ? -6.343  -18.919 -3.527  1.000 20.240  0 421  LYS   A HE3  1 c 1 
ATOM   5651  H  HZ1  . LYS   A  1  366 ? -5.462  -21.326 -2.626  1.000 22.162  0 421  LYS   A HZ1  1 c 1 
ATOM   5652  H  HZ2  . LYS   A  1  366 ? -5.687  -21.157 -4.079  1.000 22.129  0 421  LYS   A HZ2  1 c 1 
ATOM   5653  H  HZ3  . LYS   A  1  366 ? -6.808  -20.992 -3.132  1.000 22.185  0 421  LYS   A HZ3  1 c 1 
ATOM   5654  N  N    . PRO   A  1  367 ? 0.100   -21.177 -2.854  1.000 20.806  0 422  PRO   A N    1 ? 1 
ATOM   5655  C  CA   . PRO   A  1  367 ? 1.337   -20.891 -3.583  1.000 19.091  0 422  PRO   A CA   1 ? 1 
ATOM   5656  C  C    . PRO   A  1  367 ? 1.080   -20.029 -4.804  1.000 24.609  0 422  PRO   A C    1 ? 1 
ATOM   5657  O  O    . PRO   A  1  367 ? 0.056   -20.175 -5.445  1.000 19.804  0 422  PRO   A O    1 ? 1 
ATOM   5658  C  CB   . PRO   A  1  367 ? 1.807   -22.283 -4.024  1.000 20.822  0 422  PRO   A CB   1 ? 1 
ATOM   5659  C  CG   . PRO   A  1  367 ? 0.539   -23.034 -4.240  1.000 24.277  0 422  PRO   A CG   1 ? 1 
ATOM   5660  C  CD   . PRO   A  1  367 ? -0.447  -22.508 -3.164  1.000 17.997  0 422  PRO   A CD   1 ? 1 
ATOM   5661  H  HA   . PRO   A  1  367 ? 2.004   -20.476 -2.982  1.000 20.361  0 422  PRO   A HA   1 c 1 
ATOM   5662  H  HB2  . PRO   A  1  367 ? 2.331   -22.234 -4.851  1.000 21.428  0 422  PRO   A HB2  1 c 1 
ATOM   5663  H  HB3  . PRO   A  1  367 ? 2.352   -22.708 -3.327  1.000 21.477  0 422  PRO   A HB3  1 c 1 
ATOM   5664  H  HG2  . PRO   A  1  367 ? 0.188   -22.867 -5.139  1.000 21.904  0 422  PRO   A HG2  1 c 1 
ATOM   5665  H  HG3  . PRO   A  1  367 ? 0.682   -23.995 -4.134  1.000 22.431  0 422  PRO   A HG3  1 c 1 
ATOM   5666  H  HD2  . PRO   A  1  367 ? -1.353  -22.444 -3.518  1.000 19.816  0 422  PRO   A HD2  1 c 1 
ATOM   5667  H  HD3  . PRO   A  1  367 ? -0.449  -23.082 -2.376  1.000 20.099  0 422  PRO   A HD3  1 c 1 
ATOM   5668  N  N    . TYR   A  1  368 ? 2.067   -19.217 -5.155  1.000 21.416  0 423  TYR   A N    1 ? 1 
ATOM   5669  C  CA   . TYR   A  1  368 ? 1.983   -18.306 -6.273  1.000 18.322  0 423  TYR   A CA   1 ? 1 
ATOM   5670  C  C    . TYR   A  1  368 ? 3.376   -18.200 -6.858  1.000 20.883  0 423  TYR   A C    1 ? 1 
ATOM   5671  O  O    . TYR   A  1  368 ? 4.351   -18.209 -6.119  1.000 23.041  0 423  TYR   A O    1 ? 1 
ATOM   5672  C  CB   . TYR   A  1  368 ? 1.568   -16.881 -5.828  1.000 17.120  0 423  TYR   A CB   1 ? 1 
ATOM   5673  C  CG   . TYR   A  1  368 ? 0.128   -16.637 -5.479  1.000 16.796  0 423  TYR   A CG   1 ? 1 
ATOM   5674  C  CD1  . TYR   A  1  368 ? -0.354  -16.896 -4.217  1.000 16.781  0 423  TYR   A CD1  1 ? 1 
ATOM   5675  C  CD2  . TYR   A  1  368 ? -0.745  -16.076 -6.406  1.000 19.264  0 423  TYR   A CD2  1 ? 1 
ATOM   5676  C  CE1  . TYR   A  1  368 ? -1.687  -16.636 -3.887  1.000 20.457  0 423  TYR   A CE1  1 ? 1 
ATOM   5677  C  CE2  . TYR   A  1  368 ? -2.060  -15.770 -6.078  1.000 16.663  0 423  TYR   A CE2  1 ? 1 
ATOM   5678  C  CZ   . TYR   A  1  368 ? -2.535  -16.073 -4.821  1.000 21.708  0 423  TYR   A CZ   1 ? 1 
ATOM   5679  O  OH   . TYR   A  1  368 ? -3.835  -15.791 -4.501  1.000 22.505  0 423  TYR   A OH   1 ? 1 
ATOM   5680  H  H    . TYR   A  1  368 ? 2.839   -19.230 -4.665  1.000 21.352  0 423  TYR   A H    1 c 1 
ATOM   5681  H  HA   . TYR   A  1  368 ? 1.354   -18.652 -6.956  1.000 19.279  0 423  TYR   A HA   1 c 1 
ATOM   5682  H  HB2  . TYR   A  1  368 ? 2.112   -16.645 -5.048  1.000 17.154  0 423  TYR   A HB2  1 c 1 
ATOM   5683  H  HB3  . TYR   A  1  368 ? 1.813   -16.263 -6.546  1.000 17.166  0 423  TYR   A HB3  1 c 1 
ATOM   5684  H  HD1  . TYR   A  1  368 ? 0.217   -17.279 -3.571  1.000 17.727  0 423  TYR   A HD1  1 c 1 
ATOM   5685  H  HD2  . TYR   A  1  368 ? -0.425  -15.857 -7.265  1.000 18.054  0 423  TYR   A HD2  1 c 1 
ATOM   5686  H  HE1  . TYR   A  1  368 ? -2.004  -16.826 -3.020  1.000 19.744  0 423  TYR   A HE1  1 c 1 
ATOM   5687  H  HE2  . TYR   A  1  368 ? -2.637  -15.402 -6.726  1.000 18.243  0 423  TYR   A HE2  1 c 1 
ATOM   5688  H  HH   . TYR   A  1  368 ? -4.140  -15.975 -3.717  0.000 15.940  0 423  TYR   A HH   1 c 1 
ATOM   5689  N  N    . MET   A  1  369 ? 3.476   -18.060 -8.172  1.000 18.796  0 424  MET   A N    1 ? 1 
ATOM   5690  C  CA   . MET   A  1  369 ? 4.615   -17.367 -8.743  1.000 22.337  0 424  MET   A CA   1 ? 1 
ATOM   5691  C  C    . MET   A  1  369 ? 4.434   -15.895 -8.372  1.000 22.631  0 424  MET   A C    1 ? 1 
ATOM   5692  O  O    . MET   A  1  369 ? 3.317   -15.382 -8.330  1.000 20.345  0 424  MET   A O    1 ? 1 
ATOM   5693  C  CB   . MET   A  1  369 ? 4.669   -17.618 -10.220 1.000 26.625  0 424  MET   A CB   1 ? 1 
ATOM   5694  C  CG   . MET   A  1  369 ? 4.924   -19.116 -10.545 1.000 33.041  0 424  MET   A CG   1 ? 1 
ATOM   5695  S  SD   . MET   A  1  369 ? 6.583   -19.776 -10.057 1.000 34.733  0 424  MET   A SD   1 ? 1 
ATOM   5696  C  CE   . MET   A  1  369 ? 7.593   -19.023 -11.204 1.000 44.176  0 424  MET   A CE   1 ? 1 
ATOM   5697  H  H    . MET   A  1  369 ? 2.828   -18.393 -8.723  1.000 20.302  0 424  MET   A H    1 c 1 
ATOM   5698  H  HA   . MET   A  1  369 ? 5.433   -17.706 -8.320  1.000 22.550  0 424  MET   A HA   1 c 1 
ATOM   5699  H  HB2  . MET   A  1  369 ? 3.824   -17.338 -10.624 1.000 26.531  0 424  MET   A HB2  1 c 1 
ATOM   5700  H  HB3  . MET   A  1  369 ? 5.385   -17.077 -10.609 1.000 26.886  0 424  MET   A HB3  1 c 1 
ATOM   5701  H  HG2  . MET   A  1  369 ? 4.237   -19.656 -10.099 1.000 31.537  0 424  MET   A HG2  1 c 1 
ATOM   5702  H  HG3  . MET   A  1  369 ? 4.816   -19.247 -11.511 1.000 31.880  0 424  MET   A HG3  1 c 1 
ATOM   5703  H  HE1  . MET   A  1  369 ? 7.317   -19.281 -12.092 1.000 41.600  0 424  MET   A HE1  1 c 1 
ATOM   5704  H  HE2  . MET   A  1  369 ? 7.525   -18.065 -11.111 1.000 41.024  0 424  MET   A HE2  1 c 1 
ATOM   5705  H  HE3  . MET   A  1  369 ? 8.506   -19.298 -11.057 1.000 41.697  0 424  MET   A HE3  1 c 1 
ATOM   5706  N  N    . LYS   A  1  370 ? 5.534   -15.195 -8.081  1.000 18.659  0 425  LYS   A N    1 ? 1 
ATOM   5707  C  CA   . LYS   A  1  370 ? 5.419   -13.871 -7.513  1.000 16.164  0 425  LYS   A CA   1 ? 1 
ATOM   5708  C  C    . LYS   A  1  370 ? 4.672   -12.913 -8.422  1.000 16.108  0 425  LYS   A C    1 ? 1 
ATOM   5709  O  O    . LYS   A  1  370 ? 3.899   -12.089 -7.934  1.000 21.021  0 425  LYS   A O    1 ? 1 
ATOM   5710  C  CB   . LYS   A  1  370 ? 6.819   -13.324 -7.088  1.000 20.304  0 425  LYS   A CB   1 ? 1 
ATOM   5711  C  CG   . LYS   A  1  370 ? 7.867   -13.296 -8.179  1.000 21.954  0 425  LYS   A CG   1 ? 1 
ATOM   5712  C  CD   . LYS   A  1  370 ? 9.152   -12.646 -7.693  1.000 17.790  0 425  LYS   A CD   1 ? 1 
ATOM   5713  C  CE   . LYS   A  1  370 ? 10.247  -12.524 -8.726  1.000 17.384  0 425  LYS   A CE   1 ? 1 
ATOM   5714  N  NZ   . LYS   A  1  370 ? 11.331  -11.687 -8.195  1.000 19.023  0 425  LYS   A NZ   1 ? 1 
ATOM   5715  H  H    . LYS   A  1  370 ? 6.361   -15.553 -8.231  1.000 19.320  0 425  LYS   A H    1 c 1 
ATOM   5716  H  HA   . LYS   A  1  370 ? 4.884   -13.962 -6.691  1.000 17.128  0 425  LYS   A HA   1 c 1 
ATOM   5717  H  HB2  . LYS   A  1  370 ? 6.703   -12.412 -6.747  1.000 19.230  0 425  LYS   A HB2  1 c 1 
ATOM   5718  H  HB3  . LYS   A  1  370 ? 7.154   -13.875 -6.350  1.000 19.657  0 425  LYS   A HB3  1 c 1 
ATOM   5719  H  HG2  . LYS   A  1  370 ? 8.056   -14.212 -8.471  1.000 20.878  0 425  LYS   A HG2  1 c 1 
ATOM   5720  H  HG3  . LYS   A  1  370 ? 7.520   -12.796 -8.947  1.000 20.460  0 425  LYS   A HG3  1 c 1 
ATOM   5721  H  HD2  . LYS   A  1  370 ? 8.941   -11.749 -7.359  1.000 18.099  0 425  LYS   A HD2  1 c 1 
ATOM   5722  H  HD3  . LYS   A  1  370 ? 9.498   -13.166 -6.938  1.000 18.544  0 425  LYS   A HD3  1 c 1 
ATOM   5723  H  HE2  . LYS   A  1  370 ? 10.598  -13.406 -8.945  1.000 18.366  0 425  LYS   A HE2  1 c 1 
ATOM   5724  H  HE3  . LYS   A  1  370 ? 9.894   -12.120 -9.541  1.000 17.881  0 425  LYS   A HE3  1 c 1 
ATOM   5725  H  HZ1  . LYS   A  1  370 ? 11.651  -12.049 -7.428  1.000 18.599  0 425  LYS   A HZ1  1 c 1 
ATOM   5726  H  HZ2  . LYS   A  1  370 ? 11.020  -10.853 -8.024  1.000 18.202  0 425  LYS   A HZ2  1 c 1 
ATOM   5727  H  HZ3  . LYS   A  1  370 ? 12.004  -11.635 -8.802  1.000 18.799  0 425  LYS   A HZ3  1 c 1 
ATOM   5728  N  N    . GLN   A  1  371 ? 4.815   -13.096 -9.746  1.000 23.058  0 426  GLN   A N    1 ? 1 
ATOM   5729  C  CA   . GLN   A  1  371 ? 4.136   -12.246 -10.718 1.000 22.331  0 426  GLN   A CA   1 ? 1 
ATOM   5730  C  C    . GLN   A  1  371 ? 2.629   -12.462 -10.745 1.000 20.919  0 426  GLN   A C    1 ? 1 
ATOM   5731  O  O    . GLN   A  1  371 ? 1.891   -11.635 -11.255 1.000 29.302  0 426  GLN   A O    1 ? 1 
ATOM   5732  C  CB   . GLN   A  1  371 ? 4.686   -12.448 -12.145 1.000 31.625  0 426  GLN   A CB   1 ? 1 
ATOM   5733  C  CG   . GLN   A  1  371 ? 4.450   -13.839 -12.727 1.000 43.980  0 426  GLN   A CG   1 ? 1 
ATOM   5734  C  CD   . GLN   A  1  371 ? 5.551   -14.816 -12.379 1.000 53.415  0 426  GLN   A CD   1 ? 1 
ATOM   5735  O  OE1  . GLN   A  1  371 ? 6.411   -14.574 -11.483 1.000 48.798  0 426  GLN   A OE1  1 ? 1 
ATOM   5736  N  NE2  . GLN   A  1  371 ? 5.528   -15.947 -13.093 1.000 57.133  0 426  GLN   A NE2  1 ? 1 
ATOM   5737  H  H    . GLN   A  1  371 ? 5.366   -13.757 -10.049 1.000 21.505  0 426  GLN   A H    1 c 1 
ATOM   5738  H  HA   . GLN   A  1  371 ? 4.302   -11.310 -10.459 1.000 23.255  0 426  GLN   A HA   1 c 1 
ATOM   5739  H  HB2  . GLN   A  1  371 ? 4.265   -11.785 -12.732 1.000 31.280  0 426  GLN   A HB2  1 c 1 
ATOM   5740  H  HB3  . GLN   A  1  371 ? 5.649   -12.264 -12.134 1.000 31.623  0 426  GLN   A HB3  1 c 1 
ATOM   5741  H  HG2  . GLN   A  1  371 ? 3.599   -14.189 -12.394 1.000 42.061  0 426  GLN   A HG2  1 c 1 
ATOM   5742  H  HG3  . GLN   A  1  371 ? 4.383   -13.769 -13.703 1.000 42.737  0 426  GLN   A HG3  1 c 1 
ATOM   5743  H  HE21 . GLN   A  1  371 ? 4.881   -16.089 -13.679 1.000 55.951  0 426  GLN   A HE21 1 c 1 
ATOM   5744  H  HE22 . GLN   A  1  371 ? 6.160   -16.554 -12.980 1.000 56.345  0 426  GLN   A HE22 1 c 1 
ATOM   5745  N  N    . HIS   A  1  372 ? 2.160   -13.577 -10.195 1.000 23.340  0 427  HIS   A N    1 ? 1 
ATOM   5746  C  CA   . HIS   A  1  372 ? 0.726   -13.797 -10.139 1.000 17.300  0 427  HIS   A CA   1 ? 1 
ATOM   5747  C  C    . HIS   A  1  372 ? 0.107   -13.345 -8.829  1.000 17.610  0 427  HIS   A C    1 ? 1 
ATOM   5748  O  O    . HIS   A  1  372 ? -1.097  -13.463 -8.631  1.000 22.643  0 427  HIS   A O    1 ? 1 
ATOM   5749  C  CB   . HIS   A  1  372 ? 0.440   -15.276 -10.397 1.000 26.326  0 427  HIS   A CB   1 ? 1 
ATOM   5750  C  CG   . HIS   A  1  372 ? 0.871   -15.733 -11.754 1.000 23.627  0 427  HIS   A CG   1 ? 1 
ATOM   5751  N  ND1  . HIS   A  1  372 ? 1.236   -17.040 -11.981 1.000 30.830  0 427  HIS   A ND1  1 ? 1 
ATOM   5752  C  CD2  . HIS   A  1  372 ? 1.023   -15.024 -12.899 1.000 28.207  0 427  HIS   A CD2  1 ? 1 
ATOM   5753  C  CE1  . HIS   A  1  372 ? 1.616   -17.087 -13.252 1.000 33.416  0 427  HIS   A CE1  1 ? 1 
ATOM   5754  N  NE2  . HIS   A  1  372 ? 1.490   -15.891 -13.836 1.000 31.005  0 427  HIS   A NE2  1 ? 1 
ATOM   5755  H  H    . HIS   A  1  372 ? 2.726   -14.215 -9.869  1.000 21.420  0 427  HIS   A H    1 c 1 
ATOM   5756  H  HA   . HIS   A  1  372 ? 0.312   -13.279 -10.869 1.000 19.846  0 427  HIS   A HA   1 c 1 
ATOM   5757  H  HB2  . HIS   A  1  372 ? 0.904   -15.810 -9.721  1.000 23.305  0 427  HIS   A HB2  1 c 1 
ATOM   5758  H  HB3  . HIS   A  1  372 ? -0.520  -15.435 -10.302 1.000 23.214  0 427  HIS   A HB3  1 c 1 
ATOM   5759  H  HD1  . HIS   A  1  372 ? 1.240   -17.693 -11.377 0.000 21.940  0 427  HIS   A HD1  1 c 1 
ATOM   5760  H  HD2  . HIS   A  1  372 ? 0.850   -14.102 -13.016 1.000 27.208  0 427  HIS   A HD2  1 c 1 
ATOM   5761  H  HE1  . HIS   A  1  372 ? 1.901   -17.869 -13.694 1.000 32.648  0 427  HIS   A HE1  1 c 1 
ATOM   5762  H  HE2  . HIS   A  1  372 ? 1.698   -15.716 -14.685 0.000 23.010  0 427  HIS   A HE2  1 c 1 
ATOM   5763  N  N    . LEU   A  1  373 ? 0.931   -12.871 -7.896  1.000 16.373  0 428  LEU   A N    1 ? 1 
ATOM   5764  C  CA   . LEU   A  1  373 ? 0.396   -12.360 -6.647  1.000 18.336  0 428  LEU   A CA   1 ? 1 
ATOM   5765  C  C    . LEU   A  1  373 ? -0.469  -11.146 -6.949  1.000 17.499  0 428  LEU   A C    1 ? 1 
ATOM   5766  O  O    . LEU   A  1  373 ? -0.215  -10.417 -7.897  1.000 16.674  0 428  LEU   A O    1 ? 1 
ATOM   5767  C  CB   . LEU   A  1  373 ? 1.515   -11.867 -5.701  1.000 17.816  0 428  LEU   A CB   1 ? 1 
ATOM   5768  C  CG   . LEU   A  1  373 ? 2.316   -12.945 -4.996  1.000 17.575  0 428  LEU   A CG   1 ? 1 
ATOM   5769  C  CD1  . LEU   A  1  373 ? 3.593   -12.322 -4.364  1.000 20.500  0 428  LEU   A CD1  1 ? 1 
ATOM   5770  C  CD2  . LEU   A  1  373 ? 1.475   -13.628 -3.895  1.000 15.211  0 428  LEU   A CD2  1 ? 1 
ATOM   5771  H  H    . LEU   A  1  373 ? 1.835   -12.870 -8.030  1.000 17.231  0 428  LEU   A H    1 c 1 
ATOM   5772  H  HA   . LEU   A  1  373 ? -0.141  -13.059 -6.213  1.000 17.775  0 428  LEU   A HA   1 c 1 
ATOM   5773  H  HB2  . LEU   A  1  373 ? 2.131   -11.313 -6.220  1.000 17.792  0 428  LEU   A HB2  1 c 1 
ATOM   5774  H  HB3  . LEU   A  1  373 ? 1.110   -11.293 -5.021  1.000 17.576  0 428  LEU   A HB3  1 c 1 
ATOM   5775  H  HG   . LEU   A  1  373 ? 2.588   -13.626 -5.659  1.000 17.917  0 428  LEU   A HG   1 c 1 
ATOM   5776  H  HD11 . LEU   A  1  373 ? 4.193   -13.032 -4.076  1.000 19.796  0 428  LEU   A HD11 1 c 1 
ATOM   5777  H  HD12 . LEU   A  1  373 ? 3.344   -11.778 -3.597  1.000 19.356  0 428  LEU   A HD12 1 c 1 
ATOM   5778  H  HD13 . LEU   A  1  373 ? 4.044   -11.765 -5.022  1.000 19.525  0 428  LEU   A HD13 1 c 1 
ATOM   5779  H  HD21 . LEU   A  1  373 ? 0.694   -14.047 -4.296  1.000 15.955  0 428  LEU   A HD21 1 c 1 
ATOM   5780  H  HD22 . LEU   A  1  373 ? 1.189   -12.963 -3.246  1.000 15.636  0 428  LEU   A HD22 1 c 1 
ATOM   5781  H  HD23 . LEU   A  1  373 ? 2.013   -14.305 -3.449  1.000 16.066  0 428  LEU   A HD23 1 c 1 
ATOM   5782  N  N    . PRO   A  1  374 ? -1.449  -10.837 -6.088  1.000 15.275  0 429  PRO   A N    1 ? 1 
ATOM   5783  C  CA   . PRO   A  1  374 ? -2.201  -9.594  -6.227  1.000 14.239  0 429  PRO   A CA   1 ? 1 
ATOM   5784  C  C    . PRO   A  1  374 ? -1.292  -8.385  -6.424  1.000 19.759  0 429  PRO   A C    1 ? 1 
ATOM   5785  O  O    . PRO   A  1  374 ? -0.329  -8.210  -5.690  1.000 20.834  0 429  PRO   A O    1 ? 1 
ATOM   5786  C  CB   . PRO   A  1  374 ? -3.017  -9.536  -4.943  1.000 17.674  0 429  PRO   A CB   1 ? 1 
ATOM   5787  C  CG   . PRO   A  1  374 ? -3.103  -11.021 -4.477  1.000 18.679  0 429  PRO   A CG   1 ? 1 
ATOM   5788  C  CD   . PRO   A  1  374 ? -1.826  -11.653 -4.916  1.000 16.519  0 429  PRO   A CD   1 ? 1 
ATOM   5789  H  HA   . PRO   A  1  374 ? -2.815  -9.677  -6.997  1.000 16.003  0 429  PRO   A HA   1 c 1 
ATOM   5790  H  HB2  . PRO   A  1  374 ? -2.570  -8.984  -4.266  1.000 16.779  0 429  PRO   A HB2  1 c 1 
ATOM   5791  H  HB3  . PRO   A  1  374 ? -3.911  -9.171  -5.111  1.000 16.904  0 429  PRO   A HB3  1 c 1 
ATOM   5792  H  HG2  . PRO   A  1  374 ? -3.195  -11.070 -3.504  1.000 18.025  0 429  PRO   A HG2  1 c 1 
ATOM   5793  H  HG3  . PRO   A  1  374 ? -3.869  -11.469 -4.889  1.000 18.167  0 429  PRO   A HG3  1 c 1 
ATOM   5794  H  HD2  . PRO   A  1  374 ? -1.146  -11.602 -4.218  1.000 16.667  0 429  PRO   A HD2  1 c 1 
ATOM   5795  H  HD3  . PRO   A  1  374 ? -1.963  -12.586 -5.163  1.000 16.960  0 429  PRO   A HD3  1 c 1 
ATOM   5796  N  N    . LYS   A  1  375 ? -1.597  -7.580  -7.453  1.000 18.680  0 430  LYS   A N    1 ? 1 
ATOM   5797  C  CA   . LYS   A  1  375 ? -0.853  -6.374  -7.762  1.000 18.704  0 430  LYS   A CA   1 ? 1 
ATOM   5798  C  C    . LYS   A  1  375 ? -0.796  -5.380  -6.606  1.000 15.903  0 430  LYS   A C    1 ? 1 
ATOM   5799  O  O    . LYS   A  1  375 ? 0.201   -4.674  -6.468  1.000 17.236  0 430  LYS   A O    1 ? 1 
ATOM   5800  C  CB   . LYS   A  1  375 ? -1.487  -5.686  -8.988  1.000 27.259  0 430  LYS   A CB   1 ? 1 
ATOM   5801  C  CG   . LYS   A  1  375 ? -1.446  -6.501  -10.258 1.000 26.390  0 430  LYS   A CG   1 ? 1 
ATOM   5802  C  CD   . LYS   A  1  375 ? -0.057  -7.053  -10.707 1.000 23.753  0 430  LYS   A CD   1 ? 1 
ATOM   5803  C  CE   . LYS   A  1  375 ? 0.749   -6.110  -11.454 1.000 24.322  0 430  LYS   A CE   1 ? 1 
ATOM   5804  N  NZ   . LYS   A  1  375 ? 1.989   -6.762  -11.918 1.000 25.168  0 430  LYS   A NZ   1 ? 1 
ATOM   5805  H  H    . LYS   A  1  375 ? -2.313  -7.795  -7.978  1.000 19.107  0 430  LYS   A H    1 c 1 
ATOM   5806  H  HA   . LYS   A  1  375 ? 0.068   -6.634  -7.987  1.000 19.530  0 430  LYS   A HA   1 c 1 
ATOM   5807  H  HB2  . LYS   A  1  375 ? -2.422  -5.478  -8.780  1.000 24.663  0 430  LYS   A HB2  1 c 1 
ATOM   5808  H  HB3  . LYS   A  1  375 ? -1.020  -4.838  -9.146  1.000 24.611  0 430  LYS   A HB3  1 c 1 
ATOM   5809  H  HG2  . LYS   A  1  375 ? -2.057  -7.261  -10.151 1.000 25.975  0 430  LYS   A HG2  1 c 1 
ATOM   5810  H  HG3  . LYS   A  1  375 ? -1.802  -5.946  -10.984 1.000 25.943  0 430  LYS   A HG3  1 c 1 
ATOM   5811  H  HD2  . LYS   A  1  375 ? 0.446   -7.336  -9.916  1.000 24.302  0 430  LYS   A HD2  1 c 1 
ATOM   5812  H  HD3  . LYS   A  1  375 ? -0.201  -7.847  -11.264 1.000 24.599  0 430  LYS   A HD3  1 c 1 
ATOM   5813  H  HE2  . LYS   A  1  375 ? 0.248   -5.783  -12.225 1.000 24.430  0 430  LYS   A HE2  1 c 1 
ATOM   5814  H  HE3  . LYS   A  1  375 ? 0.977   -5.348  -10.888 1.000 24.168  0 430  LYS   A HE3  1 c 1 
ATOM   5815  H  HZ1  . LYS   A  1  375 ? 1.788   -7.428  -12.500 1.000 25.160  0 430  LYS   A HZ1  1 c 1 
ATOM   5816  H  HZ2  . LYS   A  1  375 ? 2.438   -7.110  -11.211 1.000 24.919  0 430  LYS   A HZ2  1 c 1 
ATOM   5817  H  HZ3  . LYS   A  1  375 ? 2.518   -6.154  -12.334 1.000 25.037  0 430  LYS   A HZ3  1 c 1 
ATOM   5818  N  N    . ARG   A  1  376 ? -1.866  -5.340  -5.790  1.000 14.732  0 431  ARG   A N    1 ? 1 
ATOM   5819  C  CA   . ARG   A  1  376 ? -1.954  -4.469  -4.637  1.000 16.885  0 431  ARG   A CA   1 ? 1 
ATOM   5820  C  C    . ARG   A  1  376 ? -0.829  -4.688  -3.629  1.000 22.749  0 431  ARG   A C    1 ? 1 
ATOM   5821  O  O    . ARG   A  1  376 ? -0.528  -3.797  -2.834  1.000 21.341  0 431  ARG   A O    1 ? 1 
ATOM   5822  C  CB   . ARG   A  1  376 ? -3.313  -4.653  -3.913  1.000 15.042  0 431  ARG   A CB   1 ? 1 
ATOM   5823  C  CG   . ARG   A  1  376 ? -3.555  -6.027  -3.374  1.000 15.178  0 431  ARG   A CG   1 ? 1 
ATOM   5824  C  CD   . ARG   A  1  376 ? -4.885  -6.098  -2.625  1.000 17.545  0 431  ARG   A CD   1 ? 1 
ATOM   5825  N  NE   . ARG   A  1  376 ? -5.233  -7.461  -2.226  1.000 17.507  0 431  ARG   A NE   1 ? 1 
ATOM   5826  C  CZ   . ARG   A  1  376 ? -4.694  -8.134  -1.214  1.000 20.531  0 431  ARG   A CZ   1 ? 1 
ATOM   5827  N  NH1  . ARG   A  1  376 ? -3.981  -7.526  -0.279  1.000 23.222  0 431  ARG   A NH1  1 ? 1 
ATOM   5828  N  NH2  . ARG   A  1  376 ? -4.907  -9.446  -1.118  1.000 16.212  0 431  ARG   A NH2  1 ? 1 
ATOM   5829  H  H    . ARG   A  1  376 ? -2.582  -5.875  -5.983  1.000 15.616  0 431  ARG   A H    1 c 1 
ATOM   5830  H  HA   . ARG   A  1  376 ? -1.900  -3.540  -4.959  1.000 16.893  0 431  ARG   A HA   1 c 1 
ATOM   5831  H  HB2  . ARG   A  1  376 ? -3.357  -4.013  -3.171  1.000 15.355  0 431  ARG   A HB2  1 c 1 
ATOM   5832  H  HB3  . ARG   A  1  376 ? -4.031  -4.431  -4.541  1.000 15.533  0 431  ARG   A HB3  1 c 1 
ATOM   5833  H  HG2  . ARG   A  1  376 ? -3.564  -6.674  -4.109  1.000 15.811  0 431  ARG   A HG2  1 c 1 
ATOM   5834  H  HG3  . ARG   A  1  376 ? -2.829  -6.272  -2.761  1.000 15.667  0 431  ARG   A HG3  1 c 1 
ATOM   5835  H  HD2  . ARG   A  1  376 ? -4.833  -5.532  -1.826  1.000 16.918  0 431  ARG   A HD2  1 c 1 
ATOM   5836  H  HD3  . ARG   A  1  376 ? -5.595  -5.741  -3.196  1.000 17.037  0 431  ARG   A HD3  1 c 1 
ATOM   5837  H  HE   . ARG   A  1  376 ? -5.849  -7.867  -2.691  1.000 18.317  0 431  ARG   A HE   1 c 1 
ATOM   5838  H  HH11 . ARG   A  1  376 ? -4.252  -6.752  0.048   1.000 22.114  0 431  ARG   A HH11 1 c 1 
ATOM   5839  H  HH12 . ARG   A  1  376 ? -3.241  -7.900  0.017   1.000 22.229  0 431  ARG   A HH12 1 c 1 
ATOM   5840  H  HH21 . ARG   A  1  376 ? -4.454  -9.921  -0.534  1.000 17.614  0 431  ARG   A HH21 1 c 1 
ATOM   5841  H  HH22 . ARG   A  1  376 ? -5.499  -9.835  -1.639  1.000 17.620  0 431  ARG   A HH22 1 c 1 
ATOM   5842  N  N    . LEU   A  1  377 ? -0.253  -5.897  -3.633  1.000 16.498  0 432  LEU   A N    1 ? 1 
ATOM   5843  C  CA   . LEU   A  1  377 ? 0.847   -6.207  -2.732  1.000 15.911  0 432  LEU   A CA   1 ? 1 
ATOM   5844  C  C    . LEU   A  1  377 ? 2.172   -5.629  -3.219  1.000 17.547  0 432  LEU   A C    1 ? 1 
ATOM   5845  O  O    . LEU   A  1  377 ? 3.108   -5.534  -2.448  1.000 21.599  0 432  LEU   A O    1 ? 1 
ATOM   5846  C  CB   . LEU   A  1  377 ? 0.954   -7.684  -2.593  1.000 15.566  0 432  LEU   A CB   1 ? 1 
ATOM   5847  C  CG   . LEU   A  1  377 ? -0.211  -8.376  -1.858  1.000 20.999  0 432  LEU   A CG   1 ? 1 
ATOM   5848  C  CD1  . LEU   A  1  377 ? 0.059   -9.845  -1.726  1.000 20.449  0 432  LEU   A CD1  1 ? 1 
ATOM   5849  C  CD2  . LEU   A  1  377 ? -0.443  -7.799  -0.505  1.000 21.245  0 432  LEU   A CD2  1 ? 1 
ATOM   5850  H  H    . LEU   A  1  377 ? -0.563  -6.549  -4.194  1.000 17.688  0 432  LEU   A H    1 c 1 
ATOM   5851  H  HA   . LEU   A  1  377 ? 0.645   -5.812  -1.854  1.000 16.215  0 432  LEU   A HA   1 c 1 
ATOM   5852  H  HB2  . LEU   A  1  377 ? 1.031   -8.073  -3.486  1.000 16.878  0 432  LEU   A HB2  1 c 1 
ATOM   5853  H  HB3  . LEU   A  1  377 ? 1.782   -7.886  -2.113  1.000 16.818  0 432  LEU   A HB3  1 c 1 
ATOM   5854  H  HG   . LEU   A  1  377 ? -1.034  -8.257  -2.394  1.000 19.745  0 432  LEU   A HG   1 c 1 
ATOM   5855  H  HD11 . LEU   A  1  377 ? -0.755  -10.302 -1.452  1.000 20.753  0 432  LEU   A HD11 1 c 1 
ATOM   5856  H  HD12 . LEU   A  1  377 ? 0.752   -9.989  -1.058  1.000 20.732  0 432  LEU   A HD12 1 c 1 
ATOM   5857  H  HD13 . LEU   A  1  377 ? 0.357   -10.199 -2.582  1.000 20.760  0 432  LEU   A HD13 1 c 1 
ATOM   5858  H  HD21 . LEU   A  1  377 ? -0.888  -6.937  -0.590  1.000 20.928  0 432  LEU   A HD21 1 c 1 
ATOM   5859  H  HD22 . LEU   A  1  377 ? 0.411   -7.680  -0.052  1.000 21.119  0 432  LEU   A HD22 1 c 1 
ATOM   5860  H  HD23 . LEU   A  1  377 ? -1.003  -8.402  0.015   1.000 21.216  0 432  LEU   A HD23 1 c 1 
ATOM   5861  N  N    . HIS   A  1  378 ? 2.237   -5.275  -4.509  1.000 14.671  0 433  HIS   A N    1 ? 1 
ATOM   5862  C  CA   . HIS   A  1  378 ? 3.452   -4.792  -5.142  1.000 15.348  0 433  HIS   A CA   1 ? 1 
ATOM   5863  C  C    . HIS   A  1  378 ? 4.659   -5.551  -4.626  1.000 19.925  0 433  HIS   A C    1 ? 1 
ATOM   5864  O  O    . HIS   A  1  378 ? 5.618   -4.911  -4.216  1.000 17.969  0 433  HIS   A O    1 ? 1 
ATOM   5865  C  CB   . HIS   A  1  378 ? 3.647   -3.278  -4.889  1.000 19.638  0 433  HIS   A CB   1 ? 1 
ATOM   5866  C  CG   . HIS   A  1  378 ? 2.488   -2.436  -5.319  1.000 17.583  0 433  HIS   A CG   1 ? 1 
ATOM   5867  N  ND1  . HIS   A  1  378 ? 2.315   -2.077  -6.637  1.000 21.172  0 433  HIS   A ND1  1 ? 1 
ATOM   5868  C  CD2  . HIS   A  1  378 ? 1.465   -1.938  -4.587  1.000 19.816  0 433  HIS   A CD2  1 ? 1 
ATOM   5869  C  CE1  . HIS   A  1  378 ? 1.181   -1.376  -6.684  1.000 19.194  0 433  HIS   A CE1  1 ? 1 
ATOM   5870  N  NE2  . HIS   A  1  378 ? 0.634   -1.264  -5.470  1.000 21.933  0 433  HIS   A NE2  1 ? 1 
ATOM   5871  H  H    . HIS   A  1  378 ? 1.486   -5.347  -5.024  1.000 15.483  0 433  HIS   A H    1 c 1 
ATOM   5872  H  HA   . HIS   A  1  378 ? 3.371   -4.940  -6.113  1.000 16.954  0 433  HIS   A HA   1 c 1 
ATOM   5873  H  HB2  . HIS   A  1  378 ? 3.799   -3.136  -3.932  1.000 17.995  0 433  HIS   A HB2  1 c 1 
ATOM   5874  H  HB3  . HIS   A  1  378 ? 4.446   -2.979  -5.369  1.000 18.192  0 433  HIS   A HB3  1 c 1 
ATOM   5875  H  HD1  . HIS   A  1  378 ? 2.846   -2.296  -7.304  0.000 17.100  0 433  HIS   A HD1  1 c 1 
ATOM   5876  H  HD2  . HIS   A  1  378 ? 1.337   -2.045  -3.657  1.000 19.593  0 433  HIS   A HD2  1 c 1 
ATOM   5877  H  HE1  . HIS   A  1  378 ? 0.823   -0.991  -7.466  1.000 20.324  0 433  HIS   A HE1  1 c 1 
ATOM   5878  H  HE2  . HIS   A  1  378 ? -0.119  -0.834  -5.277  0.000 16.790  0 433  HIS   A HE2  1 c 1 
ATOM   5879  N  N    . TYR   A  1  379 ? 4.623   -6.891  -4.723  1.000 17.539  0 434  TYR   A N    1 ? 1 
ATOM   5880  C  CA   . TYR   A  1  379 ? 5.687   -7.717  -4.182  1.000 14.493  0 434  TYR   A CA   1 ? 1 
ATOM   5881  C  C    . TYR   A  1  379 ? 6.258   -8.679  -5.208  1.000 15.268  0 434  TYR   A C    1 ? 1 
ATOM   5882  O  O    . TYR   A  1  379 ? 6.031   -9.880  -5.125  1.000 19.440  0 434  TYR   A O    1 ? 1 
ATOM   5883  C  CB   . TYR   A  1  379 ? 5.175   -8.464  -2.920  1.000 15.727  0 434  TYR   A CB   1 ? 1 
ATOM   5884  C  CG   . TYR   A  1  379 ? 6.267   -9.067  -2.030  1.000 15.208  0 434  TYR   A CG   1 ? 1 
ATOM   5885  C  CD1  . TYR   A  1  379 ? 7.109   -8.261  -1.286  1.000 16.202  0 434  TYR   A CD1  1 ? 1 
ATOM   5886  C  CD2  . TYR   A  1  379 ? 6.475   -10.438 -1.977  1.000 12.754  0 434  TYR   A CD2  1 ? 1 
ATOM   5887  C  CE1  . TYR   A  1  379 ? 8.108   -8.798  -0.488  1.000 21.205  0 434  TYR   A CE1  1 ? 1 
ATOM   5888  C  CE2  . TYR   A  1  379 ? 7.472   -10.986 -1.178  1.000 18.906  0 434  TYR   A CE2  1 ? 1 
ATOM   5889  C  CZ   . TYR   A  1  379 ? 8.308   -10.153 -0.450  1.000 18.069  0 434  TYR   A CZ   1 ? 1 
ATOM   5890  O  OH   . TYR   A  1  379 ? 9.305   -10.606 0.375   1.000 16.940  0 434  TYR   A OH   1 ? 1 
ATOM   5891  H  H    . TYR   A  1  379 ? 3.917   -7.296  -5.139  1.000 17.218  0 434  TYR   A H    1 c 1 
ATOM   5892  H  HA   . TYR   A  1  379 ? 6.424   -7.119  -3.897  1.000 15.427  0 434  TYR   A HA   1 c 1 
ATOM   5893  H  HB2  . TYR   A  1  379 ? 4.649   -7.834  -2.385  1.000 15.047  0 434  TYR   A HB2  1 c 1 
ATOM   5894  H  HB3  . TYR   A  1  379 ? 4.573   -9.181  -3.209  1.000 15.304  0 434  TYR   A HB3  1 c 1 
ATOM   5895  H  HD1  . TYR   A  1  379 ? 6.993   -7.326  -1.311  1.000 16.703  0 434  TYR   A HD1  1 c 1 
ATOM   5896  H  HD2  . TYR   A  1  379 ? 5.920   -11.010 -2.480  1.000 14.620  0 434  TYR   A HD2  1 c 1 
ATOM   5897  H  HE1  . TYR   A  1  379 ? 8.666   -8.228  0.014   1.000 19.035  0 434  TYR   A HE1  1 c 1 
ATOM   5898  H  HE2  . TYR   A  1  379 ? 7.598   -11.919 -1.152  1.000 17.267  0 434  TYR   A HE2  1 c 1 
ATOM   5899  H  HH   . TYR   A  1  379 ? 9.762   -10.053 0.840   0.000 10.060  0 434  TYR   A HH   1 c 1 
ATOM   5900  N  N    . ALA   A  1  380 ? 7.040   -8.167  -6.166  1.000 15.189  0 435  ALA   A N    1 ? 1 
ATOM   5901  C  CA   . ALA   A  1  380 ? 7.646   -9.057  -7.139  1.000 17.820  0 435  ALA   A CA   1 ? 1 
ATOM   5902  C  C    . ALA   A  1  380 ? 8.911   -8.512  -7.778  1.000 13.470  0 435  ALA   A C    1 ? 1 
ATOM   5903  O  O    . ALA   A  1  380 ? 9.799   -9.282  -8.106  1.000 15.953  0 435  ALA   A O    1 ? 1 
ATOM   5904  C  CB   . ALA   A  1  380 ? 6.642   -9.425  -8.232  1.000 19.337  0 435  ALA   A CB   1 ? 1 
ATOM   5905  H  H    . ALA   A  1  380 ? 7.191   -7.267  -6.209  1.000 15.562  0 435  ALA   A H    1 c 1 
ATOM   5906  H  HA   . ALA   A  1  380 ? 7.893   -9.886  -6.668  1.000 16.723  0 435  ALA   A HA   1 c 1 
ATOM   5907  H  HB1  . ALA   A  1  380 ? 7.053   -10.051 -8.853  1.000 19.147  0 435  ALA   A HB1  1 c 1 
ATOM   5908  H  HB2  . ALA   A  1  380 ? 5.859   -9.836  -7.831  1.000 18.754  0 435  ALA   A HB2  1 c 1 
ATOM   5909  H  HB3  . ALA   A  1  380 ? 6.376   -8.624  -8.713  1.000 18.834  0 435  ALA   A HB3  1 c 1 
ATOM   5910  N  N    . ASN   A  1  381 ? 8.959   -7.211  -8.023  1.000 15.500  0 436  ASN   A N    1 ? 1 
ATOM   5911  C  CA   . ASN   A  1  381 ? 10.022  -6.669  -8.842  1.000 16.415  0 436  ASN   A CA   1 ? 1 
ATOM   5912  C  C    . ASN   A  1  381 ? 11.287  -6.385  -8.030  1.000 21.783  0 436  ASN   A C    1 ? 1 
ATOM   5913  O  O    . ASN   A  1  381 ? 11.710  -5.233  -7.922  1.000 17.042  0 436  ASN   A O    1 ? 1 
ATOM   5914  C  CB   . ASN   A  1  381 ? 9.571   -5.396  -9.559  1.000 17.060  0 436  ASN   A CB   1 ? 1 
ATOM   5915  C  CG   . ASN   A  1  381 ? 10.546  -4.899  -10.555 1.000 18.418  0 436  ASN   A CG   1 ? 1 
ATOM   5916  O  OD1  . ASN   A  1  381 ? 11.264  -5.663  -11.174 1.000 23.474  0 436  ASN   A OD1  1 ? 1 
ATOM   5917  N  ND2  . ASN   A  1  381 ? 10.590  -3.641  -10.755 1.000 25.646  0 436  ASN   A ND2  1 ? 1 
ATOM   5918  H  H    . ASN   A  1  381 ? 8.321   -6.648  -7.689  1.000 14.867  0 436  ASN   A H    1 c 1 
ATOM   5919  H  HA   . ASN   A  1  381 ? 10.242  -7.334  -9.535  1.000 17.509  0 436  ASN   A HA   1 c 1 
ATOM   5920  H  HB2  . ASN   A  1  381 ? 8.723   -5.577  -10.010 1.000 17.056  0 436  ASN   A HB2  1 c 1 
ATOM   5921  H  HB3  . ASN   A  1  381 ? 9.411   -4.698  -8.891  1.000 16.941  0 436  ASN   A HB3  1 c 1 
ATOM   5922  H  HD21 . ASN   A  1  381 ? 9.938   -3.120  -10.458 1.000 22.620  0 436  ASN   A HD21 1 c 1 
ATOM   5923  H  HD22 . ASN   A  1  381 ? 11.272  -3.286  -11.193 1.000 23.241  0 436  ASN   A HD22 1 c 1 
ATOM   5924  N  N    . ASN   A  1  382 ? 11.928  -7.459  -7.549  1.000 19.687  0 437  ASN   A N    1 ? 1 
ATOM   5925  C  CA   . ASN   A  1  382 ? 13.218  -7.379  -6.868  1.000 17.206  0 437  ASN   A CA   1 ? 1 
ATOM   5926  C  C    . ASN   A  1  382 ? 13.861  -8.755  -6.943  1.000 17.993  0 437  ASN   A C    1 ? 1 
ATOM   5927  O  O    . ASN   A  1  382 ? 13.194  -9.757  -6.680  1.000 19.052  0 437  ASN   A O    1 ? 1 
ATOM   5928  C  CB   . ASN   A  1  382 ? 13.051  -6.966  -5.397  1.000 18.170  0 437  ASN   A CB   1 ? 1 
ATOM   5929  C  CG   . ASN   A  1  382 ? 14.373  -6.534  -4.755  1.000 21.676  0 437  ASN   A CG   1 ? 1 
ATOM   5930  O  OD1  . ASN   A  1  382 ? 15.287  -7.310  -4.588  1.000 18.860  0 437  ASN   A OD1  1 ? 1 
ATOM   5931  N  ND2  . ASN   A  1  382 ? 14.492  -5.290  -4.439  1.000 17.647  0 437  ASN   A ND2  1 ? 1 
ATOM   5932  H  H    . ASN   A  1  382 ? 11.546  -8.282  -7.655  1.000 19.449  0 437  ASN   A H    1 c 1 
ATOM   5933  H  HA   . ASN   A  1  382 ? 13.788  -6.718  -7.324  1.000 18.206  0 437  ASN   A HA   1 c 1 
ATOM   5934  H  HB2  . ASN   A  1  382 ? 12.410  -6.228  -5.345  1.000 18.199  0 437  ASN   A HB2  1 c 1 
ATOM   5935  H  HB3  . ASN   A  1  382 ? 12.684  -7.721  -4.895  1.000 18.440  0 437  ASN   A HB3  1 c 1 
ATOM   5936  H  HD21 . ASN   A  1  382 ? 13.781  -4.763  -4.429  1.000 18.407  0 437  ASN   A HD21 1 c 1 
ATOM   5937  H  HD22 . ASN   A  1  382 ? 15.287  -4.960  -4.230  1.000 18.941  0 437  ASN   A HD22 1 c 1 
ATOM   5938  N  N    . ARG   A  1  383 ? 15.151  -8.805  -7.309  1.000 17.339  0 438  ARG   A N    1 ? 1 
ATOM   5939  C  CA   . ARG   A  1  383 ? 15.884  -10.057 -7.361  1.000 15.992  0 438  ARG   A CA   1 ? 1 
ATOM   5940  C  C    . ARG   A  1  383 ? 15.969  -10.765 -6.001  1.000 17.189  0 438  ARG   A C    1 ? 1 
ATOM   5941  O  O    . ARG   A  1  383 ? 16.290  -11.949 -5.944  1.000 16.942  0 438  ARG   A O    1 ? 1 
ATOM   5942  C  CB   . ARG   A  1  383 ? 17.284  -9.822  -7.945  1.000 18.479  0 438  ARG   A CB   1 ? 1 
ATOM   5943  C  CG   . ARG   A  1  383 ? 18.150  -8.974  -7.049  1.000 22.561  0 438  ARG   A CG   1 ? 1 
ATOM   5944  C  CD   . ARG   A  1  383 ? 19.443  -8.524  -7.693  1.000 24.375  0 438  ARG   A CD   1 ? 1 
ATOM   5945  N  NE   . ARG   A  1  383 ? 20.295  -7.877  -6.698  1.000 26.783  0 438  ARG   A NE   1 ? 1 
ATOM   5946  C  CZ   . ARG   A  1  383 ? 20.751  -6.629  -6.753  1.000 31.037  0 438  ARG   A CZ   1 ? 1 
ATOM   5947  N  NH1  . ARG   A  1  383 ? 20.661  -5.904  -7.860  1.000 30.427  0 438  ARG   A NH1  1 ? 1 
ATOM   5948  N  NH2  . ARG   A  1  383 ? 21.371  -6.120  -5.687  1.000 22.251  0 438  ARG   A NH2  1 ? 1 
ATOM   5949  H  H    . ARG   A  1  383 ? 15.579  -8.032  -7.542  1.000 17.259  0 438  ARG   A H    1 c 1 
ATOM   5950  H  HA   . ARG   A  1  383 ? 15.399  -10.654 -7.977  1.000 16.924  0 438  ARG   A HA   1 c 1 
ATOM   5951  H  HB2  . ARG   A  1  383 ? 17.719  -10.689 -8.086  1.000 19.188  0 438  ARG   A HB2  1 c 1 
ATOM   5952  H  HB3  . ARG   A  1  383 ? 17.194  -9.380  -8.816  1.000 18.811  0 438  ARG   A HB3  1 c 1 
ATOM   5953  H  HG2  . ARG   A  1  383 ? 17.646  -8.180  -6.771  1.000 21.323  0 438  ARG   A HG2  1 c 1 
ATOM   5954  H  HG3  . ARG   A  1  383 ? 18.367  -9.484  -6.240  1.000 21.800  0 438  ARG   A HG3  1 c 1 
ATOM   5955  H  HD2  . ARG   A  1  383 ? 19.909  -9.298  -8.074  1.000 25.085  0 438  ARG   A HD2  1 c 1 
ATOM   5956  H  HD3  . ARG   A  1  383 ? 19.244  -7.897  -8.418  1.000 24.718  0 438  ARG   A HD3  1 c 1 
ATOM   5957  H  HE   . ARG   A  1  383 ? 20.530  -8.353  -6.010  1.000 27.111  0 438  ARG   A HE   1 c 1 
ATOM   5958  H  HH11 . ARG   A  1  383 ? 20.950  -6.234  -8.625  1.000 30.865  0 438  ARG   A HH11 1 c 1 
ATOM   5959  H  HH12 . ARG   A  1  383 ? 20.314  -5.095  -7.828  1.000 30.322  0 438  ARG   A HH12 1 c 1 
ATOM   5960  H  HH21 . ARG   A  1  383 ? 21.778  -5.342  -5.748  1.000 24.669  0 438  ARG   A HH21 1 c 1 
ATOM   5961  H  HH22 . ARG   A  1  383 ? 21.370  -6.559  -4.926  1.000 24.512  0 438  ARG   A HH22 1 c 1 
ATOM   5962  N  N    . ARG   A  1  384 ? 15.657  -10.054 -4.917  1.000 15.635  0 439  ARG   A N    1 ? 1 
ATOM   5963  C  CA   . ARG   A  1  384 ? 15.631  -10.638 -3.594  1.000 19.918  0 439  ARG   A CA   1 ? 1 
ATOM   5964  C  C    . ARG   A  1  384 ? 14.306  -11.309 -3.295  1.000 21.125  0 439  ARG   A C    1 ? 1 
ATOM   5965  O  O    . ARG   A  1  384 ? 14.173  -11.927 -2.241  1.000 20.348  0 439  ARG   A O    1 ? 1 
ATOM   5966  C  CB   . ARG   A  1  384 ? 15.865  -9.563  -2.528  1.000 18.089  0 439  ARG   A CB   1 ? 1 
ATOM   5967  C  CG   . ARG   A  1  384 ? 17.193  -8.890  -2.679  1.000 18.719  0 439  ARG   A CG   1 ? 1 
ATOM   5968  C  CD   . ARG   A  1  384 ? 17.288  -7.576  -1.889  1.000 19.769  0 439  ARG   A CD   1 ? 1 
ATOM   5969  N  NE   . ARG   A  1  384 ? 18.593  -6.970  -2.067  1.000 16.308  0 439  ARG   A NE   1 ? 1 
ATOM   5970  C  CZ   . ARG   A  1  384 ? 18.948  -5.791  -1.575  1.000 16.962  0 439  ARG   A CZ   1 ? 1 
ATOM   5971  N  NH1  . ARG   A  1  384 ? 18.124  -5.074  -0.841  1.000 16.551  0 439  ARG   A NH1  1 ? 1 
ATOM   5972  N  NH2  . ARG   A  1  384 ? 20.165  -5.329  -1.827  1.000 18.812  0 439  ARG   A NH2  1 ? 1 
ATOM   5973  H  H    . ARG   A  1  384 ? 15.475  -9.163  -5.002  1.000 16.552  0 439  ARG   A H    1 c 1 
ATOM   5974  H  HA   . ARG   A  1  384 ? 16.349  -11.310 -3.531  1.000 19.284  0 439  ARG   A HA   1 c 1 
ATOM   5975  H  HB2  . ARG   A  1  384 ? 15.154  -8.892  -2.590  1.000 18.092  0 439  ARG   A HB2  1 c 1 
ATOM   5976  H  HB3  . ARG   A  1  384 ? 15.817  -9.977  -1.641  1.000 18.523  0 439  ARG   A HB3  1 c 1 
ATOM   5977  H  HG2  . ARG   A  1  384 ? 17.899  -9.497  -2.369  1.000 19.342  0 439  ARG   A HG2  1 c 1 
ATOM   5978  H  HG3  . ARG   A  1  384 ? 17.356  -8.701  -3.628  1.000 19.033  0 439  ARG   A HG3  1 c 1 
ATOM   5979  H  HD2  . ARG   A  1  384 ? 16.593  -6.956  -2.199  1.000 18.036  0 439  ARG   A HD2  1 c 1 
ATOM   5980  H  HD3  . ARG   A  1  384 ? 17.137  -7.754  -0.936  1.000 18.336  0 439  ARG   A HD3  1 c 1 
ATOM   5981  H  HE   . ARG   A  1  384 ? 19.186  -7.409  -2.531  1.000 17.690  0 439  ARG   A HE   1 c 1 
ATOM   5982  H  HH11 . ARG   A  1  384 ? 17.624  -5.468  -0.228  1.000 16.361  0 439  ARG   A HH11 1 c 1 
ATOM   5983  H  HH12 . ARG   A  1  384 ? 18.080  -4.200  -0.960  1.000 16.418  0 439  ARG   A HH12 1 c 1 
ATOM   5984  H  HH21 . ARG   A  1  384 ? 20.359  -4.490  -1.652  1.000 18.353  0 439  ARG   A HH21 1 c 1 
ATOM   5985  H  HH22 . ARG   A  1  384 ? 20.769  -5.859  -2.178  1.000 18.794  0 439  ARG   A HH22 1 c 1 
ATOM   5986  N  N    . ILE   A  1  385 ? 13.313  -11.158 -4.185  1.000 21.488  0 440  ILE   A N    1 ? 1 
ATOM   5987  C  CA   . ILE   A  1  385 ? 12.059  -11.869 -3.991  1.000 18.552  0 440  ILE   A CA   1 ? 1 
ATOM   5988  C  C    . ILE   A  1  385 ? 12.063  -13.189 -4.776  1.000 26.631  0 440  ILE   A C    1 ? 1 
ATOM   5989  O  O    . ILE   A  1  385 ? 12.108  -13.202 -6.011  1.000 17.405  0 440  ILE   A O    1 ? 1 
ATOM   5990  C  CB   . ILE   A  1  385 ? 10.848  -11.000 -4.314  1.000 18.637  0 440  ILE   A CB   1 ? 1 
ATOM   5991  C  CG1  . ILE   A  1  385 ? 10.824  -9.711  -3.483  1.000 15.867  0 440  ILE   A CG1  1 ? 1 
ATOM   5992  C  CG2  . ILE   A  1  385 ? 9.550   -11.835 -4.103  1.000 16.691  0 440  ILE   A CG2  1 ? 1 
ATOM   5993  C  CD1  . ILE   A  1  385 ? 9.827   -8.742  -3.919  1.000 17.238  0 440  ILE   A CD1  1 ? 1 
ATOM   5994  H  H    . ILE   A  1  385 ? 13.408  -10.604 -4.905  1.000 20.532  0 440  ILE   A H    1 c 1 
ATOM   5995  H  HA   . ILE   A  1  385 ? 11.997  -12.095 -3.047  1.000 20.306  0 440  ILE   A HA   1 c 1 
ATOM   5996  H  HB   . ILE   A  1  385 ? 10.900  -10.746 -5.268  1.000 17.751  0 440  ILE   A HB   1 c 1 
ATOM   5997  H  HG12 . ILE   A  1  385 ? 10.646  -9.945  -2.547  1.000 16.725  0 440  ILE   A HG12 1 c 1 
ATOM   5998  H  HG13 . ILE   A  1  385 ? 11.709  -9.291  -3.524  1.000 16.978  0 440  ILE   A HG13 1 c 1 
ATOM   5999  H  HG21 . ILE   A  1  385 ? 9.523   -12.171 -3.190  1.000 17.199  0 440  ILE   A HG21 1 c 1 
ATOM   6000  H  HG22 . ILE   A  1  385 ? 9.537   -12.585 -4.722  1.000 17.453  0 440  ILE   A HG22 1 c 1 
ATOM   6001  H  HG23 . ILE   A  1  385 ? 8.770   -11.276 -4.264  1.000 16.881  0 440  ILE   A HG23 1 c 1 
ATOM   6002  H  HD11 . ILE   A  1  385 ? 8.935   -9.077  -3.720  1.000 16.483  0 440  ILE   A HD11 1 c 1 
ATOM   6003  H  HD12 . ILE   A  1  385 ? 9.911   -8.596  -4.877  1.000 16.736  0 440  ILE   A HD12 1 c 1 
ATOM   6004  H  HD13 . ILE   A  1  385 ? 9.966   -7.900  -3.451  1.000 16.506  0 440  ILE   A HD13 1 c 1 
ATOM   6005  N  N    . GLU   A  1  386 ? 11.987  -14.317 -4.051  1.000 19.024  0 441  GLU   A N    1 ? 1 
ATOM   6006  C  CA   . GLU   A  1  386 ? 11.955  -15.609 -4.715  1.000 19.795  0 441  GLU   A CA   1 ? 1 
ATOM   6007  C  C    . GLU   A  1  386 ? 10.713  -15.750 -5.601  1.000 20.944  0 441  GLU   A C    1 ? 1 
ATOM   6008  O  O    . GLU   A  1  386 ? 9.645   -15.222 -5.281  1.000 18.093  0 441  GLU   A O    1 ? 1 
ATOM   6009  C  CB   . GLU   A  1  386 ? 12.015  -16.759 -3.710  1.000 24.832  0 441  GLU   A CB   1 ? 1 
ATOM   6010  C  CG   . GLU   A  1  386 ? 13.343  -16.914 -2.922  1.000 24.579  0 441  GLU   A CG   1 ? 1 
ATOM   6011  C  CD   . GLU   A  1  386 ? 13.610  -15.940 -1.789  1.000 22.718  0 441  GLU   A CD   1 ? 1 
ATOM   6012  O  OE1  . GLU   A  1  386 ? 12.716  -15.130 -1.460  1.000 26.231  0 441  GLU   A OE1  1 ? 1 
ATOM   6013  O  OE2  . GLU   A  1  386 ? 14.717  -16.009 -1.210  1.000 23.084  0 441  GLU   A OE2  1 ? 1 
ATOM   6014  H  H    . GLU   A  1  386 ? 11.942  -14.279 -3.139  1.000 20.575  0 441  GLU   A H    1 c 1 
ATOM   6015  H  HA   . GLU   A  1  386 ? 12.751  -15.666 -5.293  1.000 21.068  0 441  GLU   A HA   1 c 1 
ATOM   6016  H  HB2  . GLU   A  1  386 ? 11.285  -16.641 -3.068  1.000 23.161  0 441  GLU   A HB2  1 c 1 
ATOM   6017  H  HB3  . GLU   A  1  386 ? 11.846  -17.593 -4.195  1.000 23.688  0 441  GLU   A HB3  1 c 1 
ATOM   6018  H  HG2  . GLU   A  1  386 ? 13.374  -17.821 -2.549  1.000 24.664  0 441  GLU   A HG2  1 c 1 
ATOM   6019  H  HG3  . GLU   A  1  386 ? 14.087  -16.843 -3.557  1.000 24.624  0 441  GLU   A HG3  1 c 1 
ATOM   6020  N  N    . ASP   A  1  387 ? 10.892  -16.430 -6.743  1.000 19.778  0 442  ASP   A N    1 ? 1 
ATOM   6021  C  CA   . ASP   A  1  387 ? 9.812   -16.651 -7.692  1.000 20.969  0 442  ASP   A CA   1 ? 1 
ATOM   6022  C  C    . ASP   A  1  387 ? 8.636   -17.339 -7.031  1.000 21.496  0 442  ASP   A C    1 ? 1 
ATOM   6023  O  O    . ASP   A  1  387 ? 7.496   -16.992 -7.295  1.000 21.865  0 442  ASP   A O    1 ? 1 
ATOM   6024  C  CB   . ASP   A  1  387 ? 10.281  -17.495 -8.839  1.000 26.178  0 442  ASP   A CB   1 ? 1 
ATOM   6025  C  CG   . ASP   A  1  387 ? 11.219  -16.743 -9.760  1.000 31.152  0 442  ASP   A CG   1 ? 1 
ATOM   6026  O  OD1  . ASP   A  1  387 ? 11.212  -15.505 -9.735  1.000 35.604  0 442  ASP   A OD1  1 ? 1 
ATOM   6027  O  OD2  . ASP   A  1  387 ? 12.002  -17.385 -10.436 1.000 38.696  0 442  ASP   A OD2  1 ? 1 
ATOM   6028  H  H    . ASP   A  1  387 ? 11.719  -16.769 -6.934  1.000 20.912  0 442  ASP   A H    1 c 1 
ATOM   6029  H  HA   . ASP   A  1  387 ? 9.515   -15.779 -8.038  1.000 21.363  0 442  ASP   A HA   1 c 1 
ATOM   6030  H  HB2  . ASP   A  1  387 ? 10.747  -18.284 -8.494  1.000 26.237  0 442  ASP   A HB2  1 c 1 
ATOM   6031  H  HB3  . ASP   A  1  387 ? 9.509   -17.796 -9.359  1.000 25.846  0 442  ASP   A HB3  1 c 1 
ATOM   6032  N  N    . ILE   A  1  388 ? 8.934   -18.291 -6.147  1.000 23.721  0 443  ILE   A N    1 ? 1 
ATOM   6033  C  CA   . ILE   A  1  388 ? 7.862   -19.007 -5.479  1.000 20.330  0 443  ILE   A CA   1 ? 1 
ATOM   6034  C  C    . ILE   A  1  388 ? 7.517   -18.352 -4.150  1.000 22.613  0 443  ILE   A C    1 ? 1 
ATOM   6035  O  O    . ILE   A  1  388 ? 8.349   -18.278 -3.262  1.000 22.913  0 443  ILE   A O    1 ? 1 
ATOM   6036  C  CB   . ILE   A  1  388 ? 8.219   -20.487 -5.356  1.000 22.149  0 443  ILE   A CB   1 ? 1 
ATOM   6037  C  CG1  . ILE   A  1  388 ? 8.388   -21.117 -6.719  1.000 20.970  0 443  ILE   A CG1  1 ? 1 
ATOM   6038  C  CG2  . ILE   A  1  388 ? 7.126   -21.260 -4.555  1.000 23.351  0 443  ILE   A CG2  1 ? 1 
ATOM   6039  C  CD1  . ILE   A  1  388 ? 8.954   -22.446 -6.686  1.000 23.266  0 443  ILE   A CD1  1 ? 1 
ATOM   6040  H  H    . ILE   A  1  388 ? 9.803   -18.506 -5.962  1.000 22.694  0 443  ILE   A H    1 c 1 
ATOM   6041  H  HA   . ILE   A  1  388 ? 7.074   -18.951 -6.047  1.000 21.465  0 443  ILE   A HA   1 c 1 
ATOM   6042  H  HB   . ILE   A  1  388 ? 9.077   -20.561 -4.870  1.000 22.010  0 443  ILE   A HB   1 c 1 
ATOM   6043  H  HG12 . ILE   A  1  388 ? 7.511   -21.160 -7.157  1.000 21.546  0 443  ILE   A HG12 1 c 1 
ATOM   6044  H  HG13 . ILE   A  1  388 ? 8.968   -20.544 -7.264  1.000 21.669  0 443  ILE   A HG13 1 c 1 
ATOM   6045  H  HG21 . ILE   A  1  388 ? 6.265   -21.160 -4.998  1.000 22.811  0 443  ILE   A HG21 1 c 1 
ATOM   6046  H  HG22 . ILE   A  1  388 ? 7.067   -20.903 -3.652  1.000 22.789  0 443  ILE   A HG22 1 c 1 
ATOM   6047  H  HG23 . ILE   A  1  388 ? 7.358   -22.204 -4.511  1.000 23.441  0 443  ILE   A HG23 1 c 1 
ATOM   6048  H  HD11 . ILE   A  1  388 ? 8.263   -23.089 -6.448  1.000 22.895  0 443  ILE   A HD11 1 c 1 
ATOM   6049  H  HD12 . ILE   A  1  388 ? 9.668   -22.481 -6.026  1.000 22.963  0 443  ILE   A HD12 1 c 1 
ATOM   6050  H  HD13 . ILE   A  1  388 ? 9.314   -22.668 -7.562  1.000 23.145  0 443  ILE   A HD13 1 c 1 
ATOM   6051  N  N    . HIS   A  1  389 ? 6.265   -17.930 -4.008  1.000 18.876  0 444  HIS   A N    1 ? 1 
ATOM   6052  C  CA   . HIS   A  1  389 ? 5.779   -17.374 -2.765  1.000 18.004  0 444  HIS   A CA   1 ? 1 
ATOM   6053  C  C    . HIS   A  1  389 ? 4.604   -18.173 -2.234  1.000 23.313  0 444  HIS   A C    1 ? 1 
ATOM   6054  O  O    . HIS   A  1  389 ? 3.791   -18.655 -3.019  1.000 21.305  0 444  HIS   A O    1 ? 1 
ATOM   6055  C  CB   . HIS   A  1  389 ? 5.327   -15.948 -2.992  1.000 17.794  0 444  HIS   A CB   1 ? 1 
ATOM   6056  C  CG   . HIS   A  1  389 ? 5.234   -15.118 -1.749  1.000 19.323  0 444  HIS   A CG   1 ? 1 
ATOM   6057  N  ND1  . HIS   A  1  389 ? 6.352   -14.574 -1.168  1.000 16.470  0 444  HIS   A ND1  1 ? 1 
ATOM   6058  C  CD2  . HIS   A  1  389 ? 4.144   -14.760 -1.038  1.000 21.997  0 444  HIS   A CD2  1 ? 1 
ATOM   6059  C  CE1  . HIS   A  1  389 ? 5.915   -13.906 -0.108  1.000 17.168  0 444  HIS   A CE1  1 ? 1 
ATOM   6060  N  NE2  . HIS   A  1  389 ? 4.586   -14.024 0.022   1.000 17.490  0 444  HIS   A NE2  1 ? 1 
ATOM   6061  H  H    . HIS   A  1  389 ? 5.689   -17.991 -4.715  1.000 19.438  0 444  HIS   A H    1 c 1 
ATOM   6062  H  HA   . HIS   A  1  389 ? 6.508   -17.379 -2.105  1.000 19.131  0 444  HIS   A HA   1 c 1 
ATOM   6063  H  HB2  . HIS   A  1  389 ? 5.956   -15.517 -3.607  1.000 18.119  0 444  HIS   A HB2  1 c 1 
ATOM   6064  H  HB3  . HIS   A  1  389 ? 4.449   -15.963 -3.425  1.000 18.032  0 444  HIS   A HB3  1 c 1 
ATOM   6065  H  HD1  . HIS   A  1  389 ? 7.172   -14.667 -1.459  0.000 9.790   0 444  HIS   A HD1  1 c 1 
ATOM   6066  H  HD2  . HIS   A  1  389 ? 3.252   -15.017 -1.213  1.000 20.117  0 444  HIS   A HD2  1 c 1 
ATOM   6067  H  HE1  . HIS   A  1  389 ? 6.469   -13.433 0.488   1.000 17.109  0 444  HIS   A HE1  1 c 1 
ATOM   6068  H  HE2  . HIS   A  1  389 ? 4.087   -13.648 0.657   0.000 10.970  0 444  HIS   A HE2  1 c 1 
ATOM   6069  N  N    . LEU   A  1  390 ? 4.515   -18.271 -0.902  1.000 17.362  0 445  LEU   A N    1 ? 1 
ATOM   6070  C  CA   . LEU   A  1  390 ? 3.326   -18.773 -0.239  1.000 20.528  0 445  LEU   A CA   1 ? 1 
ATOM   6071  C  C    . LEU   A  1  390 ? 2.639   -17.654 0.543   1.000 21.759  0 445  LEU   A C    1 ? 1 
ATOM   6072  O  O    . LEU   A  1  390 ? 3.250   -17.040 1.429   1.000 25.149  0 445  LEU   A O    1 ? 1 
ATOM   6073  C  CB   . LEU   A  1  390 ? 3.709   -19.925 0.726   1.000 22.148  0 445  LEU   A CB   1 ? 1 
ATOM   6074  C  CG   . LEU   A  1  390 ? 4.659   -20.964 0.195   1.000 24.027  0 445  LEU   A CG   1 ? 1 
ATOM   6075  C  CD1  . LEU   A  1  390 ? 4.893   -22.003 1.233   1.000 22.584  0 445  LEU   A CD1  1 ? 1 
ATOM   6076  C  CD2  . LEU   A  1  390 ? 4.165   -21.602 -1.120  1.000 21.105  0 445  LEU   A CD2  1 ? 1 
ATOM   6077  H  H    . LEU   A  1  390 ? 5.225   -18.013 -0.388  1.000 19.246  0 445  LEU   A H    1 c 1 
ATOM   6078  H  HA   . LEU   A  1  390 ? 2.705   -19.113 -0.921  1.000 20.315  0 445  LEU   A HA   1 c 1 
ATOM   6079  H  HB2  . LEU   A  1  390 ? 4.104   -19.531 1.529   1.000 22.120  0 445  LEU   A HB2  1 c 1 
ATOM   6080  H  HB3  . LEU   A  1  390 ? 2.885   -20.376 1.000   1.000 22.289  0 445  LEU   A HB3  1 c 1 
ATOM   6081  H  HG   . LEU   A  1  390 ? 5.524   -20.521 0.011   1.000 22.700  0 445  LEU   A HG   1 c 1 
ATOM   6082  H  HD11 . LEU   A  1  390 ? 5.634   -22.572 0.961   1.000 23.510  0 445  LEU   A HD11 1 c 1 
ATOM   6083  H  HD12 . LEU   A  1  390 ? 4.091   -22.544 1.337   1.000 23.285  0 445  LEU   A HD12 1 c 1 
ATOM   6084  H  HD13 . LEU   A  1  390 ? 5.107   -21.575 2.080   1.000 23.034  0 445  LEU   A HD13 1 c 1 
ATOM   6085  H  HD21 . LEU   A  1  390 ? 4.156   -20.932 -1.824  1.000 21.671  0 445  LEU   A HD21 1 c 1 
ATOM   6086  H  HD22 . LEU   A  1  390 ? 3.266   -21.952 -0.993  1.000 21.984  0 445  LEU   A HD22 1 c 1 
ATOM   6087  H  HD23 . LEU   A  1  390 ? 4.762   -22.328 -1.372  1.000 22.349  0 445  LEU   A HD23 1 c 1 
ATOM   6088  N  N    . LEU   A  1  391 ? 1.362   -17.391 0.215   1.000 17.185  0 446  LEU   A N    1 ? 1 
ATOM   6089  C  CA   . LEU   A  1  391 ? 0.525   -16.535 1.046   1.000 21.030  0 446  LEU   A CA   1 ? 1 
ATOM   6090  C  C    . LEU   A  1  391 ? -0.141  -17.415 2.089   1.000 20.075  0 446  LEU   A C    1 ? 1 
ATOM   6091  O  O    . LEU   A  1  391 ? -0.799  -18.394 1.731   1.000 19.542  0 446  LEU   A O    1 ? 1 
ATOM   6092  C  CB   . LEU   A  1  391 ? -0.580  -15.794 0.286   1.000 24.074  0 446  LEU   A CB   1 ? 1 
ATOM   6093  C  CG   . LEU   A  1  391 ? -0.131  -14.620 -0.565  1.000 29.542  0 446  LEU   A CG   1 ? 1 
ATOM   6094  C  CD1  . LEU   A  1  391 ? -1.306  -14.053 -1.356  1.000 31.310  0 446  LEU   A CD1  1 ? 1 
ATOM   6095  C  CD2  . LEU   A  1  391 ? 0.516   -13.501 0.307   1.000 30.993  0 446  LEU   A CD2  1 ? 1 
ATOM   6096  H  H    . LEU   A  1  391 ? 1.006   -17.752 -0.545  1.000 19.082  0 446  LEU   A H    1 c 1 
ATOM   6097  H  HA   . LEU   A  1  391 ? 1.102   -15.883 1.503   1.000 20.336  0 446  LEU   A HA   1 c 1 
ATOM   6098  H  HB2  . LEU   A  1  391 ? -1.036  -16.437 -0.292  1.000 24.615  0 446  LEU   A HB2  1 c 1 
ATOM   6099  H  HB3  . LEU   A  1  391 ? -1.234  -15.469 0.937   1.000 24.288  0 446  LEU   A HB3  1 c 1 
ATOM   6100  H  HG   . LEU   A  1  391 ? 0.548   -14.943 -1.207  1.000 29.054  0 446  LEU   A HG   1 c 1 
ATOM   6101  H  HD11 . LEU   A  1  391 ? -0.972  -13.481 -2.069  1.000 30.532  0 446  LEU   A HD11 1 c 1 
ATOM   6102  H  HD12 . LEU   A  1  391 ? -1.876  -13.532 -0.764  1.000 30.540  0 446  LEU   A HD12 1 c 1 
ATOM   6103  H  HD13 . LEU   A  1  391 ? -1.822  -14.783 -1.741  1.000 30.749  0 446  LEU   A HD13 1 c 1 
ATOM   6104  H  HD21 . LEU   A  1  391 ? 1.360   -13.818 0.670   1.000 30.326  0 446  LEU   A HD21 1 c 1 
ATOM   6105  H  HD22 . LEU   A  1  391 ? -0.084  -13.270 1.037   1.000 30.350  0 446  LEU   A HD22 1 c 1 
ATOM   6106  H  HD23 . LEU   A  1  391 ? 0.676   -12.713 -0.242  1.000 30.202  0 446  LEU   A HD23 1 c 1 
ATOM   6107  N  N    . VAL   A  1  392 ? 0.054   -17.046 3.363   1.000 20.721  0 447  VAL   A N    1 ? 1 
ATOM   6108  C  CA   . VAL   A  1  392 ? -0.390  -17.852 4.487   1.000 18.533  0 447  VAL   A CA   1 ? 1 
ATOM   6109  C  C    . VAL   A  1  392 ? -1.644  -17.241 5.086   1.000 18.654  0 447  VAL   A C    1 ? 1 
ATOM   6110  O  O    . VAL   A  1  392 ? -1.741  -16.019 5.207   1.000 18.389  0 447  VAL   A O    1 ? 1 
ATOM   6111  C  CB   . VAL   A  1  392 ? 0.735   -18.041 5.517   1.000 21.510  0 447  VAL   A CB   1 ? 1 
ATOM   6112  C  CG1  . VAL   A  1  392 ? 0.309   -18.949 6.644   1.000 21.399  0 447  VAL   A CG1  1 ? 1 
ATOM   6113  C  CG2  . VAL   A  1  392 ? 1.960   -18.634 4.852   1.000 24.968  0 447  VAL   A CG2  1 ? 1 
ATOM   6114  H  H    . VAL   A  1  392 ? 0.480   -16.256 3.536   1.000 19.712  0 447  VAL   A H    1 c 1 
ATOM   6115  H  HA   . VAL   A  1  392 ? -0.624  -18.733 4.145   1.000 19.766  0 447  VAL   A HA   1 c 1 
ATOM   6116  H  HB   . VAL   A  1  392 ? 0.971   -17.157 5.890   1.000 21.106  0 447  VAL   A HB   1 c 1 
ATOM   6117  H  HG11 . VAL   A  1  392 ? -0.038  -19.781 6.278   1.000 21.843  0 447  VAL   A HG11 1 c 1 
ATOM   6118  H  HG12 . VAL   A  1  392 ? -0.383  -18.513 7.170   1.000 21.451  0 447  VAL   A HG12 1 c 1 
ATOM   6119  H  HG13 . VAL   A  1  392 ? 1.074   -19.141 7.213   1.000 21.787  0 447  VAL   A HG13 1 c 1 
ATOM   6120  H  HG21 . VAL   A  1  392 ? 2.654   -18.777 5.518   1.000 24.086  0 447  VAL   A HG21 1 c 1 
ATOM   6121  H  HG22 . VAL   A  1  392 ? 2.289   -18.024 4.170   1.000 23.611  0 447  VAL   A HG22 1 c 1 
ATOM   6122  H  HG23 . VAL   A  1  392 ? 1.727   -19.484 4.440   1.000 24.191  0 447  VAL   A HG23 1 c 1 
ATOM   6123  N  N    . ASP   A  1  393 ? -2.612  -18.103 5.436   1.000 15.347  0 448  ASP   A N    1 ? 1 
ATOM   6124  C  CA   . ASP   A  1  393 ? -3.789  -17.632 6.157   1.000 17.703  0 448  ASP   A CA   1 ? 1 
ATOM   6125  C  C    . ASP   A  1  393 ? -3.433  -17.006 7.505   1.000 20.299  0 448  ASP   A C    1 ? 1 
ATOM   6126  O  O    . ASP   A  1  393 ? -2.593  -17.521 8.255   1.000 19.229  0 448  ASP   A O    1 ? 1 
ATOM   6127  C  CB   . ASP   A  1  393 ? -4.750  -18.727 6.446   1.000 21.336  0 448  ASP   A CB   1 ? 1 
ATOM   6128  C  CG   . ASP   A  1  393 ? -5.407  -19.372 5.256   1.000 36.495  0 448  ASP   A CG   1 ? 1 
ATOM   6129  O  OD1  . ASP   A  1  393 ? -5.075  -18.995 4.100   1.000 44.090  0 448  ASP   A OD1  1 ? 1 
ATOM   6130  O  OD2  . ASP   A  1  393 ? -6.258  -20.243 5.472   1.000 44.647  0 448  ASP   A OD2  1 ? 1 
ATOM   6131  H  H    . ASP   A  1  393 ? -2.539  -18.990 5.228   1.000 17.056  0 448  ASP   A H    1 c 1 
ATOM   6132  H  HA   . ASP   A  1  393 ? -4.243  -16.956 5.602   1.000 18.069  0 448  ASP   A HA   1 c 1 
ATOM   6133  H  HB2  . ASP   A  1  393 ? -4.281  -19.427 6.943   1.000 23.335  0 448  ASP   A HB2  1 c 1 
ATOM   6134  H  HB3  . ASP   A  1  393 ? -5.460  -18.375 7.021   1.000 23.054  0 448  ASP   A HB3  1 c 1 
ATOM   6135  N  N    . ARG   A  1  394 ? -4.106  -15.904 7.811   1.000 21.143  0 449  ARG   A N    1 ? 1 
ATOM   6136  C  CA   . ARG   A  1  394 ? -4.008  -15.308 9.126   1.000 23.964  0 449  ARG   A CA   1 ? 1 
ATOM   6137  C  C    . ARG   A  1  394 ? -4.185  -16.432 10.156  1.000 28.928  0 449  ARG   A C    1 ? 1 
ATOM   6138  O  O    . ARG   A  1  394 ? -4.955  -17.371 9.938   1.000 26.536  0 449  ARG   A O    1 ? 1 
ATOM   6139  C  CB   . ARG   A  1  394 ? -5.020  -14.158 9.239   1.000 24.776  0 449  ARG   A CB   1 ? 1 
ATOM   6140  C  CG   . ARG   A  1  394 ? -6.455  -14.594 9.264   1.000 29.312  0 449  ARG   A CG   1 ? 1 
ATOM   6141  C  CD   . ARG   A  1  394 ? -7.452  -13.444 9.226   1.000 36.765  0 449  ARG   A CD   1 ? 1 
ATOM   6142  N  NE   . ARG   A  1  394 ? -8.664  -13.746 9.997   1.000 98.909  0 449  ARG   A NE   1 ? 1 
ATOM   6143  C  CZ   . ARG   A  1  394 ? -9.459  -14.814 9.858   1.000 66.229  0 449  ARG   A CZ   1 ? 1 
ATOM   6144  N  NH1  . ARG   A  1  394 ? -9.457  -15.552 8.758   1.000 90.776  0 449  ARG   A NH1  1 ? 1 
ATOM   6145  N  NH2  . ARG   A  1  394 ? -10.297 -15.129 10.842  1.000 72.354  0 449  ARG   A NH2  1 ? 1 
ATOM   6146  H  H    . ARG   A  1  394 ? -4.646  -15.513 7.186   1.000 21.358  0 449  ARG   A H    1 c 1 
ATOM   6147  H  HA   . ARG   A  1  394 ? -3.102  -14.935 9.223   1.000 24.041  0 449  ARG   A HA   1 c 1 
ATOM   6148  H  HB2  . ARG   A  1  394 ? -4.830  -13.657 10.059  1.000 25.419  0 449  ARG   A HB2  1 c 1 
ATOM   6149  H  HB3  . ARG   A  1  394 ? -4.889  -13.552 8.480   1.000 25.072  0 449  ARG   A HB3  1 c 1 
ATOM   6150  H  HG2  . ARG   A  1  394 ? -6.624  -15.180 8.495   1.000 29.737  0 449  ARG   A HG2  1 c 1 
ATOM   6151  H  HG3  . ARG   A  1  394 ? -6.615  -15.119 10.077  1.000 30.412  0 449  ARG   A HG3  1 c 1 
ATOM   6152  H  HD2  . ARG   A  1  394 ? -7.030  -12.637 9.591   1.000 43.801  0 449  ARG   A HD2  1 c 1 
ATOM   6153  H  HD3  . ARG   A  1  394 ? -7.699  -13.261 8.294   1.000 43.950  0 449  ARG   A HD3  1 c 1 
ATOM   6154  H  HE   . ARG   A  1  394 ? -8.892  -13.168 10.608  1.000 70.094  0 449  ARG   A HE   1 c 1 
ATOM   6155  H  HH11 . ARG   A  1  394 ? -9.172  -15.207 7.997   1.000 81.426  0 449  ARG   A HH11 1 c 1 
ATOM   6156  H  HH12 . ARG   A  1  394 ? -9.743  -16.387 8.789   1.000 82.278  0 449  ARG   A HH12 1 c 1 
ATOM   6157  H  HH21 . ARG   A  1  394 ? -10.886 -15.772 10.728  1.000 71.148  0 449  ARG   A HH21 1 c 1 
ATOM   6158  H  HH22 . ARG   A  1  394 ? -10.261 -14.695 11.606  1.000 70.846  0 449  ARG   A HH22 1 c 1 
ATOM   6159  N  N    . ARG   A  1  395 ? -3.386  -16.356 11.237  1.000 22.253  0 450  ARG   A N    1 ? 1 
ATOM   6160  C  CA   . ARG   A  1  395 ? -3.414  -17.244 12.394  1.000 20.176  0 450  ARG   A CA   1 ? 1 
ATOM   6161  C  C    . ARG   A  1  395 ? -2.570  -18.484 12.165  1.000 19.700  0 450  ARG   A C    1 ? 1 
ATOM   6162  O  O    . ARG   A  1  395 ? -2.425  -19.269 13.100  1.000 20.065  0 450  ARG   A O    1 ? 1 
ATOM   6163  C  CB   . ARG   A  1  395 ? -4.841  -17.652 12.894  1.000 19.824  0 450  ARG   A CB   1 ? 1 
ATOM   6164  C  CG   . ARG   A  1  395 ? -5.643  -16.453 13.400  1.000 23.892  0 450  ARG   A CG   1 ? 1 
ATOM   6165  C  CD   . ARG   A  1  395 ? -7.148  -16.641 13.489  1.000 25.474  0 450  ARG   A CD   1 ? 1 
ATOM   6166  N  NE   . ARG   A  1  395 ? -7.529  -17.976 13.924  1.000 47.537  0 450  ARG   A NE   1 ? 1 
ATOM   6167  C  CZ   . ARG   A  1  395 ? -7.430  -18.434 15.165  1.000 60.336  0 450  ARG   A CZ   1 ? 1 
ATOM   6168  N  NH1  . ARG   A  1  395 ? -7.092  -17.642 16.167  1.000 53.441  0 450  ARG   A NH1  1 ? 1 
ATOM   6169  N  NH2  . ARG   A  1  395 ? -7.715  -19.712 15.410  1.000 70.281  0 450  ARG   A NH2  1 ? 1 
ATOM   6170  H  H    . ARG   A  1  395 ? -2.774  -15.678 11.251  1.000 22.677  0 450  ARG   A H    1 c 1 
ATOM   6171  H  HA   . ARG   A  1  395 ? -2.991  -16.748 13.125  1.000 20.362  0 450  ARG   A HA   1 c 1 
ATOM   6172  H  HB2  . ARG   A  1  395 ? -5.329  -18.083 12.163  1.000 20.954  0 450  ARG   A HB2  1 c 1 
ATOM   6173  H  HB3  . ARG   A  1  395 ? -4.748  -18.302 13.622  1.000 21.294  0 450  ARG   A HB3  1 c 1 
ATOM   6174  H  HG2  . ARG   A  1  395 ? -5.314  -16.210 14.290  1.000 23.312  0 450  ARG   A HG2  1 c 1 
ATOM   6175  H  HG3  . ARG   A  1  395 ? -5.466  -15.690 12.810  1.000 22.646  0 450  ARG   A HG3  1 c 1 
ATOM   6176  H  HD2  . ARG   A  1  395 ? -7.517  -15.982 14.115  1.000 29.113  0 450  ARG   A HD2  1 c 1 
ATOM   6177  H  HD3  . ARG   A  1  395 ? -7.543  -16.469 12.608  1.000 28.720  0 450  ARG   A HD3  1 c 1 
ATOM   6178  H  HE   . ARG   A  1  395 ? -7.851  -18.519 13.322  1.000 43.108  0 450  ARG   A HE   1 c 1 
ATOM   6179  H  HH11 . ARG   A  1  395 ? -6.539  -16.969 16.033  1.000 53.595  0 450  ARG   A HH11 1 c 1 
ATOM   6180  H  HH12 . ARG   A  1  395 ? -7.421  -17.794 16.973  1.000 55.629  0 450  ARG   A HH12 1 c 1 
ATOM   6181  H  HH21 . ARG   A  1  395 ? -7.632  -20.030 16.225  1.000 66.168  0 450  ARG   A HH21 1 c 1 
ATOM   6182  H  HH22 . ARG   A  1  395 ? -7.986  -20.235 14.757  1.000 66.546  0 450  ARG   A HH22 1 c 1 
ATOM   6183  N  N    . TRP   A  1  396 ? -1.938  -18.590 10.983  1.000 21.864  0 451  TRP   A N    1 ? 1 
ATOM   6184  C  CA   . TRP   A  1  396 ? -1.165  -19.770 10.627  1.000 21.599  0 451  TRP   A CA   1 ? 1 
ATOM   6185  C  C    . TRP   A  1  396 ? 0.291   -19.446 10.322  1.000 20.259  0 451  TRP   A C    1 ? 1 
ATOM   6186  O  O    . TRP   A  1  396 ? 0.626   -18.302 10.028  1.000 19.248  0 451  TRP   A O    1 ? 1 
ATOM   6187  C  CB   . TRP   A  1  396 ? -1.806  -20.546 9.421   1.000 22.169  0 451  TRP   A CB   1 ? 1 
ATOM   6188  C  CG   . TRP   A  1  396 ? -2.990  -21.347 9.862   1.000 19.721  0 451  TRP   A CG   1 ? 1 
ATOM   6189  C  CD1  . TRP   A  1  396 ? -4.236  -20.872 10.125  1.000 21.468  0 451  TRP   A CD1  1 ? 1 
ATOM   6190  C  CD2  . TRP   A  1  396 ? -3.026  -22.749 10.163  1.000 23.769  0 451  TRP   A CD2  1 ? 1 
ATOM   6191  N  NE1  . TRP   A  1  396 ? -5.043  -21.871 10.558  1.000 20.131  0 451  TRP   A NE1  1 ? 1 
ATOM   6192  C  CE2  . TRP   A  1  396 ? -4.330  -23.042 10.604  1.000 21.493  0 451  TRP   A CE2  1 ? 1 
ATOM   6193  C  CE3  . TRP   A  1  396 ? -2.079  -23.784 10.112  1.000 21.974  0 451  TRP   A CE3  1 ? 1 
ATOM   6194  C  CZ2  . TRP   A  1  396 ? -4.721  -24.327 10.986  1.000 25.686  0 451  TRP   A CZ2  1 ? 1 
ATOM   6195  C  CZ3  . TRP   A  1  396 ? -2.464  -25.062 10.492  1.000 24.570  0 451  TRP   A CZ3  1 ? 1 
ATOM   6196  C  CH2  . TRP   A  1  396 ? -3.767  -25.318 10.938  1.000 23.946  0 451  TRP   A CH2  1 ? 1 
ATOM   6197  H  H    . TRP   A  1  396 ? -1.979  -17.901 10.385  1.000 20.762  0 451  TRP   A H    1 c 1 
ATOM   6198  H  HA   . TRP   A  1  396 ? -1.184  -20.377 11.401  1.000 22.143  0 451  TRP   A HA   1 c 1 
ATOM   6199  H  HB2  . TRP   A  1  396 ? -2.080  -19.904 8.738   1.000 20.920  0 451  TRP   A HB2  1 c 1 
ATOM   6200  H  HB3  . TRP   A  1  396 ? -1.133  -21.142 9.032   1.000 21.481  0 451  TRP   A HB3  1 c 1 
ATOM   6201  H  HD1  . TRP   A  1  396 ? -4.509  -19.974 10.021  1.000 20.262  0 451  TRP   A HD1  1 c 1 
ATOM   6202  H  HE1  . TRP   A  1  396 ? -5.887  -21.780 10.777  1.000 20.927  0 451  TRP   A HE1  1 c 1 
ATOM   6203  H  HE3  . TRP   A  1  396 ? -1.190  -23.609 9.844   1.000 22.726  0 451  TRP   A HE3  1 c 1 
ATOM   6204  H  HZ2  . TRP   A  1  396 ? -5.605  -24.506 11.260  1.000 24.500  0 451  TRP   A HZ2  1 c 1 
ATOM   6205  H  HZ3  . TRP   A  1  396 ? -1.835  -25.765 10.469  1.000 24.238  0 451  TRP   A HZ3  1 c 1 
ATOM   6206  H  HH2  . TRP   A  1  396 ? -4.010  -26.198 11.164  1.000 25.131  0 451  TRP   A HH2  1 c 1 
ATOM   6207  N  N    . HIS   A  1  397 ? 1.132   -20.486 10.446  1.000 19.455  0 452  HIS   A N    1 ? 1 
ATOM   6208  C  CA   . HIS   A  1  397 ? 2.484   -20.518 9.921   1.000 17.644  0 452  HIS   A CA   1 ? 1 
ATOM   6209  C  C    . HIS   A  1  397 ? 2.615   -21.612 8.871   1.000 23.104  0 452  HIS   A C    1 ? 1 
ATOM   6210  O  O    . HIS   A  1  397 ? 1.815   -22.555 8.839   1.000 21.792  0 452  HIS   A O    1 ? 1 
ATOM   6211  C  CB   . HIS   A  1  397 ? 3.477   -20.830 11.020  1.000 21.617  0 452  HIS   A CB   1 ? 1 
ATOM   6212  C  CG   . HIS   A  1  397 ? 3.923   -19.695 11.890  1.000 26.462  0 452  HIS   A CG   1 ? 1 
ATOM   6213  N  ND1  . HIS   A  1  397 ? 4.668   -19.934 13.016  1.000 27.087  0 452  HIS   A ND1  1 ? 1 
ATOM   6214  C  CD2  . HIS   A  1  397 ? 3.792   -18.364 11.753  1.000 31.411  0 452  HIS   A CD2  1 ? 1 
ATOM   6215  C  CE1  . HIS   A  1  397 ? 4.938   -18.767 13.557  1.000 24.604  0 452  HIS   A CE1  1 ? 1 
ATOM   6216  N  NE2  . HIS   A  1  397 ? 4.448   -17.793 12.842  1.000 25.463  0 452  HIS   A NE2  1 ? 1 
ATOM   6217  H  H    . HIS   A  1  397 ? 0.834   -21.225 10.892  1.000 19.748  0 452  HIS   A H    1 c 1 
ATOM   6218  H  HA   . HIS   A  1  397 ? 2.696   -19.645 9.524   1.000 19.078  0 452  HIS   A HA   1 c 1 
ATOM   6219  H  HB2  . HIS   A  1  397 ? 3.081   -21.515 11.598  1.000 22.022  0 452  HIS   A HB2  1 c 1 
ATOM   6220  H  HB3  . HIS   A  1  397 ? 4.273   -21.223 10.608  1.000 21.828  0 452  HIS   A HB3  1 c 1 
ATOM   6221  H  HD1  . HIS   A  1  397 ? 4.914   -20.729 13.314  0.000 16.710  0 452  HIS   A HD1  1 c 1 
ATOM   6222  H  HD2  . HIS   A  1  397 ? 3.333   -17.912 11.061  1.000 28.044  0 452  HIS   A HD2  1 c 1 
ATOM   6223  H  HE1  . HIS   A  1  397 ? 5.431   -18.649 14.351  1.000 25.823  0 452  HIS   A HE1  1 c 1 
ATOM   6224  H  HE2  . HIS   A  1  397 ? 4.523   -16.934 13.040  0.000 15.260  0 452  HIS   A HE2  1 c 1 
ATOM   6225  N  N    . VAL   A  1  398 ? 3.646   -21.468 8.034   1.000 22.555  0 453  VAL   A N    1 ? 1 
ATOM   6226  C  CA   . VAL   A  1  398 ? 4.118   -22.519 7.159   1.000 21.623  0 453  VAL   A CA   1 ? 1 
ATOM   6227  C  C    . VAL   A  1  398 ? 5.579   -22.788 7.513   1.000 26.125  0 453  VAL   A C    1 ? 1 
ATOM   6228  O  O    . VAL   A  1  398 ? 6.347   -21.859 7.771   1.000 24.448  0 453  VAL   A O    1 ? 1 
ATOM   6229  C  CB   . VAL   A  1  398 ? 3.987   -22.135 5.676   1.000 21.362  0 453  VAL   A CB   1 ? 1 
ATOM   6230  C  CG1  . VAL   A  1  398 ? 4.957   -20.973 5.290   1.000 22.797  0 453  VAL   A CG1  1 ? 1 
ATOM   6231  C  CG2  . VAL   A  1  398 ? 4.225   -23.341 4.791   1.000 22.938  0 453  VAL   A CG2  1 ? 1 
ATOM   6232  H  H    . VAL   A  1  398 ? 4.081   -20.664 8.016   1.000 21.993  0 453  VAL   A H    1 c 1 
ATOM   6233  H  HA   . VAL   A  1  398 ? 3.598   -23.323 7.324   1.000 22.961  0 453  VAL   A HA   1 c 1 
ATOM   6234  H  HB   . VAL   A  1  398 ? 3.061   -21.823 5.527   1.000 21.600  0 453  VAL   A HB   1 c 1 
ATOM   6235  H  HG11 . VAL   A  1  398 ? 5.863   -21.317 5.209   1.000 22.526  0 453  VAL   A HG11 1 c 1 
ATOM   6236  H  HG12 . VAL   A  1  398 ? 4.931   -20.284 5.976   1.000 22.014  0 453  VAL   A HG12 1 c 1 
ATOM   6237  H  HG13 . VAL   A  1  398 ? 4.680   -20.591 4.439   1.000 21.944  0 453  VAL   A HG13 1 c 1 
ATOM   6238  H  HG21 . VAL   A  1  398 ? 4.053   -23.103 3.864   1.000 22.381  0 453  VAL   A HG21 1 c 1 
ATOM   6239  H  HG22 . VAL   A  1  398 ? 3.627   -24.062 5.056   1.000 22.916  0 453  VAL   A HG22 1 c 1 
ATOM   6240  H  HG23 . VAL   A  1  398 ? 5.148   -23.637 4.882   1.000 22.899  0 453  VAL   A HG23 1 c 1 
ATOM   6241  N  N    . ALA   A  1  399 ? 5.950   -24.076 7.508   1.000 24.283  0 454  ALA   A N    1 ? 1 
ATOM   6242  C  CA   . ALA   A  1  399 ? 7.321   -24.510 7.742   1.000 22.771  0 454  ALA   A CA   1 ? 1 
ATOM   6243  C  C    . ALA   A  1  399 ? 7.651   -25.637 6.770   1.000 26.433  0 454  ALA   A C    1 ? 1 
ATOM   6244  O  O    . ALA   A  1  399 ? 6.767   -26.213 6.124   1.000 21.309  0 454  ALA   A O    1 ? 1 
ATOM   6245  C  CB   . ALA   A  1  399 ? 7.492   -24.981 9.184   1.000 24.532  0 454  ALA   A CB   1 ? 1 
ATOM   6246  H  H    . ALA   A  1  399 ? 5.315   -24.715 7.351   1.000 24.532  0 454  ALA   A H    1 c 1 
ATOM   6247  H  HA   . ALA   A  1  399 ? 7.932   -23.755 7.572   1.000 23.653  0 454  ALA   A HA   1 c 1 
ATOM   6248  H  HB1  . ALA   A  1  399 ? 8.410   -25.266 9.326   1.000 24.523  0 454  ALA   A HB1  1 c 1 
ATOM   6249  H  HB2  . ALA   A  1  399 ? 7.283   -24.251 9.792   1.000 23.852  0 454  ALA   A HB2  1 c 1 
ATOM   6250  H  HB3  . ALA   A  1  399 ? 6.892   -25.725 9.357   1.000 24.468  0 454  ALA   A HB3  1 c 1 
ATOM   6251  N  N    . ARG   A  1  400 ? 8.936   -25.957 6.677   1.000 24.710  0 455  ARG   A N    1 ? 1 
ATOM   6252  C  CA   . ARG   A  1  400 ? 9.387   -26.898 5.671   1.000 28.413  0 455  ARG   A CA   1 ? 1 
ATOM   6253  C  C    . ARG   A  1  400 ? 9.127   -28.333 6.145   1.000 27.256  0 455  ARG   A C    1 ? 1 
ATOM   6254  O  O    . ARG   A  1  400 ? 8.530   -29.139 5.421   1.000 26.038  0 455  ARG   A O    1 ? 1 
ATOM   6255  C  CB   . ARG   A  1  400 ? 10.868  -26.618 5.344   1.000 27.289  0 455  ARG   A CB   1 ? 1 
ATOM   6256  C  CG   . ARG   A  1  400 ? 11.458  -27.451 4.229   1.000 31.819  0 455  ARG   A CG   1 ? 1 
ATOM   6257  C  CD   . ARG   A  1  400 ? 12.919  -27.155 4.012   1.000 36.038  0 455  ARG   A CD   1 ? 1 
ATOM   6258  N  NE   . ARG   A  1  400 ? 13.732  -27.608 5.132   1.000 37.141  0 455  ARG   A NE   1 ? 1 
ATOM   6259  C  CZ   . ARG   A  1  400 ? 14.822  -28.356 5.030   1.000 44.447  0 455  ARG   A CZ   1 ? 1 
ATOM   6260  N  NH1  . ARG   A  1  400 ? 15.383  -28.626 3.858   1.000 50.245  0 455  ARG   A NH1  1 ? 1 
ATOM   6261  N  NH2  . ARG   A  1  400 ? 15.380  -28.827 6.140   1.000 52.353  0 455  ARG   A NH2  1 ? 1 
ATOM   6262  H  H    . ARG   A  1  400 ? 9.545   -25.587 7.250   1.000 25.881  0 455  ARG   A H    1 c 1 
ATOM   6263  H  HA   . ARG   A  1  400 ? 8.859   -26.745 4.854   1.000 26.793  0 455  ARG   A HA   1 c 1 
ATOM   6264  H  HB2  . ARG   A  1  400 ? 10.955  -25.672 5.102   1.000 27.958  0 455  ARG   A HB2  1 c 1 
ATOM   6265  H  HB3  . ARG   A  1  400 ? 11.392  -26.763 6.154   1.000 28.945  0 455  ARG   A HB3  1 c 1 
ATOM   6266  H  HG2  . ARG   A  1  400 ? 11.355  -28.403 4.444   1.000 32.165  0 455  ARG   A HG2  1 c 1 
ATOM   6267  H  HG3  . ARG   A  1  400 ? 10.969  -27.274 3.397   1.000 31.301  0 455  ARG   A HG3  1 c 1 
ATOM   6268  H  HD2  . ARG   A  1  400 ? 13.216  -27.597 3.189   1.000 35.634  0 455  ARG   A HD2  1 c 1 
ATOM   6269  H  HD3  . ARG   A  1  400 ? 13.039  -26.189 3.896   1.000 34.706  0 455  ARG   A HD3  1 c 1 
ATOM   6270  H  HE   . ARG   A  1  400 ? 13.491  -27.362 5.932   1.000 38.266  0 455  ARG   A HE   1 c 1 
ATOM   6271  H  HH11 . ARG   A  1  400 ? 15.348  -28.037 3.203   1.000 47.806  0 455  ARG   A HH11 1 c 1 
ATOM   6272  H  HH12 . ARG   A  1  400 ? 15.809  -29.387 3.746   1.000 48.973  0 455  ARG   A HH12 1 c 1 
ATOM   6273  H  HH21 . ARG   A  1  400 ? 16.154  -29.242 6.097   1.000 50.419  0 455  ARG   A HH21 1 c 1 
ATOM   6274  H  HH22 . ARG   A  1  400 ? 14.976  -28.724 6.914   1.000 49.579  0 455  ARG   A HH22 1 c 1 
ATOM   6275  N  N    . LYS   A  1  401 ? 9.598   -28.650 7.350   1.000 26.757  0 456  LYS   A N    1 ? 1 
ATOM   6276  C  CA   . LYS   A  1  401 ? 9.313   -29.940 7.952   1.000 29.922  0 456  LYS   A CA   1 ? 1 
ATOM   6277  C  C    . LYS   A  1  401 ? 9.251   -29.839 9.472   1.000 34.186  0 456  LYS   A C    1 ? 1 
ATOM   6278  O  O    . LYS   A  1  401 ? 9.780   -28.891 10.040  1.000 28.249  0 456  LYS   A O    1 ? 1 
ATOM   6279  C  CB   . LYS   A  1  401 ? 10.367  -30.971 7.503   1.000 37.308  0 456  LYS   A CB   1 ? 1 
ATOM   6280  C  CG   . LYS   A  1  401 ? 11.718  -30.886 8.179   1.000 43.120  0 456  LYS   A CG   1 ? 1 
ATOM   6281  C  CD   . LYS   A  1  401 ? 12.847  -31.502 7.382   1.000 48.530  0 456  LYS   A CD   1 ? 1 
ATOM   6282  C  CE   . LYS   A  1  401 ? 12.511  -32.870 6.832   1.000 52.395  0 456  LYS   A CE   1 ? 1 
ATOM   6283  N  NZ   . LYS   A  1  401 ? 13.693  -33.484 6.172   1.000 61.118  0 456  LYS   A NZ   1 ? 1 
ATOM   6284  H  H    . LYS   A  1  401 ? 10.114  -28.051 7.809   1.000 27.376  0 456  LYS   A H    1 c 1 
ATOM   6285  H  HA   . LYS   A  1  401 ? 8.433   -30.236 7.627   1.000 30.980  0 456  LYS   A HA   1 c 1 
ATOM   6286  H  HB2  . LYS   A  1  401 ? 10.002  -31.867 7.659   1.000 37.238  0 456  LYS   A HB2  1 c 1 
ATOM   6287  H  HB3  . LYS   A  1  401 ? 10.499  -30.871 6.537   1.000 36.627  0 456  LYS   A HB3  1 c 1 
ATOM   6288  H  HG2  . LYS   A  1  401 ? 11.925  -29.944 8.345   1.000 42.256  0 456  LYS   A HG2  1 c 1 
ATOM   6289  H  HG3  . LYS   A  1  401 ? 11.663  -31.336 9.048   1.000 43.141  0 456  LYS   A HG3  1 c 1 
ATOM   6290  H  HD2  . LYS   A  1  401 ? 13.072  -30.907 6.635   1.000 47.617  0 456  LYS   A HD2  1 c 1 
ATOM   6291  H  HD3  . LYS   A  1  401 ? 13.639  -31.577 7.956   1.000 48.435  0 456  LYS   A HD3  1 c 1 
ATOM   6292  H  HE2  . LYS   A  1  401 ? 12.212  -33.451 7.556   1.000 53.715  0 456  LYS   A HE2  1 c 1 
ATOM   6293  H  HE3  . LYS   A  1  401 ? 11.788  -32.797 6.182   1.000 52.757  0 456  LYS   A HE3  1 c 1 
ATOM   6294  H  HZ1  . LYS   A  1  401 ? 14.358  -33.600 6.778   1.000 58.867  0 456  LYS   A HZ1  1 c 1 
ATOM   6295  H  HZ2  . LYS   A  1  401 ? 13.989  -32.943 5.507   1.000 58.097  0 456  LYS   A HZ2  1 c 1 
ATOM   6296  H  HZ3  . LYS   A  1  401 ? 13.466  -34.289 5.822   1.000 58.906  0 456  LYS   A HZ3  1 c 1 
ATOM   6297  N  N    . PRO   A  1  402 ? 8.582   -30.787 10.167  1.000 28.770  0 457  PRO   A N    1 ? 1 
ATOM   6298  C  CA   . PRO   A  1  402 ? 8.440   -30.730 11.622  1.000 34.265  0 457  PRO   A CA   1 ? 1 
ATOM   6299  C  C    . PRO   A  1  402 ? 9.720   -30.472 12.419  1.000 32.192  0 457  PRO   A C    1 ? 1 
ATOM   6300  O  O    . PRO   A  1  402 ? 9.776   -29.551 13.228  1.000 36.323  0 457  PRO   A O    1 ? 1 
ATOM   6301  C  CB   . PRO   A  1  402 ? 7.852   -32.093 11.907  1.000 34.979  0 457  PRO   A CB   1 ? 1 
ATOM   6302  C  CG   . PRO   A  1  402 ? 6.928   -32.335 10.756  1.000 29.979  0 457  PRO   A CG   1 ? 1 
ATOM   6303  C  CD   . PRO   A  1  402 ? 7.823   -31.922 9.592   1.000 30.716  0 457  PRO   A CD   1 ? 1 
ATOM   6304  H  HA   . PRO   A  1  402 ? 7.769   -30.041 11.850  1.000 32.138  0 457  PRO   A HA   1 c 1 
ATOM   6305  H  HB2  . PRO   A  1  402 ? 8.554   -32.779 11.941  1.000 34.410  0 457  PRO   A HB2  1 c 1 
ATOM   6306  H  HB3  . PRO   A  1  402 ? 7.373   -32.095 12.748  1.000 33.904  0 457  PRO   A HB3  1 c 1 
ATOM   6307  H  HG2  . PRO   A  1  402 ? 6.668   -33.277 10.693  1.000 31.764  0 457  PRO   A HG2  1 c 1 
ATOM   6308  H  HG3  . PRO   A  1  402 ? 6.127   -31.774 10.811  1.000 30.688  0 457  PRO   A HG3  1 c 1 
ATOM   6309  H  HD2  . PRO   A  1  402 ? 8.417   -32.647 9.325   1.000 30.682  0 457  PRO   A HD2  1 c 1 
ATOM   6310  H  HD3  . PRO   A  1  402 ? 7.292   -31.642 8.824   1.000 29.718  0 457  PRO   A HD3  1 c 1 
ATOM   6311  N  N    . LEU   A  1  403 ? 10.768  -31.243 12.158  1.000 35.258  0 458  LEU   A N    1 ? 1 
ATOM   6312  C  CA   . LEU   A  1  403 ? 11.979  -31.110 12.952  1.000 37.823  0 458  LEU   A CA   1 ? 1 
ATOM   6313  C  C    . LEU   A  1  403 ? 12.752  -29.804 12.726  1.000 48.416  0 458  LEU   A C    1 ? 1 
ATOM   6314  O  O    . LEU   A  1  403 ? 13.620  -29.465 13.528  1.000 54.302  0 458  LEU   A O    1 ? 1 
ATOM   6315  C  CB   . LEU   A  1  403 ? 12.874  -32.331 12.685  1.000 39.387  0 458  LEU   A CB   1 ? 1 
ATOM   6316  C  CG   . LEU   A  1  403 ? 12.445  -33.639 13.305  1.000 34.736  0 458  LEU   A CG   1 ? 1 
ATOM   6317  C  CD1  . LEU   A  1  403 ? 13.464  -34.645 13.115  1.000 48.397  0 458  LEU   A CD1  1 ? 1 
ATOM   6318  C  CD2  . LEU   A  1  403 ? 12.176  -33.481 14.760  1.000 37.904  0 458  LEU   A CD2  1 ? 1 
ATOM   6319  H  H    . LEU   A  1  403 ? 10.735  -31.855 11.481  1.000 35.338  0 458  LEU   A H    1 c 1 
ATOM   6320  H  HA   . LEU   A  1  403 ? 11.708  -31.126 13.898  1.000 39.294  0 458  LEU   A HA   1 c 1 
ATOM   6321  H  HB2  . LEU   A  1  403 ? 12.935  -32.457 11.717  1.000 37.738  0 458  LEU   A HB2  1 c 1 
ATOM   6322  H  HB3  . LEU   A  1  403 ? 13.773  -32.123 13.007  1.000 38.209  0 458  LEU   A HB3  1 c 1 
ATOM   6323  H  HG   . LEU   A  1  403 ? 11.615  -33.943 12.862  1.000 38.141  0 458  LEU   A HG   1 c 1 
ATOM   6324  H  HD11 . LEU   A  1  403 ? 13.101  -35.520 13.334  1.000 44.122  0 458  LEU   A HD11 1 c 1 
ATOM   6325  H  HD12 . LEU   A  1  403 ? 14.221  -34.454 13.695  1.000 43.816  0 458  LEU   A HD12 1 c 1 
ATOM   6326  H  HD13 . LEU   A  1  403 ? 13.758  -34.639 12.187  1.000 43.412  0 458  LEU   A HD13 1 c 1 
ATOM   6327  H  HD21 . LEU   A  1  403 ? 11.319  -33.038 14.888  1.000 36.570  0 458  LEU   A HD21 1 c 1 
ATOM   6328  H  HD22 . LEU   A  1  403 ? 12.881  -32.947 15.165  1.000 37.244  0 458  LEU   A HD22 1 c 1 
ATOM   6329  H  HD23 . LEU   A  1  403 ? 12.150  -34.357 15.183  1.000 37.860  0 458  LEU   A HD23 1 c 1 
ATOM   6330  N  N    . ASP   A  1  404 ? 12.431  -29.073 11.648  1.000 42.708  0 459  ASP   A N    1 ? 1 
ATOM   6331  C  CA   . ASP   A  1  404 ? 12.891  -27.706 11.453  1.000 36.694  0 459  ASP   A CA   1 ? 1 
ATOM   6332  C  C    . ASP   A  1  404 ? 12.340  -26.774 12.527  1.000 44.959  0 459  ASP   A C    1 ? 1 
ATOM   6333  O  O    . ASP   A  1  404 ? 12.879  -25.701 12.742  1.000 46.472  0 459  ASP   A O    1 ? 1 
ATOM   6334  C  CB   . ASP   A  1  404 ? 12.427  -27.127 10.105  1.000 36.270  0 459  ASP   A CB   1 ? 1 
ATOM   6335  C  CG   . ASP   A  1  404 ? 13.102  -27.691 8.895   1.000 46.032  0 459  ASP   A CG   1 ? 1 
ATOM   6336  O  OD1  . ASP   A  1  404 ? 14.168  -28.327 9.053   1.000 44.621  0 459  ASP   A OD1  1 ? 1 
ATOM   6337  O  OD2  . ASP   A  1  404 ? 12.547  -27.535 7.781   1.000 47.470  0 459  ASP   A OD2  1 ? 1 
ATOM   6338  H  H    . ASP   A  1  404 ? 11.913  -29.451 10.997  1.000 42.158  0 459  ASP   A H    1 c 1 
ATOM   6339  H  HA   . ASP   A  1  404 ? 13.876  -27.693 11.490  1.000 39.554  0 459  ASP   A HA   1 c 1 
ATOM   6340  H  HB2  . ASP   A  1  404 ? 11.465  -27.272 10.012  1.000 37.833  0 459  ASP   A HB2  1 c 1 
ATOM   6341  H  HB3  . ASP   A  1  404 ? 12.585  -26.161 10.109  1.000 37.693  0 459  ASP   A HB3  1 c 1 
ATOM   6342  N  N    . VAL   A  1  405 ? 11.210  -27.153 13.123  1.000 55.886  0 460  VAL   A N    1 ? 1 
ATOM   6343  C  CA   . VAL   A  1  405 ? 10.547  -26.374 14.154  1.000 52.894  0 460  VAL   A CA   1 ? 1 
ATOM   6344  C  C    . VAL   A  1  405 ? 10.908  -27.003 15.497  1.000 54.154  0 460  VAL   A C    1 ? 1 
ATOM   6345  O  O    . VAL   A  1  405 ? 11.318  -28.160 15.526  1.000 52.756  0 460  VAL   A O    1 ? 1 
ATOM   6346  C  CB   . VAL   A  1  405 ? 9.016   -26.379 13.859  1.000 55.583  0 460  VAL   A CB   1 ? 1 
ATOM   6347  C  CG1  . VAL   A  1  405 ? 8.187   -25.806 15.008  1.000 86.205  0 460  VAL   A CG1  1 ? 1 
ATOM   6348  C  CG2  . VAL   A  1  405 ? 8.729   -25.631 12.564  1.000 68.195  0 460  VAL   A CG2  1 ? 1 
ATOM   6349  H  H    . VAL   A  1  405 ? 10.817  -27.935 12.860  1.000 52.308  0 460  VAL   A H    1 c 1 
ATOM   6350  H  HA   . VAL   A  1  405 ? 10.877  -25.458 14.129  1.000 53.502  0 460  VAL   A HA   1 c 1 
ATOM   6351  H  HB   . VAL   A  1  405 ? 8.740   -27.319 13.731  1.000 62.107  0 460  VAL   A HB   1 c 1 
ATOM   6352  H  HG11 . VAL   A  1  405 ? 8.578   -24.965 15.302  1.000 74.783  0 460  VAL   A HG11 1 c 1 
ATOM   6353  H  HG12 . VAL   A  1  405 ? 8.178   -26.436 15.749  1.000 75.380  0 460  VAL   A HG12 1 c 1 
ATOM   6354  H  HG13 . VAL   A  1  405 ? 7.276   -25.650 14.705  1.000 74.648  0 460  VAL   A HG13 1 c 1 
ATOM   6355  H  HG21 . VAL   A  1  405 ? 7.768   -25.596 12.415  1.000 63.638  0 460  VAL   A HG21 1 c 1 
ATOM   6356  H  HG22 . VAL   A  1  405 ? 9.154   -26.092 11.821  1.000 63.966  0 460  VAL   A HG22 1 c 1 
ATOM   6357  H  HG23 . VAL   A  1  405 ? 9.080   -24.726 12.627  1.000 63.444  0 460  VAL   A HG23 1 c 1 
ATOM   6358  N  N    . TYR   A  1  406 ? 10.774  -26.232 16.585  1.000 48.261  0 461  TYR   A N    1 ? 1 
ATOM   6359  C  CA   . TYR   A  1  406 ? 10.833  -26.788 17.927  1.000 88.818  0 461  TYR   A CA   1 ? 1 
ATOM   6360  C  C    . TYR   A  1  406 ? 10.036  -25.958 18.932  1.000 77.315  0 461  TYR   A C    1 ? 1 
ATOM   6361  O  O    . TYR   A  1  406 ? 10.153  -24.735 18.980  1.000 66.576  0 461  TYR   A O    1 ? 1 
ATOM   6362  C  CB   . TYR   A  1  406 ? 12.298  -26.965 18.398  1.000 121.086 0 461  TYR   A CB   1 ? 1 
ATOM   6363  C  CG   . TYR   A  1  406 ? 12.964  -28.236 17.903  1.000 156.479 0 461  TYR   A CG   1 ? 1 
ATOM   6364  C  CD1  . TYR   A  1  406 ? 12.325  -29.469 18.009  1.000 140.702 0 461  TYR   A CD1  1 ? 1 
ATOM   6365  C  CD2  . TYR   A  1  406 ? 14.238  -28.208 17.349  1.000 171.324 0 461  TYR   A CD2  1 ? 1 
ATOM   6366  C  CE1  . TYR   A  1  406 ? 12.927  -30.635 17.552  1.000 134.615 0 461  TYR   A CE1  1 ? 1 
ATOM   6367  C  CE2  . TYR   A  1  406 ? 14.853  -29.370 16.896  1.000 185.730 0 461  TYR   A CE2  1 ? 1 
ATOM   6368  C  CZ   . TYR   A  1  406 ? 14.195  -30.582 17.002  1.000 170.292 0 461  TYR   A CZ   1 ? 1 
ATOM   6369  O  OH   . TYR   A  1  406 ? 14.801  -31.731 16.558  1.000 129.163 0 461  TYR   A OH   1 ? 1 
ATOM   6370  H  H    . TYR   A  1  406 ? 10.644  -25.333 16.485  1.000 56.001  0 461  TYR   A H    1 c 1 
ATOM   6371  H  HA   . TYR   A  1  406 ? 10.417  -27.684 17.893  1.000 80.800  0 461  TYR   A HA   1 c 1 
ATOM   6372  H  HB2  . TYR   A  1  406 ? 12.818  -26.194 18.090  1.000 119.498 0 461  TYR   A HB2  1 c 1 
ATOM   6373  H  HB3  . TYR   A  1  406 ? 12.312  -26.963 19.378  1.000 119.586 0 461  TYR   A HB3  1 c 1 
ATOM   6374  H  HD1  . TYR   A  1  406 ? 11.461  -29.514 18.380  1.000 141.680 0 461  TYR   A HD1  1 c 1 
ATOM   6375  H  HD2  . TYR   A  1  406 ? 14.692  -27.386 17.272  1.000 169.118 0 461  TYR   A HD2  1 c 1 
ATOM   6376  H  HE1  . TYR   A  1  406 ? 12.479  -31.460 17.626  1.000 144.387 0 461  TYR   A HE1  1 c 1 
ATOM   6377  H  HE2  . TYR   A  1  406 ? 15.717  -29.333 16.518  1.000 177.630 0 461  TYR   A HE2  1 c 1 
ATOM   6378  H  HH   . TYR   A  1  406 ? 14.411  -32.477 16.607  0.000 108.340 0 461  TYR   A HH   1 c 1 
ATOM   6379  N  N    . LYS   A  1  407 ? 9.194   -26.661 19.702  1.000 59.168  0 462  LYS   A N    1 ? 1 
ATOM   6380  C  CA   . LYS   A  1  407 ? 8.543   -26.128 20.888  1.000 71.966  0 462  LYS   A CA   1 ? 1 
ATOM   6381  C  C    . LYS   A  1  407 ? 9.576   -25.941 21.999  1.000 65.130  0 462  LYS   A C    1 ? 1 
ATOM   6382  O  O    . LYS   A  1  407 ? 10.731  -26.322 21.842  1.000 54.340  0 462  LYS   A O    1 ? 1 
ATOM   6383  C  CB   . LYS   A  1  407 ? 7.455   -27.115 21.382  1.000 94.416  0 462  LYS   A CB   1 ? 1 
ATOM   6384  C  CG   . LYS   A  1  407 ? 6.339   -27.463 20.392  1.000 92.383  0 462  LYS   A CG   1 ? 1 
ATOM   6385  C  CD   . LYS   A  1  407 ? 5.413   -28.554 20.949  1.000 96.394  0 462  LYS   A CD   1 ? 1 
ATOM   6386  C  CE   . LYS   A  1  407 ? 4.137   -28.748 20.151  1.000 95.509  0 462  LYS   A CE   1 ? 1 
ATOM   6387  N  NZ   . LYS   A  1  407 ? 4.385   -29.392 18.836  1.000 86.622  0 462  LYS   A NZ   1 ? 1 
ATOM   6388  H  H    . LYS   A  1  407 ? 9.021   -27.528 19.472  1.000 66.959  0 462  LYS   A H    1 c 1 
ATOM   6389  H  HA   . LYS   A  1  407 ? 8.131   -25.261 20.671  1.000 70.378  0 462  LYS   A HA   1 c 1 
ATOM   6390  H  HB2  . LYS   A  1  407 ? 7.898   -27.948 21.647  1.000 88.900  0 462  LYS   A HB2  1 c 1 
ATOM   6391  H  HB3  . LYS   A  1  407 ? 7.042   -26.735 22.185  1.000 88.131  0 462  LYS   A HB3  1 c 1 
ATOM   6392  H  HG2  . LYS   A  1  407 ? 5.814   -26.656 20.203  1.000 92.650  0 462  LYS   A HG2  1 c 1 
ATOM   6393  H  HG3  . LYS   A  1  407 ? 6.737   -27.773 19.552  1.000 92.919  0 462  LYS   A HG3  1 c 1 
ATOM   6394  H  HD2  . LYS   A  1  407 ? 5.903   -29.402 20.970  1.000 96.039  0 462  LYS   A HD2  1 c 1 
ATOM   6395  H  HD3  . LYS   A  1  407 ? 5.175   -28.326 21.870  1.000 95.334  0 462  LYS   A HD3  1 c 1 
ATOM   6396  H  HE2  . LYS   A  1  407 ? 3.517   -29.303 20.661  1.000 93.952  0 462  LYS   A HE2  1 c 1 
ATOM   6397  H  HE3  . LYS   A  1  407 ? 3.713   -27.882 20.003  1.000 92.851  0 462  LYS   A HE3  1 c 1 
ATOM   6398  H  HZ1  . LYS   A  1  407 ? 4.808   -30.185 18.957  1.000 89.817  0 462  LYS   A HZ1  1 c 1 
ATOM   6399  H  HZ2  . LYS   A  1  407 ? 4.904   -28.854 18.323  1.000 88.786  0 462  LYS   A HZ2  1 c 1 
ATOM   6400  H  HZ3  . LYS   A  1  407 ? 3.597   -29.537 18.411  1.000 89.090  0 462  LYS   A HZ3  1 c 1 
ATOM   6401  N  N    . LYS   A  1  408 ? 9.155   -25.379 23.136  1.000 73.585  0 463  LYS   A N    1 ? 1 
ATOM   6402  C  CA   . LYS   A  1  408 ? 9.943   -25.455 24.359  1.000 68.114  0 463  LYS   A CA   1 ? 1 
ATOM   6403  C  C    . LYS   A  1  408 ? 10.046  -26.918 24.785  1.000 62.629  0 463  LYS   A C    1 ? 1 
ATOM   6404  O  O    . LYS   A  1  408 ? 9.214   -27.734 24.392  1.000 55.023  0 463  LYS   A O    1 ? 1 
ATOM   6405  C  CB   . LYS   A  1  408 ? 9.306   -24.625 25.492  1.000 57.708  0 463  LYS   A CB   1 ? 1 
ATOM   6406  C  CG   . LYS   A  1  408 ? 9.421   -23.119 25.315  1.000 72.146  0 463  LYS   A CG   1 ? 1 
ATOM   6407  C  CD   . LYS   A  1  408 ? 9.063   -22.349 26.588  1.000 89.055  0 463  LYS   A CD   1 ? 1 
ATOM   6408  C  CE   . LYS   A  1  408 ? 7.576   -22.188 26.821  1.000 90.320  0 463  LYS   A CE   1 ? 1 
ATOM   6409  N  NZ   . LYS   A  1  408 ? 7.026   -21.049 26.046  1.000 132.360 0 463  LYS   A NZ   1 ? 1 
ATOM   6410  H  H    . LYS   A  1  408 ? 8.355   -24.936 23.151  1.000 69.584  0 463  LYS   A H    1 c 1 
ATOM   6411  H  HA   . LYS   A  1  408 ? 10.846  -25.108 24.173  1.000 65.910  0 463  LYS   A HA   1 c 1 
ATOM   6412  H  HB2  . LYS   A  1  408 ? 8.357   -24.861 25.552  1.000 63.131  0 463  LYS   A HB2  1 c 1 
ATOM   6413  H  HB3  . LYS   A  1  408 ? 9.730   -24.875 26.339  1.000 63.992  0 463  LYS   A HB3  1 c 1 
ATOM   6414  H  HG2  . LYS   A  1  408 ? 10.341  -22.899 25.054  1.000 71.328  0 463  LYS   A HG2  1 c 1 
ATOM   6415  H  HG3  . LYS   A  1  408 ? 8.825   -22.837 24.589  1.000 70.787  0 463  LYS   A HG3  1 c 1 
ATOM   6416  H  HD2  . LYS   A  1  408 ? 9.451   -22.814 27.359  1.000 85.683  0 463  LYS   A HD2  1 c 1 
ATOM   6417  H  HD3  . LYS   A  1  408 ? 9.471   -21.458 26.543  1.000 84.912  0 463  LYS   A HD3  1 c 1 
ATOM   6418  H  HE2  . LYS   A  1  408 ? 7.113   -23.005 26.557  1.000 98.558  0 463  LYS   A HE2  1 c 1 
ATOM   6419  H  HE3  . LYS   A  1  408 ? 7.408   -22.038 27.771  1.000 98.796  0 463  LYS   A HE3  1 c 1 
ATOM   6420  H  HZ1  . LYS   A  1  408 ? 7.200   -21.166 25.164  1.000 115.605 0 463  LYS   A HZ1  1 c 1 
ATOM   6421  H  HZ2  . LYS   A  1  408 ? 7.408   -20.275 26.324  1.000 116.194 0 463  LYS   A HZ2  1 c 1 
ATOM   6422  H  HZ3  . LYS   A  1  408 ? 6.129   -20.998 26.169  1.000 116.495 0 463  LYS   A HZ3  1 c 1 
ATOM   6423  N  N    . PRO   A  1  409 ? 11.046  -27.309 25.613  1.000 93.869  0 464  PRO   A N    1 ? 1 
ATOM   6424  C  CA   . PRO   A  1  409 ? 11.103  -28.679 26.140  1.000 80.733  0 464  PRO   A CA   1 ? 1 
ATOM   6425  C  C    . PRO   A  1  409 ? 9.875   -29.046 26.975  1.000 67.542  0 464  PRO   A C    1 ? 1 
ATOM   6426  O  O    . PRO   A  1  409 ? 9.476   -30.209 27.021  1.000 56.463  0 464  PRO   A O    1 ? 1 
ATOM   6427  C  CB   . PRO   A  1  409 ? 12.406  -28.693 26.960  1.000 78.337  0 464  PRO   A CB   1 ? 1 
ATOM   6428  C  CG   . PRO   A  1  409 ? 12.696  -27.241 27.267  1.000 94.002  0 464  PRO   A CG   1 ? 1 
ATOM   6429  C  CD   . PRO   A  1  409 ? 12.164  -26.470 26.076  1.000 94.738  0 464  PRO   A CD   1 ? 1 
ATOM   6430  H  HA   . PRO   A  1  409 ? 11.191  -29.310 25.383  1.000 79.764  0 464  PRO   A HA   1 c 1 
ATOM   6431  H  HB2  . PRO   A  1  409 ? 12.293  -29.206 27.788  1.000 83.045  0 464  PRO   A HB2  1 c 1 
ATOM   6432  H  HB3  . PRO   A  1  409 ? 13.139  -29.090 26.442  1.000 82.628  0 464  PRO   A HB3  1 c 1 
ATOM   6433  H  HG2  . PRO   A  1  409 ? 12.243  -26.963 28.089  1.000 90.434  0 464  PRO   A HG2  1 c 1 
ATOM   6434  H  HG3  . PRO   A  1  409 ? 13.658  -27.094 27.372  1.000 90.551  0 464  PRO   A HG3  1 c 1 
ATOM   6435  H  HD2  . PRO   A  1  409 ? 11.856  -25.584 26.340  1.000 93.000  0 464  PRO   A HD2  1 c 1 
ATOM   6436  H  HD3  . PRO   A  1  409 ? 12.844  -26.379 25.383  1.000 93.794  0 464  PRO   A HD3  1 c 1 
ATOM   6437  N  N    . SER   A  1  410 ? 9.274   -28.039 27.622  1.000 69.454  0 465  SER   A N    1 ? 1 
ATOM   6438  C  CA   . SER   A  1  410 ? 8.044   -28.222 28.374  1.000 71.159  0 465  SER   A CA   1 ? 1 
ATOM   6439  C  C    . SER   A  1  410 ? 6.848   -28.571 27.488  1.000 81.870  0 465  SER   A C    1 ? 1 
ATOM   6440  O  O    . SER   A  1  410 ? 5.862   -29.115 27.973  1.000 70.339  0 465  SER   A O    1 ? 1 
ATOM   6441  C  CB   . SER   A  1  410 ? 7.746   -26.972 29.192  1.000 83.089  0 465  SER   A CB   1 ? 1 
ATOM   6442  O  OG   . SER   A  1  410 ? 7.703   -25.826 28.363  1.000 85.563  0 465  SER   A OG   1 ? 1 
ATOM   6443  H  H    . SER   A  1  410 ? 9.653   -27.208 27.605  1.000 69.043  0 465  SER   A H    1 c 1 
ATOM   6444  H  HA   . SER   A  1  410 ? 8.186   -28.978 29.006  1.000 75.540  0 465  SER   A HA   1 c 1 
ATOM   6445  H  HB2  . SER   A  1  410 ? 6.881   -27.079 29.649  1.000 81.079  0 465  SER   A HB2  1 c 1 
ATOM   6446  H  HB3  . SER   A  1  410 ? 8.442   -26.857 29.877  1.000 81.301  0 465  SER   A HB3  1 c 1 
ATOM   6447  H  HG   . SER   A  1  410 ? 6.885   -25.743 28.088  0.000 71.150  0 465  SER   A HG   1 c 1 
ATOM   6448  N  N    . GLY   A  1  411 ? 6.937   -28.245 26.192  1.000 76.618  0 466  GLY   A N    1 ? 1 
ATOM   6449  C  CA   . GLY   A  1  411 ? 5.930   -28.642 25.222  1.000 67.882  0 466  GLY   A CA   1 ? 1 
ATOM   6450  C  C    . GLY   A  1  411 ? 5.068   -27.477 24.734  1.000 70.353  0 466  GLY   A C    1 ? 1 
ATOM   6451  O  O    . GLY   A  1  411 ? 4.304   -27.638 23.791  1.000 59.718  0 466  GLY   A O    1 ? 1 
ATOM   6452  H  H    . GLY   A  1  411 ? 7.641   -27.740 25.905  1.000 75.022  0 466  GLY   A H    1 c 1 
ATOM   6453  H  HA2  . GLY   A  1  411 ? 6.385   -29.053 24.444  1.000 70.522  0 466  GLY   A HA2  1 c 1 
ATOM   6454  H  HA3  . GLY   A  1  411 ? 5.346   -29.331 25.625  1.000 71.145  0 466  GLY   A HA3  1 c 1 
ATOM   6455  N  N    . LYS   A  1  412 ? 5.176   -26.315 25.395  1.000 70.406  0 467  LYS   A N    1 ? 1 
ATOM   6456  C  CA   . LYS   A  1  412 ? 4.433   -25.127 25.004  1.000 69.173  0 467  LYS   A CA   1 ? 1 
ATOM   6457  C  C    . LYS   A  1  412 ? 5.162   -24.420 23.867  1.000 61.774  0 467  LYS   A C    1 ? 1 
ATOM   6458  O  O    . LYS   A  1  412 ? 6.354   -24.642 23.682  1.000 56.178  0 467  LYS   A O    1 ? 1 
ATOM   6459  C  CB   . LYS   A  1  412 ? 4.215   -24.206 26.220  1.000 82.354  0 467  LYS   A CB   1 ? 1 
ATOM   6460  C  CG   . LYS   A  1  412 ? 3.130   -24.791 27.142  1.000 100.635 0 467  LYS   A CG   1 ? 1 
ATOM   6461  C  CD   . LYS   A  1  412 ? 2.730   -23.947 28.339  1.000 100.385 0 467  LYS   A CD   1 ? 1 
ATOM   6462  C  CE   . LYS   A  1  412 ? 1.749   -24.706 29.207  1.000 102.322 0 467  LYS   A CE   1 ? 1 
ATOM   6463  N  NZ   . LYS   A  1  412 ? 1.310   -23.916 30.383  1.000 107.197 0 467  LYS   A NZ   1 ? 1 
ATOM   6464  H  H    . LYS   A  1  412 ? 5.733   -26.262 26.118  1.000 70.828  0 467  LYS   A H    1 c 1 
ATOM   6465  H  HA   . LYS   A  1  412 ? 3.552   -25.415 24.672  1.000 70.135  0 467  LYS   A HA   1 c 1 
ATOM   6466  H  HB2  . LYS   A  1  412 ? 5.054   -24.117 26.717  1.000 82.814  0 467  LYS   A HB2  1 c 1 
ATOM   6467  H  HB3  . LYS   A  1  412 ? 3.938   -23.319 25.911  1.000 81.810  0 467  LYS   A HB3  1 c 1 
ATOM   6468  H  HG2  . LYS   A  1  412 ? 2.328   -24.958 26.603  1.000 95.760  0 467  LYS   A HG2  1 c 1 
ATOM   6469  H  HG3  . LYS   A  1  412 ? 3.446   -25.660 27.470  1.000 96.803  0 467  LYS   A HG3  1 c 1 
ATOM   6470  H  HD2  . LYS   A  1  412 ? 3.528   -23.724 28.866  1.000 100.918 0 467  LYS   A HD2  1 c 1 
ATOM   6471  H  HD3  . LYS   A  1  412 ? 2.317   -23.112 28.031  1.000 100.113 0 467  LYS   A HD3  1 c 1 
ATOM   6472  H  HE2  . LYS   A  1  412 ? 0.964   -24.945 28.678  1.000 102.980 0 467  LYS   A HE2  1 c 1 
ATOM   6473  H  HE3  . LYS   A  1  412 ? 2.164   -25.533 29.519  1.000 103.775 0 467  LYS   A HE3  1 c 1 
ATOM   6474  H  HZ1  . LYS   A  1  412 ? 0.871   -23.172 30.109  1.000 105.194 0 467  LYS   A HZ1  1 c 1 
ATOM   6475  H  HZ2  . LYS   A  1  412 ? 2.033   -23.670 30.874  1.000 105.888 0 467  LYS   A HZ2  1 c 1 
ATOM   6476  H  HZ3  . LYS   A  1  412 ? 0.758   -24.416 30.901  1.000 106.296 0 467  LYS   A HZ3  1 c 1 
ATOM   6477  N  N    . CYS   A  1  413 ? 4.429   -23.604 23.090  1.000 59.882  0 468  CYS   A N    1 ? 1 
ATOM   6478  C  CA   . CYS   A  1  413 ? 5.016   -22.852 21.988  1.000 50.991  0 468  CYS   A CA   1 ? 1 
ATOM   6479  C  C    . CYS   A  1  413 ? 5.916   -21.775 22.584  1.000 38.634  0 468  CYS   A C    1 ? 1 
ATOM   6480  O  O    . CYS   A  1  413 ? 5.685   -21.326 23.700  1.000 44.417  0 468  CYS   A O    1 ? 1 
ATOM   6481  C  CB   . CYS   A  1  413 ? 3.986   -22.191 21.054  1.000 49.388  0 468  CYS   A CB   1 ? 1 
ATOM   6482  S  SG   . CYS   A  1  413 ? 2.638   -23.255 20.466  1.000 82.394  0 468  CYS   A SG   1 ? 1 
ATOM   6483  H  H    . CYS   A  1  413 ? 3.535   -23.514 23.254  1.000 58.228  0 468  CYS   A H    1 c 1 
ATOM   6484  H  HA   . CYS   A  1  413 ? 5.570   -23.469 21.456  1.000 49.746  0 468  CYS   A HA   1 c 1 
ATOM   6485  H  HB2  . CYS   A  1  413 ? 3.586   -21.429 21.522  1.000 54.065  0 468  CYS   A HB2  1 c 1 
ATOM   6486  H  HB3  . CYS   A  1  413 ? 4.456   -21.839 20.271  1.000 54.029  0 468  CYS   A HB3  1 c 1 
ATOM   6487  N  N    . PHE   A  1  414 ? 6.873   -21.304 21.774  1.000 42.333  0 469  PHE   A N    1 ? 1 
ATOM   6488  C  CA   . PHE   A  1  414 ? 7.610   -20.081 22.043  1.000 48.574  0 469  PHE   A CA   1 ? 1 
ATOM   6489  C  C    . PHE   A  1  414 ? 6.752   -18.812 21.925  1.000 57.067  0 469  PHE   A C    1 ? 1 
ATOM   6490  O  O    . PHE   A  1  414 ? 7.063   -17.805 22.559  1.000 60.790  0 469  PHE   A O    1 ? 1 
ATOM   6491  C  CB   . PHE   A  1  414 ? 8.841   -19.998 21.076  1.000 46.744  0 469  PHE   A CB   1 ? 1 
ATOM   6492  C  CG   . PHE   A  1  414 ? 10.023  -20.842 21.512  1.000 64.032  0 469  PHE   A CG   1 ? 1 
ATOM   6493  C  CD1  . PHE   A  1  414 ? 10.905  -20.385 22.484  1.000 66.195  0 469  PHE   A CD1  1 ? 1 
ATOM   6494  C  CD2  . PHE   A  1  414 ? 10.226  -22.110 20.984  1.000 62.431  0 469  PHE   A CD2  1 ? 1 
ATOM   6495  C  CE1  . PHE   A  1  414 ? 11.985  -21.169 22.892  1.000 68.607  0 469  PHE   A CE1  1 ? 1 
ATOM   6496  C  CE2  . PHE   A  1  414 ? 11.298  -22.902 21.409  1.000 56.240  0 469  PHE   A CE2  1 ? 1 
ATOM   6497  C  CZ   . PHE   A  1  414 ? 12.173  -22.423 22.353  1.000 66.805  0 469  PHE   A CZ   1 ? 1 
ATOM   6498  H  H    . PHE   A  1  414 ? 7.074   -21.774 21.015  1.000 42.764  0 469  PHE   A H    1 c 1 
ATOM   6499  H  HA   . PHE   A  1  414 ? 7.953   -20.129 22.972  1.000 48.780  0 469  PHE   A HA   1 c 1 
ATOM   6500  H  HB2  . PHE   A  1  414 ? 8.557   -20.284 20.183  1.000 50.100  0 469  PHE   A HB2  1 c 1 
ATOM   6501  H  HB3  . PHE   A  1  414 ? 9.126   -19.062 21.015  1.000 50.057  0 469  PHE   A HB3  1 c 1 
ATOM   6502  H  HD1  . PHE   A  1  414 ? 10.784  -19.526 22.855  1.000 65.643  0 469  PHE   A HD1  1 c 1 
ATOM   6503  H  HD2  . PHE   A  1  414 ? 9.627   -22.444 20.335  1.000 60.973  0 469  PHE   A HD2  1 c 1 
ATOM   6504  H  HE1  . PHE   A  1  414 ? 12.582  -20.843 23.546  1.000 67.768  0 469  PHE   A HE1  1 c 1 
ATOM   6505  H  HE2  . PHE   A  1  414 ? 11.432  -23.757 21.033  1.000 60.520  0 469  PHE   A HE2  1 c 1 
ATOM   6506  H  HZ   . PHE   A  1  414 ? 12.902  -22.953 22.634  1.000 65.243  0 469  PHE   A HZ   1 c 1 
ATOM   6507  N  N    . PHE   A  1  415 ? 5.674   -18.859 21.123  1.000 32.833  0 470  PHE   A N    1 ? 1 
ATOM   6508  C  CA   . PHE   A  1  415 ? 4.929   -17.669 20.751  1.000 32.105  0 470  PHE   A CA   1 ? 1 
ATOM   6509  C  C    . PHE   A  1  415 ? 3.418   -17.925 20.741  1.000 26.223  0 470  PHE   A C    1 ? 1 
ATOM   6510  O  O    . PHE   A  1  415 ? 2.982   -19.034 20.496  1.000 29.373  0 470  PHE   A O    1 ? 1 
ATOM   6511  C  CB   . PHE   A  1  415 ? 5.404   -17.236 19.359  1.000 39.163  0 470  PHE   A CB   1 ? 1 
ATOM   6512  C  CG   . PHE   A  1  415 ? 5.131   -18.307 18.321  1.000 53.146  0 470  PHE   A CG   1 ? 1 
ATOM   6513  C  CD1  . PHE   A  1  415 ? 5.966   -19.420 18.201  1.000 60.817  0 470  PHE   A CD1  1 ? 1 
ATOM   6514  C  CD2  . PHE   A  1  415 ? 4.019   -18.231 17.502  1.000 46.198  0 470  PHE   A CD2  1 ? 1 
ATOM   6515  C  CE1  . PHE   A  1  415 ? 5.695   -20.417 17.264  1.000 47.851  0 470  PHE   A CE1  1 ? 1 
ATOM   6516  C  CE2  . PHE   A  1  415 ? 3.749   -19.235 16.577  1.000 52.331  0 470  PHE   A CE2  1 ? 1 
ATOM   6517  C  CZ   . PHE   A  1  415 ? 4.578   -20.324 16.472  1.000 40.382  0 470  PHE   A CZ   1 ? 1 
ATOM   6518  H  H    . PHE   A  1  415 ? 5.389   -19.668 20.808  1.000 37.548  0 470  PHE   A H    1 c 1 
ATOM   6519  H  HA   . PHE   A  1  415 ? 5.125   -16.947 21.399  1.000 32.090  0 470  PHE   A HA   1 c 1 
ATOM   6520  H  HB2  . PHE   A  1  415 ? 4.940   -16.410 19.106  1.000 39.342  0 470  PHE   A HB2  1 c 1 
ATOM   6521  H  HB3  . PHE   A  1  415 ? 6.366   -17.051 19.393  1.000 39.821  0 470  PHE   A HB3  1 c 1 
ATOM   6522  H  HD1  . PHE   A  1  415 ? 6.726   -19.494 18.755  1.000 55.532  0 470  PHE   A HD1  1 c 1 
ATOM   6523  H  HD2  . PHE   A  1  415 ? 3.433   -17.495 17.579  1.000 48.385  0 470  PHE   A HD2  1 c 1 
ATOM   6524  H  HE1  . PHE   A  1  415 ? 6.269   -21.162 17.188  1.000 49.067  0 470  PHE   A HE1  1 c 1 
ATOM   6525  H  HE2  . PHE   A  1  415 ? 2.990   -19.167 16.021  1.000 47.262  0 470  PHE   A HE2  1 c 1 
ATOM   6526  H  HZ   . PHE   A  1  415 ? 4.401   -20.991 15.828  1.000 44.808  0 470  PHE   A HZ   1 c 1 
ATOM   6527  N  N    . GLN   A  1  416 ? 2.618   -16.895 21.014  1.000 25.018  0 471  GLN   A N    1 ? 1 
ATOM   6528  C  CA   . GLN   A  1  416 ? 1.179   -16.924 20.805  1.000 23.487  0 471  GLN   A CA   1 ? 1 
ATOM   6529  C  C    . GLN   A  1  416 ? 0.723   -15.836 19.834  1.000 21.642  0 471  GLN   A C    1 ? 1 
ATOM   6530  O  O    . GLN   A  1  416 ? -0.447  -15.781 19.490  1.000 19.929  0 471  GLN   A O    1 ? 1 
ATOM   6531  C  CB   . GLN   A  1  416 ? 0.456   -16.725 22.137  1.000 23.642  0 471  GLN   A CB   1 ? 1 
ATOM   6532  C  CG   . GLN   A  1  416 ? 0.886   -17.771 23.178  1.000 36.157  0 471  GLN   A CG   1 ? 1 
ATOM   6533  C  CD   . GLN   A  1  416 ? 0.079   -17.675 24.430  1.000 38.542  0 471  GLN   A CD   1 ? 1 
ATOM   6534  O  OE1  . GLN   A  1  416 ? -1.087  -18.034 24.428  1.000 60.488  0 471  GLN   A OE1  1 ? 1 
ATOM   6535  N  NE2  . GLN   A  1  416 ? 0.668   -17.213 25.522  1.000 59.753  0 471  GLN   A NE2  1 ? 1 
ATOM   6536  H  H    . GLN   A  1  416 ? 2.987   -16.142 21.376  1.000 24.757  0 471  GLN   A H    1 c 1 
ATOM   6537  H  HA   . GLN   A  1  416 ? 0.929   -17.801 20.435  1.000 23.745  0 471  GLN   A HA   1 c 1 
ATOM   6538  H  HB2  . GLN   A  1  416 ? 0.653   -15.826 22.475  1.000 25.577  0 471  GLN   A HB2  1 c 1 
ATOM   6539  H  HB3  . GLN   A  1  416 ? -0.510  -16.790 21.988  1.000 25.808  0 471  GLN   A HB3  1 c 1 
ATOM   6540  H  HG2  . GLN   A  1  416 ? 0.782   -18.668 22.796  1.000 33.315  0 471  GLN   A HG2  1 c 1 
ATOM   6541  H  HG3  . GLN   A  1  416 ? 1.834   -17.644 23.394  1.000 33.240  0 471  GLN   A HG3  1 c 1 
ATOM   6542  H  HE21 . GLN   A  1  416 ? 1.480   -16.865 25.476  1.000 51.364  0 471  GLN   A HE21 1 c 1 
ATOM   6543  H  HE22 . GLN   A  1  416 ? 0.249   -17.252 26.300  1.000 52.223  0 471  GLN   A HE22 1 c 1 
ATOM   6544  N  N    . GLY   A  1  417 ? 1.638   -14.958 19.427  1.000 18.421  0 472  GLY   A N    1 ? 1 
ATOM   6545  C  CA   . GLY   A  1  417 ? 1.318   -13.921 18.453  1.000 22.474  0 472  GLY   A CA   1 ? 1 
ATOM   6546  C  C    . GLY   A  1  417 ? 2.383   -13.820 17.366  1.000 21.195  0 472  GLY   A C    1 ? 1 
ATOM   6547  O  O    . GLY   A  1  417 ? 3.558   -14.101 17.615  1.000 23.103  0 472  GLY   A O    1 ? 1 
ATOM   6548  H  H    . GLY   A  1  417 ? 2.487   -14.997 19.759  1.000 20.208  0 472  GLY   A H    1 c 1 
ATOM   6549  H  HA2  . GLY   A  1  417 ? 0.446   -14.126 18.039  1.000 20.863  0 472  GLY   A HA2  1 c 1 
ATOM   6550  H  HA3  . GLY   A  1  417 ? 1.241   -13.052 18.920  1.000 20.845  0 472  GLY   A HA3  1 c 1 
ATOM   6551  N  N    . ASP   A  1  418 ? 1.951   -13.434 16.159  1.000 20.234  0 473  ASP   A N    1 ? 1 
ATOM   6552  C  CA   . ASP   A  1  418 ? 2.862   -13.198 15.058  1.000 17.392  0 473  ASP   A CA   1 ? 1 
ATOM   6553  C  C    . ASP   A  1  418 ? 2.197   -12.310 14.008  1.000 18.533  0 473  ASP   A C    1 ? 1 
ATOM   6554  O  O    . ASP   A  1  418 ? 1.046   -11.928 14.155  1.000 18.054  0 473  ASP   A O    1 ? 1 
ATOM   6555  C  CB   . ASP   A  1  418 ? 3.360   -14.529 14.457  1.000 19.153  0 473  ASP   A CB   1 ? 1 
ATOM   6556  C  CG   . ASP   A  1  418 ? 4.745   -14.466 13.833  1.000 20.203  0 473  ASP   A CG   1 ? 1 
ATOM   6557  O  OD1  . ASP   A  1  418 ? 5.362   -13.357 13.842  1.000 19.171  0 473  ASP   A OD1  1 ? 1 
ATOM   6558  O  OD2  . ASP   A  1  418 ? 5.210   -15.509 13.338  1.000 22.154  0 473  ASP   A OD2  1 ? 1 
ATOM   6559  H  H    . ASP   A  1  418 ? 1.055   -13.316 16.021  1.000 19.629  0 473  ASP   A H    1 c 1 
ATOM   6560  H  HA   . ASP   A  1  418 ? 3.643   -12.715 15.414  1.000 18.462  0 473  ASP   A HA   1 c 1 
ATOM   6561  H  HB2  . ASP   A  1  418 ? 3.375   -15.211 15.160  1.000 19.483  0 473  ASP   A HB2  1 c 1 
ATOM   6562  H  HB3  . ASP   A  1  418 ? 2.729   -14.821 13.768  1.000 18.923  0 473  ASP   A HB3  1 c 1 
ATOM   6563  N  N    . HIS   A  1  419 ? 2.994   -11.912 13.004  1.000 19.399  0 474  HIS   A N    1 ? 1 
ATOM   6564  C  CA   . HIS   A  1  419 ? 2.585   -10.977 11.987  1.000 17.027  0 474  HIS   A CA   1 ? 1 
ATOM   6565  C  C    . HIS   A  1  419 ? 3.495   -11.193 10.779  1.000 16.320  0 474  HIS   A C    1 ? 1 
ATOM   6566  O  O    . HIS   A  1  419 ? 4.504   -11.908 10.854  1.000 18.089  0 474  HIS   A O    1 ? 1 
ATOM   6567  C  CB   . HIS   A  1  419 ? 2.693   -9.546  12.518  1.000 17.319  0 474  HIS   A CB   1 ? 1 
ATOM   6568  C  CG   . HIS   A  1  419 ? 4.089   -9.225  12.960  1.000 19.739  0 474  HIS   A CG   1 ? 1 
ATOM   6569  N  ND1  . HIS   A  1  419 ? 5.018   -8.732  12.081  1.000 19.553  0 474  HIS   A ND1  1 ? 1 
ATOM   6570  C  CD2  . HIS   A  1  419 ? 4.684   -9.402  14.158  1.000 18.038  0 474  HIS   A CD2  1 ? 1 
ATOM   6571  C  CE1  . HIS   A  1  419 ? 6.155   -8.652  12.757  1.000 18.156  0 474  HIS   A CE1  1 ? 1 
ATOM   6572  N  NE2  . HIS   A  1  419 ? 5.991   -9.044  14.007  1.000 16.269  0 474  HIS   A NE2  1 ? 1 
ATOM   6573  H  H    . HIS   A  1  419 ? 3.847   -12.237 12.970  1.000 18.776  0 474  HIS   A H    1 c 1 
ATOM   6574  H  HA   . HIS   A  1  419 ? 1.649   -11.164 11.737  1.000 17.305  0 474  HIS   A HA   1 c 1 
ATOM   6575  H  HB2  . HIS   A  1  419 ? 2.429   -8.921  11.814  1.000 17.402  0 474  HIS   A HB2  1 c 1 
ATOM   6576  H  HB3  . HIS   A  1  419 ? 2.081   -9.437  13.274  1.000 17.812  0 474  HIS   A HB3  1 c 1 
ATOM   6577  H  HD1  . HIS   A  1  419 ? 4.873   -8.575  11.226  0.000 11.770  0 474  HIS   A HD1  1 c 1 
ATOM   6578  H  HD2  . HIS   A  1  419 ? 4.281   -9.751  14.938  1.000 18.281  0 474  HIS   A HD2  1 c 1 
ATOM   6579  H  HE1  . HIS   A  1  419 ? 6.958   -8.314  12.406  1.000 18.159  0 474  HIS   A HE1  1 c 1 
ATOM   6580  H  HE2  . HIS   A  1  419 ? 6.630   -9.073  14.614  0.000 8.220   0 474  HIS   A HE2  1 c 1 
ATOM   6581  N  N    . GLY   A  1  420 ? 3.111   -10.592 9.653   1.000 17.719  0 475  GLY   A N    1 ? 1 
ATOM   6582  C  CA   . GLY   A  1  420 ? 3.785   -10.836 8.389   1.000 17.383  0 475  GLY   A CA   1 ? 1 
ATOM   6583  C  C    . GLY   A  1  420 ? 2.822   -11.101 7.237   1.000 17.468  0 475  GLY   A C    1 ? 1 
ATOM   6584  O  O    . GLY   A  1  420 ? 3.226   -11.028 6.075   1.000 17.921  0 475  GLY   A O    1 ? 1 
ATOM   6585  H  H    . GLY   A  1  420 ? 2.422   -9.991  9.678   1.000 16.998  0 475  GLY   A H    1 c 1 
ATOM   6586  H  HA2  . GLY   A  1  420 ? 4.341   -10.049 8.168   1.000 17.319  0 475  GLY   A HA2  1 c 1 
ATOM   6587  H  HA3  . GLY   A  1  420 ? 4.391   -11.609 8.488   1.000 17.745  0 475  GLY   A HA3  1 c 1 
ATOM   6588  N  N    . PHE   A  1  421 ? 1.560   -11.370 7.592   1.000 14.309  0 476  PHE   A N    1 ? 1 
ATOM   6589  C  CA   . PHE   A  1  421 ? 0.502   -11.684 6.650   1.000 16.202  0 476  PHE   A CA   1 ? 1 
ATOM   6590  C  C    . PHE   A  1  421 ? 0.106   -10.530 5.729   1.000 18.475  0 476  PHE   A C    1 ? 1 
ATOM   6591  O  O    . PHE   A  1  421 ? 0.391   -9.363  5.992   1.000 14.673  0 476  PHE   A O    1 ? 1 
ATOM   6592  C  CB   . PHE   A  1  421 ? -0.786  -12.102 7.412   1.000 15.594  0 476  PHE   A CB   1 ? 1 
ATOM   6593  C  CG   . PHE   A  1  421 ? -0.616  -13.157 8.463   1.000 15.694  0 476  PHE   A CG   1 ? 1 
ATOM   6594  C  CD1  . PHE   A  1  421 ? -0.445  -14.490 8.111   1.000 17.243  0 476  PHE   A CD1  1 ? 1 
ATOM   6595  C  CD2  . PHE   A  1  421 ? -0.626  -12.829 9.800   1.000 18.090  0 476  PHE   A CD2  1 ? 1 
ATOM   6596  C  CE1  . PHE   A  1  421 ? -0.271  -15.458 9.069   1.000 18.176  0 476  PHE   A CE1  1 ? 1 
ATOM   6597  C  CE2  . PHE   A  1  421 ? -0.452  -13.814 10.765  1.000 20.440  0 476  PHE   A CE2  1 ? 1 
ATOM   6598  C  CZ   . PHE   A  1  421 ? -0.286  -15.123 10.388  1.000 18.400  0 476  PHE   A CZ   1 ? 1 
ATOM   6599  H  H    . PHE   A  1  421 ? 1.349   -11.358 8.480   1.000 15.598  0 476  PHE   A H    1 c 1 
ATOM   6600  H  HA   . PHE   A  1  421 ? 0.798   -12.445 6.088   1.000 16.203  0 476  PHE   A HA   1 c 1 
ATOM   6601  H  HB2  . PHE   A  1  421 ? -1.164  -11.301 7.833   1.000 15.595  0 476  PHE   A HB2  1 c 1 
ATOM   6602  H  HB3  . PHE   A  1  421 ? -1.438  -12.422 6.754   1.000 15.713  0 476  PHE   A HB3  1 c 1 
ATOM   6603  H  HD1  . PHE   A  1  421 ? -0.432  -14.730 7.198   1.000 17.018  0 476  PHE   A HD1  1 c 1 
ATOM   6604  H  HD2  . PHE   A  1  421 ? -0.738  -11.929 10.061  1.000 17.701  0 476  PHE   A HD2  1 c 1 
ATOM   6605  H  HE1  . PHE   A  1  421 ? -0.160  -16.357 8.811   1.000 18.345  0 476  PHE   A HE1  1 c 1 
ATOM   6606  H  HE2  . PHE   A  1  421 ? -0.461  -13.583 11.680  1.000 19.461  0 476  PHE   A HE2  1 c 1 
ATOM   6607  H  HZ   . PHE   A  1  421 ? -0.173  -15.792 11.045  1.000 19.228  0 476  PHE   A HZ   1 c 1 
ATOM   6608  N  N    . ASP   A  1  422 ? -0.595  -10.900 4.658   1.000 16.141  0 477  ASP   A N    1 ? 1 
ATOM   6609  C  CA   . ASP   A  1  422 ? -1.213  -9.966  3.732   1.000 18.076  0 477  ASP   A CA   1 ? 1 
ATOM   6610  C  C    . ASP   A  1  422 ? -1.665  -8.714  4.473   1.000 18.050  0 477  ASP   A C    1 ? 1 
ATOM   6611  O  O    . ASP   A  1  422 ? -2.330  -8.794  5.511   1.000 19.866  0 477  ASP   A O    1 ? 1 
ATOM   6612  C  CB   . ASP   A  1  422 ? -2.402  -10.667 3.072   1.000 20.179  0 477  ASP   A CB   1 ? 1 
ATOM   6613  C  CG   . ASP   A  1  422 ? -3.127  -9.890  1.996   1.000 21.824  0 477  ASP   A CG   1 ? 1 
ATOM   6614  O  OD1  . ASP   A  1  422 ? -3.049  -8.654  2.002   1.000 16.599  0 477  ASP   A OD1  1 ? 1 
ATOM   6615  O  OD2  . ASP   A  1  422 ? -3.735  -10.540 1.118   1.000 24.769  0 477  ASP   A OD2  1 ? 1 
ATOM   6616  H  H    . ASP   A  1  422 ? -0.692  -11.794 4.494   1.000 17.353  0 477  ASP   A H    1 c 1 
ATOM   6617  H  HA   . ASP   A  1  422 ? -0.557  -9.720  3.040   1.000 17.871  0 477  ASP   A HA   1 c 1 
ATOM   6618  H  HB2  . ASP   A  1  422 ? -2.081  -11.499 2.669   1.000 20.363  0 477  ASP   A HB2  1 c 1 
ATOM   6619  H  HB3  . ASP   A  1  422 ? -3.052  -10.899 3.766   1.000 20.257  0 477  ASP   A HB3  1 c 1 
ATOM   6620  N  N    . ASN   A  1  423 ? -1.291  -7.557  3.928   1.000 16.093  0 478  ASN   A N    1 ? 1 
ATOM   6621  C  CA   . ASN   A  1  423 ? -1.502  -6.296  4.612   1.000 21.680  0 478  ASN   A CA   1 ? 1 
ATOM   6622  C  C    . ASN   A  1  423 ? -2.939  -5.785  4.581   1.000 21.787  0 478  ASN   A C    1 ? 1 
ATOM   6623  O  O    . ASN   A  1  423 ? -3.205  -4.731  5.161   1.000 22.153  0 478  ASN   A O    1 ? 1 
ATOM   6624  C  CB   . ASN   A  1  423 ? -0.540  -5.217  4.077   1.000 16.150  0 478  ASN   A CB   1 ? 1 
ATOM   6625  C  CG   . ASN   A  1  423 ? -0.807  -4.895  2.618   1.000 23.371  0 478  ASN   A CG   1 ? 1 
ATOM   6626  O  OD1  . ASN   A  1  423 ? -1.205  -5.749  1.837   1.000 19.532  0 478  ASN   A OD1  1 ? 1 
ATOM   6627  N  ND2  . ASN   A  1  423 ? -0.556  -3.675  2.217   1.000 15.892  0 478  ASN   A ND2  1 ? 1 
ATOM   6628  H  H    . ASN   A  1  423 ? -0.895  -7.554  3.104   1.000 17.579  0 478  ASN   A H    1 c 1 
ATOM   6629  H  HA   . ASN   A  1  423 ? -1.262  -6.437  5.559   1.000 19.439  0 478  ASN   A HA   1 c 1 
ATOM   6630  H  HB2  . ASN   A  1  423 ? -0.645  -4.405  4.612   1.000 18.684  0 478  ASN   A HB2  1 c 1 
ATOM   6631  H  HB3  . ASN   A  1  423 ? 0.381   -5.532  4.175   1.000 18.754  0 478  ASN   A HB3  1 c 1 
ATOM   6632  H  HD21 . ASN   A  1  423 ? -0.109  -3.119  2.741   1.000 17.786  0 478  ASN   A HD21 1 c 1 
ATOM   6633  H  HD22 . ASN   A  1  423 ? -0.831  -3.405  1.421   1.000 17.776  0 478  ASN   A HD22 1 c 1 
ATOM   6634  N  N    . LYS   A  1  424 ? -3.866  -6.560  3.992   1.000 22.733  0 479  LYS   A N    1 ? 1 
ATOM   6635  C  CA   . LYS   A  1  424 ? -5.284  -6.251  4.095   1.000 28.028  0 479  LYS   A CA   1 ? 1 
ATOM   6636  C  C    . LYS   A  1  424 ? -5.899  -6.834  5.361   1.000 23.641  0 479  LYS   A C    1 ? 1 
ATOM   6637  O  O    . LYS   A  1  424 ? -6.959  -6.379  5.775   1.000 22.898  0 479  LYS   A O    1 ? 1 
ATOM   6638  C  CB   . LYS   A  1  424 ? -6.083  -6.769  2.861   1.000 32.456  0 479  LYS   A CB   1 ? 1 
ATOM   6639  C  CG   . LYS   A  1  424 ? -6.422  -8.239  2.912   1.000 42.929  0 479  LYS   A CG   1 ? 1 
ATOM   6640  C  CD   . LYS   A  1  424 ? -6.864  -8.757  1.564   1.000 70.369  0 479  LYS   A CD   1 ? 1 
ATOM   6641  C  CE   . LYS   A  1  424 ? -7.952  -9.815  1.647   1.000 47.726  0 479  LYS   A CE   1 ? 1 
ATOM   6642  N  NZ   . LYS   A  1  424 ? -7.481  -11.080 2.305   1.000 43.643  0 479  LYS   A NZ   1 ? 1 
ATOM   6643  H  H    . LYS   A  1  424 ? -3.609  -7.285  3.500   1.000 23.500  0 479  LYS   A H    1 c 1 
ATOM   6644  H  HA   . LYS   A  1  424 ? -5.379  -5.271  4.132   1.000 26.518  0 479  LYS   A HA   1 c 1 
ATOM   6645  H  HB2  . LYS   A  1  424 ? -6.917  -6.258  2.792   1.000 33.538  0 479  LYS   A HB2  1 c 1 
ATOM   6646  H  HB3  . LYS   A  1  424 ? -5.557  -6.596  2.053   1.000 33.574  0 479  LYS   A HB3  1 c 1 
ATOM   6647  H  HG2  . LYS   A  1  424 ? -5.633  -8.740  3.210   1.000 44.920  0 479  LYS   A HG2  1 c 1 
ATOM   6648  H  HG3  . LYS   A  1  424 ? -7.140  -8.382  3.565   1.000 45.104  0 479  LYS   A HG3  1 c 1 
ATOM   6649  H  HD2  . LYS   A  1  424 ? -7.194  -8.007  1.024   1.000 56.578  0 479  LYS   A HD2  1 c 1 
ATOM   6650  H  HD3  . LYS   A  1  424 ? -6.089  -9.140  1.103   1.000 56.174  0 479  LYS   A HD3  1 c 1 
ATOM   6651  H  HE2  . LYS   A  1  424 ? -8.709  -9.462  2.152   1.000 51.075  0 479  LYS   A HE2  1 c 1 
ATOM   6652  H  HE3  . LYS   A  1  424 ? -8.265  -10.028 0.748   1.000 51.061  0 479  LYS   A HE3  1 c 1 
ATOM   6653  H  HZ1  . LYS   A  1  424 ? -7.297  -10.923 3.179   1.000 44.921  0 479  LYS   A HZ1  1 c 1 
ATOM   6654  H  HZ2  . LYS   A  1  424 ? -6.732  -11.381 1.892   1.000 44.855  0 479  LYS   A HZ2  1 c 1 
ATOM   6655  H  HZ3  . LYS   A  1  424 ? -8.127  -11.715 2.248   1.000 45.156  0 479  LYS   A HZ3  1 c 1 
ATOM   6656  N  N    . VAL   A  1  425 ? -5.257  -7.861  5.938   1.000 20.615  0 480  VAL   A N    1 ? 1 
ATOM   6657  C  CA   . VAL   A  1  425 ? -5.760  -8.499  7.155   1.000 23.760  0 480  VAL   A CA   1 ? 1 
ATOM   6658  C  C    . VAL   A  1  425 ? -5.930  -7.492  8.308   1.000 22.150  0 480  VAL   A C    1 ? 1 
ATOM   6659  O  O    . VAL   A  1  425 ? -5.052  -6.686  8.592   1.000 15.978  0 480  VAL   A O    1 ? 1 
ATOM   6660  C  CB   . VAL   A  1  425 ? -4.855  -9.705  7.549   1.000 23.536  0 480  VAL   A CB   1 ? 1 
ATOM   6661  C  CG1  . VAL   A  1  425 ? -5.208  -10.255 8.928   1.000 26.094  0 480  VAL   A CG1  1 ? 1 
ATOM   6662  C  CG2  . VAL   A  1  425 ? -4.933  -10.819 6.514   1.000 25.605  0 480  VAL   A CG2  1 ? 1 
ATOM   6663  H  H    . VAL   A  1  425 ? -4.485  -8.175  5.565   1.000 21.955  0 480  VAL   A H    1 c 1 
ATOM   6664  H  HA   . VAL   A  1  425 ? -6.642  -8.855  6.946   1.000 22.893  0 480  VAL   A HA   1 c 1 
ATOM   6665  H  HB   . VAL   A  1  425 ? -3.921  -9.381  7.580   1.000 24.194  0 480  VAL   A HB   1 c 1 
ATOM   6666  H  HG11 . VAL   A  1  425 ? -6.165  -10.422 8.976   1.000 25.658  0 480  VAL   A HG11 1 c 1 
ATOM   6667  H  HG12 . VAL   A  1  425 ? -4.955  -9.610  9.609   1.000 25.335  0 480  VAL   A HG12 1 c 1 
ATOM   6668  H  HG13 . VAL   A  1  425 ? -4.727  -11.088 9.079   1.000 25.594  0 480  VAL   A HG13 1 c 1 
ATOM   6669  H  HG21 . VAL   A  1  425 ? -4.378  -11.566 6.798   1.000 25.153  0 480  VAL   A HG21 1 c 1 
ATOM   6670  H  HG22 . VAL   A  1  425 ? -4.616  -10.489 5.656   1.000 24.749  0 480  VAL   A HG22 1 c 1 
ATOM   6671  H  HG23 . VAL   A  1  425 ? -5.855  -11.116 6.426   1.000 25.149  0 480  VAL   A HG23 1 c 1 
ATOM   6672  N  N    . ASN   A  1  426 ? -7.103  -7.521  8.940   1.000 18.046  0 481  ASN   A N    1 ? 1 
ATOM   6673  C  CA   . ASN   A  1  426 ? -7.475  -6.569  9.966   1.000 26.519  0 481  ASN   A CA   1 ? 1 
ATOM   6674  C  C    . ASN   A  1  426 ? -6.407  -6.493  11.054  1.000 22.415  0 481  ASN   A C    1 ? 1 
ATOM   6675  O  O    . ASN   A  1  426 ? -6.017  -5.406  11.452  1.000 20.009  0 481  ASN   A O    1 ? 1 
ATOM   6676  C  CB   . ASN   A  1  426 ? -8.865  -6.934  10.622  1.000 32.879  0 481  ASN   A CB   1 ? 1 
ATOM   6677  C  CG   . ASN   A  1  426 ? -9.268  -5.897  11.675  1.000 66.879  0 481  ASN   A CG   1 ? 1 
ATOM   6678  O  OD1  . ASN   A  1  426 ? -9.468  -6.201  12.878  1.000 56.544  0 481  ASN   A OD1  1 ? 1 
ATOM   6679  N  ND2  . ASN   A  1  426 ? -9.354  -4.617  11.261  1.000 56.825  0 481  ASN   A ND2  1 ? 1 
ATOM   6680  H  H    . ASN   A  1  426 ? -7.704  -8.174  8.720   1.000 20.909  0 481  ASN   A H    1 c 1 
ATOM   6681  H  HA   . ASN   A  1  426 ? -7.563  -5.680  9.547   1.000 24.460  0 481  ASN   A HA   1 c 1 
ATOM   6682  H  HB2  . ASN   A  1  426 ? -9.551  -6.973  9.924   1.000 36.954  0 481  ASN   A HB2  1 c 1 
ATOM   6683  H  HB3  . ASN   A  1  426 ? -8.803  -7.814  11.042  1.000 37.207  0 481  ASN   A HB3  1 c 1 
ATOM   6684  H  HD21 . ASN   A  1  426 ? -9.455  -4.435  10.402  1.000 59.221  0 481  ASN   A HD21 1 c 1 
ATOM   6685  H  HD22 . ASN   A  1  426 ? -9.311  -3.958  11.849  1.000 59.662  0 481  ASN   A HD22 1 c 1 
ATOM   6686  N  N    . SER   A  1  427 ? -5.935  -7.668  11.493  1.000 17.253  0 482  SER   A N    1 ? 1 
ATOM   6687  C  CA   . SER   A  1  427 ? -5.041  -7.755  12.629  1.000 21.845  0 482  SER   A CA   1 ? 1 
ATOM   6688  C  C    . SER   A  1  427 ? -3.678  -7.110  12.361  1.000 19.914  0 482  SER   A C    1 ? 1 
ATOM   6689  O  O    . SER   A  1  427 ? -2.940  -6.781  13.294  1.000 21.967  0 482  SER   A O    1 ? 1 
ATOM   6690  C  CB   . SER   A  1  427 ? -4.888  -9.217  13.050  1.000 20.803  0 482  SER   A CB   1 ? 1 
ATOM   6691  O  OG   . SER   A  1  427 ? -4.408  -10.028 11.977  1.000 26.023  0 482  SER   A OG   1 ? 1 
ATOM   6692  H  H    . SER   A  1  427 ? -6.192  -8.439  11.075  1.000 19.496  0 482  SER   A H    1 c 1 
ATOM   6693  H  HA   . SER   A  1  427 ? -5.465  -7.263  13.382  1.000 20.495  0 482  SER   A HA   1 c 1 
ATOM   6694  H  HB2  . SER   A  1  427 ? -4.259  -9.272  13.803  1.000 22.412  0 482  SER   A HB2  1 c 1 
ATOM   6695  H  HB3  . SER   A  1  427 ? -5.759  -9.559  13.354  1.000 22.523  0 482  SER   A HB3  1 c 1 
ATOM   6696  H  HG   . SER   A  1  427 ? -3.560  -10.033 12.007  0.000 19.210  0 482  SER   A HG   1 c 1 
ATOM   6697  N  N    . MET   A  1  428 ? -3.331  -6.936  11.081  1.000 16.100  0 483  MET   A N    1 ? 1 
ATOM   6698  C  CA   . MET   A  1  428 ? -2.037  -6.378  10.740  1.000 20.701  0 483  MET   A CA   1 ? 1 
ATOM   6699  C  C    . MET   A  1  428 ? -2.044  -4.848  10.709  1.000 19.437  0 483  MET   A C    1 ? 1 
ATOM   6700  O  O    . MET   A  1  428 ? -0.979  -4.251  10.561  1.000 18.065  0 483  MET   A O    1 ? 1 
ATOM   6701  C  CB   . MET   A  1  428 ? -1.594  -6.940  9.396   1.000 21.560  0 483  MET   A CB   1 ? 1 
ATOM   6702  C  CG   . MET   A  1  428 ? -1.412  -8.439  9.394   1.000 19.666  0 483  MET   A CG   1 ? 1 
ATOM   6703  S  SD   . MET   A  1  428 ? -0.029  -8.958  10.385  1.000 18.867  0 483  MET   A SD   1 ? 1 
ATOM   6704  C  CE   . MET   A  1  428 ? -0.897  -9.487  11.840  1.000 16.576  0 483  MET   A CE   1 ? 1 
ATOM   6705  H  H    . MET   A  1  428 ? -3.900  -7.183  10.410  1.000 17.878  0 483  MET   A H    1 c 1 
ATOM   6706  H  HA   . MET   A  1  428 ? -1.394  -6.661  11.429  1.000 19.698  0 483  MET   A HA   1 c 1 
ATOM   6707  H  HB2  . MET   A  1  428 ? -2.260  -6.700  8.722   1.000 20.677  0 483  MET   A HB2  1 c 1 
ATOM   6708  H  HB3  . MET   A  1  428 ? -0.750  -6.518  9.144   1.000 20.633  0 483  MET   A HB3  1 c 1 
ATOM   6709  H  HG2  . MET   A  1  428 ? -2.227  -8.866  9.734   1.000 20.030  0 483  MET   A HG2  1 c 1 
ATOM   6710  H  HG3  . MET   A  1  428 ? -1.273  -8.745  8.472   1.000 19.822  0 483  MET   A HG3  1 c 1 
ATOM   6711  H  HE1  . MET   A  1  428 ? -1.313  -8.726  12.262  1.000 17.214  0 483  MET   A HE1  1 c 1 
ATOM   6712  H  HE2  . MET   A  1  428 ? -1.574  -10.128 11.593  1.000 17.346  0 483  MET   A HE2  1 c 1 
ATOM   6713  H  HE3  . MET   A  1  428 ? -0.275  -9.895  12.454  1.000 17.440  0 483  MET   A HE3  1 c 1 
ATOM   6714  N  N    . GLN   A  1  429 ? -3.221  -4.222  10.863  1.000 17.784  0 484  GLN   A N    1 ? 1 
ATOM   6715  C  CA   . GLN   A  1  429 ? -3.287  -2.767  10.781  1.000 19.977  0 484  GLN   A CA   1 ? 1 
ATOM   6716  C  C    . GLN   A  1  429 ? -2.681  -2.137  12.038  1.000 17.494  0 484  GLN   A C    1 ? 1 
ATOM   6717  O  O    . GLN   A  1  429 ? -2.774  -2.696  13.124  1.000 15.044  0 484  GLN   A O    1 ? 1 
ATOM   6718  C  CB   . GLN   A  1  429 ? -4.732  -2.248  10.620  1.000 16.313  0 484  GLN   A CB   1 ? 1 
ATOM   6719  C  CG   . GLN   A  1  429 ? -5.499  -2.836  9.416   1.000 20.311  0 484  GLN   A CG   1 ? 1 
ATOM   6720  C  CD   . GLN   A  1  429 ? -4.682  -2.847  8.140   1.000 15.971  0 484  GLN   A CD   1 ? 1 
ATOM   6721  O  OE1  . GLN   A  1  429 ? -4.352  -1.794  7.566   1.000 18.524  0 484  GLN   A OE1  1 ? 1 
ATOM   6722  N  NE2  . GLN   A  1  429 ? -4.343  -4.063  7.702   1.000 18.926  0 484  GLN   A NE2  1 ? 1 
ATOM   6723  H  H    . GLN   A  1  429 ? -3.986  -4.697  11.013  1.000 18.802  0 484  GLN   A H    1 c 1 
ATOM   6724  H  HA   . GLN   A  1  429 ? -2.760  -2.477  10.002  1.000 18.088  0 484  GLN   A HA   1 c 1 
ATOM   6725  H  HB2  . GLN   A  1  429 ? -5.227  -2.453  11.441  1.000 18.178  0 484  GLN   A HB2  1 c 1 
ATOM   6726  H  HB3  . GLN   A  1  429 ? -4.700  -1.274  10.528  1.000 17.884  0 484  GLN   A HB3  1 c 1 
ATOM   6727  H  HG2  . GLN   A  1  429 ? -5.776  -3.751  9.627   1.000 18.470  0 484  GLN   A HG2  1 c 1 
ATOM   6728  H  HG3  . GLN   A  1  429 ? -6.312  -2.306  9.267   1.000 18.367  0 484  GLN   A HG3  1 c 1 
ATOM   6729  H  HE21 . GLN   A  1  429 ? -4.458  -4.771  8.221   1.000 18.116  0 484  GLN   A HE21 1 c 1 
ATOM   6730  H  HE22 . GLN   A  1  429 ? -4.001  -4.161  6.892   1.000 17.812  0 484  GLN   A HE22 1 c 1 
ATOM   6731  N  N    . THR   A  1  430 ? -2.070  -0.968  11.866  1.000 21.762  0 485  THR   A N    1 ? 1 
ATOM   6732  C  CA   . THR   A  1  430 ? -1.379  -0.277  12.940  1.000 17.052  0 485  THR   A CA   1 ? 1 
ATOM   6733  C  C    . THR   A  1  430 ? -1.932  1.147   13.010  1.000 20.722  0 485  THR   A C    1 ? 1 
ATOM   6734  O  O    . THR   A  1  430 ? -3.039  1.406   12.543  1.000 18.677  0 485  THR   A O    1 ? 1 
ATOM   6735  C  CB   . THR   A  1  430 ? 0.115   -0.415  12.717  1.000 15.303  0 485  THR   A CB   1 ? 1 
ATOM   6736  O  OG1  . THR   A  1  430 ? 0.786   0.194   13.813  1.000 16.190  0 485  THR   A OG1  1 ? 1 
ATOM   6737  C  CG2  . THR   A  1  430 ? 0.572   0.247   11.427  1.000 15.871  0 485  THR   A CG2  1 ? 1 
ATOM   6738  H  H    . THR   A  1  430 ? -2.095  -0.575  11.041  1.000 19.193  0 485  THR   A H    1 c 1 
ATOM   6739  H  HA   . THR   A  1  430 ? -1.604  -0.731  13.784  1.000 18.365  0 485  THR   A HA   1 c 1 
ATOM   6740  H  HB   . THR   A  1  430 ? 0.342   -1.372  12.688  1.000 15.930  0 485  THR   A HB   1 c 1 
ATOM   6741  H  HG1  . THR   A  1  430 ? 0.573   1.008   13.856  0.000 9.840   0 485  THR   A HG1  1 c 1 
ATOM   6742  H  HG21 . THR   A  1  430 ? 1.529   0.111   11.315  1.000 15.647  0 485  THR   A HG21 1 c 1 
ATOM   6743  H  HG22 . THR   A  1  430 ? 0.383   1.201   11.463  1.000 15.648  0 485  THR   A HG22 1 c 1 
ATOM   6744  H  HG23 . THR   A  1  430 ? 0.101   -0.148  10.672  1.000 15.559  0 485  THR   A HG23 1 c 1 
ATOM   6745  N  N    . VAL   A  1  431 ? -1.196  2.048   13.671  1.000 17.990  0 486  VAL   A N    1 ? 1 
ATOM   6746  C  CA   . VAL   A  1  431 ? -1.746  3.318   14.111  1.000 17.004  0 486  VAL   A CA   1 ? 1 
ATOM   6747  C  C    . VAL   A  1  431 ? -1.051  4.530   13.511  1.000 17.328  0 486  VAL   A C    1 ? 1 
ATOM   6748  O  O    . VAL   A  1  431 ? 0.103   4.458   13.104  1.000 21.749  0 486  VAL   A O    1 ? 1 
ATOM   6749  C  CB   . VAL   A  1  431 ? -1.780  3.409   15.621  1.000 19.273  0 486  VAL   A CB   1 ? 1 
ATOM   6750  C  CG1  . VAL   A  1  431 ? -2.746  2.356   16.126  1.000 23.686  0 486  VAL   A CG1  1 ? 1 
ATOM   6751  C  CG2  . VAL   A  1  431 ? -0.375  3.250   16.241  1.000 20.985  0 486  VAL   A CG2  1 ? 1 
ATOM   6752  H  H    . VAL   A  1  431 ? -0.318  1.866   13.844  1.000 18.332  0 486  VAL   A H    1 c 1 
ATOM   6753  H  HA   . VAL   A  1  431 ? -2.668  3.346   13.805  1.000 17.781  0 486  VAL   A HA   1 c 1 
ATOM   6754  H  HB   . VAL   A  1  431 ? -2.133  4.299   15.868  1.000 19.989  0 486  VAL   A HB   1 c 1 
ATOM   6755  H  HG11 . VAL   A  1  431 ? -2.400  1.471   15.917  1.000 22.200  0 486  VAL   A HG11 1 c 1 
ATOM   6756  H  HG12 . VAL   A  1  431 ? -3.612  2.477   15.698  1.000 22.232  0 486  VAL   A HG12 1 c 1 
ATOM   6757  H  HG13 . VAL   A  1  431 ? -2.847  2.443   17.090  1.000 22.577  0 486  VAL   A HG13 1 c 1 
ATOM   6758  H  HG21 . VAL   A  1  431 ? -0.429  3.385   17.204  1.000 20.753  0 486  VAL   A HG21 1 c 1 
ATOM   6759  H  HG22 . VAL   A  1  431 ? 0.229   3.908   15.857  1.000 20.374  0 486  VAL   A HG22 1 c 1 
ATOM   6760  H  HG23 . VAL   A  1  431 ? -0.037  2.356   16.060  1.000 20.388  0 486  VAL   A HG23 1 c 1 
ATOM   6761  N  N    . PHE   A  1  432 ? -1.808  5.624   13.431  1.000 17.766  0 487  PHE   A N    1 ? 1 
ATOM   6762  C  CA   . PHE   A  1  432 ? -1.212  6.900   13.127  1.000 19.194  0 487  PHE   A CA   1 ? 1 
ATOM   6763  C  C    . PHE   A  1  432 ? -1.916  8.000   13.901  1.000 21.125  0 487  PHE   A C    1 ? 1 
ATOM   6764  O  O    . PHE   A  1  432 ? -3.139  8.134   13.829  1.000 18.242  0 487  PHE   A O    1 ? 1 
ATOM   6765  C  CB   . PHE   A  1  432 ? -1.281  7.233   11.610  1.000 23.593  0 487  PHE   A CB   1 ? 1 
ATOM   6766  C  CG   . PHE   A  1  432 ? -0.868  8.651   11.369  1.000 18.166  0 487  PHE   A CG   1 ? 1 
ATOM   6767  C  CD1  . PHE   A  1  432 ? 0.472   8.992   11.259  1.000 20.356  0 487  PHE   A CD1  1 ? 1 
ATOM   6768  C  CD2  . PHE   A  1  432 ? -1.811  9.658   11.303  1.000 20.079  0 487  PHE   A CD2  1 ? 1 
ATOM   6769  C  CE1  . PHE   A  1  432 ? 0.845   10.296  11.057  1.000 18.091  0 487  PHE   A CE1  1 ? 1 
ATOM   6770  C  CE2  . PHE   A  1  432 ? -1.430  10.978  11.080  1.000 20.223  0 487  PHE   A CE2  1 ? 1 
ATOM   6771  C  CZ   . PHE   A  1  432 ? -0.099  11.290  10.997  1.000 17.430  0 487  PHE   A CZ   1 ? 1 
ATOM   6772  H  H    . PHE   A  1  432 ? -2.711  5.572   13.568  1.000 18.094  0 487  PHE   A H    1 c 1 
ATOM   6773  H  HA   . PHE   A  1  432 ? -0.262  6.880   13.401  1.000 19.875  0 487  PHE   A HA   1 c 1 
ATOM   6774  H  HB2  . PHE   A  1  432 ? -0.686  6.628   11.120  1.000 20.879  0 487  PHE   A HB2  1 c 1 
ATOM   6775  H  HB3  . PHE   A  1  432 ? -2.197  7.097   11.291  1.000 21.040  0 487  PHE   A HB3  1 c 1 
ATOM   6776  H  HD1  . PHE   A  1  432 ? 1.131   8.318   11.318  1.000 19.145  0 487  PHE   A HD1  1 c 1 
ATOM   6777  H  HD2  . PHE   A  1  432 ? -2.726  9.442   11.377  1.000 19.704  0 487  PHE   A HD2  1 c 1 
ATOM   6778  H  HE1  . PHE   A  1  432 ? 1.760   10.514  10.982  1.000 18.542  0 487  PHE   A HE1  1 c 1 
ATOM   6779  H  HE2  . PHE   A  1  432 ? -2.083  11.660  11.037  1.000 19.688  0 487  PHE   A HE2  1 c 1 
ATOM   6780  H  HZ   . PHE   A  1  432 ? 0.166   12.183  10.841  1.000 18.427  0 487  PHE   A HZ   1 c 1 
ATOM   6781  N  N    . VAL   A  1  433 ? -1.097  8.793   14.620  1.000 16.668  0 488  VAL   A N    1 ? 1 
ATOM   6782  C  CA   . VAL   A  1  433 ? -1.552  10.014  15.245  1.000 16.244  0 488  VAL   A CA   1 ? 1 
ATOM   6783  C  C    . VAL   A  1  433 ? -0.537  11.112  14.946  1.000 18.290  0 488  VAL   A C    1 ? 1 
ATOM   6784  O  O    . VAL   A  1  433 ? 0.659   10.883  15.050  1.000 17.790  0 488  VAL   A O    1 ? 1 
ATOM   6785  C  CB   . VAL   A  1  433 ? -1.733  9.820   16.776  1.000 18.455  0 488  VAL   A CB   1 ? 1 
ATOM   6786  C  CG1  . VAL   A  1  433 ? -2.144  11.133  17.444  1.000 19.270  0 488  VAL   A CG1  1 ? 1 
ATOM   6787  C  CG2  . VAL   A  1  433 ? -2.718  8.688   17.079  1.000 20.563  0 488  VAL   A CG2  1 ? 1 
ATOM   6788  H  H    . VAL   A  1  433 ? -0.222  8.552   14.723  1.000 17.429  0 488  VAL   A H    1 c 1 
ATOM   6789  H  HA   . VAL   A  1  433 ? -2.409  10.265  14.857  1.000 17.159  0 488  VAL   A HA   1 c 1 
ATOM   6790  H  HB   . VAL   A  1  433 ? -0.855  9.560   17.144  1.000 18.527  0 488  VAL   A HB   1 c 1 
ATOM   6791  H  HG11 . VAL   A  1  433 ? -2.891  11.525  16.959  1.000 19.185  0 488  VAL   A HG11 1 c 1 
ATOM   6792  H  HG12 . VAL   A  1  433 ? -1.393  11.753  17.438  1.000 19.220  0 488  VAL   A HG12 1 c 1 
ATOM   6793  H  HG13 . VAL   A  1  433 ? -2.410  10.959  18.363  1.000 19.461  0 488  VAL   A HG13 1 c 1 
ATOM   6794  H  HG21 . VAL   A  1  433 ? -2.895  8.658   18.035  1.000 20.187  0 488  VAL   A HG21 1 c 1 
ATOM   6795  H  HG22 . VAL   A  1  433 ? -2.337  7.840   16.794  1.000 19.679  0 488  VAL   A HG22 1 c 1 
ATOM   6796  H  HG23 . VAL   A  1  433 ? -3.551  8.845   16.601  1.000 19.889  0 488  VAL   A HG23 1 c 1 
ATOM   6797  N  N    . GLY   A  1  434 ? -1.024  12.288  14.535  1.000 20.272  0 489  GLY   A N    1 ? 1 
ATOM   6798  C  CA   . GLY   A  1  434 ? -0.165  13.456  14.451  1.000 20.129  0 489  GLY   A CA   1 ? 1 
ATOM   6799  C  C    . GLY   A  1  434 ? -0.667  14.582  15.350  1.000 21.473  0 489  GLY   A C    1 ? 1 
ATOM   6800  O  O    . GLY   A  1  434 ? -1.861  14.873  15.419  1.000 25.962  0 489  GLY   A O    1 ? 1 
ATOM   6801  H  H    . GLY   A  1  434 ? -1.904  12.364  14.302  1.000 19.721  0 489  GLY   A H    1 c 1 
ATOM   6802  H  HA2  . GLY   A  1  434 ? 0.754   13.207  14.714  1.000 20.354  0 489  GLY   A HA2  1 c 1 
ATOM   6803  H  HA3  . GLY   A  1  434 ? -0.142  13.771  13.514  1.000 20.291  0 489  GLY   A HA3  1 c 1 
ATOM   6804  N  N    . TYR   A  1  435 ? 0.270   15.232  16.036  1.000 22.417  0 490  TYR   A N    1 ? 1 
ATOM   6805  C  CA   . TYR   A  1  435 ? -0.059  16.249  17.018  1.000 18.140  0 490  TYR   A CA   1 ? 1 
ATOM   6806  C  C    . TYR   A  1  435 ? 0.981   17.344  16.915  1.000 22.354  0 490  TYR   A C    1 ? 1 
ATOM   6807  O  O    . TYR   A  1  435 ? 2.188   17.043  16.907  1.000 22.531  0 490  TYR   A O    1 ? 1 
ATOM   6808  C  CB   . TYR   A  1  435 ? -0.032  15.662  18.424  1.000 21.797  0 490  TYR   A CB   1 ? 1 
ATOM   6809  C  CG   . TYR   A  1  435 ? -0.307  16.640  19.532  1.000 24.465  0 490  TYR   A CG   1 ? 1 
ATOM   6810  C  CD1  . TYR   A  1  435 ? 0.684   17.495  19.997  1.000 23.640  0 490  TYR   A CD1  1 ? 1 
ATOM   6811  C  CD2  . TYR   A  1  435 ? -1.564  16.716  20.119  1.000 30.701  0 490  TYR   A CD2  1 ? 1 
ATOM   6812  C  CE1  . TYR   A  1  435 ? 0.433   18.398  21.024  1.000 23.778  0 490  TYR   A CE1  1 ? 1 
ATOM   6813  C  CE2  . TYR   A  1  435 ? -1.823  17.611  21.151  1.000 26.106  0 490  TYR   A CE2  1 ? 1 
ATOM   6814  C  CZ   . TYR   A  1  435 ? -0.819  18.448  21.597  1.000 29.497  0 490  TYR   A CZ   1 ? 1 
ATOM   6815  O  OH   . TYR   A  1  435 ? -1.082  19.285  22.634  1.000 23.173  0 490  TYR   A OH   1 ? 1 
ATOM   6816  H  H    . TYR   A  1  435 ? 1.150   15.035  15.886  1.000 20.894  0 490  TYR   A H    1 c 1 
ATOM   6817  H  HA   . TYR   A  1  435 ? -0.956  16.623  16.829  1.000 20.384  0 490  TYR   A HA   1 c 1 
ATOM   6818  H  HB2  . TYR   A  1  435 ? -0.695  14.942  18.469  1.000 21.270  0 490  TYR   A HB2  1 c 1 
ATOM   6819  H  HB3  . TYR   A  1  435 ? 0.850   15.262  18.572  1.000 21.249  0 490  TYR   A HB3  1 c 1 
ATOM   6820  H  HD1  . TYR   A  1  435 ? 1.545   17.461  19.613  1.000 23.687  0 490  TYR   A HD1  1 c 1 
ATOM   6821  H  HD2  . TYR   A  1  435 ? -2.251  16.143  19.821  1.000 27.557  0 490  TYR   A HD2  1 c 1 
ATOM   6822  H  HE1  . TYR   A  1  435 ? 1.121   18.960  21.341  1.000 25.320  0 490  TYR   A HE1  1 c 1 
ATOM   6823  H  HE2  . TYR   A  1  435 ? -2.675  17.642  21.551  1.000 28.027  0 490  TYR   A HE2  1 c 1 
ATOM   6824  H  HH   . TYR   A  1  435 ? -0.471  19.806  22.941  0.000 11.880  0 490  TYR   A HH   1 c 1 
ATOM   6825  N  N    . GLY   A  1  436 ? 0.486   18.584  16.884  1.000 19.530  0 491  GLY   A N    1 ? 1 
ATOM   6826  C  CA   . GLY   A  1  436 ? 1.353   19.740  16.903  1.000 19.643  0 491  GLY   A CA   1 ? 1 
ATOM   6827  C  C    . GLY   A  1  436 ? 0.870   20.838  15.963  1.000 24.310  0 491  GLY   A C    1 ? 1 
ATOM   6828  O  O    . GLY   A  1  436 ? -0.171  20.736  15.322  1.000 24.424  0 491  GLY   A O    1 ? 1 
ATOM   6829  H  H    . GLY   A  1  436 ? -0.419  18.712  16.850  1.000 20.262  0 491  GLY   A H    1 c 1 
ATOM   6830  H  HA2  . GLY   A  1  436 ? 1.396   20.095  17.826  1.000 20.949  0 491  GLY   A HA2  1 c 1 
ATOM   6831  H  HA3  . GLY   A  1  436 ? 2.265   19.463  16.639  1.000 20.478  0 491  GLY   A HA3  1 c 1 
ATOM   6832  N  N    . PRO   A  1  437 ? 1.647   21.921  15.819  1.000 25.250  0 492  PRO   A N    1 ? 1 
ATOM   6833  C  CA   . PRO   A  1  437 ? 1.182   23.105  15.108  1.000 24.113  0 492  PRO   A CA   1 ? 1 
ATOM   6834  C  C    . PRO   A  1  437 ? 0.788   22.853  13.655  1.000 24.643  0 492  PRO   A C    1 ? 1 
ATOM   6835  O  O    . PRO   A  1  437 ? -0.060  23.566  13.144  1.000 28.655  0 492  PRO   A O    1 ? 1 
ATOM   6836  C  CB   . PRO   A  1  437 ? 2.400   24.045  15.211  1.000 26.577  0 492  PRO   A CB   1 ? 1 
ATOM   6837  C  CG   . PRO   A  1  437 ? 3.566   23.084  15.351  1.000 25.331  0 492  PRO   A CG   1 ? 1 
ATOM   6838  C  CD   . PRO   A  1  437 ? 3.044   22.034  16.261  1.000 23.104  0 492  PRO   A CD   1 ? 1 
ATOM   6839  H  HA   . PRO   A  1  437 ? 0.420   23.502  15.600  1.000 25.215  0 492  PRO   A HA   1 c 1 
ATOM   6840  H  HB2  . PRO   A  1  437 ? 2.492   24.598  14.405  1.000 25.987  0 492  PRO   A HB2  1 c 1 
ATOM   6841  H  HB3  . PRO   A  1  437 ? 2.329   24.630  15.995  1.000 26.363  0 492  PRO   A HB3  1 c 1 
ATOM   6842  H  HG2  . PRO   A  1  437 ? 3.816   22.705  14.484  1.000 24.711  0 492  PRO   A HG2  1 c 1 
ATOM   6843  H  HG3  . PRO   A  1  437 ? 4.345   23.530  15.742  1.000 25.319  0 492  PRO   A HG3  1 c 1 
ATOM   6844  H  HD2  . PRO   A  1  437 ? 3.525   21.194  16.145  1.000 23.653  0 492  PRO   A HD2  1 c 1 
ATOM   6845  H  HD3  . PRO   A  1  437 ? 3.099   22.311  17.194  1.000 24.363  0 492  PRO   A HD3  1 c 1 
ATOM   6846  N  N    . THR   A  1  438 ? 1.395   21.864  12.980  1.000 26.725  0 493  THR   A N    1 ? 1 
ATOM   6847  C  CA   . THR   A  1  438 ? 1.142   21.698  11.560  1.000 27.410  0 493  THR   A CA   1 ? 1 
ATOM   6848  C  C    . THR   A  1  438 ? -0.035  20.766  11.292  1.000 25.982  0 493  THR   A C    1 ? 1 
ATOM   6849  O  O    . THR   A  1  438 ? -0.627  20.814  10.222  1.000 25.383  0 493  THR   A O    1 ? 1 
ATOM   6850  C  CB   . THR   A  1  438 ? 2.382   21.269  10.812  1.000 22.012  0 493  THR   A CB   1 ? 1 
ATOM   6851  O  OG1  . THR   A  1  438 ? 3.476   22.067  11.196  1.000 25.345  0 493  THR   A OG1  1 ? 1 
ATOM   6852  C  CG2  . THR   A  1  438 ? 2.216   21.430  9.329   1.000 24.726  0 493  THR   A CG2  1 ? 1 
ATOM   6853  H  H    . THR   A  1  438 ? 1.978   21.301  13.401  1.000 26.097  0 493  THR   A H    1 c 1 
ATOM   6854  H  HA   . THR   A  1  438 ? 0.891   22.585  11.212  1.000 26.239  0 493  THR   A HA   1 c 1 
ATOM   6855  H  HB   . THR   A  1  438 ? 2.571   20.324  11.022  1.000 23.628  0 493  THR   A HB   1 c 1 
ATOM   6856  H  HG1  . THR   A  1  438 ? 3.312   22.875  11.023  0.000 16.700  0 493  THR   A HG1  1 c 1 
ATOM   6857  H  HG21 . THR   A  1  438 ? 3.089   21.389  8.898   1.000 23.829  0 493  THR   A HG21 1 c 1 
ATOM   6858  H  HG22 . THR   A  1  438 ? 1.803   22.291  9.138   1.000 24.188  0 493  THR   A HG22 1 c 1 
ATOM   6859  H  HG23 . THR   A  1  438 ? 1.652   20.716  8.983   1.000 23.542  0 493  THR   A HG23 1 c 1 
ATOM   6860  N  N    . PHE   A  1  439 ? -0.371  19.932  12.271  1.000 27.686  0 494  PHE   A N    1 ? 1 
ATOM   6861  C  CA   . PHE   A  1  439 ? -1.499  19.031  12.165  1.000 23.410  0 494  PHE   A CA   1 ? 1 
ATOM   6862  C  C    . PHE   A  1  439 ? -2.789  19.768  12.515  1.000 28.380  0 494  PHE   A C    1 ? 1 
ATOM   6863  O  O    . PHE   A  1  439 ? -2.771  20.794  13.194  1.000 27.834  0 494  PHE   A O    1 ? 1 
ATOM   6864  C  CB   . PHE   A  1  439 ? -1.322  17.803  13.063  1.000 19.170  0 494  PHE   A CB   1 ? 1 
ATOM   6865  C  CG   . PHE   A  1  439 ? -0.333  16.785  12.536  1.000 21.864  0 494  PHE   A CG   1 ? 1 
ATOM   6866  C  CD1  . PHE   A  1  439 ? -0.650  15.977  11.458  1.000 20.730  0 494  PHE   A CD1  1 ? 1 
ATOM   6867  C  CD2  . PHE   A  1  439 ? 0.927   16.654  13.105  1.000 21.154  0 494  PHE   A CD2  1 ? 1 
ATOM   6868  C  CE1  . PHE   A  1  439 ? 0.278   15.081  10.946  1.000 22.253  0 494  PHE   A CE1  1 ? 1 
ATOM   6869  C  CE2  . PHE   A  1  439 ? 1.834   15.756  12.598  1.000 25.025  0 494  PHE   A CE2  1 ? 1 
ATOM   6870  C  CZ   . PHE   A  1  439 ? 1.496   14.944  11.543  1.000 26.198  0 494  PHE   A CZ   1 ? 1 
ATOM   6871  H  H    . PHE   A  1  439 ? 0.127   19.917  13.037  1.000 26.259  0 494  PHE   A H    1 c 1 
ATOM   6872  H  HA   . PHE   A  1  439 ? -1.565  18.721  11.226  1.000 23.765  0 494  PHE   A HA   1 c 1 
ATOM   6873  H  HB2  . PHE   A  1  439 ? -1.027  18.105  13.947  1.000 20.979  0 494  PHE   A HB2  1 c 1 
ATOM   6874  H  HB3  . PHE   A  1  439 ? -2.194  17.370  13.171  1.000 20.676  0 494  PHE   A HB3  1 c 1 
ATOM   6875  H  HD1  . PHE   A  1  439 ? -1.495  16.061  11.047  1.000 21.361  0 494  PHE   A HD1  1 c 1 
ATOM   6876  H  HD2  . PHE   A  1  439 ? 1.166   17.199  13.837  1.000 22.524  0 494  PHE   A HD2  1 c 1 
ATOM   6877  H  HE1  . PHE   A  1  439 ? 0.043   14.523  10.222  1.000 22.357  0 494  PHE   A HE1  1 c 1 
ATOM   6878  H  HE2  . PHE   A  1  439 ? 2.681   15.667  13.005  1.000 24.251  0 494  PHE   A HE2  1 c 1 
ATOM   6879  H  HZ   . PHE   A  1  439 ? 2.124   14.328  11.199  1.000 24.520  0 494  PHE   A HZ   1 c 1 
ATOM   6880  N  N    . LYS   A  1  440 ? -3.900  19.226  12.015  1.000 25.244  0 495  LYS   A N    1 ? 1 
ATOM   6881  C  CA   . LYS   A  1  440 ? -5.231  19.704  12.324  1.000 24.597  0 495  LYS   A CA   1 ? 1 
ATOM   6882  C  C    . LYS   A  1  440 ? -5.573  19.363  13.770  1.000 25.712  0 495  LYS   A C    1 ? 1 
ATOM   6883  O  O    . LYS   A  1  440 ? -5.008  18.434  14.337  1.000 25.384  0 495  LYS   A O    1 ? 1 
ATOM   6884  C  CB   . LYS   A  1  440 ? -6.259  19.080  11.364  1.000 25.874  0 495  LYS   A CB   1 ? 1 
ATOM   6885  C  CG   . LYS   A  1  440 ? -6.173  19.637  9.970   1.000 23.631  0 495  LYS   A CG   1 ? 1 
ATOM   6886  C  CD   . LYS   A  1  440 ? -7.313  19.259  9.076   1.000 28.631  0 495  LYS   A CD   1 ? 1 
ATOM   6887  C  CE   . LYS   A  1  440 ? -7.146  19.987  7.754   1.000 29.180  0 495  LYS   A CE   1 ? 1 
ATOM   6888  N  NZ   . LYS   A  1  440 ? -8.140  19.578  6.810   1.000 33.893  0 495  LYS   A NZ   1 ? 1 
ATOM   6889  H  H    . LYS   A  1  440 ? -3.818  18.515  11.447  1.000 25.268  0 495  LYS   A H    1 c 1 
ATOM   6890  H  HA   . LYS   A  1  440 ? -5.244  20.683  12.215  1.000 25.612  0 495  LYS   A HA   1 c 1 
ATOM   6891  H  HB2  . LYS   A  1  440 ? -6.117  18.112  11.329  1.000 24.634  0 495  LYS   A HB2  1 c 1 
ATOM   6892  H  HB3  . LYS   A  1  440 ? -7.158  19.244  11.715  1.000 25.278  0 495  LYS   A HB3  1 c 1 
ATOM   6893  H  HG2  . LYS   A  1  440 ? -6.129  20.615  10.028  1.000 25.582  0 495  LYS   A HG2  1 c 1 
ATOM   6894  H  HG3  . LYS   A  1  440 ? -5.337  19.327  9.562   1.000 24.906  0 495  LYS   A HG3  1 c 1 
ATOM   6895  H  HD2  . LYS   A  1  440 ? -7.315  18.291  8.927   1.000 27.061  0 495  LYS   A HD2  1 c 1 
ATOM   6896  H  HD3  . LYS   A  1  440 ? -8.163  19.518  9.492   1.000 27.759  0 495  LYS   A HD3  1 c 1 
ATOM   6897  H  HE2  . LYS   A  1  440 ? -7.217  20.950  7.896   1.000 30.505  0 495  LYS   A HE2  1 c 1 
ATOM   6898  H  HE3  . LYS   A  1  440 ? -6.264  19.797  7.386   1.000 29.751  0 495  LYS   A HE3  1 c 1 
ATOM   6899  H  HZ1  . LYS   A  1  440 ? -8.955  19.555  7.210   1.000 32.538  0 495  LYS   A HZ1  1 c 1 
ATOM   6900  H  HZ2  . LYS   A  1  440 ? -7.941  18.752  6.492   1.000 31.970  0 495  LYS   A HZ2  1 c 1 
ATOM   6901  H  HZ3  . LYS   A  1  440 ? -8.169  20.164  6.119   1.000 32.610  0 495  LYS   A HZ3  1 c 1 
ATOM   6902  N  N    . TYR   A  1  441 ? -6.488  20.165  14.331  1.000 27.631  0 496  TYR   A N    1 ? 1 
ATOM   6903  C  CA   . TYR   A  1  441 ? -6.978  20.042  15.690  1.000 26.607  0 496  TYR   A CA   1 ? 1 
ATOM   6904  C  C    . TYR   A  1  441 ? -8.217  19.164  15.765  1.000 24.930  0 496  TYR   A C    1 ? 1 
ATOM   6905  O  O    . TYR   A  1  441 ? -9.170  19.387  15.025  1.000 25.579  0 496  TYR   A O    1 ? 1 
ATOM   6906  C  CB   . TYR   A  1  441 ? -7.306  21.462  16.203  1.000 32.470  0 496  TYR   A CB   1 ? 1 
ATOM   6907  C  CG   . TYR   A  1  441 ? -7.836  21.563  17.620  1.000 25.760  0 496  TYR   A CG   1 ? 1 
ATOM   6908  C  CD1  . TYR   A  1  441 ? -7.037  21.252  18.704  1.000 25.865  0 496  TYR   A CD1  1 ? 1 
ATOM   6909  C  CD2  . TYR   A  1  441 ? -9.123  22.005  17.871  1.000 29.018  0 496  TYR   A CD2  1 ? 1 
ATOM   6910  C  CE1  . TYR   A  1  441 ? -7.503  21.365  19.993  1.000 27.294  0 496  TYR   A CE1  1 ? 1 
ATOM   6911  C  CE2  . TYR   A  1  441 ? -9.600  22.133  19.167  1.000 26.120  0 496  TYR   A CE2  1 ? 1 
ATOM   6912  C  CZ   . TYR   A  1  441 ? -8.784  21.823  20.228  1.000 32.140  0 496  TYR   A CZ   1 ? 1 
ATOM   6913  O  OH   . TYR   A  1  441 ? -9.225  21.922  21.538  1.000 31.985  0 496  TYR   A OH   1 ? 1 
ATOM   6914  H  H    . TYR   A  1  441 ? -6.833  20.838  13.818  1.000 27.212  0 496  TYR   A H    1 c 1 
ATOM   6915  H  HA   . TYR   A  1  441 ? -6.267  19.649  16.257  1.000 27.202  0 496  TYR   A HA   1 c 1 
ATOM   6916  H  HB2  . TYR   A  1  441 ? -6.491  22.002  16.139  1.000 29.382  0 496  TYR   A HB2  1 c 1 
ATOM   6917  H  HB3  . TYR   A  1  441 ? -7.966  21.857  15.596  1.000 29.485  0 496  TYR   A HB3  1 c 1 
ATOM   6918  H  HD1  . TYR   A  1  441 ? -6.154  20.955  18.557  1.000 25.787  0 496  TYR   A HD1  1 c 1 
ATOM   6919  H  HD2  . TYR   A  1  441 ? -9.682  22.236  17.148  1.000 27.624  0 496  TYR   A HD2  1 c 1 
ATOM   6920  H  HE1  . TYR   A  1  441 ? -6.940  21.151  20.718  1.000 28.054  0 496  TYR   A HE1  1 c 1 
ATOM   6921  H  HE2  . TYR   A  1  441 ? -10.480 22.435  19.321  1.000 28.584  0 496  TYR   A HE2  1 c 1 
ATOM   6922  H  HH   . TYR   A  1  441 ? -8.698  21.705  22.184  0.000 18.040  0 496  TYR   A HH   1 c 1 
ATOM   6923  N  N    . ARG   A  1  442 ? -8.182  18.170  16.665  1.000 26.166  0 497  ARG   A N    1 ? 1 
ATOM   6924  C  CA   . ARG   A  1  442 ? -9.303  17.279  16.947  1.000 26.513  0 497  ARG   A CA   1 ? 1 
ATOM   6925  C  C    . ARG   A  1  442 ? -9.973  16.759  15.674  1.000 26.307  0 497  ARG   A C    1 ? 1 
ATOM   6926  O  O    . ARG   A  1  442 ? -11.193 16.811  15.549  1.000 24.769  0 497  ARG   A O    1 ? 1 
ATOM   6927  C  CB   . ARG   A  1  442 ? -10.342 18.002  17.799  1.000 25.267  0 497  ARG   A CB   1 ? 1 
ATOM   6928  C  CG   . ARG   A  1  442 ? -9.943  18.405  19.201  1.000 26.695  0 497  ARG   A CG   1 ? 1 
ATOM   6929  C  CD   . ARG   A  1  442 ? -11.213 18.666  19.982  1.000 38.743  0 497  ARG   A CD   1 ? 1 
ATOM   6930  N  NE   . ARG   A  1  442 ? -10.977 18.882  21.399  1.000 55.783  0 497  ARG   A NE   1 ? 1 
ATOM   6931  C  CZ   . ARG   A  1  442 ? -11.307 18.039  22.368  1.000 60.893  0 497  ARG   A CZ   1 ? 1 
ATOM   6932  N  NH1  . ARG   A  1  442 ? -11.646 16.782  22.112  1.000 56.975  0 497  ARG   A NH1  1 ? 1 
ATOM   6933  N  NH2  . ARG   A  1  442 ? -11.231 18.453  23.631  1.000 68.578  0 497  ARG   A NH2  1 ? 1 
ATOM   6934  H  H    . ARG   A  1  442 ? -7.407  18.039  17.131  1.000 25.821  0 497  ARG   A H    1 c 1 
ATOM   6935  H  HA   . ARG   A  1  442 ? -8.961  16.509  17.456  1.000 25.927  0 497  ARG   A HA   1 c 1 
ATOM   6936  H  HB2  . ARG   A  1  442 ? -10.617 18.810  17.318  1.000 26.168  0 497  ARG   A HB2  1 c 1 
ATOM   6937  H  HB3  . ARG   A  1  442 ? -11.130 17.422  17.865  1.000 26.125  0 497  ARG   A HB3  1 c 1 
ATOM   6938  H  HG2  . ARG   A  1  442 ? -9.431  17.687  19.628  1.000 28.308  0 497  ARG   A HG2  1 c 1 
ATOM   6939  H  HG3  . ARG   A  1  442 ? -9.394  19.217  19.176  1.000 28.675  0 497  ARG   A HG3  1 c 1 
ATOM   6940  H  HD2  . ARG   A  1  442 ? -11.658 19.458  19.610  1.000 38.780  0 497  ARG   A HD2  1 c 1 
ATOM   6941  H  HD3  . ARG   A  1  442 ? -11.822 17.905  19.870  1.000 38.441  0 497  ARG   A HD3  1 c 1 
ATOM   6942  H  HE   . ARG   A  1  442 ? -10.584 19.625  21.632  1.000 52.508  0 497  ARG   A HE   1 c 1 
ATOM   6943  H  HH11 . ARG   A  1  442 ? -11.173 16.308  21.540  1.000 57.189  0 497  ARG   A HH11 1 c 1 
ATOM   6944  H  HH12 . ARG   A  1  442 ? -12.342 16.425  22.518  1.000 58.233  0 497  ARG   A HH12 1 c 1 
ATOM   6945  H  HH21 . ARG   A  1  442 ? -11.247 17.863  24.286  1.000 66.247  0 497  ARG   A HH21 1 c 1 
ATOM   6946  H  HH22 . ARG   A  1  442 ? -11.167 19.314  23.809  1.000 66.394  0 497  ARG   A HH22 1 c 1 
ATOM   6947  N  N    . THR   A  1  443 ? -9.153  16.296  14.724  1.000 26.675  0 498  THR   A N    1 ? 1 
ATOM   6948  C  CA   . THR   A  1  443 ? -9.628  15.894  13.415  1.000 28.105  0 498  THR   A CA   1 ? 1 
ATOM   6949  C  C    . THR   A  1  443 ? -9.415  14.403  13.196  1.000 23.360  0 498  THR   A C    1 ? 1 
ATOM   6950  O  O    . THR   A  1  443 ? -8.338  13.889  13.452  1.000 26.010  0 498  THR   A O    1 ? 1 
ATOM   6951  C  CB   . THR   A  1  443 ? -8.926  16.682  12.337  1.000 28.481  0 498  THR   A CB   1 ? 1 
ATOM   6952  O  OG1  . THR   A  1  443 ? -9.269  18.016  12.572  1.000 23.205  0 498  THR   A OG1  1 ? 1 
ATOM   6953  C  CG2  . THR   A  1  443 ? -9.314  16.246  10.934  1.000 29.758  0 498  THR   A CG2  1 ? 1 
ATOM   6954  H  H    . THR   A  1  443 ? -8.260  16.225  14.905  1.000 26.604  0 498  THR   A H    1 c 1 
ATOM   6955  H  HA   . THR   A  1  443 ? -10.592 16.086  13.363  1.000 27.195  0 498  THR   A HA   1 c 1 
ATOM   6956  H  HB   . THR   A  1  443 ? -7.951  16.573  12.452  1.000 27.100  0 498  THR   A HB   1 c 1 
ATOM   6957  H  HG1  . THR   A  1  443 ? -10.118 18.108  12.532  0.000 13.340  0 498  THR   A HG1  1 c 1 
ATOM   6958  H  HG21 . THR   A  1  443 ? -9.002  16.907  10.290  1.000 29.296  0 498  THR   A HG21 1 c 1 
ATOM   6959  H  HG22 . THR   A  1  443 ? -10.283 16.168  10.874  1.000 29.487  0 498  THR   A HG22 1 c 1 
ATOM   6960  H  HG23 . THR   A  1  443 ? -8.906  15.384  10.734  1.000 28.857  0 498  THR   A HG23 1 c 1 
ATOM   6961  N  N    . LYS   A  1  444 ? -10.463 13.723  12.725  1.000 22.491  0 499  LYS   A N    1 ? 1 
ATOM   6962  C  CA   . LYS   A  1  444 ? -10.327 12.356  12.255  1.000 21.104  0 499  LYS   A CA   1 ? 1 
ATOM   6963  C  C    . LYS   A  1  444 ? -10.172 12.375  10.731  1.000 21.992  0 499  LYS   A C    1 ? 1 
ATOM   6964  O  O    . LYS   A  1  444 ? -10.759 13.214  10.050  1.000 25.769  0 499  LYS   A O    1 ? 1 
ATOM   6965  C  CB   . LYS   A  1  444 ? -11.523 11.565  12.718  1.000 20.776  0 499  LYS   A CB   1 ? 1 
ATOM   6966  C  CG   . LYS   A  1  444 ? -11.494 10.063  12.435  1.000 28.870  0 499  LYS   A CG   1 ? 1 
ATOM   6967  C  CD   . LYS   A  1  444 ? -12.790 9.391   12.925  1.000 35.322  0 499  LYS   A CD   1 ? 1 
ATOM   6968  C  CE   . LYS   A  1  444 ? -12.869 7.909   12.643  1.000 41.652  0 499  LYS   A CE   1 ? 1 
ATOM   6969  N  NZ   . LYS   A  1  444 ? -14.187 7.359   13.075  1.000 48.956  0 499  LYS   A NZ   1 ? 1 
ATOM   6970  H  H    . LYS   A  1  444 ? -11.286 14.120  12.697  1.000 22.855  0 499  LYS   A H    1 c 1 
ATOM   6971  H  HA   . LYS   A  1  444 ? -9.518  11.966  12.652  1.000 21.217  0 499  LYS   A HA   1 c 1 
ATOM   6972  H  HB2  . LYS   A  1  444 ? -11.618 11.693  13.685  1.000 22.792  0 499  LYS   A HB2  1 c 1 
ATOM   6973  H  HB3  . LYS   A  1  444 ? -12.321 11.942  12.292  1.000 22.751  0 499  LYS   A HB3  1 c 1 
ATOM   6974  H  HG2  . LYS   A  1  444 ? -11.394 9.916   11.470  1.000 27.333  0 499  LYS   A HG2  1 c 1 
ATOM   6975  H  HG3  . LYS   A  1  444 ? -10.724 9.662   12.891  1.000 27.421  0 499  LYS   A HG3  1 c 1 
ATOM   6976  H  HD2  . LYS   A  1  444 ? -12.870 9.530   13.893  1.000 35.434  0 499  LYS   A HD2  1 c 1 
ATOM   6977  H  HD3  . LYS   A  1  444 ? -13.554 9.832   12.497  1.000 35.439  0 499  LYS   A HD3  1 c 1 
ATOM   6978  H  HE2  . LYS   A  1  444 ? -12.752 7.748   11.688  1.000 41.050  0 499  LYS   A HE2  1 c 1 
ATOM   6979  H  HE3  . LYS   A  1  444 ? -12.156 7.444   13.120  1.000 41.140  0 499  LYS   A HE3  1 c 1 
ATOM   6980  H  HZ1  . LYS   A  1  444 ? -14.857 7.900   12.787  1.000 46.788  0 499  LYS   A HZ1  1 c 1 
ATOM   6981  H  HZ2  . LYS   A  1  444 ? -14.217 7.305   13.980  1.000 46.897  0 499  LYS   A HZ2  1 c 1 
ATOM   6982  H  HZ3  . LYS   A  1  444 ? -14.304 6.534   12.722  1.000 46.528  0 499  LYS   A HZ3  1 c 1 
ATOM   6983  N  N    . VAL   A  1  445 ? -9.339  11.472  10.205  1.000 21.428  0 500  VAL   A N    1 ? 1 
ATOM   6984  C  CA   . VAL   A  1  445 ? -9.085  11.350  8.778   1.000 22.995  0 500  VAL   A CA   1 ? 1 
ATOM   6985  C  C    . VAL   A  1  445 ? -9.286  9.886   8.400   1.000 20.902  0 500  VAL   A C    1 ? 1 
ATOM   6986  O  O    . VAL   A  1  445 ? -9.188  9.022   9.266   1.000 24.792  0 500  VAL   A O    1 ? 1 
ATOM   6987  C  CB   . VAL   A  1  445 ? -7.692  11.864  8.385   1.000 19.429  0 500  VAL   A CB   1 ? 1 
ATOM   6988  C  CG1  . VAL   A  1  445 ? -7.495  13.309  8.839   1.000 24.671  0 500  VAL   A CG1  1 ? 1 
ATOM   6989  C  CG2  . VAL   A  1  445 ? -6.582  10.981  8.936   1.000 23.520  0 500  VAL   A CG2  1 ? 1 
ATOM   6990  H  H    . VAL   A  1  445 ? -8.908  10.896  10.769  1.000 21.713  0 500  VAL   A H    1 c 1 
ATOM   6991  H  HA   . VAL   A  1  445 ? -9.749  11.881  8.306   1.000 21.889  0 500  VAL   A HA   1 c 1 
ATOM   6992  H  HB   . VAL   A  1  445 ? -7.634  11.845  7.398   1.000 21.484  0 500  VAL   A HB   1 c 1 
ATOM   6993  H  HG11 . VAL   A  1  445 ? -7.524  13.353  9.810   1.000 23.220  0 500  VAL   A HG11 1 c 1 
ATOM   6994  H  HG12 . VAL   A  1  445 ? -8.202  13.866  8.469   1.000 23.305  0 500  VAL   A HG12 1 c 1 
ATOM   6995  H  HG13 . VAL   A  1  445 ? -6.632  13.633  8.528   1.000 22.960  0 500  VAL   A HG13 1 c 1 
ATOM   6996  H  HG21 . VAL   A  1  445 ? -5.729  11.439  8.848   1.000 22.048  0 500  VAL   A HG21 1 c 1 
ATOM   6997  H  HG22 . VAL   A  1  445 ? -6.552  10.145  8.438   1.000 21.841  0 500  VAL   A HG22 1 c 1 
ATOM   6998  H  HG23 . VAL   A  1  445 ? -6.752  10.792  9.874   1.000 22.198  0 500  VAL   A HG23 1 c 1 
ATOM   6999  N  N    . PRO   A  1  446 ? -9.603  9.552   7.123   1.000 22.446  0 501  PRO   A N    1 ? 1 
ATOM   7000  C  CA   . PRO   A  1  446 ? -9.694  8.152   6.700   1.000 20.777  0 501  PRO   A CA   1 ? 1 
ATOM   7001  C  C    . PRO   A  1  446 ? -8.379  7.408   6.845   1.000 21.962  0 501  PRO   A C    1 ? 1 
ATOM   7002  O  O    . PRO   A  1  446 ? -7.311  8.007   6.917   1.000 21.291  0 501  PRO   A O    1 ? 1 
ATOM   7003  C  CB   . PRO   A  1  446 ? -10.140 8.213   5.232   1.000 20.557  0 501  PRO   A CB   1 ? 1 
ATOM   7004  C  CG   . PRO   A  1  446 ? -10.720 9.567   5.057   1.000 29.687  0 501  PRO   A CG   1 ? 1 
ATOM   7005  C  CD   . PRO   A  1  446 ? -9.970  10.483  6.055   1.000 23.958  0 501  PRO   A CD   1 ? 1 
ATOM   7006  H  HA   . PRO   A  1  446 ? -10.396 7.703   7.234   1.000 21.506  0 501  PRO   A HA   1 c 1 
ATOM   7007  H  HB2  . PRO   A  1  446 ? -9.376  8.084   4.629   1.000 22.069  0 501  PRO   A HB2  1 c 1 
ATOM   7008  H  HB3  . PRO   A  1  446 ? -10.810 7.522   5.043   1.000 22.359  0 501  PRO   A HB3  1 c 1 
ATOM   7009  H  HG2  . PRO   A  1  446 ? -10.591 9.881   4.139   1.000 25.935  0 501  PRO   A HG2  1 c 1 
ATOM   7010  H  HG3  . PRO   A  1  446 ? -11.679 9.558   5.253   1.000 26.250  0 501  PRO   A HG3  1 c 1 
ATOM   7011  H  HD2  . PRO   A  1  446 ? -9.180  10.881  5.646   1.000 24.600  0 501  PRO   A HD2  1 c 1 
ATOM   7012  H  HD3  . PRO   A  1  446 ? -10.552 11.192  6.386   1.000 25.038  0 501  PRO   A HD3  1 c 1 
ATOM   7013  N  N    . PRO   A  1  447 ? -8.425  6.068   6.941   1.000 25.567  0 502  PRO   A N    1 ? 1 
ATOM   7014  C  CA   . PRO   A  1  447 ? -7.200  5.285   7.005   1.000 22.141  0 502  PRO   A CA   1 ? 1 
ATOM   7015  C  C    . PRO   A  1  447 ? -6.449  5.461   5.695   1.000 20.855  0 502  PRO   A C    1 ? 1 
ATOM   7016  O  O    . PRO   A  1  447 ? -7.058  5.704   4.656   1.000 26.085  0 502  PRO   A O    1 ? 1 
ATOM   7017  C  CB   . PRO   A  1  447 ? -7.675  3.842   7.236   1.000 21.250  0 502  PRO   A CB   1 ? 1 
ATOM   7018  C  CG   . PRO   A  1  447 ? -9.157  3.850   6.959   1.000 24.600  0 502  PRO   A CG   1 ? 1 
ATOM   7019  C  CD   . PRO   A  1  447 ? -9.650  5.257   7.051   1.000 30.239  0 502  PRO   A CD   1 ? 1 
ATOM   7020  H  HA   . PRO   A  1  447 ? -6.648  5.588   7.768   1.000 22.309  0 502  PRO   A HA   1 c 1 
ATOM   7021  H  HB2  . PRO   A  1  447 ? -7.214  3.223   6.630   1.000 21.914  0 502  PRO   A HB2  1 c 1 
ATOM   7022  H  HB3  . PRO   A  1  447 ? -7.501  3.563   8.159   1.000 22.192  0 502  PRO   A HB3  1 c 1 
ATOM   7023  H  HG2  . PRO   A  1  447 ? -9.334  3.490   6.066   1.000 24.848  0 502  PRO   A HG2  1 c 1 
ATOM   7024  H  HG3  . PRO   A  1  447 ? -9.624  3.289   7.611   1.000 25.099  0 502  PRO   A HG3  1 c 1 
ATOM   7025  H  HD2  . PRO   A  1  447 ? -10.269 5.458   6.326   1.000 27.868  0 502  PRO   A HD2  1 c 1 
ATOM   7026  H  HD3  . PRO   A  1  447 ? -10.097 5.416   7.903   1.000 28.060  0 502  PRO   A HD3  1 c 1 
ATOM   7027  N  N    . PHE   A  1  448 ? -5.128  5.287   5.764   1.000 17.928  0 503  PHE   A N    1 ? 1 
ATOM   7028  C  CA   . PHE   A  1  448 ? -4.243  5.513   4.628   1.000 15.181  0 503  PHE   A CA   1 ? 1 
ATOM   7029  C  C    . PHE   A  1  448 ? -3.134  4.488   4.744   1.000 17.648  0 503  PHE   A C    1 ? 1 
ATOM   7030  O  O    . PHE   A  1  448 ? -2.982  3.853   5.790   1.000 16.449  0 503  PHE   A O    1 ? 1 
ATOM   7031  C  CB   . PHE   A  1  448 ? -3.748  6.960   4.595   1.000 21.054  0 503  PHE   A CB   1 ? 1 
ATOM   7032  C  CG   . PHE   A  1  448 ? -2.942  7.411   5.784   1.000 15.213  0 503  PHE   A CG   1 ? 1 
ATOM   7033  C  CD1  . PHE   A  1  448 ? -1.582  7.246   5.812   1.000 19.285  0 503  PHE   A CD1  1 ? 1 
ATOM   7034  C  CD2  . PHE   A  1  448 ? -3.558  7.986   6.888   1.000 18.796  0 503  PHE   A CD2  1 ? 1 
ATOM   7035  C  CE1  . PHE   A  1  448 ? -0.835  7.622   6.935   1.000 24.592  0 503  PHE   A CE1  1 ? 1 
ATOM   7036  C  CE2  . PHE   A  1  448 ? -2.810  8.389   7.994   1.000 21.724  0 503  PHE   A CE2  1 ? 1 
ATOM   7037  C  CZ   . PHE   A  1  448 ? -1.453  8.198   8.009   1.000 19.754  0 503  PHE   A CZ   1 ? 1 
ATOM   7038  H  H    . PHE   A  1  448 ? -4.759  5.017   6.556   1.000 17.939  0 503  PHE   A H    1 c 1 
ATOM   7039  H  HA   . PHE   A  1  448 ? -4.746  5.332   3.793   1.000 17.108  0 503  PHE   A HA   1 c 1 
ATOM   7040  H  HB2  . PHE   A  1  448 ? -3.204  7.076   3.789   1.000 17.983  0 503  PHE   A HB2  1 c 1 
ATOM   7041  H  HB3  . PHE   A  1  448 ? -4.529  7.546   4.509   1.000 18.210  0 503  PHE   A HB3  1 c 1 
ATOM   7042  H  HD1  . PHE   A  1  448 ? -1.151  6.841   5.080   1.000 19.025  0 503  PHE   A HD1  1 c 1 
ATOM   7043  H  HD2  . PHE   A  1  448 ? -4.493  8.112   6.886   1.000 18.687  0 503  PHE   A HD2  1 c 1 
ATOM   7044  H  HE1  . PHE   A  1  448 ? 0.102   7.508   6.935   1.000 21.892  0 503  PHE   A HE1  1 c 1 
ATOM   7045  H  HE2  . PHE   A  1  448 ? -3.241  8.779   8.738   1.000 20.770  0 503  PHE   A HE2  1 c 1 
ATOM   7046  H  HZ   . PHE   A  1  448 ? -0.945  8.475   8.753   1.000 21.289  0 503  PHE   A HZ   1 c 1 
ATOM   7047  N  N    . GLU   A  1  449 ? -2.404  4.308   3.645   1.000 18.167  0 504  GLU   A N    1 ? 1 
ATOM   7048  C  CA   . GLU   A  1  449 ? -1.281  3.393   3.598   1.000 23.439  0 504  GLU   A CA   1 ? 1 
ATOM   7049  C  C    . GLU   A  1  449 ? -0.029  4.102   4.106   1.000 21.152  0 504  GLU   A C    1 ? 1 
ATOM   7050  O  O    . GLU   A  1  449 ? 0.079   5.314   3.950   1.000 15.121  0 504  GLU   A O    1 ? 1 
ATOM   7051  C  CB   . GLU   A  1  449 ? -1.068  2.884   2.177   1.000 24.894  0 504  GLU   A CB   1 ? 1 
ATOM   7052  C  CG   . GLU   A  1  449 ? -2.342  2.301   1.566   1.000 31.143  0 504  GLU   A CG   1 ? 1 
ATOM   7053  C  CD   . GLU   A  1  449 ? -2.132  1.435   0.330   1.000 43.066  0 504  GLU   A CD   1 ? 1 
ATOM   7054  O  OE1  . GLU   A  1  449 ? -1.273  1.798   -0.511  1.000 35.019  0 504  GLU   A OE1  1 ? 1 
ATOM   7055  O  OE2  . GLU   A  1  449 ? -2.825  0.394   0.207   1.000 39.120  0 504  GLU   A OE2  1 ? 1 
ATOM   7056  H  H    . GLU   A  1  449 ? -2.612  4.783   2.892   1.000 19.198  0 504  GLU   A H    1 c 1 
ATOM   7057  H  HA   . GLU   A  1  449 ? -1.475  2.626   4.186   1.000 21.983  0 504  GLU   A HA   1 c 1 
ATOM   7058  H  HB2  . GLU   A  1  449 ? -0.755  3.626   1.619   1.000 25.779  0 504  GLU   A HB2  1 c 1 
ATOM   7059  H  HB3  . GLU   A  1  449 ? -0.373  2.198   2.187   1.000 25.707  0 504  GLU   A HB3  1 c 1 
ATOM   7060  H  HG2  . GLU   A  1  449 ? -2.798  1.761   2.245   1.000 31.936  0 504  GLU   A HG2  1 c 1 
ATOM   7061  H  HG3  . GLU   A  1  449 ? -2.943  3.038   1.325   1.000 31.659  0 504  GLU   A HG3  1 c 1 
ATOM   7062  N  N    . ASN   A  1  450 ? 0.900   3.332   4.687   1.000 17.283  0 505  ASN   A N    1 ? 1 
ATOM   7063  C  CA   . ASN   A  1  450 ? 2.073   3.894   5.315   1.000 21.383  0 505  ASN   A CA   1 ? 1 
ATOM   7064  C  C    . ASN   A  1  450 ? 3.027   4.460   4.261   1.000 17.947  0 505  ASN   A C    1 ? 1 
ATOM   7065  O  O    . ASN   A  1  450 ? 3.775   5.381   4.564   1.000 19.300  0 505  ASN   A O    1 ? 1 
ATOM   7066  C  CB   . ASN   A  1  450 ? 2.768   2.891   6.261   1.000 18.361  0 505  ASN   A CB   1 ? 1 
ATOM   7067  C  CG   . ASN   A  1  450 ? 3.393   1.690   5.587   1.000 26.571  0 505  ASN   A CG   1 ? 1 
ATOM   7068  O  OD1  . ASN   A  1  450 ? 3.159   1.420   4.397   1.000 20.914  0 505  ASN   A OD1  1 ? 1 
ATOM   7069  N  ND2  . ASN   A  1  450 ? 4.175   0.927   6.350   1.000 17.175  0 505  ASN   A ND2  1 ? 1 
ATOM   7070  H  H    . ASN   A  1  450 ? 0.793   2.424   4.686   1.000 19.021  0 505  ASN   A H    1 c 1 
ATOM   7071  H  HA   . ASN   A  1  450 ? 1.771   4.647   5.876   1.000 19.368  0 505  ASN   A HA   1 c 1 
ATOM   7072  H  HB2  . ASN   A  1  450 ? 3.465   3.367   6.756   1.000 20.840  0 505  ASN   A HB2  1 c 1 
ATOM   7073  H  HB3  . ASN   A  1  450 ? 2.109   2.574   6.912   1.000 20.708  0 505  ASN   A HB3  1 c 1 
ATOM   7074  H  HD21 . ASN   A  1  450 ? 4.286   1.122   7.205   1.000 19.687  0 505  ASN   A HD21 1 c 1 
ATOM   7075  H  HD22 . ASN   A  1  450 ? 4.582   0.224   6.001   1.000 19.613  0 505  ASN   A HD22 1 c 1 
ATOM   7076  N  N    . ILE   A  1  451 ? 2.959   3.976   3.016   1.000 17.170  0 506  ILE   A N    1 ? 1 
ATOM   7077  C  CA   . ILE   A  1  451 ? 3.785   4.543   1.947   1.000 16.002  0 506  ILE   A CA   1 ? 1 
ATOM   7078  C  C    . ILE   A  1  451 ? 3.552   6.052   1.768   1.000 15.699  0 506  ILE   A C    1 ? 1 
ATOM   7079  O  O    . ILE   A  1  451 ? 4.377   6.736   1.176   1.000 17.381  0 506  ILE   A O    1 ? 1 
ATOM   7080  C  CB   . ILE   A  1  451 ? 3.544   3.831   0.566   1.000 18.044  0 506  ILE   A CB   1 ? 1 
ATOM   7081  C  CG1  . ILE   A  1  451 ? 2.085   4.003   0.085   1.000 16.610  0 506  ILE   A CG1  1 ? 1 
ATOM   7082  C  CG2  . ILE   A  1  451 ? 3.928   2.367   0.566   1.000 24.276  0 506  ILE   A CG2  1 ? 1 
ATOM   7083  C  CD1  . ILE   A  1  451 ? 1.871   3.685   -1.375  1.000 22.011  0 506  ILE   A CD1  1 ? 1 
ATOM   7084  H  H    . ILE   A  1  451 ? 2.403   3.277   2.825   1.000 17.079  0 506  ILE   A H    1 c 1 
ATOM   7085  H  HA   . ILE   A  1  451 ? 4.718   4.411   2.190   1.000 16.598  0 506  ILE   A HA   1 c 1 
ATOM   7086  H  HB   . ILE   A  1  451 ? 4.121   4.284   -0.097  1.000 18.461  0 506  ILE   A HB   1 c 1 
ATOM   7087  H  HG12 . ILE   A  1  451 ? 1.508   3.418   0.620   1.000 17.936  0 506  ILE   A HG12 1 c 1 
ATOM   7088  H  HG13 . ILE   A  1  451 ? 1.804   4.928   0.245   1.000 18.043  0 506  ILE   A HG13 1 c 1 
ATOM   7089  H  HG21 . ILE   A  1  451 ? 3.328   1.872   1.150   1.000 22.049  0 506  ILE   A HG21 1 c 1 
ATOM   7090  H  HG22 . ILE   A  1  451 ? 4.842   2.270   0.887   1.000 22.239  0 506  ILE   A HG22 1 c 1 
ATOM   7091  H  HG23 . ILE   A  1  451 ? 3.866   2.012   -0.337  1.000 22.138  0 506  ILE   A HG23 1 c 1 
ATOM   7092  H  HD11 . ILE   A  1  451 ? 1.903   2.721   -1.506  1.000 20.151  0 506  ILE   A HD11 1 c 1 
ATOM   7093  H  HD12 . ILE   A  1  451 ? 2.569   4.106   -1.904  1.000 20.248  0 506  ILE   A HD12 1 c 1 
ATOM   7094  H  HD13 . ILE   A  1  451 ? 1.002   4.021   -1.658  1.000 20.189  0 506  ILE   A HD13 1 c 1 
ATOM   7095  N  N    . GLU   A  1  452 ? 2.391   6.576   2.208   1.000 15.752  0 507  GLU   A N    1 ? 1 
ATOM   7096  C  CA   . GLU   A  1  452 ? 2.074   7.990   2.034   1.000 15.763  0 507  GLU   A CA   1 ? 1 
ATOM   7097  C  C    . GLU   A  1  452 ? 2.822   8.889   3.038   1.000 21.281  0 507  GLU   A C    1 ? 1 
ATOM   7098  O  O    . GLU   A  1  452 ? 2.904   10.103  2.854   1.000 18.420  0 507  GLU   A O    1 ? 1 
ATOM   7099  C  CB   . GLU   A  1  452 ? 0.579   8.269   2.229   1.000 16.141  0 507  GLU   A CB   1 ? 1 
ATOM   7100  C  CG   . GLU   A  1  452 ? -0.352  7.531   1.266   1.000 22.836  0 507  GLU   A CG   1 ? 1 
ATOM   7101  C  CD   . GLU   A  1  452 ? -0.051  7.805   -0.200  1.000 19.326  0 507  GLU   A CD   1 ? 1 
ATOM   7102  O  OE1  . GLU   A  1  452 ? 0.367   8.937   -0.566  1.000 17.461  0 507  GLU   A OE1  1 ? 1 
ATOM   7103  O  OE2  . GLU   A  1  452 ? -0.216  6.856   -0.988  1.000 26.152  0 507  GLU   A OE2  1 ? 1 
ATOM   7104  H  H    . GLU   A  1  452 ? 1.773   6.035   2.608   1.000 15.651  0 507  GLU   A H    1 c 1 
ATOM   7105  H  HA   . GLU   A  1  452 ? 2.331   8.257   1.122   1.000 16.765  0 507  GLU   A HA   1 c 1 
ATOM   7106  H  HB2  . GLU   A  1  452 ? 0.339   8.022   3.146   1.000 17.396  0 507  GLU   A HB2  1 c 1 
ATOM   7107  H  HB3  . GLU   A  1  452 ? 0.430   9.232   2.131   1.000 17.559  0 507  GLU   A HB3  1 c 1 
ATOM   7108  H  HG2  . GLU   A  1  452 ? -0.280  6.565   1.426   1.000 20.113  0 507  GLU   A HG2  1 c 1 
ATOM   7109  H  HG3  . GLU   A  1  452 ? -1.279  7.795   1.450   1.000 20.270  0 507  GLU   A HG3  1 c 1 
ATOM   7110  N  N    . LEU   A  1  453 ? 3.304   8.301   4.133   1.000 12.292  0 508  LEU   A N    1 ? 1 
ATOM   7111  C  CA   . LEU   A  1  453 ? 3.783   9.066   5.268   1.000 16.287  0 508  LEU   A CA   1 ? 1 
ATOM   7112  C  C    . LEU   A  1  453 ? 5.070   9.825   4.959   1.000 15.781  0 508  LEU   A C    1 ? 1 
ATOM   7113  O  O    . LEU   A  1  453 ? 5.244   10.940  5.452   1.000 19.305  0 508  LEU   A O    1 ? 1 
ATOM   7114  C  CB   . LEU   A  1  453 ? 3.973   8.192   6.501   1.000 18.399  0 508  LEU   A CB   1 ? 1 
ATOM   7115  C  CG   . LEU   A  1  453 ? 3.895   8.973   7.779   1.000 30.143  0 508  LEU   A CG   1 ? 1 
ATOM   7116  C  CD1  . LEU   A  1  453 ? 2.556   9.619   7.912   1.000 32.656  0 508  LEU   A CD1  1 ? 1 
ATOM   7117  C  CD2  . LEU   A  1  453 ? 4.182   8.081   8.984   1.000 27.506  0 508  LEU   A CD2  1 ? 1 
ATOM   7118  H  H    . LEU   A  1  453 ? 3.335   7.389   4.178   1.000 14.727  0 508  LEU   A H    1 c 1 
ATOM   7119  H  HA   . LEU   A  1  453 ? 3.094   9.736   5.467   1.000 15.969  0 508  LEU   A HA   1 c 1 
ATOM   7120  H  HB2  . LEU   A  1  453 ? 3.284   7.499   6.508   1.000 19.765  0 508  LEU   A HB2  1 c 1 
ATOM   7121  H  HB3  . LEU   A  1  453 ? 4.845   7.752   6.448   1.000 19.920  0 508  LEU   A HB3  1 c 1 
ATOM   7122  H  HG   . LEU   A  1  453 ? 4.580   9.684   7.751   1.000 27.312  0 508  LEU   A HG   1 c 1 
ATOM   7123  H  HD11 . LEU   A  1  453 ? 2.491   10.047  8.784   1.000 31.719  0 508  LEU   A HD11 1 c 1 
ATOM   7124  H  HD12 . LEU   A  1  453 ? 1.859   8.942   7.831   1.000 31.603  0 508  LEU   A HD12 1 c 1 
ATOM   7125  H  HD13 . LEU   A  1  453 ? 2.441   10.289  7.216   1.000 31.486  0 508  LEU   A HD13 1 c 1 
ATOM   7126  H  HD21 . LEU   A  1  453 ? 5.074   7.702   8.903   1.000 28.277  0 508  LEU   A HD21 1 c 1 
ATOM   7127  H  HD22 . LEU   A  1  453 ? 3.527   7.362   9.020   1.000 28.133  0 508  LEU   A HD22 1 c 1 
ATOM   7128  H  HD23 . LEU   A  1  453 ? 4.127   8.609   9.799   1.000 28.432  0 508  LEU   A HD23 1 c 1 
ATOM   7129  N  N    . TYR   A  1  454 ? 5.957   9.251   4.134   1.000 14.371  0 509  TYR   A N    1 ? 1 
ATOM   7130  C  CA   . TYR   A  1  454 ? 7.226   9.920   3.903   1.000 14.850  0 509  TYR   A CA   1 ? 1 
ATOM   7131  C  C    . TYR   A  1  454 ? 6.996   11.332  3.373   1.000 18.475  0 509  TYR   A C    1 ? 1 
ATOM   7132  O  O    . TYR   A  1  454 ? 7.644   12.285  3.824   1.000 15.671  0 509  TYR   A O    1 ? 1 
ATOM   7133  C  CB   . TYR   A  1  454 ? 8.092   9.068   2.999   1.000 15.911  0 509  TYR   A CB   1 ? 1 
ATOM   7134  C  CG   . TYR   A  1  454 ? 9.309   9.709   2.376   1.000 16.139  0 509  TYR   A CG   1 ? 1 
ATOM   7135  C  CD1  . TYR   A  1  454 ? 10.471  9.887   3.100   1.000 14.468  0 509  TYR   A CD1  1 ? 1 
ATOM   7136  C  CD2  . TYR   A  1  454 ? 9.314   10.080  1.034   1.000 16.408  0 509  TYR   A CD2  1 ? 1 
ATOM   7137  C  CE1  . TYR   A  1  454 ? 11.588  10.470  2.523   1.000 17.611  0 509  TYR   A CE1  1 ? 1 
ATOM   7138  C  CE2  . TYR   A  1  454 ? 10.430  10.643  0.445   1.000 16.302  0 509  TYR   A CE2  1 ? 1 
ATOM   7139  C  CZ   . TYR   A  1  454 ? 11.559  10.862  1.195   1.000 13.700  0 509  TYR   A CZ   1 ? 1 
ATOM   7140  O  OH   . TYR   A  1  454 ? 12.678  11.398  0.606   1.000 17.065  0 509  TYR   A OH   1 ? 1 
ATOM   7141  H  H    . TYR   A  1  454 ? 5.778   8.453   3.726   1.000 14.582  0 509  TYR   A H    1 c 1 
ATOM   7142  H  HA   . TYR   A  1  454 ? 7.689   10.000  4.777   1.000 15.696  0 509  TYR   A HA   1 c 1 
ATOM   7143  H  HB2  . TYR   A  1  454 ? 8.390   8.292   3.518   1.000 15.586  0 509  TYR   A HB2  1 c 1 
ATOM   7144  H  HB3  . TYR   A  1  454 ? 7.524   8.730   2.277   1.000 15.530  0 509  TYR   A HB3  1 c 1 
ATOM   7145  H  HD1  . TYR   A  1  454 ? 10.493  9.645   4.011   1.000 15.475  0 509  TYR   A HD1  1 c 1 
ATOM   7146  H  HD2  . TYR   A  1  454 ? 8.536   9.952   0.516   1.000 16.084  0 509  TYR   A HD2  1 c 1 
ATOM   7147  H  HE1  . TYR   A  1  454 ? 12.370  10.599  3.034   1.000 16.115  0 509  TYR   A HE1  1 c 1 
ATOM   7148  H  HE2  . TYR   A  1  454 ? 10.408  10.904  -0.461  1.000 15.747  0 509  TYR   A HE2  1 c 1 
ATOM   7149  H  HH   . TYR   A  1  454 ? 13.400  11.491  1.058   0.000 9.260   0 509  TYR   A HH   1 c 1 
ATOM   7150  N  N    . ASN   A  1  455 ? 6.045   11.479  2.428   1.000 18.148  0 510  ASN   A N    1 ? 1 
ATOM   7151  C  CA   . ASN   A  1  455 ? 5.713   12.791  1.891   1.000 20.113  0 510  ASN   A CA   1 ? 1 
ATOM   7152  C  C    . ASN   A  1  455 ? 5.220   13.793  2.949   1.000 16.178  0 510  ASN   A C    1 ? 1 
ATOM   7153  O  O    . ASN   A  1  455 ? 5.555   14.966  2.931   1.000 19.622  0 510  ASN   A O    1 ? 1 
ATOM   7154  C  CB   . ASN   A  1  455 ? 4.671   12.637  0.791   1.000 19.550  0 510  ASN   A CB   1 ? 1 
ATOM   7155  C  CG   . ASN   A  1  455 ? 5.183   12.154  -0.541  1.000 16.614  0 510  ASN   A CG   1 ? 1 
ATOM   7156  O  OD1  . ASN   A  1  455 ? 6.322   12.324  -0.893  1.000 17.523  0 510  ASN   A OD1  1 ? 1 
ATOM   7157  N  ND2  . ASN   A  1  455 ? 4.294   11.605  -1.348  1.000 18.073  0 510  ASN   A ND2  1 ? 1 
ATOM   7158  H  H    . ASN   A  1  455 ? 5.605   10.744  2.109   1.000 18.320  0 510  ASN   A H    1 c 1 
ATOM   7159  H  HA   . ASN   A  1  455 ? 6.527   13.162  1.476   1.000 19.025  0 510  ASN   A HA   1 c 1 
ATOM   7160  H  HB2  . ASN   A  1  455 ? 3.985   12.014  1.105   1.000 18.734  0 510  ASN   A HB2  1 c 1 
ATOM   7161  H  HB3  . ASN   A  1  455 ? 4.239   13.505  0.656   1.000 19.278  0 510  ASN   A HB3  1 c 1 
ATOM   7162  H  HD21 . ASN   A  1  455 ? 3.436   11.618  -1.138  1.000 17.486  0 510  ASN   A HD21 1 c 1 
ATOM   7163  H  HD22 . ASN   A  1  455 ? 4.557   11.223  -2.101  1.000 17.546  0 510  ASN   A HD22 1 c 1 
ATOM   7164  N  N    . VAL   A  1  456 ? 4.442   13.322  3.914   1.000 15.351  0 511  VAL   A N    1 ? 1 
ATOM   7165  C  CA   . VAL   A  1  456 ? 3.952   14.191  4.955   1.000 22.364  0 511  VAL   A CA   1 ? 1 
ATOM   7166  C  C    . VAL   A  1  456 ? 5.144   14.685  5.772   1.000 19.716  0 511  VAL   A C    1 ? 1 
ATOM   7167  O  O    . VAL   A  1  456 ? 5.241   15.871  6.058   1.000 20.883  0 511  VAL   A O    1 ? 1 
ATOM   7168  C  CB   . VAL   A  1  456 ? 2.911   13.497  5.876   1.000 26.555  0 511  VAL   A CB   1 ? 1 
ATOM   7169  C  CG1  . VAL   A  1  456 ? 2.412   14.444  6.932   1.000 25.675  0 511  VAL   A CG1  1 ? 1 
ATOM   7170  C  CG2  . VAL   A  1  456 ? 1.762   12.938  5.068   1.000 24.508  0 511  VAL   A CG2  1 ? 1 
ATOM   7171  H  H    . VAL   A  1  456 ? 4.218   12.436  3.928   1.000 16.726  0 511  VAL   A H    1 c 1 
ATOM   7172  H  HA   . VAL   A  1  456 ? 3.526   14.961  4.537   1.000 20.943  0 511  VAL   A HA   1 c 1 
ATOM   7173  H  HB   . VAL   A  1  456 ? 3.364   12.743  6.329   1.000 25.002  0 511  VAL   A HB   1 c 1 
ATOM   7174  H  HG11 . VAL   A  1  456 ? 2.118   15.272  6.513   1.000 26.189  0 511  VAL   A HG11 1 c 1 
ATOM   7175  H  HG12 . VAL   A  1  456 ? 3.127   14.637  7.563   1.000 26.103  0 511  VAL   A HG12 1 c 1 
ATOM   7176  H  HG13 . VAL   A  1  456 ? 1.665   14.039  7.406   1.000 25.920  0 511  VAL   A HG13 1 c 1 
ATOM   7177  H  HG21 . VAL   A  1  456 ? 1.073   12.606  5.669   1.000 25.008  0 511  VAL   A HG21 1 c 1 
ATOM   7178  H  HG22 . VAL   A  1  456 ? 2.080   12.208  4.509   1.000 24.744  0 511  VAL   A HG22 1 c 1 
ATOM   7179  H  HG23 . VAL   A  1  456 ? 1.389   13.637  4.505   1.000 25.394  0 511  VAL   A HG23 1 c 1 
ATOM   7180  N  N    . MET   A  1  457 ? 6.026   13.756  6.155   1.000 17.405  0 512  MET   A N    1 ? 1 
ATOM   7181  C  CA   . MET   A  1  457 ? 7.136   14.088  7.019   1.000 18.809  0 512  MET   A CA   1 ? 1 
ATOM   7182  C  C    . MET   A  1  457 ? 8.050   15.094  6.314   1.000 25.649  0 512  MET   A C    1 ? 1 
ATOM   7183  O  O    . MET   A  1  457 ? 8.614   15.998  6.946   1.000 24.791  0 512  MET   A O    1 ? 1 
ATOM   7184  C  CB   . MET   A  1  457 ? 7.831   12.809  7.425   1.000 17.744  0 512  MET   A CB   1 ? 1 
ATOM   7185  C  CG   . MET   A  1  457 ? 6.955   12.004  8.431   1.000 20.240  0 512  MET   A CG   1 ? 1 
ATOM   7186  S  SD   . MET   A  1  457 ? 7.706   10.540  9.165   1.000 24.297  0 512  MET   A SD   1 ? 1 
ATOM   7187  C  CE   . MET   A  1  457 ? 8.177   9.567   7.767   1.000 26.093  0 512  MET   A CE   1 ? 1 
ATOM   7188  H  H    . MET   A  1  457 ? 5.926   12.892  5.874   1.000 17.933  0 512  MET   A H    1 c 1 
ATOM   7189  H  HA   . MET   A  1  457 ? 6.771   14.522  7.824   1.000 19.544  0 512  MET   A HA   1 c 1 
ATOM   7190  H  HB2  . MET   A  1  457 ? 8.002   12.265  6.630   1.000 18.362  0 512  MET   A HB2  1 c 1 
ATOM   7191  H  HB3  . MET   A  1  457 ? 8.690   13.025  7.839   1.000 18.755  0 512  MET   A HB3  1 c 1 
ATOM   7192  H  HG2  . MET   A  1  457 ? 6.689   12.605  9.159   1.000 20.401  0 512  MET   A HG2  1 c 1 
ATOM   7193  H  HG3  . MET   A  1  457 ? 6.134   11.725  7.971   1.000 20.023  0 512  MET   A HG3  1 c 1 
ATOM   7194  H  HE1  . MET   A  1  457 ? 7.394   9.355   7.245   1.000 25.356  0 512  MET   A HE1  1 c 1 
ATOM   7195  H  HE2  . MET   A  1  457 ? 8.800   10.066  7.224   1.000 25.697  0 512  MET   A HE2  1 c 1 
ATOM   7196  H  HE3  . MET   A  1  457 ? 8.594   8.751   8.069   1.000 25.535  0 512  MET   A HE3  1 c 1 
ATOM   7197  N  N    . CYS   A  1  458 ? 8.191   14.927  4.996   1.000 18.161  0 513  CYS   A N    1 ? 1 
ATOM   7198  C  CA   . CYS   A  1  458 ? 8.943   15.869  4.203   1.000 17.814  0 513  CYS   A CA   1 ? 1 
ATOM   7199  C  C    . CYS   A  1  458 ? 8.308   17.252  4.232   1.000 17.989  0 513  CYS   A C    1 ? 1 
ATOM   7200  O  O    . CYS   A  1  458 ? 9.003   18.255  4.425   1.000 20.688  0 513  CYS   A O    1 ? 1 
ATOM   7201  C  CB   . CYS   A  1  458 ? 9.122   15.342  2.785   1.000 20.216  0 513  CYS   A CB   1 ? 1 
ATOM   7202  S  SG   . CYS   A  1  458 ? 10.378  14.049  2.658   1.000 21.420  0 513  CYS   A SG   1 ? 1 
ATOM   7203  H  H    . CYS   A  1  458 ? 7.816   14.200  4.587   1.000 19.180  0 513  CYS   A H    1 c 1 
ATOM   7204  H  HA   . CYS   A  1  458 ? 9.838   15.941  4.608   1.000 18.622  0 513  CYS   A HA   1 c 1 
ATOM   7205  H  HB2  . CYS   A  1  458 ? 8.270   14.982  2.464   1.000 19.540  0 513  CYS   A HB2  1 c 1 
ATOM   7206  H  HB3  . CYS   A  1  458 ? 9.376   16.081  2.197   1.000 20.053  0 513  CYS   A HB3  1 c 1 
ATOM   7207  H  HG   . CYS   A  1  458 ? 10.278  13.861  1.472   0.000 14.140  0 513  CYS   A HG   1 c 1 
ATOM   7208  N  N    . ASP   A  1  459 ? 6.990   17.291  4.046   1.000 17.108  0 514  ASP   A N    1 ? 1 
ATOM   7209  C  CA   . ASP   A  1  459 ? 6.239   18.525  4.070   1.000 19.451  0 514  ASP   A CA   1 ? 1 
ATOM   7210  C  C    . ASP   A  1  459 ? 6.364   19.178  5.442   1.000 21.072  0 514  ASP   A C    1 ? 1 
ATOM   7211  O  O    . ASP   A  1  459 ? 6.497   20.392  5.537   1.000 21.328  0 514  ASP   A O    1 ? 1 
ATOM   7212  C  CB   . ASP   A  1  459 ? 4.748   18.318  3.674   1.000 23.456  0 514  ASP   A CB   1 ? 1 
ATOM   7213  C  CG   . ASP   A  1  459 ? 4.516   18.001  2.174   1.000 32.834  0 514  ASP   A CG   1 ? 1 
ATOM   7214  O  OD1  . ASP   A  1  459 ? 5.471   18.085  1.385   1.000 28.591  0 514  ASP   A OD1  1 ? 1 
ATOM   7215  O  OD2  . ASP   A  1  459 ? 3.417   17.607  1.823   1.000 28.156  0 514  ASP   A OD2  1 ? 1 
ATOM   7216  H  H    . ASP   A  1  459 ? 6.540   16.510  3.891   1.000 17.444  0 514  ASP   A H    1 c 1 
ATOM   7217  H  HA   . ASP   A  1  459 ? 6.642   19.133  3.407   1.000 20.205  0 514  ASP   A HA   1 c 1 
ATOM   7218  H  HB2  . ASP   A  1  459 ? 4.380   17.580  4.201   1.000 23.817  0 514  ASP   A HB2  1 c 1 
ATOM   7219  H  HB3  . ASP   A  1  459 ? 4.246   19.129  3.894   1.000 24.321  0 514  ASP   A HB3  1 c 1 
ATOM   7220  N  N    . LEU   A  1  460 ? 6.318   18.365  6.496   1.000 19.225  0 515  LEU   A N    1 ? 1 
ATOM   7221  C  CA   . LEU   A  1  460 ? 6.379   18.884  7.844   1.000 21.619  0 515  LEU   A CA   1 ? 1 
ATOM   7222  C  C    . LEU   A  1  460 ? 7.720   19.574  8.093   1.000 24.212  0 515  LEU   A C    1 ? 1 
ATOM   7223  O  O    . LEU   A  1  460 ? 7.799   20.433  8.960   1.000 18.606  0 515  LEU   A O    1 ? 1 
ATOM   7224  C  CB   . LEU   A  1  460 ? 6.181   17.771  8.840   1.000 24.952  0 515  LEU   A CB   1 ? 1 
ATOM   7225  C  CG   . LEU   A  1  460 ? 4.735   17.337  9.017   1.000 27.943  0 515  LEU   A CG   1 ? 1 
ATOM   7226  C  CD1  . LEU   A  1  460 ? 4.651   16.056  9.874   1.000 25.590  0 515  LEU   A CD1  1 ? 1 
ATOM   7227  C  CD2  . LEU   A  1  460 ? 3.942   18.425  9.610   1.000 28.684  0 515  LEU   A CD2  1 ? 1 
ATOM   7228  H  H    . LEU   A  1  460 ? 6.239   17.463  6.371   1.000 19.784  0 515  LEU   A H    1 c 1 
ATOM   7229  H  HA   . LEU   A  1  460 ? 5.663   19.550  7.949   1.000 22.369  0 515  LEU   A HA   1 c 1 
ATOM   7230  H  HB2  . LEU   A  1  460 ? 6.708   16.998  8.552   1.000 24.425  0 515  LEU   A HB2  1 c 1 
ATOM   7231  H  HB3  . LEU   A  1  460 ? 6.529   18.062  9.706   1.000 24.915  0 515  LEU   A HB3  1 c 1 
ATOM   7232  H  HG   . LEU   A  1  460 ? 4.361   17.136  8.125   1.000 26.782  0 515  LEU   A HG   1 c 1 
ATOM   7233  H  HD11 . LEU   A  1  460 ? 3.758   15.675  9.803   1.000 25.996  0 515  LEU   A HD11 1 c 1 
ATOM   7234  H  HD12 . LEU   A  1  460 ? 4.836   16.274  10.804  1.000 26.362  0 515  LEU   A HD12 1 c 1 
ATOM   7235  H  HD13 . LEU   A  1  460 ? 5.304   15.408  9.558   1.000 25.988  0 515  LEU   A HD13 1 c 1 
ATOM   7236  H  HD21 . LEU   A  1  460 ? 3.789   19.118  8.945   1.000 28.530  0 515  LEU   A HD21 1 c 1 
ATOM   7237  H  HD22 . LEU   A  1  460 ? 4.421   18.802  10.369  1.000 28.717  0 515  LEU   A HD22 1 c 1 
ATOM   7238  H  HD23 . LEU   A  1  460 ? 3.085   18.074  9.912   1.000 28.385  0 515  LEU   A HD23 1 c 1 
ATOM   7239  N  N    . LEU   A  1  461 ? 8.752   19.191  7.335   1.000 22.235  0 516  LEU   A N    1 ? 1 
ATOM   7240  C  CA   . LEU   A  1  461 ? 10.091  19.737  7.502   1.000 21.486  0 516  LEU   A CA   1 ? 1 
ATOM   7241  C  C    . LEU   A  1  461 ? 10.483  20.658  6.354   1.000 22.599  0 516  LEU   A C    1 ? 1 
ATOM   7242  O  O    . LEU   A  1  461 ? 11.626  21.092  6.264   1.000 22.527  0 516  LEU   A O    1 ? 1 
ATOM   7243  C  CB   . LEU   A  1  461 ? 11.115  18.608  7.590   1.000 19.824  0 516  LEU   A CB   1 ? 1 
ATOM   7244  C  CG   . LEU   A  1  461 ? 10.976  17.705  8.793   1.000 19.668  0 516  LEU   A CG   1 ? 1 
ATOM   7245  C  CD1  . LEU   A  1  461 ? 11.734  16.381  8.589   1.000 19.180  0 516  LEU   A CD1  1 ? 1 
ATOM   7246  C  CD2  . LEU   A  1  461 ? 11.465  18.409  10.071  1.000 21.589  0 516  LEU   A CD2  1 ? 1 
ATOM   7247  H  H    . LEU   A  1  461 ? 8.624   18.546  6.702   1.000 22.055  0 516  LEU   A H    1 c 1 
ATOM   7248  H  HA   . LEU   A  1  461 ? 10.113  20.257  8.337   1.000 21.794  0 516  LEU   A HA   1 c 1 
ATOM   7249  H  HB2  . LEU   A  1  461 ? 11.043  18.064  6.781   1.000 19.926  0 516  LEU   A HB2  1 c 1 
ATOM   7250  H  HB3  . LEU   A  1  461 ? 12.011  19.001  7.602   1.000 20.523  0 516  LEU   A HB3  1 c 1 
ATOM   7251  H  HG   . LEU   A  1  461 ? 10.017  17.492  8.908   1.000 19.627  0 516  LEU   A HG   1 c 1 
ATOM   7252  H  HD11 . LEU   A  1  461 ? 11.476  15.749  9.282   1.000 19.082  0 516  LEU   A HD11 1 c 1 
ATOM   7253  H  HD12 . LEU   A  1  461 ? 12.692  16.544  8.640   1.000 19.536  0 516  LEU   A HD12 1 c 1 
ATOM   7254  H  HD13 . LEU   A  1  461 ? 11.515  16.011  7.716   1.000 19.034  0 516  LEU   A HD13 1 c 1 
ATOM   7255  H  HD21 . LEU   A  1  461 ? 10.912  19.190  10.244  1.000 21.301  0 516  LEU   A HD21 1 c 1 
ATOM   7256  H  HD22 . LEU   A  1  461 ? 12.390  18.687  9.954   1.000 21.433  0 516  LEU   A HD22 1 c 1 
ATOM   7257  H  HD23 . LEU   A  1  461 ? 11.404  17.795  10.823  1.000 21.022  0 516  LEU   A HD23 1 c 1 
ATOM   7258  N  N    . GLY   A  1  462 ? 9.556   20.948  5.453   1.000 22.599  0 517  GLY   A N    1 ? 1 
ATOM   7259  C  CA   . GLY   A  1  462 ? 9.906   21.773  4.317   1.000 20.671  0 517  GLY   A CA   1 ? 1 
ATOM   7260  C  C    . GLY   A  1  462 ? 10.922  21.131  3.382   1.000 20.021  0 517  GLY   A C    1 ? 1 
ATOM   7261  O  O    . GLY   A  1  462 ? 11.690  21.849  2.774   1.000 22.528  0 517  GLY   A O    1 ? 1 
ATOM   7262  H  H    . GLY   A  1  462 ? 8.700   20.643  5.543   1.000 21.784  0 517  GLY   A H    1 c 1 
ATOM   7263  H  HA2  . GLY   A  1  462 ? 9.082   21.974  3.807   1.000 20.970  0 517  GLY   A HA2  1 c 1 
ATOM   7264  H  HA3  . GLY   A  1  462 ? 10.269  22.633  4.648   1.000 21.477  0 517  GLY   A HA3  1 c 1 
ATOM   7265  N  N    . LEU   A  1  463 ? 10.936  19.793  3.288   1.000 20.797  0 518  LEU   A N    1 ? 1 
ATOM   7266  C  CA   . LEU   A  1  463 ? 11.839  19.070  2.404   1.000 20.723  0 518  LEU   A CA   1 ? 1 
ATOM   7267  C  C    . LEU   A  1  463 ? 11.124  18.693  1.108   1.000 20.724  0 518  LEU   A C    1 ? 1 
ATOM   7268  O  O    . LEU   A  1  463 ? 9.942   18.391  1.131   1.000 23.047  0 518  LEU   A O    1 ? 1 
ATOM   7269  C  CB   . LEU   A  1  463 ? 12.338  17.776  3.054   1.000 22.374  0 518  LEU   A CB   1 ? 1 
ATOM   7270  C  CG   . LEU   A  1  463 ? 13.169  17.921  4.373   1.000 24.378  0 518  LEU   A CG   1 ? 1 
ATOM   7271  C  CD1  . LEU   A  1  463 ? 13.370  16.576  5.012   1.000 19.944  0 518  LEU   A CD1  1 ? 1 
ATOM   7272  C  CD2  . LEU   A  1  463 ? 14.463  18.575  4.156   1.000 28.468  0 518  LEU   A CD2  1 ? 1 
ATOM   7273  H  H    . LEU   A  1  463 ? 10.349  19.309  3.795   1.000 20.184  0 518  LEU   A H    1 c 1 
ATOM   7274  H  HA   . LEU   A  1  463 ? 12.605  19.649  2.192   1.000 21.574  0 518  LEU   A HA   1 c 1 
ATOM   7275  H  HB2  . LEU   A  1  463 ? 11.560  17.214  3.244   1.000 21.863  0 518  LEU   A HB2  1 c 1 
ATOM   7276  H  HB3  . LEU   A  1  463 ? 12.886  17.300  2.399   1.000 22.250  0 518  LEU   A HB3  1 c 1 
ATOM   7277  H  HG   . LEU   A  1  463 ? 12.648  18.480  5.000   1.000 23.835  0 518  LEU   A HG   1 c 1 
ATOM   7278  H  HD11 . LEU   A  1  463 ? 13.718  16.693  5.913   1.000 21.208  0 518  LEU   A HD11 1 c 1 
ATOM   7279  H  HD12 . LEU   A  1  463 ? 14.003  16.057  4.485   1.000 21.103  0 518  LEU   A HD12 1 c 1 
ATOM   7280  H  HD13 . LEU   A  1  463 ? 12.519  16.105  5.052   1.000 20.698  0 518  LEU   A HD13 1 c 1 
ATOM   7281  H  HD21 . LEU   A  1  463 ? 14.321  19.464  3.786   1.000 27.466  0 518  LEU   A HD21 1 c 1 
ATOM   7282  H  HD22 . LEU   A  1  463 ? 14.994  18.047  3.536   1.000 27.219  0 518  LEU   A HD22 1 c 1 
ATOM   7283  H  HD23 . LEU   A  1  463 ? 14.936  18.650  5.004   1.000 27.368  0 518  LEU   A HD23 1 c 1 
ATOM   7284  N  N    . LYS   A  1  464 ? 11.862  18.721  -0.007  1.000 23.175  0 519  LYS   A N    1 ? 1 
ATOM   7285  C  CA   . LYS   A  1  464 ? 11.447  18.111  -1.261  1.000 22.095  0 519  LYS   A CA   1 ? 1 
ATOM   7286  C  C    . LYS   A  1  464 ? 11.612  16.581  -1.187  1.000 21.941  0 519  LYS   A C    1 ? 1 
ATOM   7287  O  O    . LYS   A  1  464 ? 12.716  16.071  -0.988  1.000 23.740  0 519  LYS   A O    1 ? 1 
ATOM   7288  C  CB   . LYS   A  1  464 ? 12.264  18.711  -2.361  1.000 29.295  0 519  LYS   A CB   1 ? 1 
ATOM   7289  C  CG   . LYS   A  1  464 ? 12.255  20.262  -2.389  1.000 49.260  0 519  LYS   A CG   1 ? 1 
ATOM   7290  C  CD   . LYS   A  1  464 ? 13.579  20.839  -2.988  1.000 70.164  0 519  LYS   A CD   1 ? 1 
ATOM   7291  C  CE   . LYS   A  1  464 ? 13.812  22.293  -2.659  1.000 62.814  0 519  LYS   A CE   1 ? 1 
ATOM   7292  N  NZ   . LYS   A  1  464 ? 12.824  23.150  -3.341  1.000 75.344  0 519  LYS   A NZ   1 ? 1 
ATOM   7293  H  H    . LYS   A  1  464 ? 12.679  19.129  0.025   1.000 23.041  0 519  LYS   A H    1 c 1 
ATOM   7294  H  HA   . LYS   A  1  464 ? 10.501  18.327  -1.417  1.000 23.324  0 519  LYS   A HA   1 c 1 
ATOM   7295  H  HB2  . LYS   A  1  464 ? 13.189  18.403  -2.265  1.000 30.919  0 519  LYS   A HB2  1 c 1 
ATOM   7296  H  HB3  . LYS   A  1  464 ? 11.925  18.380  -3.218  1.000 30.516  0 519  LYS   A HB3  1 c 1 
ATOM   7297  H  HG2  . LYS   A  1  464 ? 11.496  20.567  -2.931  1.000 46.674  0 519  LYS   A HG2  1 c 1 
ATOM   7298  H  HG3  . LYS   A  1  464 ? 12.135  20.605  -1.479  1.000 46.087  0 519  LYS   A HG3  1 c 1 
ATOM   7299  H  HD2  . LYS   A  1  464 ? 14.336  20.316  -2.649  1.000 62.751  0 519  LYS   A HD2  1 c 1 
ATOM   7300  H  HD3  . LYS   A  1  464 ? 13.557  20.736  -3.963  1.000 63.191  0 519  LYS   A HD3  1 c 1 
ATOM   7301  H  HE2  . LYS   A  1  464 ? 13.743  22.428  -1.695  1.000 67.206  0 519  LYS   A HE2  1 c 1 
ATOM   7302  H  HE3  . LYS   A  1  464 ? 14.710  22.554  -2.940  1.000 67.704  0 519  LYS   A HE3  1 c 1 
ATOM   7303  H  HZ1  . LYS   A  1  464 ? 11.996  22.993  -3.004  1.000 70.781  0 519  LYS   A HZ1  1 c 1 
ATOM   7304  H  HZ2  . LYS   A  1  464 ? 12.822  22.971  -4.230  1.000 71.218  0 519  LYS   A HZ2  1 c 1 
ATOM   7305  H  HZ3  . LYS   A  1  464 ? 13.034  24.023  -3.214  1.000 71.636  0 519  LYS   A HZ3  1 c 1 
ATOM   7306  N  N    . PRO   A  1  465 ? 10.519  15.782  -1.235  1.000 21.816  0 520  PRO   A N    1 ? 1 
ATOM   7307  C  CA   . PRO   A  1  465 ? 10.648  14.324  -1.159  1.000 23.617  0 520  PRO   A CA   1 ? 1 
ATOM   7308  C  C    . PRO   A  1  465 ? 11.461  13.740  -2.304  1.000 19.886  0 520  PRO   A C    1 ? 1 
ATOM   7309  O  O    . PRO   A  1  465 ? 11.388  14.243  -3.409  1.000 16.421  0 520  PRO   A O    1 ? 1 
ATOM   7310  C  CB   . PRO   A  1  465 ? 9.202   13.828  -1.195  1.000 28.935  0 520  PRO   A CB   1 ? 1 
ATOM   7311  C  CG   . PRO   A  1  465 ? 8.345   15.036  -0.899  1.000 31.168  0 520  PRO   A CG   1 ? 1 
ATOM   7312  C  CD   . PRO   A  1  465 ? 9.118   16.227  -1.339  1.000 29.473  0 520  PRO   A CD   1 ? 1 
ATOM   7313  H  HA   . PRO   A  1  465 ? 11.057  14.078  -0.291  1.000 23.207  0 520  PRO   A HA   1 c 1 
ATOM   7314  H  HB2  . PRO   A  1  465 ? 8.982   13.459  -2.077  1.000 27.786  0 520  PRO   A HB2  1 c 1 
ATOM   7315  H  HB3  . PRO   A  1  465 ? 9.058   13.131  -0.520  1.000 27.658  0 520  PRO   A HB3  1 c 1 
ATOM   7316  H  HG2  . PRO   A  1  465 ? 7.497   14.981  -1.385  1.000 29.985  0 520  PRO   A HG2  1 c 1 
ATOM   7317  H  HG3  . PRO   A  1  465 ? 8.150   15.091  0.059   1.000 30.070  0 520  PRO   A HG3  1 c 1 
ATOM   7318  H  HD2  . PRO   A  1  465 ? 8.896   16.472  -2.257  1.000 27.873  0 520  PRO   A HD2  1 c 1 
ATOM   7319  H  HD3  . PRO   A  1  465 ? 8.946   16.989  -0.757  1.000 27.880  0 520  PRO   A HD3  1 c 1 
ATOM   7320  N  N    . ALA   A  1  466 ? 12.225  12.678  -2.027  1.000 17.400  0 521  ALA   A N    1 ? 1 
ATOM   7321  C  CA   . ALA   A  1  466 ? 12.795  11.844  -3.066  1.000 20.063  0 521  ALA   A CA   1 ? 1 
ATOM   7322  C  C    . ALA   A  1  466 ? 11.679  11.108  -3.819  1.000 19.190  0 521  ALA   A C    1 ? 1 
ATOM   7323  O  O    . ALA   A  1  466 ? 10.572  10.898  -3.309  1.000 19.564  0 521  ALA   A O    1 ? 1 
ATOM   7324  C  CB   . ALA   A  1  466 ? 13.754  10.836  -2.468  1.000 20.540  0 521  ALA   A CB   1 ? 1 
ATOM   7325  H  H    . ALA   A  1  466 ? 12.396  12.469  -1.154  1.000 18.491  0 521  ALA   A H    1 c 1 
ATOM   7326  H  HA   . ALA   A  1  466 ? 13.284  12.420  -3.698  1.000 19.852  0 521  ALA   A HA   1 c 1 
ATOM   7327  H  HB1  . ALA   A  1  466 ? 14.118  10.275  -3.174  1.000 20.493  0 521  ALA   A HB1  1 c 1 
ATOM   7328  H  HB2  . ALA   A  1  466 ? 14.479  11.303  -2.021  1.000 20.670  0 521  ALA   A HB2  1 c 1 
ATOM   7329  H  HB3  . ALA   A  1  466 ? 13.282  10.280  -1.825  1.000 20.094  0 521  ALA   A HB3  1 c 1 
ATOM   7330  N  N    . PRO   A  1  467 ? 11.902  10.689  -5.074  1.000 17.874  0 522  PRO   A N    1 ? 1 
ATOM   7331  C  CA   . PRO   A  1  467 ? 10.850  9.934   -5.792  1.000 23.007  0 522  PRO   A CA   1 ? 1 
ATOM   7332  C  C    . PRO   A  1  467 ? 10.387  8.691   -5.023  1.000 20.232  0 522  PRO   A C    1 ? 1 
ATOM   7333  O  O    . PRO   A  1  467 ? 11.221  7.885   -4.614  1.000 18.307  0 522  PRO   A O    1 ? 1 
ATOM   7334  C  CB   . PRO   A  1  467 ? 11.499  9.569   -7.115  1.000 20.990  0 522  PRO   A CB   1 ? 1 
ATOM   7335  C  CG   . PRO   A  1  467 ? 12.691  10.552  -7.251  1.000 25.570  0 522  PRO   A CG   1 ? 1 
ATOM   7336  C  CD   . PRO   A  1  467 ? 13.133  10.903  -5.848  1.000 21.873  0 522  PRO   A CD   1 ? 1 
ATOM   7337  H  HA   . PRO   A  1  467 ? 10.080  10.532  -5.961  1.000 20.916  0 522  PRO   A HA   1 c 1 
ATOM   7338  H  HB2  . PRO   A  1  467 ? 11.814  8.640   -7.108  1.000 22.226  0 522  PRO   A HB2  1 c 1 
ATOM   7339  H  HB3  . PRO   A  1  467 ? 10.868  9.683   -7.857  1.000 22.306  0 522  PRO   A HB3  1 c 1 
ATOM   7340  H  HG2  . PRO   A  1  467 ? 13.425  10.132  -7.744  1.000 23.963  0 522  PRO   A HG2  1 c 1 
ATOM   7341  H  HG3  . PRO   A  1  467 ? 12.415  11.359  -7.733  1.000 23.899  0 522  PRO   A HG3  1 c 1 
ATOM   7342  H  HD2  . PRO   A  1  467 ? 13.849  10.315  -5.543  1.000 21.729  0 522  PRO   A HD2  1 c 1 
ATOM   7343  H  HD3  . PRO   A  1  467 ? 13.431  11.829  -5.794  1.000 21.933  0 522  PRO   A HD3  1 c 1 
ATOM   7344  N  N    . ASN   A  1  468 ? 9.078   8.587   -4.752  1.000 22.236  0 523  ASN   A N    1 ? 1 
ATOM   7345  C  CA   . ASN   A  1  468 ? 8.547   7.526   -3.900  1.000 21.830  0 523  ASN   A CA   1 ? 1 
ATOM   7346  C  C    . ASN   A  1  468 ? 7.139   7.111   -4.346  1.000 19.032  0 523  ASN   A C    1 ? 1 
ATOM   7347  O  O    . ASN   A  1  468 ? 6.620   7.664   -5.305  1.000 21.499  0 523  ASN   A O    1 ? 1 
ATOM   7348  C  CB   . ASN   A  1  468 ? 8.578   7.958   -2.417  1.000 17.769  0 523  ASN   A CB   1 ? 1 
ATOM   7349  C  CG   . ASN   A  1  468 ? 7.606   9.092   -2.115  1.000 21.603  0 523  ASN   A CG   1 ? 1 
ATOM   7350  O  OD1  . ASN   A  1  468 ? 6.401   8.899   -1.773  1.000 15.708  0 523  ASN   A OD1  1 ? 1 
ATOM   7351  N  ND2  . ASN   A  1  468 ? 8.085   10.300  -2.300  1.000 18.849  0 523  ASN   A ND2  1 ? 1 
ATOM   7352  H  H    . ASN   A  1  468 ? 8.497   9.195   -5.109  1.000 21.635  0 523  ASN   A H    1 c 1 
ATOM   7353  H  HA   . ASN   A  1  468 ? 9.135   6.745   -3.989  1.000 20.491  0 523  ASN   A HA   1 c 1 
ATOM   7354  H  HB2  . ASN   A  1  468 ? 8.357   7.189   -1.857  1.000 19.206  0 523  ASN   A HB2  1 c 1 
ATOM   7355  H  HB3  . ASN   A  1  468 ? 9.486   8.246   -2.191  1.000 19.620  0 523  ASN   A HB3  1 c 1 
ATOM   7356  H  HD21 . ASN   A  1  468 ? 8.840   10.415  -2.745  1.000 19.928  0 523  ASN   A HD21 1 c 1 
ATOM   7357  H  HD22 . ASN   A  1  468 ? 7.652   11.001  -1.979  1.000 19.731  0 523  ASN   A HD22 1 c 1 
ATOM   7358  N  N    . ASN   A  1  469 ? 6.517   6.162   -3.644  1.000 19.848  0 524  ASN   A N    1 ? 1 
ATOM   7359  C  CA   . ASN   A  1  469 ? 5.269   5.542   -4.085  1.000 19.223  0 524  ASN   A CA   1 ? 1 
ATOM   7360  C  C    . ASN   A  1  469 ? 4.036   6.130   -3.417  1.000 21.237  0 524  ASN   A C    1 ? 1 
ATOM   7361  O  O    . ASN   A  1  469 ? 2.882   5.752   -3.727  1.000 15.805  0 524  ASN   A O    1 ? 1 
ATOM   7362  C  CB   . ASN   A  1  469 ? 5.335   4.019   -3.866  1.000 20.404  0 524  ASN   A CB   1 ? 1 
ATOM   7363  C  CG   . ASN   A  1  469 ? 6.489   3.454   -4.605  1.000 24.313  0 524  ASN   A CG   1 ? 1 
ATOM   7364  O  OD1  . ASN   A  1  469 ? 7.353   2.758   -4.047  1.000 15.434  0 524  ASN   A OD1  1 ? 1 
ATOM   7365  N  ND2  . ASN   A  1  469 ? 6.529   3.734   -5.887  1.000 18.349  0 524  ASN   A ND2  1 ? 1 
ATOM   7366  H  H    . ASN   A  1  469 ? 6.890   5.875   -2.861  1.000 19.412  0 524  ASN   A H    1 c 1 
ATOM   7367  H  HA   . ASN   A  1  469 ? 5.184   5.696   -5.050  1.000 20.063  0 524  ASN   A HA   1 c 1 
ATOM   7368  H  HB2  . ASN   A  1  469 ? 5.431   3.830   -2.910  1.000 20.799  0 524  ASN   A HB2  1 c 1 
ATOM   7369  H  HB3  . ASN   A  1  469 ? 4.506   3.608   -4.185  1.000 20.765  0 524  ASN   A HB3  1 c 1 
ATOM   7370  H  HD21 . ASN   A  1  469 ? 5.914   4.251   -6.253  1.000 20.711  0 524  ASN   A HD21 1 c 1 
ATOM   7371  N  N    . GLY   A  1  470 ? 4.292   7.093   -2.524  1.000 14.940  0 525  GLY   A N    1 ? 1 
ATOM   7372  C  CA   . GLY   A  1  470 ? 3.260   7.983   -2.029  1.000 17.624  0 525  GLY   A CA   1 ? 1 
ATOM   7373  C  C    . GLY   A  1  470 ? 2.687   8.813   -3.174  1.000 19.884  0 525  GLY   A C    1 ? 1 
ATOM   7374  O  O    . GLY   A  1  470 ? 3.340   8.988   -4.196  1.000 20.425  0 525  GLY   A O    1 ? 1 
ATOM   7375  H  H    . GLY   A  1  470 ? 5.141   7.192   -2.201  1.000 16.971  0 525  GLY   A H    1 c 1 
ATOM   7376  H  HA2  . GLY   A  1  470 ? 2.540   7.447   -1.611  1.000 17.197  0 525  GLY   A HA2  1 c 1 
ATOM   7377  H  HA3  . GLY   A  1  470 ? 3.646   8.583   -1.342  1.000 17.424  0 525  GLY   A HA3  1 c 1 
ATOM   7378  N  N    . THR   A  1  471 ? 1.428   9.236   -3.018  1.000 19.061  0 526  THR   A N    1 ? 1 
ATOM   7379  C  CA   . THR   A  1  471 ? 0.807   10.210  -3.904  1.000 19.518  0 526  THR   A CA   1 ? 1 
ATOM   7380  C  C    . THR   A  1  471 ? 0.778   11.549  -3.171  1.000 17.562  0 526  THR   A C    1 ? 1 
ATOM   7381  O  O    . THR   A  1  471 ? -0.017  11.766  -2.259  1.000 18.037  0 526  THR   A O    1 ? 1 
ATOM   7382  C  CB   . THR   A  1  471 ? -0.572  9.748   -4.326  1.000 23.202  0 526  THR   A CB   1 ? 1 
ATOM   7383  O  OG1  . THR   A  1  471 ? -0.478  8.456   -4.934  1.000 19.195  0 526  THR   A OG1  1 ? 1 
ATOM   7384  C  CG2  . THR   A  1  471 ? -1.215  10.690  -5.297  1.000 21.703  0 526  THR   A CG2  1 ? 1 
ATOM   7385  H  H    . THR   A  1  471 ? 0.933   8.901   -2.328  1.000 19.153  0 526  THR   A H    1 c 1 
ATOM   7386  H  HA   . THR   A  1  471 ? 1.366   10.299  -4.709  1.000 19.765  0 526  THR   A HA   1 c 1 
ATOM   7387  H  HB   . THR   A  1  471 ? -1.139  9.683   -3.520  1.000 21.246  0 526  THR   A HB   1 c 1 
ATOM   7388  H  HG1  . THR   A  1  471 ? 0.017   8.507   -5.625  0.000 13.890  0 526  THR   A HG1  1 c 1 
ATOM   7389  H  HG21 . THR   A  1  471 ? -2.043  10.299  -5.629  1.000 22.195  0 526  THR   A HG21 1 c 1 
ATOM   7390  H  HG22 . THR   A  1  471 ? -0.610  10.849  -6.044  1.000 22.335  0 526  THR   A HG22 1 c 1 
ATOM   7391  H  HG23 . THR   A  1  471 ? -1.412  11.534  -4.854  1.000 22.336  0 526  THR   A HG23 1 c 1 
ATOM   7392  N  N    . HIS   A  1  472 ? 1.688   12.427  -3.572  1.000 18.454  0 527  HIS   A N    1 ? 1 
ATOM   7393  C  CA   . HIS   A  1  472 ? 1.964   13.649  -2.831  1.000 16.905  0 527  HIS   A CA   1 ? 1 
ATOM   7394  C  C    . HIS   A  1  472 ? 0.765   14.561  -3.011  1.000 17.802  0 527  HIS   A C    1 ? 1 
ATOM   7395  O  O    . HIS   A  1  472 ? 0.403   14.883  -4.142  1.000 17.828  0 527  HIS   A O    1 ? 1 
ATOM   7396  C  CB   . HIS   A  1  472 ? 3.246   14.289  -3.352  1.000 19.091  0 527  HIS   A CB   1 ? 1 
ATOM   7397  C  CG   . HIS   A  1  472 ? 3.881   15.306  -2.464  1.000 17.684  0 527  HIS   A CG   1 ? 1 
ATOM   7398  N  ND1  . HIS   A  1  472 ? 5.005   15.970  -2.865  1.000 19.631  0 527  HIS   A ND1  1 ? 1 
ATOM   7399  C  CD2  . HIS   A  1  472 ? 3.582   15.657  -1.188  1.000 23.123  0 527  HIS   A CD2  1 ? 1 
ATOM   7400  C  CE1  . HIS   A  1  472 ? 5.357   16.764  -1.838  1.000 22.111  0 527  HIS   A CE1  1 ? 1 
ATOM   7401  N  NE2  . HIS   A  1  472 ? 4.515   16.602  -0.788  1.000 17.801  0 527  HIS   A NE2  1 ? 1 
ATOM   7402  H  H    . HIS   A  1  472 ? 2.155   12.265  -4.340  1.000 17.975  0 527  HIS   A H    1 c 1 
ATOM   7403  H  HA   . HIS   A  1  472 ? 2.077   13.423  -1.881  1.000 17.665  0 527  HIS   A HA   1 c 1 
ATOM   7404  H  HB2  . HIS   A  1  472 ? 3.898   13.577  -3.517  1.000 18.123  0 527  HIS   A HB2  1 c 1 
ATOM   7405  H  HB3  . HIS   A  1  472 ? 3.050   14.712  -4.213  1.000 18.433  0 527  HIS   A HB3  1 c 1 
ATOM   7406  H  HD1  . HIS   A  1  472 ? 5.423   15.863  -3.628  0.000 12.550  0 527  HIS   A HD1  1 c 1 
ATOM   7407  H  HD2  . HIS   A  1  472 ? 2.859   15.336  -0.681  1.000 20.469  0 527  HIS   A HD2  1 c 1 
ATOM   7408  H  HE1  . HIS   A  1  472 ? 6.092   17.355  -1.847  1.000 20.810  0 527  HIS   A HE1  1 c 1 
ATOM   7409  H  HE2  . HIS   A  1  472 ? 4.575   17.034  -0.009  0.000 10.120  0 527  HIS   A HE2  1 c 1 
ATOM   7410  N  N    . GLY   A  1  473 ? 0.112   14.900  -1.894  1.000 17.235  0 528  GLY   A N    1 ? 1 
ATOM   7411  C  CA   . GLY   A  1  473 ? -1.107  15.689  -1.904  1.000 16.545  0 528  GLY   A CA   1 ? 1 
ATOM   7412  C  C    . GLY   A  1  473 ? -2.298  14.875  -1.397  1.000 17.001  0 528  GLY   A C    1 ? 1 
ATOM   7413  O  O    . GLY   A  1  473 ? -3.308  15.439  -0.986  1.000 18.253  0 528  GLY   A O    1 ? 1 
ATOM   7414  H  H    . GLY   A  1  473 ? 0.446   14.628  -1.088  1.000 17.159  0 528  GLY   A H    1 c 1 
ATOM   7415  H  HA2  . GLY   A  1  473 ? -0.982  16.483  -1.330  1.000 17.163  0 528  GLY   A HA2  1 c 1 
ATOM   7416  H  HA3  . GLY   A  1  473 ? -1.290  16.001  -2.825  1.000 17.103  0 528  GLY   A HA3  1 c 1 
ATOM   7417  N  N    . SER   A  1  474 ? -2.163  13.542  -1.390  1.000 21.992  0 529  SER   A N    1 ? 1 
ATOM   7418  C  CA   . SER   A  1  474 ? -3.268  12.674  -1.026  1.000 18.207  0 529  SER   A CA   1 ? 1 
ATOM   7419  C  C    . SER   A  1  474 ? -3.605  12.744  0.453   1.000 20.467  0 529  SER   A C    1 ? 1 
ATOM   7420  O  O    . SER   A  1  474 ? -4.680  12.308  0.848   1.000 20.826  0 529  SER   A O    1 ? 1 
ATOM   7421  C  CB   . SER   A  1  474 ? -2.979  11.237  -1.412  1.000 21.495  0 529  SER   A CB   1 ? 1 
ATOM   7422  O  OG   . SER   A  1  474 ? -2.013  10.609  -0.583  1.000 26.490  0 529  SER   A OG   1 ? 1 
ATOM   7423  H  H    . SER   A  1  474 ? -1.364  13.164  -1.619  1.000 19.499  0 529  SER   A H    1 c 1 
ATOM   7424  H  HA   . SER   A  1  474 ? -4.068  12.975  -1.535  1.000 20.034  0 529  SER   A HA   1 c 1 
ATOM   7425  H  HB2  . SER   A  1  474 ? -3.817  10.723  -1.372  1.000 21.601  0 529  SER   A HB2  1 c 1 
ATOM   7426  H  HB3  . SER   A  1  474 ? -2.662  11.216  -2.344  1.000 21.658  0 529  SER   A HB3  1 c 1 
ATOM   7427  H  HG   . SER   A  1  474 ? -2.412  10.240  0.060   0.000 20.100  0 529  SER   A HG   1 c 1 
ATOM   7428  N  N    . LEU   A  1  475 ? -2.669  13.243  1.268   1.000 21.839  0 530  LEU   A N    1 ? 1 
ATOM   7429  C  CA   . LEU   A  1  475 ? -2.936  13.463  2.686   1.000 26.975  0 530  LEU   A CA   1 ? 1 
ATOM   7430  C  C    . LEU   A  1  475 ? -2.832  14.934  3.101   1.000 27.106  0 530  LEU   A C    1 ? 1 
ATOM   7431  O  O    . LEU   A  1  475 ? -2.529  15.216  4.262   1.000 23.053  0 530  LEU   A O    1 ? 1 
ATOM   7432  C  CB   . LEU   A  1  475 ? -1.954  12.648  3.572   1.000 18.116  0 530  LEU   A CB   1 ? 1 
ATOM   7433  C  CG   . LEU   A  1  475 ? -1.920  11.168  3.412   1.000 20.852  0 530  LEU   A CG   1 ? 1 
ATOM   7434  C  CD1  . LEU   A  1  475 ? -0.802  10.575  4.357   1.000 24.500  0 530  LEU   A CD1  1 ? 1 
ATOM   7435  C  CD2  . LEU   A  1  475 ? -3.261  10.532  3.716   1.000 21.731  0 530  LEU   A CD2  1 ? 1 
ATOM   7436  H  H    . LEU   A  1  475 ? -1.838  13.436  0.943   1.000 22.439  0 530  LEU   A H    1 c 1 
ATOM   7437  H  HA   . LEU   A  1  475 ? -3.854  13.163  2.874   1.000 23.964  0 530  LEU   A HA   1 c 1 
ATOM   7438  H  HB2  . LEU   A  1  475 ? -1.053  12.986  3.408   1.000 20.639  0 530  LEU   A HB2  1 c 1 
ATOM   7439  H  HB3  . LEU   A  1  475 ? -2.165  12.840  4.507   1.000 20.635  0 530  LEU   A HB3  1 c 1 
ATOM   7440  H  HG   . LEU   A  1  475 ? -1.680  10.961  2.475   1.000 20.881  0 530  LEU   A HG   1 c 1 
ATOM   7441  H  HD11 . LEU   A  1  475 ? -0.838  9.603   4.333   1.000 23.053  0 530  LEU   A HD11 1 c 1 
ATOM   7442  H  HD12 . LEU   A  1  475 ? -0.952  10.882  5.269   1.000 23.432  0 530  LEU   A HD12 1 c 1 
ATOM   7443  H  HD13 . LEU   A  1  475 ? 0.073   10.875  4.054   1.000 23.343  0 530  LEU   A HD13 1 c 1 
ATOM   7444  H  HD21 . LEU   A  1  475 ? -3.919  10.830  3.064   1.000 21.588  0 530  LEU   A HD21 1 c 1 
ATOM   7445  H  HD22 . LEU   A  1  475 ? -3.549  10.791  4.609   1.000 21.591  0 530  LEU   A HD22 1 c 1 
ATOM   7446  H  HD23 . LEU   A  1  475 ? -3.178  9.564   3.672   1.000 21.276  0 530  LEU   A HD23 1 c 1 
ATOM   7447  N  N    . ASN   A  1  476 ? -3.140  15.869  2.187   1.000 19.755  0 531  ASN   A N    1 ? 1 
ATOM   7448  C  CA   . ASN   A  1  476 ? -3.130  17.286  2.533   1.000 25.387  0 531  ASN   A CA   1 ? 1 
ATOM   7449  C  C    . ASN   A  1  476 ? -4.182  17.617  3.583   1.000 21.939  0 531  ASN   A C    1 ? 1 
ATOM   7450  O  O    . ASN   A  1  476 ? -3.984  18.525  4.378   1.000 23.486  0 531  ASN   A O    1 ? 1 
ATOM   7451  C  CB   . ASN   A  1  476 ? -3.300  18.211  1.338   1.000 21.767  0 531  ASN   A CB   1 ? 1 
ATOM   7452  C  CG   . ASN   A  1  476 ? -1.993  18.557  0.644   1.000 22.703  0 531  ASN   A CG   1 ? 1 
ATOM   7453  O  OD1  . ASN   A  1  476 ? -0.997  17.867  0.742   1.000 26.145  0 531  ASN   A OD1  1 ? 1 
ATOM   7454  N  ND2  . ASN   A  1  476 ? -1.975  19.656  -0.103  1.000 31.700  0 531  ASN   A ND2  1 ? 1 
ATOM   7455  H  H    . ASN   A  1  476 ? -3.363  15.620  1.337   1.000 22.383  0 531  ASN   A H    1 c 1 
ATOM   7456  H  HA   . ASN   A  1  476 ? -2.247  17.485  2.926   1.000 23.027  0 531  ASN   A HA   1 c 1 
ATOM   7457  H  HB2  . ASN   A  1  476 ? -3.898  17.783  0.692   1.000 22.739  0 531  ASN   A HB2  1 c 1 
ATOM   7458  H  HB3  . ASN   A  1  476 ? -3.727  19.039  1.639   1.000 23.215  0 531  ASN   A HB3  1 c 1 
ATOM   7459  H  HD21 . ASN   A  1  476 ? -2.714  20.129  -0.214  1.000 28.767  0 531  ASN   A HD21 1 c 1 
ATOM   7460  H  HD22 . ASN   A  1  476 ? -1.224  19.915  -0.491  1.000 28.674  0 531  ASN   A HD22 1 c 1 
ATOM   7461  N  N    . HIS   A  1  477 ? -5.245  16.816  3.651   1.000 18.260  0 532  HIS   A N    1 ? 1 
ATOM   7462  C  CA   . HIS   A  1  477 ? -6.282  17.009  4.641   1.000 21.580  0 532  HIS   A CA   1 ? 1 
ATOM   7463  C  C    . HIS   A  1  477 ? -5.853  16.710  6.091   1.000 23.262  0 532  HIS   A C    1 ? 1 
ATOM   7464  O  O    . HIS   A  1  477 ? -6.655  16.892  7.003   1.000 25.007  0 532  HIS   A O    1 ? 1 
ATOM   7465  C  CB   . HIS   A  1  477 ? -7.534  16.155  4.244   1.000 20.080  0 532  HIS   A CB   1 ? 1 
ATOM   7466  C  CG   . HIS   A  1  477 ? -7.303  14.673  4.233   1.000 22.373  0 532  HIS   A CG   1 ? 1 
ATOM   7467  N  ND1  . HIS   A  1  477 ? -6.706  14.031  3.145   1.000 27.488  0 532  HIS   A ND1  1 ? 1 
ATOM   7468  C  CD2  . HIS   A  1  477 ? -7.621  13.740  5.158   1.000 25.094  0 532  HIS   A CD2  1 ? 1 
ATOM   7469  C  CE1  . HIS   A  1  477 ? -6.658  12.732  3.451   1.000 22.880  0 532  HIS   A CE1  1 ? 1 
ATOM   7470  N  NE2  . HIS   A  1  477 ? -7.214  12.505  4.649   1.000 24.707  0 532  HIS   A NE2  1 ? 1 
ATOM   7471  H  H    . HIS   A  1  477 ? -5.336  16.137  3.047   1.000 19.562  0 532  HIS   A H    1 c 1 
ATOM   7472  H  HA   . HIS   A  1  477 ? -6.548  17.956  4.597   1.000 21.444  0 532  HIS   A HA   1 c 1 
ATOM   7473  H  HB2  . HIS   A  1  477 ? -8.257  16.352  4.873   1.000 21.261  0 532  HIS   A HB2  1 c 1 
ATOM   7474  H  HB3  . HIS   A  1  477 ? -7.829  16.431  3.353   1.000 21.107  0 532  HIS   A HB3  1 c 1 
ATOM   7475  H  HD1  . HIS   A  1  477 ? -6.431  14.416  2.407   0.000 19.600  0 532  HIS   A HD1  1 c 1 
ATOM   7476  H  HD2  . HIS   A  1  477 ? -8.044  13.896  5.988   1.000 24.570  0 532  HIS   A HD2  1 c 1 
ATOM   7477  H  HE1  . HIS   A  1  477 ? -6.300  12.063  2.892   1.000 23.913  0 532  HIS   A HE1  1 c 1 
ATOM   7478  H  HE2  . HIS   A  1  477 ? -7.275  11.711  5.050   0.000 17.620  0 532  HIS   A HE2  1 c 1 
ATOM   7479  N  N    . LEU   A  1  478 ? -4.619  16.203  6.296   1.000 25.338  0 533  LEU   A N    1 ? 1 
ATOM   7480  C  CA   . LEU   A  1  478 ? -4.080  15.964  7.628   1.000 24.292  0 533  LEU   A CA   1 ? 1 
ATOM   7481  C  C    . LEU   A  1  478 ? -3.570  17.259  8.250   1.000 31.267  0 533  LEU   A C    1 ? 1 
ATOM   7482  O  O    . LEU   A  1  478 ? -3.519  17.376  9.480   1.000 28.690  0 533  LEU   A O    1 ? 1 
ATOM   7483  C  CB   . LEU   A  1  478 ? -2.935  14.935  7.579   1.000 21.655  0 533  LEU   A CB   1 ? 1 
ATOM   7484  C  CG   . LEU   A  1  478 ? -3.341  13.444  7.773   1.000 23.289  0 533  LEU   A CG   1 ? 1 
ATOM   7485  C  CD1  . LEU   A  1  478 ? -4.344  12.985  6.717   1.000 25.710  0 533  LEU   A CD1  1 ? 1 
ATOM   7486  C  CD2  . LEU   A  1  478 ? -2.154  12.617  7.776   1.000 20.573  0 533  LEU   A CD2  1 ? 1 
ATOM   7487  H  H    . LEU   A  1  478 ? -4.103  15.984  5.574   1.000 24.191  0 533  LEU   A H    1 c 1 
ATOM   7488  H  HA   . LEU   A  1  478 ? -4.805  15.611  8.194   1.000 25.151  0 533  LEU   A HA   1 c 1 
ATOM   7489  H  HB2  . LEU   A  1  478 ? -2.480  15.021  6.719   1.000 22.505  0 533  LEU   A HB2  1 c 1 
ATOM   7490  H  HB3  . LEU   A  1  478 ? -2.287  15.167  8.274   1.000 22.692  0 533  LEU   A HB3  1 c 1 
ATOM   7491  H  HG   . LEU   A  1  478 ? -3.773  13.359  8.659   1.000 22.977  0 533  LEU   A HG   1 c 1 
ATOM   7492  H  HD11 . LEU   A  1  478 ? -4.587  12.058  6.880   1.000 24.722  0 533  LEU   A HD11 1 c 1 
ATOM   7493  H  HD12 . LEU   A  1  478 ? -3.944  13.064  5.834   1.000 24.780  0 533  LEU   A HD12 1 c 1 
ATOM   7494  H  HD13 . LEU   A  1  478 ? -5.141  13.541  6.761   1.000 25.131  0 533  LEU   A HD13 1 c 1 
ATOM   7495  H  HD21 . LEU   A  1  478 ? -1.568  12.891  8.503   1.000 21.391  0 533  LEU   A HD21 1 c 1 
ATOM   7496  H  HD22 . LEU   A  1  478 ? -1.686  12.717  6.929   1.000 21.188  0 533  LEU   A HD22 1 c 1 
ATOM   7497  H  HD23 . LEU   A  1  478 ? -2.407  11.685  7.898   1.000 21.108  0 533  LEU   A HD23 1 c 1 
ATOM   7498  N  N    . LEU   A  1  479 ? -3.152  18.192  7.381   1.000 21.106  0 534  LEU   A N    1 ? 1 
ATOM   7499  C  CA   . LEU   A  1  479 ? -2.386  19.356  7.792   1.000 22.841  0 534  LEU   A CA   1 ? 1 
ATOM   7500  C  C    . LEU   A  1  479 ? -3.204  20.631  7.773   1.000 23.185  0 534  LEU   A C    1 ? 1 
ATOM   7501  O  O    . LEU   A  1  479 ? -4.127  20.767  6.967   1.000 22.939  0 534  LEU   A O    1 ? 1 
ATOM   7502  C  CB   . LEU   A  1  479 ? -1.191  19.497  6.857   1.000 26.535  0 534  LEU   A CB   1 ? 1 
ATOM   7503  C  CG   . LEU   A  1  479 ? -0.314  18.246  6.752   1.000 30.297  0 534  LEU   A CG   1 ? 1 
ATOM   7504  C  CD1  . LEU   A  1  479 ? 0.876   18.496  5.812   1.000 30.574  0 534  LEU   A CD1  1 ? 1 
ATOM   7505  C  CD2  . LEU   A  1  479 ? 0.190   17.761  8.171   1.000 26.956  0 534  LEU   A CD2  1 ? 1 
ATOM   7506  H  H    . LEU   A  1  479 ? -3.350  18.096  6.495   1.000 23.403  0 534  LEU   A H    1 c 1 
ATOM   7507  H  HA   . LEU   A  1  479 ? -2.064  19.207  8.709   1.000 23.324  0 534  LEU   A HA   1 c 1 
ATOM   7508  H  HB2  . LEU   A  1  479 ? -1.519  19.724  5.965   1.000 26.451  0 534  LEU   A HB2  1 c 1 
ATOM   7509  H  HB3  . LEU   A  1  479 ? -0.638  20.241  7.170   1.000 26.700  0 534  LEU   A HB3  1 c 1 
ATOM   7510  H  HG   . LEU   A  1  479 ? -0.862  17.522  6.361   1.000 28.578  0 534  LEU   A HG   1 c 1 
ATOM   7511  H  HD11 . LEU   A  1  479 ? 1.254   17.644  5.532   1.000 30.459  0 534  LEU   A HD11 1 c 1 
ATOM   7512  H  HD12 . LEU   A  1  479 ? 1.556   19.013  6.279   1.000 30.795  0 534  LEU   A HD12 1 c 1 
ATOM   7513  H  HD13 . LEU   A  1  479 ? 0.576   18.991  5.031   1.000 30.866  0 534  LEU   A HD13 1 c 1 
ATOM   7514  H  HD21 . LEU   A  1  479 ? -0.561  17.414  8.684   1.000 27.735  0 534  LEU   A HD21 1 c 1 
ATOM   7515  H  HD22 . LEU   A  1  479 ? 0.590   18.510  8.648   1.000 28.111  0 534  LEU   A HD22 1 c 1 
ATOM   7516  H  HD23 . LEU   A  1  479 ? 0.855   17.059  8.057   1.000 27.575  0 534  LEU   A HD23 1 c 1 
ATOM   7517  N  N    . ARG   A  1  480 ? -2.874  21.564  8.675   1.000 28.700  0 535  ARG   A N    1 ? 1 
ATOM   7518  C  CA   . ARG   A  1  480 ? -3.511  22.870  8.647   1.000 24.961  0 535  ARG   A CA   1 ? 1 
ATOM   7519  C  C    . ARG   A  1  480 ? -2.777  23.802  7.682   1.000 25.359  0 535  ARG   A C    1 ? 1 
ATOM   7520  O  O    . ARG   A  1  480 ? -3.337  24.797  7.258   1.000 24.798  0 535  ARG   A O    1 ? 1 
ATOM   7521  C  CB   . ARG   A  1  480 ? -3.660  23.468  10.063  1.000 36.674  0 535  ARG   A CB   1 ? 1 
ATOM   7522  C  CG   . ARG   A  1  480 ? -2.413  23.865  10.764  1.000 32.929  0 535  ARG   A CG   1 ? 1 
ATOM   7523  C  CD   . ARG   A  1  480 ? -2.705  24.295  12.212  1.000 33.561  0 535  ARG   A CD   1 ? 1 
ATOM   7524  N  NE   . ARG   A  1  480 ? -3.706  25.344  12.315  1.000 32.954  0 535  ARG   A NE   1 ? 1 
ATOM   7525  C  CZ   . ARG   A  1  480 ? -4.800  25.280  13.071  1.000 45.712  0 535  ARG   A CZ   1 ? 1 
ATOM   7526  N  NH1  . ARG   A  1  480 ? -5.056  24.225  13.823  1.000 40.440  0 535  ARG   A NH1  1 ? 1 
ATOM   7527  N  NH2  . ARG   A  1  480 ? -5.663  26.295  13.068  1.000 37.009  0 535  ARG   A NH2  1 ? 1 
ATOM   7528  H  H    . ARG   A  1  480 ? -2.247  21.385  9.315   1.000 26.346  0 535  ARG   A H    1 c 1 
ATOM   7529  H  HA   . ARG   A  1  480 ? -4.420  22.742  8.290   1.000 27.484  0 535  ARG   A HA   1 c 1 
ATOM   7530  H  HB2  . ARG   A  1  480 ? -4.237  24.257  9.996   1.000 33.112  0 535  ARG   A HB2  1 c 1 
ATOM   7531  H  HB3  . ARG   A  1  480 ? -4.128  22.811  10.620  1.000 32.551  0 535  ARG   A HB3  1 c 1 
ATOM   7532  H  HG2  . ARG   A  1  480 ? -1.786  23.111  10.772  1.000 33.335  0 535  ARG   A HG2  1 c 1 
ATOM   7533  H  HG3  . ARG   A  1  480 ? -1.990  24.610  10.287  1.000 33.991  0 535  ARG   A HG3  1 c 1 
ATOM   7534  H  HD2  . ARG   A  1  480 ? -3.001  23.511  12.721  1.000 33.186  0 535  ARG   A HD2  1 c 1 
ATOM   7535  H  HD3  . ARG   A  1  480 ? -1.875  24.616  12.620  1.000 33.349  0 535  ARG   A HD3  1 c 1 
ATOM   7536  H  HE   . ARG   A  1  480 ? -3.581  26.070  11.847  1.000 36.043  0 535  ARG   A HE   1 c 1 
ATOM   7537  H  HH11 . ARG   A  1  480 ? -4.433  23.913  14.373  1.000 41.617  0 535  ARG   A HH11 1 c 1 
ATOM   7538  H  HH12 . ARG   A  1  480 ? -5.857  23.841  13.779  1.000 41.818  0 535  ARG   A HH12 1 c 1 
ATOM   7539  H  HH21 . ARG   A  1  480 ? -6.381  26.260  13.574  1.000 39.799  0 535  ARG   A HH21 1 c 1 
ATOM   7540  H  HH22 . ARG   A  1  480 ? -5.514  26.997  12.560  1.000 39.751  0 535  ARG   A HH22 1 c 1 
ATOM   7541  N  N    . THR   A  1  481 ? -1.520  23.483  7.346   1.000 31.906  0 536  THR   A N    1 ? 1 
ATOM   7542  C  CA   . THR   A  1  481 ? -0.768  24.213  6.341   1.000 36.977  0 536  THR   A CA   1 ? 1 
ATOM   7543  C  C    . THR   A  1  481 ? -0.038  23.216  5.457   1.000 40.958  0 536  THR   A C    1 ? 1 
ATOM   7544  O  O    . THR   A  1  481 ? 0.653   22.340  5.963   1.000 42.193  0 536  THR   A O    1 ? 1 
ATOM   7545  C  CB   . THR   A  1  481 ? 0.287   25.158  6.945   1.000 36.628  0 536  THR   A CB   1 ? 1 
ATOM   7546  O  OG1  . THR   A  1  481 ? -0.316  25.925  7.978   1.000 46.806  0 536  THR   A OG1  1 ? 1 
ATOM   7547  C  CG2  . THR   A  1  481 ? 0.889   26.082  5.886   1.000 43.699  0 536  THR   A CG2  1 ? 1 
ATOM   7548  H  H    . THR   A  1  481 ? -1.110  22.786  7.771   1.000 30.643  0 536  THR   A H    1 c 1 
ATOM   7549  H  HA   . THR   A  1  481 ? -1.395  24.736  5.791   1.000 36.604  0 536  THR   A HA   1 c 1 
ATOM   7550  H  HB   . THR   A  1  481 ? 1.009   24.609  7.336   1.000 39.427  0 536  THR   A HB   1 c 1 
ATOM   7551  H  HG1  . THR   A  1  481 ? -0.960  26.372  7.682   0.000 35.460  0 536  THR   A HG1  1 c 1 
ATOM   7552  H  HG21 . THR   A  1  481 ? 1.659   26.547  6.259   1.000 41.805  0 536  THR   A HG21 1 c 1 
ATOM   7553  H  HG22 . THR   A  1  481 ? 0.221   26.734  5.605   1.000 41.897  0 536  THR   A HG22 1 c 1 
ATOM   7554  H  HG23 . THR   A  1  481 ? 1.172   25.557  5.117   1.000 41.260  0 536  THR   A HG23 1 c 1 
ATOM   7555  N  N    . ASN   A  1  482 ? -0.158  23.396  4.142   1.000 35.366  0 537  ASN   A N    1 ? 1 
ATOM   7556  C  CA   . ASN   A  1  482 ? 0.509   22.539  3.180   1.000 26.783  0 537  ASN   A CA   1 ? 1 
ATOM   7557  C  C    . ASN   A  1  482 ? 1.647   23.255  2.466   1.000 33.332  0 537  ASN   A C    1 ? 1 
ATOM   7558  O  O    . ASN   A  1  482 ? 1.438   24.334  1.928   1.000 39.027  0 537  ASN   A O    1 ? 1 
ATOM   7559  C  CB   . ASN   A  1  482 ? -0.540  22.101  2.182   1.000 25.063  0 537  ASN   A CB   1 ? 1 
ATOM   7560  C  CG   . ASN   A  1  482 ? -1.377  21.038  2.782   1.000 30.731  0 537  ASN   A CG   1 ? 1 
ATOM   7561  O  OD1  . ASN   A  1  482 ? -0.872  19.941  3.044   1.000 35.317  0 537  ASN   A OD1  1 ? 1 
ATOM   7562  N  ND2  . ASN   A  1  482 ? -2.631  21.340  3.055   1.000 35.111  0 537  ASN   A ND2  1 ? 1 
ATOM   7563  H  H    . ASN   A  1  482 ? -0.672  24.085  3.831   1.000 34.584  0 537  ASN   A H    1 c 1 
ATOM   7564  H  HA   . ASN   A  1  482 ? 0.859   21.741  3.640   1.000 28.793  0 537  ASN   A HA   1 c 1 
ATOM   7565  H  HB2  . ASN   A  1  482 ? -1.099  22.866  1.934   1.000 27.218  0 537  ASN   A HB2  1 c 1 
ATOM   7566  H  HB3  . ASN   A  1  482 ? -0.103  21.759  1.376   1.000 26.607  0 537  ASN   A HB3  1 c 1 
ATOM   7567  H  HD21 . ASN   A  1  482 ? -2.897  22.184  3.051   1.000 33.951  0 537  ASN   A HD21 1 c 1 
ATOM   7568  H  HD22 . ASN   A  1  482 ? -3.208  20.697  3.245   1.000 33.428  0 537  ASN   A HD22 1 c 1 
ATOM   7569  N  N    . THR   A  1  483 ? 2.829   22.645  2.442   1.000 35.559  0 538  THR   A N    1 ? 1 
ATOM   7570  C  CA   . THR   A  1  483 ? 3.946   23.200  1.694   1.000 44.107  0 538  THR   A CA   1 ? 1 
ATOM   7571  C  C    . THR   A  1  483 ? 3.914   22.724  0.245   1.000 31.656  0 538  THR   A C    1 ? 1 
ATOM   7572  O  O    . THR   A  1  483 ? 4.658   23.236  -0.598  1.000 31.626  0 538  THR   A O    1 ? 1 
ATOM   7573  C  CB   . THR   A  1  483 ? 5.316   22.848  2.331   1.000 46.563  0 538  THR   A CB   1 ? 1 
ATOM   7574  O  OG1  . THR   A  1  483 ? 5.544   21.450  2.175   1.000 54.540  0 538  THR   A OG1  1 ? 1 
ATOM   7575  C  CG2  . THR   A  1  483 ? 5.398   23.224  3.788   1.000 59.397  0 538  THR   A CG2  1 ? 1 
ATOM   7576  H  H    . THR   A  1  483 ? 2.949   21.866  2.905   1.000 36.102  0 538  THR   A H    1 c 1 
ATOM   7577  H  HA   . THR   A  1  483 ? 3.853   24.181  1.696   1.000 40.523  0 538  THR   A HA   1 c 1 
ATOM   7578  H  HB   . THR   A  1  483 ? 6.017   23.339  1.840   1.000 50.060  0 538  THR   A HB   1 c 1 
ATOM   7579  H  HG1  . THR   A  1  483 ? 4.907   21.017  2.548   0.000 45.050  0 538  THR   A HG1  1 c 1 
ATOM   7580  H  HG21 . THR   A  1  483 ? 6.292   23.033  4.124   1.000 55.199  0 538  THR   A HG21 1 c 1 
ATOM   7581  H  HG22 . THR   A  1  483 ? 4.745   22.708  4.296   1.000 54.811  0 538  THR   A HG22 1 c 1 
ATOM   7582  H  HG23 . THR   A  1  483 ? 5.210   24.174  3.891   1.000 55.594  0 538  THR   A HG23 1 c 1 
ATOM   7583  N  N    . PHE   A  1  484 ? 3.049   21.742  -0.032  1.000 36.867  0 539  PHE   A N    1 ? 1 
ATOM   7584  C  CA   . PHE   A  1  484 ? 2.920   21.185  -1.369  1.000 37.351  0 539  PHE   A CA   1 ? 1 
ATOM   7585  C  C    . PHE   A  1  484 ? 1.473   21.241  -1.863  1.000 32.333  0 539  PHE   A C    1 ? 1 
ATOM   7586  O  O    . PHE   A  1  484 ? 0.558   20.862  -1.143  1.000 34.595  0 539  PHE   A O    1 ? 1 
ATOM   7587  C  CB   . PHE   A  1  484 ? 3.423   19.751  -1.374  1.000 38.555  0 539  PHE   A CB   1 ? 1 
ATOM   7588  C  CG   . PHE   A  1  484 ? 3.321   19.102  -2.728  1.000 22.320  0 539  PHE   A CG   1 ? 1 
ATOM   7589  C  CD1  . PHE   A  1  484 ? 4.229   19.389  -3.714  1.000 20.109  0 539  PHE   A CD1  1 ? 1 
ATOM   7590  C  CD2  . PHE   A  1  484 ? 2.295   18.213  -3.012  1.000 26.260  0 539  PHE   A CD2  1 ? 1 
ATOM   7591  C  CE1  . PHE   A  1  484 ? 4.121   18.803  -4.985  1.000 22.101  0 539  PHE   A CE1  1 ? 1 
ATOM   7592  C  CE2  . PHE   A  1  484 ? 2.195   17.633  -4.277  1.000 25.991  0 539  PHE   A CE2  1 ? 1 
ATOM   7593  C  CZ   . PHE   A  1  484 ? 3.126   17.935  -5.250  1.000 22.473  0 539  PHE   A CZ   1 ? 1 
ATOM   7594  H  H    . PHE   A  1  484 ? 2.527   21.397  0.634   1.000 35.370  0 539  PHE   A H    1 c 1 
ATOM   7595  H  HA   . PHE   A  1  484 ? 3.481   21.715  -1.989  1.000 36.699  0 539  PHE   A HA   1 c 1 
ATOM   7596  H  HB2  . PHE   A  1  484 ? 4.359   19.745  -1.084  1.000 33.292  0 539  PHE   A HB2  1 c 1 
ATOM   7597  H  HB3  . PHE   A  1  484 ? 2.901   19.231  -0.727  1.000 32.900  0 539  PHE   A HB3  1 c 1 
ATOM   7598  H  HD1  . PHE   A  1  484 ? 4.929   19.997  -3.537  1.000 21.542  0 539  PHE   A HD1  1 c 1 
ATOM   7599  H  HD2  . PHE   A  1  484 ? 1.656   18.008  -2.348  1.000 24.987  0 539  PHE   A HD2  1 c 1 
ATOM   7600  H  HE1  . PHE   A  1  484 ? 4.758   19.006  -5.652  1.000 22.083  0 539  PHE   A HE1  1 c 1 
ATOM   7601  H  HE2  . PHE   A  1  484 ? 1.497   17.027  -4.463  1.000 24.732  0 539  PHE   A HE2  1 c 1 
ATOM   7602  H  HZ   . PHE   A  1  484 ? 3.060   17.538  -6.104  1.000 23.091  0 539  PHE   A HZ   1 c 1 
ATOM   7603  N  N    . ARG   A  1  485 ? 1.278   21.765  -3.076  1.000 31.129  0 540  ARG   A N    1 ? 1 
ATOM   7604  C  CA   . ARG   A  1  485 ? -0.027  21.789  -3.715  1.000 39.104  0 540  ARG   A CA   1 ? 1 
ATOM   7605  C  C    . ARG   A  1  485 ? -0.025  20.873  -4.935  1.000 26.392  0 540  ARG   A C    1 ? 1 
ATOM   7606  O  O    . ARG   A  1  485 ? 0.735   21.060  -5.878  1.000 26.943  0 540  ARG   A O    1 ? 1 
ATOM   7607  C  CB   . ARG   A  1  485 ? -0.444  23.216  -4.101  1.000 50.230  0 540  ARG   A CB   1 ? 1 
ATOM   7608  C  CG   . ARG   A  1  485 ? -1.066  23.922  -2.915  1.000 72.484  0 540  ARG   A CG   1 ? 1 
ATOM   7609  C  CD   . ARG   A  1  485 ? -0.984  25.434  -3.005  1.000 98.463  0 540  ARG   A CD   1 ? 1 
ATOM   7610  N  NE   . ARG   A  1  485 ? -1.068  26.027  -1.675  1.000 78.038  0 540  ARG   A NE   1 ? 1 
ATOM   7611  C  CZ   . ARG   A  1  485 ? -2.112  26.700  -1.219  1.000 63.347  0 540  ARG   A CZ   1 ? 1 
ATOM   7612  N  NH1  . ARG   A  1  485 ? -2.877  27.416  -2.024  1.000 78.662  0 540  ARG   A NH1  1 ? 1 
ATOM   7613  N  NH2  . ARG   A  1  485 ? -2.384  26.668  0.082   1.000 79.465  0 540  ARG   A NH2  1 ? 1 
ATOM   7614  H  H    . ARG   A  1  485 ? 1.989   22.123  -3.525  1.000 33.382  0 540  ARG   A H    1 c 1 
ATOM   7615  H  HA   . ARG   A  1  485 ? -0.682  21.445  -3.071  1.000 35.944  0 540  ARG   A HA   1 c 1 
ATOM   7616  H  HB2  . ARG   A  1  485 ? 0.344   23.713  -4.405  1.000 52.198  0 540  ARG   A HB2  1 c 1 
ATOM   7617  H  HB3  . ARG   A  1  485 ? -1.092  23.178  -4.836  1.000 51.560  0 540  ARG   A HB3  1 c 1 
ATOM   7618  H  HG2  . ARG   A  1  485 ? -2.009  23.661  -2.845  1.000 70.923  0 540  ARG   A HG2  1 c 1 
ATOM   7619  H  HG3  . ARG   A  1  485 ? -0.614  23.631  -2.094  1.000 70.325  0 540  ARG   A HG3  1 c 1 
ATOM   7620  H  HD2  . ARG   A  1  485 ? -0.137  25.693  -3.425  1.000 86.510  0 540  ARG   A HD2  1 c 1 
ATOM   7621  H  HD3  . ARG   A  1  485 ? -1.718  25.769  -3.565  1.000 86.861  0 540  ARG   A HD3  1 c 1 
ATOM   7622  H  HE   . ARG   A  1  485 ? -0.383  25.934  -1.144  1.000 78.045  0 540  ARG   A HE   1 c 1 
ATOM   7623  H  HH11 . ARG   A  1  485 ? -2.517  27.848  -2.702  1.000 74.185  0 540  ARG   A HH11 1 c 1 
ATOM   7624  H  HH12 . ARG   A  1  485 ? -3.745  27.459  -1.880  1.000 73.848  0 540  ARG   A HH12 1 c 1 
ATOM   7625  H  HH21 . ARG   A  1  485 ? -3.048  27.148  0.402   1.000 74.328  0 540  ARG   A HH21 1 c 1 
ATOM   7626  H  HH22 . ARG   A  1  485 ? -1.901  26.168  0.620   1.000 73.751  0 540  ARG   A HH22 1 c 1 
ATOM   7627  N  N    . PRO   A  1  486 ? -0.889  19.839  -4.941  1.000 22.543  0 541  PRO   A N    1 ? 1 
ATOM   7628  C  CA   . PRO   A  1  486 ? -0.944  18.910  -6.061  1.000 28.384  0 541  PRO   A CA   1 ? 1 
ATOM   7629  C  C    . PRO   A  1  486 ? -1.511  19.617  -7.290  1.000 24.913  0 541  PRO   A C    1 ? 1 
ATOM   7630  O  O    . PRO   A  1  486 ? -2.404  20.445  -7.164  1.000 28.958  0 541  PRO   A O    1 ? 1 
ATOM   7631  C  CB   . PRO   A  1  486 ? -1.842  17.795  -5.510  1.000 27.933  0 541  PRO   A CB   1 ? 1 
ATOM   7632  C  CG   . PRO   A  1  486 ? -2.681  18.450  -4.498  1.000 24.057  0 541  PRO   A CG   1 ? 1 
ATOM   7633  C  CD   . PRO   A  1  486 ? -1.825  19.482  -3.857  1.000 26.646  0 541  PRO   A CD   1 ? 1 
ATOM   7634  H  HA   . PRO   A  1  486 ? -0.040  18.553  -6.247  1.000 26.193  0 541  PRO   A HA   1 c 1 
ATOM   7635  H  HB2  . PRO   A  1  486 ? -2.395  17.409  -6.222  1.000 26.857  0 541  PRO   A HB2  1 c 1 
ATOM   7636  H  HB3  . PRO   A  1  486 ? -1.305  17.081  -5.106  1.000 26.580  0 541  PRO   A HB3  1 c 1 
ATOM   7637  H  HG2  . PRO   A  1  486 ? -3.463  18.864  -4.917  1.000 25.830  0 541  PRO   A HG2  1 c 1 
ATOM   7638  H  HG3  . PRO   A  1  486 ? -2.990  17.800  -3.835  1.000 25.189  0 541  PRO   A HG3  1 c 1 
ATOM   7639  H  HD2  . PRO   A  1  486 ? -2.354  20.252  -3.578  1.000 25.437  0 541  PRO   A HD2  1 c 1 
ATOM   7640  H  HD3  . PRO   A  1  486 ? -1.351  19.121  -3.086  1.000 24.806  0 541  PRO   A HD3  1 c 1 
ATOM   7641  N  N    . THR   A  1  487 ? -0.955  19.313  -8.458  1.000 25.499  0 542  THR   A N    1 ? 1 
ATOM   7642  C  CA   . THR   A  1  487 ? -1.490  19.822  -9.711  1.000 31.121  0 542  THR   A CA   1 ? 1 
ATOM   7643  C  C    . THR   A  1  487 ? -1.737  18.614  -10.611 1.000 27.167  0 542  THR   A C    1 ? 1 
ATOM   7644  O  O    . THR   A  1  487 ? -0.964  17.659  -10.591 1.000 27.320  0 542  THR   A O    1 ? 1 
ATOM   7645  C  CB   . THR   A  1  487 ? -0.542  20.841  -10.351 1.000 33.316  0 542  THR   A CB   1 ? 1 
ATOM   7646  O  OG1  . THR   A  1  487 ? 0.613   20.127  -10.666 1.000 42.904  0 542  THR   A OG1  1 ? 1 
ATOM   7647  C  CG2  . THR   A  1  487 ? -0.183  21.994  -9.437  1.000 31.024  0 542  THR   A CG2  1 ? 1 
ATOM   7648  H  H    . THR   A  1  487 ? -0.218  18.773  -8.480  1.000 26.235  0 542  THR   A H    1 c 1 
ATOM   7649  H  HA   . THR   A  1  487 ? -2.352  20.262  -9.528  1.000 29.684  0 542  THR   A HA   1 c 1 
ATOM   7650  H  HB   . THR   A  1  487 ? -0.953  21.189  -11.178 1.000 34.488  0 542  THR   A HB   1 c 1 
ATOM   7651  H  HG1  . THR   A  1  487 ? 0.953   19.804  -9.916  0.000 32.710  0 542  THR   A HG1  1 c 1 
ATOM   7652  H  HG21 . THR   A  1  487 ? 0.553   22.500  -9.825  1.000 32.076  0 542  THR   A HG21 1 c 1 
ATOM   7653  H  HG22 . THR   A  1  487 ? 0.083   21.652  -8.566  1.000 31.442  0 542  THR   A HG22 1 c 1 
ATOM   7654  H  HG23 . THR   A  1  487 ? -0.956  22.577  -9.331  1.000 32.010  0 542  THR   A HG23 1 c 1 
ATOM   7655  N  N    . MET   A  1  488 ? -2.839  18.667  -11.369 1.000 26.155  0 543  MET   A N    1 ? 1 
ATOM   7656  C  CA   . MET   A  1  488 ? -3.293  17.560  -12.189 1.000 26.444  0 543  MET   A CA   1 ? 1 
ATOM   7657  C  C    . MET   A  1  488 ? -2.388  17.482  -13.411 1.000 28.028  0 543  MET   A C    1 ? 1 
ATOM   7658  O  O    . MET   A  1  488 ? -2.140  18.489  -14.058 1.000 28.604  0 543  MET   A O    1 ? 1 
ATOM   7659  C  CB   . MET   A  1  488 ? -4.713  17.838  -12.597 1.000 24.730  0 543  MET   A CB   1 ? 1 
ATOM   7660  C  CG   . MET   A  1  488 ? -5.350  16.770  -13.364 1.000 39.106  0 543  MET   A CG   1 ? 1 
ATOM   7661  S  SD   . MET   A  1  488 ? -7.035  17.261  -13.815 1.000 39.507  0 543  MET   A SD   1 ? 1 
ATOM   7662  C  CE   . MET   A  1  488 ? -7.830  17.316  -12.299 1.000 40.564  0 543  MET   A CE   1 ? 1 
ATOM   7663  H  H    . MET   A  1  488 ? -3.328  19.439  -11.376 1.000 26.932  0 543  MET   A H    1 c 1 
ATOM   7664  H  HA   . MET   A  1  488 ? -3.236  16.728  -11.673 1.000 25.832  0 543  MET   A HA   1 c 1 
ATOM   7665  H  HB2  . MET   A  1  488 ? -5.237  18.002  -11.789 1.000 27.982  0 543  MET   A HB2  1 c 1 
ATOM   7666  H  HB3  . MET   A  1  488 ? -4.728  18.659  -13.129 1.000 28.412  0 543  MET   A HB3  1 c 1 
ATOM   7667  H  HG2  . MET   A  1  488 ? -4.835  16.592  -14.179 1.000 34.465  0 543  MET   A HG2  1 c 1 
ATOM   7668  H  HG3  . MET   A  1  488 ? -5.381  15.948  -12.829 1.000 34.043  0 543  MET   A HG3  1 c 1 
ATOM   7669  H  HE1  . MET   A  1  488 ? -7.677  16.489  -11.825 1.000 39.711  0 543  MET   A HE1  1 c 1 
ATOM   7670  H  HE2  . MET   A  1  488 ? -7.485  18.053  -11.781 1.000 40.065  0 543  MET   A HE2  1 c 1 
ATOM   7671  H  HE3  . MET   A  1  488 ? -8.777  17.437  -12.437 1.000 40.308  0 543  MET   A HE3  1 c 1 
ATOM   7672  N  N    . PRO   A  1  489 ? -1.856  16.305  -13.784 1.000 27.683  0 544  PRO   A N    1 ? 1 
ATOM   7673  C  CA   . PRO   A  1  489 ? -0.952  16.233  -14.938 1.000 26.776  0 544  PRO   A CA   1 ? 1 
ATOM   7674  C  C    . PRO   A  1  489 ? -1.596  16.642  -16.266 1.000 26.451  0 544  PRO   A C    1 ? 1 
ATOM   7675  O  O    . PRO   A  1  489 ? -2.796  16.503  -16.490 1.000 22.074  0 544  PRO   A O    1 ? 1 
ATOM   7676  C  CB   . PRO   A  1  489 ? -0.509  14.764  -14.932 1.000 27.969  0 544  PRO   A CB   1 ? 1 
ATOM   7677  C  CG   . PRO   A  1  489 ? -1.561  14.044  -14.125 1.000 28.548  0 544  PRO   A CG   1 ? 1 
ATOM   7678  C  CD   . PRO   A  1  489 ? -2.103  15.010  -13.140 1.000 27.881  0 544  PRO   A CD   1 ? 1 
ATOM   7679  H  HA   . PRO   A  1  489 ? -0.164  16.806  -14.761 1.000 27.286  0 544  PRO   A HA   1 c 1 
ATOM   7680  H  HB2  . PRO   A  1  489 ? -0.466  14.406  -15.845 1.000 27.958  0 544  PRO   A HB2  1 c 1 
ATOM   7681  H  HB3  . PRO   A  1  489 ? 0.374   14.667  -14.515 1.000 27.677  0 544  PRO   A HB3  1 c 1 
ATOM   7682  H  HG2  . PRO   A  1  489 ? -2.276  13.720  -14.710 1.000 28.226  0 544  PRO   A HG2  1 c 1 
ATOM   7683  H  HG3  . PRO   A  1  489 ? -1.169  13.274  -13.664 1.000 27.798  0 544  PRO   A HG3  1 c 1 
ATOM   7684  H  HD2  . PRO   A  1  489 ? -3.056  14.865  -12.994 1.000 27.782  0 544  PRO   A HD2  1 c 1 
ATOM   7685  H  HD3  . PRO   A  1  489 ? -1.635  14.946  -12.287 1.000 27.606  0 544  PRO   A HD3  1 c 1 
ATOM   7686  N  N    . ASP   A  1  490 ? -0.770  17.166  -17.161 1.000 28.220  0 545  ASP   A N    1 ? 1 
ATOM   7687  C  CA   . ASP   A  1  490 ? -1.229  17.522  -18.486 1.000 26.776  0 545  ASP   A CA   1 ? 1 
ATOM   7688  C  C    . ASP   A  1  490 ? -1.370  16.253  -19.313 1.000 22.523  0 545  ASP   A C    1 ? 1 
ATOM   7689  O  O    . ASP   A  1  490 ? -0.510  15.384  -19.242 1.000 25.640  0 545  ASP   A O    1 ? 1 
ATOM   7690  C  CB   . ASP   A  1  490 ? -0.222  18.450  -19.135 1.000 29.455  0 545  ASP   A CB   1 ? 1 
ATOM   7691  C  CG   . ASP   A  1  490 ? -0.323  19.862  -18.656 1.000 42.513  0 545  ASP   A CG   1 ? 1 
ATOM   7692  O  OD1  . ASP   A  1  490 ? -1.339  20.192  -17.995 1.000 45.752  0 545  ASP   A OD1  1 ? 1 
ATOM   7693  O  OD2  . ASP   A  1  490 ? 0.604   20.649  -18.948 1.000 53.032  0 545  ASP   A OD2  1 ? 1 
ATOM   7694  H  H    . ASP   A  1  490 ? 0.106   17.304  -16.942 1.000 27.461  0 545  ASP   A H    1 c 1 
ATOM   7695  H  HA   . ASP   A  1  490 ? -2.104  17.972  -18.419 1.000 26.876  0 545  ASP   A HA   1 c 1 
ATOM   7696  H  HB2  . ASP   A  1  490 ? 0.683   18.124  -18.954 1.000 31.141  0 545  ASP   A HB2  1 c 1 
ATOM   7697  H  HB3  . ASP   A  1  490 ? -0.360  18.444  -20.105 1.000 31.645  0 545  ASP   A HB3  1 c 1 
ATOM   7698  N  N    . GLU   A  1  491 ? -2.431  16.187  -20.118 1.000 23.729  0 546  GLU   A N    1 ? 1 
ATOM   7699  C  CA   . GLU   A  1  491 ? -2.623  15.087  -21.041 1.000 25.740  0 546  GLU   A CA   1 ? 1 
ATOM   7700  C  C    . GLU   A  1  491 ? -1.541  15.126  -22.113 1.000 24.777  0 546  GLU   A C    1 ? 1 
ATOM   7701  O  O    . GLU   A  1  491 ? -1.317  16.179  -22.699 1.000 25.513  0 546  GLU   A O    1 ? 1 
ATOM   7702  C  CB   . GLU   A  1  491 ? -4.026  15.133  -21.707 1.000 29.117  0 546  GLU   A CB   1 ? 1 
ATOM   7703  C  CG   . GLU   A  1  491 ? -4.185  14.069  -22.790 1.000 30.132  0 546  GLU   A CG   1 ? 1 
ATOM   7704  C  CD   . GLU   A  1  491 ? -5.605  13.629  -23.113 1.000 53.655  0 546  GLU   A CD   1 ? 1 
ATOM   7705  O  OE1  . GLU   A  1  491 ? -6.407  14.553  -23.386 1.000 34.303  0 546  GLU   A OE1  1 ? 1 
ATOM   7706  O  OE2  . GLU   A  1  491 ? -5.905  12.394  -23.108 1.000 32.343  0 546  GLU   A OE2  1 ? 1 
ATOM   7707  H  H    . GLU   A  1  491 ? -3.058  16.852  -20.091 1.000 24.245  0 546  GLU   A H    1 c 1 
ATOM   7708  H  HA   . GLU   A  1  491 ? -2.540  14.245  -20.538 1.000 25.030  0 546  GLU   A HA   1 c 1 
ATOM   7709  H  HB2  . GLU   A  1  491 ? -4.709  14.998  -21.018 1.000 28.306  0 546  GLU   A HB2  1 c 1 
ATOM   7710  H  HB3  . GLU   A  1  491 ? -4.161  16.019  -22.103 1.000 29.054  0 546  GLU   A HB3  1 c 1 
ATOM   7711  H  HG2  . GLU   A  1  491 ? -3.780  14.404  -23.618 1.000 34.288  0 546  GLU   A HG2  1 c 1 
ATOM   7712  H  HG3  . GLU   A  1  491 ? -3.678  13.273  -22.521 1.000 33.328  0 546  GLU   A HG3  1 c 1 
ATOM   7713  N  N    . VAL   A  1  492 ? -0.919  13.963  -22.369 1.000 23.166  0 547  VAL   A N    1 ? 1 
ATOM   7714  C  CA   . VAL   A  1  492 ? 0.121   13.808  -23.377 1.000 22.703  0 547  VAL   A CA   1 ? 1 
ATOM   7715  C  C    . VAL   A  1  492 ? -0.427  13.511  -24.770 1.000 26.678  0 547  VAL   A C    1 ? 1 
ATOM   7716  O  O    . VAL   A  1  492 ? -0.049  14.132  -25.747 1.000 25.347  0 547  VAL   A O    1 ? 1 
ATOM   7717  C  CB   . VAL   A  1  492 ? 1.075   12.719  -22.914 1.000 21.032  0 547  VAL   A CB   1 ? 1 
ATOM   7718  C  CG1  . VAL   A  1  492 ? 2.147   12.422  -23.974 1.000 24.621  0 547  VAL   A CG1  1 ? 1 
ATOM   7719  C  CG2  . VAL   A  1  492 ? 1.721   13.097  -21.575 1.000 21.246  0 547  VAL   A CG2  1 ? 1 
ATOM   7720  H  H    . VAL   A  1  492 ? -1.162  13.225  -21.887 1.000 22.849  0 547  VAL   A H    1 c 1 
ATOM   7721  H  HA   . VAL   A  1  492 ? 0.620   14.644  -23.424 1.000 23.534  0 547  VAL   A HA   1 c 1 
ATOM   7722  H  HB   . VAL   A  1  492 ? 0.546   11.895  -22.776 1.000 21.584  0 547  VAL   A HB   1 c 1 
ATOM   7723  H  HG11 . VAL   A  1  492 ? 2.529   13.258  -24.293 1.000 24.044  0 547  VAL   A HG11 1 c 1 
ATOM   7724  H  HG12 . VAL   A  1  492 ? 1.745   11.943  -24.720 1.000 23.802  0 547  VAL   A HG12 1 c 1 
ATOM   7725  H  HG13 . VAL   A  1  492 ? 2.849   11.874  -23.581 1.000 23.362  0 547  VAL   A HG13 1 c 1 
ATOM   7726  H  HG21 . VAL   A  1  492 ? 2.386   12.428  -21.334 1.000 20.849  0 547  VAL   A HG21 1 c 1 
ATOM   7727  H  HG22 . VAL   A  1  492 ? 1.039   13.137  -20.882 1.000 20.759  0 547  VAL   A HG22 1 c 1 
ATOM   7728  H  HG23 . VAL   A  1  492 ? 2.151   13.966  -21.655 1.000 21.394  0 547  VAL   A HG23 1 c 1 
ATOM   7729  N  N    . SER   A  1  493 ? -1.359  12.572  -24.870 1.000 23.757  0 548  SER   A N    1 ? 1 
ATOM   7730  C  CA   . SER   A  1  493 ? -1.932  12.260  -26.164 1.000 26.971  0 548  SER   A CA   1 ? 1 
ATOM   7731  C  C    . SER   A  1  493 ? -3.385  12.695  -26.199 1.000 22.699  0 548  SER   A C    1 ? 1 
ATOM   7732  O  O    . SER   A  1  493 ? -4.181  12.262  -25.375 1.000 25.558  0 548  SER   A O    1 ? 1 
ATOM   7733  C  CB   . SER   A  1  493 ? -1.827  10.769  -26.440 1.000 27.394  0 548  SER   A CB   1 ? 1 
ATOM   7734  O  OG   . SER   A  1  493 ? -0.468  10.378  -26.472 1.000 24.829  0 548  SER   A OG   1 ? 1 
ATOM   7735  H  H    . SER   A  1  493 ? -1.641  12.117  -24.130 1.000 24.450  0 548  SER   A H    1 c 1 
ATOM   7736  H  HA   . SER   A  1  493 ? -1.430  12.752  -26.866 1.000 26.237  0 548  SER   A HA   1 c 1 
ATOM   7737  H  HB2  . SER   A  1  493 ? -2.299  10.270  -25.736 1.000 26.137  0 548  SER   A HB2  1 c 1 
ATOM   7738  H  HB3  . SER   A  1  493 ? -2.251  10.564  -27.304 1.000 26.961  0 548  SER   A HB3  1 c 1 
ATOM   7739  H  HG   . SER   A  1  493 ? -0.231  10.159  -25.685 0.000 13.450  0 548  SER   A HG   1 c 1 
ATOM   7740  N  N    . ARG   A  1  494 ? -3.710  13.510  -27.199 1.000 25.871  0 549  ARG   A N    1 ? 1 
ATOM   7741  C  CA   . ARG   A  1  494 ? -5.078  13.890  -27.507 1.000 31.733  0 549  ARG   A CA   1 ? 1 
ATOM   7742  C  C    . ARG   A  1  494 ? -5.739  12.766  -28.302 1.000 30.170  0 549  ARG   A C    1 ? 1 
ATOM   7743  O  O    . ARG   A  1  494 ? -5.097  12.111  -29.129 1.000 25.578  0 549  ARG   A O    1 ? 1 
ATOM   7744  C  CB   . ARG   A  1  494 ? -5.109  15.203  -28.309 1.000 33.227  0 549  ARG   A CB   1 ? 1 
ATOM   7745  C  CG   . ARG   A  1  494 ? -4.755  16.460  -27.466 1.000 51.255  0 549  ARG   A CG   1 ? 1 
ATOM   7746  C  CD   . ARG   A  1  494 ? -5.889  16.901  -26.547 1.000 73.737  0 549  ARG   A CD   1 ? 1 
ATOM   7747  N  NE   . ARG   A  1  494 ? -7.116  17.155  -27.299 1.000 108.411 0 549  ARG   A NE   1 ? 1 
ATOM   7748  C  CZ   . ARG   A  1  494 ? -8.301  17.411  -26.759 1.000 89.384  0 549  ARG   A CZ   1 ? 1 
ATOM   7749  N  NH1  . ARG   A  1  494 ? -8.426  17.714  -25.478 1.000 90.455  0 549  ARG   A NH1  1 ? 1 
ATOM   7750  N  NH2  . ARG   A  1  494 ? -9.389  17.355  -27.523 1.000 78.350  0 549  ARG   A NH2  1 ? 1 
ATOM   7751  H  H    . ARG   A  1  494 ? -3.041  13.852  -27.719 1.000 26.748  0 549  ARG   A H    1 c 1 
ATOM   7752  H  HA   . ARG   A  1  494 ? -5.564  14.018  -26.662 1.000 30.077  0 549  ARG   A HA   1 c 1 
ATOM   7753  H  HB2  . ARG   A  1  494 ? -4.474  15.131  -29.051 1.000 36.572  0 549  ARG   A HB2  1 c 1 
ATOM   7754  H  HB3  . ARG   A  1  494 ? -6.004  15.315  -28.690 1.000 36.983  0 549  ARG   A HB3  1 c 1 
ATOM   7755  H  HG2  . ARG   A  1  494 ? -3.962  16.267  -26.920 1.000 49.370  0 549  ARG   A HG2  1 c 1 
ATOM   7756  H  HG3  . ARG   A  1  494 ? -4.531  17.199  -28.070 1.000 50.325  0 549  ARG   A HG3  1 c 1 
ATOM   7757  H  HD2  . ARG   A  1  494 ? -6.056  16.204  -25.878 1.000 72.581  0 549  ARG   A HD2  1 c 1 
ATOM   7758  H  HD3  . ARG   A  1  494 ? -5.624  17.719  -26.073 1.000 73.690  0 549  ARG   A HD3  1 c 1 
ATOM   7759  H  HE   . ARG   A  1  494 ? -7.065  17.156  -28.169 1.000 92.508  0 549  ARG   A HE   1 c 1 
ATOM   7760  H  HH11 . ARG   A  1  494 ? -7.826  18.230  -25.087 1.000 89.815  0 549  ARG   A HH11 1 c 1 
ATOM   7761  H  HH12 . ARG   A  1  494 ? -9.111  17.400  -25.018 1.000 89.724  0 549  ARG   A HH12 1 c 1 
ATOM   7762  H  HH21 . ARG   A  1  494 ? -10.145 17.698  -27.233 1.000 81.958  0 549  ARG   A HH21 1 c 1 
ATOM   7763  H  HH22 . ARG   A  1  494 ? -9.350  16.976  -28.316 1.000 82.220  0 549  ARG   A HH22 1 c 1 
ATOM   7764  N  N    . PRO   A  1  495 ? -7.042  12.504  -28.074 1.000 30.708  0 550  PRO   A N    1 ? 1 
ATOM   7765  C  CA   . PRO   A  1  495 ? -7.779  11.554  -28.909 1.000 31.021  0 550  PRO   A CA   1 ? 1 
ATOM   7766  C  C    . PRO   A  1  495 ? -8.148  12.098  -30.286 1.000 36.243  0 550  PRO   A C    1 ? 1 
ATOM   7767  O  O    . PRO   A  1  495 ? -8.302  13.305  -30.464 1.000 37.866  0 550  PRO   A O    1 ? 1 
ATOM   7768  C  CB   . PRO   A  1  495 ? -9.034  11.298  -28.101 1.000 35.110  0 550  PRO   A CB   1 ? 1 
ATOM   7769  C  CG   . PRO   A  1  495 ? -9.235  12.543  -27.296 1.000 34.003  0 550  PRO   A CG   1 ? 1 
ATOM   7770  C  CD   . PRO   A  1  495 ? -7.867  13.099  -27.013 1.000 30.108  0 550  PRO   A CD   1 ? 1 
ATOM   7771  H  HA   . PRO   A  1  495 ? -7.262  10.715  -28.994 1.000 32.167  0 550  PRO   A HA   1 c 1 
ATOM   7772  H  HB2  . PRO   A  1  495 ? -9.798  11.141  -28.693 1.000 34.136  0 550  PRO   A HB2  1 c 1 
ATOM   7773  H  HB3  . PRO   A  1  495 ? -8.923  10.521  -27.518 1.000 33.238  0 550  PRO   A HB3  1 c 1 
ATOM   7774  H  HG2  . PRO   A  1  495 ? -9.769  13.192  -27.798 1.000 33.813  0 550  PRO   A HG2  1 c 1 
ATOM   7775  H  HG3  . PRO   A  1  495 ? -9.700  12.338  -26.460 1.000 32.932  0 550  PRO   A HG3  1 c 1 
ATOM   7776  H  HD2  . PRO   A  1  495 ? -7.865  14.072  -27.071 1.000 31.325  0 550  PRO   A HD2  1 c 1 
ATOM   7777  H  HD3  . PRO   A  1  495 ? -7.552  12.832  -26.130 1.000 30.497  0 550  PRO   A HD3  1 c 1 
ATOM   7778  N  N    . ASN   A  1  496 ? -8.268  11.187  -31.258 1.000 43.202  0 551  ASN   A N    1 ? 1 
ATOM   7779  C  CA   . ASN   A  1  496 ? -9.079  11.410  -32.449 1.000 37.995  0 551  ASN   A CA   1 ? 1 
ATOM   7780  C  C    . ASN   A  1  496 ? -10.548 11.126  -32.135 1.000 41.771  0 551  ASN   A C    1 ? 1 
ATOM   7781  O  O    . ASN   A  1  496 ? -10.864 10.294  -31.276 1.000 33.115  0 551  ASN   A O    1 ? 1 
ATOM   7782  C  CB   . ASN   A  1  496 ? -8.624  10.498  -33.552 1.000 41.056  0 551  ASN   A CB   1 ? 1 
ATOM   7783  C  CG   . ASN   A  1  496 ? -7.232  10.757  -33.983 1.000 51.415  0 551  ASN   A CG   1 ? 1 
ATOM   7784  O  OD1  . ASN   A  1  496 ? -6.976  11.750  -34.678 1.000 78.593  0 551  ASN   A OD1  1 ? 1 
ATOM   7785  N  ND2  . ASN   A  1  496 ? -6.302  9.864   -33.621 1.000 62.387  0 551  ASN   A ND2  1 ? 1 
ATOM   7786  H  H    . ASN   A  1  496 ? -7.826  10.391  -31.174 1.000 39.663  0 551  ASN   A H    1 c 1 
ATOM   7787  H  HA   . ASN   A  1  496 ? -8.975  12.344  -32.747 1.000 40.654  0 551  ASN   A HA   1 c 1 
ATOM   7788  H  HB2  . ASN   A  1  496 ? -8.698  9.572   -33.245 1.000 42.131  0 551  ASN   A HB2  1 c 1 
ATOM   7789  H  HB3  . ASN   A  1  496 ? -9.220  10.610  -34.320 1.000 43.023  0 551  ASN   A HB3  1 c 1 
ATOM   7790  H  HD21 . ASN   A  1  496 ? -6.509  9.206   -33.067 1.000 57.685  0 551  ASN   A HD21 1 c 1 
ATOM   7791  H  HD22 . ASN   A  1  496 ? -5.479  9.932   -33.936 1.000 58.681  0 551  ASN   A HD22 1 c 1 
ATOM   7792  N  N    . TYR   A  1  497 ? -11.437 11.788  -32.876 1.000 38.076  0 552  TYR   A N    1 ? 1 
ATOM   7793  C  CA   . TYR   A  1  497 ? -12.874 11.589  -32.777 1.000 41.348  0 552  TYR   A CA   1 ? 1 
ATOM   7794  C  C    . TYR   A  1  497 ? -13.445 11.194  -34.140 1.000 56.535  0 552  TYR   A C    1 ? 1 
ATOM   7795  O  O    . TYR   A  1  497 ? -14.125 11.980  -34.796 1.000 46.468  0 552  TYR   A O    1 ? 1 
ATOM   7796  C  CB   . TYR   A  1  497 ? -13.544 12.873  -32.258 1.000 41.567  0 552  TYR   A CB   1 ? 1 
ATOM   7797  C  CG   . TYR   A  1  497 ? -13.167 13.272  -30.841 1.000 35.159  0 552  TYR   A CG   1 ? 1 
ATOM   7798  C  CD1  . TYR   A  1  497 ? -12.021 14.012  -30.581 1.000 36.361  0 552  TYR   A CD1  1 ? 1 
ATOM   7799  C  CD2  . TYR   A  1  497 ? -13.980 12.955  -29.781 1.000 32.629  0 552  TYR   A CD2  1 ? 1 
ATOM   7800  C  CE1  . TYR   A  1  497 ? -11.700 14.419  -29.290 1.000 28.806  0 552  TYR   A CE1  1 ? 1 
ATOM   7801  C  CE2  . TYR   A  1  497 ? -13.667 13.349  -28.489 1.000 43.501  0 552  TYR   A CE2  1 ? 1 
ATOM   7802  C  CZ   . TYR   A  1  497 ? -12.514 14.064  -28.243 1.000 35.880  0 552  TYR   A CZ   1 ? 1 
ATOM   7803  O  OH   . TYR   A  1  497 ? -12.228 14.410  -26.935 1.000 46.107  0 552  TYR   A OH   1 ? 1 
ATOM   7804  H  H    . TYR   A  1  497 ? -11.129 12.400  -33.481 1.000 40.244  0 552  TYR   A H    1 c 1 
ATOM   7805  H  HA   . TYR   A  1  497 ? -13.056 10.859  -32.134 1.000 42.265  0 552  TYR   A HA   1 c 1 
ATOM   7806  H  HB2  . TYR   A  1  497 ? -13.309 13.608  -32.863 1.000 40.695  0 552  TYR   A HB2  1 c 1 
ATOM   7807  H  HB3  . TYR   A  1  497 ? -14.515 12.753  -32.302 1.000 40.394  0 552  TYR   A HB3  1 c 1 
ATOM   7808  H  HD1  . TYR   A  1  497 ? -11.457 14.257  -31.296 1.000 34.624  0 552  TYR   A HD1  1 c 1 
ATOM   7809  H  HD2  . TYR   A  1  497 ? -14.769 12.462  -29.934 1.000 35.553  0 552  TYR   A HD2  1 c 1 
ATOM   7810  H  HE1  . TYR   A  1  497 ? -10.905 14.901  -29.129 1.000 31.898  0 552  TYR   A HE1  1 c 1 
ATOM   7811  H  HE2  . TYR   A  1  497 ? -14.224 13.100  -27.772 1.000 38.217  0 552  TYR   A HE2  1 c 1 
ATOM   7812  H  HH   . TYR   A  1  497 ? -11.524 14.855  -26.755 0.000 31.990  0 552  TYR   A HH   1 c 1 
ATOM   7813  N  N    . PRO   A  1  498 ? -13.195 9.958   -34.620 1.000 47.835  0 553  PRO   A N    1 ? 1 
ATOM   7814  C  CA   . PRO   A  1  498 ? -13.595 9.583   -35.982 1.000 47.770  0 553  PRO   A CA   1 ? 1 
ATOM   7815  C  C    . PRO   A  1  498 ? -15.110 9.437   -36.140 1.000 46.295  0 553  PRO   A C    1 ? 1 
ATOM   7816  O  O    . PRO   A  1  498 ? -15.767 8.814   -35.307 1.000 46.016  0 553  PRO   A O    1 ? 1 
ATOM   7817  C  CB   . PRO   A  1  498 ? -12.877 8.240   -36.201 1.000 45.780  0 553  PRO   A CB   1 ? 1 
ATOM   7818  C  CG   . PRO   A  1  498 ? -12.816 7.638   -34.775 1.000 42.020  0 553  PRO   A CG   1 ? 1 
ATOM   7819  C  CD   . PRO   A  1  498 ? -12.568 8.859   -33.863 1.000 40.950  0 553  PRO   A CD   1 ? 1 
ATOM   7820  H  HA   . PRO   A  1  498 ? -13.246 10.252  -36.623 1.000 47.835  0 553  PRO   A HA   1 c 1 
ATOM   7821  H  HB2  . PRO   A  1  498 ? -13.385 7.660   -36.807 1.000 45.724  0 553  PRO   A HB2  1 c 1 
ATOM   7822  H  HB3  . PRO   A  1  498 ? -11.976 8.375   -36.565 1.000 45.553  0 553  PRO   A HB3  1 c 1 
ATOM   7823  H  HG2  . PRO   A  1  498 ? -13.658 7.196   -34.545 1.000 42.379  0 553  PRO   A HG2  1 c 1 
ATOM   7824  H  HG3  . PRO   A  1  498 ? -12.085 6.991   -34.699 1.000 42.096  0 553  PRO   A HG3  1 c 1 
ATOM   7825  H  HD2  . PRO   A  1  498 ? -12.992 8.742   -32.993 1.000 41.983  0 553  PRO   A HD2  1 c 1 
ATOM   7826  H  HD3  . PRO   A  1  498 ? -11.614 9.018   -33.736 1.000 42.201  0 553  PRO   A HD3  1 c 1 
ATOM   7827  N  N    . GLY   A  1  499 ? -15.663 10.032  -37.206 1.000 46.112  0 554  GLY   A N    1 ? 1 
ATOM   7828  C  CA   . GLY   A  1  499 ? -17.006 9.706   -37.658 1.000 45.496  0 554  GLY   A CA   1 ? 1 
ATOM   7829  C  C    . GLY   A  1  499 ? -16.995 8.471   -38.562 1.000 61.292  0 554  GLY   A C    1 ? 1 
ATOM   7830  O  O    . GLY   A  1  499 ? -16.084 7.647   -38.477 1.000 55.882  0 554  GLY   A O    1 ? 1 
ATOM   7831  H  H    . GLY   A  1  499 ? -15.190 10.669  -37.659 1.000 46.623  0 554  GLY   A H    1 c 1 
ATOM   7832  H  HA2  . GLY   A  1  499 ? -17.585 9.537   -36.873 1.000 48.330  0 554  GLY   A HA2  1 c 1 
ATOM   7833  H  HA3  . GLY   A  1  499 ? -17.376 10.477  -38.156 1.000 49.378  0 554  GLY   A HA3  1 c 1 
ATOM   7834  N  N    . ILE   A  1  500 ? -18.019 8.343   -39.420 1.000 52.952  0 555  ILE   A N    1 ? 1 
ATOM   7835  C  CA   . ILE   A  1  500 ? -18.098 7.246   -40.372 1.000 56.489  0 555  ILE   A CA   1 ? 1 
ATOM   7836  C  C    . ILE   A  1  500 ? -17.016 7.522   -41.413 1.000 58.304  0 555  ILE   A C    1 ? 1 
ATOM   7837  O  O    . ILE   A  1  500 ? -17.091 8.525   -42.116 1.000 58.196  0 555  ILE   A O    1 ? 1 
ATOM   7838  C  CB   . ILE   A  1  500 ? -19.523 7.116   -41.035 1.000 56.413  0 555  ILE   A CB   1 ? 1 
ATOM   7839  C  CG1  . ILE   A  1  500 ? -20.665 7.114   -40.009 1.000 53.632  0 555  ILE   A CG1  1 ? 1 
ATOM   7840  C  CG2  . ILE   A  1  500 ? -19.613 5.912   -41.933 1.000 58.347  0 555  ILE   A CG2  1 ? 1 
ATOM   7841  C  CD1  . ILE   A  1  500 ? -20.379 6.317   -38.734 1.000 52.192  0 555  ILE   A CD1  1 ? 1 
ATOM   7842  H  H    . ILE   A  1  500 ? -18.688 8.966   -39.411 1.000 55.882  0 555  ILE   A H    1 c 1 
ATOM   7843  H  HA   . ILE   A  1  500 ? -17.890 6.413   -39.911 1.000 55.267  0 555  ILE   A HA   1 c 1 
ATOM   7844  H  HB   . ILE   A  1  500 ? -19.650 7.914   -41.605 1.000 57.028  0 555  ILE   A HB   1 c 1 
ATOM   7845  H  HG12 . ILE   A  1  500 ? -20.858 8.043   -39.758 1.000 54.264  0 555  ILE   A HG12 1 c 1 
ATOM   7846  H  HG13 . ILE   A  1  500 ? -21.469 6.747   -40.433 1.000 54.652  0 555  ILE   A HG13 1 c 1 
ATOM   7847  H  HG21 . ILE   A  1  500 ? -19.399 5.111   -41.427 1.000 56.813  0 555  ILE   A HG21 1 c 1 
ATOM   7848  H  HG22 . ILE   A  1  500 ? -18.984 6.006   -42.670 1.000 58.092  0 555  ILE   A HG22 1 c 1 
ATOM   7849  H  HG23 . ILE   A  1  500 ? -20.515 5.837   -42.290 1.000 58.292  0 555  ILE   A HG23 1 c 1 
ATOM   7850  H  HD11 . ILE   A  1  500 ? -19.622 6.705   -38.264 1.000 51.725  0 555  ILE   A HD11 1 c 1 
ATOM   7851  H  HD12 . ILE   A  1  500 ? -20.177 5.396   -38.966 1.000 51.763  0 555  ILE   A HD12 1 c 1 
ATOM   7852  H  HD13 . ILE   A  1  500 ? -21.161 6.338   -38.156 1.000 52.127  0 555  ILE   A HD13 1 c 1 
ATOM   7853  N  N    . MET   A  1  501 ? -16.012 6.640   -41.496 1.000 45.495  0 556  MET   A N    1 ? 1 
ATOM   7854  C  CA   . MET   A  1  501 ? -14.947 6.764   -42.482 1.000 57.514  0 556  MET   A CA   1 ? 1 
ATOM   7855  C  C    . MET   A  1  501 ? -15.054 5.657   -43.531 1.000 50.638  0 556  MET   A C    1 ? 1 
ATOM   7856  O  O    . MET   A  1  501 ? -15.112 5.930   -44.723 1.000 65.618  0 556  MET   A O    1 ? 1 
ATOM   7857  C  CB   . MET   A  1  501 ? -13.586 6.707   -41.781 1.000 55.887  0 556  MET   A CB   1 ? 1 
ATOM   7858  C  CG   . MET   A  1  501 ? -13.390 7.800   -40.709 1.000 93.783  0 556  MET   A CG   1 ? 1 
ATOM   7859  S  SD   . MET   A  1  501 ? -13.600 9.534   -41.263 1.000 81.611  0 556  MET   A SD   1 ? 1 
ATOM   7860  C  CE   . MET   A  1  501 ? -12.925 10.411  -39.792 1.000 64.102  0 556  MET   A CE   1 ? 1 
ATOM   7861  H  H    . MET   A  1  501 ? -15.986 5.939   -40.911 1.000 50.050  0 556  MET   A H    1 c 1 
ATOM   7862  H  HA   . MET   A  1  501 ? -15.042 7.632   -42.937 1.000 54.104  0 556  MET   A HA   1 c 1 
ATOM   7863  H  HB2  . MET   A  1  501 ? -13.489 5.832   -41.361 1.000 62.304  0 556  MET   A HB2  1 c 1 
ATOM   7864  H  HB3  . MET   A  1  501 ? -12.883 6.794   -42.455 1.000 63.095  0 556  MET   A HB3  1 c 1 
ATOM   7865  H  HG2  . MET   A  1  501 ? -14.023 7.634   -39.979 1.000 78.563  0 556  MET   A HG2  1 c 1 
ATOM   7866  H  HG3  . MET   A  1  501 ? -12.487 7.708   -40.336 1.000 78.882  0 556  MET   A HG3  1 c 1 
ATOM   7867  H  HE1  . MET   A  1  501 ? -13.428 10.158  -39.009 1.000 66.833  0 556  MET   A HE1  1 c 1 
ATOM   7868  H  HE2  . MET   A  1  501 ? -11.998 10.170  -39.671 1.000 67.280  0 556  MET   A HE2  1 c 1 
ATOM   7869  H  HE3  . MET   A  1  501 ? -12.994 11.364  -39.926 1.000 67.999  0 556  MET   A HE3  1 c 1 
ATOM   7870  N  N    . TYR   A  1  502 ? -15.117 4.402   -43.076 1.000 64.751  0 557  TYR   A N    1 ? 1 
ATOM   7871  C  CA   . TYR   A  1  502 ? -15.062 3.250   -43.960 1.000 62.632  0 557  TYR   A CA   1 ? 1 
ATOM   7872  C  C    . TYR   A  1  502 ? -16.441 2.657   -44.231 1.000 72.088  0 557  TYR   A C    1 ? 1 
ATOM   7873  O  O    . TYR   A  1  502 ? -17.431 3.072   -43.632 1.000 71.929  0 557  TYR   A O    1 ? 1 
ATOM   7874  C  CB   . TYR   A  1  502 ? -14.115 2.206   -43.364 1.000 56.812  0 557  TYR   A CB   1 ? 1 
ATOM   7875  C  CG   . TYR   A  1  502 ? -12.704 2.732   -43.233 1.000 68.418  0 557  TYR   A CG   1 ? 1 
ATOM   7876  C  CD1  . TYR   A  1  502 ? -12.304 3.442   -42.106 1.000 69.597  0 557  TYR   A CD1  1 ? 1 
ATOM   7877  C  CD2  . TYR   A  1  502 ? -11.785 2.571   -44.258 1.000 70.758  0 557  TYR   A CD2  1 ? 1 
ATOM   7878  C  CE1  . TYR   A  1  502 ? -11.017 3.956   -41.996 1.000 72.925  0 557  TYR   A CE1  1 ? 1 
ATOM   7879  C  CE2  . TYR   A  1  502 ? -10.493 3.070   -44.155 1.000 69.339  0 557  TYR   A CE2  1 ? 1 
ATOM   7880  C  CZ   . TYR   A  1  502 ? -10.110 3.761   -43.021 1.000 71.906  0 557  TYR   A CZ   1 ? 1 
ATOM   7881  O  OH   . TYR   A  1  502 ? -8.827  4.245   -42.920 1.000 57.949  0 557  TYR   A OH   1 ? 1 
ATOM   7882  H  H    . TYR   A  1  502 ? -15.192 4.258   -42.176 1.000 59.246  0 557  TYR   A H    1 c 1 
ATOM   7883  H  HA   . TYR   A  1  502 ? -14.683 3.543   -44.828 1.000 64.170  0 557  TYR   A HA   1 c 1 
ATOM   7884  H  HB2  . TYR   A  1  502 ? -14.447 1.943   -42.480 1.000 59.839  0 557  TYR   A HB2  1 c 1 
ATOM   7885  H  HB3  . TYR   A  1  502 ? -14.113 1.412   -43.939 1.000 60.891  0 557  TYR   A HB3  1 c 1 
ATOM   7886  H  HD1  . TYR   A  1  502 ? -12.917 3.577   -41.402 1.000 69.376  0 557  TYR   A HD1  1 c 1 
ATOM   7887  H  HD2  . TYR   A  1  502 ? -12.036 2.099   -45.035 1.000 70.537  0 557  TYR   A HD2  1 c 1 
ATOM   7888  H  HE1  . TYR   A  1  502 ? -10.757 4.419   -41.217 1.000 70.986  0 557  TYR   A HE1  1 c 1 
ATOM   7889  H  HE2  . TYR   A  1  502 ? -9.877  2.936   -44.856 1.000 70.714  0 557  TYR   A HE2  1 c 1 
ATOM   7890  H  HH   . TYR   A  1  502 ? -8.575  4.681   -42.212 0.000 35.930  0 557  TYR   A HH   1 c 1 
ATOM   7891  N  N    . LEU   A  1  503 ? -16.482 1.708   -45.175 1.000 80.749  0 558  LEU   A N    1 ? 1 
ATOM   7892  C  CA   . LEU   A  1  503 ? -17.701 0.998   -45.529 1.000 79.800  0 558  LEU   A CA   1 ? 1 
ATOM   7893  C  C    . LEU   A  1  503 ? -17.555 -0.474  -45.153 1.000 75.973  0 558  LEU   A C    1 ? 1 
ATOM   7894  O  O    . LEU   A  1  503 ? -16.441 -0.978  -45.053 1.000 69.675  0 558  LEU   A O    1 ? 1 
ATOM   7895  C  CB   . LEU   A  1  503 ? -17.973 1.133   -47.031 1.000 103.487 0 558  LEU   A CB   1 ? 1 
ATOM   7896  C  CG   . LEU   A  1  503 ? -18.222 2.553   -47.531 1.000 136.031 0 558  LEU   A CG   1 ? 1 
ATOM   7897  C  CD1  . LEU   A  1  503 ? -18.208 2.614   -49.052 1.000 105.521 0 558  LEU   A CD1  1 ? 1 
ATOM   7898  C  CD2  . LEU   A  1  503 ? -19.539 3.103   -46.988 1.000 178.360 0 558  LEU   A CD2  1 ? 1 
ATOM   7899  H  H    . LEU   A  1  503 ? -15.713 1.500   -45.622 1.000 78.190  0 558  LEU   A H    1 c 1 
ATOM   7900  H  HA   . LEU   A  1  503 ? -18.452 1.381   -45.021 1.000 83.394  0 558  LEU   A HA   1 c 1 
ATOM   7901  H  HB2  . LEU   A  1  503 ? -17.208 0.764   -47.516 1.000 103.578 0 558  LEU   A HB2  1 c 1 
ATOM   7902  H  HB3  . LEU   A  1  503 ? -18.753 0.587   -47.253 1.000 103.747 0 558  LEU   A HB3  1 c 1 
ATOM   7903  H  HG   . LEU   A  1  503 ? -17.490 3.129   -47.197 1.000 128.321 0 558  LEU   A HG   1 c 1 
ATOM   7904  H  HD11 . LEU   A  1  503 ? -18.162 3.542   -49.339 1.000 114.204 0 558  LEU   A HD11 1 c 1 
ATOM   7905  H  HD12 . LEU   A  1  503 ? -19.021 2.207   -49.400 1.000 114.286 0 558  LEU   A HD12 1 c 1 
ATOM   7906  H  HD13 . LEU   A  1  503 ? -17.434 2.131   -49.390 1.000 113.758 0 558  LEU   A HD13 1 c 1 
ATOM   7907  H  HD21 . LEU   A  1  503 ? -19.476 3.206   -46.022 1.000 162.109 0 558  LEU   A HD21 1 c 1 
ATOM   7908  H  HD22 . LEU   A  1  503 ? -20.261 2.487   -47.201 1.000 164.364 0 558  LEU   A HD22 1 c 1 
ATOM   7909  H  HD23 . LEU   A  1  503 ? -19.722 3.969   -47.393 1.000 164.588 0 558  LEU   A HD23 1 c 1 
ATOM   7910  N  N    . GLN   A  1  504 ? -18.693 -1.142  -44.937 1.000 87.237  0 559  GLN   A N    1 ? 1 
ATOM   7911  C  CA   . GLN   A  1  504 ? -18.723 -2.553  -44.578 1.000 83.588  0 559  GLN   A CA   1 ? 1 
ATOM   7912  C  C    . GLN   A  1  504 ? -17.781 -3.372  -45.458 1.000 90.404  0 559  GLN   A C    1 ? 1 
ATOM   7913  O  O    . GLN   A  1  504 ? -17.022 -4.206  -44.968 1.000 64.903  0 559  GLN   A O    1 ? 1 
ATOM   7914  C  CB   . GLN   A  1  504 ? -20.144 -3.128  -44.755 1.000 104.574 0 559  GLN   A CB   1 ? 1 
ATOM   7915  C  CG   . GLN   A  1  504 ? -21.247 -2.481  -43.923 1.000 93.614  0 559  GLN   A CG   1 ? 1 
ATOM   7916  C  CD   . GLN   A  1  504 ? -21.130 -2.830  -42.473 1.000 88.812  0 559  GLN   A CD   1 ? 1 
ATOM   7917  O  OE1  . GLN   A  1  504 ? -21.054 -4.006  -42.106 1.000 83.571  0 559  GLN   A OE1  1 ? 1 
ATOM   7918  N  NE2  . GLN   A  1  504 ? -21.099 -1.817  -41.611 1.000 85.075  0 559  GLN   A NE2  1 ? 1 
ATOM   7919  H  H    . GLN   A  1  504 ? -19.486 -0.697  -45.027 1.000 84.237  0 559  GLN   A H    1 c 1 
ATOM   7920  H  HA   . GLN   A  1  504 ? -18.449 -2.647  -43.636 1.000 87.974  0 559  GLN   A HA   1 c 1 
ATOM   7921  H  HB2  . GLN   A  1  504 ? -20.385 -3.050  -45.702 1.000 97.540  0 559  GLN   A HB2  1 c 1 
ATOM   7922  H  HB3  . GLN   A  1  504 ? -20.112 -4.084  -44.542 1.000 96.591  0 559  GLN   A HB3  1 c 1 
ATOM   7923  H  HG2  . GLN   A  1  504 ? -21.205 -1.508  -44.026 1.000 94.884  0 559  GLN   A HG2  1 c 1 
ATOM   7924  H  HG3  . GLN   A  1  504 ? -22.120 -2.781  -44.255 1.000 95.505  0 559  GLN   A HG3  1 c 1 
ATOM   7925  H  HE21 . GLN   A  1  504 ? -21.433 -1.029  -41.839 1.000 86.473  0 559  GLN   A HE21 1 c 1 
ATOM   7926  H  HE22 . GLN   A  1  504 ? -20.747 -1.931  -40.807 1.000 85.375  0 559  GLN   A HE22 1 c 1 
ATOM   7927  N  N    . SER   A  1  505 ? -17.864 -3.118  -46.772 1.000 74.489  0 560  SER   A N    1 ? 1 
ATOM   7928  C  CA   . SER   A  1  505 ? -17.171 -3.889  -47.792 1.000 67.540  0 560  SER   A CA   1 ? 1 
ATOM   7929  C  C    . SER   A  1  505 ? -15.656 -3.929  -47.621 1.000 60.679  0 560  SER   A C    1 ? 1 
ATOM   7930  O  O    . SER   A  1  505 ? -15.009 -4.914  -47.960 1.000 72.526  0 560  SER   A O    1 ? 1 
ATOM   7931  C  CB   . SER   A  1  505 ? -17.478 -3.310  -49.167 1.000 60.093  0 560  SER   A CB   1 ? 1 
ATOM   7932  O  OG   . SER   A  1  505 ? -18.852 -2.988  -49.268 1.000 73.416  0 560  SER   A OG   1 ? 1 
ATOM   7933  H  H    . SER   A  1  505 ? -18.395 -2.426  -47.046 1.000 76.539  0 560  SER   A H    1 c 1 
ATOM   7934  H  HA   . SER   A  1  505 ? -17.513 -4.823  -47.759 1.000 65.945  0 560  SER   A HA   1 c 1 
ATOM   7935  H  HB2  . SER   A  1  505 ? -16.938 -2.500  -49.311 1.000 64.714  0 560  SER   A HB2  1 c 1 
ATOM   7936  H  HB3  . SER   A  1  505 ? -17.241 -3.967  -49.860 1.000 65.183  0 560  SER   A HB3  1 c 1 
ATOM   7937  H  HG   . SER   A  1  505 ? -18.972 -2.167  -49.007 0.000 48.000  0 560  SER   A HG   1 c 1 
ATOM   7938  N  N    . GLU   A  1  506 ? -15.097 -2.849  -47.083 1.000 66.885  0 561  GLU   A N    1 ? 1 
ATOM   7939  C  CA   . GLU   A  1  506 ? -13.657 -2.716  -46.970 1.000 62.949  0 561  GLU   A CA   1 ? 1 
ATOM   7940  C  C    . GLU   A  1  506 ? -13.091 -3.576  -45.838 1.000 73.220  0 561  GLU   A C    1 ? 1 
ATOM   7941  O  O    . GLU   A  1  506 ? -11.883 -3.568  -45.588 1.000 54.937  0 561  GLU   A O    1 ? 1 
ATOM   7942  C  CB   . GLU   A  1  506 ? -13.322 -1.232  -46.756 1.000 79.081  0 561  GLU   A CB   1 ? 1 
ATOM   7943  C  CG   . GLU   A  1  506 ? -14.263 -0.301  -47.514 1.000 78.452  0 561  GLU   A CG   1 ? 1 
ATOM   7944  C  CD   . GLU   A  1  506 ? -13.737 1.106   -47.737 1.000 93.194  0 561  GLU   A CD   1 ? 1 
ATOM   7945  O  OE1  . GLU   A  1  506 ? -12.567 1.246   -48.158 1.000 96.576  0 561  GLU   A OE1  1 ? 1 
ATOM   7946  O  OE2  . GLU   A  1  506 ? -14.505 2.071   -47.520 1.000 101.226 0 561  GLU   A OE2  1 ? 1 
ATOM   7947  H  H    . GLU   A  1  506 ? -15.631 -2.185  -46.755 1.000 64.793  0 561  GLU   A H    1 c 1 
ATOM   7948  H  HA   . GLU   A  1  506 ? -13.251 -3.009  -47.818 1.000 68.799  0 561  GLU   A HA   1 c 1 
ATOM   7949  H  HB2  . GLU   A  1  506 ? -13.373 -1.030  -45.798 1.000 73.865  0 561  GLU   A HB2  1 c 1 
ATOM   7950  H  HB3  . GLU   A  1  506 ? -12.402 -1.071  -47.052 1.000 74.811  0 561  GLU   A HB3  1 c 1 
ATOM   7951  H  HG2  . GLU   A  1  506 ? -14.463 -0.696  -48.389 1.000 82.323  0 561  GLU   A HG2  1 c 1 
ATOM   7952  H  HG3  . GLU   A  1  506 ? -15.107 -0.233  -47.023 1.000 81.490  0 561  GLU   A HG3  1 c 1 
ATOM   7953  N  N    . PHE   A  1  507 ? -13.966 -4.310  -45.141 1.000 58.719  0 562  PHE   A N    1 ? 1 
ATOM   7954  C  CA   . PHE   A  1  507 ? -13.548 -5.074  -43.979 1.000 66.807  0 562  PHE   A CA   1 ? 1 
ATOM   7955  C  C    . PHE   A  1  507 ? -13.492 -6.566  -44.275 1.000 54.349  0 562  PHE   A C    1 ? 1 
ATOM   7956  O  O    . PHE   A  1  507 ? -14.516 -7.212  -44.425 1.000 57.339  0 562  PHE   A O    1 ? 1 
ATOM   7957  C  CB   . PHE   A  1  507 ? -14.488 -4.810  -42.814 1.000 57.115  0 562  PHE   A CB   1 ? 1 
ATOM   7958  C  CG   . PHE   A  1  507 ? -14.272 -3.466  -42.171 1.000 58.364  0 562  PHE   A CG   1 ? 1 
ATOM   7959  C  CD1  . PHE   A  1  507 ? -13.329 -3.300  -41.166 1.000 48.068  0 562  PHE   A CD1  1 ? 1 
ATOM   7960  C  CD2  . PHE   A  1  507 ? -15.013 -2.368  -42.568 1.000 47.321  0 562  PHE   A CD2  1 ? 1 
ATOM   7961  C  CE1  . PHE   A  1  507 ? -13.139 -2.051  -40.582 1.000 40.803  0 562  PHE   A CE1  1 ? 1 
ATOM   7962  C  CE2  . PHE   A  1  507 ? -14.823 -1.130  -41.978 1.000 44.726  0 562  PHE   A CE2  1 ? 1 
ATOM   7963  C  CZ   . PHE   A  1  507 ? -13.899 -0.975  -40.992 1.000 39.316  0 562  PHE   A CZ   1 ? 1 
ATOM   7964  H  H    . PHE   A  1  507 ? -14.846 -4.331  -45.384 1.000 64.002  0 562  PHE   A H    1 c 1 
ATOM   7965  H  HA   . PHE   A  1  507 ? -12.640 -4.776  -43.716 1.000 60.339  0 562  PHE   A HA   1 c 1 
ATOM   7966  H  HB2  . PHE   A  1  507 ? -15.411 -4.868  -43.135 1.000 59.799  0 562  PHE   A HB2  1 c 1 
ATOM   7967  H  HB3  . PHE   A  1  507 ? -14.358 -5.511  -42.141 1.000 58.886  0 562  PHE   A HB3  1 c 1 
ATOM   7968  H  HD1  . PHE   A  1  507 ? -12.810 -4.036  -40.884 1.000 47.716  0 562  PHE   A HD1  1 c 1 
ATOM   7969  H  HD2  . PHE   A  1  507 ? -15.661 -2.468  -43.245 1.000 49.734  0 562  PHE   A HD2  1 c 1 
ATOM   7970  H  HE1  . PHE   A  1  507 ? -12.496 -1.942  -39.899 1.000 41.354  0 562  PHE   A HE1  1 c 1 
ATOM   7971  H  HE2  . PHE   A  1  507 ? -15.340 -0.392  -42.259 1.000 44.506  0 562  PHE   A HE2  1 c 1 
ATOM   7972  H  HZ   . PHE   A  1  507 ? -13.770 -0.129  -40.597 1.000 40.648  0 562  PHE   A HZ   1 c 1 
ATOM   7973  N  N    . ASP   A  1  508 ? -12.278 -7.107  -44.322 1.000 56.108  0 563  ASP   A N    1 ? 1 
ATOM   7974  C  CA   . ASP   A  1  508 ? -12.085 -8.540  -44.428 1.000 85.474  0 563  ASP   A CA   1 ? 1 
ATOM   7975  C  C    . ASP   A  1  508 ? -11.436 -9.003  -43.122 1.000 61.055  0 563  ASP   A C    1 ? 1 
ATOM   7976  O  O    . ASP   A  1  508 ? -10.244 -9.293  -43.083 1.000 60.828  0 563  ASP   A O    1 ? 1 
ATOM   7977  C  CB   . ASP   A  1  508 ? -11.269 -8.866  -45.709 1.000 94.958  0 563  ASP   A CB   1 ? 1 
ATOM   7978  C  CG   . ASP   A  1  508 ? -10.953 -10.331 -45.905 1.000 114.816 0 563  ASP   A CG   1 ? 1 
ATOM   7979  O  OD1  . ASP   A  1  508 ? -11.829 -11.166 -45.612 1.000 142.159 0 563  ASP   A OD1  1 ? 1 
ATOM   7980  O  OD2  . ASP   A  1  508 ? -9.829  -10.641 -46.359 1.000 86.131  0 563  ASP   A OD2  1 ? 1 
ATOM   7981  H  H    . ASP   A  1  508 ? -11.542 -6.566  -44.290 1.000 60.763  0 563  ASP   A H    1 c 1 
ATOM   7982  H  HA   . ASP   A  1  508 ? -12.966 -8.967  -44.509 1.000 74.805  0 563  ASP   A HA   1 c 1 
ATOM   7983  H  HB2  . ASP   A  1  508 ? -11.775 -8.559  -46.489 1.000 97.580  0 563  ASP   A HB2  1 c 1 
ATOM   7984  H  HB3  . ASP   A  1  508 ? -10.425 -8.375  -45.685 1.000 96.542  0 563  ASP   A HB3  1 c 1 
ATOM   7985  N  N    . LEU   A  1  509 ? -12.239 -9.089  -42.054 1.000 56.031  0 564  LEU   A N    1 ? 1 
ATOM   7986  C  CA   . LEU   A  1  509 ? -11.725 -9.443  -40.736 1.000 46.239  0 564  LEU   A CA   1 ? 1 
ATOM   7987  C  C    . LEU   A  1  509 ? -11.971 -10.885 -40.289 1.000 36.315  0 564  LEU   A C    1 ? 1 
ATOM   7988  O  O    . LEU   A  1  509 ? -11.603 -11.240 -39.171 1.000 42.508  0 564  LEU   A O    1 ? 1 
ATOM   7989  C  CB   . LEU   A  1  509 ? -12.345 -8.521  -39.682 1.000 40.973  0 564  LEU   A CB   1 ? 1 
ATOM   7990  C  CG   . LEU   A  1  509 ? -12.184 -7.042  -39.867 1.000 45.709  0 564  LEU   A CG   1 ? 1 
ATOM   7991  C  CD1  . LEU   A  1  509 ? -12.970 -6.314  -38.784 1.000 42.567  0 564  LEU   A CD1  1 ? 1 
ATOM   7992  C  CD2  . LEU   A  1  509 ? -10.688 -6.634  -39.890 1.000 40.792  0 564  LEU   A CD2  1 ? 1 
ATOM   7993  H  H    . LEU   A  1  509 ? -13.133 -8.922  -42.148 1.000 55.215  0 564  LEU   A H    1 c 1 
ATOM   7994  H  HA   . LEU   A  1  509 ? -10.752 -9.296  -40.745 1.000 44.588  0 564  LEU   A HA   1 c 1 
ATOM   7995  H  HB2  . LEU   A  1  509 ? -13.302 -8.719  -39.636 1.000 43.084  0 564  LEU   A HB2  1 c 1 
ATOM   7996  H  HB3  . LEU   A  1  509 ? -11.962 -8.757  -38.814 1.000 42.355  0 564  LEU   A HB3  1 c 1 
ATOM   7997  H  HG   . LEU   A  1  509 ? -12.578 -6.800  -40.741 1.000 44.070  0 564  LEU   A HG   1 c 1 
ATOM   7998  H  HD11 . LEU   A  1  509 ? -12.991 -5.361  -38.982 1.000 43.409  0 564  LEU   A HD11 1 c 1 
ATOM   7999  H  HD12 . LEU   A  1  509 ? -12.543 -6.456  -37.922 1.000 42.681  0 564  LEU   A HD12 1 c 1 
ATOM   8000  H  HD13 . LEU   A  1  509 ? -13.880 -6.657  -38.755 1.000 43.445  0 564  LEU   A HD13 1 c 1 
ATOM   8001  H  HD21 . LEU   A  1  509 ? -10.265 -6.990  -40.691 1.000 42.566  0 564  LEU   A HD21 1 c 1 
ATOM   8002  H  HD22 . LEU   A  1  509 ? -10.241 -6.991  -39.102 1.000 41.425  0 564  LEU   A HD22 1 c 1 
ATOM   8003  H  HD23 . LEU   A  1  509 ? -10.616 -5.664  -39.890 1.000 42.003  0 564  LEU   A HD23 1 c 1 
ATOM   8004  N  N    . GLY   A  1  510 ? -12.617 -11.698 -41.136 1.000 42.165  0 565  GLY   A N    1 ? 1 
ATOM   8005  C  CA   . GLY   A  1  510 ? -12.860 -13.102 -40.827 1.000 36.081  0 565  GLY   A CA   1 ? 1 
ATOM   8006  C  C    . GLY   A  1  510 ? -13.946 -13.310 -39.779 1.000 30.879  0 565  GLY   A C    1 ? 1 
ATOM   8007  O  O    . GLY   A  1  510 ? -14.051 -14.364 -39.181 1.000 31.103  0 565  GLY   A O    1 ? 1 
ATOM   8008  H  H    . GLY   A  1  510 ? -12.919 -11.368 -41.933 1.000 40.048  0 565  GLY   A H    1 c 1 
ATOM   8009  H  HA2  . GLY   A  1  510 ? -13.121 -13.570 -41.660 1.000 36.754  0 565  GLY   A HA2  1 c 1 
ATOM   8010  H  HA3  . GLY   A  1  510 ? -12.016 -13.508 -40.505 1.000 35.835  0 565  GLY   A HA3  1 c 1 
ATOM   8011  N  N    . CYS   A  1  511 ? -14.784 -12.298 -39.594 1.000 31.575  0 566  CYS   A N    1 ? 1 
ATOM   8012  C  CA   . CYS   A  1  511 ? -15.804 -12.298 -38.560 1.000 38.740  0 566  CYS   A CA   1 ? 1 
ATOM   8013  C  C    . CYS   A  1  511 ? -17.157 -12.668 -39.166 1.000 40.662  0 566  CYS   A C    1 ? 1 
ATOM   8014  O  O    . CYS   A  1  511 ? -17.318 -12.647 -40.382 1.000 40.821  0 566  CYS   A O    1 ? 1 
ATOM   8015  C  CB   . CYS   A  1  511 ? -15.856 -10.922 -37.892 1.000 40.976  0 566  CYS   A CB   1 ? 1 
ATOM   8016  S  SG   . CYS   A  1  511 ? -14.356 -10.485 -36.954 1.000 43.587  0 566  CYS   A SG   1 ? 1 
ATOM   8017  H  H    . CYS   A  1  511 ? -14.731 -11.573 -40.147 1.000 33.129  0 566  CYS   A H    1 c 1 
ATOM   8018  H  HA   . CYS   A  1  511 ? -15.565 -12.970 -37.883 1.000 37.149  0 566  CYS   A HA   1 c 1 
ATOM   8019  H  HB2  . CYS   A  1  511 ? -15.999 -10.241 -38.580 1.000 41.251  0 566  CYS   A HB2  1 c 1 
ATOM   8020  H  HB3  . CYS   A  1  511 ? -16.620 -10.895 -37.281 1.000 40.677  0 566  CYS   A HB3  1 c 1 
ATOM   8021  N  N    . THR   A  1  512 ? -18.136 -12.955 -38.305 1.000 33.258  0 567  THR   A N    1 ? 1 
ATOM   8022  C  CA   . THR   A  1  512 ? -19.499 -13.206 -38.756 1.000 37.175  0 567  THR   A CA   1 ? 1 
ATOM   8023  C  C    . THR   A  1  512 ? -20.458 -12.465 -37.829 1.000 35.590  0 567  THR   A C    1 ? 1 
ATOM   8024  O  O    . THR   A  1  512 ? -20.189 -12.362 -36.639 1.000 29.233  0 567  THR   A O    1 ? 1 
ATOM   8025  C  CB   . THR   A  1  512 ? -19.793 -14.719 -38.740 1.000 41.208  0 567  THR   A CB   1 ? 1 
ATOM   8026  O  OG1  . THR   A  1  512 ? -19.746 -15.149 -37.373 1.000 51.897  0 567  THR   A OG1  1 ? 1 
ATOM   8027  C  CG2  . THR   A  1  512 ? -18.804 -15.524 -39.519 1.000 41.130  0 567  THR   A CG2  1 ? 1 
ATOM   8028  H  H    . THR   A  1  512 ? -17.953 -12.992 -37.411 1.000 34.976  0 567  THR   A H    1 c 1 
ATOM   8029  H  HA   . THR   A  1  512 ? -19.602 -12.864 -39.673 1.000 37.422  0 567  THR   A HA   1 c 1 
ATOM   8030  H  HB   . THR   A  1  512 ? -20.699 -14.872 -39.102 1.000 42.793  0 567  THR   A HB   1 c 1 
ATOM   8031  H  HG1  . THR   A  1  512 ? -18.974 -14.986 -37.058 0.000 31.180  0 567  THR   A HG1  1 c 1 
ATOM   8032  H  HG21 . THR   A  1  512 ? -19.107 -16.448 -39.572 1.000 41.568  0 567  THR   A HG21 1 c 1 
ATOM   8033  H  HG22 . THR   A  1  512 ? -17.936 -15.493 -39.076 1.000 40.680  0 567  THR   A HG22 1 c 1 
ATOM   8034  H  HG23 . THR   A  1  512 ? -18.722 -15.159 -40.418 1.000 41.703  0 567  THR   A HG23 1 c 1 
ATOM   8035  N  N    . CYS   A  1  513 ? -21.565 -11.956 -38.375 1.000 33.266  0 568  CYS   A N    1 ? 1 
ATOM   8036  C  CA   . CYS   A  1  513 ? -22.665 -11.463 -37.563 1.000 33.615  0 568  CYS   A CA   1 ? 1 
ATOM   8037  C  C    . CYS   A  1  513 ? -23.986 -11.504 -38.311 1.000 35.712  0 568  CYS   A C    1 ? 1 
ATOM   8038  O  O    . CYS   A  1  513 ? -24.054 -11.148 -39.484 1.000 34.583  0 568  CYS   A O    1 ? 1 
ATOM   8039  C  CB   . CYS   A  1  513 ? -22.406 -10.042 -37.091 1.000 35.778  0 568  CYS   A CB   1 ? 1 
ATOM   8040  S  SG   . CYS   A  1  513 ? -23.637 -9.421  -35.894 1.000 37.631  0 568  CYS   A SG   1 ? 1 
ATOM   8041  H  H    . CYS   A  1  513 ? -21.637 -11.914 -39.285 1.000 34.652  0 568  CYS   A H    1 c 1 
ATOM   8042  H  HA   . CYS   A  1  513 ? -22.738 -12.043 -36.770 1.000 33.853  0 568  CYS   A HA   1 c 1 
ATOM   8043  H  HB2  . CYS   A  1  513 ? -21.521 -10.001 -36.674 1.000 34.845  0 568  CYS   A HB2  1 c 1 
ATOM   8044  H  HB3  . CYS   A  1  513 ? -22.401 -9.445  -37.866 1.000 35.823  0 568  CYS   A HB3  1 c 1 
ATOM   8045  N  N    . ASP   A  1  514 ? -25.051 -11.830 -37.583 1.000 37.858  0 569  ASP   A N    1 ? 1 
ATOM   8046  C  CA   . ASP   A  1  514 ? -26.401 -11.698 -38.103 1.000 38.665  0 569  ASP   A CA   1 ? 1 
ATOM   8047  C  C    . ASP   A  1  514 ? -26.941 -10.271 -37.912 1.000 42.356  0 569  ASP   A C    1 ? 1 
ATOM   8048  O  O    . ASP   A  1  514 ? -27.658 -10.001 -36.953 1.000 46.784  0 569  ASP   A O    1 ? 1 
ATOM   8049  C  CB   . ASP   A  1  514 ? -27.260 -12.759 -37.405 1.000 34.592  0 569  ASP   A CB   1 ? 1 
ATOM   8050  C  CG   . ASP   A  1  514 ? -28.660 -12.922 -37.943 1.000 36.979  0 569  ASP   A CG   1 ? 1 
ATOM   8051  O  OD1  . ASP   A  1  514 ? -28.919 -12.464 -39.061 1.000 36.612  0 569  ASP   A OD1  1 ? 1 
ATOM   8052  O  OD2  . ASP   A  1  514 ? -29.495 -13.480 -37.227 1.000 43.555  0 569  ASP   A OD2  1 ? 1 
ATOM   8053  H  H    . ASP   A  1  514 ? -24.936 -12.143 -36.732 1.000 36.758  0 569  ASP   A H    1 c 1 
ATOM   8054  H  HA   . ASP   A  1  514 ? -26.384 -11.900 -39.068 1.000 38.928  0 569  ASP   A HA   1 c 1 
ATOM   8055  H  HB2  . ASP   A  1  514 ? -26.806 -13.623 -37.483 1.000 35.741  0 569  ASP   A HB2  1 c 1 
ATOM   8056  H  HB3  . ASP   A  1  514 ? -27.322 -12.537 -36.454 1.000 35.320  0 569  ASP   A HB3  1 c 1 
ATOM   8057  N  N    . ASP   A  1  515 ? -26.547 -9.352  -38.809 1.000 45.218  0 570  ASP   A N    1 ? 1 
ATOM   8058  C  CA   . ASP   A  1  515 ? -27.142 -8.025  -38.931 1.000 61.013  0 570  ASP   A CA   1 ? 1 
ATOM   8059  C  C    . ASP   A  1  515 ? -28.504 -7.891  -38.233 1.000 59.212  0 570  ASP   A C    1 ? 1 
ATOM   8060  O  O    . ASP   A  1  515 ? -29.408 -7.222  -38.730 1.000 50.574  0 570  ASP   A O    1 ? 1 
ATOM   8061  C  CB   . ASP   A  1  515 ? -27.319 -7.652  -40.426 1.000 59.315  0 570  ASP   A CB   1 ? 1 
ATOM   8062  C  CG   . ASP   A  1  515 ? -27.865 -6.255  -40.693 1.000 101.920 0 570  ASP   A CG   1 ? 1 
ATOM   8063  O  OD1  . ASP   A  1  515 ? -27.298 -5.277  -40.147 1.000 104.581 0 570  ASP   A OD1  1 ? 1 
ATOM   8064  O  OD2  . ASP   A  1  515 ? -28.846 -6.137  -41.462 1.000 129.669 0 570  ASP   A OD2  1 ? 1 
ATOM   8065  H  H    . ASP   A  1  515 ? -25.866 -9.571  -39.378 1.000 47.292  0 570  ASP   A H    1 c 1 
ATOM   8066  H  HA   . ASP   A  1  515 ? -26.523 -7.377  -38.526 1.000 55.960  0 570  ASP   A HA   1 c 1 
ATOM   8067  H  HB2  . ASP   A  1  515 ? -26.451 -7.726  -40.871 1.000 67.272  0 570  ASP   A HB2  1 c 1 
ATOM   8068  H  HB3  . ASP   A  1  515 ? -27.927 -8.298  -40.839 1.000 68.220  0 570  ASP   A HB3  1 c 1 
ATOM   8069  N  N    . HIS   A  1  531 ? -21.443 7.148   -33.785 1.000 91.511  0 586  HIS   A N    1 ? 1 
ATOM   8070  C  CA   . HIS   A  1  531 ? -22.404 7.884   -32.953 1.000 85.509  0 586  HIS   A CA   1 ? 1 
ATOM   8071  C  C    . HIS   A  1  531 ? -21.770 9.234   -32.620 1.000 68.401  0 586  HIS   A C    1 ? 1 
ATOM   8072  O  O    . HIS   A  1  531 ? -20.547 9.347   -32.587 1.000 57.391  0 586  HIS   A O    1 ? 1 
ATOM   8073  C  CB   . HIS   A  1  531 ? -22.789 7.026   -31.713 1.000 115.885 0 586  HIS   A CB   1 ? 1 
ATOM   8074  C  CG   . HIS   A  1  531 ? -23.788 7.606   -30.752 1.000 105.226 0 586  HIS   A CG   1 ? 1 
ATOM   8075  N  ND1  . HIS   A  1  531 ? -25.131 7.236   -30.780 1.000 95.492  0 586  HIS   A ND1  1 ? 1 
ATOM   8076  C  CD2  . HIS   A  1  531 ? -23.606 8.474   -29.734 1.000 72.962  0 586  HIS   A CD2  1 ? 1 
ATOM   8077  C  CE1  . HIS   A  1  531 ? -25.719 7.904   -29.795 1.000 57.681  0 586  HIS   A CE1  1 ? 1 
ATOM   8078  N  NE2  . HIS   A  1  531 ? -24.834 8.662   -29.139 1.000 78.052  0 586  HIS   A NE2  1 ? 1 
ATOM   8079  H  H    . HIS   A  1  531 ? -21.186 6.385   -33.359 1.000 89.353  0 586  HIS   A H    1 c 1 
ATOM   8080  H  HA   . HIS   A  1  531 ? -23.216 8.037   -33.491 1.000 88.359  0 586  HIS   A HA   1 c 1 
ATOM   8081  H  HB2  . HIS   A  1  531 ? -23.139 6.170   -32.034 1.000 104.770 0 586  HIS   A HB2  1 c 1 
ATOM   8082  H  HB3  . HIS   A  1  531 ? -21.971 6.836   -31.215 1.000 101.244 0 586  HIS   A HB3  1 c 1 
ATOM   8083  H  HD1  . HIS   A  1  531 ? -25.490 6.657   -31.337 0.000 73.050  0 586  HIS   A HD1  1 c 1 
ATOM   8084  H  HD2  . HIS   A  1  531 ? -22.790 8.880   -29.484 1.000 79.926  0 586  HIS   A HD2  1 c 1 
ATOM   8085  H  HE1  . HIS   A  1  531 ? -26.638 7.854   -29.588 1.000 69.855  0 586  HIS   A HE1  1 c 1 
ATOM   8086  H  HE2  . HIS   A  1  531 ? -25.010 9.198   -28.455 0.000 58.330  0 586  HIS   A HE2  1 c 1 
ATOM   8087  N  N    . THR   A  1  532 ? -22.607 10.265  -32.447 1.000 85.450  0 587  THR   A N    1 ? 1 
ATOM   8088  C  CA   . THR   A  1  532 ? -22.132 11.618  -32.207 1.000 89.791  0 587  THR   A CA   1 ? 1 
ATOM   8089  C  C    . THR   A  1  532 ? -22.422 11.994  -30.762 1.000 115.731 0 587  THR   A C    1 ? 1 
ATOM   8090  O  O    . THR   A  1  532 ? -23.579 12.165  -30.384 1.000 131.760 0 587  THR   A O    1 ? 1 
ATOM   8091  C  CB   . THR   A  1  532 ? -22.755 12.609  -33.185 1.000 72.691  0 587  THR   A CB   1 ? 1 
ATOM   8092  O  OG1  . THR   A  1  532 ? -22.407 12.175  -34.495 1.000 85.292  0 587  THR   A OG1  1 ? 1 
ATOM   8093  C  CG2  . THR   A  1  532 ? -22.278 14.047  -32.961 1.000 63.934  0 587  THR   A CG2  1 ? 1 
ATOM   8094  H  H    . THR   A  1  532 ? -23.509 10.117  -32.480 1.000 82.387  0 587  THR   A H    1 c 1 
ATOM   8095  H  HA   . THR   A  1  532 ? -21.157 11.628  -32.342 1.000 88.760  0 587  THR   A HA   1 c 1 
ATOM   8096  H  HB   . THR   A  1  532 ? -23.736 12.575  -33.084 1.000 76.410  0 587  THR   A HB   1 c 1 
ATOM   8097  H  HG1  . THR   A  1  532 ? -21.568 12.173  -34.578 0.000 59.140  0 587  THR   A HG1  1 c 1 
ATOM   8098  H  HG21 . THR   A  1  532 ? -22.519 14.593  -33.731 1.000 67.161  0 587  THR   A HG21 1 c 1 
ATOM   8099  H  HG22 . THR   A  1  532 ? -21.310 14.055  -32.849 1.000 65.959  0 587  THR   A HG22 1 c 1 
ATOM   8100  H  HG23 . THR   A  1  532 ? -22.700 14.411  -32.162 1.000 66.453  0 587  THR   A HG23 1 c 1 
ATOM   8101  N  N    . LYS   A  1  533 ? -21.350 12.101  -29.972 1.000 110.249 0 588  LYS   A N    1 ? 1 
ATOM   8102  C  CA   . LYS   A  1  533 ? -21.428 12.518  -28.585 1.000 112.677 0 588  LYS   A CA   1 ? 1 
ATOM   8103  C  C    . LYS   A  1  533 ? -22.861 12.516  -28.064 1.000 98.464  0 588  LYS   A C    1 ? 1 
ATOM   8104  O  O    . LYS   A  1  533 ? -23.355 11.492  -27.607 1.000 117.275 0 588  LYS   A O    1 ? 1 
ATOM   8105  C  CB   . LYS   A  1  533 ? -20.827 13.907  -28.456 1.000 121.244 0 588  LYS   A CB   1 ? 1 
ATOM   8106  C  CG   . LYS   A  1  533 ? -20.043 14.102  -27.191 1.000 105.023 0 588  LYS   A CG   1 ? 1 
ATOM   8107  C  CD   . LYS   A  1  533 ? -19.611 15.561  -27.025 1.000 83.637  0 588  LYS   A CD   1 ? 1 
ATOM   8108  C  CE   . LYS   A  1  533 ? -18.110 15.719  -26.910 1.000 103.863 0 588  LYS   A CE   1 ? 1 
ATOM   8109  N  NZ   . LYS   A  1  533 ? -17.411 15.299  -28.168 1.000 114.196 0 588  LYS   A NZ   1 ? 1 
ATOM   8110  H  H    . LYS   A  1  533 ? -20.527 11.901  -30.317 1.000 111.323 0 588  LYS   A H    1 c 1 
ATOM   8111  H  HA   . LYS   A  1  533 ? -20.897 11.890  -28.043 1.000 109.988 0 588  LYS   A HA   1 c 1 
ATOM   8112  H  HB2  . LYS   A  1  533 ? -20.231 14.062  -29.219 1.000 115.581 0 588  LYS   A HB2  1 c 1 
ATOM   8113  H  HB3  . LYS   A  1  533 ? -21.537 14.577  -28.492 1.000 115.513 0 588  LYS   A HB3  1 c 1 
ATOM   8114  H  HG2  . LYS   A  1  533 ? -20.597 13.838  -26.426 1.000 102.400 0 588  LYS   A HG2  1 c 1 
ATOM   8115  H  HG3  . LYS   A  1  533 ? -19.252 13.525  -27.209 1.000 101.665 0 588  LYS   A HG3  1 c 1 
ATOM   8116  H  HD2  . LYS   A  1  533 ? -19.927 16.082  -27.794 1.000 93.543  0 588  LYS   A HD2  1 c 1 
ATOM   8117  H  HD3  . LYS   A  1  533 ? -20.031 15.929  -26.218 1.000 92.585  0 588  LYS   A HD3  1 c 1 
ATOM   8118  H  HE2  . LYS   A  1  533 ? -17.893 16.651  -26.722 1.000 100.841 0 588  LYS   A HE2  1 c 1 
ATOM   8119  H  HE3  . LYS   A  1  533 ? -17.780 15.177  -26.170 1.000 99.663  0 588  LYS   A HE3  1 c 1 
ATOM   8120  H  HZ1  . LYS   A  1  533 ? -17.836 15.652  -28.888 1.000 111.183 0 588  LYS   A HZ1  1 c 1 
ATOM   8121  H  HZ2  . LYS   A  1  533 ? -17.411 14.396  -28.236 1.000 109.724 0 588  LYS   A HZ2  1 c 1 
ATOM   8122  H  HZ3  . LYS   A  1  533 ? -16.553 15.594  -28.156 1.000 110.522 0 588  LYS   A HZ3  1 c 1 
ATOM   8123  N  N    . GLY   A  1  534 ? -23.537 13.662  -28.195 1.000 102.139 0 589  GLY   A N    1 ? 1 
ATOM   8124  C  CA   . GLY   A  1  534 ? -24.829 13.861  -27.573 1.000 85.110  0 589  GLY   A CA   1 ? 1 
ATOM   8125  C  C    . GLY   A  1  534 ? -24.704 13.890  -26.054 1.000 83.490  0 589  GLY   A C    1 ? 1 
ATOM   8126  O  O    . GLY   A  1  534 ? -23.825 14.554  -25.505 1.000 69.274  0 589  GLY   A O    1 ? 1 
ATOM   8127  H  H    . GLY   A  1  534 ? -23.206 14.326  -28.728 1.000 97.899  0 589  GLY   A H    1 c 1 
ATOM   8128  H  HA2  . GLY   A  1  534 ? -25.213 14.717  -27.889 1.000 89.396  0 589  GLY   A HA2  1 c 1 
ATOM   8129  H  HA3  . GLY   A  1  534 ? -25.437 13.128  -27.845 1.000 89.078  0 589  GLY   A HA3  1 c 1 
ATOM   8130  N  N    . SER   A  1  535 ? -25.591 13.147  -25.387 1.000 93.219  0 590  SER   A N    1 ? 1 
ATOM   8131  C  CA   . SER   A  1  535 ? -25.616 13.079  -23.937 1.000 91.517  0 590  SER   A CA   1 ? 1 
ATOM   8132  C  C    . SER   A  1  535 ? -24.982 11.795  -23.405 1.000 98.700  0 590  SER   A C    1 ? 1 
ATOM   8133  O  O    . SER   A  1  535 ? -25.136 11.484  -22.227 1.000 88.166  0 590  SER   A O    1 ? 1 
ATOM   8134  C  CB   . SER   A  1  535 ? -27.055 13.186  -23.450 1.000 86.580  0 590  SER   A CB   1 ? 1 
ATOM   8135  O  OG   . SER   A  1  535 ? -27.821 12.096  -23.940 1.000 79.452  0 590  SER   A OG   1 ? 1 
ATOM   8136  H  H    . SER   A  1  535 ? -26.207 12.662  -25.856 1.000 90.806  0 590  SER   A H    1 c 1 
ATOM   8137  H  HA   . SER   A  1  535 ? -25.104 13.852  -23.577 1.000 91.711  0 590  SER   A HA   1 c 1 
ATOM   8138  H  HB2  . SER   A  1  535 ? -27.072 13.187  -22.466 1.000 85.577  0 590  SER   A HB2  1 c 1 
ATOM   8139  H  HB3  . SER   A  1  535 ? -27.446 14.032  -23.765 1.000 86.539  0 590  SER   A HB3  1 c 1 
ATOM   8140  H  HG   . SER   A  1  535 ? -27.771 11.457  -23.369 0.000 61.560  0 590  SER   A HG   1 c 1 
ATOM   8141  N  N    . THR   A  1  536 ? -24.278 11.057  -24.278 1.000 134.727 0 591  THR   A N    1 ? 1 
ATOM   8142  C  CA   . THR   A  1  536 ? -23.601 9.831   -23.889 1.000 116.880 0 591  THR   A CA   1 ? 1 
ATOM   8143  C  C    . THR   A  1  536 ? -22.422 10.176  -22.984 1.000 65.669  0 591  THR   A C    1 ? 1 
ATOM   8144  O  O    . THR   A  1  536 ? -22.151 9.466   -22.021 1.000 71.416  0 591  THR   A O    1 ? 1 
ATOM   8145  C  CB   . THR   A  1  536 ? -23.130 9.033   -25.121 1.000 114.667 0 591  THR   A CB   1 ? 1 
ATOM   8146  O  OG1  . THR   A  1  536 ? -22.143 9.794   -25.817 1.000 107.905 0 591  THR   A OG1  1 ? 1 
ATOM   8147  C  CG2  . THR   A  1  536 ? -24.274 8.679   -26.065 1.000 86.193  0 591  THR   A CG2  1 ? 1 
ATOM   8148  H  H    . THR   A  1  536 ? -24.210 11.335  -25.145 1.000 120.154 0 591  THR   A H    1 c 1 
ATOM   8149  H  HA   . THR   A  1  536 ? -24.237 9.278   -23.380 1.000 106.580 0 591  THR   A HA   1 c 1 
ATOM   8150  H  HB   . THR   A  1  536 ? -22.716 8.196   -24.802 1.000 107.021 0 591  THR   A HB   1 c 1 
ATOM   8151  H  HG1  . THR   A  1  536 ? -22.482 10.560  -26.057 0.000 92.410  0 591  THR   A HG1  1 c 1 
ATOM   8152  H  HG21 . THR   A  1  536 ? -23.934 8.131   -26.794 1.000 91.961  0 591  THR   A HG21 1 c 1 
ATOM   8153  H  HG22 . THR   A  1  536 ? -24.664 9.494   -26.428 1.000 94.355  0 591  THR   A HG22 1 c 1 
ATOM   8154  H  HG23 . THR   A  1  536 ? -24.956 8.182   -25.578 1.000 93.477  0 591  THR   A HG23 1 c 1 
ATOM   8155  N  N    . LYS   A  1  537 ? -21.716 11.259  -23.328 1.000 67.749  0 592  LYS   A N    1 ? 1 
ATOM   8156  C  CA   . LYS   A  1  537 ? -20.592 11.737  -22.538 1.000 83.512  0 592  LYS   A CA   1 ? 1 
ATOM   8157  C  C    . LYS   A  1  537 ? -21.077 12.109  -21.136 1.000 58.135  0 592  LYS   A C    1 ? 1 
ATOM   8158  O  O    . LYS   A  1  537 ? -20.449 11.769  -20.131 1.000 68.067  0 592  LYS   A O    1 ? 1 
ATOM   8159  C  CB   . LYS   A  1  537 ? -19.882 12.915  -23.261 1.000 61.380  0 592  LYS   A CB   1 ? 1 
ATOM   8160  C  CG   . LYS   A  1  537 ? -18.492 13.237  -22.695 1.000 65.384  0 592  LYS   A CG   1 ? 1 
ATOM   8161  C  CD   . LYS   A  1  537 ? -17.477 13.658  -23.771 1.000 73.658  0 592  LYS   A CD   1 ? 1 
ATOM   8162  C  CE   . LYS   A  1  537 ? -16.041 13.540  -23.298 1.000 58.266  0 592  LYS   A CE   1 ? 1 
ATOM   8163  N  NZ   . LYS   A  1  537 ? -15.077 13.404  -24.428 1.000 58.522  0 592  LYS   A NZ   1 ? 1 
ATOM   8164  H  H    . LYS   A  1  537 ? -21.940 11.714  -24.089 1.000 71.590  0 592  LYS   A H    1 c 1 
ATOM   8165  H  HA   . LYS   A  1  537 ? -19.950 10.995  -22.452 1.000 69.754  0 592  LYS   A HA   1 c 1 
ATOM   8166  H  HB2  . LYS   A  1  537 ? -19.794 12.693  -24.211 1.000 67.180  0 592  LYS   A HB2  1 c 1 
ATOM   8167  H  HB3  . LYS   A  1  537 ? -20.445 13.714  -23.187 1.000 67.310  0 592  LYS   A HB3  1 c 1 
ATOM   8168  H  HG2  . LYS   A  1  537 ? -18.579 13.961  -22.038 1.000 66.017  0 592  LYS   A HG2  1 c 1 
ATOM   8169  H  HG3  . LYS   A  1  537 ? -18.151 12.447  -22.226 1.000 65.510  0 592  LYS   A HG3  1 c 1 
ATOM   8170  H  HD2  . LYS   A  1  537 ? -17.597 13.097  -24.566 1.000 68.098  0 592  LYS   A HD2  1 c 1 
ATOM   8171  H  HD3  . LYS   A  1  537 ? -17.651 14.589  -24.027 1.000 68.720  0 592  LYS   A HD3  1 c 1 
ATOM   8172  H  HE2  . LYS   A  1  537 ? -15.805 14.332  -22.778 1.000 61.285  0 592  LYS   A HE2  1 c 1 
ATOM   8173  H  HE3  . LYS   A  1  537 ? -15.953 12.762  -22.716 1.000 60.837  0 592  LYS   A HE3  1 c 1 
ATOM   8174  H  HZ1  . LYS   A  1  537 ? -15.234 14.050  -25.045 1.000 58.984  0 592  LYS   A HZ1  1 c 1 
ATOM   8175  H  HZ2  . LYS   A  1  537 ? -15.174 12.591  -24.818 1.000 58.400  0 592  LYS   A HZ2  1 c 1 
ATOM   8176  H  HZ3  . LYS   A  1  537 ? -14.229 13.488  -24.120 1.000 58.064  0 592  LYS   A HZ3  1 c 1 
ATOM   8177  N  N    . GLU   A  1  538 ? -22.241 12.755  -21.078 1.000 42.120  0 593  GLU   A N    1 ? 1 
ATOM   8178  C  CA   . GLU   A  1  538 ? -22.803 13.196  -19.817 1.000 57.516  0 593  GLU   A CA   1 ? 1 
ATOM   8179  C  C    . GLU   A  1  538 ? -23.113 11.986  -18.932 1.000 63.313  0 593  GLU   A C    1 ? 1 
ATOM   8180  O  O    . GLU   A  1  538 ? -22.778 11.988  -17.751 1.000 61.954  0 593  GLU   A O    1 ? 1 
ATOM   8181  C  CB   . GLU   A  1  538 ? -24.063 14.053  -20.060 1.000 61.747  0 593  GLU   A CB   1 ? 1 
ATOM   8182  C  CG   . GLU   A  1  538 ? -24.345 15.033  -18.931 1.000 84.755  0 593  GLU   A CG   1 ? 1 
ATOM   8183  C  CD   . GLU   A  1  538 ? -25.801 15.411  -18.698 1.000 85.247  0 593  GLU   A CD   1 ? 1 
ATOM   8184  O  OE1  . GLU   A  1  538 ? -26.474 15.843  -19.661 1.000 76.765  0 593  GLU   A OE1  1 ? 1 
ATOM   8185  O  OE2  . GLU   A  1  538 ? -26.265 15.283  -17.540 1.000 73.493  0 593  GLU   A OE2  1 ? 1 
ATOM   8186  H  H    . GLU   A  1  538 ? -22.698 12.931  -21.850 1.000 49.683  0 593  GLU   A H    1 c 1 
ATOM   8187  H  HA   . GLU   A  1  538 ? -22.130 13.752  -19.360 1.000 55.324  0 593  GLU   A HA   1 c 1 
ATOM   8188  H  HB2  . GLU   A  1  538 ? -23.950 14.553  -20.895 1.000 65.528  0 593  GLU   A HB2  1 c 1 
ATOM   8189  H  HB3  . GLU   A  1  538 ? -24.834 13.457  -20.166 1.000 65.684  0 593  GLU   A HB3  1 c 1 
ATOM   8190  H  HG2  . GLU   A  1  538 ? -23.994 14.654  -18.096 1.000 77.762  0 593  GLU   A HG2  1 c 1 
ATOM   8191  H  HG3  . GLU   A  1  538 ? -23.844 15.858  -19.105 1.000 78.613  0 593  GLU   A HG3  1 c 1 
ATOM   8192  N  N    . ARG   A  1  539 ? -23.739 10.951  -19.513 1.000 50.883  0 594  ARG   A N    1 ? 1 
ATOM   8193  C  CA   . ARG   A  1  539 ? -24.193 9.807   -18.737 1.000 57.111  0 594  ARG   A CA   1 ? 1 
ATOM   8194  C  C    . ARG   A  1  539 ? -23.145 8.722   -18.485 1.000 38.480  0 594  ARG   A C    1 ? 1 
ATOM   8195  O  O    . ARG   A  1  539 ? -23.127 8.158   -17.398 1.000 46.781  0 594  ARG   A O    1 ? 1 
ATOM   8196  C  CB   . ARG   A  1  539 ? -25.410 9.117   -19.360 1.000 75.516  0 594  ARG   A CB   1 ? 1 
ATOM   8197  C  CG   . ARG   A  1  539 ? -25.927 8.032   -18.388 1.000 103.386 0 594  ARG   A CG   1 ? 1 
ATOM   8198  C  CD   . ARG   A  1  539 ? -27.241 7.431   -18.757 1.000 113.395 0 594  ARG   A CD   1 ? 1 
ATOM   8199  N  NE   . ARG   A  1  539 ? -27.603 6.381   -17.815 1.000 67.250  0 594  ARG   A NE   1 ? 1 
ATOM   8200  C  CZ   . ARG   A  1  539 ? -28.631 5.563   -17.973 1.000 98.087  0 594  ARG   A CZ   1 ? 1 
ATOM   8201  N  NH1  . ARG   A  1  539 ? -29.457 5.678   -19.001 1.000 141.891 0 594  ARG   A NH1  1 ? 1 
ATOM   8202  N  NH2  . ARG   A  1  539 ? -28.833 4.600   -17.083 1.000 112.417 0 594  ARG   A NH2  1 ? 1 
ATOM   8203  H  H    . ARG   A  1  539 ? -23.890 10.961  -20.415 1.000 55.317  0 594  ARG   A H    1 c 1 
ATOM   8204  H  HA   . ARG   A  1  539 ? -24.472 10.152  -17.857 1.000 54.526  0 594  ARG   A HA   1 c 1 
ATOM   8205  H  HB2  . ARG   A  1  539 ? -26.114 9.778   -19.526 1.000 76.479  0 594  ARG   A HB2  1 c 1 
ATOM   8206  H  HB3  . ARG   A  1  539 ? -25.154 8.705   -20.212 1.000 75.660  0 594  ARG   A HB3  1 c 1 
ATOM   8207  H  HG2  . ARG   A  1  539 ? -25.267 7.310   -18.338 1.000 96.204  0 594  ARG   A HG2  1 c 1 
ATOM   8208  H  HG3  . ARG   A  1  539 ? -26.005 8.422   -17.491 1.000 96.936  0 594  ARG   A HG3  1 c 1 
ATOM   8209  H  HD2  . ARG   A  1  539 ? -27.933 8.127   -18.753 1.000 98.303  0 594  ARG   A HD2  1 c 1 
ATOM   8210  H  HD3  . ARG   A  1  539 ? -27.188 7.056   -19.662 1.000 98.166  0 594  ARG   A HD3  1 c 1 
ATOM   8211  H  HE   . ARG   A  1  539 ? -27.112 6.284   -17.100 1.000 82.458  0 594  ARG   A HE   1 c 1 
ATOM   8212  H  HH11 . ARG   A  1  539 ? -29.508 6.439   -19.444 1.000 126.502 0 594  ARG   A HH11 1 c 1 
ATOM   8213  H  HH12 . ARG   A  1  539 ? -29.958 4.991   -19.240 1.000 126.516 0 594  ARG   A HH12 1 c 1 
ATOM   8214  H  HH21 . ARG   A  1  539 ? -29.545 4.088   -17.145 1.000 108.238 0 594  ARG   A HH21 1 c 1 
ATOM   8215  H  HH22 . ARG   A  1  539 ? -28.255 4.475   -16.432 1.000 106.556 0 594  ARG   A HH22 1 c 1 
ATOM   8216  N  N    . HIS   A  1  540 ? -22.305 8.411   -19.482 1.000 28.811  0 595  HIS   A N    1 ? 1 
ATOM   8217  C  CA   . HIS   A  1  540 ? -21.420 7.267   -19.385 1.000 25.389  0 595  HIS   A CA   1 ? 1 
ATOM   8218  C  C    . HIS   A  1  540 ? -20.029 7.672   -18.915 1.000 30.719  0 595  HIS   A C    1 ? 1 
ATOM   8219  O  O    . HIS   A  1  540 ? -19.303 6.809   -18.426 1.000 28.582  0 595  HIS   A O    1 ? 1 
ATOM   8220  C  CB   . HIS   A  1  540 ? -21.469 6.469   -20.697 1.000 26.416  0 595  HIS   A CB   1 ? 1 
ATOM   8221  C  CG   . HIS   A  1  540 ? -22.835 5.862   -20.871 1.000 30.764  0 595  HIS   A CG   1 ? 1 
ATOM   8222  N  ND1  . HIS   A  1  540 ? -23.354 4.915   -19.948 1.000 26.196  0 595  HIS   A ND1  1 ? 1 
ATOM   8223  C  CD2  . HIS   A  1  540 ? -23.794 6.128   -21.773 1.000 29.761  0 595  HIS   A CD2  1 ? 1 
ATOM   8224  C  CE1  . HIS   A  1  540 ? -24.566 4.637   -20.347 1.000 33.526  0 595  HIS   A CE1  1 ? 1 
ATOM   8225  N  NE2  . HIS   A  1  540 ? -24.887 5.348   -21.447 1.000 32.489  0 595  HIS   A NE2  1 ? 1 
ATOM   8226  H  H    . HIS   A  1  540 ? -22.293 8.919   -20.242 1.000 30.549  0 595  HIS   A H    1 c 1 
ATOM   8227  H  HA   . HIS   A  1  540 ? -21.796 6.681   -18.688 1.000 27.009  0 595  HIS   A HA   1 c 1 
ATOM   8228  H  HB2  . HIS   A  1  540 ? -21.276 7.062   -21.451 1.000 27.456  0 595  HIS   A HB2  1 c 1 
ATOM   8229  H  HB3  . HIS   A  1  540 ? -20.796 5.759   -20.675 1.000 26.599  0 595  HIS   A HB3  1 c 1 
ATOM   8230  H  HD1  . HIS   A  1  540 ? -22.926 4.622   -19.237 0.000 12.670  0 595  HIS   A HD1  1 c 1 
ATOM   8231  H  HD2  . HIS   A  1  540 ? -23.729 6.733   -22.497 1.000 31.005  0 595  HIS   A HD2  1 c 1 
ATOM   8232  H  HE1  . HIS   A  1  540 ? -25.138 4.016   -19.926 1.000 31.372  0 595  HIS   A HE1  1 c 1 
ATOM   8233  H  HE2  . HIS   A  1  540 ? -25.658 5.310   -21.871 0.000 17.500  0 595  HIS   A HE2  1 c 1 
ATOM   8234  N  N    . LEU   A  1  541 ? -19.675 8.964   -19.038 1.000 30.024  0 596  LEU   A N    1 ? 1 
ATOM   8235  C  CA   . LEU   A  1  541 ? -18.423 9.496   -18.488 1.000 32.661  0 596  LEU   A CA   1 ? 1 
ATOM   8236  C  C    . LEU   A  1  541 ? -18.700 10.575  -17.449 1.000 29.273  0 596  LEU   A C    1 ? 1 
ATOM   8237  O  O    . LEU   A  1  541 ? -18.702 11.764  -17.758 1.000 32.052  0 596  LEU   A O    1 ? 1 
ATOM   8238  C  CB   . LEU   A  1  541 ? -17.505 10.106  -19.552 1.000 35.854  0 596  LEU   A CB   1 ? 1 
ATOM   8239  C  CG   . LEU   A  1  541 ? -16.487 9.210   -20.229 1.000 50.030  0 596  LEU   A CG   1 ? 1 
ATOM   8240  C  CD1  . LEU   A  1  541 ? -15.716 9.982   -21.260 1.000 62.323  0 596  LEU   A CD1  1 ? 1 
ATOM   8241  C  CD2  . LEU   A  1  541 ? -15.503 8.656   -19.271 1.000 44.245  0 596  LEU   A CD2  1 ? 1 
ATOM   8242  H  H    . LEU   A  1  541 ? -20.227 9.535   -19.490 1.000 31.313  0 596  LEU   A H    1 c 1 
ATOM   8243  H  HA   . LEU   A  1  541 ? -17.949 8.759   -18.043 1.000 31.435  0 596  LEU   A HA   1 c 1 
ATOM   8244  H  HB2  . LEU   A  1  541 ? -18.073 10.492  -20.248 1.000 38.590  0 596  LEU   A HB2  1 c 1 
ATOM   8245  H  HB3  . LEU   A  1  541 ? -17.016 10.846  -19.140 1.000 37.704  0 596  LEU   A HB3  1 c 1 
ATOM   8246  H  HG   . LEU   A  1  541 ? -16.960 8.463   -20.673 1.000 47.800  0 596  LEU   A HG   1 c 1 
ATOM   8247  H  HD11 . LEU   A  1  541 ? -15.195 9.367   -21.805 1.000 56.898  0 596  LEU   A HD11 1 c 1 
ATOM   8248  H  HD12 . LEU   A  1  541 ? -15.120 10.608  -20.818 1.000 56.897  0 596  LEU   A HD12 1 c 1 
ATOM   8249  H  HD13 . LEU   A  1  541 ? -16.335 10.473  -21.827 1.000 57.647  0 596  LEU   A HD13 1 c 1 
ATOM   8250  H  HD21 . LEU   A  1  541 ? -15.955 8.072   -18.639 1.000 45.096  0 596  LEU   A HD21 1 c 1 
ATOM   8251  H  HD22 . LEU   A  1  541 ? -15.075 9.383   -18.789 1.000 45.373  0 596  LEU   A HD22 1 c 1 
ATOM   8252  H  HD23 . LEU   A  1  541 ? -14.829 8.148   -19.754 1.000 45.496  0 596  LEU   A HD23 1 c 1 
ATOM   8253  N  N    . LEU   A  1  542 ? -18.925 10.131  -16.213 1.000 30.420  0 597  LEU   A N    1 ? 1 
ATOM   8254  C  CA   . LEU   A  1  542 ? -19.404 10.984  -15.141 1.000 26.014  0 597  LEU   A CA   1 ? 1 
ATOM   8255  C  C    . LEU   A  1  542 ? -18.324 11.907  -14.575 1.000 25.668  0 597  LEU   A C    1 ? 1 
ATOM   8256  O  O    . LEU   A  1  542 ? -18.652 12.916  -13.958 1.000 28.636  0 597  LEU   A O    1 ? 1 
ATOM   8257  C  CB   . LEU   A  1  542 ? -19.932 10.077  -14.011 1.000 26.179  0 597  LEU   A CB   1 ? 1 
ATOM   8258  C  CG   . LEU   A  1  542 ? -21.222 9.289   -14.281 1.000 28.664  0 597  LEU   A CG   1 ? 1 
ATOM   8259  C  CD1  . LEU   A  1  542 ? -21.684 8.578   -13.062 1.000 26.494  0 597  LEU   A CD1  1 ? 1 
ATOM   8260  C  CD2  . LEU   A  1  542 ? -22.348 10.214  -14.791 1.000 31.045  0 597  LEU   A CD2  1 ? 1 
ATOM   8261  H  H    . LEU   A  1  542 ? -18.771 9.249   -16.029 1.000 28.617  0 597  LEU   A H    1 c 1 
ATOM   8262  H  HA   . LEU   A  1  542 ? -20.139 11.538  -15.489 1.000 27.494  0 597  LEU   A HA   1 c 1 
ATOM   8263  H  HB2  . LEU   A  1  542 ? -19.228 9.438   -13.784 1.000 26.065  0 597  LEU   A HB2  1 c 1 
ATOM   8264  H  HB3  . LEU   A  1  542 ? -20.079 10.636  -13.221 1.000 26.555  0 597  LEU   A HB3  1 c 1 
ATOM   8265  H  HG   . LEU   A  1  542 ? -21.033 8.615   -14.980 1.000 28.062  0 597  LEU   A HG   1 c 1 
ATOM   8266  H  HD11 . LEU   A  1  542 ? -22.351 7.912   -13.307 1.000 27.286  0 597  LEU   A HD11 1 c 1 
ATOM   8267  H  HD12 . LEU   A  1  542 ? -22.076 9.217   -12.445 1.000 27.300  0 597  LEU   A HD12 1 c 1 
ATOM   8268  H  HD13 . LEU   A  1  542 ? -20.928 8.139   -12.636 1.000 26.540  0 597  LEU   A HD13 1 c 1 
ATOM   8269  H  HD21 . LEU   A  1  542 ? -22.156 10.486  -15.705 1.000 30.857  0 597  LEU   A HD21 1 c 1 
ATOM   8270  H  HD22 . LEU   A  1  542 ? -22.403 11.002  -14.223 1.000 30.704  0 597  LEU   A HD22 1 c 1 
ATOM   8271  H  HD23 . LEU   A  1  542 ? -23.196 9.737   -14.768 1.000 30.871  0 597  LEU   A HD23 1 c 1 
ATOM   8272  N  N    . TYR   A  1  543 ? -17.047 11.552  -14.762 1.000 23.770  0 598  TYR   A N    1 ? 1 
ATOM   8273  C  CA   . TYR   A  1  543 ? -15.966 12.254  -14.089 1.000 32.889  0 598  TYR   A CA   1 ? 1 
ATOM   8274  C  C    . TYR   A  1  543 ? -14.941 12.766  -15.102 1.000 25.826  0 598  TYR   A C    1 ? 1 
ATOM   8275  O  O    . TYR   A  1  543 ? -13.754 12.919  -14.805 1.000 33.236  0 598  TYR   A O    1 ? 1 
ATOM   8276  C  CB   . TYR   A  1  543 ? -15.322 11.321  -13.023 1.000 26.045  0 598  TYR   A CB   1 ? 1 
ATOM   8277  C  CG   . TYR   A  1  543 ? -16.339 10.458  -12.314 1.000 28.447  0 598  TYR   A CG   1 ? 1 
ATOM   8278  C  CD1  . TYR   A  1  543 ? -17.215 11.006  -11.373 1.000 26.881  0 598  TYR   A CD1  1 ? 1 
ATOM   8279  C  CD2  . TYR   A  1  543 ? -16.466 9.100   -12.622 1.000 26.813  0 598  TYR   A CD2  1 ? 1 
ATOM   8280  C  CE1  . TYR   A  1  543 ? -18.171 10.221  -10.739 1.000 25.067  0 598  TYR   A CE1  1 ? 1 
ATOM   8281  C  CE2  . TYR   A  1  543 ? -17.409 8.305   -11.987 1.000 29.480  0 598  TYR   A CE2  1 ? 1 
ATOM   8282  C  CZ   . TYR   A  1  543 ? -18.267 8.868   -11.051 1.000 30.927  0 598  TYR   A CZ   1 ? 1 
ATOM   8283  O  OH   . TYR   A  1  543 ? -19.200 8.063   -10.439 1.000 31.794  0 598  TYR   A OH   1 ? 1 
ATOM   8284  H  H    . TYR   A  1  543 ? -16.843 10.854  -15.315 1.000 25.790  0 598  TYR   A H    1 c 1 
ATOM   8285  H  HA   . TYR   A  1  543 ? -16.346 13.038  -13.620 1.000 28.452  0 598  TYR   A HA   1 c 1 
ATOM   8286  H  HB2  . TYR   A  1  543 ? -14.660 10.747  -13.460 1.000 27.620  0 598  TYR   A HB2  1 c 1 
ATOM   8287  H  HB3  . TYR   A  1  543 ? -14.855 11.874  -12.363 1.000 27.698  0 598  TYR   A HB3  1 c 1 
ATOM   8288  H  HD1  . TYR   A  1  543 ? -17.155 11.923  -11.162 1.000 27.044  0 598  TYR   A HD1  1 c 1 
ATOM   8289  H  HD2  . TYR   A  1  543 ? -15.888 8.713   -13.257 1.000 27.615  0 598  TYR   A HD2  1 c 1 
ATOM   8290  H  HE1  . TYR   A  1  543 ? -18.749 10.601  -10.099 1.000 27.026  0 598  TYR   A HE1  1 c 1 
ATOM   8291  H  HE2  . TYR   A  1  543 ? -17.477 7.389   -12.199 1.000 28.895  0 598  TYR   A HE2  1 c 1 
ATOM   8292  H  HH   . TYR   A  1  543 ? -19.733 8.402   -9.846  0.000 22.240  0 598  TYR   A HH   1 c 1 
ATOM   8293  N  N    . GLY   A  1  544 ? -15.417 13.029  -16.309 1.000 32.593  0 599  GLY   A N    1 ? 1 
ATOM   8294  C  CA   . GLY   A  1  544 ? -14.541 13.445  -17.388 1.000 29.821  0 599  GLY   A CA   1 ? 1 
ATOM   8295  C  C    . GLY   A  1  544 ? -13.935 12.241  -18.091 1.000 23.972  0 599  GLY   A C    1 ? 1 
ATOM   8296  O  O    . GLY   A  1  544 ? -13.950 11.131  -17.584 1.000 26.445  0 599  GLY   A O    1 ? 1 
ATOM   8297  H  H    . GLY   A  1  544 ? -16.313 12.961  -16.470 1.000 30.545  0 599  GLY   A H    1 c 1 
ATOM   8298  H  HA2  . GLY   A  1  544 ? -15.062 13.979  -18.039 1.000 29.515  0 599  GLY   A HA2  1 c 1 
ATOM   8299  H  HA3  . GLY   A  1  544 ? -13.819 14.017  -17.026 1.000 28.893  0 599  GLY   A HA3  1 c 1 
ATOM   8300  N  N    . ARG   A  1  545 ? -13.389 12.492  -19.270 1.000 23.371  0 600  ARG   A N    1 ? 1 
ATOM   8301  C  CA   . ARG   A  1  545 ? -12.593 11.525  -19.985 1.000 27.274  0 600  ARG   A CA   1 ? 1 
ATOM   8302  C  C    . ARG   A  1  545 ? -11.323 11.272  -19.179 1.000 26.882  0 600  ARG   A C    1 ? 1 
ATOM   8303  O  O    . ARG   A  1  545 ? -10.744 12.226  -18.666 1.000 25.244  0 600  ARG   A O    1 ? 1 
ATOM   8304  C  CB   . ARG   A  1  545 ? -12.275 12.155  -21.351 1.000 32.576  0 600  ARG   A CB   1 ? 1 
ATOM   8305  C  CG   . ARG   A  1  545 ? -11.641 11.226  -22.335 1.000 52.910  0 600  ARG   A CG   1 ? 1 
ATOM   8306  C  CD   . ARG   A  1  545 ? -11.589 11.843  -23.728 1.000 48.161  0 600  ARG   A CD   1 ? 1 
ATOM   8307  N  NE   . ARG   A  1  545 ? -10.965 13.165  -23.747 1.000 40.452  0 600  ARG   A NE   1 ? 1 
ATOM   8308  C  CZ   . ARG   A  1  545 ? -9.663  13.381  -23.649 1.000 36.488  0 600  ARG   A CZ   1 ? 1 
ATOM   8309  N  NH1  . ARG   A  1  545 ? -8.841  12.437  -23.216 1.000 46.030  0 600  ARG   A NH1  1 ? 1 
ATOM   8310  N  NH2  . ARG   A  1  545 ? -9.177  14.578  -23.969 1.000 34.509  0 600  ARG   A NH2  1 ? 1 
ATOM   8311  H  H    . ARG   A  1  545 ? -13.519 13.315  -19.646 1.000 25.023  0 600  ARG   A H    1 c 1 
ATOM   8312  H  HA   . ARG   A  1  545 ? -13.101 10.693  -20.101 1.000 27.195  0 600  ARG   A HA   1 c 1 
ATOM   8313  H  HB2  . ARG   A  1  545 ? -13.109 12.497  -21.736 1.000 35.280  0 600  ARG   A HB2  1 c 1 
ATOM   8314  H  HB3  . ARG   A  1  545 ? -11.677 12.918  -21.207 1.000 34.953  0 600  ARG   A HB3  1 c 1 
ATOM   8315  H  HG2  . ARG   A  1  545 ? -10.730 11.013  -22.043 1.000 45.112  0 600  ARG   A HG2  1 c 1 
ATOM   8316  H  HG3  . ARG   A  1  545 ? -12.153 10.391  -22.373 1.000 45.568  0 600  ARG   A HG3  1 c 1 
ATOM   8317  H  HD2  . ARG   A  1  545 ? -11.085 11.248  -24.318 1.000 46.851  0 600  ARG   A HD2  1 c 1 
ATOM   8318  H  HD3  . ARG   A  1  545 ? -12.501 11.914  -24.081 1.000 47.541  0 600  ARG   A HD3  1 c 1 
ATOM   8319  H  HE   . ARG   A  1  545 ? -11.487 13.860  -23.827 1.000 41.396  0 600  ARG   A HE   1 c 1 
ATOM   8320  H  HH11 . ARG   A  1  545 ? -8.798  11.663  -23.637 1.000 42.493  0 600  ARG   A HH11 1 c 1 
ATOM   8321  H  HH12 . ARG   A  1  545 ? -8.335  12.586  -22.510 1.000 42.208  0 600  ARG   A HH12 1 c 1 
ATOM   8322  H  HH21 . ARG   A  1  545 ? -8.337  14.770  -23.794 1.000 35.185  0 600  ARG   A HH21 1 c 1 
ATOM   8323  H  HH22 . ARG   A  1  545 ? -9.696  15.174  -24.355 1.000 35.786  0 600  ARG   A HH22 1 c 1 
ATOM   8324  N  N    . PRO   A  1  546 ? -10.833 10.018  -19.051 1.000 22.531  0 601  PRO   A N    1 ? 1 
ATOM   8325  C  CA   . PRO   A  1  546 ? -9.470  9.782   -18.572 1.000 27.630  0 601  PRO   A CA   1 ? 1 
ATOM   8326  C  C    . PRO   A  1  546 ? -8.437  10.428  -19.495 1.000 31.065  0 601  PRO   A C    1 ? 1 
ATOM   8327  O  O    . PRO   A  1  546 ? -8.597  10.439  -20.723 1.000 28.830  0 601  PRO   A O    1 ? 1 
ATOM   8328  C  CB   . PRO   A  1  546 ? -9.350  8.241   -18.591 1.000 28.526  0 601  PRO   A CB   1 ? 1 
ATOM   8329  C  CG   . PRO   A  1  546 ? -10.764 7.747   -18.650 1.000 24.872  0 601  PRO   A CG   1 ? 1 
ATOM   8330  C  CD   . PRO   A  1  546 ? -11.526 8.768   -19.408 1.000 23.495  0 601  PRO   A CD   1 ? 1 
ATOM   8331  H  HA   . PRO   A  1  546 ? -9.376  10.119  -17.646 1.000 26.811  0 601  PRO   A HA   1 c 1 
ATOM   8332  H  HB2  . PRO   A  1  546 ? -8.843  7.938   -19.375 1.000 27.434  0 601  PRO   A HB2  1 c 1 
ATOM   8333  H  HB3  . PRO   A  1  546 ? -8.902  7.915   -17.781 1.000 26.913  0 601  PRO   A HB3  1 c 1 
ATOM   8334  H  HG2  . PRO   A  1  546 ? -10.807 6.881   -19.104 1.000 25.163  0 601  PRO   A HG2  1 c 1 
ATOM   8335  H  HG3  . PRO   A  1  546 ? -11.130 7.645   -17.748 1.000 24.946  0 601  PRO   A HG3  1 c 1 
ATOM   8336  H  HD2  . PRO   A  1  546 ? -11.482 8.603   -20.368 1.000 23.939  0 601  PRO   A HD2  1 c 1 
ATOM   8337  H  HD3  . PRO   A  1  546 ? -12.459 8.790   -19.128 1.000 23.833  0 601  PRO   A HD3  1 c 1 
ATOM   8338  N  N    . ALA   A  1  547 ? -7.367  10.976  -18.912 1.000 28.923  0 602  ALA   A N    1 ? 1 
ATOM   8339  C  CA   . ALA   A  1  547 ? -6.279  11.489  -19.736 1.000 21.421  0 602  ALA   A CA   1 ? 1 
ATOM   8340  C  C    . ALA   A  1  547 ? -5.274  10.374  -19.992 1.000 18.316  0 602  ALA   A C    1 ? 1 
ATOM   8341  O  O    . ALA   A  1  547 ? -5.048  9.503   -19.152 1.000 22.414  0 602  ALA   A O    1 ? 1 
ATOM   8342  C  CB   . ALA   A  1  547 ? -5.642  12.676  -19.083 1.000 23.442  0 602  ALA   A CB   1 ? 1 
ATOM   8343  H  H    . ALA   A  1  547 ? -7.310  11.032  -18.002 1.000 26.881  0 602  ALA   A H    1 c 1 
ATOM   8344  H  HA   . ALA   A  1  547 ? -6.652  11.775  -20.602 1.000 22.904  0 602  ALA   A HA   1 c 1 
ATOM   8345  H  HB1  . ALA   A  1  547 ? -4.857  12.944  -19.589 1.000 23.000  0 602  ALA   A HB1  1 c 1 
ATOM   8346  H  HB2  . ALA   A  1  547 ? -6.276  13.413  -19.058 1.000 23.135  0 602  ALA   A HB2  1 c 1 
ATOM   8347  H  HB3  . ALA   A  1  547 ? -5.378  12.446  -18.176 1.000 22.461  0 602  ALA   A HB3  1 c 1 
ATOM   8348  N  N    . VAL   A  1  548 ? -4.662  10.408  -21.175 1.000 20.814  0 603  VAL   A N    1 ? 1 
ATOM   8349  C  CA   . VAL   A  1  548 ? -3.609  9.474   -21.526 1.000 22.470  0 603  VAL   A CA   1 ? 1 
ATOM   8350  C  C    . VAL   A  1  548 ? -2.287  10.194  -21.312 1.000 25.086  0 603  VAL   A C    1 ? 1 
ATOM   8351  O  O    . VAL   A  1  548 ? -2.032  11.199  -21.965 1.000 18.688  0 603  VAL   A O    1 ? 1 
ATOM   8352  C  CB   . VAL   A  1  548 ? -3.810  8.970   -22.964 1.000 25.680  0 603  VAL   A CB   1 ? 1 
ATOM   8353  C  CG1  . VAL   A  1  548 ? -2.616  8.138   -23.442 1.000 24.322  0 603  VAL   A CG1  1 ? 1 
ATOM   8354  C  CG2  . VAL   A  1  548 ? -5.131  8.187   -23.065 1.000 22.482  0 603  VAL   A CG2  1 ? 1 
ATOM   8355  H  H    . VAL   A  1  548 ? -4.910  11.038  -21.788 1.000 21.073  0 603  VAL   A H    1 c 1 
ATOM   8356  H  HA   . VAL   A  1  548 ? -3.653  8.712   -20.922 1.000 22.550  0 603  VAL   A HA   1 c 1 
ATOM   8357  H  HB   . VAL   A  1  548 ? -3.882  9.763   -23.550 1.000 24.705  0 603  VAL   A HB   1 c 1 
ATOM   8358  H  HG11 . VAL   A  1  548 ? -2.370  7.496   -22.754 1.000 24.315  0 603  VAL   A HG11 1 c 1 
ATOM   8359  H  HG12 . VAL   A  1  548 ? -1.862  8.725   -23.622 1.000 24.933  0 603  VAL   A HG12 1 c 1 
ATOM   8360  H  HG13 . VAL   A  1  548 ? -2.857  7.663   -24.257 1.000 24.973  0 603  VAL   A HG13 1 c 1 
ATOM   8361  H  HG21 . VAL   A  1  548 ? -5.285  7.929   -23.990 1.000 23.674  0 603  VAL   A HG21 1 c 1 
ATOM   8362  H  HG22 . VAL   A  1  548 ? -5.867  8.746   -22.759 1.000 23.363  0 603  VAL   A HG22 1 c 1 
ATOM   8363  H  HG23 . VAL   A  1  548 ? -5.079  7.390   -22.512 1.000 22.943  0 603  VAL   A HG23 1 c 1 
ATOM   8364  N  N    . LEU   A  1  549 ? -1.441  9.627   -20.447 1.000 19.757  0 604  LEU   A N    1 ? 1 
ATOM   8365  C  CA   . LEU   A  1  549 ? -0.236  10.281  -19.975 1.000 25.880  0 604  LEU   A CA   1 ? 1 
ATOM   8366  C  C    . LEU   A  1  549 ? 1.000   9.703   -20.654 1.000 30.090  0 604  LEU   A C    1 ? 1 
ATOM   8367  O  O    . LEU   A  1  549 ? 2.112   9.791   -20.125 1.000 28.227  0 604  LEU   A O    1 ? 1 
ATOM   8368  C  CB   . LEU   A  1  549 ? -0.109  10.111  -18.433 1.000 22.597  0 604  LEU   A CB   1 ? 1 
ATOM   8369  C  CG   . LEU   A  1  549 ? -1.158  10.802  -17.606 1.000 24.336  0 604  LEU   A CG   1 ? 1 
ATOM   8370  C  CD1  . LEU   A  1  549 ? -0.754  10.766  -16.111 1.000 28.684  0 604  LEU   A CD1  1 ? 1 
ATOM   8371  C  CD2  . LEU   A  1  549 ? -1.421  12.282  -18.120 1.000 29.261  0 604  LEU   A CD2  1 ? 1 
ATOM   8372  H  H    . LEU   A  1  549 ? -1.625  8.787   -20.138 1.000 21.743  0 604  LEU   A H    1 c 1 
ATOM   8373  H  HA   . LEU   A  1  549 ? -0.292  11.239  -20.195 1.000 24.885  0 604  LEU   A HA   1 c 1 
ATOM   8374  H  HB2  . LEU   A  1  549 ? -0.132  9.155   -18.226 1.000 23.300  0 604  LEU   A HB2  1 c 1 
ATOM   8375  H  HB3  . LEU   A  1  549 ? 0.767   10.448  -18.158 1.000 23.687  0 604  LEU   A HB3  1 c 1 
ATOM   8376  H  HG   . LEU   A  1  549 ? -2.001  10.295  -17.703 1.000 25.374  0 604  LEU   A HG   1 c 1 
ATOM   8377  H  HD11 . LEU   A  1  549 ? -1.512  11.031  -15.562 1.000 26.970  0 604  LEU   A HD11 1 c 1 
ATOM   8378  H  HD12 . LEU   A  1  549 ? -0.015  11.381  -15.959 1.000 27.246  0 604  LEU   A HD12 1 c 1 
ATOM   8379  H  HD13 . LEU   A  1  549 ? -0.479  9.865   -15.870 1.000 26.830  0 604  LEU   A HD13 1 c 1 
ATOM   8380  H  HD21 . LEU   A  1  549 ? -1.949  12.254  -18.937 1.000 28.146  0 604  LEU   A HD21 1 c 1 
ATOM   8381  H  HD22 . LEU   A  1  549 ? -0.571  12.721  -18.297 1.000 28.092  0 604  LEU   A HD22 1 c 1 
ATOM   8382  H  HD23 . LEU   A  1  549 ? -1.907  12.780  -17.439 1.000 27.812  0 604  LEU   A HD23 1 c 1 
ATOM   8383  N  N    . TYR   A  1  550 ? 0.802   9.138   -21.845 1.000 25.328  0 605  TYR   A N    1 ? 1 
ATOM   8384  C  CA   . TYR   A  1  550 ? 1.909   8.671   -22.653 1.000 21.955  0 605  TYR   A CA   1 ? 1 
ATOM   8385  C  C    . TYR   A  1  550 ? 1.584   8.936   -24.118 1.000 27.267  0 605  TYR   A C    1 ? 1 
ATOM   8386  O  O    . TYR   A  1  550 ? 0.435   9.234   -24.435 1.000 27.720  0 605  TYR   A O    1 ? 1 
ATOM   8387  C  CB   . TYR   A  1  550 ? 2.197   7.207   -22.335 1.000 24.945  0 605  TYR   A CB   1 ? 1 
ATOM   8388  C  CG   . TYR   A  1  550 ? 1.107   6.216   -22.656 1.000 21.467  0 605  TYR   A CG   1 ? 1 
ATOM   8389  C  CD1  . TYR   A  1  550 ? 0.052   6.000   -21.785 1.000 24.008  0 605  TYR   A CD1  1 ? 1 
ATOM   8390  C  CD2  . TYR   A  1  550 ? 1.127   5.496   -23.847 1.000 29.427  0 605  TYR   A CD2  1 ? 1 
ATOM   8391  C  CE1  . TYR   A  1  550 ? -0.956  5.064   -22.083 1.000 26.222  0 605  TYR   A CE1  1 ? 1 
ATOM   8392  C  CE2  . TYR   A  1  550 ? 0.139   4.565   -24.155 1.000 25.245  0 605  TYR   A CE2  1 ? 1 
ATOM   8393  C  CZ   . TYR   A  1  550 ? -0.906  4.347   -23.278 1.000 25.912  0 605  TYR   A CZ   1 ? 1 
ATOM   8394  O  OH   . TYR   A  1  550 ? -1.859  3.403   -23.644 1.000 21.526  0 605  TYR   A OH   1 ? 1 
ATOM   8395  H  H    . TYR   A  1  550 ? -0.047  9.036   -22.165 1.000 25.443  0 605  TYR   A H    1 c 1 
ATOM   8396  H  HA   . TYR   A  1  550 ? 2.713   9.202   -22.420 1.000 24.164  0 605  TYR   A HA   1 c 1 
ATOM   8397  H  HB2  . TYR   A  1  550 ? 3.005   6.946   -22.825 1.000 23.594  0 605  TYR   A HB2  1 c 1 
ATOM   8398  H  HB3  . TYR   A  1  550 ? 2.402   7.141   -21.379 1.000 22.935  0 605  TYR   A HB3  1 c 1 
ATOM   8399  H  HD1  . TYR   A  1  550 ? 0.016   6.476   -20.972 1.000 23.521  0 605  TYR   A HD1  1 c 1 
ATOM   8400  H  HD2  . TYR   A  1  550 ? 1.839   5.626   -24.451 1.000 26.695  0 605  TYR   A HD2  1 c 1 
ATOM   8401  H  HE1  . TYR   A  1  550 ? -1.665  4.923   -21.479 1.000 25.242  0 605  TYR   A HE1  1 c 1 
ATOM   8402  H  HE2  . TYR   A  1  550 ? 0.180   4.083   -24.965 1.000 26.614  0 605  TYR   A HE2  1 c 1 
ATOM   8403  H  HH   . TYR   A  1  550 ? -2.516  3.245   -23.117 0.000 12.310  0 605  TYR   A HH   1 c 1 
ATOM   8404  N  N    . ARG   A  1  551 ? 2.609   8.860   -24.987 1.000 28.065  0 606  ARG   A N    1 ? 1 
ATOM   8405  C  CA   . ARG   A  1  551 ? 2.456   9.147   -26.399 1.000 26.075  0 606  ARG   A CA   1 ? 1 
ATOM   8406  C  C    . ARG   A  1  551 ? 1.840   7.919   -27.053 1.000 21.899  0 606  ARG   A C    1 ? 1 
ATOM   8407  O  O    . ARG   A  1  551 ? 2.432   6.856   -27.048 1.000 21.068  0 606  ARG   A O    1 ? 1 
ATOM   8408  C  CB   . ARG   A  1  551 ? 3.815   9.567   -27.060 1.000 31.700  0 606  ARG   A CB   1 ? 1 
ATOM   8409  C  CG   . ARG   A  1  551 ? 3.912   11.079  -27.258 1.000 47.314  0 606  ARG   A CG   1 ? 1 
ATOM   8410  C  CD   . ARG   A  1  551 ? 5.311   11.553  -27.606 1.000 67.849  0 606  ARG   A CD   1 ? 1 
ATOM   8411  N  NE   . ARG   A  1  551 ? 6.072   12.023  -26.449 1.000 63.103  0 606  ARG   A NE   1 ? 1 
ATOM   8412  C  CZ   . ARG   A  1  551 ? 5.805   13.130  -25.758 1.000 72.024  0 606  ARG   A CZ   1 ? 1 
ATOM   8413  N  NH1  . ARG   A  1  551 ? 4.962   14.050  -26.211 1.000 63.039  0 606  ARG   A NH1  1 ? 1 
ATOM   8414  N  NH2  . ARG   A  1  551 ? 6.401   13.319  -24.582 1.000 53.863  0 606  ARG   A NH2  1 ? 1 
ATOM   8415  H  H    . ARG   A  1  551 ? 3.433   8.615   -24.676 1.000 27.266  0 606  ARG   A H    1 c 1 
ATOM   8416  H  HA   . ARG   A  1  551 ? 1.828   9.897   -26.490 1.000 26.663  0 606  ARG   A HA   1 c 1 
ATOM   8417  H  HB2  . ARG   A  1  551 ? 4.555   9.269   -26.492 1.000 32.786  0 606  ARG   A HB2  1 c 1 
ATOM   8418  H  HB3  . ARG   A  1  551 ? 3.899   9.123   -27.930 1.000 33.352  0 606  ARG   A HB3  1 c 1 
ATOM   8419  H  HG2  . ARG   A  1  551 ? 3.301   11.347  -27.977 1.000 46.765  0 606  ARG   A HG2  1 c 1 
ATOM   8420  H  HG3  . ARG   A  1  551 ? 3.621   11.529  -26.437 1.000 46.147  0 606  ARG   A HG3  1 c 1 
ATOM   8421  H  HD2  . ARG   A  1  551 ? 5.801   10.814  -28.028 1.000 61.323  0 606  ARG   A HD2  1 c 1 
ATOM   8422  H  HD3  . ARG   A  1  551 ? 5.249   12.278  -28.264 1.000 61.990  0 606  ARG   A HD3  1 c 1 
ATOM   8423  H  HE   . ARG   A  1  551 ? 6.754   11.544  -26.193 1.000 65.856  0 606  ARG   A HE   1 c 1 
ATOM   8424  H  HH11 . ARG   A  1  551 ? 4.639   13.991  -27.028 1.000 66.025  0 606  ARG   A HH11 1 c 1 
ATOM   8425  H  HH12 . ARG   A  1  551 ? 4.727   14.723  -25.692 1.000 65.511  0 606  ARG   A HH12 1 c 1 
ATOM   8426  H  HH21 . ARG   A  1  551 ? 6.279   14.072  -24.144 1.000 58.793  0 606  ARG   A HH21 1 c 1 
ATOM   8427  H  HH22 . ARG   A  1  551 ? 6.915   12.691  -24.245 1.000 58.569  0 606  ARG   A HH22 1 c 1 
ATOM   8428  N  N    . THR   A  1  552 ? 0.666   8.081   -27.650 1.000 28.841  0 607  THR   A N    1 ? 1 
ATOM   8429  C  CA   . THR   A  1  552 ? 0.022   6.992   -28.360 1.000 26.942  0 607  THR   A CA   1 ? 1 
ATOM   8430  C  C    . THR   A  1  552 ? -1.006  7.594   -29.298 1.000 28.876  0 607  THR   A C    1 ? 1 
ATOM   8431  O  O    . THR   A  1  552 ? -1.244  8.800   -29.239 1.000 32.743  0 607  THR   A O    1 ? 1 
ATOM   8432  C  CB   . THR   A  1  552 ? -0.616  5.981   -27.354 1.000 30.449  0 607  THR   A CB   1 ? 1 
ATOM   8433  O  OG1  . THR   A  1  552 ? -0.779  4.717   -28.020 1.000 26.845  0 607  THR   A OG1  1 ? 1 
ATOM   8434  C  CG2  . THR   A  1  552 ? -1.908  6.484   -26.797 1.000 32.737  0 607  THR   A CG2  1 ? 1 
ATOM   8435  H  H    . THR   A  1  552 ? 0.248   8.893   -27.613 1.000 26.622  0 607  THR   A H    1 c 1 
ATOM   8436  H  HA   . THR   A  1  552 ? 0.703   6.523   -28.896 1.000 28.428  0 607  THR   A HA   1 c 1 
ATOM   8437  H  HB   . THR   A  1  552 ? 0.016   5.858   -26.607 1.000 28.813  0 607  THR   A HB   1 c 1 
ATOM   8438  H  HG1  . THR   A  1  552 ? -1.295  4.822   -28.689 0.000 15.030  0 607  THR   A HG1  1 c 1 
ATOM   8439  H  HG21 . THR   A  1  552 ? -2.156  5.951   -26.021 1.000 31.479  0 607  THR   A HG21 1 c 1 
ATOM   8440  H  HG22 . THR   A  1  552 ? -2.606  6.413   -27.473 1.000 32.221  0 607  THR   A HG22 1 c 1 
ATOM   8441  H  HG23 . THR   A  1  552 ? -1.807  7.416   -26.531 1.000 31.964  0 607  THR   A HG23 1 c 1 
ATOM   8442  N  N    . SER   A  1  553 ? -1.615  6.748   -30.146 1.000 25.921  0 608  SER   A N    1 ? 1 
ATOM   8443  C  CA   . SER   A  1  553 ? -2.731  7.189   -30.966 1.000 29.185  0 608  SER   A CA   1 ? 1 
ATOM   8444  C  C    . SER   A  1  553 ? -3.972  6.399   -30.569 1.000 28.802  0 608  SER   A C    1 ? 1 
ATOM   8445  O  O    . SER   A  1  553 ? -3.948  5.164   -30.544 1.000 26.954  0 608  SER   A O    1 ? 1 
ATOM   8446  C  CB   . SER   A  1  553 ? -2.408  7.082   -32.454 1.000 28.597  0 608  SER   A CB   1 ? 1 
ATOM   8447  O  OG   . SER   A  1  553 ? -2.532  5.770   -32.923 1.000 42.038  0 608  SER   A OG   1 ? 1 
ATOM   8448  H  H    . SER   A  1  553 ? -1.328  5.883   -30.211 1.000 27.132  0 608  SER   A H    1 c 1 
ATOM   8449  H  HA   . SER   A  1  553 ? -2.899  8.144   -30.761 1.000 28.523  0 608  SER   A HA   1 c 1 
ATOM   8450  H  HB2  . SER   A  1  553 ? -3.016  7.667   -32.960 1.000 31.884  0 608  SER   A HB2  1 c 1 
ATOM   8451  H  HB3  . SER   A  1  553 ? -1.488  7.396   -32.608 1.000 31.662  0 608  SER   A HB3  1 c 1 
ATOM   8452  H  HG   . SER   A  1  553 ? -3.316  5.653   -33.185 0.000 26.000  0 608  SER   A HG   1 c 1 
ATOM   8453  N  N    . TYR   A  1  554 ? -5.026  7.125   -30.177 1.000 26.462  0 609  TYR   A N    1 ? 1 
ATOM   8454  C  CA   . TYR   A  1  554 ? -6.268  6.489   -29.770 1.000 28.059  0 609  TYR   A CA   1 ? 1 
ATOM   8455  C  C    . TYR   A  1  554 ? -7.475  7.333   -30.171 1.000 24.753  0 609  TYR   A C    1 ? 1 
ATOM   8456  O  O    . TYR   A  1  554 ? -7.337  8.517   -30.487 1.000 24.683  0 609  TYR   A O    1 ? 1 
ATOM   8457  C  CB   . TYR   A  1  554 ? -6.265  6.171   -28.278 1.000 26.841  0 609  TYR   A CB   1 ? 1 
ATOM   8458  C  CG   . TYR   A  1  554 ? -6.500  7.364   -27.393 1.000 25.473  0 609  TYR   A CG   1 ? 1 
ATOM   8459  C  CD1  . TYR   A  1  554 ? -5.505  8.317   -27.190 1.000 28.420  0 609  TYR   A CD1  1 ? 1 
ATOM   8460  C  CD2  . TYR   A  1  554 ? -7.725  7.572   -26.790 1.000 24.420  0 609  TYR   A CD2  1 ? 1 
ATOM   8461  C  CE1  . TYR   A  1  554 ? -5.722  9.422   -26.386 1.000 26.301  0 609  TYR   A CE1  1 ? 1 
ATOM   8462  C  CE2  . TYR   A  1  554 ? -7.950  8.679   -25.980 1.000 27.932  0 609  TYR   A CE2  1 ? 1 
ATOM   8463  C  CZ   . TYR   A  1  554 ? -6.940  9.592   -25.767 1.000 30.116  0 609  TYR   A CZ   1 ? 1 
ATOM   8464  O  OH   . TYR   A  1  554 ? -7.151  10.676  -24.952 1.000 42.441  0 609  TYR   A OH   1 ? 1 
ATOM   8465  H  H    . TYR   A  1  554 ? -4.970  8.038   -30.162 1.000 27.564  0 609  TYR   A H    1 c 1 
ATOM   8466  H  HA   . TYR   A  1  554 ? -6.337  5.631   -30.259 1.000 26.890  0 609  TYR   A HA   1 c 1 
ATOM   8467  H  HB2  . TYR   A  1  554 ? -6.959  5.503   -28.099 1.000 26.428  0 609  TYR   A HB2  1 c 1 
ATOM   8468  H  HB3  . TYR   A  1  554 ? -5.400  5.772   -28.048 1.000 26.399  0 609  TYR   A HB3  1 c 1 
ATOM   8469  H  HD1  . TYR   A  1  554 ? -4.662  8.200   -27.596 1.000 27.379  0 609  TYR   A HD1  1 c 1 
ATOM   8470  H  HD2  . TYR   A  1  554 ? -8.417  6.945   -26.917 1.000 25.522  0 609  TYR   A HD2  1 c 1 
ATOM   8471  H  HE1  . TYR   A  1  554 ? -5.029  10.042  -26.240 1.000 27.677  0 609  TYR   A HE1  1 c 1 
ATOM   8472  H  HE2  . TYR   A  1  554 ? -8.784  8.792   -25.556 1.000 27.524  0 609  TYR   A HE2  1 c 1 
ATOM   8473  H  HH   . TYR   A  1  554 ? -6.516  11.248  -24.823 0.000 31.060  0 609  TYR   A HH   1 c 1 
ATOM   8474  N  N    . ASP   A  1  555 ? -8.637  6.668   -30.209 1.000 24.258  0 610  ASP   A N    1 ? 1 
ATOM   8475  C  CA   . ASP   A  1  555 ? -9.873  7.249   -30.687 1.000 24.803  0 610  ASP   A CA   1 ? 1 
ATOM   8476  C  C    . ASP   A  1  555 ? -10.919 7.231   -29.582 1.000 27.105  0 610  ASP   A C    1 ? 1 
ATOM   8477  O  O    . ASP   A  1  555 ? -11.027 6.245   -28.875 1.000 29.280  0 610  ASP   A O    1 ? 1 
ATOM   8478  C  CB   . ASP   A  1  555 ? -10.421 6.428   -31.852 1.000 25.996  0 610  ASP   A CB   1 ? 1 
ATOM   8479  C  CG   . ASP   A  1  555 ? -9.465  6.187   -32.986 1.000 35.104  0 610  ASP   A CG   1 ? 1 
ATOM   8480  O  OD1  . ASP   A  1  555 ? -8.641  7.062   -33.246 1.000 31.100  0 610  ASP   A OD1  1 ? 1 
ATOM   8481  O  OD2  . ASP   A  1  555 ? -9.596  5.145   -33.663 1.000 32.972  0 610  ASP   A OD2  1 ? 1 
ATOM   8482  H  H    . ASP   A  1  555 ? -8.653  5.802   -29.916 1.000 24.105  0 610  ASP   A H    1 c 1 
ATOM   8483  H  HA   . ASP   A  1  555 ? -9.711  8.173   -30.979 1.000 25.735  0 610  ASP   A HA   1 c 1 
ATOM   8484  H  HB2  . ASP   A  1  555 ? -10.710 5.556   -31.513 1.000 27.219  0 610  ASP   A HB2  1 c 1 
ATOM   8485  H  HB3  . ASP   A  1  555 ? -11.207 6.887   -32.213 1.000 27.913  0 610  ASP   A HB3  1 c 1 
ATOM   8486  N  N    . ILE   A  1  556 ? -11.722 8.291   -29.483 1.000 24.576  0 611  ILE   A N    1 ? 1 
ATOM   8487  C  CA   . ILE   A  1  556 ? -12.894 8.279   -28.622 1.000 27.604  0 611  ILE   A CA   1 ? 1 
ATOM   8488  C  C    . ILE   A  1  556 ? -14.024 7.708   -29.465 1.000 24.309  0 611  ILE   A C    1 ? 1 
ATOM   8489  O  O    . ILE   A  1  556 ? -14.318 8.249   -30.521 1.000 24.127  0 611  ILE   A O    1 ? 1 
ATOM   8490  C  CB   . ILE   A  1  556 ? -13.287 9.683   -28.096 1.000 30.539  0 611  ILE   A CB   1 ? 1 
ATOM   8491  C  CG1  . ILE   A  1  556 ? -12.185 10.311  -27.290 1.000 33.106  0 611  ILE   A CG1  1 ? 1 
ATOM   8492  C  CG2  . ILE   A  1  556 ? -14.588 9.646   -27.277 1.000 31.932  0 611  ILE   A CG2  1 ? 1 
ATOM   8493  C  CD1  . ILE   A  1  556 ? -11.614 9.458   -26.373 1.000 34.403  0 611  ILE   A CD1  1 ? 1 
ATOM   8494  H  H    . ILE   A  1  556 ? -11.536 9.046   -29.964 1.000 26.264  0 611  ILE   A H    1 c 1 
ATOM   8495  H  HA   . ILE   A  1  556 ? -12.732 7.691   -27.867 1.000 26.117  0 611  ILE   A HA   1 c 1 
ATOM   8496  H  HB   . ILE   A  1  556 ? -13.445 10.261  -28.883 1.000 31.350  0 611  ILE   A HB   1 c 1 
ATOM   8497  H  HG12 . ILE   A  1  556 ? -11.493 10.625  -27.904 1.000 33.066  0 611  ILE   A HG12 1 c 1 
ATOM   8498  H  HG13 . ILE   A  1  556 ? -12.543 11.092  -26.816 1.000 32.876  0 611  ILE   A HG13 1 c 1 
ATOM   8499  H  HG21 . ILE   A  1  556 ? -14.526 8.953   -26.596 1.000 31.011  0 611  ILE   A HG21 1 c 1 
ATOM   8500  H  HG22 . ILE   A  1  556 ? -15.340 9.454   -27.864 1.000 31.882  0 611  ILE   A HG22 1 c 1 
ATOM   8501  H  HG23 . ILE   A  1  556 ? -14.729 10.508  -26.847 1.000 31.575  0 611  ILE   A HG23 1 c 1 
ATOM   8502  H  HD11 . ILE   A  1  556 ? -11.132 8.752   -26.837 1.000 33.509  0 611  ILE   A HD11 1 c 1 
ATOM   8503  H  HD12 . ILE   A  1  556 ? -12.307 9.065   -25.814 1.000 33.470  0 611  ILE   A HD12 1 c 1 
ATOM   8504  H  HD13 . ILE   A  1  556 ? -10.992 9.952   -25.815 1.000 33.592  0 611  ILE   A HD13 1 c 1 
ATOM   8505  N  N    . LEU   A  1  557 ? -14.633 6.625   -28.982 1.000 27.244  0 612  LEU   A N    1 ? 1 
ATOM   8506  C  CA   . LEU   A  1  557 ? -15.767 5.995   -29.633 1.000 24.919  0 612  LEU   A CA   1 ? 1 
ATOM   8507  C  C    . LEU   A  1  557 ? -16.996 6.152   -28.743 1.000 26.679  0 612  LEU   A C    1 ? 1 
ATOM   8508  O  O    . LEU   A  1  557 ? -16.943 5.774   -27.577 1.000 22.541  0 612  LEU   A O    1 ? 1 
ATOM   8509  C  CB   . LEU   A  1  557 ? -15.448 4.519   -29.828 1.000 23.741  0 612  LEU   A CB   1 ? 1 
ATOM   8510  C  CG   . LEU   A  1  557 ? -14.211 4.233   -30.623 1.000 24.487  0 612  LEU   A CG   1 ? 1 
ATOM   8511  C  CD1  . LEU   A  1  557 ? -14.108 2.731   -30.903 1.000 23.196  0 612  LEU   A CD1  1 ? 1 
ATOM   8512  C  CD2  . LEU   A  1  557 ? -14.178 5.076   -31.982 1.000 26.634  0 612  LEU   A CD2  1 ? 1 
ATOM   8513  H  H    . LEU   A  1  557 ? -14.323 6.257   -28.205 1.000 25.236  0 612  LEU   A H    1 c 1 
ATOM   8514  H  HA   . LEU   A  1  557 ? -15.931 6.427   -30.501 1.000 26.156  0 612  LEU   A HA   1 c 1 
ATOM   8515  H  HB2  . LEU   A  1  557 ? -15.354 4.105   -28.948 1.000 23.633  0 612  LEU   A HB2  1 c 1 
ATOM   8516  H  HB3  . LEU   A  1  557 ? -16.208 4.096   -30.274 1.000 24.484  0 612  LEU   A HB3  1 c 1 
ATOM   8517  H  HG   . LEU   A  1  557 ? -13.429 4.497   -30.079 1.000 23.922  0 612  LEU   A HG   1 c 1 
ATOM   8518  H  HD11 . LEU   A  1  557 ? -13.210 2.519   -31.212 1.000 23.463  0 612  LEU   A HD11 1 c 1 
ATOM   8519  H  HD12 . LEU   A  1  557 ? -14.753 2.484   -31.589 1.000 24.017  0 612  LEU   A HD12 1 c 1 
ATOM   8520  H  HD13 . LEU   A  1  557 ? -14.296 2.234   -30.088 1.000 23.110  0 612  LEU   A HD13 1 c 1 
ATOM   8521  H  HD21 . LEU   A  1  557 ? -13.975 6.006   -31.785 1.000 26.243  0 612  LEU   A HD21 1 c 1 
ATOM   8522  H  HD22 . LEU   A  1  557 ? -15.045 5.020   -32.421 1.000 26.689  0 612  LEU   A HD22 1 c 1 
ATOM   8523  H  HD23 . LEU   A  1  557 ? -13.493 4.714   -32.571 1.000 26.344  0 612  LEU   A HD23 1 c 1 
ATOM   8524  N  N    . TYR   A  1  558 ? -18.077 6.729   -29.283 1.000 24.385  0 613  TYR   A N    1 ? 1 
ATOM   8525  C  CA   . TYR   A  1  558 ? -19.314 6.916   -28.541 1.000 23.788  0 613  TYR   A CA   1 ? 1 
ATOM   8526  C  C    . TYR   A  1  558 ? -20.348 5.879   -28.959 1.000 26.736  0 613  TYR   A C    1 ? 1 
ATOM   8527  O  O    . TYR   A  1  558 ? -20.395 5.484   -30.119 1.000 26.666  0 613  TYR   A O    1 ? 1 
ATOM   8528  C  CB   . TYR   A  1  558 ? -19.898 8.304   -28.794 1.000 23.805  0 613  TYR   A CB   1 ? 1 
ATOM   8529  C  CG   . TYR   A  1  558 ? -19.016 9.462   -28.425 1.000 31.968  0 613  TYR   A CG   1 ? 1 
ATOM   8530  C  CD1  . TYR   A  1  558 ? -18.819 9.814   -27.092 1.000 44.379  0 613  TYR   A CD1  1 ? 1 
ATOM   8531  C  CD2  . TYR   A  1  558 ? -18.356 10.206  -29.404 1.000 34.355  0 613  TYR   A CD2  1 ? 1 
ATOM   8532  C  CE1  . TYR   A  1  558 ? -18.010 10.889  -26.741 1.000 48.984  0 613  TYR   A CE1  1 ? 1 
ATOM   8533  C  CE2  . TYR   A  1  558 ? -17.535 11.279  -29.062 1.000 38.931  0 613  TYR   A CE2  1 ? 1 
ATOM   8534  C  CZ   . TYR   A  1  558 ? -17.376 11.624  -27.728 1.000 39.356  0 613  TYR   A CZ   1 ? 1 
ATOM   8535  O  OH   . TYR   A  1  558 ? -16.584 12.681  -27.359 1.000 44.750  0 613  TYR   A OH   1 ? 1 
ATOM   8536  H  H    . TYR   A  1  558 ? -18.041 7.018   -30.150 1.000 25.348  0 613  TYR   A H    1 c 1 
ATOM   8537  H  HA   . TYR   A  1  558 ? -19.132 6.816   -27.572 1.000 23.720  0 613  TYR   A HA   1 c 1 
ATOM   8538  H  HB2  . TYR   A  1  558 ? -20.119 8.372   -29.747 1.000 26.127  0 613  TYR   A HB2  1 c 1 
ATOM   8539  H  HB3  . TYR   A  1  558 ? -20.736 8.378   -28.291 1.000 25.614  0 613  TYR   A HB3  1 c 1 
ATOM   8540  H  HD1  . TYR   A  1  558 ? -19.259 9.327   -26.415 1.000 40.963  0 613  TYR   A HD1  1 c 1 
ATOM   8541  H  HD2  . TYR   A  1  558 ? -18.471 9.983   -30.312 1.000 35.346  0 613  TYR   A HD2  1 c 1 
ATOM   8542  H  HE1  . TYR   A  1  558 ? -17.899 11.123  -25.835 1.000 44.609  0 613  TYR   A HE1  1 c 1 
ATOM   8543  H  HE2  . TYR   A  1  558 ? -17.106 11.782  -29.735 1.000 38.329  0 613  TYR   A HE2  1 c 1 
ATOM   8544  H  HH   . TYR   A  1  558 ? -16.481 12.879  -26.526 0.000 25.580  0 613  TYR   A HH   1 c 1 
ATOM   8545  N  N    . HIS   A  1  559 ? -21.216 5.505   -28.013 1.000 26.157  0 614  HIS   A N    1 ? 1 
ATOM   8546  C  CA   . HIS   A  1  559 ? -22.337 4.618   -28.260 1.000 24.383  0 614  HIS   A CA   1 ? 1 
ATOM   8547  C  C    . HIS   A  1  559 ? -23.443 5.037   -27.299 1.000 25.752  0 614  HIS   A C    1 ? 1 
ATOM   8548  O  O    . HIS   A  1  559 ? -23.146 5.713   -26.319 1.000 23.728  0 614  HIS   A O    1 ? 1 
ATOM   8549  C  CB   . HIS   A  1  559 ? -21.939 3.143   -28.014 1.000 24.959  0 614  HIS   A CB   1 ? 1 
ATOM   8550  C  CG   . HIS   A  1  559 ? -20.554 2.810   -28.477 1.000 23.118  0 614  HIS   A CG   1 ? 1 
ATOM   8551  N  ND1  . HIS   A  1  559 ? -19.438 3.201   -27.745 1.000 26.253  0 614  HIS   A ND1  1 ? 1 
ATOM   8552  C  CD2  . HIS   A  1  559 ? -20.136 2.139   -29.565 1.000 23.312  0 614  HIS   A CD2  1 ? 1 
ATOM   8553  C  CE1  . HIS   A  1  559 ? -18.383 2.756   -28.401 1.000 23.812  0 614  HIS   A CE1  1 ? 1 
ATOM   8554  N  NE2  . HIS   A  1  559 ? -18.742 2.087   -29.485 1.000 24.400  0 614  HIS   A NE2  1 ? 1 
ATOM   8555  H  H    . HIS   A  1  559 ? -21.097 5.822   -27.164 1.000 25.311  0 614  HIS   A H    1 c 1 
ATOM   8556  H  HA   . HIS   A  1  559 ? -22.642 4.729   -29.191 1.000 25.792  0 614  HIS   A HA   1 c 1 
ATOM   8557  H  HB2  . HIS   A  1  559 ? -22.004 2.954   -27.055 1.000 23.977  0 614  HIS   A HB2  1 c 1 
ATOM   8558  H  HB3  . HIS   A  1  559 ? -22.575 2.564   -28.479 1.000 24.835  0 614  HIS   A HB3  1 c 1 
ATOM   8559  H  HD1  . HIS   A  1  559 ? -19.459 3.658   -26.984 0.000 11.060  0 614  HIS   A HD1  1 c 1 
ATOM   8560  H  HD2  . HIS   A  1  559 ? -20.683 1.744   -30.226 1.000 24.175  0 614  HIS   A HD2  1 c 1 
ATOM   8561  H  HE1  . HIS   A  1  559 ? -17.491 2.879   -28.122 1.000 23.887  0 614  HIS   A HE1  1 c 1 
ATOM   8562  H  HE2  . HIS   A  1  559 ? -18.187 1.711   -30.059 0.000 9.570   0 614  HIS   A HE2  1 c 1 
ATOM   8563  N  N    . THR   A  1  560 ? -24.691 4.607   -27.551 1.000 26.038  0 615  THR   A N    1 ? 1 
ATOM   8564  C  CA   . THR   A  1  560 ? -25.781 4.799   -26.593 1.000 28.155  0 615  THR   A CA   1 ? 1 
ATOM   8565  C  C    . THR   A  1  560 ? -25.386 4.400   -25.167 1.000 24.741  0 615  THR   A C    1 ? 1 
ATOM   8566  O  O    . THR   A  1  560 ? -25.607 5.149   -24.213 1.000 23.378  0 615  THR   A O    1 ? 1 
ATOM   8567  C  CB   . THR   A  1  560 ? -27.039 4.019   -27.011 1.000 30.520  0 615  THR   A CB   1 ? 1 
ATOM   8568  O  OG1  . THR   A  1  560 ? -27.347 4.334   -28.325 1.000 31.039  0 615  THR   A OG1  1 ? 1 
ATOM   8569  C  CG2  . THR   A  1  560 ? -28.246 4.351   -26.166 1.000 33.876  0 615  THR   A CG2  1 ? 1 
ATOM   8570  H  H    . THR   A  1  560 ? -24.868 4.182   -28.341 1.000 26.901  0 615  THR   A H    1 c 1 
ATOM   8571  H  HA   . THR   A  1  560 ? -26.004 5.759   -26.590 1.000 27.799  0 615  THR   A HA   1 c 1 
ATOM   8572  H  HB   . THR   A  1  560 ? -26.850 3.053   -26.943 1.000 30.372  0 615  THR   A HB   1 c 1 
ATOM   8573  H  HG1  . THR   A  1  560 ? -27.494 5.168   -28.381 0.000 11.750  0 615  THR   A HG1  1 c 1 
ATOM   8574  H  HG21 . THR   A  1  560 ? -29.036 3.930   -26.548 1.000 33.454  0 615  THR   A HG21 1 c 1 
ATOM   8575  H  HG22 . THR   A  1  560 ? -28.373 5.317   -26.145 1.000 33.145  0 615  THR   A HG22 1 c 1 
ATOM   8576  H  HG23 . THR   A  1  560 ? -28.112 4.023   -25.259 1.000 32.373  0 615  THR   A HG23 1 c 1 
ATOM   8577  N  N    . ASP   A  1  561 ? -24.791 3.215   -25.026 1.000 24.684  0 616  ASP   A N    1 ? 1 
ATOM   8578  C  CA   . ASP   A  1  561 ? -24.659 2.594   -23.720 1.000 23.697  0 616  ASP   A CA   1 ? 1 
ATOM   8579  C  C    . ASP   A  1  561 ? -23.267 2.694   -23.086 1.000 27.083  0 616  ASP   A C    1 ? 1 
ATOM   8580  O  O    . ASP   A  1  561 ? -23.110 2.349   -21.922 1.000 22.390  0 616  ASP   A O    1 ? 1 
ATOM   8581  C  CB   . ASP   A  1  561 ? -25.038 1.133   -23.835 1.000 24.610  0 616  ASP   A CB   1 ? 1 
ATOM   8582  C  CG   . ASP   A  1  561 ? -26.489 0.860   -24.117 1.000 27.207  0 616  ASP   A CG   1 ? 1 
ATOM   8583  O  OD1  . ASP   A  1  561 ? -27.301 1.791   -23.984 1.000 27.002  0 616  ASP   A OD1  1 ? 1 
ATOM   8584  O  OD2  . ASP   A  1  561 ? -26.815 -0.303  -24.427 1.000 28.689  0 616  ASP   A OD2  1 ? 1 
ATOM   8585  H  H    . ASP   A  1  561 ? -24.463 2.779   -25.759 1.000 24.604  0 616  ASP   A H    1 c 1 
ATOM   8586  H  HA   . ASP   A  1  561 ? -25.303 3.023   -23.110 1.000 24.746  0 616  ASP   A HA   1 c 1 
ATOM   8587  H  HB2  . ASP   A  1  561 ? -24.507 0.725   -24.549 1.000 24.816  0 616  ASP   A HB2  1 c 1 
ATOM   8588  H  HB3  . ASP   A  1  561 ? -24.810 0.683   -22.997 1.000 24.370  0 616  ASP   A HB3  1 c 1 
ATOM   8589  N  N    . PHE   A  1  562 ? -22.265 3.119   -23.861 1.000 23.870  0 617  PHE   A N    1 ? 1 
ATOM   8590  C  CA   . PHE   A  1  562 ? -20.905 3.198   -23.359 1.000 24.615  0 617  PHE   A CA   1 ? 1 
ATOM   8591  C  C    . PHE   A  1  562 ? -20.051 4.108   -24.236 1.000 25.053  0 617  PHE   A C    1 ? 1 
ATOM   8592  O  O    . PHE   A  1  562 ? -20.381 4.360   -25.400 1.000 27.048  0 617  PHE   A O    1 ? 1 
ATOM   8593  C  CB   . PHE   A  1  562 ? -20.265 1.814   -23.285 1.000 21.491  0 617  PHE   A CB   1 ? 1 
ATOM   8594  C  CG   . PHE   A  1  562 ? -20.078 1.070   -24.584 1.000 22.218  0 617  PHE   A CG   1 ? 1 
ATOM   8595  C  CD1  . PHE   A  1  562 ? -21.158 0.433   -25.215 1.000 23.418  0 617  PHE   A CD1  1 ? 1 
ATOM   8596  C  CD2  . PHE   A  1  562 ? -18.822 0.964   -25.170 1.000 21.891  0 617  PHE   A CD2  1 ? 1 
ATOM   8597  C  CE1  . PHE   A  1  562 ? -20.969 -0.274  -26.392 1.000 26.273  0 617  PHE   A CE1  1 ? 1 
ATOM   8598  C  CE2  . PHE   A  1  562 ? -18.639 0.239   -26.344 1.000 22.412  0 617  PHE   A CE2  1 ? 1 
ATOM   8599  C  CZ   . PHE   A  1  562 ? -19.709 -0.355  -26.965 1.000 25.440  0 617  PHE   A CZ   1 ? 1 
ATOM   8600  H  H    . PHE   A  1  562 ? -22.431 3.365   -24.725 1.000 25.274  0 617  PHE   A H    1 c 1 
ATOM   8601  H  HA   . PHE   A  1  562 ? -20.930 3.582   -22.446 1.000 23.564  0 617  PHE   A HA   1 c 1 
ATOM   8602  H  HB2  . PHE   A  1  562 ? -19.388 1.913   -22.859 1.000 21.658  0 617  PHE   A HB2  1 c 1 
ATOM   8603  H  HB3  . PHE   A  1  562 ? -20.813 1.262   -22.692 1.000 22.110  0 617  PHE   A HB3  1 c 1 
ATOM   8604  H  HD1  . PHE   A  1  562 ? -22.019 0.487   -24.834 1.000 24.028  0 617  PHE   A HD1  1 c 1 
ATOM   8605  H  HD2  . PHE   A  1  562 ? -18.079 1.371   -24.753 1.000 21.595  0 617  PHE   A HD2  1 c 1 
ATOM   8606  H  HE1  . PHE   A  1  562 ? -21.705 -0.688  -26.814 1.000 25.901  0 617  PHE   A HE1  1 c 1 
ATOM   8607  H  HE2  . PHE   A  1  562 ? -17.781 0.191   -26.736 1.000 22.783  0 617  PHE   A HE2  1 c 1 
ATOM   8608  H  HZ   . PHE   A  1  562 ? -19.584 -0.837  -27.767 1.000 25.177  0 617  PHE   A HZ   1 c 1 
ATOM   8609  N  N    . GLU   A  1  563 ? -18.974 4.619   -23.631 1.000 23.185  0 618  GLU   A N    1 ? 1 
ATOM   8610  C  CA   . GLU   A  1  563 ? -17.933 5.346   -24.319 1.000 22.132  0 618  GLU   A CA   1 ? 1 
ATOM   8611  C  C    . GLU   A  1  563 ? -16.612 4.613   -24.142 1.000 22.320  0 618  GLU   A C    1 ? 1 
ATOM   8612  O  O    . GLU   A  1  563 ? -16.375 4.017   -23.072 1.000 22.619  0 618  GLU   A O    1 ? 1 
ATOM   8613  C  CB   . GLU   A  1  563 ? -17.889 6.756   -23.726 1.000 27.980  0 618  GLU   A CB   1 ? 1 
ATOM   8614  C  CG   . GLU   A  1  563 ? -16.823 7.629   -24.364 1.000 35.367  0 618  GLU   A CG   1 ? 1 
ATOM   8615  C  CD   . GLU   A  1  563 ? -16.965 9.128   -24.116 1.000 45.305  0 618  GLU   A CD   1 ? 1 
ATOM   8616  O  OE1  . GLU   A  1  563 ? -18.049 9.588   -23.676 1.000 35.128  0 618  GLU   A OE1  1 ? 1 
ATOM   8617  O  OE2  . GLU   A  1  563 ? -15.966 9.846   -24.362 1.000 36.241  0 618  GLU   A OE2  1 ? 1 
ATOM   8618  H  H    . GLU   A  1  563 ? -18.888 4.501   -22.729 1.000 22.845  0 618  GLU   A H    1 c 1 
ATOM   8619  H  HA   . GLU   A  1  563 ? -18.153 5.399   -25.276 1.000 23.854  0 618  GLU   A HA   1 c 1 
ATOM   8620  H  HB2  . GLU   A  1  563 ? -18.766 7.175   -23.849 1.000 28.168  0 618  GLU   A HB2  1 c 1 
ATOM   8621  H  HB3  . GLU   A  1  563 ? -17.716 6.688   -22.764 1.000 27.263  0 618  GLU   A HB3  1 c 1 
ATOM   8622  H  HG2  . GLU   A  1  563 ? -15.945 7.347   -24.031 1.000 34.504  0 618  GLU   A HG2  1 c 1 
ATOM   8623  H  HG3  . GLU   A  1  563 ? -16.831 7.476   -25.333 1.000 35.524  0 618  GLU   A HG3  1 c 1 
ATOM   8624  N  N    . SER   A  1  564 ? -15.737 4.679   -25.163 1.000 19.319  0 619  SER   A N    1 ? 1 
ATOM   8625  C  CA   . SER   A  1  564 ? -14.415 4.086   -25.024 1.000 21.772  0 619  SER   A CA   1 ? 1 
ATOM   8626  C  C    . SER   A  1  564 ? -13.271 4.908   -25.608 1.000 21.976  0 619  SER   A C    1 ? 1 
ATOM   8627  O  O    . SER   A  1  564 ? -13.474 5.747   -26.470 1.000 22.422  0 619  SER   A O    1 ? 1 
ATOM   8628  C  CB   . SER   A  1  564 ? -14.405 2.674   -25.617 1.000 27.515  0 619  SER   A CB   1 ? 1 
ATOM   8629  O  OG   . SER   A  1  564 ? -14.496 2.699   -27.023 1.000 30.327  0 619  SER   A OG   1 ? 1 
ATOM   8630  H  H    . SER   A  1  564 ? -15.965 5.094   -25.945 1.000 21.096  0 619  SER   A H    1 c 1 
ATOM   8631  H  HA   . SER   A  1  564 ? -14.237 3.997   -24.050 1.000 21.521  0 619  SER   A HA   1 c 1 
ATOM   8632  H  HB2  . SER   A  1  564 ? -13.574 2.218   -25.353 1.000 26.101  0 619  SER   A HB2  1 c 1 
ATOM   8633  H  HB3  . SER   A  1  564 ? -15.162 2.163   -25.251 1.000 26.461  0 619  SER   A HB3  1 c 1 
ATOM   8634  H  HG   . SER   A  1  564 ? -13.718 2.743   -27.347 0.000 18.030  0 619  SER   A HG   1 c 1 
ATOM   8635  N  N    . GLY   A  1  565 ? -12.068 4.682   -25.072 1.000 22.942  0 620  GLY   A N    1 ? 1 
ATOM   8636  C  CA   . GLY   A  1  565 ? -10.827 5.157   -25.642 1.000 21.257  0 620  GLY   A CA   1 ? 1 
ATOM   8637  C  C    . GLY   A  1  565 ? -10.103 4.000   -26.311 1.000 20.631  0 620  GLY   A C    1 ? 1 
ATOM   8638  O  O    . GLY   A  1  565 ? -9.535  3.165   -25.623 1.000 27.777  0 620  GLY   A O    1 ? 1 
ATOM   8639  H  H    . GLY   A  1  565 ? -12.025 4.199   -24.297 1.000 21.746  0 620  GLY   A H    1 c 1 
ATOM   8640  H  HA2  . GLY   A  1  565 ? -11.013 5.868   -26.303 1.000 21.960  0 620  GLY   A HA2  1 c 1 
ATOM   8641  H  HA3  . GLY   A  1  565 ? -10.260 5.534   -24.924 1.000 21.169  0 620  GLY   A HA3  1 c 1 
ATOM   8642  N  N    . TYR   A  1  566 ? -10.176 3.939   -27.642 1.000 21.260  0 621  TYR   A N    1 ? 1 
ATOM   8643  C  CA   . TYR   A  1  566 ? -9.738  2.780   -28.401 1.000 20.490  0 621  TYR   A CA   1 ? 1 
ATOM   8644  C  C    . TYR   A  1  566 ? -8.343  3.038   -28.959 1.000 20.930  0 621  TYR   A C    1 ? 1 
ATOM   8645  O  O    . TYR   A  1  566 ? -8.136  4.022   -29.675 1.000 20.012  0 621  TYR   A O    1 ? 1 
ATOM   8646  C  CB   . TYR   A  1  566 ? -10.680 2.487   -29.569 1.000 20.387  0 621  TYR   A CB   1 ? 1 
ATOM   8647  C  CG   . TYR   A  1  566 ? -10.170 1.361   -30.450 1.000 25.003  0 621  TYR   A CG   1 ? 1 
ATOM   8648  C  CD1  . TYR   A  1  566 ? -10.395 0.023   -30.115 1.000 27.657  0 621  TYR   A CD1  1 ? 1 
ATOM   8649  C  CD2  . TYR   A  1  566 ? -9.466  1.627   -31.612 1.000 23.926  0 621  TYR   A CD2  1 ? 1 
ATOM   8650  C  CE1  . TYR   A  1  566 ? -9.912  -1.009  -30.914 1.000 26.860  0 621  TYR   A CE1  1 ? 1 
ATOM   8651  C  CE2  . TYR   A  1  566 ? -8.967  0.603   -32.403 1.000 24.298  0 621  TYR   A CE2  1 ? 1 
ATOM   8652  C  CZ   . TYR   A  1  566 ? -9.191  -0.711  -32.053 1.000 25.926  0 621  TYR   A CZ   1 ? 1 
ATOM   8653  O  OH   . TYR   A  1  566 ? -8.708  -1.719  -32.833 1.000 26.093  0 621  TYR   A OH   1 ? 1 
ATOM   8654  H  H    . TYR   A  1  566 ? -10.515 4.655   -28.099 1.000 21.428  0 621  TYR   A H    1 c 1 
ATOM   8655  H  HA   . TYR   A  1  566 ? -9.708  1.993   -27.808 1.000 20.262  0 621  TYR   A HA   1 c 1 
ATOM   8656  H  HB2  . TYR   A  1  566 ? -11.561 2.246   -29.213 1.000 21.378  0 621  TYR   A HB2  1 c 1 
ATOM   8657  H  HB3  . TYR   A  1  566 ? -10.780 3.300   -30.107 1.000 21.810  0 621  TYR   A HB3  1 c 1 
ATOM   8658  H  HD1  . TYR   A  1  566 ? -10.874 -0.186  -29.330 1.000 26.258  0 621  TYR   A HD1  1 c 1 
ATOM   8659  H  HD2  . TYR   A  1  566 ? -9.290  2.522   -31.851 1.000 24.528  0 621  TYR   A HD2  1 c 1 
ATOM   8660  H  HE1  . TYR   A  1  566 ? -10.062 -1.907  -30.673 1.000 26.584  0 621  TYR   A HE1  1 c 1 
ATOM   8661  H  HE2  . TYR   A  1  566 ? -8.481  0.805   -33.186 1.000 25.120  0 621  TYR   A HE2  1 c 1 
ATOM   8662  H  HH   . TYR   A  1  566 ? -8.855  -2.536  -32.621 0.000 11.240  0 621  TYR   A HH   1 c 1 
ATOM   8663  N  N    . SER   A  1  567 ? -7.406  2.136   -28.641 1.000 20.224  0 622  SER   A N    1 ? 1 
ATOM   8664  C  CA   . SER   A  1  567 ? -6.022  2.281   -29.071 1.000 22.084  0 622  SER   A CA   1 ? 1 
ATOM   8665  C  C    . SER   A  1  567 ? -5.813  1.623   -30.431 1.000 25.360  0 622  SER   A C    1 ? 1 
ATOM   8666  O  O    . SER   A  1  567 ? -6.143  0.449   -30.632 1.000 21.835  0 622  SER   A O    1 ? 1 
ATOM   8667  C  CB   . SER   A  1  567 ? -5.047  1.673   -28.062 1.000 28.863  0 622  SER   A CB   1 ? 1 
ATOM   8668  O  OG   . SER   A  1  567 ? -3.752  1.596   -28.628 1.000 24.012  0 622  SER   A OG   1 ? 1 
ATOM   8669  H  H    . SER   A  1  567 ? -7.636  1.407   -28.141 1.000 20.424  0 622  SER   A H    1 c 1 
ATOM   8670  H  HA   . SER   A  1  567 ? -5.821  3.252   -29.154 1.000 23.352  0 622  SER   A HA   1 c 1 
ATOM   8671  H  HB2  . SER   A  1  567 ? -5.022  2.230   -27.251 1.000 25.295  0 622  SER   A HB2  1 c 1 
ATOM   8672  H  HB3  . SER   A  1  567 ? -5.351  0.773   -27.810 1.000 25.408  0 622  SER   A HB3  1 c 1 
ATOM   8673  H  HG   . SER   A  1  567 ? -3.342  2.323   -28.443 0.000 12.240  0 622  SER   A HG   1 c 1 
ATOM   8674  N  N    . GLU   A  1  568 ? -5.291  2.414   -31.371 1.000 23.942  0 623  GLU   A N    1 ? 1 
ATOM   8675  C  CA   . GLU   A  1  568 ? -4.879  1.904   -32.661 1.000 31.440  0 623  GLU   A CA   1 ? 1 
ATOM   8676  C  C    . GLU   A  1  568 ? -3.512  1.239   -32.622 1.000 29.861  0 623  GLU   A C    1 ? 1 
ATOM   8677  O  O    . GLU   A  1  568 ? -3.095  0.650   -33.616 1.000 38.606  0 623  GLU   A O    1 ? 1 
ATOM   8678  C  CB   . GLU   A  1  568 ? -4.896  3.026   -33.678 1.000 31.091  0 623  GLU   A CB   1 ? 1 
ATOM   8679  C  CG   . GLU   A  1  568 ? -6.291  3.620   -33.784 1.000 34.799  0 623  GLU   A CG   1 ? 1 
ATOM   8680  C  CD   . GLU   A  1  568 ? -6.466  4.479   -35.013 1.000 36.563  0 623  GLU   A CD   1 ? 1 
ATOM   8681  O  OE1  . GLU   A  1  568 ? -5.439  4.865   -35.611 1.000 42.429  0 623  GLU   A OE1  1 ? 1 
ATOM   8682  O  OE2  . GLU   A  1  568 ? -7.628  4.733   -35.392 1.000 27.408  0 623  GLU   A OE2  1 ? 1 
ATOM   8683  H  H    . GLU   A  1  568 ? -5.183  3.305   -31.198 1.000 25.802  0 623  GLU   A H    1 c 1 
ATOM   8684  H  HA   . GLU   A  1  568 ? -5.537  1.228   -32.942 1.000 29.467  0 623  GLU   A HA   1 c 1 
ATOM   8685  H  HB2  . GLU   A  1  568 ? -4.261  3.721   -33.405 1.000 32.011  0 623  GLU   A HB2  1 c 1 
ATOM   8686  H  HB3  . GLU   A  1  568 ? -4.620  2.674   -34.550 1.000 32.623  0 623  GLU   A HB3  1 c 1 
ATOM   8687  H  HG2  . GLU   A  1  568 ? -6.952  2.896   -33.808 1.000 34.041  0 623  GLU   A HG2  1 c 1 
ATOM   8688  H  HG3  . GLU   A  1  568 ? -6.473  4.167   -32.989 1.000 33.647  0 623  GLU   A HG3  1 c 1 
ATOM   8689  N  N    . ILE   A  1  569 ? -2.841  1.327   -31.469 1.000 25.570  0 624  ILE   A N    1 ? 1 
ATOM   8690  C  CA   . ILE   A  1  569 ? -1.586  0.634   -31.270 1.000 24.237  0 624  ILE   A CA   1 ? 1 
ATOM   8691  C  C    . ILE   A  1  569 ? -1.866  -0.770  -30.746 1.000 22.192  0 624  ILE   A C    1 ? 1 
ATOM   8692  O  O    . ILE   A  1  569 ? -1.442  -1.747  -31.357 1.000 24.946  0 624  ILE   A O    1 ? 1 
ATOM   8693  C  CB   . ILE   A  1  569 ? -0.650  1.455   -30.354 1.000 24.701  0 624  ILE   A CB   1 ? 1 
ATOM   8694  C  CG1  . ILE   A  1  569 ? -0.450  2.912   -30.870 1.000 25.844  0 624  ILE   A CG1  1 ? 1 
ATOM   8695  C  CG2  . ILE   A  1  569 ? 0.696   0.737   -30.170 1.000 29.856  0 624  ILE   A CG2  1 ? 1 
ATOM   8696  C  CD1  . ILE   A  1  569 ? 0.082   3.011   -32.254 1.000 27.870  0 624  ILE   A CD1  1 ? 1 
ATOM   8697  H  H    . ILE   A  1  569 ? -3.165  1.848   -30.793 1.000 25.740  0 624  ILE   A H    1 c 1 
ATOM   8698  H  HA   . ILE   A  1  569 ? -1.149  0.546   -32.136 1.000 24.876  0 624  ILE   A HA   1 c 1 
ATOM   8699  H  HB   . ILE   A  1  569 ? -1.082  1.512   -29.466 1.000 25.027  0 624  ILE   A HB   1 c 1 
ATOM   8700  H  HG12 . ILE   A  1  569 ? -1.311  3.380   -30.831 1.000 25.934  0 624  ILE   A HG12 1 c 1 
ATOM   8701  H  HG13 . ILE   A  1  569 ? 0.169   3.374   -30.264 1.000 25.724  0 624  ILE   A HG13 1 c 1 
ATOM   8702  H  HG21 . ILE   A  1  569 ? 1.054   0.487   -31.040 1.000 28.607  0 624  ILE   A HG21 1 c 1 
ATOM   8703  H  HG22 . ILE   A  1  569 ? 0.570   -0.063  -29.631 1.000 27.762  0 624  ILE   A HG22 1 c 1 
ATOM   8704  H  HG23 . ILE   A  1  569 ? 1.323   1.331   -29.722 1.000 27.996  0 624  ILE   A HG23 1 c 1 
ATOM   8705  H  HD11 . ILE   A  1  569 ? -0.578  2.673   -32.883 1.000 27.746  0 624  ILE   A HD11 1 c 1 
ATOM   8706  H  HD12 . ILE   A  1  569 ? 0.899   2.487   -32.330 1.000 27.580  0 624  ILE   A HD12 1 c 1 
ATOM   8707  H  HD13 . ILE   A  1  569 ? 0.276   3.942   -32.462 1.000 27.744  0 624  ILE   A HD13 1 c 1 
ATOM   8708  N  N    . PHE   A  1  570 ? -2.607  -0.869  -29.638 1.000 21.370  0 625  PHE   A N    1 ? 1 
ATOM   8709  C  CA   . PHE   A  1  570 ? -2.840  -2.160  -29.016 1.000 26.413  0 625  PHE   A CA   1 ? 1 
ATOM   8710  C  C    . PHE   A  1  570 ? -4.100  -2.850  -29.553 1.000 25.820  0 625  PHE   A C    1 ? 1 
ATOM   8711  O  O    . PHE   A  1  570 ? -4.466  -3.943  -29.089 1.000 29.696  0 625  PHE   A O    1 ? 1 
ATOM   8712  C  CB   . PHE   A  1  570 ? -2.921  -1.990  -27.500 1.000 38.764  0 625  PHE   A CB   1 ? 1 
ATOM   8713  C  CG   . PHE   A  1  570 ? -1.599  -1.650  -26.833 1.000 34.992  0 625  PHE   A CG   1 ? 1 
ATOM   8714  C  CD1  . PHE   A  1  570 ? -1.062  -0.382  -26.928 1.000 76.641  0 625  PHE   A CD1  1 ? 1 
ATOM   8715  C  CD2  . PHE   A  1  570 ? -0.901  -2.602  -26.123 1.000 61.840  0 625  PHE   A CD2  1 ? 1 
ATOM   8716  C  CE1  . PHE   A  1  570 ? 0.146   -0.071  -26.321 1.000 79.059  0 625  PHE   A CE1  1 ? 1 
ATOM   8717  C  CE2  . PHE   A  1  570 ? 0.306   -2.287  -25.514 1.000 68.276  0 625  PHE   A CE2  1 ? 1 
ATOM   8718  C  CZ   . PHE   A  1  570 ? 0.822   -1.023  -25.625 1.000 58.802  0 625  PHE   A CZ   1 ? 1 
ATOM   8719  H  H    . PHE   A  1  570 ? -2.974  -0.121  -29.264 1.000 22.637  0 625  PHE   A H    1 c 1 
ATOM   8720  H  HA   . PHE   A  1  570 ? -2.066  -2.745  -29.216 1.000 26.818  0 625  PHE   A HA   1 c 1 
ATOM   8721  H  HB2  . PHE   A  1  570 ? -3.566  -1.279  -27.303 1.000 34.057  0 625  PHE   A HB2  1 c 1 
ATOM   8722  H  HB3  . PHE   A  1  570 ? -3.265  -2.821  -27.112 1.000 34.145  0 625  PHE   A HB3  1 c 1 
ATOM   8723  H  HD1  . PHE   A  1  570 ? -1.525  0.283   -27.413 1.000 61.457  0 625  PHE   A HD1  1 c 1 
ATOM   8724  H  HD2  . PHE   A  1  570 ? -1.252  -3.474  -26.044 1.000 53.477  0 625  PHE   A HD2  1 c 1 
ATOM   8725  H  HE1  . PHE   A  1  570 ? 0.500   0.801   -26.396 1.000 72.558  0 625  PHE   A HE1  1 c 1 
ATOM   8726  H  HE2  . PHE   A  1  570 ? 0.774   -2.948  -25.030 1.000 63.914  0 625  PHE   A HE2  1 c 1 
ATOM   8727  H  HZ   . PHE   A  1  570 ? 1.643   -0.810  -25.210 1.000 64.888  0 625  PHE   A HZ   1 c 1 
ATOM   8728  N  N    . LEU   A  1  571 ? -4.762  -2.183  -30.504 1.000 21.584  0 626  LEU   A N    1 ? 1 
ATOM   8729  C  CA   . LEU   A  1  571 ? -5.933  -2.693  -31.215 1.000 25.565  0 626  LEU   A CA   1 ? 1 
ATOM   8730  C  C    . LEU   A  1  571 ? -7.120  -3.051  -30.307 1.000 26.843  0 626  LEU   A C    1 ? 1 
ATOM   8731  O  O    . LEU   A  1  571 ? -7.936  -3.916  -30.645 1.000 25.923  0 626  LEU   A O    1 ? 1 
ATOM   8732  C  CB   . LEU   A  1  571 ? -5.519  -3.912  -32.052 1.000 26.626  0 626  LEU   A CB   1 ? 1 
ATOM   8733  C  CG   . LEU   A  1  571 ? -4.299  -3.749  -32.961 1.000 29.727  0 626  LEU   A CG   1 ? 1 
ATOM   8734  C  CD1  . LEU   A  1  571 ? -3.896  -5.068  -33.583 1.000 27.157  0 626  LEU   A CD1  1 ? 1 
ATOM   8735  C  CD2  . LEU   A  1  571 ? -4.548  -2.709  -34.079 1.000 27.014  0 626  LEU   A CD2  1 ? 1 
ATOM   8736  H  H    . LEU   A  1  571 ? -4.475  -1.344  -30.719 1.000 23.463  0 626  LEU   A H    1 c 1 
ATOM   8737  H  HA   . LEU   A  1  571 ? -6.232  -1.984  -31.829 1.000 25.497  0 626  LEU   A HA   1 c 1 
ATOM   8738  H  HB2  . LEU   A  1  571 ? -5.347  -4.656  -31.440 1.000 26.747  0 626  LEU   A HB2  1 c 1 
ATOM   8739  H  HB3  . LEU   A  1  571 ? -6.280  -4.167  -32.610 1.000 27.380  0 626  LEU   A HB3  1 c 1 
ATOM   8740  H  HG   . LEU   A  1  571 ? -3.543  -3.430  -32.408 1.000 27.656  0 626  LEU   A HG   1 c 1 
ATOM   8741  H  HD11 . LEU   A  1  571 ? -3.010  -4.985  -33.975 1.000 28.212  0 626  LEU   A HD11 1 c 1 
ATOM   8742  H  HD12 . LEU   A  1  571 ? -4.536  -5.308  -34.276 1.000 28.381  0 626  LEU   A HD12 1 c 1 
ATOM   8743  H  HD13 . LEU   A  1  571 ? -3.884  -5.760  -32.900 1.000 27.623  0 626  LEU   A HD13 1 c 1 
ATOM   8744  H  HD21 . LEU   A  1  571 ? -4.769  -1.849  -33.681 1.000 27.693  0 626  LEU   A HD21 1 c 1 
ATOM   8745  H  HD22 . LEU   A  1  571 ? -5.286  -3.005  -34.639 1.000 28.265  0 626  LEU   A HD22 1 c 1 
ATOM   8746  H  HD23 . LEU   A  1  571 ? -3.746  -2.617  -34.623 1.000 28.232  0 626  LEU   A HD23 1 c 1 
ATOM   8747  N  N    . MET   A  1  572 ? -7.217  -2.365  -29.162 1.000 24.491  0 627  MET   A N    1 ? 1 
ATOM   8748  C  CA   . MET   A  1  572 ? -8.328  -2.526  -28.233 1.000 23.131  0 627  MET   A CA   1 ? 1 
ATOM   8749  C  C    . MET   A  1  572 ? -8.481  -1.284  -27.360 1.000 21.111  0 627  MET   A C    1 ? 1 
ATOM   8750  O  O    . MET   A  1  572 ? -7.584  -0.444  -27.328 1.000 22.682  0 627  MET   A O    1 ? 1 
ATOM   8751  C  CB   . MET   A  1  572 ? -8.124  -3.753  -27.309 1.000 23.846  0 627  MET   A CB   1 ? 1 
ATOM   8752  C  CG   . MET   A  1  572 ? -6.906  -3.657  -26.445 1.000 21.570  0 627  MET   A CG   1 ? 1 
ATOM   8753  S  SD   . MET   A  1  572 ? -6.542  -5.219  -25.626 1.000 23.019  0 627  MET   A SD   1 ? 1 
ATOM   8754  C  CE   . MET   A  1  572 ? -5.734  -6.074  -26.984 1.000 24.448  0 627  MET   A CE   1 ? 1 
ATOM   8755  H  H    . MET   A  1  572 ? -6.566  -1.759  -28.954 1.000 24.467  0 627  MET   A H    1 c 1 
ATOM   8756  H  HA   . MET   A  1  572 ? -9.150  -2.645  -28.756 1.000 23.638  0 627  MET   A HA   1 c 1 
ATOM   8757  H  HB2  . MET   A  1  572 ? -8.910  -3.851  -26.739 1.000 22.983  0 627  MET   A HB2  1 c 1 
ATOM   8758  H  HB3  . MET   A  1  572 ? -8.057  -4.554  -27.864 1.000 23.451  0 627  MET   A HB3  1 c 1 
ATOM   8759  H  HG2  . MET   A  1  572 ? -6.136  -3.396  -26.993 1.000 22.494  0 627  MET   A HG2  1 c 1 
ATOM   8760  H  HG3  . MET   A  1  572 ? -7.043  -2.965  -25.762 1.000 22.002  0 627  MET   A HG3  1 c 1 
ATOM   8761  H  HE1  . MET   A  1  572 ? -6.272  -5.994  -27.781 1.000 24.603  0 627  MET   A HE1  1 c 1 
ATOM   8762  H  HE2  . MET   A  1  572 ? -4.867  -5.681  -27.140 1.000 24.244  0 627  MET   A HE2  1 c 1 
ATOM   8763  H  HE3  . MET   A  1  572 ? -5.630  -7.006  -26.759 1.000 24.167  0 627  MET   A HE3  1 c 1 
ATOM   8764  N  N    . PRO   A  1  573 ? -9.620  -1.110  -26.639 1.000 21.989  0 628  PRO   A N    1 ? 1 
ATOM   8765  C  CA   . PRO   A  1  573 ? -9.780  0.006   -25.712 1.000 20.392  0 628  PRO   A CA   1 ? 1 
ATOM   8766  C  C    . PRO   A  1  573 ? -8.723  0.026   -24.616 1.000 22.841  0 628  PRO   A C    1 ? 1 
ATOM   8767  O  O    . PRO   A  1  573 ? -8.329  -1.025  -24.107 1.000 22.346  0 628  PRO   A O    1 ? 1 
ATOM   8768  C  CB   . PRO   A  1  573 ? -11.184 -0.205  -25.133 1.000 20.767  0 628  PRO   A CB   1 ? 1 
ATOM   8769  C  CG   . PRO   A  1  573 ? -11.908 -0.937  -26.246 1.000 20.413  0 628  PRO   A CG   1 ? 1 
ATOM   8770  C  CD   . PRO   A  1  573 ? -10.869 -1.888  -26.760 1.000 23.048  0 628  PRO   A CD   1 ? 1 
ATOM   8771  H  HA   . PRO   A  1  573 ? -9.760  0.853   -26.219 1.000 21.479  0 628  PRO   A HA   1 c 1 
ATOM   8772  H  HB2  . PRO   A  1  573 ? -11.152 -0.744  -24.316 1.000 20.119  0 628  PRO   A HB2  1 c 1 
ATOM   8773  H  HB3  . PRO   A  1  573 ? -11.618 0.652   -24.934 1.000 20.518  0 628  PRO   A HB3  1 c 1 
ATOM   8774  H  HG2  . PRO   A  1  573 ? -12.689 -1.419  -25.904 1.000 21.166  0 628  PRO   A HG2  1 c 1 
ATOM   8775  H  HG3  . PRO   A  1  573 ? -12.194 -0.316  -26.946 1.000 21.553  0 628  PRO   A HG3  1 c 1 
ATOM   8776  H  HD2  . PRO   A  1  573 ? -10.833 -2.698  -26.218 1.000 21.976  0 628  PRO   A HD2  1 c 1 
ATOM   8777  H  HD3  . PRO   A  1  573 ? -11.045 -2.132  -27.688 1.000 22.721  0 628  PRO   A HD3  1 c 1 
ATOM   8778  N  N    . LEU   A  1  574 ? -8.268  1.239   -24.312 1.000 18.349  0 629  LEU   A N    1 ? 1 
ATOM   8779  C  CA   . LEU   A  1  574 ? -7.485  1.510   -23.117 1.000 20.690  0 629  LEU   A CA   1 ? 1 
ATOM   8780  C  C    . LEU   A  1  574 ? -8.421  1.525   -21.917 1.000 19.257  0 629  LEU   A C    1 ? 1 
ATOM   8781  O  O    . LEU   A  1  574 ? -8.057  1.095   -20.812 1.000 22.642  0 629  LEU   A O    1 ? 1 
ATOM   8782  C  CB   . LEU   A  1  574 ? -6.831  2.892   -23.265 1.000 20.564  0 629  LEU   A CB   1 ? 1 
ATOM   8783  C  CG   . LEU   A  1  574 ? -5.830  3.024   -24.412 1.000 23.573  0 629  LEU   A CG   1 ? 1 
ATOM   8784  C  CD1  . LEU   A  1  574 ? -5.186  4.374   -24.392 1.000 23.029  0 629  LEU   A CD1  1 ? 1 
ATOM   8785  C  CD2  . LEU   A  1  574 ? -4.774  1.981   -24.327 1.000 31.339  0 629  LEU   A CD2  1 ? 1 
ATOM   8786  H  H    . LEU   A  1  574 ? -8.452  1.934   -24.878 1.000 20.268  0 629  LEU   A H    1 c 1 
ATOM   8787  H  HA   . LEU   A  1  574 ? -6.802  0.810   -23.001 1.000 19.767  0 629  LEU   A HA   1 c 1 
ATOM   8788  H  HB2  . LEU   A  1  574 ? -7.539  3.555   -23.393 1.000 21.356  0 629  LEU   A HB2  1 c 1 
ATOM   8789  H  HB3  . LEU   A  1  574 ? -6.374  3.108   -22.428 1.000 20.816  0 629  LEU   A HB3  1 c 1 
ATOM   8790  H  HG   . LEU   A  1  574 ? -6.313  2.917   -25.269 1.000 24.479  0 629  LEU   A HG   1 c 1 
ATOM   8791  H  HD11 . LEU   A  1  574 ? -4.709  4.519   -25.227 1.000 23.585  0 629  LEU   A HD11 1 c 1 
ATOM   8792  H  HD12 . LEU   A  1  574 ? -4.560  4.424   -23.648 1.000 22.924  0 629  LEU   A HD12 1 c 1 
ATOM   8793  H  HD13 . LEU   A  1  574 ? -5.869  5.058   -24.286 1.000 23.312  0 629  LEU   A HD13 1 c 1 
ATOM   8794  H  HD21 . LEU   A  1  574 ? -5.124  1.137   -24.663 1.000 28.520  0 629  LEU   A HD21 1 c 1 
ATOM   8795  H  HD22 . LEU   A  1  574 ? -4.500  1.870   -23.401 1.000 28.140  0 629  LEU   A HD22 1 c 1 
ATOM   8796  H  HD23 . LEU   A  1  574 ? -4.007  2.248   -24.863 1.000 28.763  0 629  LEU   A HD23 1 c 1 
ATOM   8797  N  N    . TRP   A  1  575 ? -9.631  2.060   -22.170 1.000 19.599  0 630  TRP   A N    1 ? 1 
ATOM   8798  C  CA   . TRP   A  1  575 ? -10.695 2.146   -21.188 1.000 18.478  0 630  TRP   A CA   1 ? 1 
ATOM   8799  C  C    . TRP   A  1  575 ? -12.058 2.127   -21.867 1.000 21.708  0 630  TRP   A C    1 ? 1 
ATOM   8800  O  O    . TRP   A  1  575 ? -12.187 2.579   -22.998 1.000 18.533  0 630  TRP   A O    1 ? 1 
ATOM   8801  C  CB   . TRP   A  1  575 ? -10.571 3.425   -20.357 1.000 22.577  0 630  TRP   A CB   1 ? 1 
ATOM   8802  C  CG   . TRP   A  1  575 ? -10.513 4.669   -21.171 1.000 19.345  0 630  TRP   A CG   1 ? 1 
ATOM   8803  C  CD1  . TRP   A  1  575 ? -9.394  5.302   -21.591 1.000 18.069  0 630  TRP   A CD1  1 ? 1 
ATOM   8804  C  CD2  . TRP   A  1  575 ? -11.621 5.464   -21.624 1.000 19.376  0 630  TRP   A CD2  1 ? 1 
ATOM   8805  N  NE1  . TRP   A  1  575 ? -9.736  6.410   -22.367 1.000 19.997  0 630  TRP   A NE1  1 ? 1 
ATOM   8806  C  CE2  . TRP   A  1  575 ? -11.094 6.557   -22.353 1.000 22.786  0 630  TRP   A CE2  1 ? 1 
ATOM   8807  C  CE3  . TRP   A  1  575 ? -12.994 5.353   -21.509 1.000 18.859  0 630  TRP   A CE3  1 ? 1 
ATOM   8808  C  CZ2  . TRP   A  1  575 ? -11.910 7.524   -22.959 1.000 19.820  0 630  TRP   A CZ2  1 ? 1 
ATOM   8809  C  CZ3  . TRP   A  1  575 ? -13.805 6.309   -22.107 1.000 21.493  0 630  TRP   A CZ3  1 ? 1 
ATOM   8810  C  CH2  . TRP   A  1  575 ? -13.266 7.394   -22.794 1.000 18.843  0 630  TRP   A CH2  1 ? 1 
ATOM   8811  H  H    . TRP   A  1  575 ? -9.790  2.402   -23.002 1.000 19.746  0 630  TRP   A H    1 c 1 
ATOM   8812  H  HA   . TRP   A  1  575 ? -10.621 1.373   -20.582 1.000 19.558  0 630  TRP   A HA   1 c 1 
ATOM   8813  H  HB2  . TRP   A  1  575 ? -11.338 3.475   -19.750 1.000 20.542  0 630  TRP   A HB2  1 c 1 
ATOM   8814  H  HB3  . TRP   A  1  575 ? -9.761  3.362   -19.813 1.000 20.245  0 630  TRP   A HB3  1 c 1 
ATOM   8815  H  HD1  . TRP   A  1  575 ? -8.510  4.993   -21.459 1.000 18.481  0 630  TRP   A HD1  1 c 1 
ATOM   8816  H  HE1  . TRP   A  1  575 ? -9.166  6.976   -22.718 1.000 20.304  0 630  TRP   A HE1  1 c 1 
ATOM   8817  H  HE3  . TRP   A  1  575 ? -13.374 4.638   -21.024 1.000 19.317  0 630  TRP   A HE3  1 c 1 
ATOM   8818  H  HZ2  . TRP   A  1  575 ? -11.539 8.244   -23.440 1.000 20.494  0 630  TRP   A HZ2  1 c 1 
ATOM   8819  H  HZ3  . TRP   A  1  575 ? -14.742 6.246   -22.009 1.000 20.451  0 630  TRP   A HZ3  1 c 1 
ATOM   8820  H  HH2  . TRP   A  1  575 ? -13.842 8.019   -23.198 1.000 20.443  0 630  TRP   A HH2  1 c 1 
ATOM   8821  N  N    . THR   A  1  576 ? -13.040 1.591   -21.138 1.000 20.290  0 631  THR   A N    1 ? 1 
ATOM   8822  C  CA   . THR   A  1  576 ? -14.435 1.556   -21.527 1.000 20.575  0 631  THR   A CA   1 ? 1 
ATOM   8823  C  C    . THR   A  1  576 ? -15.244 1.972   -20.302 1.000 20.664  0 631  THR   A C    1 ? 1 
ATOM   8824  O  O    . THR   A  1  576 ? -15.144 1.356   -19.238 1.000 22.350  0 631  THR   A O    1 ? 1 
ATOM   8825  C  CB   . THR   A  1  576 ? -14.792 0.168   -21.981 1.000 25.163  0 631  THR   A CB   1 ? 1 
ATOM   8826  O  OG1  . THR   A  1  576 ? -13.967 -0.152  -23.092 1.000 24.854  0 631  THR   A OG1  1 ? 1 
ATOM   8827  C  CG2  . THR   A  1  576 ? -16.299 0.014   -22.332 1.000 35.178  0 631  THR   A CG2  1 ? 1 
ATOM   8828  H  H    . THR   A  1  576 ? -12.816 1.217   -20.334 1.000 20.178  0 631  THR   A H    1 c 1 
ATOM   8829  H  HA   . THR   A  1  576 ? -14.585 2.195   -22.261 1.000 21.673  0 631  THR   A HA   1 c 1 
ATOM   8830  H  HB   . THR   A  1  576 ? -14.580 -0.454  -21.245 1.000 25.092  0 631  THR   A HB   1 c 1 
ATOM   8831  H  HG1  . THR   A  1  576 ? -14.109 0.416   -23.713 0.000 14.410  0 631  THR   A HG1  1 c 1 
ATOM   8832  H  HG21 . THR   A  1  576 ? -16.450 -0.858  -22.740 1.000 32.068  0 631  THR   A HG21 1 c 1 
ATOM   8833  H  HG22 . THR   A  1  576 ? -16.562 0.713   -22.957 1.000 32.272  0 631  THR   A HG22 1 c 1 
ATOM   8834  H  HG23 . THR   A  1  576 ? -16.834 0.087   -21.521 1.000 31.752  0 631  THR   A HG23 1 c 1 
ATOM   8835  N  N    . SER   A  1  577 ? -16.078 2.988   -20.479 1.000 17.892  0 632  SER   A N    1 ? 1 
ATOM   8836  C  CA   . SER   A  1  577 ? -16.818 3.626   -19.408 1.000 19.153  0 632  SER   A CA   1 ? 1 
ATOM   8837  C  C    . SER   A  1  577 ? -18.321 3.520   -19.653 1.000 19.257  0 632  SER   A C    1 ? 1 
ATOM   8838  O  O    . SER   A  1  577 ? -18.812 3.862   -20.738 1.000 20.837  0 632  SER   A O    1 ? 1 
ATOM   8839  C  CB   . SER   A  1  577 ? -16.386 5.102   -19.317 1.000 19.760  0 632  SER   A CB   1 ? 1 
ATOM   8840  O  OG   . SER   A  1  577 ? -17.127 5.788   -18.324 1.000 26.587  0 632  SER   A OG   1 ? 1 
ATOM   8841  H  H    . SER   A  1  577 ? -16.199 3.305   -21.328 1.000 19.253  0 632  SER   A H    1 c 1 
ATOM   8842  H  HA   . SER   A  1  577 ? -16.597 3.173   -18.555 1.000 18.553  0 632  SER   A HA   1 c 1 
ATOM   8843  H  HB2  . SER   A  1  577 ? -15.427 5.148   -19.100 1.000 20.605  0 632  SER   A HB2  1 c 1 
ATOM   8844  H  HB3  . SER   A  1  577 ? -16.524 5.537   -20.188 1.000 21.354  0 632  SER   A HB3  1 c 1 
ATOM   8845  H  HG   . SER   A  1  577 ? -16.729 5.715   -17.583 0.000 14.920  0 632  SER   A HG   1 c 1 
ATOM   8846  N  N    . TYR   A  1  578 ? -19.064 3.128   -18.615 1.000 19.250  0 633  TYR   A N    1 ? 1 
ATOM   8847  C  CA   . TYR   A  1  578 ? -20.515 3.085   -18.696 1.000 19.777  0 633  TYR   A CA   1 ? 1 
ATOM   8848  C  C    . TYR   A  1  578 ? -21.195 3.123   -17.337 1.000 23.915  0 633  TYR   A C    1 ? 1 
ATOM   8849  O  O    . TYR   A  1  578 ? -20.623 2.673   -16.338 1.000 25.007  0 633  TYR   A O    1 ? 1 
ATOM   8850  C  CB   . TYR   A  1  578 ? -20.931 1.826   -19.411 1.000 19.507  0 633  TYR   A CB   1 ? 1 
ATOM   8851  C  CG   . TYR   A  1  578 ? -20.467 0.541   -18.776 1.000 19.648  0 633  TYR   A CG   1 ? 1 
ATOM   8852  C  CD1  . TYR   A  1  578 ? -19.185 0.055   -18.992 1.000 19.738  0 633  TYR   A CD1  1 ? 1 
ATOM   8853  C  CD2  . TYR   A  1  578 ? -21.337 -0.235  -18.028 1.000 22.066  0 633  TYR   A CD2  1 ? 1 
ATOM   8854  C  CE1  . TYR   A  1  578 ? -18.774 -1.160  -18.456 1.000 21.394  0 633  TYR   A CE1  1 ? 1 
ATOM   8855  C  CE2  . TYR   A  1  578 ? -20.941 -1.450  -17.485 1.000 22.269  0 633  TYR   A CE2  1 ? 1 
ATOM   8856  C  CZ   . TYR   A  1  578 ? -19.672 -1.924  -17.716 1.000 25.303  0 633  TYR   A CZ   1 ? 1 
ATOM   8857  O  OH   . TYR   A  1  578 ? -19.316 -3.134  -17.158 1.000 25.982  0 633  TYR   A OH   1 ? 1 
ATOM   8858  H  H    . TYR   A  1  578 ? -18.658 2.879   -17.835 1.000 18.842  0 633  TYR   A H    1 c 1 
ATOM   8859  H  HA   . TYR   A  1  578 ? -20.826 3.866   -19.221 1.000 20.769  0 633  TYR   A HA   1 c 1 
ATOM   8860  H  HB2  . TYR   A  1  578 ? -21.910 1.814   -19.465 1.000 20.246  0 633  TYR   A HB2  1 c 1 
ATOM   8861  H  HB3  . TYR   A  1  578 ? -20.586 1.865   -20.327 1.000 19.922  0 633  TYR   A HB3  1 c 1 
ATOM   8862  H  HD1  . TYR   A  1  578 ? -18.581 0.556   -19.515 1.000 20.049  0 633  TYR   A HD1  1 c 1 
ATOM   8863  H  HD2  . TYR   A  1  578 ? -22.219 0.067   -17.887 1.000 22.062  0 633  TYR   A HD2  1 c 1 
ATOM   8864  H  HE1  . TYR   A  1  578 ? -17.899 -1.476  -18.610 1.000 21.355  0 633  TYR   A HE1  1 c 1 
ATOM   8865  H  HE2  . TYR   A  1  578 ? -21.550 -1.963  -16.979 1.000 22.953  0 633  TYR   A HE2  1 c 1 
ATOM   8866  H  HH   . TYR   A  1  578 ? -18.538 -3.439  -17.251 0.000 14.860  0 633  TYR   A HH   1 c 1 
ATOM   8867  N  N    . THR   A  1  579 ? -22.441 3.628   -17.323 1.000 22.528  0 634  THR   A N    1 ? 1 
ATOM   8868  C  CA   . THR   A  1  579 ? -23.199 3.811   -16.093 1.000 20.813  0 634  THR   A CA   1 ? 1 
ATOM   8869  C  C    . THR   A  1  579 ? -24.406 2.887   -16.115 1.000 23.143  0 634  THR   A C    1 ? 1 
ATOM   8870  O  O    . THR   A  1  579 ? -25.127 2.844   -17.115 1.000 22.081  0 634  THR   A O    1 ? 1 
ATOM   8871  C  CB   . THR   A  1  579 ? -23.559 5.272   -15.951 1.000 22.269  0 634  THR   A CB   1 ? 1 
ATOM   8872  O  OG1  . THR   A  1  579 ? -22.319 6.042   -15.966 1.000 20.645  0 634  THR   A OG1  1 ? 1 
ATOM   8873  C  CG2  . THR   A  1  579 ? -24.362 5.563   -14.704 1.000 24.287  0 634  THR   A CG2  1 ? 1 
ATOM   8874  H  H    . THR   A  1  579 ? -22.832 3.866   -18.115 1.000 22.920  0 634  THR   A H    1 c 1 
ATOM   8875  H  HA   . THR   A  1  579 ? -22.623 3.559   -15.338 1.000 21.244  0 634  THR   A HA   1 c 1 
ATOM   8876  H  HB   . THR   A  1  579 ? -24.098 5.530   -16.737 1.000 22.631  0 634  THR   A HB   1 c 1 
ATOM   8877  H  HG1  . THR   A  1  579 ? -21.826 5.800   -15.325 0.000 7.960   0 634  THR   A HG1  1 c 1 
ATOM   8878  H  HG21 . THR   A  1  579 ? -24.458 6.527   -14.596 1.000 23.897  0 634  THR   A HG21 1 c 1 
ATOM   8879  H  HG22 . THR   A  1  579 ? -23.904 5.195   -13.927 1.000 23.253  0 634  THR   A HG22 1 c 1 
ATOM   8880  H  HG23 . THR   A  1  579 ? -25.245 5.158   -14.781 1.000 24.114  0 634  THR   A HG23 1 c 1 
ATOM   8881  N  N    . ILE   A  1  580 ? -24.579 2.143   -15.013 1.000 19.905  0 635  ILE   A N    1 ? 1 
ATOM   8882  C  CA   . ILE   A  1  580 ? -25.649 1.173   -14.841 1.000 24.968  0 635  ILE   A CA   1 ? 1 
ATOM   8883  C  C    . ILE   A  1  580 ? -26.464 1.629   -13.633 1.000 27.420  0 635  ILE   A C    1 ? 1 
ATOM   8884  O  O    . ILE   A  1  580 ? -25.949 1.693   -12.517 1.000 34.416  0 635  ILE   A O    1 ? 1 
ATOM   8885  C  CB   . ILE   A  1  580 ? -25.066 -0.240  -14.624 1.000 29.083  0 635  ILE   A CB   1 ? 1 
ATOM   8886  C  CG1  . ILE   A  1  580 ? -24.138 -0.677  -15.772 1.000 33.208  0 635  ILE   A CG1  1 ? 1 
ATOM   8887  C  CG2  . ILE   A  1  580 ? -26.155 -1.299  -14.368 1.000 33.305  0 635  ILE   A CG2  1 ? 1 
ATOM   8888  C  CD1  . ILE   A  1  580 ? -24.831 -0.813  -17.142 1.000 27.003  0 635  ILE   A CD1  1 ? 1 
ATOM   8889  H  H    . ILE   A  1  580 ? -23.989 2.251   -14.323 1.000 21.083  0 635  ILE   A H    1 c 1 
ATOM   8890  H  HA   . ILE   A  1  580 ? -26.214 1.168   -15.633 1.000 25.450  0 635  ILE   A HA   1 c 1 
ATOM   8891  H  HB   . ILE   A  1  580 ? -24.509 -0.197  -13.808 1.000 29.029  0 635  ILE   A HB   1 c 1 
ATOM   8892  H  HG12 . ILE   A  1  580 ? -23.410 -0.025  -15.853 1.000 29.955  0 635  ILE   A HG12 1 c 1 
ATOM   8893  H  HG13 . ILE   A  1  580 ? -23.738 -1.542  -15.538 1.000 30.115  0 635  ILE   A HG13 1 c 1 
ATOM   8894  H  HG21 . ILE   A  1  580 ? -26.829 -1.248  -15.066 1.000 32.612  0 635  ILE   A HG21 1 c 1 
ATOM   8895  H  HG22 . ILE   A  1  580 ? -26.572 -1.139  -13.504 1.000 32.177  0 635  ILE   A HG22 1 c 1 
ATOM   8896  H  HG23 . ILE   A  1  580 ? -25.754 -2.186  -14.372 1.000 31.890  0 635  ILE   A HG23 1 c 1 
ATOM   8897  H  HD11 . ILE   A  1  580 ? -25.141 0.060   -17.438 1.000 29.055  0 635  ILE   A HD11 1 c 1 
ATOM   8898  H  HD12 . ILE   A  1  580 ? -25.590 -1.416  -17.065 1.000 29.110  0 635  ILE   A HD12 1 c 1 
ATOM   8899  H  HD13 . ILE   A  1  580 ? -24.201 -1.170  -17.792 1.000 28.550  0 635  ILE   A HD13 1 c 1 
ATOM   8900  N  N    . SER   A  1  581 ? -27.728 1.985   -13.859 1.000 24.200  0 636  SER   A N    1 ? 1 
ATOM   8901  C  CA   . SER   A  1  581 ? -28.602 2.461   -12.795 1.000 26.855  0 636  SER   A CA   1 ? 1 
ATOM   8902  C  C    . SER   A  1  581 ? -29.090 1.318   -11.915 1.000 23.793  0 636  SER   A C    1 ? 1 
ATOM   8903  O  O    . SER   A  1  581 ? -28.960 0.148   -12.251 1.000 24.578  0 636  SER   A O    1 ? 1 
ATOM   8904  C  CB   . SER   A  1  581 ? -29.819 3.175   -13.329 1.000 35.605  0 636  SER   A CB   1 ? 1 
ATOM   8905  O  OG   . SER   A  1  581 ? -30.721 2.198   -13.821 1.000 34.180  0 636  SER   A OG   1 ? 1 
ATOM   8906  H  H    . SER   A  1  581 ? -28.063 1.930   -14.708 1.000 25.969  0 636  SER   A H    1 c 1 
ATOM   8907  H  HA   . SER   A  1  581 ? -28.087 3.094   -12.228 1.000 26.716  0 636  SER   A HA   1 c 1 
ATOM   8908  H  HB2  . SER   A  1  581 ? -30.245 3.696   -12.612 1.000 33.278  0 636  SER   A HB2  1 c 1 
ATOM   8909  H  HB3  . SER   A  1  581 ? -29.558 3.788   -14.053 1.000 33.107  0 636  SER   A HB3  1 c 1 
ATOM   8910  H  HG   . SER   A  1  581 ? -31.242 1.973   -13.213 0.000 19.110  0 636  SER   A HG   1 c 1 
ATOM   8911  N  N    . LYS   A  1  582 ? -29.605 1.685   -10.749 1.000 29.540  0 637  LYS   A N    1 ? 1 
ATOM   8912  C  CA   . LYS   A  1  582 ? -30.133 0.726   -9.794  1.000 32.548  0 637  LYS   A CA   1 ? 1 
ATOM   8913  C  C    . LYS   A  1  582 ? -31.163 -0.215  -10.431 1.000 30.501  0 637  LYS   A C    1 ? 1 
ATOM   8914  O  O    . LYS   A  1  582 ? -31.188 -1.408  -10.152 1.000 34.759  0 637  LYS   A O    1 ? 1 
ATOM   8915  C  CB   . LYS   A  1  582 ? -30.777 1.515   -8.625  1.000 37.250  0 637  LYS   A CB   1 ? 1 
ATOM   8916  C  CG   . LYS   A  1  582 ? -31.050 0.711   -7.417  1.000 38.048  0 637  LYS   A CG   1 ? 1 
ATOM   8917  C  CD   . LYS   A  1  582 ? -31.988 1.414   -6.446  1.000 45.058  0 637  LYS   A CD   1 ? 1 
ATOM   8918  C  CE   . LYS   A  1  582 ? -32.546 0.419   -5.458  1.000 46.189  0 637  LYS   A CE   1 ? 1 
ATOM   8919  N  NZ   . LYS   A  1  582 ? -33.727 0.961   -4.749  1.000 68.567  0 637  LYS   A NZ   1 ? 1 
ATOM   8920  H  H    . LYS   A  1  582 ? -29.632 2.574   -10.537 1.000 28.695  0 637  LYS   A H    1 c 1 
ATOM   8921  H  HA   . LYS   A  1  582 ? -29.385 0.189   -9.445  1.000 31.468  0 637  LYS   A HA   1 c 1 
ATOM   8922  H  HB2  . LYS   A  1  582 ? -30.180 2.252   -8.379  1.000 35.989  0 637  LYS   A HB2  1 c 1 
ATOM   8923  H  HB3  . LYS   A  1  582 ? -31.619 1.905   -8.940  1.000 37.130  0 637  LYS   A HB3  1 c 1 
ATOM   8924  H  HG2  . LYS   A  1  582 ? -31.446 -0.144  -7.686  1.000 39.443  0 637  LYS   A HG2  1 c 1 
ATOM   8925  H  HG3  . LYS   A  1  582 ? -30.201 0.521   -6.963  1.000 38.575  0 637  LYS   A HG3  1 c 1 
ATOM   8926  H  HD2  . LYS   A  1  582 ? -31.499 2.115   -5.965  1.000 43.338  0 637  LYS   A HD2  1 c 1 
ATOM   8927  H  HD3  . LYS   A  1  582 ? -32.725 1.831   -6.942  1.000 44.148  0 637  LYS   A HD3  1 c 1 
ATOM   8928  H  HE2  . LYS   A  1  582 ? -32.806 -0.397  -5.925  1.000 50.140  0 637  LYS   A HE2  1 c 1 
ATOM   8929  H  HE3  . LYS   A  1  582 ? -31.862 0.186   -4.804  1.000 49.608  0 637  LYS   A HE3  1 c 1 
ATOM   8930  H  HZ1  . LYS   A  1  582 ? -34.392 1.126   -5.342  1.000 61.141  0 637  LYS   A HZ1  1 c 1 
ATOM   8931  H  HZ2  . LYS   A  1  582 ? -33.505 1.733   -4.328  1.000 60.513  0 637  LYS   A HZ2  1 c 1 
ATOM   8932  H  HZ3  . LYS   A  1  582 ? -34.019 0.364   -4.135  1.000 60.797  0 637  LYS   A HZ3  1 c 1 
ATOM   8933  N  N    . GLN   A  1  583 ? -32.023 0.342   -11.282 1.000 32.083  0 638  GLN   A N    1 ? 1 
ATOM   8934  C  CA   . GLN   A  1  583 ? -33.142 -0.375  -11.869 1.000 38.438  0 638  GLN   A CA   1 ? 1 
ATOM   8935  C  C    . GLN   A  1  583 ? -32.794 -1.029  -13.205 1.000 38.960  0 638  GLN   A C    1 ? 1 
ATOM   8936  O  O    . GLN   A  1  583 ? -33.679 -1.515  -13.895 1.000 33.065  0 638  GLN   A O    1 ? 1 
ATOM   8937  C  CB   . GLN   A  1  583 ? -34.325 0.589   -12.076 1.000 35.657  0 638  GLN   A CB   1 ? 1 
ATOM   8938  C  CG   . GLN   A  1  583 ? -34.893 1.168   -10.784 1.000 55.164  0 638  GLN   A CG   1 ? 1 
ATOM   8939  C  CD   . GLN   A  1  583 ? -34.474 2.614   -10.559 1.000 87.650  0 638  GLN   A CD   1 ? 1 
ATOM   8940  O  OE1  . GLN   A  1  583 ? -33.288 2.992   -10.696 1.000 65.379  0 638  GLN   A OE1  1 ? 1 
ATOM   8941  N  NE2  . GLN   A  1  583 ? -35.452 3.471   -10.228 1.000 75.649  0 638  GLN   A NE2  1 ? 1 
ATOM   8942  H  H    . GLN   A  1  583 ? -31.912 1.221   -11.504 1.000 32.953  0 638  GLN   A H    1 c 1 
ATOM   8943  H  HA   . GLN   A  1  583 ? -33.421 -1.081  -11.241 1.000 36.767  0 638  GLN   A HA   1 c 1 
ATOM   8944  H  HB2  . GLN   A  1  583 ? -34.029 1.323   -12.654 1.000 40.129  0 638  GLN   A HB2  1 c 1 
ATOM   8945  H  HB3  . GLN   A  1  583 ? -35.039 0.109   -12.546 1.000 40.510  0 638  GLN   A HB3  1 c 1 
ATOM   8946  H  HG2  . GLN   A  1  583 ? -35.872 1.117   -10.813 1.000 55.287  0 638  GLN   A HG2  1 c 1 
ATOM   8947  H  HG3  . GLN   A  1  583 ? -34.586 0.626   -10.027 1.000 53.824  0 638  GLN   A HG3  1 c 1 
ATOM   8948  H  HE21 . GLN   A  1  583 ? -36.217 3.167   -9.902  1.000 79.355  0 638  GLN   A HE21 1 c 1 
ATOM   8949  H  HE22 . GLN   A  1  583 ? -35.331 4.342   -10.334 1.000 79.250  0 638  GLN   A HE22 1 c 1 
ATOM   8950  N  N    . ALA   A  1  584 ? -31.508 -1.044  -13.577 1.000 42.829  0 639  ALA   A N    1 ? 1 
ATOM   8951  C  CA   . ALA   A  1  584 ? -31.105 -1.555  -14.880 1.000 35.553  0 639  ALA   A CA   1 ? 1 
ATOM   8952  C  C    . ALA   A  1  584 ? -31.523 -3.014  -15.040 1.000 34.518  0 639  ALA   A C    1 ? 1 
ATOM   8953  O  O    . ALA   A  1  584 ? -31.533 -3.780  -14.077 1.000 33.674  0 639  ALA   A O    1 ? 1 
ATOM   8954  C  CB   . ALA   A  1  584 ? -29.604 -1.428  -15.074 1.000 33.460  0 639  ALA   A CB   1 ? 1 
ATOM   8955  H  H    . ALA   A  1  584 ? -30.865 -0.732  -13.009 1.000 39.067  0 639  ALA   A H    1 c 1 
ATOM   8956  H  HA   . ALA   A  1  584 ? -31.559 -1.022  -15.574 1.000 36.716  0 639  ALA   A HA   1 c 1 
ATOM   8957  H  HB1  . ALA   A  1  584 ? -29.359 -1.769  -15.951 1.000 33.820  0 639  ALA   A HB1  1 c 1 
ATOM   8958  H  HB2  . ALA   A  1  584 ? -29.346 -0.493  -15.008 1.000 33.670  0 639  ALA   A HB2  1 c 1 
ATOM   8959  H  HB3  . ALA   A  1  584 ? -29.143 -1.940  -14.388 1.000 33.373  0 639  ALA   A HB3  1 c 1 
ATOM   8960  N  N    . GLU   A  1  585 ? -31.891 -3.374  -16.268 1.000 33.148  0 640  GLU   A N    1 ? 1 
ATOM   8961  C  CA   . GLU   A  1  585 ? -32.313 -4.726  -16.583 1.000 34.230  0 640  GLU   A CA   1 ? 1 
ATOM   8962  C  C    . GLU   A  1  585 ? -31.178 -5.481  -17.252 1.000 30.772  0 640  GLU   A C    1 ? 1 
ATOM   8963  O  O    . GLU   A  1  585 ? -30.493 -4.952  -18.124 1.000 38.136  0 640  GLU   A O    1 ? 1 
ATOM   8964  C  CB   . GLU   A  1  585 ? -33.574 -4.719  -17.458 1.000 40.043  0 640  GLU   A CB   1 ? 1 
ATOM   8965  C  CG   . GLU   A  1  585 ? -34.736 -4.049  -16.751 1.000 61.618  0 640  GLU   A CG   1 ? 1 
ATOM   8966  C  CD   . GLU   A  1  585 ? -36.058 -4.784  -16.763 1.000 61.149  0 640  GLU   A CD   1 ? 1 
ATOM   8967  O  OE1  . GLU   A  1  585 ? -36.332 -5.469  -15.752 1.000 67.655  0 640  GLU   A OE1  1 ? 1 
ATOM   8968  O  OE2  . GLU   A  1  585 ? -36.837 -4.639  -17.732 1.000 59.677  0 640  GLU   A OE2  1 ? 1 
ATOM   8969  H  H    . GLU   A  1  585 ? -31.878 -2.753  -16.939 1.000 33.921  0 640  GLU   A H    1 c 1 
ATOM   8970  H  HA   . GLU   A  1  585 ? -32.530 -5.181  -15.738 1.000 34.425  0 640  GLU   A HA   1 c 1 
ATOM   8971  H  HB2  . GLU   A  1  585 ? -33.382 -4.242  -18.292 1.000 42.525  0 640  GLU   A HB2  1 c 1 
ATOM   8972  H  HB3  . GLU   A  1  585 ? -33.815 -5.642  -17.680 1.000 42.775  0 640  GLU   A HB3  1 c 1 
ATOM   8973  H  HG2  . GLU   A  1  585 ? -34.486 -3.895  -15.815 1.000 54.319  0 640  GLU   A HG2  1 c 1 
ATOM   8974  H  HG3  . GLU   A  1  585 ? -34.879 -3.168  -17.159 1.000 55.234  0 640  GLU   A HG3  1 c 1 
ATOM   8975  N  N    . VAL   A  1  586 ? -30.940 -6.704  -16.768 1.000 32.090  0 641  VAL   A N    1 ? 1 
ATOM   8976  C  CA   . VAL   A  1  586 ? -29.940 -7.582  -17.348 1.000 30.229  0 641  VAL   A CA   1 ? 1 
ATOM   8977  C  C    . VAL   A  1  586 ? -30.663 -8.408  -18.395 1.000 28.939  0 641  VAL   A C    1 ? 1 
ATOM   8978  O  O    . VAL   A  1  586 ? -31.689 -8.975  -18.085 1.000 30.858  0 641  VAL   A O    1 ? 1 
ATOM   8979  C  CB   . VAL   A  1  586 ? -29.297 -8.494  -16.322 1.000 29.047  0 641  VAL   A CB   1 ? 1 
ATOM   8980  C  CG1  . VAL   A  1  586 ? -28.427 -9.562  -16.984 1.000 26.926  0 641  VAL   A CG1  1 ? 1 
ATOM   8981  C  CG2  . VAL   A  1  586 ? -28.507 -7.677  -15.310 1.000 27.124  0 641  VAL   A CG2  1 ? 1 
ATOM   8982  H  H    . VAL   A  1  586 ? -31.419 -7.003  -16.049 1.000 31.603  0 641  VAL   A H    1 c 1 
ATOM   8983  H  HA   . VAL   A  1  586 ? -29.251 -7.046  -17.777 1.000 29.597  0 641  VAL   A HA   1 c 1 
ATOM   8984  H  HB   . VAL   A  1  586 ? -30.025 -8.954  -15.837 1.000 28.969  0 641  VAL   A HB   1 c 1 
ATOM   8985  H  HG11 . VAL   A  1  586 ? -27.844 -9.145  -17.642 1.000 27.229  0 641  VAL   A HG11 1 c 1 
ATOM   8986  H  HG12 . VAL   A  1  586 ? -28.993 -10.221 -17.423 1.000 27.961  0 641  VAL   A HG12 1 c 1 
ATOM   8987  H  HG13 . VAL   A  1  586 ? -27.885 -10.004 -16.307 1.000 27.056  0 641  VAL   A HG13 1 c 1 
ATOM   8988  H  HG21 . VAL   A  1  586 ? -28.125 -8.271  -14.641 1.000 27.196  0 641  VAL   A HG21 1 c 1 
ATOM   8989  H  HG22 . VAL   A  1  586 ? -29.097 -7.038  -14.875 1.000 27.711  0 641  VAL   A HG22 1 c 1 
ATOM   8990  H  HG23 . VAL   A  1  586 ? -27.792 -7.200  -15.764 1.000 27.189  0 641  VAL   A HG23 1 c 1 
ATOM   8991  N  N    . SER   A  1  587 ? -30.113 -8.472  -19.605 1.000 26.479  0 642  SER   A N    1 ? 1 
ATOM   8992  C  CA   . SER   A  1  587 ? -30.685 -9.252  -20.691 1.000 30.199  0 642  SER   A CA   1 ? 1 
ATOM   8993  C  C    . SER   A  1  587 ? -29.631 -10.250 -21.149 1.000 32.801  0 642  SER   A C    1 ? 1 
ATOM   8994  O  O    . SER   A  1  587 ? -28.523 -10.282 -20.605 1.000 38.913  0 642  SER   A O    1 ? 1 
ATOM   8995  C  CB   . SER   A  1  587 ? -31.113 -8.357  -21.841 1.000 33.416  0 642  SER   A CB   1 ? 1 
ATOM   8996  O  OG   . SER   A  1  587 ? -30.102 -7.413  -22.151 1.000 40.070  0 642  SER   A OG   1 ? 1 
ATOM   8997  H  H    . SER   A  1  587 ? -29.343 -8.007  -19.764 1.000 27.254  0 642  SER   A H    1 c 1 
ATOM   8998  H  HA   . SER   A  1  587 ? -31.476 -9.752  -20.352 1.000 30.947  0 642  SER   A HA   1 c 1 
ATOM   8999  H  HB2  . SER   A  1  587 ? -31.305 -8.905  -22.634 1.000 34.655  0 642  SER   A HB2  1 c 1 
ATOM   9000  H  HB3  . SER   A  1  587 ? -31.939 -7.882  -21.593 1.000 34.639  0 642  SER   A HB3  1 c 1 
ATOM   9001  H  HG   . SER   A  1  587 ? -29.604 -7.740  -22.736 0.000 21.280  0 642  SER   A HG   1 c 1 
ATOM   9002  N  N    . SER   A  1  588 ? -30.001 -11.076 -22.126 1.000 35.007  0 643  SER   A N    1 ? 1 
ATOM   9003  C  CA   . SER   A  1  588 ? -29.137 -12.153 -22.568 1.000 43.759  0 643  SER   A CA   1 ? 1 
ATOM   9004  C  C    . SER   A  1  588 ? -28.343 -11.736 -23.798 1.000 39.908  0 643  SER   A C    1 ? 1 
ATOM   9005  O  O    . SER   A  1  588 ? -28.608 -10.694 -24.385 1.000 40.733  0 643  SER   A O    1 ? 1 
ATOM   9006  C  CB   . SER   A  1  588 ? -29.961 -13.387 -22.875 1.000 54.261  0 643  SER   A CB   1 ? 1 
ATOM   9007  O  OG   . SER   A  1  588 ? -29.087 -14.495 -22.984 1.000 99.194  0 643  SER   A OG   1 ? 1 
ATOM   9008  H  H    . SER   A  1  588 ? -30.820 -10.978 -22.520 1.000 36.921  0 643  SER   A H    1 c 1 
ATOM   9009  H  HA   . SER   A  1  588 ? -28.499 -12.370 -21.837 1.000 41.823  0 643  SER   A HA   1 c 1 
ATOM   9010  H  HB2  . SER   A  1  588 ? -30.612 -13.542 -22.154 1.000 59.635  0 643  SER   A HB2  1 c 1 
ATOM   9011  H  HB3  . SER   A  1  588 ? -30.451 -13.261 -23.720 1.000 59.862  0 643  SER   A HB3  1 c 1 
ATOM   9012  H  HG   . SER   A  1  588 ? -29.010 -14.848 -22.223 0.000 75.570  0 643  SER   A HG   1 c 1 
ATOM   9013  N  N    . ILE   A  1  589 ? -27.344 -12.542 -24.150 1.000 39.146  0 644  ILE   A N    1 ? 1 
ATOM   9014  C  CA   . ILE   A  1  589 ? -26.777 -12.515 -25.488 1.000 38.551  0 644  ILE   A CA   1 ? 1 
ATOM   9015  C  C    . ILE   A  1  589 ? -27.730 -13.334 -26.350 1.000 37.009  0 644  ILE   A C    1 ? 1 
ATOM   9016  O  O    . ILE   A  1  589 ? -27.786 -14.555 -26.206 1.000 49.946  0 644  ILE   A O    1 ? 1 
ATOM   9017  C  CB   . ILE   A  1  589 ? -25.324 -13.060 -25.528 1.000 34.033  0 644  ILE   A CB   1 ? 1 
ATOM   9018  C  CG1  . ILE   A  1  589 ? -24.381 -12.164 -24.751 1.000 31.614  0 644  ILE   A CG1  1 ? 1 
ATOM   9019  C  CG2  . ILE   A  1  589 ? -24.860 -13.245 -26.940 1.000 28.628  0 644  ILE   A CG2  1 ? 1 
ATOM   9020  C  CD1  . ILE   A  1  589 ? -23.077 -12.830 -24.399 1.000 36.322  0 644  ILE   A CD1  1 ? 1 
ATOM   9021  H  H    . ILE   A  1  589 ? -27.002 -13.128 -23.538 1.000 38.847  0 644  ILE   A H    1 c 1 
ATOM   9022  H  HA   . ILE   A  1  589 ? -26.769 -11.596 -25.807 1.000 37.319  0 644  ILE   A HA   1 c 1 
ATOM   9023  H  HB   . ILE   A  1  589 ? -25.325 -13.946 -25.090 1.000 33.106  0 644  ILE   A HB   1 c 1 
ATOM   9024  H  HG12 . ILE   A  1  589 ? -24.194 -11.363 -25.285 1.000 33.027  0 644  ILE   A HG12 1 c 1 
ATOM   9025  H  HG13 . ILE   A  1  589 ? -24.823 -11.878 -23.923 1.000 32.984  0 644  ILE   A HG13 1 c 1 
ATOM   9026  H  HG21 . ILE   A  1  589 ? -25.005 -12.424 -27.441 1.000 30.341  0 644  ILE   A HG21 1 c 1 
ATOM   9027  H  HG22 . ILE   A  1  589 ? -25.358 -13.970 -27.357 1.000 30.728  0 644  ILE   A HG22 1 c 1 
ATOM   9028  H  HG23 . ILE   A  1  589 ? -23.912 -13.464 -26.947 1.000 29.838  0 644  ILE   A HG23 1 c 1 
ATOM   9029  H  HD11 . ILE   A  1  589 ? -22.572 -13.010 -25.210 1.000 34.584  0 644  ILE   A HD11 1 c 1 
ATOM   9030  H  HD12 . ILE   A  1  589 ? -23.254 -13.667 -23.935 1.000 34.613  0 644  ILE   A HD12 1 c 1 
ATOM   9031  H  HD13 . ILE   A  1  589 ? -22.559 -12.244 -23.820 1.000 34.029  0 644  ILE   A HD13 1 c 1 
ATOM   9032  N  N    . PRO   A  1  590 ? -28.538 -12.712 -27.248 1.000 35.121  0 645  PRO   A N    1 ? 1 
ATOM   9033  C  CA   . PRO   A  1  590 ? -29.470 -13.494 -28.053 1.000 32.078  0 645  PRO   A CA   1 ? 1 
ATOM   9034  C  C    . PRO   A  1  590 ? -28.720 -14.611 -28.761 1.000 31.318  0 645  PRO   A C    1 ? 1 
ATOM   9035  O  O    . PRO   A  1  590 ? -27.571 -14.440 -29.152 1.000 30.051  0 645  PRO   A O    1 ? 1 
ATOM   9036  C  CB   . PRO   A  1  590 ? -30.078 -12.470 -29.035 1.000 31.908  0 645  PRO   A CB   1 ? 1 
ATOM   9037  C  CG   . PRO   A  1  590 ? -29.773 -11.119 -28.457 1.000 35.010  0 645  PRO   A CG   1 ? 1 
ATOM   9038  C  CD   . PRO   A  1  590 ? -28.582 -11.267 -27.545 1.000 30.859  0 645  PRO   A CD   1 ? 1 
ATOM   9039  H  HA   . PRO   A  1  590 ? -30.181 -13.865 -27.473 1.000 32.728  0 645  PRO   A HA   1 c 1 
ATOM   9040  H  HB2  . PRO   A  1  590 ? -29.676 -12.561 -29.925 1.000 33.042  0 645  PRO   A HB2  1 c 1 
ATOM   9041  H  HB3  . PRO   A  1  590 ? -31.047 -12.599 -29.114 1.000 33.485  0 645  PRO   A HB3  1 c 1 
ATOM   9042  H  HG2  . PRO   A  1  590 ? -29.573 -10.482 -29.173 1.000 33.450  0 645  PRO   A HG2  1 c 1 
ATOM   9043  H  HG3  . PRO   A  1  590 ? -30.543 -10.784 -27.954 1.000 33.553  0 645  PRO   A HG3  1 c 1 
ATOM   9044  H  HD2  . PRO   A  1  590 ? -27.764 -10.977 -27.989 1.000 32.134  0 645  PRO   A HD2  1 c 1 
ATOM   9045  H  HD3  . PRO   A  1  590 ? -28.702 -10.746 -26.731 1.000 32.197  0 645  PRO   A HD3  1 c 1 
ATOM   9046  N  N    . GLU   A  1  591 ? -29.400 -15.735 -28.972 1.000 34.682  0 646  GLU   A N    1 ? 1 
ATOM   9047  C  CA   . GLU   A  1  591 ? -28.797 -16.863 -29.657 1.000 35.409  0 646  GLU   A CA   1 ? 1 
ATOM   9048  C  C    . GLU   A  1  591 ? -28.218 -16.417 -31.000 1.000 33.674  0 646  GLU   A C    1 ? 1 
ATOM   9049  O  O    . GLU   A  1  591 ? -27.152 -16.881 -31.400 1.000 33.539  0 646  GLU   A O    1 ? 1 
ATOM   9050  C  CB   . GLU   A  1  591 ? -29.826 -17.983 -29.859 1.000 37.386  0 646  GLU   A CB   1 ? 1 
ATOM   9051  C  CG   . GLU   A  1  591 ? -29.300 -19.178 -30.646 1.000 34.194  0 646  GLU   A CG   1 ? 1 
ATOM   9052  C  CD   . GLU   A  1  591 ? -29.061 -18.950 -32.127 1.000 38.884  0 646  GLU   A CD   1 ? 1 
ATOM   9053  O  OE1  . GLU   A  1  591 ? -29.829 -18.187 -32.763 1.000 40.402  0 646  GLU   A OE1  1 ? 1 
ATOM   9054  O  OE2  . GLU   A  1  591 ? -28.109 -19.563 -32.655 1.000 45.129  0 646  GLU   A OE2  1 ? 1 
ATOM   9055  H  H    . GLU   A  1  591 ? -30.265 -15.802 -28.683 1.000 34.496  0 646  GLU   A H    1 c 1 
ATOM   9056  H  HA   . GLU   A  1  591 ? -28.065 -17.207 -29.097 1.000 34.593  0 646  GLU   A HA   1 c 1 
ATOM   9057  H  HB2  . GLU   A  1  591 ? -30.127 -18.292 -28.979 1.000 36.159  0 646  GLU   A HB2  1 c 1 
ATOM   9058  H  HB3  . GLU   A  1  591 ? -30.603 -17.612 -30.327 1.000 36.830  0 646  GLU   A HB3  1 c 1 
ATOM   9059  H  HG2  . GLU   A  1  591 ? -28.454 -19.467 -30.243 1.000 35.347  0 646  GLU   A HG2  1 c 1 
ATOM   9060  H  HG3  . GLU   A  1  591 ? -29.932 -19.917 -30.549 1.000 36.386  0 646  GLU   A HG3  1 c 1 
ATOM   9061  N  N    . HIS   A  1  592 ? -28.928 -15.509 -31.682 1.000 34.630  0 647  HIS   A N    1 ? 1 
ATOM   9062  C  CA   . HIS   A  1  592 ? -28.564 -15.113 -33.032 1.000 35.356  0 647  HIS   A CA   1 ? 1 
ATOM   9063  C  C    . HIS   A  1  592 ? -27.348 -14.180 -33.022 1.000 33.638  0 647  HIS   A C    1 ? 1 
ATOM   9064  O  O    . HIS   A  1  592 ? -26.780 -13.914 -34.071 1.000 37.435  0 647  HIS   A O    1 ? 1 
ATOM   9065  C  CB   . HIS   A  1  592 ? -29.789 -14.498 -33.771 1.000 37.371  0 647  HIS   A CB   1 ? 1 
ATOM   9066  C  CG   . HIS   A  1  592 ? -29.988 -13.020 -33.565 1.000 46.586  0 647  HIS   A CG   1 ? 1 
ATOM   9067  N  ND1  . HIS   A  1  592 ? -30.652 -12.522 -32.455 1.000 43.701  0 647  HIS   A ND1  1 ? 1 
ATOM   9068  C  CD2  . HIS   A  1  592 ? -29.631 -11.973 -34.355 1.000 41.470  0 647  HIS   A CD2  1 ? 1 
ATOM   9069  C  CE1  . HIS   A  1  592 ? -30.658 -11.201 -32.588 1.000 40.030  0 647  HIS   A CE1  1 ? 1 
ATOM   9070  N  NE2  . HIS   A  1  592 ? -30.048 -10.829 -33.719 1.000 39.068  0 647  HIS   A NE2  1 ? 1 
ATOM   9071  H  H    . HIS   A  1  592 ? -29.663 -15.128 -31.297 1.000 35.039  0 647  HIS   A H    1 c 1 
ATOM   9072  H  HA   . HIS   A  1  592 ? -28.311 -15.934 -33.517 1.000 35.570  0 647  HIS   A HA   1 c 1 
ATOM   9073  H  HB2  . HIS   A  1  592 ? -29.687 -14.665 -34.730 1.000 39.433  0 647  HIS   A HB2  1 c 1 
ATOM   9074  H  HB3  . HIS   A  1  592 ? -30.596 -14.964 -33.473 1.000 39.525  0 647  HIS   A HB3  1 c 1 
ATOM   9075  H  HD1  . HIS   A  1  592 ? -31.002 -13.008 -31.800 0.000 21.670  0 647  HIS   A HD1  1 c 1 
ATOM   9076  H  HD2  . HIS   A  1  592 ? -29.163 -12.023 -35.172 1.000 42.083  0 647  HIS   A HD2  1 c 1 
ATOM   9077  H  HE1  . HIS   A  1  592 ? -31.041 -10.609 -31.968 1.000 40.599  0 647  HIS   A HE1  1 c 1 
ATOM   9078  H  HE2  . HIS   A  1  592 ? -29.942 -9.994  -33.994 0.000 16.810  0 647  HIS   A HE2  1 c 1 
ATOM   9079  N  N    . LEU   A  1  593 ? -26.943 -13.686 -31.838 1.000 32.010  0 648  LEU   A N    1 ? 1 
ATOM   9080  C  CA   . LEU   A  1  593 ? -25.784 -12.816 -31.725 1.000 30.602  0 648  LEU   A CA   1 ? 1 
ATOM   9081  C  C    . LEU   A  1  593 ? -24.669 -13.464 -30.899 1.000 34.573  0 648  LEU   A C    1 ? 1 
ATOM   9082  O  O    . LEU   A  1  593 ? -23.714 -12.807 -30.480 1.000 39.430  0 648  LEU   A O    1 ? 1 
ATOM   9083  C  CB   . LEU   A  1  593 ? -26.245 -11.490 -31.114 1.000 33.552  0 648  LEU   A CB   1 ? 1 
ATOM   9084  C  CG   . LEU   A  1  593 ? -27.116 -10.573 -31.988 1.000 38.843  0 648  LEU   A CG   1 ? 1 
ATOM   9085  C  CD1  . LEU   A  1  593 ? -27.188 -9.151  -31.390 1.000 39.269  0 648  LEU   A CD1  1 ? 1 
ATOM   9086  C  CD2  . LEU   A  1  593 ? -26.591 -10.480 -33.450 1.000 38.857  0 648  LEU   A CD2  1 ? 1 
ATOM   9087  H  H    . LEU   A  1  593 ? -27.416 -13.881 -31.082 1.000 31.989  0 648  LEU   A H    1 c 1 
ATOM   9088  H  HA   . LEU   A  1  593 ? -25.433 -12.649 -32.628 1.000 32.385  0 648  LEU   A HA   1 c 1 
ATOM   9089  H  HB2  . LEU   A  1  593 ? -26.742 -11.692 -30.297 1.000 33.556  0 648  LEU   A HB2  1 c 1 
ATOM   9090  H  HB3  . LEU   A  1  593 ? -25.449 -10.986 -30.850 1.000 33.133  0 648  LEU   A HB3  1 c 1 
ATOM   9091  H  HG   . LEU   A  1  593 ? -28.030 -10.946 -32.010 1.000 38.487  0 648  LEU   A HG   1 c 1 
ATOM   9092  H  HD11 . LEU   A  1  593 ? -27.919 -8.661  -31.803 1.000 39.565  0 648  LEU   A HD11 1 c 1 
ATOM   9093  H  HD12 . LEU   A  1  593 ? -26.350 -8.685  -31.557 1.000 38.643  0 648  LEU   A HD12 1 c 1 
ATOM   9094  H  HD13 . LEU   A  1  593 ? -27.339 -9.210  -30.430 1.000 38.669  0 648  LEU   A HD13 1 c 1 
ATOM   9095  H  HD21 . LEU   A  1  593 ? -26.809 -11.299 -33.927 1.000 39.316  0 648  LEU   A HD21 1 c 1 
ATOM   9096  H  HD22 . LEU   A  1  593 ? -25.626 -10.356 -33.441 1.000 38.467  0 648  LEU   A HD22 1 c 1 
ATOM   9097  H  HD23 . LEU   A  1  593 ? -27.011 -9.724  -33.897 1.000 39.317  0 648  LEU   A HD23 1 c 1 
ATOM   9098  N  N    . THR   A  1  594 ? -24.794 -14.770 -30.669 1.000 29.420  0 649  THR   A N    1 ? 1 
ATOM   9099  C  CA   . THR   A  1  594 ? -23.850 -15.493 -29.848 1.000 29.543  0 649  THR   A CA   1 ? 1 
ATOM   9100  C  C    . THR   A  1  594 ? -22.408 -15.235 -30.296 1.000 34.647  0 649  THR   A C    1 ? 1 
ATOM   9101  O  O    . THR   A  1  594 ? -21.585 -14.758 -29.508 1.000 32.965  0 649  THR   A O    1 ? 1 
ATOM   9102  C  CB   . THR   A  1  594 ? -24.186 -16.977 -29.807 1.000 30.898  0 649  THR   A CB   1 ? 1 
ATOM   9103  O  OG1  . THR   A  1  594 ? -25.552 -17.194 -29.428 1.000 36.303  0 649  THR   A OG1  1 ? 1 
ATOM   9104  C  CG2  . THR   A  1  594 ? -23.327 -17.690 -28.849 1.000 35.083  0 649  THR   A CG2  1 ? 1 
ATOM   9105  H  H    . THR   A  1  594 ? -25.488 -15.230 -31.045 1.000 31.296  0 649  THR   A H    1 c 1 
ATOM   9106  H  HA   . THR   A  1  594 ? -23.942 -15.144 -28.931 1.000 30.022  0 649  THR   A HA   1 c 1 
ATOM   9107  H  HB   . THR   A  1  594 ? -24.040 -17.353 -30.708 1.000 32.821  0 649  THR   A HB   1 c 1 
ATOM   9108  H  HG1  . THR   A  1  594 ? -25.680 -16.868 -28.658 0.000 17.940  0 649  THR   A HG1  1 c 1 
ATOM   9109  H  HG21 . THR   A  1  594 ? -23.607 -18.620 -28.792 1.000 33.818  0 649  THR   A HG21 1 c 1 
ATOM   9110  H  HG22 . THR   A  1  594 ? -23.404 -17.275 -27.971 1.000 33.031  0 649  THR   A HG22 1 c 1 
ATOM   9111  H  HG23 . THR   A  1  594 ? -22.401 -17.649 -29.146 1.000 33.207  0 649  THR   A HG23 1 c 1 
ATOM   9112  N  N    . ASN   A  1  595 ? -22.084 -15.529 -31.555 1.000 34.050  0 650  ASN   A N    1 ? 1 
ATOM   9113  C  CA   . ASN   A  1  595 ? -20.718 -15.317 -32.026 1.000 33.638  0 650  ASN   A CA   1 ? 1 
ATOM   9114  C  C    . ASN   A  1  595 ? -20.572 -14.135 -32.983 1.000 34.369  0 650  ASN   A C    1 ? 1 
ATOM   9115  O  O    . ASN   A  1  595 ? -19.669 -14.104 -33.804 1.000 40.536  0 650  ASN   A O    1 ? 1 
ATOM   9116  C  CB   . ASN   A  1  595 ? -20.181 -16.606 -32.659 1.000 34.089  0 650  ASN   A CB   1 ? 1 
ATOM   9117  C  CG   . ASN   A  1  595 ? -19.981 -17.702 -31.607 1.000 34.560  0 650  ASN   A CG   1 ? 1 
ATOM   9118  O  OD1  . ASN   A  1  595 ? -20.267 -18.872 -31.830 1.000 41.054  0 650  ASN   A OD1  1 ? 1 
ATOM   9119  N  ND2  . ASN   A  1  595 ? -19.480 -17.363 -30.425 1.000 32.744  0 650  ASN   A ND2  1 ? 1 
ATOM   9120  H  H    . ASN   A  1  595 ? -22.712 -15.863 -32.129 1.000 34.853  0 650  ASN   A H    1 c 1 
ATOM   9121  H  HA   . ASN   A  1  595 ? -20.156 -15.130 -31.240 1.000 33.211  0 650  ASN   A HA   1 c 1 
ATOM   9122  H  HB2  . ASN   A  1  595 ? -20.812 -16.919 -33.339 1.000 34.896  0 650  ASN   A HB2  1 c 1 
ATOM   9123  H  HB3  . ASN   A  1  595 ? -19.325 -16.420 -33.097 1.000 34.175  0 650  ASN   A HB3  1 c 1 
ATOM   9124  H  HD21 . ASN   A  1  595 ? -18.777 -16.828 -30.379 1.000 32.661  0 650  ASN   A HD21 1 c 1 
ATOM   9125  H  HD22 . ASN   A  1  595 ? -19.848 -17.673 -29.683 1.000 32.923  0 650  ASN   A HD22 1 c 1 
ATOM   9126  N  N    . CYS   A  1  596 ? -21.457 -13.146 -32.864 1.000 33.121  0 651  CYS   A N    1 ? 1 
ATOM   9127  C  CA   . CYS   A  1  596 ? -21.355 -11.929 -33.649 1.000 31.171  0 651  CYS   A CA   1 ? 1 
ATOM   9128  C  C    . CYS   A  1  596 ? -20.153 -11.068 -33.222 1.000 35.558  0 651  CYS   A C    1 ? 1 
ATOM   9129  O  O    . CYS   A  1  596 ? -19.958 -10.776 -32.039 1.000 26.607  0 651  CYS   A O    1 ? 1 
ATOM   9130  C  CB   . CYS   A  1  596 ? -22.660 -11.148 -33.531 1.000 36.608  0 651  CYS   A CB   1 ? 1 
ATOM   9131  S  SG   . CYS   A  1  596 ? -22.574 -9.440  -34.119 1.000 39.886  0 651  CYS   A SG   1 ? 1 
ATOM   9132  H  H    . CYS   A  1  596 ? -22.146 -13.229 -32.270 1.000 32.969  0 651  CYS   A H    1 c 1 
ATOM   9133  H  HA   . CYS   A  1  596 ? -21.239 -12.188 -34.588 1.000 33.760  0 651  CYS   A HA   1 c 1 
ATOM   9134  H  HB2  . CYS   A  1  596 ? -23.354 -11.613 -34.041 1.000 36.432  0 651  CYS   A HB2  1 c 1 
ATOM   9135  H  HB3  . CYS   A  1  596 ? -22.939 -11.135 -32.593 1.000 35.398  0 651  CYS   A HB3  1 c 1 
ATOM   9136  N  N    . VAL   A  1  597 ? -19.338 -10.709 -34.216 1.000 29.679  0 652  VAL   A N    1 ? 1 
ATOM   9137  C  CA   . VAL   A  1  597 ? -18.381 -9.620  -34.137 1.000 33.301  0 652  VAL   A CA   1 ? 1 
ATOM   9138  C  C    . VAL   A  1  597 ? -18.638 -8.765  -35.372 1.000 31.456  0 652  VAL   A C    1 ? 1 
ATOM   9139  O  O    . VAL   A  1  597 ? -18.784 -9.291  -36.469 1.000 26.359  0 652  VAL   A O    1 ? 1 
ATOM   9140  C  CB   . VAL   A  1  597 ? -16.894 -10.091 -34.076 1.000 36.589  0 652  VAL   A CB   1 ? 1 
ATOM   9141  C  CG1  . VAL   A  1  597 ? -15.922 -8.913  -34.022 1.000 37.005  0 652  VAL   A CG1  1 ? 1 
ATOM   9142  C  CG2  . VAL   A  1  597 ? -16.652 -11.029 -32.891 1.000 33.179  0 652  VAL   A CG2  1 ? 1 
ATOM   9143  H  H    . VAL   A  1  597 ? -19.379 -11.183 -34.997 1.000 32.328  0 652  VAL   A H    1 c 1 
ATOM   9144  H  HA   . VAL   A  1  597 ? -18.575 -9.092  -33.344 1.000 31.947  0 652  VAL   A HA   1 c 1 
ATOM   9145  H  HB   . VAL   A  1  597 ? -16.711 -10.596 -34.905 1.000 35.999  0 652  VAL   A HB   1 c 1 
ATOM   9146  H  HG11 . VAL   A  1  597 ? -16.178 -8.312  -33.300 1.000 36.373  0 652  VAL   A HG11 1 c 1 
ATOM   9147  H  HG12 . VAL   A  1  597 ? -15.944 -8.431  -34.867 1.000 37.139  0 652  VAL   A HG12 1 c 1 
ATOM   9148  H  HG13 . VAL   A  1  597 ? -15.020 -9.243  -33.863 1.000 36.463  0 652  VAL   A HG13 1 c 1 
ATOM   9149  H  HG21 . VAL   A  1  597 ? -15.713 -11.284 -32.865 1.000 33.754  0 652  VAL   A HG21 1 c 1 
ATOM   9150  H  HG22 . VAL   A  1  597 ? -17.200 -11.827 -32.990 1.000 34.256  0 652  VAL   A HG22 1 c 1 
ATOM   9151  H  HG23 . VAL   A  1  597 ? -16.887 -10.575 -32.063 1.000 33.548  0 652  VAL   A HG23 1 c 1 
ATOM   9152  N  N    . ARG   A  1  598 ? -18.679 -7.447  -35.184 1.000 31.733  0 653  ARG   A N    1 ? 1 
ATOM   9153  C  CA   . ARG   A  1  598 ? -19.010 -6.517  -36.250 1.000 28.411  0 653  ARG   A CA   1 ? 1 
ATOM   9154  C  C    . ARG   A  1  598 ? -17.852 -5.568  -36.523 1.000 31.619  0 653  ARG   A C    1 ? 1 
ATOM   9155  O  O    . ARG   A  1  598 ? -17.196 -5.114  -35.585 1.000 30.726  0 653  ARG   A O    1 ? 1 
ATOM   9156  C  CB   . ARG   A  1  598 ? -20.216 -5.679  -35.855 1.000 30.668  0 653  ARG   A CB   1 ? 1 
ATOM   9157  C  CG   . ARG   A  1  598 ? -21.497 -6.461  -35.779 1.000 32.816  0 653  ARG   A CG   1 ? 1 
ATOM   9158  C  CD   . ARG   A  1  598 ? -22.633 -5.682  -35.164 1.000 39.766  0 653  ARG   A CD   1 ? 1 
ATOM   9159  N  NE   . ARG   A  1  598 ? -23.058 -4.532  -35.957 1.000 36.769  0 653  ARG   A NE   1 ? 1 
ATOM   9160  C  CZ   . ARG   A  1  598 ? -23.113 -3.278  -35.513 1.000 35.883  0 653  ARG   A CZ   1 ? 1 
ATOM   9161  N  NH1  . ARG   A  1  598 ? -22.755 -2.954  -34.282 1.000 33.793  0 653  ARG   A NH1  1 ? 1 
ATOM   9162  N  NH2  . ARG   A  1  598 ? -23.533 -2.321  -36.328 1.000 45.476  0 653  ARG   A NH2  1 ? 1 
ATOM   9163  H  H    . ARG   A  1  598 ? -18.489 -7.110  -34.356 1.000 30.113  0 653  ARG   A H    1 c 1 
ATOM   9164  H  HA   . ARG   A  1  598 ? -19.218 -7.023  -37.067 1.000 30.700  0 653  ARG   A HA   1 c 1 
ATOM   9165  H  HB2  . ARG   A  1  598 ? -20.041 -5.271  -34.981 1.000 29.956  0 653  ARG   A HB2  1 c 1 
ATOM   9166  H  HB3  . ARG   A  1  598 ? -20.325 -4.956  -36.508 1.000 30.926  0 653  ARG   A HB3  1 c 1 
ATOM   9167  H  HG2  . ARG   A  1  598 ? -21.758 -6.739  -36.683 1.000 34.369  0 653  ARG   A HG2  1 c 1 
ATOM   9168  H  HG3  . ARG   A  1  598 ? -21.345 -7.269  -35.249 1.000 33.445  0 653  ARG   A HG3  1 c 1 
ATOM   9169  H  HD2  . ARG   A  1  598 ? -23.399 -6.283  -35.046 1.000 37.382  0 653  ARG   A HD2  1 c 1 
ATOM   9170  H  HD3  . ARG   A  1  598 ? -22.359 -5.377  -34.273 1.000 36.471  0 653  ARG   A HD3  1 c 1 
ATOM   9171  H  HE   . ARG   A  1  598 ? -23.294 -4.676  -36.784 1.000 38.034  0 653  ARG   A HE   1 c 1 
ATOM   9172  H  HH11 . ARG   A  1  598 ? -21.973 -3.213  -33.968 1.000 33.675  0 653  ARG   A HH11 1 c 1 
ATOM   9173  H  HH12 . ARG   A  1  598 ? -23.298 -2.470  -33.783 1.000 34.117  0 653  ARG   A HH12 1 c 1 
ATOM   9174  H  HH21 . ARG   A  1  598 ? -23.528 -1.484  -36.059 1.000 42.115  0 653  ARG   A HH21 1 c 1 
ATOM   9175  H  HH22 . ARG   A  1  598 ? -23.816 -2.524  -37.135 1.000 42.792  0 653  ARG   A HH22 1 c 1 
ATOM   9176  N  N    . PRO   A  1  599 ? -17.577 -5.202  -37.794 1.000 43.947  0 654  PRO   A N    1 ? 1 
ATOM   9177  C  CA   . PRO   A  1  599 ? -16.543 -4.198  -38.061 1.000 38.682  0 654  PRO   A CA   1 ? 1 
ATOM   9178  C  C    . PRO   A  1  599 ? -17.053 -2.864  -37.530 1.000 29.753  0 654  PRO   A C    1 ? 1 
ATOM   9179  O  O    . PRO   A  1  599 ? -18.259 -2.631  -37.515 1.000 28.810  0 654  PRO   A O    1 ? 1 
ATOM   9180  C  CB   . PRO   A  1  599 ? -16.387 -4.250  -39.610 1.000 37.644  0 654  PRO   A CB   1 ? 1 
ATOM   9181  C  CG   . PRO   A  1  599 ? -17.739 -4.784  -40.100 1.000 46.309  0 654  PRO   A CG   1 ? 1 
ATOM   9182  C  CD   . PRO   A  1  599 ? -18.220 -5.732  -39.018 1.000 36.234  0 654  PRO   A CD   1 ? 1 
ATOM   9183  H  HA   . PRO   A  1  599 ? -15.695 -4.455  -37.621 1.000 36.557  0 654  PRO   A HA   1 c 1 
ATOM   9184  H  HB2  . PRO   A  1  599 ? -16.210 -3.357  -39.977 1.000 39.864  0 654  PRO   A HB2  1 c 1 
ATOM   9185  H  HB3  . PRO   A  1  599 ? -15.657 -4.852  -39.870 1.000 39.647  0 654  PRO   A HB3  1 c 1 
ATOM   9186  H  HG2  . PRO   A  1  599 ? -18.376 -4.051  -40.223 1.000 42.191  0 654  PRO   A HG2  1 c 1 
ATOM   9187  H  HG3  . PRO   A  1  599 ? -17.635 -5.257  -40.951 1.000 42.447  0 654  PRO   A HG3  1 c 1 
ATOM   9188  H  HD2  . PRO   A  1  599 ? -19.192 -5.712  -38.942 1.000 40.042  0 654  PRO   A HD2  1 c 1 
ATOM   9189  H  HD3  . PRO   A  1  599 ? -17.933 -6.646  -39.197 1.000 40.025  0 654  PRO   A HD3  1 c 1 
ATOM   9190  N  N    . ASP   A  1  600 ? -16.129 -1.993  -37.144 1.000 28.384  0 655  ASP   A N    1 ? 1 
ATOM   9191  C  CA   . ASP   A  1  600 ? -16.458 -0.633  -36.731 1.000 27.268  0 655  ASP   A CA   1 ? 1 
ATOM   9192  C  C    . ASP   A  1  600 ? -16.076 0.316   -37.866 1.000 28.575  0 655  ASP   A C    1 ? 1 
ATOM   9193  O  O    . ASP   A  1  600 ? -14.891 0.459   -38.180 1.000 33.752  0 655  ASP   A O    1 ? 1 
ATOM   9194  C  CB   . ASP   A  1  600 ? -15.689 -0.270  -35.439 1.000 27.719  0 655  ASP   A CB   1 ? 1 
ATOM   9195  C  CG   . ASP   A  1  600 ? -16.173 1.004   -34.796 1.000 28.770  0 655  ASP   A CG   1 ? 1 
ATOM   9196  O  OD1  . ASP   A  1  600 ? -16.615 1.926   -35.555 1.000 26.946  0 655  ASP   A OD1  1 ? 1 
ATOM   9197  O  OD2  . ASP   A  1  600 ? -16.158 1.080   -33.525 1.000 23.088  0 655  ASP   A OD2  1 ? 1 
ATOM   9198  H  H    . ASP   A  1  600 ? -15.253 -2.250  -37.135 1.000 28.214  0 655  ASP   A H    1 c 1 
ATOM   9199  H  HA   . ASP   A  1  600 ? -17.426 -0.569  -36.560 1.000 28.039  0 655  ASP   A HA   1 c 1 
ATOM   9200  H  HB2  . ASP   A  1  600 ? -15.787 -0.999  -34.792 1.000 27.230  0 655  ASP   A HB2  1 c 1 
ATOM   9201  H  HB3  . ASP   A  1  600 ? -14.737 -0.171  -35.645 1.000 27.553  0 655  ASP   A HB3  1 c 1 
ATOM   9202  N  N    . VAL   A  1  601 ? -17.081 0.966   -38.469 1.000 31.670  0 656  VAL   A N    1 ? 1 
ATOM   9203  C  CA   . VAL   A  1  601 ? -16.850 1.780   -39.652 1.000 36.202  0 656  VAL   A CA   1 ? 1 
ATOM   9204  C  C    . VAL   A  1  601 ? -16.012 3.016   -39.341 1.000 42.339  0 656  VAL   A C    1 ? 1 
ATOM   9205  O  O    . VAL   A  1  601 ? -15.474 3.615   -40.271 1.000 37.886  0 656  VAL   A O    1 ? 1 
ATOM   9206  C  CB   . VAL   A  1  601 ? -18.152 2.184   -40.389 1.000 37.353  0 656  VAL   A CB   1 ? 1 
ATOM   9207  C  CG1  . VAL   A  1  601 ? -18.889 0.942   -40.892 1.000 40.678  0 656  VAL   A CG1  1 ? 1 
ATOM   9208  C  CG2  . VAL   A  1  601 ? -19.069 3.056   -39.533 1.000 32.500  0 656  VAL   A CG2  1 ? 1 
ATOM   9209  H  H    . VAL   A  1  601 ? -17.929 0.897   -38.137 1.000 31.812  0 656  VAL   A H    1 c 1 
ATOM   9210  H  HA   . VAL   A  1  601 ? -16.332 1.236   -40.271 1.000 36.604  0 656  VAL   A HA   1 c 1 
ATOM   9211  H  HB   . VAL   A  1  601 ? -17.888 2.716   -41.178 1.000 37.465  0 656  VAL   A HB   1 c 1 
ATOM   9212  H  HG11 . VAL   A  1  601 ? -19.136 0.382   -40.136 1.000 39.207  0 656  VAL   A HG11 1 c 1 
ATOM   9213  H  HG12 . VAL   A  1  601 ? -18.309 0.440   -41.490 1.000 39.921  0 656  VAL   A HG12 1 c 1 
ATOM   9214  H  HG13 . VAL   A  1  601 ? -19.691 1.213   -41.370 1.000 40.373  0 656  VAL   A HG13 1 c 1 
ATOM   9215  H  HG21 . VAL   A  1  601 ? -19.882 3.257   -40.029 1.000 34.503  0 656  VAL   A HG21 1 c 1 
ATOM   9216  H  HG22 . VAL   A  1  601 ? -18.614 3.886   -39.309 1.000 33.737  0 656  VAL   A HG22 1 c 1 
ATOM   9217  H  HG23 . VAL   A  1  601 ? -19.300 2.583   -38.715 1.000 33.271  0 656  VAL   A HG23 1 c 1 
ATOM   9218  N  N    . ARG   A  1  602 ? -15.898 3.368   -38.043 1.000 34.350  0 657  ARG   A N    1 ? 1 
ATOM   9219  C  CA   . ARG   A  1  602 ? -15.073 4.491   -37.617 1.000 33.090  0 657  ARG   A CA   1 ? 1 
ATOM   9220  C  C    . ARG   A  1  602 ? -13.566 4.210   -37.577 1.000 31.983  0 657  ARG   A C    1 ? 1 
ATOM   9221  O  O    . ARG   A  1  602 ? -12.765 5.142   -37.513 1.000 30.831  0 657  ARG   A O    1 ? 1 
ATOM   9222  C  CB   . ARG   A  1  602 ? -15.509 4.971   -36.235 1.000 32.544  0 657  ARG   A CB   1 ? 1 
ATOM   9223  C  CG   . ARG   A  1  602 ? -16.955 5.456   -36.177 1.000 31.418  0 657  ARG   A CG   1 ? 1 
ATOM   9224  C  CD   . ARG   A  1  602 ? -17.474 5.545   -34.728 1.000 28.793  0 657  ARG   A CD   1 ? 1 
ATOM   9225  N  NE   . ARG   A  1  602 ? -17.492 4.242   -34.065 1.000 25.707  0 657  ARG   A NE   1 ? 1 
ATOM   9226  C  CZ   . ARG   A  1  602 ? -17.997 4.019   -32.854 1.000 25.127  0 657  ARG   A CZ   1 ? 1 
ATOM   9227  N  NH1  . ARG   A  1  602 ? -18.517 4.997   -32.129 1.000 24.359  0 657  ARG   A NH1  1 ? 1 
ATOM   9228  N  NH2  . ARG   A  1  602 ? -18.051 2.773   -32.395 1.000 22.776  0 657  ARG   A NH2  1 ? 1 
ATOM   9229  H  H    . ARG   A  1  602 ? -16.363 2.904   -37.408 1.000 35.104  0 657  ARG   A H    1 c 1 
ATOM   9230  H  HA   . ARG   A  1  602 ? -15.224 5.226   -38.254 1.000 33.867  0 657  ARG   A HA   1 c 1 
ATOM   9231  H  HB2  . ARG   A  1  602 ? -15.391 4.237   -35.599 1.000 31.487  0 657  ARG   A HB2  1 c 1 
ATOM   9232  H  HB3  . ARG   A  1  602 ? -14.920 5.704   -35.959 1.000 31.930  0 657  ARG   A HB3  1 c 1 
ATOM   9233  H  HG2  . ARG   A  1  602 ? -17.018 6.342   -36.591 1.000 31.915  0 657  ARG   A HG2  1 c 1 
ATOM   9234  H  HG3  . ARG   A  1  602 ? -17.527 4.843   -36.684 1.000 31.719  0 657  ARG   A HG3  1 c 1 
ATOM   9235  H  HD2  . ARG   A  1  602 ? -16.900 6.156   -34.218 1.000 28.247  0 657  ARG   A HD2  1 c 1 
ATOM   9236  H  HD3  . ARG   A  1  602 ? -18.381 5.917   -34.732 1.000 28.908  0 657  ARG   A HD3  1 c 1 
ATOM   9237  H  HE   . ARG   A  1  602 ? -17.161 3.562   -34.495 1.000 26.318  0 657  ARG   A HE   1 c 1 
ATOM   9238  H  HH11 . ARG   A  1  602 ? -18.293 5.834   -32.291 1.000 24.995  0 657  ARG   A HH11 1 c 1 
ATOM   9239  H  HH12 . ARG   A  1  602 ? -19.085 4.806   -31.481 1.000 24.446  0 657  ARG   A HH12 1 c 1 
ATOM   9240  H  HH21 . ARG   A  1  602 ? -17.963 2.620   -31.534 1.000 22.842  0 657  ARG   A HH21 1 c 1 
ATOM   9241  H  HH22 . ARG   A  1  602 ? -18.174 2.107   -32.954 1.000 23.635  0 657  ARG   A HH22 1 c 1 
ATOM   9242  N  N    . VAL   A  1  603 ? -13.177 2.931   -37.620 1.000 35.585  0 658  VAL   A N    1 ? 1 
ATOM   9243  C  CA   . VAL   A  1  603 ? -11.792 2.522   -37.458 1.000 34.256  0 658  VAL   A CA   1 ? 1 
ATOM   9244  C  C    . VAL   A  1  603 ? -11.334 1.709   -38.664 1.000 37.485  0 658  VAL   A C    1 ? 1 
ATOM   9245  O  O    . VAL   A  1  603 ? -12.006 0.762   -39.083 1.000 32.193  0 658  VAL   A O    1 ? 1 
ATOM   9246  C  CB   . VAL   A  1  603 ? -11.598 1.698   -36.155 1.000 39.722  0 658  VAL   A CB   1 ? 1 
ATOM   9247  C  CG1  . VAL   A  1  603 ? -10.187 1.083   -36.081 1.000 35.570  0 658  VAL   A CG1  1 ? 1 
ATOM   9248  C  CG2  . VAL   A  1  603 ? -11.920 2.546   -34.930 1.000 34.409  0 658  VAL   A CG2  1 ? 1 
ATOM   9249  H  H    . VAL   A  1  603 ? -13.806 2.282   -37.752 1.000 34.519  0 658  VAL   A H    1 c 1 
ATOM   9250  H  HA   . VAL   A  1  603 ? -11.240 3.322   -37.399 1.000 35.863  0 658  VAL   A HA   1 c 1 
ATOM   9251  H  HB   . VAL   A  1  603 ? -12.248 0.953   -36.181 1.000 36.842  0 658  VAL   A HB   1 c 1 
ATOM   9252  H  HG11 . VAL   A  1  603 ? -9.530  1.738   -36.376 1.000 36.786  0 658  VAL   A HG11 1 c 1 
ATOM   9253  H  HG12 . VAL   A  1  603 ? -10.142 0.298   -36.653 1.000 36.937  0 658  VAL   A HG12 1 c 1 
ATOM   9254  H  HG13 . VAL   A  1  603 ? -9.994  0.823   -35.163 1.000 36.023  0 658  VAL   A HG13 1 c 1 
ATOM   9255  H  HG21 . VAL   A  1  603 ? -11.759 2.025   -34.123 1.000 35.144  0 658  VAL   A HG21 1 c 1 
ATOM   9256  H  HG22 . VAL   A  1  603 ? -12.854 2.818   -34.958 1.000 35.919  0 658  VAL   A HG22 1 c 1 
ATOM   9257  H  HG23 . VAL   A  1  603 ? -11.353 3.336   -34.923 1.000 35.700  0 658  VAL   A HG23 1 c 1 
ATOM   9258  N  N    . SER   A  1  604 ? -10.179 2.103   -39.212 1.000 36.359  0 659  SER   A N    1 ? 1 
ATOM   9259  C  CA   . SER   A  1  604 ? -9.567  1.395   -40.321 1.000 40.972  0 659  SER   A CA   1 ? 1 
ATOM   9260  C  C    . SER   A  1  604 ? -9.543  -0.108  -40.064 1.000 45.982  0 659  SER   A C    1 ? 1 
ATOM   9261  O  O    . SER   A  1  604 ? -9.380  -0.528  -38.920 1.000 53.116  0 659  SER   A O    1 ? 1 
ATOM   9262  C  CB   . SER   A  1  604 ? -8.149  1.895   -40.543 1.000 40.325  0 659  SER   A CB   1 ? 1 
ATOM   9263  O  OG   . SER   A  1  604 ? -7.340  0.856   -41.054 1.000 51.652  0 659  SER   A OG   1 ? 1 
ATOM   9264  H  H    . SER   A  1  604 ? -9.761  2.846   -38.882 1.000 37.382  0 659  SER   A H    1 c 1 
ATOM   9265  H  HA   . SER   A  1  604 ? -10.101 1.573   -41.137 1.000 41.750  0 659  SER   A HA   1 c 1 
ATOM   9266  H  HB2  . SER   A  1  604 ? -8.159  2.646   -41.175 1.000 43.470  0 659  SER   A HB2  1 c 1 
ATOM   9267  H  HB3  . SER   A  1  604 ? -7.774  2.214   -39.692 1.000 42.236  0 659  SER   A HB3  1 c 1 
ATOM   9268  H  HG   . SER   A  1  604 ? -7.379  0.894   -41.912 0.000 31.640  0 659  SER   A HG   1 c 1 
ATOM   9269  N  N    . PRO   A  1  605 ? -9.719  -0.946  -41.115 1.000 47.047  0 660  PRO   A N    1 ? 1 
ATOM   9270  C  CA   . PRO   A  1  605 ? -9.422  -2.378  -41.025 1.000 50.770  0 660  PRO   A CA   1 ? 1 
ATOM   9271  C  C    . PRO   A  1  605 ? -8.051  -2.659  -40.414 1.000 46.437  0 660  PRO   A C    1 ? 1 
ATOM   9272  O  O    . PRO   A  1  605 ? -7.927  -3.516  -39.542 1.000 39.863  0 660  PRO   A O    1 ? 1 
ATOM   9273  C  CB   . PRO   A  1  605 ? -9.473  -2.848  -42.491 1.000 46.901  0 660  PRO   A CB   1 ? 1 
ATOM   9274  C  CG   . PRO   A  1  605 ? -10.398 -1.857  -43.171 1.000 48.814  0 660  PRO   A CG   1 ? 1 
ATOM   9275  C  CD   . PRO   A  1  605 ? -10.221 -0.545  -42.444 1.000 44.641  0 660  PRO   A CD   1 ? 1 
ATOM   9276  H  HA   . PRO   A  1  605 ? -10.130 -2.832  -40.504 1.000 48.087  0 660  PRO   A HA   1 c 1 
ATOM   9277  H  HB2  . PRO   A  1  605 ? -8.581  -2.829  -42.899 1.000 48.387  0 660  PRO   A HB2  1 c 1 
ATOM   9278  H  HB3  . PRO   A  1  605 ? -9.831  -3.759  -42.555 1.000 48.270  0 660  PRO   A HB3  1 c 1 
ATOM   9279  H  HG2  . PRO   A  1  605 ? -10.162 -1.760  -44.116 1.000 48.307  0 660  PRO   A HG2  1 c 1 
ATOM   9280  H  HG3  . PRO   A  1  605 ? -11.327 -2.159  -43.111 1.000 47.703  0 660  PRO   A HG3  1 c 1 
ATOM   9281  H  HD2  . PRO   A  1  605 ? -9.578  0.027   -42.903 1.000 46.510  0 660  PRO   A HD2  1 c 1 
ATOM   9282  H  HD3  . PRO   A  1  605 ? -11.069 -0.070  -42.369 1.000 46.280  0 660  PRO   A HD3  1 c 1 
ATOM   9283  N  N    . GLY   A  1  606 ? -7.043  -1.903  -40.873 1.000 40.358  0 661  GLY   A N    1 ? 1 
ATOM   9284  C  CA   . GLY   A  1  606 ? -5.665  -2.084  -40.446 1.000 40.947  0 661  GLY   A CA   1 ? 1 
ATOM   9285  C  C    . GLY   A  1  606 ? -5.414  -1.894  -38.947 1.000 42.934  0 661  GLY   A C    1 ? 1 
ATOM   9286  O  O    . GLY   A  1  606 ? -4.462  -2.451  -38.416 1.000 35.458  0 661  GLY   A O    1 ? 1 
ATOM   9287  H  H    . GLY   A  1  606 ? -7.224  -1.248  -41.485 1.000 42.524  0 661  GLY   A H    1 c 1 
ATOM   9288  H  HA2  . GLY   A  1  606 ? -5.376  -2.995  -40.703 1.000 41.497  0 661  GLY   A HA2  1 c 1 
ATOM   9289  H  HA3  . GLY   A  1  606 ? -5.097  -1.445  -40.946 1.000 41.714  0 661  GLY   A HA3  1 c 1 
ATOM   9290  N  N    . PHE   A  1  607 ? -6.258  -1.102  -38.277 1.000 34.234  0 662  PHE   A N    1 ? 1 
ATOM   9291  C  CA   . PHE   A  1  607 ? -6.097  -0.843  -36.853 1.000 39.356  0 662  PHE   A CA   1 ? 1 
ATOM   9292  C  C    . PHE   A  1  607 ? -7.211  -1.526  -36.068 1.000 33.614  0 662  PHE   A C    1 ? 1 
ATOM   9293  O  O    . PHE   A  1  607 ? -7.560  -1.091  -34.976 1.000 33.563  0 662  PHE   A O    1 ? 1 
ATOM   9294  C  CB   . PHE   A  1  607 ? -6.080  0.683   -36.590 1.000 38.094  0 662  PHE   A CB   1 ? 1 
ATOM   9295  C  CG   . PHE   A  1  607 ? -4.982  1.424   -37.321 1.000 35.408  0 662  PHE   A CG   1 ? 1 
ATOM   9296  C  CD1  . PHE   A  1  607 ? -3.657  1.037   -37.189 1.000 46.607  0 662  PHE   A CD1  1 ? 1 
ATOM   9297  C  CD2  . PHE   A  1  607 ? -5.274  2.526   -38.111 1.000 52.646  0 662  PHE   A CD2  1 ? 1 
ATOM   9298  C  CE1  . PHE   A  1  607 ? -2.642  1.726   -37.856 1.000 52.798  0 662  PHE   A CE1  1 ? 1 
ATOM   9299  C  CE2  . PHE   A  1  607 ? -4.265  3.205   -38.786 1.000 49.351  0 662  PHE   A CE2  1 ? 1 
ATOM   9300  C  CZ   . PHE   A  1  607 ? -2.953  2.799   -38.653 1.000 48.915  0 662  PHE   A CZ   1 ? 1 
ATOM   9301  H  H    . PHE   A  1  607 ? -6.949  -0.700  -38.720 1.000 37.672  0 662  PHE   A H    1 c 1 
ATOM   9302  H  HA   . PHE   A  1  607 ? -5.232  -1.222  -36.555 1.000 36.677  0 662  PHE   A HA   1 c 1 
ATOM   9303  H  HB2  . PHE   A  1  607 ? -6.947  1.053   -36.857 1.000 37.924  0 662  PHE   A HB2  1 c 1 
ATOM   9304  H  HB3  . PHE   A  1  607 ? -5.974  0.831   -35.628 1.000 36.988  0 662  PHE   A HB3  1 c 1 
ATOM   9305  H  HD1  . PHE   A  1  607 ? -3.441  0.295   -36.648 1.000 44.117  0 662  PHE   A HD1  1 c 1 
ATOM   9306  H  HD2  . PHE   A  1  607 ? -6.170  2.802   -38.212 1.000 46.955  0 662  PHE   A HD2  1 c 1 
ATOM   9307  H  HE1  . PHE   A  1  607 ? -1.745  1.446   -37.768 1.000 50.124  0 662  PHE   A HE1  1 c 1 
ATOM   9308  H  HE2  . PHE   A  1  607 ? -4.478  3.948   -39.328 1.000 50.470  0 662  PHE   A HE2  1 c 1 
ATOM   9309  H  HZ   . PHE   A  1  607 ? -2.268  3.267   -39.102 1.000 50.297  0 662  PHE   A HZ   1 c 1 
ATOM   9310  N  N    . SER   A  1  608 ? -7.738  -2.612  -36.646 1.000 36.569  0 663  SER   A N    1 ? 1 
ATOM   9311  C  CA   . SER   A  1  608 ? -8.779  -3.416  -36.035 1.000 30.639  0 663  SER   A CA   1 ? 1 
ATOM   9312  C  C    . SER   A  1  608 ? -8.255  -4.822  -35.770 1.000 28.388  0 663  SER   A C    1 ? 1 
ATOM   9313  O  O    . SER   A  1  608 ? -7.354  -5.288  -36.454 1.000 29.676  0 663  SER   A O    1 ? 1 
ATOM   9314  C  CB   . SER   A  1  608 ? -9.995  -3.488  -36.951 1.000 31.890  0 663  SER   A CB   1 ? 1 
ATOM   9315  O  OG   . SER   A  1  608 ? -10.671 -2.246  -37.072 1.000 33.714  0 663  SER   A OG   1 ? 1 
ATOM   9316  H  H    . SER   A  1  608 ? -7.426  -2.869  -37.465 1.000 35.057  0 663  SER   A H    1 c 1 
ATOM   9317  H  HA   . SER   A  1  608 ? -9.045  -3.001  -35.171 1.000 30.809  0 663  SER   A HA   1 c 1 
ATOM   9318  H  HB2  . SER   A  1  608 ? -9.708  -3.785  -37.842 1.000 32.684  0 663  SER   A HB2  1 c 1 
ATOM   9319  H  HB3  . SER   A  1  608 ? -10.622 -4.160  -36.599 1.000 31.992  0 663  SER   A HB3  1 c 1 
ATOM   9320  H  HG   . SER   A  1  608 ? -10.330 -1.825  -37.737 0.000 16.640  0 663  SER   A HG   1 c 1 
ATOM   9321  N  N    . GLN   A  1  609 ? -8.847  -5.493  -34.777 1.000 30.980  0 664  GLN   A N    1 ? 1 
ATOM   9322  C  CA   . GLN   A  1  609 ? -8.580  -6.892  -34.516 1.000 26.476  0 664  GLN   A CA   1 ? 1 
ATOM   9323  C  C    . GLN   A  1  609 ? -9.243  -7.667  -35.641 1.000 33.696  0 664  GLN   A C    1 ? 1 
ATOM   9324  O  O    . GLN   A  1  609 ? -9.920  -7.066  -36.465 1.000 27.965  0 664  GLN   A O    1 ? 1 
ATOM   9325  C  CB   . GLN   A  1  609 ? -9.156  -7.328  -33.183 1.000 24.467  0 664  GLN   A CB   1 ? 1 
ATOM   9326  C  CG   . GLN   A  1  609 ? -8.392  -6.781  -32.007 1.000 24.273  0 664  GLN   A CG   1 ? 1 
ATOM   9327  C  CD   . GLN   A  1  609 ? -8.990  -7.258  -30.690 1.000 29.670  0 664  GLN   A CD   1 ? 1 
ATOM   9328  O  OE1  . GLN   A  1  609 ? -9.320  -8.446  -30.508 1.000 23.063  0 664  GLN   A OE1  1 ? 1 
ATOM   9329  N  NE2  . GLN   A  1  609 ? -9.176  -6.330  -29.761 1.000 30.152  0 664  GLN   A NE2  1 ? 1 
ATOM   9330  H  H    . GLN   A  1  609 ? -9.445  -5.055  -34.241 1.000 28.818  0 664  GLN   A H    1 c 1 
ATOM   9331  H  HA   . GLN   A  1  609 ? -7.608  -7.050  -34.529 1.000 27.924  0 664  GLN   A HA   1 c 1 
ATOM   9332  H  HB2  . GLN   A  1  609 ? -10.087 -7.028  -33.131 1.000 24.994  0 664  GLN   A HB2  1 c 1 
ATOM   9333  H  HB3  . GLN   A  1  609 ? -9.151  -8.307  -33.143 1.000 25.066  0 664  GLN   A HB3  1 c 1 
ATOM   9334  H  HG2  . GLN   A  1  609 ? -7.456  -7.070  -32.062 1.000 25.325  0 664  GLN   A HG2  1 c 1 
ATOM   9335  H  HG3  . GLN   A  1  609 ? -8.409  -5.803  -32.038 1.000 25.331  0 664  GLN   A HG3  1 c 1 
ATOM   9336  H  HE21 . GLN   A  1  609 ? -8.856  -5.514  -29.877 1.000 29.631  0 664  GLN   A HE21 1 c 1 
ATOM   9337  H  HE22 . GLN   A  1  609 ? -9.620  -6.528  -29.023 1.000 29.442  0 664  GLN   A HE22 1 c 1 
ATOM   9338  N  N    . ASN   A  1  610 ? -9.031  -8.985  -35.671 1.000 34.794  0 665  ASN   A N    1 ? 1 
ATOM   9339  C  CA   . ASN   A  1  610 ? -9.719  -9.829  -36.634 1.000 40.223  0 665  ASN   A CA   1 ? 1 
ATOM   9340  C  C    . ASN   A  1  610 ? -10.051 -11.150 -35.960 1.000 30.608  0 665  ASN   A C    1 ? 1 
ATOM   9341  O  O    . ASN   A  1  610 ? -9.427  -11.503 -34.959 1.000 28.146  0 665  ASN   A O    1 ? 1 
ATOM   9342  C  CB   . ASN   A  1  610 ? -8.900  -10.005 -37.898 1.000 38.968  0 665  ASN   A CB   1 ? 1 
ATOM   9343  C  CG   . ASN   A  1  610 ? -7.680  -10.844 -37.688 1.000 46.384  0 665  ASN   A CG   1 ? 1 
ATOM   9344  O  OD1  . ASN   A  1  610 ? -7.772  -12.097 -37.670 1.000 40.449  0 665  ASN   A OD1  1 ? 1 
ATOM   9345  N  ND2  . ASN   A  1  610 ? -6.516  -10.183 -37.552 1.000 38.756  0 665  ASN   A ND2  1 ? 1 
ATOM   9346  H  H    . ASN   A  1  610 ? -8.441  -9.366  -35.085 1.000 34.884  0 665  ASN   A H    1 c 1 
ATOM   9347  H  HA   . ASN   A  1  610 ? -10.565 -9.389  -36.886 1.000 36.934  0 665  ASN   A HA   1 c 1 
ATOM   9348  H  HB2  . ASN   A  1  610 ? -9.458  -10.421 -38.583 1.000 41.526  0 665  ASN   A HB2  1 c 1 
ATOM   9349  H  HB3  . ASN   A  1  610 ? -8.629  -9.122  -38.224 1.000 41.065  0 665  ASN   A HB3  1 c 1 
ATOM   9350  H  HD21 . ASN   A  1  610 ? -6.508  -9.364  -37.219 1.000 40.500  0 665  ASN   A HD21 1 c 1 
ATOM   9351  H  HD22 . ASN   A  1  610 ? -5.758  -10.568 -37.795 1.000 40.999  0 665  ASN   A HD22 1 c 1 
ATOM   9352  N  N    . CYS   A  1  611 ? -11.060 -11.837 -36.499 1.000 26.305  0 666  CYS   A N    1 ? 1 
ATOM   9353  C  CA   . CYS   A  1  611 ? -11.582 -13.054 -35.896 1.000 37.158  0 666  CYS   A CA   1 ? 1 
ATOM   9354  C  C    . CYS   A  1  611 ? -10.735 -14.271 -36.266 1.000 34.284  0 666  CYS   A C    1 ? 1 
ATOM   9355  O  O    . CYS   A  1  611 ? -10.694 -15.245 -35.523 1.000 32.391  0 666  CYS   A O    1 ? 1 
ATOM   9356  C  CB   . CYS   A  1  611 ? -13.050 -13.263 -36.274 1.000 39.842  0 666  CYS   A CB   1 ? 1 
ATOM   9357  S  SG   . CYS   A  1  611 ? -14.191 -12.041 -35.556 1.000 46.892  0 666  CYS   A SG   1 ? 1 
ATOM   9358  H  H    . CYS   A  1  611 ? -11.438 -11.537 -37.275 1.000 30.003  0 666  CYS   A H    1 c 1 
ATOM   9359  H  HA   . CYS   A  1  611 ? -11.539 -12.941 -34.918 1.000 33.419  0 666  CYS   A HA   1 c 1 
ATOM   9360  H  HB2  . CYS   A  1  611 ? -13.132 -13.225 -37.245 1.000 40.804  0 666  CYS   A HB2  1 c 1 
ATOM   9361  H  HB3  . CYS   A  1  611 ? -13.330 -14.155 -35.984 1.000 40.487  0 666  CYS   A HB3  1 c 1 
ATOM   9362  N  N    . LEU   A  1  612 ? -10.028 -14.193 -37.401 1.000 30.630  0 667  LEU   A N    1 ? 1 
ATOM   9363  C  CA   . LEU   A  1  612 ? -9.181  -15.289 -37.831 1.000 35.901  0 667  LEU   A CA   1 ? 1 
ATOM   9364  C  C    . LEU   A  1  612 ? -8.090  -15.578 -36.799 1.000 35.618  0 667  LEU   A C    1 ? 1 
ATOM   9365  O  O    . LEU   A  1  612 ? -7.786  -16.743 -36.529 1.000 31.055  0 667  LEU   A O    1 ? 1 
ATOM   9366  C  CB   . LEU   A  1  612 ? -8.610  -14.989 -39.231 1.000 43.470  0 667  LEU   A CB   1 ? 1 
ATOM   9367  C  CG   . LEU   A  1  612 ? -7.815  -16.111 -39.861 1.000 60.845  0 667  LEU   A CG   1 ? 1 
ATOM   9368  C  CD1  . LEU   A  1  612 ? -8.672  -17.372 -40.043 1.000 66.065  0 667  LEU   A CD1  1 ? 1 
ATOM   9369  C  CD2  . LEU   A  1  612 ? -7.236  -15.677 -41.188 1.000 62.041  0 667  LEU   A CD2  1 ? 1 
ATOM   9370  H  H    . LEU   A  1  612 ? -10.082 -13.445 -37.922 1.000 32.783  0 667  LEU   A H    1 c 1 
ATOM   9371  H  HA   . LEU   A  1  612 ? -9.751  -16.088 -37.891 1.000 36.403  0 667  LEU   A HA   1 c 1 
ATOM   9372  H  HB2  . LEU   A  1  612 ? -9.354  -14.765 -39.826 1.000 45.122  0 667  LEU   A HB2  1 c 1 
ATOM   9373  H  HB3  . LEU   A  1  612 ? -8.036  -14.200 -39.168 1.000 44.477  0 667  LEU   A HB3  1 c 1 
ATOM   9374  H  HG   . LEU   A  1  612 ? -7.064  -16.334 -39.257 1.000 57.265  0 667  LEU   A HG   1 c 1 
ATOM   9375  H  HD11 . LEU   A  1  612 ? -8.127  -18.079 -40.432 1.000 64.885  0 667  LEU   A HD11 1 c 1 
ATOM   9376  H  HD12 . LEU   A  1  612 ? -9.418  -17.174 -40.637 1.000 64.871  0 667  LEU   A HD12 1 c 1 
ATOM   9377  H  HD13 . LEU   A  1  612 ? -9.013  -17.665 -39.181 1.000 63.566  0 667  LEU   A HD13 1 c 1 
ATOM   9378  H  HD21 . LEU   A  1  612 ? -6.651  -14.912 -41.052 1.000 61.631  0 667  LEU   A HD21 1 c 1 
ATOM   9379  H  HD22 . LEU   A  1  612 ? -7.958  -15.430 -41.792 1.000 62.292  0 667  LEU   A HD22 1 c 1 
ATOM   9380  H  HD23 . LEU   A  1  612 ? -6.726  -16.410 -41.575 1.000 62.324  0 667  LEU   A HD23 1 c 1 
ATOM   9381  N  N    . ALA   A  1  613 ? -7.549  -14.511 -36.188 1.000 27.199  0 668  ALA   A N    1 ? 1 
ATOM   9382  C  CA   . ALA   A  1  613 ? -6.524  -14.664 -35.177 1.000 27.925  0 668  ALA   A CA   1 ? 1 
ATOM   9383  C  C    . ALA   A  1  613 ? -6.991  -15.592 -34.064 1.000 30.287  0 668  ALA   A C    1 ? 1 
ATOM   9384  O  O    . ALA   A  1  613 ? -6.230  -16.425 -33.581 1.000 33.905  0 668  ALA   A O    1 ? 1 
ATOM   9385  C  CB   . ALA   A  1  613 ? -6.145  -13.311 -34.605 1.000 31.491  0 668  ALA   A CB   1 ? 1 
ATOM   9386  H  H    . ALA   A  1  613 ? -7.823  -13.669 -36.415 1.000 29.081  0 668  ALA   A H    1 c 1 
ATOM   9387  H  HA   . ALA   A  1  613 ? -5.727  -15.063 -35.601 1.000 29.116  0 668  ALA   A HA   1 c 1 
ATOM   9388  H  HB1  . ALA   A  1  613 ? -5.434  -13.422 -33.952 1.000 29.776  0 668  ALA   A HB1  1 c 1 
ATOM   9389  H  HB2  . ALA   A  1  613 ? -5.838  -12.730 -35.321 1.000 30.416  0 668  ALA   A HB2  1 c 1 
ATOM   9390  H  HB3  . ALA   A  1  613 ? -6.919  -12.912 -34.174 1.000 29.837  0 668  ALA   A HB3  1 c 1 
ATOM   9391  N  N    . TYR   A  1  614 ? -8.247  -15.428 -33.659 1.000 28.568  0 669  TYR   A N    1 ? 1 
ATOM   9392  C  CA   . TYR   A  1  614 ? -8.777  -16.194 -32.548 1.000 25.679  0 669  TYR   A CA   1 ? 1 
ATOM   9393  C  C    . TYR   A  1  614 ? -8.985  -17.652 -32.925 1.000 28.967  0 669  TYR   A C    1 ? 1 
ATOM   9394  O  O    . TYR   A  1  614 ? -8.666  -18.525 -32.133 1.000 28.437  0 669  TYR   A O    1 ? 1 
ATOM   9395  C  CB   . TYR   A  1  614 ? -10.045 -15.522 -32.021 1.000 29.304  0 669  TYR   A CB   1 ? 1 
ATOM   9396  C  CG   . TYR   A  1  614 ? -9.735  -14.228 -31.320 1.000 29.800  0 669  TYR   A CG   1 ? 1 
ATOM   9397  C  CD1  . TYR   A  1  614 ? -9.246  -14.219 -30.021 1.000 28.945  0 669  TYR   A CD1  1 ? 1 
ATOM   9398  C  CD2  . TYR   A  1  614 ? -9.885  -13.000 -31.974 1.000 35.636  0 669  TYR   A CD2  1 ? 1 
ATOM   9399  C  CE1  . TYR   A  1  614 ? -8.952  -13.021 -29.371 1.000 30.989  0 669  TYR   A CE1  1 ? 1 
ATOM   9400  C  CE2  . TYR   A  1  614 ? -9.592  -11.795 -31.336 1.000 26.092  0 669  TYR   A CE2  1 ? 1 
ATOM   9401  C  CZ   . TYR   A  1  614 ? -9.109  -11.810 -30.042 1.000 29.733  0 669  TYR   A CZ   1 ? 1 
ATOM   9402  O  OH   . TYR   A  1  614 ? -8.812  -10.631 -29.399 1.000 30.784  0 669  TYR   A OH   1 ? 1 
ATOM   9403  H  H    . TYR   A  1  614 ? -8.787  -14.821 -34.077 1.000 28.435  0 669  TYR   A H    1 c 1 
ATOM   9404  H  HA   . TYR   A  1  614 ? -8.104  -16.172 -31.821 1.000 26.928  0 669  TYR   A HA   1 c 1 
ATOM   9405  H  HB2  . TYR   A  1  614 ? -10.651 -15.350 -32.771 1.000 28.995  0 669  TYR   A HB2  1 c 1 
ATOM   9406  H  HB3  . TYR   A  1  614 ? -10.493 -16.131 -31.397 1.000 28.441  0 669  TYR   A HB3  1 c 1 
ATOM   9407  H  HD1  . TYR   A  1  614 ? -9.132  -15.035 -29.563 1.000 29.523  0 669  TYR   A HD1  1 c 1 
ATOM   9408  H  HD2  . TYR   A  1  614 ? -10.209 -12.985 -32.859 1.000 32.198  0 669  TYR   A HD2  1 c 1 
ATOM   9409  H  HE1  . TYR   A  1  614 ? -8.623  -13.031 -28.487 1.000 29.501  0 669  TYR   A HE1  1 c 1 
ATOM   9410  H  HE2  . TYR   A  1  614 ? -9.703  -10.977 -31.791 1.000 28.955  0 669  TYR   A HE2  1 c 1 
ATOM   9411  H  HH   . TYR   A  1  614 ? -8.544  -10.650 -28.584 0.000 16.180  0 669  TYR   A HH   1 c 1 
ATOM   9412  N  N    A LYS   A  1  615 ? -9.474  -17.909 -34.146 0.500 32.598  0 670  LYS   A N    1 ? 1 
ATOM   9413  N  N    B LYS   A  1  615 ? -9.519  -17.886 -34.134 0.500 31.039  0 670  LYS   A N    1 ? 1 
ATOM   9414  C  CA   A LYS   A  1  615 ? -9.665  -19.273 -34.607 0.500 35.362  0 670  LYS   A CA   1 ? 1 
ATOM   9415  C  CA   B LYS   A  1  615 ? -9.652  -19.218 -34.706 0.500 33.172  0 670  LYS   A CA   1 ? 1 
ATOM   9416  C  C    A LYS   A  1  615 ? -8.339  -20.030 -34.690 0.500 34.421  0 670  LYS   A C    1 ? 1 
ATOM   9417  C  C    B LYS   A  1  615 ? -8.339  -19.992 -34.648 0.500 33.525  0 670  LYS   A C    1 ? 1 
ATOM   9418  O  O    A LYS   A  1  615 ? -8.284  -21.210 -34.351 0.500 39.367  0 670  LYS   A O    1 ? 1 
ATOM   9419  O  O    B LYS   A  1  615 ? -8.291  -21.127 -34.179 0.500 40.655  0 670  LYS   A O    1 ? 1 
ATOM   9420  C  CB   A LYS   A  1  615 ? -10.390 -19.292 -35.972 0.500 46.083  0 670  LYS   A CB   1 ? 1 
ATOM   9421  C  CB   B LYS   A  1  615 ? -10.119 -19.100 -36.185 0.500 37.543  0 670  LYS   A CB   1 ? 1 
ATOM   9422  C  CG   A LYS   A  1  615 ? -10.728 -20.706 -36.475 0.500 59.158  0 670  LYS   A CG   1 ? 1 
ATOM   9423  C  CG   B LYS   A  1  615 ? -10.288 -20.427 -36.913 0.500 43.708  0 670  LYS   A CG   1 ? 1 
ATOM   9424  C  CD   A LYS   A  1  615 ? -11.466 -21.580 -35.443 0.500 52.238  0 670  LYS   A CD   1 ? 1 
ATOM   9425  C  CD   B LYS   A  1  615 ? -10.912 -20.261 -38.299 0.500 39.360  0 670  LYS   A CD   1 ? 1 
ATOM   9426  C  CE   A LYS   A  1  615 ? -12.809 -21.007 -35.057 0.500 50.227  0 670  LYS   A CE   1 ? 1 
ATOM   9427  C  CE   B LYS   A  1  615 ? -11.429 -21.544 -38.865 0.500 36.037  0 670  LYS   A CE   1 ? 1 
ATOM   9428  N  NZ   A LYS   A  1  615 ? -13.606 -21.975 -34.268 0.500 41.007  0 670  LYS   A NZ   1 ? 1 
ATOM   9429  N  NZ   B LYS   A  1  615 ? -12.266 -21.280 -40.063 0.500 38.751  0 670  LYS   A NZ   1 ? 1 
ATOM   9430  H  H    A LYS   A  1  615 ? -9.699  -17.218 -34.700 0.500 32.369  0 670  LYS   A H    1 c 1 
ATOM   9431  H  H    B LYS   A  1  615 ? -9.822  -17.176 -34.623 0.500 31.082  0 670  LYS   A H    1 c 1 
ATOM   9432  H  HA   A LYS   A  1  615 ? -10.237 -19.733 -33.951 0.500 35.980  0 670  LYS   A HA   1 c 1 
ATOM   9433  H  HA   B LYS   A  1  615 ? -10.333 -19.710 -34.193 0.500 33.453  0 670  LYS   A HA   1 c 1 
ATOM   9434  H  HB2  A LYS   A  1  615 ? -11.220 -18.778 -35.894 0.500 45.561  0 670  LYS   A HB2  1 c 1 
ATOM   9435  H  HB2  B LYS   A  1  615 ? -10.975 -18.624 -36.202 0.500 37.723  0 670  LYS   A HB2  1 c 1 
ATOM   9436  H  HB3  A LYS   A  1  615 ? -9.821  -18.849 -36.636 0.500 45.844  0 670  LYS   A HB3  1 c 1 
ATOM   9437  H  HB3  B LYS   A  1  615 ? -9.467  -18.558 -36.674 0.500 37.776  0 670  LYS   A HB3  1 c 1 
ATOM   9438  H  HG2  A LYS   A  1  615 ? -11.285 -20.628 -37.279 0.500 54.966  0 670  LYS   A HG2  1 c 1 
ATOM   9439  H  HG2  B LYS   A  1  615 ? -9.409  -20.854 -37.005 0.500 41.276  0 670  LYS   A HG2  1 c 1 
ATOM   9440  H  HG3  A LYS   A  1  615 ? -9.895  -21.155 -36.732 0.500 54.664  0 670  LYS   A HG3  1 c 1 
ATOM   9441  H  HG3  B LYS   A  1  615 ? -10.855 -21.017 -36.373 0.500 41.116  0 670  LYS   A HG3  1 c 1 
ATOM   9442  H  HD2  A LYS   A  1  615 ? -11.598 -22.477 -35.817 0.500 53.747  0 670  LYS   A HD2  1 c 1 
ATOM   9443  H  HD2  B LYS   A  1  615 ? -11.652 -19.619 -38.241 0.500 39.180  0 670  LYS   A HD2  1 c 1 
ATOM   9444  H  HD3  A LYS   A  1  615 ? -10.912 -21.665 -34.638 0.500 52.722  0 670  LYS   A HD3  1 c 1 
ATOM   9445  H  HD3  B LYS   A  1  615 ? -10.240 -19.892 -38.911 0.500 39.502  0 670  LYS   A HD3  1 c 1 
ATOM   9446  H  HE2  A LYS   A  1  615 ? -12.679 -20.196 -34.529 0.500 47.545  0 670  LYS   A HE2  1 c 1 
ATOM   9447  H  HE2  B LYS   A  1  615 ? -10.681 -22.120 -39.116 0.500 37.627  0 670  LYS   A HE2  1 c 1 
ATOM   9448  H  HE3  A LYS   A  1  615 ? -13.306 -20.767 -35.862 0.500 48.566  0 670  LYS   A HE3  1 c 1 
ATOM   9449  H  HE3  B LYS   A  1  615 ? -11.964 -22.010 -38.195 0.500 37.190  0 670  LYS   A HE3  1 c 1 
ATOM   9450  H  HZ1  A LYS   A  1  615 ? -13.157 -22.200 -33.513 0.500 43.153  0 670  LYS   A HZ1  1 c 1 
ATOM   9451  H  HZ1  B LYS   A  1  615 ? -11.770 -20.864 -40.699 0.500 38.329  0 670  LYS   A HZ1  1 c 1 
ATOM   9452  H  HZ2  A LYS   A  1  615 ? -13.755 -22.723 -34.759 0.500 44.104  0 670  LYS   A HZ2  1 c 1 
ATOM   9453  H  HZ2  B LYS   A  1  615 ? -12.966 -20.748 -39.837 0.500 37.920  0 670  LYS   A HZ2  1 c 1 
ATOM   9454  H  HZ3  A LYS   A  1  615 ? -14.403 -21.605 -34.042 0.500 43.455  0 670  LYS   A HZ3  1 c 1 
ATOM   9455  H  HZ3  B LYS   A  1  615 ? -12.582 -22.062 -40.396 0.500 38.649  0 670  LYS   A HZ3  1 c 1 
ATOM   9456  N  N    . ASN   A  1  616 ? -7.270  -19.347 -35.123 1.000 33.287  0 671  ASN   A N    1 ? 1 
ATOM   9457  C  CA   . ASN   A  1  616 ? -5.966  -19.978 -35.219 1.000 33.100  0 671  ASN   A CA   1 ? 1 
ATOM   9458  C  C    . ASN   A  1  616 ? -5.298  -20.174 -33.864 1.000 38.192  0 671  ASN   A C    1 ? 1 
ATOM   9459  O  O    . ASN   A  1  616 ? -4.417  -21.013 -33.735 1.000 37.941  0 671  ASN   A O    1 ? 1 
ATOM   9460  C  CB   . ASN   A  1  616 ? -5.063  -19.199 -36.166 1.000 41.512  0 671  ASN   A CB   1 ? 1 
ATOM   9461  C  CG   . ASN   A  1  616 ? -5.520  -19.359 -37.623 1.000 54.359  0 671  ASN   A CG   1 ? 1 
ATOM   9462  O  OD1  . ASN   A  1  616 ? -6.343  -20.229 -37.992 1.000 44.060  0 671  ASN   A OD1  1 ? 1 
ATOM   9463  N  ND2  . ASN   A  1  616 ? -5.009  -18.523 -38.478 1.000 56.715  0 671  ASN   A ND2  1 ? 1 
ATOM   9464  H  H    . ASN   A  1  616 ? -7.358  -18.476 -35.384 1.000 33.426  0 671  ASN   A H    1 c 1 
ATOM   9465  H  HA   . ASN   A  1  616 ? -6.095  -20.870 -35.618 1.000 36.273  0 671  ASN   A HA   1 c 1 
ATOM   9466  H  HB2  . ASN   A  1  616 ? -5.080  -18.251 -35.922 1.000 41.020  0 671  ASN   A HB2  1 c 1 
ATOM   9467  H  HB3  . ASN   A  1  616 ? -4.144  -19.524 -36.076 1.000 41.492  0 671  ASN   A HB3  1 c 1 
ATOM   9468  H  HD21 . ASN   A  1  616 ? -4.435  -17.908 -38.207 1.000 55.446  0 671  ASN   A HD21 1 c 1 
ATOM   9469  H  HD22 . ASN   A  1  616 ? -5.236  -18.569 -39.331 1.000 56.435  0 671  ASN   A HD22 1 c 1 
ATOM   9470  N  N    . ASP   A  1  617 ? -5.736  -19.419 -32.856 1.000 35.659  0 672  ASP   A N    1 ? 1 
ATOM   9471  C  CA   . ASP   A  1  617 ? -5.160  -19.545 -31.530 1.000 42.144  0 672  ASP   A CA   1 ? 1 
ATOM   9472  C  C    . ASP   A  1  617 ? -6.047  -20.509 -30.756 1.000 37.698  0 672  ASP   A C    1 ? 1 
ATOM   9473  O  O    . ASP   A  1  617 ? -7.180  -20.181 -30.407 1.000 41.780  0 672  ASP   A O    1 ? 1 
ATOM   9474  C  CB   . ASP   A  1  617 ? -5.056  -18.186 -30.832 1.000 42.292  0 672  ASP   A CB   1 ? 1 
ATOM   9475  C  CG   . ASP   A  1  617 ? -4.093  -18.165 -29.664 1.000 45.600  0 672  ASP   A CG   1 ? 1 
ATOM   9476  O  OD1  . ASP   A  1  617 ? -4.179  -19.079 -28.793 1.000 41.740  0 672  ASP   A OD1  1 ? 1 
ATOM   9477  O  OD2  . ASP   A  1  617 ? -3.260  -17.242 -29.609 1.000 43.875  0 672  ASP   A OD2  1 ? 1 
ATOM   9478  H  H    . ASP   A  1  617 ? -6.391  -18.799 -32.996 1.000 37.217  0 672  ASP   A H    1 c 1 
ATOM   9479  H  HA   . ASP   A  1  617 ? -4.256  -19.929 -31.609 1.000 40.062  0 672  ASP   A HA   1 c 1 
ATOM   9480  H  HB2  . ASP   A  1  617 ? -4.761  -17.519 -31.484 1.000 43.062  0 672  ASP   A HB2  1 c 1 
ATOM   9481  H  HB3  . ASP   A  1  617 ? -5.941  -17.922 -30.506 1.000 42.664  0 672  ASP   A HB3  1 c 1 
ATOM   9482  N  N    . LYS   A  1  618 ? -5.504  -21.695 -30.483 1.000 38.445  0 673  LYS   A N    1 ? 1 
ATOM   9483  C  CA   . LYS   A  1  618 ? -6.291  -22.754 -29.888 1.000 52.857  0 673  LYS   A CA   1 ? 1 
ATOM   9484  C  C    . LYS   A  1  618 ? -6.527  -22.499 -28.402 1.000 41.711  0 673  LYS   A C    1 ? 1 
ATOM   9485  O  O    . LYS   A  1  618 ? -7.532  -22.948 -27.865 1.000 49.651  0 673  LYS   A O    1 ? 1 
ATOM   9486  C  CB   . LYS   A  1  618 ? -5.640  -24.110 -30.178 1.000 50.615  0 673  LYS   A CB   1 ? 1 
ATOM   9487  C  CG   . LYS   A  1  618 ? -5.553  -24.425 -31.698 1.000 57.165  0 673  LYS   A CG   1 ? 1 
ATOM   9488  C  CD   . LYS   A  1  618 ? -6.907  -24.293 -32.420 1.000 66.385  0 673  LYS   A CD   1 ? 1 
ATOM   9489  C  CE   . LYS   A  1  618 ? -6.830  -24.640 -33.866 1.000 72.296  0 673  LYS   A CE   1 ? 1 
ATOM   9490  N  NZ   . LYS   A  1  618 ? -5.915  -23.724 -34.586 1.000 73.288  0 673  LYS   A NZ   1 ? 1 
ATOM   9491  H  H    . LYS   A  1  618 ? -4.622  -21.848 -30.669 1.000 41.216  0 673  LYS   A H    1 c 1 
ATOM   9492  H  HA   . LYS   A  1  618 ? -7.171  -22.746 -30.326 1.000 47.366  0 673  LYS   A HA   1 c 1 
ATOM   9493  H  HB2  . LYS   A  1  618 ? -4.736  -24.116 -29.799 1.000 52.298  0 673  LYS   A HB2  1 c 1 
ATOM   9494  H  HB3  . LYS   A  1  618 ? -6.160  -24.813 -29.736 1.000 52.577  0 673  LYS   A HB3  1 c 1 
ATOM   9495  H  HG2  . LYS   A  1  618 ? -4.908  -23.813 -32.111 1.000 57.594  0 673  LYS   A HG2  1 c 1 
ATOM   9496  H  HG3  . LYS   A  1  618 ? -5.217  -25.339 -31.813 1.000 58.065  0 673  LYS   A HG3  1 c 1 
ATOM   9497  H  HD2  . LYS   A  1  618 ? -7.561  -24.881 -31.986 1.000 65.342  0 673  LYS   A HD2  1 c 1 
ATOM   9498  H  HD3  . LYS   A  1  618 ? -7.228  -23.370 -32.337 1.000 64.737  0 673  LYS   A HD3  1 c 1 
ATOM   9499  H  HE2  . LYS   A  1  618 ? -6.510  -25.557 -33.968 1.000 71.756  0 673  LYS   A HE2  1 c 1 
ATOM   9500  H  HE3  . LYS   A  1  618 ? -7.719  -24.583 -34.266 1.000 71.548  0 673  LYS   A HE3  1 c 1 
ATOM   9501  H  HZ1  . LYS   A  1  618 ? -5.054  -23.970 -34.440 1.000 72.611  0 673  LYS   A HZ1  1 c 1 
ATOM   9502  H  HZ2  . LYS   A  1  618 ? -6.036  -22.875 -34.295 1.000 71.635  0 673  LYS   A HZ2  1 c 1 
ATOM   9503  H  HZ3  . LYS   A  1  618 ? -6.084  -23.758 -35.476 1.000 73.250  0 673  LYS   A HZ3  1 c 1 
ATOM   9504  N  N    . GLN   A  1  619 ? -5.670  -21.698 -27.767 1.000 39.628  0 674  GLN   A N    1 ? 1 
ATOM   9505  C  CA   . GLN   A  1  619 ? -5.856  -21.379 -26.359 1.000 36.564  0 674  GLN   A CA   1 ? 1 
ATOM   9506  C  C    . GLN   A  1  619 ? -6.697  -20.129 -26.073 1.000 30.837  0 674  GLN   A C    1 ? 1 
ATOM   9507  O  O    . GLN   A  1  619 ? -7.292  -20.033 -25.002 1.000 36.099  0 674  GLN   A O    1 ? 1 
ATOM   9508  C  CB   . GLN   A  1  619 ? -4.485  -21.219 -25.685 1.000 34.134  0 674  GLN   A CB   1 ? 1 
ATOM   9509  C  CG   . GLN   A  1  619 ? -3.873  -22.497 -25.152 1.000 46.825  0 674  GLN   A CG   1 ? 1 
ATOM   9510  C  CD   . GLN   A  1  619 ? -2.983  -22.246 -23.917 1.000 76.652  0 674  GLN   A CD   1 ? 1 
ATOM   9511  O  OE1  . GLN   A  1  619 ? -2.725  -21.112 -23.487 1.000 70.762  0 674  GLN   A OE1  1 ? 1 
ATOM   9512  N  NE2  . GLN   A  1  619 ? -2.496  -23.305 -23.299 1.000 88.778  0 674  GLN   A NE2  1 ? 1 
ATOM   9513  H  H    . GLN   A  1  619 ? -4.954  -21.348 -28.213 1.000 39.464  0 674  GLN   A H    1 c 1 
ATOM   9514  H  HA   . GLN   A  1  619 ? -6.310  -22.144 -25.938 1.000 35.880  0 674  GLN   A HA   1 c 1 
ATOM   9515  H  HB2  . GLN   A  1  619 ? -3.868  -20.821 -26.333 1.000 37.229  0 674  GLN   A HB2  1 c 1 
ATOM   9516  H  HB3  . GLN   A  1  619 ? -4.583  -20.584 -24.945 1.000 36.781  0 674  GLN   A HB3  1 c 1 
ATOM   9517  H  HG2  . GLN   A  1  619 ? -4.588  -23.123 -24.909 1.000 48.243  0 674  GLN   A HG2  1 c 1 
ATOM   9518  H  HG3  . GLN   A  1  619 ? -3.334  -22.915 -25.857 1.000 48.692  0 674  GLN   A HG3  1 c 1 
ATOM   9519  H  HE21 . GLN   A  1  619 ? -2.650  -24.115 -23.619 1.000 84.895  0 674  GLN   A HE21 1 c 1 
ATOM   9520  H  HE22 . GLN   A  1  619 ? -2.013  -23.207 -22.564 1.000 84.396  0 674  GLN   A HE22 1 c 1 
ATOM   9521  N  N    . MET   A  1  620 ? -6.768  -19.182 -27.018 1.000 32.244  0 675  MET   A N    1 ? 1 
ATOM   9522  C  CA   . MET   A  1  620 ? -7.355  -17.872 -26.754 1.000 28.824  0 675  MET   A CA   1 ? 1 
ATOM   9523  C  C    . MET   A  1  620 ? -8.767  -17.719 -27.327 1.000 27.877  0 675  MET   A C    1 ? 1 
ATOM   9524  O  O    . MET   A  1  620 ? -8.999  -18.048 -28.479 1.000 27.876  0 675  MET   A O    1 ? 1 
ATOM   9525  C  CB   . MET   A  1  620 ? -6.432  -16.794 -27.361 1.000 26.826  0 675  MET   A CB   1 ? 1 
ATOM   9526  C  CG   . MET   A  1  620 ? -6.724  -15.344 -26.911 1.000 25.601  0 675  MET   A CG   1 ? 1 
ATOM   9527  S  SD   . MET   A  1  620 ? -6.552  -15.072 -25.115 1.000 28.600  0 675  MET   A SD   1 ? 1 
ATOM   9528  C  CE   . MET   A  1  620 ? -4.812  -15.458 -24.985 1.000 28.332  0 675  MET   A CE   1 ? 1 
ATOM   9529  H  H    . MET   A  1  620 ? -6.440  -19.355 -27.853 1.000 31.697  0 675  MET   A H    1 c 1 
ATOM   9530  H  HA   . MET   A  1  620 ? -7.399  -17.747 -25.779 1.000 28.303  0 675  MET   A HA   1 c 1 
ATOM   9531  H  HB2  . MET   A  1  620 ? -5.508  -17.015 -27.132 1.000 27.037  0 675  MET   A HB2  1 c 1 
ATOM   9532  H  HB3  . MET   A  1  620 ? -6.508  -16.839 -28.335 1.000 27.532  0 675  MET   A HB3  1 c 1 
ATOM   9533  H  HG2  . MET   A  1  620 ? -6.109  -14.738 -27.377 1.000 26.443  0 675  MET   A HG2  1 c 1 
ATOM   9534  H  HG3  . MET   A  1  620 ? -7.636  -15.104 -27.179 1.000 26.542  0 675  MET   A HG3  1 c 1 
ATOM   9535  H  HE1  . MET   A  1  620 ? -4.684  -16.409 -25.092 1.000 28.647  0 675  MET   A HE1  1 c 1 
ATOM   9536  H  HE2  . MET   A  1  620 ? -4.327  -14.988 -25.674 1.000 28.539  0 675  MET   A HE2  1 c 1 
ATOM   9537  H  HE3  . MET   A  1  620 ? -4.487  -15.185 -24.118 1.000 27.971  0 675  MET   A HE3  1 c 1 
ATOM   9538  N  N    . SER   A  1  621 ? -9.704  -17.197 -26.523 1.000 23.782  0 676  SER   A N    1 ? 1 
ATOM   9539  C  CA   . SER   A  1  621 ? -10.991 -16.711 -27.016 1.000 23.881  0 676  SER   A CA   1 ? 1 
ATOM   9540  C  C    . SER   A  1  621 ? -11.043 -15.195 -26.868 1.000 21.453  0 676  SER   A C    1 ? 1 
ATOM   9541  O  O    . SER   A  1  621 ? -10.008 -14.554 -26.724 1.000 27.383  0 676  SER   A O    1 ? 1 
ATOM   9542  C  CB   . SER   A  1  621 ? -12.170 -17.367 -26.273 1.000 26.774  0 676  SER   A CB   1 ? 1 
ATOM   9543  O  OG   . SER   A  1  621 ? -13.449 -17.018 -26.801 1.000 24.790  0 676  SER   A OG   1 ? 1 
ATOM   9544  H  H    . SER   A  1  621 ? -9.534  -17.143 -25.626 1.000 24.203  0 676  SER   A H    1 c 1 
ATOM   9545  H  HA   . SER   A  1  621 ? -11.064 -16.934 -27.983 1.000 24.482  0 676  SER   A HA   1 c 1 
ATOM   9546  H  HB2  . SER   A  1  621 ? -12.064 -18.345 -26.313 1.000 25.803  0 676  SER   A HB2  1 c 1 
ATOM   9547  H  HB3  . SER   A  1  621 ? -12.133 -17.104 -25.326 1.000 25.080  0 676  SER   A HB3  1 c 1 
ATOM   9548  H  HG   . SER   A  1  621 ? -13.648 -17.585 -27.406 0.000 10.920  0 676  SER   A HG   1 c 1 
ATOM   9549  N  N    . TYR   A  1  622 ? -12.252 -14.617 -26.895 1.000 25.101  0 677  TYR   A N    1 ? 1 
ATOM   9550  C  CA   . TYR   A  1  622 ? -12.412 -13.174 -26.758 1.000 21.996  0 677  TYR   A CA   1 ? 1 
ATOM   9551  C  C    . TYR   A  1  622 ? -13.616 -12.901 -25.871 1.000 22.614  0 677  TYR   A C    1 ? 1 
ATOM   9552  O  O    . TYR   A  1  622 ? -14.457 -13.777 -25.685 1.000 21.135  0 677  TYR   A O    1 ? 1 
ATOM   9553  C  CB   . TYR   A  1  622 ? -12.535 -12.454 -28.100 1.000 21.487  0 677  TYR   A CB   1 ? 1 
ATOM   9554  C  CG   . TYR   A  1  622 ? -13.794 -12.765 -28.868 1.000 24.115  0 677  TYR   A CG   1 ? 1 
ATOM   9555  C  CD1  . TYR   A  1  622 ? -15.000 -12.113 -28.583 1.000 25.427  0 677  TYR   A CD1  1 ? 1 
ATOM   9556  C  CD2  . TYR   A  1  622 ? -13.815 -13.760 -29.828 1.000 28.484  0 677  TYR   A CD2  1 ? 1 
ATOM   9557  C  CE1  . TYR   A  1  622 ? -16.192 -12.446 -29.258 1.000 27.553  0 677  TYR   A CE1  1 ? 1 
ATOM   9558  C  CE2  . TYR   A  1  622 ? -14.995 -14.094 -30.507 1.000 29.434  0 677  TYR   A CE2  1 ? 1 
ATOM   9559  C  CZ   . TYR   A  1  622 ? -16.178 -13.429 -30.231 1.000 29.746  0 677  TYR   A CZ   1 ? 1 
ATOM   9560  O  OH   . TYR   A  1  622 ? -17.342 -13.754 -30.954 1.000 27.782  0 677  TYR   A OH   1 ? 1 
ATOM   9561  H  H    . TYR   A  1  622 ? -12.997 -15.133 -27.015 1.000 23.835  0 677  TYR   A H    1 c 1 
ATOM   9562  H  HA   . TYR   A  1  622 ? -11.614 -12.820 -26.295 1.000 22.045  0 677  TYR   A HA   1 c 1 
ATOM   9563  H  HB2  . TYR   A  1  622 ? -12.495 -11.488 -27.937 1.000 21.891  0 677  TYR   A HB2  1 c 1 
ATOM   9564  H  HB3  . TYR   A  1  622 ? -11.761 -12.695 -28.651 1.000 22.304  0 677  TYR   A HB3  1 c 1 
ATOM   9565  H  HD1  . TYR   A  1  622 ? -15.018 -11.444 -27.918 1.000 25.053  0 677  TYR   A HD1  1 c 1 
ATOM   9566  H  HD2  . TYR   A  1  622 ? -13.021 -14.227 -30.027 1.000 27.563  0 677  TYR   A HD2  1 c 1 
ATOM   9567  H  HE1  . TYR   A  1  622 ? -16.989 -11.980 -29.072 1.000 27.587  0 677  TYR   A HE1  1 c 1 
ATOM   9568  H  HE2  . TYR   A  1  622 ? -14.979 -14.759 -31.175 1.000 29.798  0 677  TYR   A HE2  1 c 1 
ATOM   9569  H  HH   . TYR   A  1  622 ? -18.073 -13.339 -30.798 0.000 11.010  0 677  TYR   A HH   1 c 1 
ATOM   9570  N  N    . GLY   A  1  623 ? -13.626 -11.698 -25.271 1.000 19.638  0 678  GLY   A N    1 ? 1 
ATOM   9571  C  CA   . GLY   A  1  623 ? -14.768 -11.174 -24.556 1.000 21.837  0 678  GLY   A CA   1 ? 1 
ATOM   9572  C  C    . GLY   A  1  623 ? -14.959 -9.706  -24.922 1.000 20.838  0 678  GLY   A C    1 ? 1 
ATOM   9573  O  O    . GLY   A  1  623 ? -14.347 -9.215  -25.853 1.000 22.835  0 678  GLY   A O    1 ? 1 
ATOM   9574  H  H    . GLY   A  1  623 ? -12.871 -11.183 -25.315 1.000 20.472  0 678  GLY   A H    1 c 1 
ATOM   9575  H  HA2  . GLY   A  1  623 ? -15.579 -11.687 -24.800 1.000 21.419  0 678  GLY   A HA2  1 c 1 
ATOM   9576  H  HA3  . GLY   A  1  623 ? -14.616 -11.260 -23.582 1.000 20.671  0 678  GLY   A HA3  1 c 1 
ATOM   9577  N  N    . PHE   A  1  624 ? -15.805 -9.028  -24.157 1.000 21.638  0 679  PHE   A N    1 ? 1 
ATOM   9578  C  CA   . PHE   A  1  624 ? -16.251 -7.684  -24.468 1.000 25.308  0 679  PHE   A CA   1 ? 1 
ATOM   9579  C  C    . PHE   A  1  624 ? -16.130 -6.830  -23.218 1.000 23.658  0 679  PHE   A C    1 ? 1 
ATOM   9580  O  O    . PHE   A  1  624 ? -16.462 -7.295  -22.135 1.000 21.662  0 679  PHE   A O    1 ? 1 
ATOM   9581  C  CB   . PHE   A  1  624 ? -17.709 -7.721  -24.941 1.000 26.451  0 679  PHE   A CB   1 ? 1 
ATOM   9582  C  CG   . PHE   A  1  624 ? -17.878 -8.352  -26.300 1.000 25.248  0 679  PHE   A CG   1 ? 1 
ATOM   9583  C  CD1  . PHE   A  1  624 ? -17.346 -7.750  -27.430 1.000 26.046  0 679  PHE   A CD1  1 ? 1 
ATOM   9584  C  CD2  . PHE   A  1  624 ? -18.564 -9.540  -26.443 1.000 27.740  0 679  PHE   A CD2  1 ? 1 
ATOM   9585  C  CE1  . PHE   A  1  624 ? -17.497 -8.325  -28.675 1.000 28.879  0 679  PHE   A CE1  1 ? 1 
ATOM   9586  C  CE2  . PHE   A  1  624 ? -18.757 -10.103 -27.719 1.000 30.252  0 679  PHE   A CE2  1 ? 1 
ATOM   9587  C  CZ   . PHE   A  1  624 ? -18.196 -9.508  -28.808 1.000 29.048  0 679  PHE   A CZ   1 ? 1 
ATOM   9588  H  H    . PHE   A  1  624 ? -16.123 -9.425  -23.398 1.000 21.976  0 679  PHE   A H    1 c 1 
ATOM   9589  H  HA   . PHE   A  1  624 ? -15.682 -7.303  -25.181 1.000 24.444  0 679  PHE   A HA   1 c 1 
ATOM   9590  H  HB2  . PHE   A  1  624 ? -18.238 -8.222  -24.285 1.000 25.863  0 679  PHE   A HB2  1 c 1 
ATOM   9591  H  HB3  . PHE   A  1  624 ? -18.053 -6.804  -24.969 1.000 25.910  0 679  PHE   A HB3  1 c 1 
ATOM   9592  H  HD1  . PHE   A  1  624 ? -16.861 -6.945  -27.344 1.000 26.197  0 679  PHE   A HD1  1 c 1 
ATOM   9593  H  HD2  . PHE   A  1  624 ? -18.951 -9.950  -25.686 1.000 27.496  0 679  PHE   A HD2  1 c 1 
ATOM   9594  H  HE1  . PHE   A  1  624 ? -17.128 -7.905  -29.436 1.000 28.478  0 679  PHE   A HE1  1 c 1 
ATOM   9595  H  HE2  . PHE   A  1  624 ? -19.219 -10.921 -27.810 1.000 29.732  0 679  PHE   A HE2  1 c 1 
ATOM   9596  H  HZ   . PHE   A  1  624 ? -18.308 -9.893  -29.663 1.000 29.855  0 679  PHE   A HZ   1 c 1 
ATOM   9597  N  N    . LEU   A  1  625 ? -15.663 -5.586  -23.385 1.000 23.400  0 680  LEU   A N    1 ? 1 
ATOM   9598  C  CA   . LEU   A  1  625 ? -15.456 -4.710  -22.239 1.000 20.885  0 680  LEU   A CA   1 ? 1 
ATOM   9599  C  C    . LEU   A  1  625 ? -16.782 -4.120  -21.786 1.000 25.726  0 680  LEU   A C    1 ? 1 
ATOM   9600  O  O    . LEU   A  1  625 ? -17.090 -4.185  -20.593 1.000 23.707  0 680  LEU   A O    1 ? 1 
ATOM   9601  C  CB   . LEU   A  1  625 ? -14.442 -3.603  -22.530 1.000 17.632  0 680  LEU   A CB   1 ? 1 
ATOM   9602  C  CG   . LEU   A  1  625 ? -13.035 -4.057  -22.755 1.000 17.371  0 680  LEU   A CG   1 ? 1 
ATOM   9603  C  CD1  . LEU   A  1  625 ? -12.146 -2.892  -23.099 1.000 20.953  0 680  LEU   A CD1  1 ? 1 
ATOM   9604  C  CD2  . LEU   A  1  625 ? -12.517 -4.787  -21.483 1.000 20.148  0 680  LEU   A CD2  1 ? 1 
ATOM   9605  H  H    . LEU   A  1  625 ? -15.473 -5.276  -24.223 1.000 23.166  0 680  LEU   A H    1 c 1 
ATOM   9606  H  HA   . LEU   A  1  625 ? -15.110 -5.264  -21.503 1.000 21.003  0 680  LEU   A HA   1 c 1 
ATOM   9607  H  HB2  . LEU   A  1  625 ? -14.741 -3.114  -23.323 1.000 18.622  0 680  LEU   A HB2  1 c 1 
ATOM   9608  H  HB3  . LEU   A  1  625 ? -14.448 -2.976  -21.779 1.000 18.016  0 680  LEU   A HB3  1 c 1 
ATOM   9609  H  HG   . LEU   A  1  625 ? -13.026 -4.695  -23.511 1.000 18.813  0 680  LEU   A HG   1 c 1 
ATOM   9610  H  HD11 . LEU   A  1  625 ? -11.297 -3.221  -23.442 1.000 19.671  0 680  LEU   A HD11 1 c 1 
ATOM   9611  H  HD12 . LEU   A  1  625 ? -11.988 -2.357  -22.301 1.000 19.382  0 680  LEU   A HD12 1 c 1 
ATOM   9612  H  HD13 . LEU   A  1  625 ? -12.579 -2.344  -23.775 1.000 20.050  0 680  LEU   A HD13 1 c 1 
ATOM   9613  H  HD21 . LEU   A  1  625 ? -12.903 -5.679  -21.438 1.000 19.189  0 680  LEU   A HD21 1 c 1 
ATOM   9614  H  HD22 . LEU   A  1  625 ? -12.773 -4.282  -20.691 1.000 18.817  0 680  LEU   A HD22 1 c 1 
ATOM   9615  H  HD23 . LEU   A  1  625 ? -11.547 -4.858  -21.522 1.000 18.888  0 680  LEU   A HD23 1 c 1 
ATOM   9616  N  N    . PHE   A  1  626 ? -17.557 -3.533  -22.714 1.000 23.444  0 681  PHE   A N    1 ? 1 
ATOM   9617  C  CA   . PHE   A  1  626 ? -18.922 -3.189  -22.380 1.000 23.036  0 681  PHE   A CA   1 ? 1 
ATOM   9618  C  C    . PHE   A  1  626 ? -19.732 -4.479  -22.481 1.000 22.514  0 681  PHE   A C    1 ? 1 
ATOM   9619  O  O    . PHE   A  1  626 ? -19.731 -5.108  -23.529 1.000 20.989  0 681  PHE   A O    1 ? 1 
ATOM   9620  C  CB   . PHE   A  1  626 ? -19.558 -2.112  -23.245 1.000 23.808  0 681  PHE   A CB   1 ? 1 
ATOM   9621  C  CG   . PHE   A  1  626 ? -21.009 -1.949  -22.847 1.000 25.648  0 681  PHE   A CG   1 ? 1 
ATOM   9622  C  CD1  . PHE   A  1  626 ? -21.361 -1.231  -21.723 1.000 22.958  0 681  PHE   A CD1  1 ? 1 
ATOM   9623  C  CD2  . PHE   A  1  626 ? -22.021 -2.540  -23.585 1.000 26.915  0 681  PHE   A CD2  1 ? 1 
ATOM   9624  C  CE1  . PHE   A  1  626 ? -22.688 -1.115  -21.337 1.000 23.536  0 681  PHE   A CE1  1 ? 1 
ATOM   9625  C  CE2  . PHE   A  1  626 ? -23.337 -2.426  -23.188 1.000 23.082  0 681  PHE   A CE2  1 ? 1 
ATOM   9626  C  CZ   . PHE   A  1  626 ? -23.667 -1.710  -22.063 1.000 24.853  0 681  PHE   A CZ   1 ? 1 
ATOM   9627  H  H    . PHE   A  1  626 ? -17.232 -3.348  -23.548 1.000 24.069  0 681  PHE   A H    1 c 1 
ATOM   9628  H  HA   . PHE   A  1  626 ? -18.942 -2.878  -21.442 1.000 22.811  0 681  PHE   A HA   1 c 1 
ATOM   9629  H  HB2  . PHE   A  1  626 ? -19.079 -1.266  -23.119 1.000 23.854  0 681  PHE   A HB2  1 c 1 
ATOM   9630  H  HB3  . PHE   A  1  626 ? -19.497 -2.372  -24.188 1.000 24.379  0 681  PHE   A HB3  1 c 1 
ATOM   9631  H  HD1  . PHE   A  1  626 ? -20.687 -0.827  -21.202 1.000 23.072  0 681  PHE   A HD1  1 c 1 
ATOM   9632  H  HD2  . PHE   A  1  626 ? -21.804 -3.050  -24.349 1.000 25.776  0 681  PHE   A HD2  1 c 1 
ATOM   9633  H  HE1  . PHE   A  1  626 ? -22.911 -0.617  -20.567 1.000 23.654  0 681  PHE   A HE1  1 c 1 
ATOM   9634  H  HE2  . PHE   A  1  626 ? -24.017 -2.832  -23.703 1.000 24.930  0 681  PHE   A HE2  1 c 1 
ATOM   9635  H  HZ   . PHE   A  1  626 ? -24.571 -1.614  -21.809 1.000 24.588  0 681  PHE   A HZ   1 c 1 
ATOM   9636  N  N    . PRO   A  1  627 ? -20.444 -4.901  -21.405 1.000 23.778  0 682  PRO   A N    1 ? 1 
ATOM   9637  C  CA   . PRO   A  1  627 ? -21.214 -6.144  -21.425 1.000 24.072  0 682  PRO   A CA   1 ? 1 
ATOM   9638  C  C    . PRO   A  1  627 ? -22.484 -6.103  -22.276 1.000 24.629  0 682  PRO   A C    1 ? 1 
ATOM   9639  O  O    . PRO   A  1  627 ? -23.332 -5.261  -22.023 1.000 23.675  0 682  PRO   A O    1 ? 1 
ATOM   9640  C  CB   . PRO   A  1  627 ? -21.592 -6.321  -19.951 1.000 22.355  0 682  PRO   A CB   1 ? 1 
ATOM   9641  C  CG   . PRO   A  1  627 ? -21.556 -4.934  -19.350 1.000 24.711  0 682  PRO   A CG   1 ? 1 
ATOM   9642  C  CD   . PRO   A  1  627 ? -20.473 -4.236  -20.083 1.000 26.433  0 682  PRO   A CD   1 ? 1 
ATOM   9643  H  HA   . PRO   A  1  627 ? -20.629 -6.891  -21.707 1.000 23.698  0 682  PRO   A HA   1 c 1 
ATOM   9644  H  HB2  . PRO   A  1  627 ? -22.487 -6.713  -19.864 1.000 23.607  0 682  PRO   A HB2  1 c 1 
ATOM   9645  H  HB3  . PRO   A  1  627 ? -20.952 -6.903  -19.502 1.000 22.856  0 682  PRO   A HB3  1 c 1 
ATOM   9646  H  HG2  . PRO   A  1  627 ? -22.412 -4.477  -19.479 1.000 24.885  0 682  PRO   A HG2  1 c 1 
ATOM   9647  H  HG3  . PRO   A  1  627 ? -21.358 -4.973  -18.392 1.000 24.142  0 682  PRO   A HG3  1 c 1 
ATOM   9648  H  HD2  . PRO   A  1  627 ? -20.672 -3.286  -20.173 1.000 25.256  0 682  PRO   A HD2  1 c 1 
ATOM   9649  H  HD3  . PRO   A  1  627 ? -19.618 -4.338  -19.624 1.000 24.735  0 682  PRO   A HD3  1 c 1 
ATOM   9650  N  N    . PRO   A  1  628 ? -22.690 -7.031  -23.250 1.000 26.593  0 683  PRO   A N    1 ? 1 
ATOM   9651  C  CA   . PRO   A  1  628 ? -23.938 -7.067  -24.019 1.000 26.307  0 683  PRO   A CA   1 ? 1 
ATOM   9652  C  C    . PRO   A  1  628 ? -25.159 -7.323  -23.140 1.000 24.487  0 683  PRO   A C    1 ? 1 
ATOM   9653  O  O    . PRO   A  1  628 ? -26.275 -7.044  -23.560 1.000 26.677  0 683  PRO   A O    1 ? 1 
ATOM   9654  C  CB   . PRO   A  1  628 ? -23.714 -8.178  -25.027 1.000 28.770  0 683  PRO   A CB   1 ? 1 
ATOM   9655  C  CG   . PRO   A  1  628 ? -22.197 -8.382  -25.055 1.000 31.041  0 683  PRO   A CG   1 ? 1 
ATOM   9656  C  CD   . PRO   A  1  628 ? -21.722 -8.046  -23.707 1.000 28.987  0 683  PRO   A CD   1 ? 1 
ATOM   9657  H  HA   . PRO   A  1  628 ? -24.047 -6.209  -24.500 1.000 26.625  0 683  PRO   A HA   1 c 1 
ATOM   9658  H  HB2  . PRO   A  1  628 ? -24.170 -9.001  -24.749 1.000 29.003  0 683  PRO   A HB2  1 c 1 
ATOM   9659  H  HB3  . PRO   A  1  628 ? -24.046 -7.917  -25.913 1.000 29.305  0 683  PRO   A HB3  1 c 1 
ATOM   9660  H  HG2  . PRO   A  1  628 ? -21.979 -9.310  -25.274 1.000 30.126  0 683  PRO   A HG2  1 c 1 
ATOM   9661  H  HG3  . PRO   A  1  628 ? -21.783 -7.797  -25.721 1.000 30.070  0 683  PRO   A HG3  1 c 1 
ATOM   9662  H  HD2  . PRO   A  1  628 ? -21.733 -8.827  -23.124 1.000 28.514  0 683  PRO   A HD2  1 c 1 
ATOM   9663  H  HD3  . PRO   A  1  628 ? -20.818 -7.682  -23.737 1.000 28.210  0 683  PRO   A HD3  1 c 1 
ATOM   9664  N  N    . TYR   A  1  629 ? -24.922 -7.809  -21.911 1.000 26.596  0 684  TYR   A N    1 ? 1 
ATOM   9665  C  CA   . TYR   A  1  629 ? -25.980 -8.151  -20.963 1.000 29.565  0 684  TYR   A CA   1 ? 1 
ATOM   9666  C  C    . TYR   A  1  629 ? -26.691 -6.922  -20.427 1.000 28.875  0 684  TYR   A C    1 ? 1 
ATOM   9667  O  O    . TYR   A  1  629 ? -27.827 -7.026  -19.973 1.000 29.847  0 684  TYR   A O    1 ? 1 
ATOM   9668  C  CB   . TYR   A  1  629 ? -25.463 -8.889  -19.724 1.000 28.841  0 684  TYR   A CB   1 ? 1 
ATOM   9669  C  CG   . TYR   A  1  629 ? -24.578 -10.060 -20.038 1.000 26.063  0 684  TYR   A CG   1 ? 1 
ATOM   9670  C  CD1  . TYR   A  1  629 ? -25.107 -11.254 -20.501 1.000 30.082  0 684  TYR   A CD1  1 ? 1 
ATOM   9671  C  CD2  . TYR   A  1  629 ? -23.211 -9.962  -19.910 1.000 23.483  0 684  TYR   A CD2  1 ? 1 
ATOM   9672  C  CE1  . TYR   A  1  629 ? -24.290 -12.338 -20.789 1.000 31.804  0 684  TYR   A CE1  1 ? 1 
ATOM   9673  C  CE2  . TYR   A  1  629 ? -22.381 -11.017 -20.214 1.000 28.390  0 684  TYR   A CE2  1 ? 1 
ATOM   9674  C  CZ   . TYR   A  1  629 ? -22.917 -12.204 -20.656 1.000 30.960  0 684  TYR   A CZ   1 ? 1 
ATOM   9675  O  OH   . TYR   A  1  629 ? -22.046 -13.199 -20.974 1.000 36.928  0 684  TYR   A OH   1 ? 1 
ATOM   9676  H  H    . TYR   A  1  629 ? -24.057 -7.946  -21.654 1.000 25.985  0 684  TYR   A H    1 c 1 
ATOM   9677  H  HA   . TYR   A  1  629 ? -26.644 -8.724  -21.422 1.000 29.396  0 684  TYR   A HA   1 c 1 
ATOM   9678  H  HB2  . TYR   A  1  629 ? -24.966 -8.254  -19.167 1.000 27.736  0 684  TYR   A HB2  1 c 1 
ATOM   9679  H  HB3  . TYR   A  1  629 ? -26.233 -9.203  -19.207 1.000 28.513  0 684  TYR   A HB3  1 c 1 
ATOM   9680  H  HD1  . TYR   A  1  629 ? -26.042 -11.344 -20.590 1.000 30.134  0 684  TYR   A HD1  1 c 1 
ATOM   9681  H  HD2  . TYR   A  1  629 ? -22.833 -9.151  -19.612 1.000 24.739  0 684  TYR   A HD2  1 c 1 
ATOM   9682  H  HE1  . TYR   A  1  629 ? -24.660 -13.143 -21.111 1.000 31.675  0 684  TYR   A HE1  1 c 1 
ATOM   9683  H  HE2  . TYR   A  1  629 ? -21.447 -10.926 -20.124 1.000 27.054  0 684  TYR   A HE2  1 c 1 
ATOM   9684  H  HH   . TYR   A  1  629 ? -22.384 -13.964 -21.243 0.000 23.330  0 684  TYR   A HH   1 c 1 
ATOM   9685  N  N    . LEU   A  1  630 ? -26.023 -5.770  -20.511 1.000 21.368  0 685  LEU   A N    1 ? 1 
ATOM   9686  C  CA   . LEU   A  1  630 ? -26.538 -4.556  -19.909 1.000 23.638  0 685  LEU   A CA   1 ? 1 
ATOM   9687  C  C    . LEU   A  1  630 ? -26.914 -3.511  -20.941 1.000 22.560  0 685  LEU   A C    1 ? 1 
ATOM   9688  O  O    . LEU   A  1  630 ? -27.088 -2.361  -20.601 1.000 27.447  0 685  LEU   A O    1 ? 1 
ATOM   9689  C  CB   . LEU   A  1  630 ? -25.474 -4.018  -18.951 1.000 25.632  0 685  LEU   A CB   1 ? 1 
ATOM   9690  C  CG   . LEU   A  1  630 ? -25.151 -4.986  -17.775 1.000 28.273  0 685  LEU   A CG   1 ? 1 
ATOM   9691  C  CD1  . LEU   A  1  630 ? -24.046 -4.455  -16.849 1.000 26.723  0 685  LEU   A CD1  1 ? 1 
ATOM   9692  C  CD2  . LEU   A  1  630 ? -26.350 -5.208  -16.948 1.000 32.819  0 685  LEU   A CD2  1 ? 1 
ATOM   9693  H  H    . LEU   A  1  630 ? -25.218 -5.738  -20.943 1.000 22.999  0 685  LEU   A H    1 c 1 
ATOM   9694  H  HA   . LEU   A  1  630 ? -27.346 -4.783  -19.397 1.000 23.736  0 685  LEU   A HA   1 c 1 
ATOM   9695  H  HB2  . LEU   A  1  630 ? -24.654 -3.848  -19.456 1.000 25.252  0 685  LEU   A HB2  1 c 1 
ATOM   9696  H  HB3  . LEU   A  1  630 ? -25.783 -3.167  -18.583 1.000 25.607  0 685  LEU   A HB3  1 c 1 
ATOM   9697  H  HG   . LEU   A  1  630 ? -24.859 -5.854  -18.148 1.000 28.147  0 685  LEU   A HG   1 c 1 
ATOM   9698  H  HD11 . LEU   A  1  630 ? -23.673 -5.191  -16.333 1.000 26.671  0 685  LEU   A HD11 1 c 1 
ATOM   9699  H  HD12 . LEU   A  1  630 ? -24.420 -3.791  -16.243 1.000 26.991  0 685  LEU   A HD12 1 c 1 
ATOM   9700  H  HD13 . LEU   A  1  630 ? -23.344 -4.045  -17.382 1.000 26.707  0 685  LEU   A HD13 1 c 1 
ATOM   9701  H  HD21 . LEU   A  1  630 ? -26.968 -5.792  -17.421 1.000 31.708  0 685  LEU   A HD21 1 c 1 
ATOM   9702  H  HD22 . LEU   A  1  630 ? -26.784 -4.355  -16.769 1.000 31.484  0 685  LEU   A HD22 1 c 1 
ATOM   9703  H  HD23 . LEU   A  1  630 ? -26.093 -5.623  -16.107 1.000 31.031  0 685  LEU   A HD23 1 c 1 
ATOM   9704  N  N    . SER   A  1  631 ? -27.123 -3.928  -22.183 1.000 24.816  0 686  SER   A N    1 ? 1 
ATOM   9705  C  CA   . SER   A  1  631 ? -27.647 -3.055  -23.227 1.000 27.284  0 686  SER   A CA   1 ? 1 
ATOM   9706  C  C    . SER   A  1  631 ? -29.008 -2.438  -22.895 1.000 30.699  0 686  SER   A C    1 ? 1 
ATOM   9707  O  O    . SER   A  1  631 ? -29.821 -3.063  -22.208 1.000 28.391  0 686  SER   A O    1 ? 1 
ATOM   9708  C  CB   . SER   A  1  631 ? -27.778 -3.816  -24.538 1.000 27.967  0 686  SER   A CB   1 ? 1 
ATOM   9709  O  OG   . SER   A  1  631 ? -28.647 -4.926  -24.371 1.000 33.081  0 686  SER   A OG   1 ? 1 
ATOM   9710  H  H    . SER   A  1  631 ? -26.934 -4.795  -22.398 1.000 24.726  0 686  SER   A H    1 c 1 
ATOM   9711  H  HA   . SER   A  1  631 ? -26.996 -2.319  -23.357 1.000 27.097  0 686  SER   A HA   1 c 1 
ATOM   9712  H  HB2  . SER   A  1  631 ? -28.135 -3.217  -25.233 1.000 29.386  0 686  SER   A HB2  1 c 1 
ATOM   9713  H  HB3  . SER   A  1  631 ? -26.891 -4.130  -24.826 1.000 28.546  0 686  SER   A HB3  1 c 1 
ATOM   9714  H  HG   . SER   A  1  631 ? -29.432 -4.668  -24.553 0.000 15.420  0 686  SER   A HG   1 c 1 
ATOM   9715  N  N    . SER   A  1  632 ? -29.230 -1.196  -23.370 1.000 29.038  0 687  SER   A N    1 ? 1 
ATOM   9716  C  CA   . SER   A  1  632 ? -30.434 -0.448  -23.044 1.000 29.380  0 687  SER   A CA   1 ? 1 
ATOM   9717  C  C    . SER   A  1  632 ? -31.621 -0.847  -23.922 1.000 32.605  0 687  SER   A C    1 ? 1 
ATOM   9718  O  O    . SER   A  1  632 ? -32.745 -0.555  -23.556 1.000 35.365  0 687  SER   A O    1 ? 1 
ATOM   9719  C  CB   . SER   A  1  632 ? -30.220 1.054   -23.175 1.000 31.970  0 687  SER   A CB   1 ? 1 
ATOM   9720  O  OG   . SER   A  1  632 ? -29.739 1.374   -24.467 1.000 26.410  0 687  SER   A OG   1 ? 1 
ATOM   9721  H  H    . SER   A  1  632 ? -28.613 -0.813  -23.924 1.000 29.257  0 687  SER   A H    1 c 1 
ATOM   9722  H  HA   . SER   A  1  632 ? -30.671 -0.646  -22.098 1.000 30.097  0 687  SER   A HA   1 c 1 
ATOM   9723  H  HB2  . SER   A  1  632 ? -31.071 1.522   -23.015 1.000 30.331  0 687  SER   A HB2  1 c 1 
ATOM   9724  H  HB3  . SER   A  1  632 ? -29.572 1.353   -22.499 1.000 29.283  0 687  SER   A HB3  1 c 1 
ATOM   9725  H  HG   . SER   A  1  632 ? -30.395 1.507   -25.012 0.000 8.890   0 687  SER   A HG   1 c 1 
ATOM   9726  N  N    . SER   A  1  633 ? -31.361 -1.502  -25.065 1.000 31.902  0 688  SER   A N    1 ? 1 
ATOM   9727  C  CA   . SER   A  1  633 ? -32.393 -1.953  -25.991 1.000 32.700  0 688  SER   A CA   1 ? 1 
ATOM   9728  C  C    . SER   A  1  633 ? -31.779 -2.959  -26.963 1.000 31.995  0 688  SER   A C    1 ? 1 
ATOM   9729  O  O    . SER   A  1  633 ? -30.557 -3.000  -27.132 1.000 29.071  0 688  SER   A O    1 ? 1 
ATOM   9730  C  CB   . SER   A  1  633 ? -32.975 -0.797  -26.792 1.000 36.115  0 688  SER   A CB   1 ? 1 
ATOM   9731  O  OG   . SER   A  1  633 ? -32.046 -0.316  -27.762 1.000 33.818  0 688  SER   A OG   1 ? 1 
ATOM   9732  H  H    . SER   A  1  633 ? -30.489 -1.668  -25.282 1.000 31.600  0 688  SER   A H    1 c 1 
ATOM   9733  H  HA   . SER   A  1  633 ? -33.116 -2.394  -25.472 1.000 33.414  0 688  SER   A HA   1 c 1 
ATOM   9734  H  HB2  . SER   A  1  633 ? -33.794 -1.096  -27.246 1.000 35.749  0 688  SER   A HB2  1 c 1 
ATOM   9735  H  HB3  . SER   A  1  633 ? -33.217 -0.066  -26.179 1.000 35.038  0 688  SER   A HB3  1 c 1 
ATOM   9736  H  HG   . SER   A  1  633 ? -32.175 -0.746  -28.487 0.000 13.070  0 688  SER   A HG   1 c 1 
ATOM   9737  N  N    . PRO   A  1  634 ? -32.595 -3.813  -27.613 1.000 34.618  0 689  PRO   A N    1 ? 1 
ATOM   9738  C  CA   . PRO   A  1  634 ? -32.100 -4.746  -28.630 1.000 33.365  0 689  PRO   A CA   1 ? 1 
ATOM   9739  C  C    . PRO   A  1  634 ? -31.234 -4.097  -29.710 1.000 32.811  0 689  PRO   A C    1 ? 1 
ATOM   9740  O  O    . PRO   A  1  634 ? -30.215 -4.654  -30.101 1.000 38.675  0 689  PRO   A O    1 ? 1 
ATOM   9741  C  CB   . PRO   A  1  634 ? -33.400 -5.325  -29.225 1.000 39.827  0 689  PRO   A CB   1 ? 1 
ATOM   9742  C  CG   . PRO   A  1  634 ? -34.392 -5.212  -28.124 1.000 37.426  0 689  PRO   A CG   1 ? 1 
ATOM   9743  C  CD   . PRO   A  1  634 ? -34.040 -3.953  -27.376 1.000 43.718  0 689  PRO   A CD   1 ? 1 
ATOM   9744  H  HA   . PRO   A  1  634 ? -31.594 -5.471  -28.185 1.000 33.886  0 689  PRO   A HA   1 c 1 
ATOM   9745  H  HB2  . PRO   A  1  634 ? -33.689 -4.809  -30.008 1.000 38.490  0 689  PRO   A HB2  1 c 1 
ATOM   9746  H  HB3  . PRO   A  1  634 ? -33.279 -6.262  -29.489 1.000 37.952  0 689  PRO   A HB3  1 c 1 
ATOM   9747  H  HG2  . PRO   A  1  634 ? -35.300 -5.155  -28.484 1.000 40.174  0 689  PRO   A HG2  1 c 1 
ATOM   9748  H  HG3  . PRO   A  1  634 ? -34.338 -5.989  -27.532 1.000 39.133  0 689  PRO   A HG3  1 c 1 
ATOM   9749  H  HD2  . PRO   A  1  634 ? -34.529 -3.186  -27.729 1.000 40.330  0 689  PRO   A HD2  1 c 1 
ATOM   9750  H  HD3  . PRO   A  1  634 ? -34.234 -4.045  -26.425 1.000 39.565  0 689  PRO   A HD3  1 c 1 
ATOM   9751  N  N    . GLU   A  1  635 ? -31.649 -2.926  -30.200 1.000 33.347  0 690  GLU   A N    1 ? 1 
ATOM   9752  C  CA   . GLU   A  1  635 ? -30.869 -2.174  -31.171 1.000 36.422  0 690  GLU   A CA   1 ? 1 
ATOM   9753  C  C    . GLU   A  1  635 ? -29.484 -1.792  -30.629 1.000 38.364  0 690  GLU   A C    1 ? 1 
ATOM   9754  O  O    . GLU   A  1  635 ? -28.455 -2.051  -31.257 1.000 32.087  0 690  GLU   A O    1 ? 1 
ATOM   9755  C  CB   . GLU   A  1  635 ? -31.670 -0.908  -31.571 1.000 42.589  0 690  GLU   A CB   1 ? 1 
ATOM   9756  C  CG   . GLU   A  1  635 ? -33.032 -1.227  -32.185 1.000 62.647  0 690  GLU   A CG   1 ? 1 
ATOM   9757  C  CD   . GLU   A  1  635 ? -34.284 -1.200  -31.307 1.000 69.111  0 690  GLU   A CD   1 ? 1 
ATOM   9758  O  OE1  . GLU   A  1  635 ? -34.260 -1.641  -30.135 1.000 50.290  0 690  GLU   A OE1  1 ? 1 
ATOM   9759  O  OE2  . GLU   A  1  635 ? -35.329 -0.770  -31.840 1.000 80.459  0 690  GLU   A OE2  1 ? 1 
ATOM   9760  H  H    . GLU   A  1  635 ? -32.443 -2.580  -29.909 1.000 34.644  0 690  GLU   A H    1 c 1 
ATOM   9761  H  HA   . GLU   A  1  635 ? -30.748 -2.737  -31.970 1.000 37.474  0 690  GLU   A HA   1 c 1 
ATOM   9762  H  HB2  . GLU   A  1  635 ? -31.801 -0.353  -30.774 1.000 44.212  0 690  GLU   A HB2  1 c 1 
ATOM   9763  H  HB3  . GLU   A  1  635 ? -31.142 -0.392  -32.215 1.000 44.486  0 690  GLU   A HB3  1 c 1 
ATOM   9764  H  HG2  . GLU   A  1  635 ? -33.181 -0.598  -32.923 1.000 58.740  0 690  GLU   A HG2  1 c 1 
ATOM   9765  H  HG3  . GLU   A  1  635 ? -32.978 -2.120  -32.586 1.000 57.958  0 690  GLU   A HG3  1 c 1 
ATOM   9766  N  N    . ALA   A  1  636 ? -29.460 -1.188  -29.432 1.000 31.257  0 691  ALA   A N    1 ? 1 
ATOM   9767  C  CA   . ALA   A  1  636 ? -28.213 -0.775  -28.786 1.000 33.200  0 691  ALA   A CA   1 ? 1 
ATOM   9768  C  C    . ALA   A  1  636 ? -27.235 -1.924  -28.545 1.000 29.133  0 691  ALA   A C    1 ? 1 
ATOM   9769  O  O    . ALA   A  1  636 ? -26.014 -1.731  -28.612 1.000 25.559  0 691  ALA   A O    1 ? 1 
ATOM   9770  C  CB   . ALA   A  1  636 ? -28.502 -0.090  -27.447 1.000 36.709  0 691  ALA   A CB   1 ? 1 
ATOM   9771  H  H    . ALA   A  1  636 ? -30.250 -1.023  -29.002 1.000 33.576  0 691  ALA   A H    1 c 1 
ATOM   9772  H  HA   . ALA   A  1  636 ? -27.770 -0.123  -29.376 1.000 32.700  0 691  ALA   A HA   1 c 1 
ATOM   9773  H  HB1  . ALA   A  1  636 ? -27.666 0.190   -27.038 1.000 34.822  0 691  ALA   A HB1  1 c 1 
ATOM   9774  H  HB2  . ALA   A  1  636 ? -29.066 0.688   -27.595 1.000 35.920  0 691  ALA   A HB2  1 c 1 
ATOM   9775  H  HB3  . ALA   A  1  636 ? -28.959 -0.711  -26.855 1.000 35.414  0 691  ALA   A HB3  1 c 1 
ATOM   9776  N  N    . LYS   A  1  637 ? -27.787 -3.122  -28.305 1.000 31.335  0 692  LYS   A N    1 ? 1 
ATOM   9777  C  CA   . LYS   A  1  637 ? -26.972 -4.283  -27.998 1.000 30.890  0 692  LYS   A CA   1 ? 1 
ATOM   9778  C  C    . LYS   A  1  637 ? -25.990 -4.588  -29.137 1.000 31.333  0 692  LYS   A C    1 ? 1 
ATOM   9779  O  O    . LYS   A  1  637 ? -24.924 -5.150  -28.888 1.000 26.692  0 692  LYS   A O    1 ? 1 
ATOM   9780  C  CB   . LYS   A  1  637 ? -27.899 -5.494  -27.678 1.000 33.772  0 692  LYS   A CB   1 ? 1 
ATOM   9781  C  CG   . LYS   A  1  637 ? -27.201 -6.658  -26.958 1.000 31.211  0 692  LYS   A CG   1 ? 1 
ATOM   9782  C  CD   . LYS   A  1  637 ? -28.084 -7.926  -26.863 1.000 30.074  0 692  LYS   A CD   1 ? 1 
ATOM   9783  C  CE   . LYS   A  1  637 ? -29.129 -7.833  -25.787 1.000 26.805  0 692  LYS   A CE   1 ? 1 
ATOM   9784  N  NZ   . LYS   A  1  637 ? -28.516 -7.880  -24.445 1.000 28.565  0 692  LYS   A NZ   1 ? 1 
ATOM   9785  H  H    . LYS   A  1  637 ? -28.695 -3.214  -28.325 1.000 31.418  0 692  LYS   A H    1 c 1 
ATOM   9786  H  HA   . LYS   A  1  637 ? -26.447 -4.076  -27.190 1.000 30.762  0 692  LYS   A HA   1 c 1 
ATOM   9787  H  HB2  . LYS   A  1  637 ? -28.641 -5.180  -27.120 1.000 32.889  0 692  LYS   A HB2  1 c 1 
ATOM   9788  H  HB3  . LYS   A  1  637 ? -28.277 -5.827  -28.519 1.000 33.271  0 692  LYS   A HB3  1 c 1 
ATOM   9789  H  HG2  . LYS   A  1  637 ? -26.376 -6.878  -27.437 1.000 31.026  0 692  LYS   A HG2  1 c 1 
ATOM   9790  H  HG3  . LYS   A  1  637 ? -26.956 -6.369  -26.054 1.000 30.684  0 692  LYS   A HG3  1 c 1 
ATOM   9791  H  HD2  . LYS   A  1  637 ? -28.529 -8.071  -27.726 1.000 30.120  0 692  LYS   A HD2  1 c 1 
ATOM   9792  H  HD3  . LYS   A  1  637 ? -27.511 -8.702  -26.686 1.000 29.195  0 692  LYS   A HD3  1 c 1 
ATOM   9793  H  HE2  . LYS   A  1  637 ? -29.625 -6.998  -25.882 1.000 28.364  0 692  LYS   A HE2  1 c 1 
ATOM   9794  H  HE3  . LYS   A  1  637 ? -29.759 -8.574  -25.876 1.000 28.550  0 692  LYS   A HE3  1 c 1 
ATOM   9795  H  HZ1  . LYS   A  1  637 ? -28.113 -7.089  -24.261 1.000 27.403  0 692  LYS   A HZ1  1 c 1 
ATOM   9796  H  HZ2  . LYS   A  1  637 ? -27.900 -8.545  -24.408 1.000 27.431  0 692  LYS   A HZ2  1 c 1 
ATOM   9797  H  HZ3  . LYS   A  1  637 ? -29.156 -8.036  -23.822 1.000 27.898  0 692  LYS   A HZ3  1 c 1 
ATOM   9798  N  N    . TYR   A  1  638 ? -26.349 -4.246  -30.388 1.000 26.758  0 693  TYR   A N    1 ? 1 
ATOM   9799  C  CA   . TYR   A  1  638 ? -25.441 -4.493  -31.503 1.000 28.068  0 693  TYR   A CA   1 ? 1 
ATOM   9800  C  C    . TYR   A  1  638 ? -24.091 -3.806  -31.351 1.000 27.495  0 693  TYR   A C    1 ? 1 
ATOM   9801  O  O    . TYR   A  1  638 ? -23.094 -4.319  -31.850 1.000 26.059  0 693  TYR   A O    1 ? 1 
ATOM   9802  C  CB   . TYR   A  1  638 ? -26.036 -4.066  -32.865 1.000 31.476  0 693  TYR   A CB   1 ? 1 
ATOM   9803  C  CG   . TYR   A  1  638 ? -27.085 -5.018  -33.387 1.000 30.512  0 693  TYR   A CG   1 ? 1 
ATOM   9804  C  CD1  . TYR   A  1  638 ? -28.408 -4.902  -33.000 1.000 35.612  0 693  TYR   A CD1  1 ? 1 
ATOM   9805  C  CD2  . TYR   A  1  638 ? -26.743 -6.062  -34.230 1.000 39.402  0 693  TYR   A CD2  1 ? 1 
ATOM   9806  C  CE1  . TYR   A  1  638 ? -29.373 -5.790  -33.463 1.000 44.711  0 693  TYR   A CE1  1 ? 1 
ATOM   9807  C  CE2  . TYR   A  1  638 ? -27.697 -6.953  -34.702 1.000 37.725  0 693  TYR   A CE2  1 ? 1 
ATOM   9808  C  CZ   . TYR   A  1  638 ? -29.013 -6.808  -34.322 1.000 43.314  0 693  TYR   A CZ   1 ? 1 
ATOM   9809  O  OH   . TYR   A  1  638 ? -29.962 -7.690  -34.761 1.000 43.572  0 693  TYR   A OH   1 ? 1 
ATOM   9810  H  H    . TYR   A  1  638 ? -27.166 -3.871  -30.551 1.000 28.684  0 693  TYR   A H    1 c 1 
ATOM   9811  H  HA   . TYR   A  1  638 ? -25.275 -5.469  -31.541 1.000 28.227  0 693  TYR   A HA   1 c 1 
ATOM   9812  H  HB2  . TYR   A  1  638 ? -26.433 -3.176  -32.768 1.000 30.640  0 693  TYR   A HB2  1 c 1 
ATOM   9813  H  HB3  . TYR   A  1  638 ? -25.310 -4.003  -33.520 1.000 30.451  0 693  TYR   A HB3  1 c 1 
ATOM   9814  H  HD1  . TYR   A  1  638 ? -28.662 -4.206  -32.420 1.000 35.817  0 693  TYR   A HD1  1 c 1 
ATOM   9815  H  HD2  . TYR   A  1  638 ? -25.845 -6.162  -34.500 1.000 36.127  0 693  TYR   A HD2  1 c 1 
ATOM   9816  H  HE1  . TYR   A  1  638 ? -30.273 -5.692  -33.198 1.000 42.306  0 693  TYR   A HE1  1 c 1 
ATOM   9817  H  HE2  . TYR   A  1  638 ? -27.447 -7.653  -35.283 1.000 39.531  0 693  TYR   A HE2  1 c 1 
ATOM   9818  H  HH   . TYR   A  1  638 ? -30.786 -7.601  -34.522 0.000 21.090  0 693  TYR   A HH   1 c 1 
ATOM   9819  N  N    . ASP   A  1  639 ? -24.082 -2.620  -30.715 1.000 29.641  0 694  ASP   A N    1 ? 1 
ATOM   9820  C  CA   . ASP   A  1  639 ? -22.844 -1.888  -30.462 1.000 31.211  0 694  ASP   A CA   1 ? 1 
ATOM   9821  C  C    . ASP   A  1  639 ? -21.871 -2.689  -29.598 1.000 27.314  0 694  ASP   A C    1 ? 1 
ATOM   9822  O  O    . ASP   A  1  639 ? -20.643 -2.544  -29.718 1.000 27.835  0 694  ASP   A O    1 ? 1 
ATOM   9823  C  CB   . ASP   A  1  639 ? -23.134 -0.568  -29.719 1.000 34.339  0 694  ASP   A CB   1 ? 1 
ATOM   9824  C  CG   . ASP   A  1  639 ? -23.856 0.482   -30.511 1.000 37.173  0 694  ASP   A CG   1 ? 1 
ATOM   9825  O  OD1  . ASP   A  1  639 ? -23.792 0.425   -31.757 1.000 39.166  0 694  ASP   A OD1  1 ? 1 
ATOM   9826  O  OD2  . ASP   A  1  639 ? -24.448 1.415   -29.875 1.000 44.477  0 694  ASP   A OD2  1 ? 1 
ATOM   9827  H  H    . ASP   A  1  639 ? -24.872 -2.254  -30.438 1.000 29.735  0 694  ASP   A H    1 c 1 
ATOM   9828  H  HA   . ASP   A  1  639 ? -22.414 -1.685  -31.325 1.000 30.949  0 694  ASP   A HA   1 c 1 
ATOM   9829  H  HB2  . ASP   A  1  639 ? -23.667 -0.767  -28.923 1.000 33.764  0 694  ASP   A HB2  1 c 1 
ATOM   9830  H  HB3  . ASP   A  1  639 ? -22.283 -0.185  -29.423 1.000 33.456  0 694  ASP   A HB3  1 c 1 
ATOM   9831  N  N    . ALA   A  1  640 ? -22.432 -3.487  -28.676 1.000 23.716  0 695  ALA   A N    1 ? 1 
ATOM   9832  C  CA   . ALA   A  1  640 ? -21.608 -4.313  -27.802 1.000 23.003  0 695  ALA   A CA   1 ? 1 
ATOM   9833  C  C    . ALA   A  1  640 ? -20.764 -5.383  -28.513 1.000 24.089  0 695  ALA   A C    1 ? 1 
ATOM   9834  O  O    . ALA   A  1  640 ? -19.733 -5.803  -27.987 1.000 22.927  0 695  ALA   A O    1 ? 1 
ATOM   9835  C  CB   . ALA   A  1  640 ? -22.490 -4.934  -26.734 1.000 23.760  0 695  ALA   A CB   1 ? 1 
ATOM   9836  H  H    . ALA   A  1  640 ? -23.341 -3.510  -28.581 1.000 24.869  0 695  ALA   A H    1 c 1 
ATOM   9837  H  HA   . ALA   A  1  640 ? -20.978 -3.707  -27.345 1.000 22.926  0 695  ALA   A HA   1 c 1 
ATOM   9838  H  HB1  . ALA   A  1  640 ? -21.934 -5.383  -26.074 1.000 23.023  0 695  ALA   A HB1  1 c 1 
ATOM   9839  H  HB2  . ALA   A  1  640 ? -23.011 -4.239  -26.297 1.000 23.548  0 695  ALA   A HB2  1 c 1 
ATOM   9840  H  HB3  . ALA   A  1  640 ? -23.090 -5.580  -27.142 1.000 23.959  0 695  ALA   A HB3  1 c 1 
ATOM   9841  N  N    . PHE   A  1  641 ? -21.136 -5.740  -29.756 1.000 23.335  0 696  PHE   A N    1 ? 1 
ATOM   9842  C  CA   . PHE   A  1  641 ? -20.426 -6.731  -30.552 1.000 24.532  0 696  PHE   A CA   1 ? 1 
ATOM   9843  C  C    . PHE   A  1  641 ? -19.464 -6.125  -31.571 1.000 24.338  0 696  PHE   A C    1 ? 1 
ATOM   9844  O  O    . PHE   A  1  641 ? -18.881 -6.842  -32.383 1.000 21.796  0 696  PHE   A O    1 ? 1 
ATOM   9845  C  CB   . PHE   A  1  641 ? -21.452 -7.626  -31.279 1.000 26.000  0 696  PHE   A CB   1 ? 1 
ATOM   9846  C  CG   . PHE   A  1  641 ? -22.356 -8.356  -30.298 1.000 28.887  0 696  PHE   A CG   1 ? 1 
ATOM   9847  C  CD1  . PHE   A  1  641 ? -21.930 -9.517  -29.666 1.000 35.128  0 696  PHE   A CD1  1 ? 1 
ATOM   9848  C  CD2  . PHE   A  1  641 ? -23.617 -7.862  -29.986 1.000 34.852  0 696  PHE   A CD2  1 ? 1 
ATOM   9849  C  CE1  . PHE   A  1  641 ? -22.756 -10.176 -28.746 1.000 37.519  0 696  PHE   A CE1  1 ? 1 
ATOM   9850  C  CE2  . PHE   A  1  641 ? -24.441 -8.526  -29.070 1.000 43.507  0 696  PHE   A CE2  1 ? 1 
ATOM   9851  C  CZ   . PHE   A  1  641 ? -24.002 -9.674  -28.453 1.000 40.322  0 696  PHE   A CZ   1 ? 1 
ATOM   9852  H  H    . PHE   A  1  641 ? -21.880 -5.353  -30.118 1.000 24.372  0 696  PHE   A H    1 c 1 
ATOM   9853  H  HA   . PHE   A  1  641 ? -19.899 -7.304  -29.939 1.000 23.955  0 696  PHE   A HA   1 c 1 
ATOM   9854  H  HB2  . PHE   A  1  641 ? -21.997 -7.069  -31.873 1.000 26.914  0 696  PHE   A HB2  1 c 1 
ATOM   9855  H  HB3  . PHE   A  1  641 ? -20.971 -8.281  -31.826 1.000 26.571  0 696  PHE   A HB3  1 c 1 
ATOM   9856  H  HD1  . PHE   A  1  641 ? -21.072 -9.862  -29.855 1.000 33.556  0 696  PHE   A HD1  1 c 1 
ATOM   9857  H  HD2  . PHE   A  1  641 ? -23.922 -7.073  -30.403 1.000 35.089  0 696  PHE   A HD2  1 c 1 
ATOM   9858  H  HE1  . PHE   A  1  641 ? -22.456 -10.966 -28.326 1.000 37.189  0 696  PHE   A HE1  1 c 1 
ATOM   9859  H  HE2  . PHE   A  1  641 ? -25.297 -8.183  -28.875 1.000 40.557  0 696  PHE   A HE2  1 c 1 
ATOM   9860  H  HZ   . PHE   A  1  641 ? -24.561 -10.124 -27.840 1.000 40.100  0 696  PHE   A HZ   1 c 1 
ATOM   9861  N  N    . LEU   A  1  642 ? -19.253 -4.807  -31.490 1.000 24.795  0 697  LEU   A N    1 ? 1 
ATOM   9862  C  CA   . LEU   A  1  642 ? -18.247 -4.165  -32.324 1.000 27.454  0 697  LEU   A CA   1 ? 1 
ATOM   9863  C  C    . LEU   A  1  642 ? -16.853 -4.722  -32.018 1.000 29.663  0 697  LEU   A C    1 ? 1 
ATOM   9864  O  O    . LEU   A  1  642 ? -16.535 -5.043  -30.875 1.000 23.848  0 697  LEU   A O    1 ? 1 
ATOM   9865  C  CB   . LEU   A  1  642 ? -18.266 -2.651  -32.145 1.000 25.033  0 697  LEU   A CB   1 ? 1 
ATOM   9866  C  CG   . LEU   A  1  642 ? -19.498 -1.950  -32.697 1.000 26.360  0 697  LEU   A CG   1 ? 1 
ATOM   9867  C  CD1  . LEU   A  1  642 ? -19.593 -0.556  -32.109 1.000 25.806  0 697  LEU   A CD1  1 ? 1 
ATOM   9868  C  CD2  . LEU   A  1  642 ? -19.471 -1.895  -34.192 1.000 26.911  0 697  LEU   A CD2  1 ? 1 
ATOM   9869  H  H    . LEU   A  1  642 ? -19.743 -4.296  -30.913 1.000 25.030  0 697  LEU   A H    1 c 1 
ATOM   9870  H  HA   . LEU   A  1  642 ? -18.460 -4.375  -33.262 1.000 27.377  0 697  LEU   A HA   1 c 1 
ATOM   9871  H  HB2  . LEU   A  1  642 ? -18.195 -2.454  -31.189 1.000 25.168  0 697  LEU   A HB2  1 c 1 
ATOM   9872  H  HB3  . LEU   A  1  642 ? -17.474 -2.278  -32.582 1.000 25.675  0 697  LEU   A HB3  1 c 1 
ATOM   9873  H  HG   . LEU   A  1  642 ? -20.298 -2.460  -32.418 1.000 26.254  0 697  LEU   A HG   1 c 1 
ATOM   9874  H  HD11 . LEU   A  1  642 ? -20.454 -0.165  -32.338 1.000 26.371  0 697  LEU   A HD11 1 c 1 
ATOM   9875  H  HD12 . LEU   A  1  642 ? -18.880 -0.003  -32.472 1.000 25.876  0 697  LEU   A HD12 1 c 1 
ATOM   9876  H  HD13 . LEU   A  1  642 ? -19.505 -0.603  -31.142 1.000 25.396  0 697  LEU   A HD13 1 c 1 
ATOM   9877  H  HD21 . LEU   A  1  642 ? -19.504 -2.798  -34.552 1.000 27.175  0 697  LEU   A HD21 1 c 1 
ATOM   9878  H  HD22 . LEU   A  1  642 ? -18.652 -1.459  -34.486 1.000 26.897  0 697  LEU   A HD22 1 c 1 
ATOM   9879  H  HD23 . LEU   A  1  642 ? -20.239 -1.391  -34.513 1.000 27.463  0 697  LEU   A HD23 1 c 1 
ATOM   9880  N  N    . VAL   A  1  643 ? -16.035 -4.842  -33.074 1.000 25.801  0 698  VAL   A N    1 ? 1 
ATOM   9881  C  CA   . VAL   A  1  643 ? -14.682 -5.349  -32.954 1.000 24.704  0 698  VAL   A CA   1 ? 1 
ATOM   9882  C  C    . VAL   A  1  643 ? -13.864 -4.434  -32.046 1.000 22.789  0 698  VAL   A C    1 ? 1 
ATOM   9883  O  O    . VAL   A  1  643 ? -12.890 -4.863  -31.421 1.000 23.462  0 698  VAL   A O    1 ? 1 
ATOM   9884  C  CB   . VAL   A  1  643 ? -14.068 -5.491  -34.378 1.000 25.543  0 698  VAL   A CB   1 ? 1 
ATOM   9885  C  CG1  . VAL   A  1  643 ? -13.858 -4.127  -35.064 1.000 29.847  0 698  VAL   A CG1  1 ? 1 
ATOM   9886  C  CG2  . VAL   A  1  643 ? -12.772 -6.279  -34.372 1.000 28.404  0 698  VAL   A CG2  1 ? 1 
ATOM   9887  H  H    . VAL   A  1  643 ? -16.342 -4.602  -33.900 1.000 27.055  0 698  VAL   A H    1 c 1 
ATOM   9888  H  HA   . VAL   A  1  643 ? -14.722 -6.232  -32.546 1.000 24.458  0 698  VAL   A HA   1 c 1 
ATOM   9889  H  HB   . VAL   A  1  643 ? -14.718 -5.999  -34.923 1.000 27.189  0 698  VAL   A HB   1 c 1 
ATOM   9890  H  HG11 . VAL   A  1  643 ? -13.188 -3.617  -34.578 1.000 28.099  0 698  VAL   A HG11 1 c 1 
ATOM   9891  H  HG12 . VAL   A  1  643 ? -14.697 -3.634  -35.073 1.000 28.711  0 698  VAL   A HG12 1 c 1 
ATOM   9892  H  HG13 . VAL   A  1  643 ? -13.556 -4.268  -35.978 1.000 29.001  0 698  VAL   A HG13 1 c 1 
ATOM   9893  H  HG21 . VAL   A  1  643 ? -12.383 -6.271  -35.264 1.000 27.846  0 698  VAL   A HG21 1 c 1 
ATOM   9894  H  HG22 . VAL   A  1  643 ? -12.951 -7.197  -34.107 1.000 27.380  0 698  VAL   A HG22 1 c 1 
ATOM   9895  H  HG23 . VAL   A  1  643 ? -12.147 -5.877  -33.744 1.000 26.941  0 698  VAL   A HG23 1 c 1 
ATOM   9896  N  N    . THR   A  1  644 ? -14.286 -3.170  -31.959 1.000 23.494  0 699  THR   A N    1 ? 1 
ATOM   9897  C  CA   . THR   A  1  644 ? -13.607 -2.182  -31.130 1.000 25.170  0 699  THR   A CA   1 ? 1 
ATOM   9898  C  C    . THR   A  1  644 ? -13.902 -2.312  -29.635 1.000 24.434  0 699  THR   A C    1 ? 1 
ATOM   9899  O  O    . THR   A  1  644 ? -13.429 -1.482  -28.851 1.000 20.650  0 699  THR   A O    1 ? 1 
ATOM   9900  C  CB   . THR   A  1  644 ? -13.980 -0.804  -31.628 1.000 23.412  0 699  THR   A CB   1 ? 1 
ATOM   9901  O  OG1  . THR   A  1  644 ? -15.413 -0.774  -31.773 1.000 24.109  0 699  THR   A OG1  1 ? 1 
ATOM   9902  C  CG2  . THR   A  1  644 ? -13.253 -0.484  -32.934 1.000 21.552  0 699  THR   A CG2  1 ? 1 
ATOM   9903  H  H    . THR   A  1  644 ? -15.008 -2.902  -32.450 1.000 24.261  0 699  THR   A H    1 c 1 
ATOM   9904  H  HA   . THR   A  1  644 ? -12.638 -2.301  -31.260 1.000 24.070  0 699  THR   A HA   1 c 1 
ATOM   9905  H  HB   . THR   A  1  644 ? -13.713 -0.142  -30.947 1.000 22.953  0 699  THR   A HB   1 c 1 
ATOM   9906  H  HG1  . THR   A  1  644 ? -15.653 -1.375  -32.337 0.000 8.930   0 699  THR   A HG1  1 c 1 
ATOM   9907  H  HG21 . THR   A  1  644 ? -13.511 0.404   -33.241 1.000 22.488  0 699  THR   A HG21 1 c 1 
ATOM   9908  H  HG22 . THR   A  1  644 ? -13.492 -1.143  -33.611 1.000 22.590  0 699  THR   A HG22 1 c 1 
ATOM   9909  H  HG23 . THR   A  1  644 ? -12.290 -0.508  -32.786 1.000 21.939  0 699  THR   A HG23 1 c 1 
ATOM   9910  N  N    . ASN   A  1  645 ? -14.696 -3.341  -29.276 1.000 19.606  0 700  ASN   A N    1 ? 1 
ATOM   9911  C  CA   . ASN   A  1  645 ? -15.126 -3.584  -27.913 1.000 21.054  0 700  ASN   A CA   1 ? 1 
ATOM   9912  C  C    . ASN   A  1  645 ? -14.623 -4.931  -27.376 1.000 21.177  0 700  ASN   A C    1 ? 1 
ATOM   9913  O  O    . ASN   A  1  645 ? -14.851 -5.291  -26.209 1.000 21.979  0 700  ASN   A O    1 ? 1 
ATOM   9914  C  CB   . ASN   A  1  645 ? -16.658 -3.448  -27.840 1.000 21.863  0 700  ASN   A CB   1 ? 1 
ATOM   9915  C  CG   . ASN   A  1  645 ? -17.197 -3.632  -26.426 1.000 25.484  0 700  ASN   A CG   1 ? 1 
ATOM   9916  O  OD1  . ASN   A  1  645 ? -16.612 -3.130  -25.436 1.000 21.175  0 700  ASN   A OD1  1 ? 1 
ATOM   9917  N  ND2  . ASN   A  1  645 ? -18.290 -4.424  -26.273 1.000 22.173  0 700  ASN   A ND2  1 ? 1 
ATOM   9918  H  H    . ASN   A  1  645 ? -15.007 -3.901  -29.926 1.000 21.498  0 700  ASN   A H    1 c 1 
ATOM   9919  H  HA   . ASN   A  1  645 ? -14.747 -2.874  -27.345 1.000 20.454  0 700  ASN   A HA   1 c 1 
ATOM   9920  H  HB2  . ASN   A  1  645 ? -16.914 -2.562  -28.167 1.000 22.803  0 700  ASN   A HB2  1 c 1 
ATOM   9921  H  HB3  . ASN   A  1  645 ? -17.064 -4.117  -28.428 1.000 22.961  0 700  ASN   A HB3  1 c 1 
ATOM   9922  H  HD21 . ASN   A  1  645 ? -18.469 -5.052  -26.869 1.000 23.471  0 700  ASN   A HD21 1 c 1 
ATOM   9923  H  HD22 . ASN   A  1  645 ? -18.821 -4.314  -25.573 1.000 23.063  0 700  ASN   A HD22 1 c 1 
ATOM   9924  N  N    . MET   A  1  646 ? -13.921 -5.675  -28.229 1.000 23.490  0 701  MET   A N    1 ? 1 
ATOM   9925  C  CA   . MET   A  1  646 ? -13.502 -7.026  -27.896 1.000 30.202  0 701  MET   A CA   1 ? 1 
ATOM   9926  C  C    . MET   A  1  646 ? -12.060 -6.980  -27.409 1.000 21.324  0 701  MET   A C    1 ? 1 
ATOM   9927  O  O    . MET   A  1  646 ? -11.310 -6.079  -27.737 1.000 18.857  0 701  MET   A O    1 ? 1 
ATOM   9928  C  CB   . MET   A  1  646 ? -13.647 -8.039  -29.062 1.000 27.695  0 701  MET   A CB   1 ? 1 
ATOM   9929  C  CG   . MET   A  1  646 ? -12.573 -7.952  -30.107 1.000 38.759  0 701  MET   A CG   1 ? 1 
ATOM   9930  S  SD   . MET   A  1  646 ? -12.929 -8.843  -31.680 1.000 37.362  0 701  MET   A SD   1 ? 1 
ATOM   9931  C  CE   . MET   A  1  646 ? -13.009 -10.479 -31.183 1.000 30.370  0 701  MET   A CE   1 ? 1 
ATOM   9932  H  H    . MET   A  1  646 ? -13.682 -5.333  -29.042 1.000 24.392  0 701  MET   A H    1 c 1 
ATOM   9933  H  HA   . MET   A  1  646 ? -14.062 -7.331  -27.149 1.000 25.956  0 701  MET   A HA   1 c 1 
ATOM   9934  H  HB2  . MET   A  1  646 ? -13.649 -8.943  -28.688 1.000 30.409  0 701  MET   A HB2  1 c 1 
ATOM   9935  H  HB3  . MET   A  1  646 ? -14.514 -7.896  -29.490 1.000 30.873  0 701  MET   A HB3  1 c 1 
ATOM   9936  H  HG2  . MET   A  1  646 ? -12.413 -7.007  -30.315 1.000 34.883  0 701  MET   A HG2  1 c 1 
ATOM   9937  H  HG3  . MET   A  1  646 ? -11.743 -8.315  -29.732 1.000 34.587  0 701  MET   A HG3  1 c 1 
ATOM   9938  H  HE1  . MET   A  1  646 ? -12.201 -10.710 -30.707 1.000 31.583  0 701  MET   A HE1  1 c 1 
ATOM   9939  H  HE2  . MET   A  1  646 ? -13.770 -10.599 -30.604 1.000 31.785  0 701  MET   A HE2  1 c 1 
ATOM   9940  H  HE3  . MET   A  1  646 ? -13.100 -11.046 -31.958 1.000 32.446  0 701  MET   A HE3  1 c 1 
ATOM   9941  N  N    . VAL   A  1  647 ? -11.714 -7.986  -26.620 1.000 19.172  0 702  VAL   A N    1 ? 1 
ATOM   9942  C  CA   . VAL   A  1  647 ? -10.426 -8.084  -25.978 1.000 24.314  0 702  VAL   A CA   1 ? 1 
ATOM   9943  C  C    . VAL   A  1  647 ? -10.104 -9.571  -25.872 1.000 23.037  0 702  VAL   A C    1 ? 1 
ATOM   9944  O  O    . VAL   A  1  647 ? -11.004 -10.387 -25.672 1.000 20.675  0 702  VAL   A O    1 ? 1 
ATOM   9945  C  CB   . VAL   A  1  647 ? -10.431 -7.386  -24.586 1.000 24.059  0 702  VAL   A CB   1 ? 1 
ATOM   9946  C  CG1  . VAL   A  1  647 ? -10.480 -5.859  -24.700 1.000 21.526  0 702  VAL   A CG1  1 ? 1 
ATOM   9947  C  CG2  . VAL   A  1  647 ? -11.579 -7.864  -23.708 1.000 22.597  0 702  VAL   A CG2  1 ? 1 
ATOM   9948  H  H    . VAL   A  1  647 ? -12.322 -8.652  -26.472 1.000 20.891  0 702  VAL   A H    1 c 1 
ATOM   9949  H  HA   . VAL   A  1  647 ? -9.763  -7.655  -26.543 1.000 22.780  0 702  VAL   A HA   1 c 1 
ATOM   9950  H  HB   . VAL   A  1  647 ? -9.587  -7.625  -24.135 1.000 22.953  0 702  VAL   A HB   1 c 1 
ATOM   9951  H  HG11 . VAL   A  1  647 ? -11.348 -5.585  -25.044 1.000 22.460  0 702  VAL   A HG11 1 c 1 
ATOM   9952  H  HG12 . VAL   A  1  647 ? -9.781  -5.555  -25.305 1.000 22.323  0 702  VAL   A HG12 1 c 1 
ATOM   9953  H  HG13 . VAL   A  1  647 ? -10.342 -5.464  -23.821 1.000 21.812  0 702  VAL   A HG13 1 c 1 
ATOM   9954  H  HG21 . VAL   A  1  647 ? -11.529 -7.424  -22.842 1.000 22.634  0 702  VAL   A HG21 1 c 1 
ATOM   9955  H  HG22 . VAL   A  1  647 ? -11.516 -8.827  -23.585 1.000 23.034  0 702  VAL   A HG22 1 c 1 
ATOM   9956  H  HG23 . VAL   A  1  647 ? -12.427 -7.647  -24.132 1.000 23.259  0 702  VAL   A HG23 1 c 1 
ATOM   9957  N  N    . PRO   A  1  648 ? -8.825  -9.972  -26.017 1.000 19.225  0 703  PRO   A N    1 ? 1 
ATOM   9958  C  CA   . PRO   A  1  648 ? -8.447  -11.369 -25.850 1.000 23.454  0 703  PRO   A CA   1 ? 1 
ATOM   9959  C  C    . PRO   A  1  648 ? -8.701  -11.888 -24.439 1.000 26.501  0 703  PRO   A C    1 ? 1 
ATOM   9960  O  O    . PRO   A  1  648 ? -8.245  -11.303 -23.453 1.000 23.859  0 703  PRO   A O    1 ? 1 
ATOM   9961  C  CB   . PRO   A  1  648 ? -6.970  -11.394 -26.217 1.000 22.177  0 703  PRO   A CB   1 ? 1 
ATOM   9962  C  CG   . PRO   A  1  648 ? -6.607  -10.030 -26.592 1.000 20.120  0 703  PRO   A CG   1 ? 1 
ATOM   9963  C  CD   . PRO   A  1  648 ? -7.683  -9.104  -26.295 1.000 19.139  0 703  PRO   A CD   1 ? 1 
ATOM   9964  H  HA   . PRO   A  1  648 ? -8.950  -11.916 -26.504 1.000 23.227  0 703  PRO   A HA   1 c 1 
ATOM   9965  H  HB2  . PRO   A  1  648 ? -6.430  -11.693 -25.454 1.000 21.668  0 703  PRO   A HB2  1 c 1 
ATOM   9966  H  HB3  . PRO   A  1  648 ? -6.813  -12.007 -26.966 1.000 22.366  0 703  PRO   A HB3  1 c 1 
ATOM   9967  H  HG2  . PRO   A  1  648 ? -5.800  -9.760  -26.108 1.000 20.078  0 703  PRO   A HG2  1 c 1 
ATOM   9968  H  HG3  . PRO   A  1  648 ? -6.403  -9.997  -27.549 1.000 20.753  0 703  PRO   A HG3  1 c 1 
ATOM   9969  H  HD2  . PRO   A  1  648 ? -7.468  -8.552  -25.521 1.000 18.913  0 703  PRO   A HD2  1 c 1 
ATOM   9970  H  HD3  . PRO   A  1  648 ? -7.862  -8.523  -27.058 1.000 19.634  0 703  PRO   A HD3  1 c 1 
ATOM   9971  N  N    . MET   A  1  649 ? -9.424  -13.012 -24.361 1.000 20.558  0 704  MET   A N    1 ? 1 
ATOM   9972  C  CA   . MET   A  1  649 ? -9.689  -13.659 -23.092 1.000 20.043  0 704  MET   A CA   1 ? 1 
ATOM   9973  C  C    . MET   A  1  649 ? -9.563  -15.179 -23.217 1.000 24.566  0 704  MET   A C    1 ? 1 
ATOM   9974  O  O    . MET   A  1  649 ? -10.184 -15.794 -24.077 1.000 23.883  0 704  MET   A O    1 ? 1 
ATOM   9975  C  CB   . MET   A  1  649 ? -11.087 -13.256 -22.555 1.000 21.251  0 704  MET   A CB   1 ? 1 
ATOM   9976  C  CG   . MET   A  1  649 ? -11.159 -11.836 -22.113 1.000 20.905  0 704  MET   A CG   1 ? 1 
ATOM   9977  S  SD   . MET   A  1  649 ? -12.667 -11.422 -21.241 1.000 25.081  0 704  MET   A SD   1 ? 1 
ATOM   9978  C  CE   . MET   A  1  649 ? -12.167 -9.788  -20.641 1.000 27.467  0 704  MET   A CE   1 ? 1 
ATOM   9979  H  H    . MET   A  1  649 ? -9.756  -13.387 -25.124 1.000 22.176  0 704  MET   A H    1 c 1 
ATOM   9980  H  HA   . MET   A  1  649 ? -9.010  -13.352 -22.455 1.000 20.680  0 704  MET   A HA   1 c 1 
ATOM   9981  H  HB2  . MET   A  1  649 ? -11.750 -13.406 -23.258 1.000 21.368  0 704  MET   A HB2  1 c 1 
ATOM   9982  H  HB3  . MET   A  1  649 ? -11.313 -13.836 -21.801 1.000 20.897  0 704  MET   A HB3  1 c 1 
ATOM   9983  H  HG2  . MET   A  1  649 ? -10.396 -11.646 -21.527 1.000 21.240  0 704  MET   A HG2  1 c 1 
ATOM   9984  H  HG3  . MET   A  1  649 ? -11.084 -11.254 -22.899 1.000 21.777  0 704  MET   A HG3  1 c 1 
ATOM   9985  H  HE1  . MET   A  1  649 ? -11.326 -9.860  -20.174 1.000 26.316  0 704  MET   A HE1  1 c 1 
ATOM   9986  H  HE2  . MET   A  1  649 ? -12.068 -9.189  -21.388 1.000 26.699  0 704  MET   A HE2  1 c 1 
ATOM   9987  H  HE3  . MET   A  1  649 ? -12.838 -9.445  -20.044 1.000 26.502  0 704  MET   A HE3  1 c 1 
ATOM   9988  N  N    . TYR   A  1  650 ? -8.758  -15.783 -22.333 1.000 22.411  0 705  TYR   A N    1 ? 1 
ATOM   9989  C  CA   . TYR   A  1  650 ? -8.730  -17.226 -22.187 1.000 22.610  0 705  TYR   A CA   1 ? 1 
ATOM   9990  C  C    . TYR   A  1  650 ? -10.101 -17.688 -21.745 1.000 18.664  0 705  TYR   A C    1 ? 1 
ATOM   9991  O  O    . TYR   A  1  650 ? -10.802 -16.973 -21.015 1.000 19.545  0 705  TYR   A O    1 ? 1 
ATOM   9992  C  CB   . TYR   A  1  650 ? -7.745  -17.702 -21.110 1.000 27.278  0 705  TYR   A CB   1 ? 1 
ATOM   9993  C  CG   . TYR   A  1  650 ? -6.286  -17.463 -21.398 1.000 25.753  0 705  TYR   A CG   1 ? 1 
ATOM   9994  C  CD1  . TYR   A  1  650 ? -5.627  -18.165 -22.402 1.000 23.810  0 705  TYR   A CD1  1 ? 1 
ATOM   9995  C  CD2  . TYR   A  1  650 ? -5.552  -16.565 -20.642 1.000 20.903  0 705  TYR   A CD2  1 ? 1 
ATOM   9996  C  CE1  . TYR   A  1  650 ? -4.280  -17.959 -22.648 1.000 24.974  0 705  TYR   A CE1  1 ? 1 
ATOM   9997  C  CE2  . TYR   A  1  650 ? -4.218  -16.367 -20.871 1.000 22.349  0 705  TYR   A CE2  1 ? 1 
ATOM   9998  C  CZ   . TYR   A  1  650 ? -3.578  -17.074 -21.862 1.000 25.123  0 705  TYR   A CZ   1 ? 1 
ATOM   9999  O  OH   . TYR   A  1  650 ? -2.260  -16.817 -22.077 1.000 34.455  0 705  TYR   A OH   1 ? 1 
ATOM   10000 H  H    . TYR   A  1  650 ? -8.208  -15.277 -21.806 1.000 22.427  0 705  TYR   A H    1 c 1 
ATOM   10001 H  HA   . TYR   A  1  650 ? -8.500  -17.639 -23.054 1.000 22.801  0 705  TYR   A HA   1 c 1 
ATOM   10002 H  HB2  . TYR   A  1  650 ? -7.975  -17.255 -20.269 1.000 25.184  0 705  TYR   A HB2  1 c 1 
ATOM   10003 H  HB3  . TYR   A  1  650 ? -7.881  -18.663 -20.979 1.000 25.897  0 705  TYR   A HB3  1 c 1 
ATOM   10004 H  HD1  . TYR   A  1  650 ? -6.105  -18.786 -22.927 1.000 25.085  0 705  TYR   A HD1  1 c 1 
ATOM   10005 H  HD2  . TYR   A  1  650 ? -5.975  -16.091 -19.945 1.000 21.898  0 705  TYR   A HD2  1 c 1 
ATOM   10006 H  HE1  . TYR   A  1  650 ? -3.841  -18.438 -23.332 1.000 25.282  0 705  TYR   A HE1  1 c 1 
ATOM   10007 H  HE2  . TYR   A  1  650 ? -3.736  -15.748 -20.348 1.000 22.207  0 705  TYR   A HE2  1 c 1 
ATOM   10008 H  HH   . TYR   A  1  650 ? -1.837  -17.214 -22.715 0.000 23.380  0 705  TYR   A HH   1 c 1 
ATOM   10009 N  N    . PRO   A  1  651 ? -10.547 -18.882 -22.177 1.000 19.765  0 706  PRO   A N    1 ? 1 
ATOM   10010 C  CA   . PRO   A  1  651 ? -11.848 -19.401 -21.735 1.000 23.668  0 706  PRO   A CA   1 ? 1 
ATOM   10011 C  C    . PRO   A  1  651 ? -12.000 -19.466 -20.210 1.000 21.355  0 706  PRO   A C    1 ? 1 
ATOM   10012 O  O    . PRO   A  1  651 ? -13.051 -19.129 -19.676 1.000 20.688  0 706  PRO   A O    1 ? 1 
ATOM   10013 C  CB   . PRO   A  1  651 ? -11.929 -20.756 -22.427 1.000 21.259  0 706  PRO   A CB   1 ? 1 
ATOM   10014 C  CG   . PRO   A  1  651 ? -11.168 -20.561 -23.654 1.000 22.554  0 706  PRO   A CG   1 ? 1 
ATOM   10015 C  CD   . PRO   A  1  651 ? -9.944  -19.709 -23.222 1.000 20.996  0 706  PRO   A CD   1 ? 1 
ATOM   10016 H  HA   . PRO   A  1  651 ? -12.558 -18.818 -22.104 1.000 21.990  0 706  PRO   A HA   1 c 1 
ATOM   10017 H  HB2  . PRO   A  1  651 ? -11.528 -21.460 -21.873 1.000 22.140  0 706  PRO   A HB2  1 c 1 
ATOM   10018 H  HB3  . PRO   A  1  651 ? -12.859 -20.997 -22.625 1.000 22.457  0 706  PRO   A HB3  1 c 1 
ATOM   10019 H  HG2  . PRO   A  1  651 ? -10.881 -21.420 -24.026 1.000 22.502  0 706  PRO   A HG2  1 c 1 
ATOM   10020 H  HG3  . PRO   A  1  651 ? -11.702 -20.088 -24.324 1.000 22.380  0 706  PRO   A HG3  1 c 1 
ATOM   10021 H  HD2  . PRO   A  1  651 ? -9.225  -20.265 -22.870 1.000 21.016  0 706  PRO   A HD2  1 c 1 
ATOM   10022 H  HD3  . PRO   A  1  651 ? -9.609  -19.169 -23.961 1.000 21.148  0 706  PRO   A HD3  1 c 1 
ATOM   10023 N  N    . ALA   A  1  652 ? -10.936 -19.857 -19.500 1.000 24.984  0 707  ALA   A N    1 ? 1 
ATOM   10024 C  CA   . ALA   A  1  652 ? -10.987 -19.909 -18.047 1.000 25.255  0 707  ALA   A CA   1 ? 1 
ATOM   10025 C  C    . ALA   A  1  652 ? -11.274 -18.505 -17.525 1.000 23.294  0 707  ALA   A C    1 ? 1 
ATOM   10026 O  O    . ALA   A  1  652 ? -12.087 -18.341 -16.627 1.000 21.676  0 707  ALA   A O    1 ? 1 
ATOM   10027 C  CB   . ALA   A  1  652 ? -9.699  -20.460 -17.465 1.000 23.042  0 707  ALA   A CB   1 ? 1 
ATOM   10028 H  H    . ALA   A  1  652 ? -10.166 -20.102 -19.927 1.000 24.103  0 707  ALA   A H    1 c 1 
ATOM   10029 H  HA   . ALA   A  1  652 ? -11.732 -20.499 -17.782 1.000 24.715  0 707  ALA   A HA   1 c 1 
ATOM   10030 H  HB1  . ALA   A  1  652 ? -9.765  -20.490 -16.497 1.000 23.439  0 707  ALA   A HB1  1 c 1 
ATOM   10031 H  HB2  . ALA   A  1  652 ? -9.546  -21.357 -17.807 1.000 24.023  0 707  ALA   A HB2  1 c 1 
ATOM   10032 H  HB3  . ALA   A  1  652 ? -8.957  -19.887 -17.720 1.000 23.390  0 707  ALA   A HB3  1 c 1 
ATOM   10033 N  N    . PHE   A  1  653 ? -10.642 -17.484 -18.113 1.000 23.480  0 708  PHE   A N    1 ? 1 
ATOM   10034 C  CA   . PHE   A  1  653 ? -10.920 -16.113 -17.701 1.000 19.868  0 708  PHE   A CA   1 ? 1 
ATOM   10035 C  C    . PHE   A  1  653 ? -12.363 -15.718 -17.996 1.000 20.749  0 708  PHE   A C    1 ? 1 
ATOM   10036 O  O    . PHE   A  1  653 ? -13.036 -15.130 -17.162 1.000 19.785  0 708  PHE   A O    1 ? 1 
ATOM   10037 C  CB   . PHE   A  1  653 ? -9.973  -15.096 -18.327 1.000 22.598  0 708  PHE   A CB   1 ? 1 
ATOM   10038 C  CG   . PHE   A  1  653 ? -10.095 -13.743 -17.644 1.000 21.857  0 708  PHE   A CG   1 ? 1 
ATOM   10039 C  CD1  . PHE   A  1  653 ? -9.640  -13.559 -16.342 1.000 23.720  0 708  PHE   A CD1  1 ? 1 
ATOM   10040 C  CD2  . PHE   A  1  653 ? -10.773 -12.707 -18.250 1.000 19.546  0 708  PHE   A CD2  1 ? 1 
ATOM   10041 C  CE1  . PHE   A  1  653 ? -9.785  -12.319 -15.702 1.000 26.057  0 708  PHE   A CE1  1 ? 1 
ATOM   10042 C  CE2  . PHE   A  1  653 ? -10.927 -11.482 -17.608 1.000 22.264  0 708  PHE   A CE2  1 ? 1 
ATOM   10043 C  CZ   . PHE   A  1  653 ? -10.413 -11.291 -16.344 1.000 24.772  0 708  PHE   A CZ   1 ? 1 
ATOM   10044 H  H    . PHE   A  1  653 ? -10.027 -17.638 -18.771 1.000 22.744  0 708  PHE   A H    1 c 1 
ATOM   10045 H  HA   . PHE   A  1  653 ? -10.798 -16.069 -16.718 1.000 20.812  0 708  PHE   A HA   1 c 1 
ATOM   10046 H  HB2  . PHE   A  1  653 ? -9.053  -15.423 -18.245 1.000 21.698  0 708  PHE   A HB2  1 c 1 
ATOM   10047 H  HB3  . PHE   A  1  653 ? -10.186 -15.003 -19.280 1.000 22.023  0 708  PHE   A HB3  1 c 1 
ATOM   10048 H  HD1  . PHE   A  1  653 ? -9.186  -14.261 -15.904 1.000 23.681  0 708  PHE   A HD1  1 c 1 
ATOM   10049 H  HD2  . PHE   A  1  653 ? -11.111 -12.822 -19.123 1.000 21.175  0 708  PHE   A HD2  1 c 1 
ATOM   10050 H  HE1  . PHE   A  1  653 ? -9.440  -12.194 -14.833 1.000 24.667  0 708  PHE   A HE1  1 c 1 
ATOM   10051 H  HE2  . PHE   A  1  653 ? -11.361 -10.771 -18.051 1.000 22.236  0 708  PHE   A HE2  1 c 1 
ATOM   10052 H  HZ   . PHE   A  1  653 ? -10.525 -10.461 -15.909 1.000 24.016  0 708  PHE   A HZ   1 c 1 
ATOM   10053 N  N    . LYS   A  1  654 ? -12.905 -16.150 -19.141 1.000 24.950  0 709  LYS   A N    1 ? 1 
ATOM   10054 C  CA   . LYS   A  1  654 ? -14.248 -15.737 -19.488 1.000 18.719  0 709  LYS   A CA   1 ? 1 
ATOM   10055 C  C    . LYS   A  1  654 ? -15.257 -16.180 -18.437 1.000 21.265  0 709  LYS   A C    1 ? 1 
ATOM   10056 O  O    . LYS   A  1  654 ? -16.304 -15.560 -18.287 1.000 28.854  0 709  LYS   A O    1 ? 1 
ATOM   10057 C  CB   . LYS   A  1  654 ? -14.622 -16.282 -20.884 1.000 23.704  0 709  LYS   A CB   1 ? 1 
ATOM   10058 C  CG   . LYS   A  1  654 ? -13.904 -15.546 -22.018 1.000 20.098  0 709  LYS   A CG   1 ? 1 
ATOM   10059 C  CD   . LYS   A  1  654 ? -14.104 -16.168 -23.312 1.000 28.811  0 709  LYS   A CD   1 ? 1 
ATOM   10060 C  CE   . LYS   A  1  654 ? -15.541 -16.054 -23.812 1.000 29.636  0 709  LYS   A CE   1 ? 1 
ATOM   10061 N  NZ   . LYS   A  1  654 ? -15.654 -16.640 -25.176 1.000 29.949  0 709  LYS   A NZ   1 ? 1 
ATOM   10062 H  H    . LYS   A  1  654 ? -12.435 -16.691 -19.709 1.000 22.465  0 709  LYS   A H    1 c 1 
ATOM   10063 H  HA   . LYS   A  1  654 ? -14.260 -14.753 -19.528 1.000 20.725  0 709  LYS   A HA   1 c 1 
ATOM   10064 H  HB2  . LYS   A  1  654 ? -14.394 -17.233 -20.926 1.000 22.105  0 709  LYS   A HB2  1 c 1 
ATOM   10065 H  HB3  . LYS   A  1  654 ? -15.590 -16.194 -21.008 1.000 22.075  0 709  LYS   A HB3  1 c 1 
ATOM   10066 H  HG2  . LYS   A  1  654 ? -14.229 -14.621 -22.053 1.000 22.294  0 709  LYS   A HG2  1 c 1 
ATOM   10067 H  HG3  . LYS   A  1  654 ? -12.943 -15.521 -21.820 1.000 22.134  0 709  LYS   A HG3  1 c 1 
ATOM   10068 H  HD2  . LYS   A  1  654 ? -13.507 -15.745 -23.965 1.000 26.401  0 709  LYS   A HD2  1 c 1 
ATOM   10069 H  HD3  . LYS   A  1  654 ? -13.862 -17.117 -23.252 1.000 26.687  0 709  LYS   A HD3  1 c 1 
ATOM   10070 H  HE2  . LYS   A  1  654 ? -16.142 -16.530 -23.208 1.000 29.456  0 709  LYS   A HE2  1 c 1 
ATOM   10071 H  HE3  . LYS   A  1  654 ? -15.811 -15.117 -23.839 1.000 29.250  0 709  LYS   A HE3  1 c 1 
ATOM   10072 H  HZ1  . LYS   A  1  654 ? -15.079 -17.335 -25.264 1.000 30.128  0 709  LYS   A HZ1  1 c 1 
ATOM   10073 H  HZ2  . LYS   A  1  654 ? -15.453 -16.009 -25.798 1.000 30.082  0 709  LYS   A HZ2  1 c 1 
ATOM   10074 H  HZ3  . LYS   A  1  654 ? -16.503 -16.934 -25.314 1.000 30.417  0 709  LYS   A HZ3  1 c 1 
ATOM   10075 N  N    . ARG   A  1  655 ? -14.958 -17.261 -17.704 1.000 23.826  0 710  ARG   A N    1 ? 1 
ATOM   10076 C  CA   . ARG   A  1  655 ? -15.851 -17.705 -16.641 1.000 23.083  0 710  ARG   A CA   1 ? 1 
ATOM   10077 C  C    . ARG   A  1  655 ? -15.965 -16.618 -15.581 1.000 21.032  0 710  ARG   A C    1 ? 1 
ATOM   10078 O  O    . ARG   A  1  655 ? -17.054 -16.342 -15.091 1.000 21.954  0 710  ARG   A O    1 ? 1 
ATOM   10079 C  CB   . ARG   A  1  655 ? -15.363 -18.996 -15.958 1.000 27.561  0 710  ARG   A CB   1 ? 1 
ATOM   10080 C  CG   . ARG   A  1  655 ? -15.422 -20.223 -16.816 1.000 26.595  0 710  ARG   A CG   1 ? 1 
ATOM   10081 C  CD   . ARG   A  1  655 ? -15.032 -21.496 -16.111 1.000 24.332  0 710  ARG   A CD   1 ? 1 
ATOM   10082 N  NE   . ARG   A  1  655 ? -15.892 -21.724 -14.966 1.000 25.696  0 710  ARG   A NE   1 ? 1 
ATOM   10083 C  CZ   . ARG   A  1  655 ? -15.613 -22.582 -13.999 1.000 26.658  0 710  ARG   A CZ   1 ? 1 
ATOM   10084 N  NH1  . ARG   A  1  655 ? -14.427 -23.150 -13.910 1.000 28.407  0 710  ARG   A NH1  1 ? 1 
ATOM   10085 N  NH2  . ARG   A  1  655 ? -16.539 -22.861 -13.087 1.000 21.087  0 710  ARG   A NH2  1 ? 1 
ATOM   10086 H  H    . ARG   A  1  655 ? -14.201 -17.742 -17.879 1.000 22.978  0 710  ARG   A H    1 c 1 
ATOM   10087 H  HA   . ARG   A  1  655 ? -16.742 -17.866 -17.028 1.000 24.057  0 710  ARG   A HA   1 c 1 
ATOM   10088 H  HB2  . ARG   A  1  655 ? -14.437 -18.862 -15.667 1.000 25.724  0 710  ARG   A HB2  1 c 1 
ATOM   10089 H  HB3  . ARG   A  1  655 ? -15.907 -19.146 -15.158 1.000 26.088  0 710  ARG   A HB3  1 c 1 
ATOM   10090 H  HG2  . ARG   A  1  655 ? -16.335 -20.324 -17.161 1.000 26.694  0 710  ARG   A HG2  1 c 1 
ATOM   10091 H  HG3  . ARG   A  1  655 ? -14.829 -20.099 -17.587 1.000 26.306  0 710  ARG   A HG3  1 c 1 
ATOM   10092 H  HD2  . ARG   A  1  655 ? -15.105 -22.252 -16.733 1.000 25.606  0 710  ARG   A HD2  1 c 1 
ATOM   10093 H  HD3  . ARG   A  1  655 ? -14.099 -21.430 -15.816 1.000 24.878  0 710  ARG   A HD3  1 c 1 
ATOM   10094 H  HE   . ARG   A  1  655 ? -16.641 -21.279 -14.916 1.000 25.588  0 710  ARG   A HE   1 c 1 
ATOM   10095 H  HH11 . ARG   A  1  655 ? -13.913 -23.223 -14.628 1.000 27.747  0 710  ARG   A HH11 1 c 1 
ATOM   10096 H  HH12 . ARG   A  1  655 ? -14.152 -23.464 -13.126 1.000 27.602  0 710  ARG   A HH12 1 c 1 
ATOM   10097 H  HH21 . ARG   A  1  655 ? -16.360 -23.429 -12.440 1.000 22.770  0 710  ARG   A HH21 1 c 1 
ATOM   10098 H  HH22 . ARG   A  1  655 ? -17.329 -22.479 -13.132 1.000 22.760  0 710  ARG   A HH22 1 c 1 
ATOM   10099 N  N    . VAL   A  1  656 ? -14.817 -16.018 -15.246 1.000 18.444  0 711  VAL   A N    1 ? 1 
ATOM   10100 C  CA   . VAL   A  1  656 ? -14.762 -14.919 -14.300 1.000 21.272  0 711  VAL   A CA   1 ? 1 
ATOM   10101 C  C    . VAL   A  1  656 ? -15.485 -13.685 -14.833 1.000 19.186  0 711  VAL   A C    1 ? 1 
ATOM   10102 O  O    . VAL   A  1  656 ? -16.351 -13.136 -14.172 1.000 22.994  0 711  VAL   A O    1 ? 1 
ATOM   10103 C  CB   . VAL   A  1  656 ? -13.298 -14.614 -13.958 1.000 18.243  0 711  VAL   A CB   1 ? 1 
ATOM   10104 C  CG1  . VAL   A  1  656 ? -13.188 -13.395 -13.071 1.000 22.077  0 711  VAL   A CG1  1 ? 1 
ATOM   10105 C  CG2  . VAL   A  1  656 ? -12.636 -15.822 -13.306 1.000 22.391  0 711  VAL   A CG2  1 ? 1 
ATOM   10106 H  H    . VAL   A  1  656 ? -14.039 -16.305 -15.630 1.000 19.627  0 711  VAL   A H    1 c 1 
ATOM   10107 H  HA   . VAL   A  1  656 ? -15.211 -15.203 -13.483 1.000 19.757  0 711  VAL   A HA   1 c 1 
ATOM   10108 H  HB   . VAL   A  1  656 ? -12.823 -14.421 -14.802 1.000 20.119  0 711  VAL   A HB   1 c 1 
ATOM   10109 H  HG11 . VAL   A  1  656 ? -13.827 -13.465 -12.341 1.000 20.644  0 711  VAL   A HG11 1 c 1 
ATOM   10110 H  HG12 . VAL   A  1  656 ? -13.378 -12.594 -13.590 1.000 20.571  0 711  VAL   A HG12 1 c 1 
ATOM   10111 H  HG13 . VAL   A  1  656 ? -12.287 -13.337 -12.708 1.000 20.337  0 711  VAL   A HG13 1 c 1 
ATOM   10112 H  HG21 . VAL   A  1  656 ? -11.745 -15.579 -13.001 1.000 20.706  0 711  VAL   A HG21 1 c 1 
ATOM   10113 H  HG22 . VAL   A  1  656 ? -12.570 -16.547 -13.951 1.000 21.288  0 711  VAL   A HG22 1 c 1 
ATOM   10114 H  HG23 . VAL   A  1  656 ? -13.170 -16.113 -12.545 1.000 21.085  0 711  VAL   A HG23 1 c 1 
ATOM   10115 N  N    . TRP   A  1  657 ? -15.080 -13.232 -16.023 1.000 22.118  0 712  TRP   A N    1 ? 1 
ATOM   10116 C  CA   . TRP   A  1  657 ? -15.538 -11.970 -16.561 1.000 20.430  0 712  TRP   A CA   1 ? 1 
ATOM   10117 C  C    . TRP   A  1  657 ? -17.041 -11.966 -16.873 1.000 21.617  0 712  TRP   A C    1 ? 1 
ATOM   10118 O  O    . TRP   A  1  657 ? -17.742 -10.992 -16.605 1.000 19.288  0 712  TRP   A O    1 ? 1 
ATOM   10119 C  CB   . TRP   A  1  657 ? -14.712 -11.688 -17.821 1.000 28.337  0 712  TRP   A CB   1 ? 1 
ATOM   10120 C  CG   . TRP   A  1  657 ? -14.880 -10.323 -18.363 1.000 24.041  0 712  TRP   A CG   1 ? 1 
ATOM   10121 C  CD1  . TRP   A  1  657 ? -15.484 -9.969  -19.531 1.000 29.425  0 712  TRP   A CD1  1 ? 1 
ATOM   10122 C  CD2  . TRP   A  1  657 ? -14.415 -9.114  -17.768 1.000 23.563  0 712  TRP   A CD2  1 ? 1 
ATOM   10123 N  NE1  . TRP   A  1  657 ? -15.418 -8.595  -19.705 1.000 28.282  0 712  TRP   A NE1  1 ? 1 
ATOM   10124 C  CE2  . TRP   A  1  657 ? -14.745 -8.053  -18.651 1.000 19.771  0 712  TRP   A CE2  1 ? 1 
ATOM   10125 C  CE3  . TRP   A  1  657 ? -13.729 -8.821  -16.583 1.000 24.599  0 712  TRP   A CE3  1 ? 1 
ATOM   10126 C  CZ2  . TRP   A  1  657 ? -14.454 -6.729  -18.359 1.000 24.945  0 712  TRP   A CZ2  1 ? 1 
ATOM   10127 C  CZ3  . TRP   A  1  657 ? -13.425 -7.500  -16.307 1.000 27.877  0 712  TRP   A CZ3  1 ? 1 
ATOM   10128 C  CH2  . TRP   A  1  657 ? -13.795 -6.475  -17.183 1.000 31.803  0 712  TRP   A CH2  1 ? 1 
ATOM   10129 H  H    . TRP   A  1  657 ? -14.496 -13.735 -16.516 1.000 21.103  0 712  TRP   A H    1 c 1 
ATOM   10130 H  HA   . TRP   A  1  657 ? -15.344 -11.265 -15.899 1.000 21.727  0 712  TRP   A HA   1 c 1 
ATOM   10131 H  HB2  . TRP   A  1  657 ? -13.768 -11.832 -17.609 1.000 24.866  0 712  TRP   A HB2  1 c 1 
ATOM   10132 H  HB3  . TRP   A  1  657 ? -14.967 -12.338 -18.507 1.000 25.552  0 712  TRP   A HB3  1 c 1 
ATOM   10133 H  HD1  . TRP   A  1  657 ? -15.876 -10.569 -20.147 1.000 28.255  0 712  TRP   A HD1  1 c 1 
ATOM   10134 H  HE1  . TRP   A  1  657 ? -15.735 -8.153  -20.392 1.000 26.388  0 712  TRP   A HE1  1 c 1 
ATOM   10135 H  HE3  . TRP   A  1  657 ? -13.477 -9.511  -15.989 1.000 24.908  0 712  TRP   A HE3  1 c 1 
ATOM   10136 H  HZ2  . TRP   A  1  657 ? -14.703 -6.034  -18.944 1.000 25.084  0 712  TRP   A HZ2  1 c 1 
ATOM   10137 H  HZ3  . TRP   A  1  657 ? -12.963 -7.286  -15.512 1.000 27.295  0 712  TRP   A HZ3  1 c 1 
ATOM   10138 H  HH2  . TRP   A  1  657 ? -13.570 -5.588  -16.969 1.000 28.445  0 712  TRP   A HH2  1 c 1 
ATOM   10139 N  N    . ALA   A  1  658 ? -17.537 -13.071 -17.434 1.000 19.358  0 713  ALA   A N    1 ? 1 
ATOM   10140 C  CA   . ALA   A  1  658 ? -18.952 -13.207 -17.725 1.000 19.947  0 713  ALA   A CA   1 ? 1 
ATOM   10141 C  C    . ALA   A  1  658 ? -19.796 -13.159 -16.456 1.000 19.463  0 713  ALA   A C    1 ? 1 
ATOM   10142 O  O    . ALA   A  1  658 ? -20.894 -12.623 -16.455 1.000 24.933  0 713  ALA   A O    1 ? 1 
ATOM   10143 C  CB   . ALA   A  1  658 ? -19.215 -14.506 -18.491 1.000 21.043  0 713  ALA   A CB   1 ? 1 
ATOM   10144 H  H    . ALA   A  1  658 ? -16.975 -13.760 -17.646 1.000 20.005  0 713  ALA   A H    1 c 1 
ATOM   10145 H  HA   . ALA   A  1  658 ? -19.219 -12.450 -18.297 1.000 20.052  0 713  ALA   A HA   1 c 1 
ATOM   10146 H  HB1  . ALA   A  1  658 ? -20.159 -14.566 -18.714 1.000 21.341  0 713  ALA   A HB1  1 c 1 
ATOM   10147 H  HB2  . ALA   A  1  658 ? -18.689 -14.513 -19.308 1.000 20.954  0 713  ALA   A HB2  1 c 1 
ATOM   10148 H  HB3  . ALA   A  1  658 ? -18.965 -15.266 -17.939 1.000 20.994  0 713  ALA   A HB3  1 c 1 
ATOM   10149 N  N    . TYR   A  1  659 ? -19.287 -13.734 -15.371 1.000 19.994  0 714  TYR   A N    1 ? 1 
ATOM   10150 C  CA   . TYR   A  1  659 ? -19.999 -13.674 -14.105 1.000 20.266  0 714  TYR   A CA   1 ? 1 
ATOM   10151 C  C    . TYR   A  1  659 ? -20.018 -12.253 -13.526 1.000 18.519  0 714  TYR   A C    1 ? 1 
ATOM   10152 O  O    . TYR   A  1  659 ? -21.060 -11.753 -13.110 1.000 19.634  0 714  TYR   A O    1 ? 1 
ATOM   10153 C  CB   . TYR   A  1  659 ? -19.403 -14.702 -13.116 1.000 20.893  0 714  TYR   A CB   1 ? 1 
ATOM   10154 C  CG   . TYR   A  1  659 ? -20.235 -14.867 -11.857 1.000 22.011  0 714  TYR   A CG   1 ? 1 
ATOM   10155 C  CD1  . TYR   A  1  659 ? -21.405 -15.615 -11.864 1.000 24.201  0 714  TYR   A CD1  1 ? 1 
ATOM   10156 C  CD2  . TYR   A  1  659 ? -19.880 -14.214 -10.673 1.000 22.678  0 714  TYR   A CD2  1 ? 1 
ATOM   10157 C  CE1  . TYR   A  1  659 ? -22.163 -15.775 -10.706 1.000 27.833  0 714  TYR   A CE1  1 ? 1 
ATOM   10158 C  CE2  . TYR   A  1  659 ? -20.645 -14.337 -9.524  1.000 27.303  0 714  TYR   A CE2  1 ? 1 
ATOM   10159 C  CZ   . TYR   A  1  659 ? -21.779 -15.134 -9.535  1.000 31.536  0 714  TYR   A CZ   1 ? 1 
ATOM   10160 O  OH   . TYR   A  1  659 ? -22.519 -15.274 -8.379  1.000 30.360  0 714  TYR   A OH   1 ? 1 
ATOM   10161 H  H    . TYR   A  1  659 ? -18.489 -14.176 -15.414 1.000 19.672  0 714  TYR   A H    1 c 1 
ATOM   10162 H  HA   . TYR   A  1  659 ? -20.939 -13.936 -14.276 1.000 20.562  0 714  TYR   A HA   1 c 1 
ATOM   10163 H  HB2  . TYR   A  1  659 ? -19.331 -15.568 -13.569 1.000 21.182  0 714  TYR   A HB2  1 c 1 
ATOM   10164 H  HB3  . TYR   A  1  659 ? -18.500 -14.413 -12.868 1.000 20.479  0 714  TYR   A HB3  1 c 1 
ATOM   10165 H  HD1  . TYR   A  1  659 ? -21.659 -16.070 -12.650 1.000 24.921  0 714  TYR   A HD1  1 c 1 
ATOM   10166 H  HD2  . TYR   A  1  659 ? -19.101 -13.683 -10.654 1.000 22.944  0 714  TYR   A HD2  1 c 1 
ATOM   10167 H  HE1  . TYR   A  1  659 ? -22.941 -16.307 -10.719 1.000 28.242  0 714  TYR   A HE1  1 c 1 
ATOM   10168 H  HE2  . TYR   A  1  659 ? -20.373 -13.915 -8.726  1.000 26.513  0 714  TYR   A HE2  1 c 1 
ATOM   10169 H  HH   . TYR   A  1  659 ? -23.233 -15.767 -8.379  0.000 17.980  0 714  TYR   A HH   1 c 1 
ATOM   10170 N  N    . PHE   A  1  660 ? -18.865 -11.597 -13.502 1.000 18.962  0 715  PHE   A N    1 ? 1 
ATOM   10171 C  CA   . PHE   A  1  660 ? -18.796 -10.178 -13.181 1.000 20.769  0 715  PHE   A CA   1 ? 1 
ATOM   10172 C  C    . PHE   A  1  660 ? -19.776 -9.328  -14.006 1.000 24.328  0 715  PHE   A C    1 ? 1 
ATOM   10173 O  O    . PHE   A  1  660 ? -20.570 -8.552  -13.466 1.000 25.068  0 715  PHE   A O    1 ? 1 
ATOM   10174 C  CB   . PHE   A  1  660 ? -17.308 -9.716  -13.388 1.000 19.697  0 715  PHE   A CB   1 ? 1 
ATOM   10175 C  CG   . PHE   A  1  660 ? -17.158 -8.229  -13.400 1.000 19.871  0 715  PHE   A CG   1 ? 1 
ATOM   10176 C  CD1  . PHE   A  1  660 ? -17.470 -7.480  -12.286 1.000 19.590  0 715  PHE   A CD1  1 ? 1 
ATOM   10177 C  CD2  . PHE   A  1  660 ? -16.786 -7.568  -14.555 1.000 25.811  0 715  PHE   A CD2  1 ? 1 
ATOM   10178 C  CE1  . PHE   A  1  660 ? -17.389 -6.091  -12.309 1.000 21.654  0 715  PHE   A CE1  1 ? 1 
ATOM   10179 C  CE2  . PHE   A  1  660 ? -16.665 -6.175  -14.568 1.000 33.118  0 715  PHE   A CE2  1 ? 1 
ATOM   10180 C  CZ   . PHE   A  1  660 ? -16.963 -5.448  -13.442 1.000 23.428  0 715  PHE   A CZ   1 ? 1 
ATOM   10181 H  H    . PHE   A  1  660 ? -18.091 -12.047 -13.686 1.000 19.005  0 715  PHE   A H    1 c 1 
ATOM   10182 H  HA   . PHE   A  1  660 ? -19.024 -10.069 -12.226 1.000 20.632  0 715  PHE   A HA   1 c 1 
ATOM   10183 H  HB2  . PHE   A  1  660 ? -16.760 -10.088 -12.666 1.000 19.664  0 715  PHE   A HB2  1 c 1 
ATOM   10184 H  HB3  . PHE   A  1  660 ? -16.980 -10.080 -14.236 1.000 20.052  0 715  PHE   A HB3  1 c 1 
ATOM   10185 H  HD1  . PHE   A  1  660 ? -17.758 -7.916  -11.500 1.000 20.292  0 715  PHE   A HD1  1 c 1 
ATOM   10186 H  HD2  . PHE   A  1  660 ? -16.567 -8.065  -15.328 1.000 25.548  0 715  PHE   A HD2  1 c 1 
ATOM   10187 H  HE1  . PHE   A  1  660 ? -17.580 -5.595  -11.529 1.000 21.455  0 715  PHE   A HE1  1 c 1 
ATOM   10188 H  HE2  . PHE   A  1  660 ? -16.389 -5.733  -15.356 1.000 28.513  0 715  PHE   A HE2  1 c 1 
ATOM   10189 H  HZ   . PHE   A  1  660 ? -16.896 -4.507  -13.454 1.000 24.665  0 715  PHE   A HZ   1 c 1 
ATOM   10190 N  N    . GLN   A  1  661 ? -19.743 -9.489  -15.333 1.000 18.390  0 716  GLN   A N    1 ? 1 
ATOM   10191 C  CA   . GLN   A  1  661 ? -20.582 -8.667  -16.201 1.000 22.616  0 716  GLN   A CA   1 ? 1 
ATOM   10192 C  C    . GLN   A  1  661 ? -22.073 -8.975  -16.132 1.000 20.427  0 716  GLN   A C    1 ? 1 
ATOM   10193 O  O    . GLN   A  1  661 ? -22.884 -8.075  -16.078 1.000 28.095  0 716  GLN   A O    1 ? 1 
ATOM   10194 C  CB   . GLN   A  1  661 ? -20.169 -8.781  -17.646 1.000 20.204  0 716  GLN   A CB   1 ? 1 
ATOM   10195 C  CG   . GLN   A  1  661 ? -18.783 -8.211  -17.942 1.000 21.611  0 716  GLN   A CG   1 ? 1 
ATOM   10196 C  CD   . GLN   A  1  661 ? -18.531 -8.074  -19.431 1.000 22.566  0 716  GLN   A CD   1 ? 1 
ATOM   10197 O  OE1  . GLN   A  1  661 ? -18.857 -8.980  -20.214 1.000 24.897  0 716  GLN   A OE1  1 ? 1 
ATOM   10198 N  NE2  . GLN   A  1  661 ? -17.971 -6.956  -19.853 1.000 21.994  0 716  GLN   A NE2  1 ? 1 
ATOM   10199 H  H    . GLN   A  1  661 ? -19.192 -10.115 -15.706 1.000 20.383  0 716  GLN   A H    1 c 1 
ATOM   10200 H  HA   . GLN   A  1  661 ? -20.457 -7.729  -15.927 1.000 20.611  0 716  GLN   A HA   1 c 1 
ATOM   10201 H  HB2  . GLN   A  1  661 ? -20.184 -9.728  -17.898 1.000 21.371  0 716  GLN   A HB2  1 c 1 
ATOM   10202 H  HB3  . GLN   A  1  661 ? -20.831 -8.318  -18.195 1.000 21.541  0 716  GLN   A HB3  1 c 1 
ATOM   10203 H  HG2  . GLN   A  1  661 ? -18.700 -7.331  -17.518 1.000 21.067  0 716  GLN   A HG2  1 c 1 
ATOM   10204 H  HG3  . GLN   A  1  661 ? -18.102 -8.797  -17.554 1.000 21.005  0 716  GLN   A HG3  1 c 1 
ATOM   10205 H  HE21 . GLN   A  1  661 ? -17.611 -6.393  -19.273 1.000 21.778  0 716  GLN   A HE21 1 c 1 
ATOM   10206 H  HE22 . GLN   A  1  661 ? -17.953 -6.770  -20.717 1.000 22.370  0 716  GLN   A HE22 1 c 1 
ATOM   10207 N  N    . ARG   A  1  662 ? -22.430 -10.253 -16.084 1.000 22.692  0 717  ARG   A N    1 ? 1 
ATOM   10208 C  CA   . ARG   A  1  662 ? -23.833 -10.654 -16.083 1.000 22.868  0 717  ARG   A CA   1 ? 1 
ATOM   10209 C  C    . ARG   A  1  662 ? -24.493 -10.571 -14.707 1.000 22.484  0 717  ARG   A C    1 ? 1 
ATOM   10210 O  O    . ARG   A  1  662 ? -25.667 -10.260 -14.612 1.000 19.675  0 717  ARG   A O    1 ? 1 
ATOM   10211 C  CB   . ARG   A  1  662 ? -23.939 -12.090 -16.616 1.000 30.081  0 717  ARG   A CB   1 ? 1 
ATOM   10212 C  CG   . ARG   A  1  662 ? -25.352 -12.487 -17.083 1.000 35.607  0 717  ARG   A CG   1 ? 1 
ATOM   10213 C  CD   . ARG   A  1  662 ? -25.358 -13.935 -17.578 1.000 31.997  0 717  ARG   A CD   1 ? 1 
ATOM   10214 N  NE   . ARG   A  1  662 ? -25.251 -14.899 -16.488 1.000 38.475  0 717  ARG   A NE   1 ? 1 
ATOM   10215 C  CZ   . ARG   A  1  662 ? -26.242 -15.223 -15.654 1.000 54.302  0 717  ARG   A CZ   1 ? 1 
ATOM   10216 N  NH1  . ARG   A  1  662 ? -27.471 -14.763 -15.822 1.000 64.807  0 717  ARG   A NH1  1 ? 1 
ATOM   10217 N  NH2  . ARG   A  1  662 ? -25.992 -16.024 -14.621 1.000 45.000  0 717  ARG   A NH2  1 ? 1 
ATOM   10218 H  H    . ARG   A  1  662 ? -21.785 -10.900 -16.053 1.000 21.956  0 717  ARG   A H    1 c 1 
ATOM   10219 H  HA   . ARG   A  1  662 ? -24.322 -10.058 -16.697 1.000 24.212  0 717  ARG   A HA   1 c 1 
ATOM   10220 H  HB2  . ARG   A  1  662 ? -23.320 -12.189 -17.370 1.000 28.857  0 717  ARG   A HB2  1 c 1 
ATOM   10221 H  HB3  . ARG   A  1  662 ? -23.654 -12.708 -15.911 1.000 28.837  0 717  ARG   A HB3  1 c 1 
ATOM   10222 H  HG2  . ARG   A  1  662 ? -25.984 -12.395 -16.339 1.000 33.801  0 717  ARG   A HG2  1 c 1 
ATOM   10223 H  HG3  . ARG   A  1  662 ? -25.639 -11.894 -17.809 1.000 33.742  0 717  ARG   A HG3  1 c 1 
ATOM   10224 H  HD2  . ARG   A  1  662 ? -26.186 -14.101 -18.076 1.000 35.078  0 717  ARG   A HD2  1 c 1 
ATOM   10225 H  HD3  . ARG   A  1  662 ? -24.607 -14.065 -18.195 1.000 34.123  0 717  ARG   A HD3  1 c 1 
ATOM   10226 H  HE   . ARG   A  1  662 ? -24.482 -15.294 -16.372 1.000 39.396  0 717  ARG   A HE   1 c 1 
ATOM   10227 H  HH11 . ARG   A  1  662 ? -27.610 -14.027 -16.287 1.000 60.224  0 717  ARG   A HH11 1 c 1 
ATOM   10228 H  HH12 . ARG   A  1  662 ? -28.153 -15.195 -15.465 1.000 61.363  0 717  ARG   A HH12 1 c 1 
ATOM   10229 H  HH21 . ARG   A  1  662 ? -26.648 -16.277 -14.093 1.000 48.072  0 717  ARG   A HH21 1 c 1 
ATOM   10230 H  HH22 . ARG   A  1  662 ? -25.171 -16.299 -14.467 1.000 47.108  0 717  ARG   A HH22 1 c 1 
ATOM   10231 N  N    . VAL   A  1  663 ? -23.727 -10.811 -13.634 1.000 21.467  0 718  VAL   A N    1 ? 1 
ATOM   10232 C  CA   . VAL   A  1  663 ? -24.323 -10.911 -12.313 1.000 21.962  0 718  VAL   A CA   1 ? 1 
ATOM   10233 C  C    . VAL   A  1  663 ? -23.855 -9.778  -11.407 1.000 19.173  0 718  VAL   A C    1 ? 1 
ATOM   10234 O  O    . VAL   A  1  663 ? -24.671 -9.092  -10.812 1.000 21.159  0 718  VAL   A O    1 ? 1 
ATOM   10235 C  CB   . VAL   A  1  663 ? -24.037 -12.296 -11.688 1.000 22.654  0 718  VAL   A CB   1 ? 1 
ATOM   10236 C  CG1  . VAL   A  1  663 ? -24.520 -12.405 -10.258 1.000 22.162  0 718  VAL   A CG1  1 ? 1 
ATOM   10237 C  CG2  . VAL   A  1  663 ? -24.651 -13.412 -12.529 1.000 30.981  0 718  VAL   A CG2  1 ? 1 
ATOM   10238 H  H    . VAL   A  1  663 ? -22.824 -10.921 -13.727 1.000 21.297  0 718  VAL   A H    1 c 1 
ATOM   10239 H  HA   . VAL   A  1  663 ? -25.288 -10.828 -12.412 1.000 22.002  0 718  VAL   A HA   1 c 1 
ATOM   10240 H  HB   . VAL   A  1  663 ? -23.058 -12.424 -11.686 1.000 23.110  0 718  VAL   A HB   1 c 1 
ATOM   10241 H  HG11 . VAL   A  1  663 ? -25.441 -12.096 -10.201 1.000 22.748  0 718  VAL   A HG11 1 c 1 
ATOM   10242 H  HG12 . VAL   A  1  663 ? -23.959 -11.858 -9.680  1.000 21.891  0 718  VAL   A HG12 1 c 1 
ATOM   10243 H  HG13 . VAL   A  1  663 ? -24.472 -13.333 -9.968  1.000 22.533  0 718  VAL   A HG13 1 c 1 
ATOM   10244 H  HG21 . VAL   A  1  663 ? -24.486 -14.270 -12.100 1.000 28.254  0 718  VAL   A HG21 1 c 1 
ATOM   10245 H  HG22 . VAL   A  1  663 ? -24.250 -13.411 -13.415 1.000 28.145  0 718  VAL   A HG22 1 c 1 
ATOM   10246 H  HG23 . VAL   A  1  663 ? -25.610 -13.270 -12.608 1.000 28.708  0 718  VAL   A HG23 1 c 1 
ATOM   10247 N  N    . LEU   A  1  664 ? -22.536 -9.610  -11.257 1.000 22.794  0 719  LEU   A N    1 ? 1 
ATOM   10248 C  CA   . LEU   A  1  664 ? -22.019 -8.740  -10.210 1.000 18.318  0 719  LEU   A CA   1 ? 1 
ATOM   10249 C  C    . LEU   A  1  664 ? -22.239 -7.253  -10.493 1.000 23.614  0 719  LEU   A C    1 ? 1 
ATOM   10250 O  O    . LEU   A  1  664 ? -22.536 -6.491  -9.565  1.000 22.370  0 719  LEU   A O    1 ? 1 
ATOM   10251 C  CB   . LEU   A  1  664 ? -20.571 -9.054  -9.992  1.000 19.176  0 719  LEU   A CB   1 ? 1 
ATOM   10252 C  CG   . LEU   A  1  664 ? -20.243 -10.377 -9.353  1.000 24.163  0 719  LEU   A CG   1 ? 1 
ATOM   10253 C  CD1  . LEU   A  1  664 ? -18.728 -10.474 -9.098  1.000 24.032  0 719  LEU   A CD1  1 ? 1 
ATOM   10254 C  CD2  . LEU   A  1  664 ? -21.037 -10.586 -8.039  1.000 25.015  0 719  LEU   A CD2  1 ? 1 
ATOM   10255 H  H    . LEU   A  1  664 ? -21.952 -10.042 -11.811 1.000 20.541  0 719  LEU   A H    1 c 1 
ATOM   10256 H  HA   . LEU   A  1  664 ? -22.510 -8.955  -9.385  1.000 20.354  0 719  LEU   A HA   1 c 1 
ATOM   10257 H  HB2  . LEU   A  1  664 ? -20.119 -9.011  -10.857 1.000 19.740  0 719  LEU   A HB2  1 c 1 
ATOM   10258 H  HB3  . LEU   A  1  664 ? -20.191 -8.347  -9.433  1.000 19.486  0 719  LEU   A HB3  1 c 1 
ATOM   10259 H  HG   . LEU   A  1  664 ? -20.496 -11.095 -9.984  1.000 23.515  0 719  LEU   A HG   1 c 1 
ATOM   10260 H  HD11 . LEU   A  1  664 ? -18.484 -11.402 -8.937  1.000 23.937  0 719  LEU   A HD11 1 c 1 
ATOM   10261 H  HD12 . LEU   A  1  664 ? -18.493 -9.938  -8.322  1.000 23.628  0 719  LEU   A HD12 1 c 1 
ATOM   10262 H  HD13 . LEU   A  1  664 ? -18.249 -10.144 -9.878  1.000 23.689  0 719  LEU   A HD13 1 c 1 
ATOM   10263 H  HD21 . LEU   A  1  664 ? -21.958 -10.820 -8.248  1.000 25.204  0 719  LEU   A HD21 1 c 1 
ATOM   10264 H  HD22 . LEU   A  1  664 ? -21.021 -9.765  -7.516  1.000 24.637  0 719  LEU   A HD22 1 c 1 
ATOM   10265 H  HD23 . LEU   A  1  664 ? -20.629 -11.305 -7.525  1.000 24.731  0 719  LEU   A HD23 1 c 1 
ATOM   10266 N  N    . VAL   A  1  665 ? -22.141 -6.824  -11.771 1.000 25.226  0 720  VAL   A N    1 ? 1 
ATOM   10267 C  CA   . VAL   A  1  665 ? -22.366 -5.419  -12.076 1.000 19.274  0 720  VAL   A CA   1 ? 1 
ATOM   10268 C  C    . VAL   A  1  665 ? -23.764 -4.993  -11.639 1.000 19.301  0 720  VAL   A C    1 ? 1 
ATOM   10269 O  O    . VAL   A  1  665 ? -23.945 -3.958  -10.994 1.000 18.597  0 720  VAL   A O    1 ? 1 
ATOM   10270 C  CB   . VAL   A  1  665 ? -22.084 -5.030  -13.540 1.000 22.451  0 720  VAL   A CB   1 ? 1 
ATOM   10271 C  CG1  . VAL   A  1  665 ? -22.576 -3.617  -13.838 1.000 20.010  0 720  VAL   A CG1  1 ? 1 
ATOM   10272 C  CG2  . VAL   A  1  665 ? -20.571 -5.131  -13.850 1.000 20.923  0 720  VAL   A CG2  1 ? 1 
ATOM   10273 H  H    . VAL   A  1  665 ? -21.932 -7.405  -12.445 1.000 23.316  0 720  VAL   A H    1 c 1 
ATOM   10274 H  HA   . VAL   A  1  665 ? -21.738 -4.914  -11.529 1.000 20.275  0 720  VAL   A HA   1 c 1 
ATOM   10275 H  HB   . VAL   A  1  665 ? -22.569 -5.662  -14.126 1.000 21.496  0 720  VAL   A HB   1 c 1 
ATOM   10276 H  HG11 . VAL   A  1  665 ? -22.308 -3.019  -13.118 1.000 20.461  0 720  VAL   A HG11 1 c 1 
ATOM   10277 H  HG12 . VAL   A  1  665 ? -23.546 -3.617  -13.916 1.000 21.194  0 720  VAL   A HG12 1 c 1 
ATOM   10278 H  HG13 . VAL   A  1  665 ? -22.186 -3.308  -14.675 1.000 20.722  0 720  VAL   A HG13 1 c 1 
ATOM   10279 H  HG21 . VAL   A  1  665 ? -20.415 -4.907  -14.784 1.000 21.294  0 720  VAL   A HG21 1 c 1 
ATOM   10280 H  HG22 . VAL   A  1  665 ? -20.264 -6.038  -13.680 1.000 21.104  0 720  VAL   A HG22 1 c 1 
ATOM   10281 H  HG23 . VAL   A  1  665 ? -20.081 -4.512  -13.282 1.000 20.856  0 720  VAL   A HG23 1 c 1 
ATOM   10282 N  N    . LYS   A  1  666 ? -24.767 -5.778  -12.004 1.000 19.966  0 721  LYS   A N    1 ? 1 
ATOM   10283 C  CA   . LYS   A  1  666 ? -26.127 -5.480  -11.590 1.000 23.586  0 721  LYS   A CA   1 ? 1 
ATOM   10284 C  C    . LYS   A  1  666 ? -26.250 -5.413  -10.069 1.000 22.027  0 721  LYS   A C    1 ? 1 
ATOM   10285 O  O    . LYS   A  1  666 ? -26.946 -4.537  -9.553  1.000 22.858  0 721  LYS   A O    1 ? 1 
ATOM   10286 C  CB   . LYS   A  1  666 ? -27.092 -6.536  -12.163 1.000 28.355  0 721  LYS   A CB   1 ? 1 
ATOM   10287 C  CG   . LYS   A  1  666 ? -28.512 -6.465  -11.584 1.000 31.025  0 721  LYS   A CG   1 ? 1 
ATOM   10288 C  CD   . LYS   A  1  666 ? -29.230 -5.154  -11.828 1.000 27.596  0 721  LYS   A CD   1 ? 1 
ATOM   10289 C  CE   . LYS   A  1  666 ? -30.670 -5.252  -11.379 1.000 32.489  0 721  LYS   A CE   1 ? 1 
ATOM   10290 N  NZ   . LYS   A  1  666 ? -31.254 -3.899  -11.318 1.000 31.570  0 721  LYS   A NZ   1 ? 1 
ATOM   10291 H  H    . LYS   A  1  666 ? -24.609 -6.512  -12.525 1.000 20.700  0 721  LYS   A H    1 c 1 
ATOM   10292 H  HA   . LYS   A  1  666 ? -26.372 -4.600  -11.959 1.000 23.406  0 721  LYS   A HA   1 c 1 
ATOM   10293 H  HB2  . LYS   A  1  666 ? -27.142 -6.419  -13.135 1.000 27.857  0 721  LYS   A HB2  1 c 1 
ATOM   10294 H  HB3  . LYS   A  1  666 ? -26.724 -7.427  -11.985 1.000 27.503  0 721  LYS   A HB3  1 c 1 
ATOM   10295 H  HG2  . LYS   A  1  666 ? -29.041 -7.189  -11.978 1.000 30.177  0 721  LYS   A HG2  1 c 1 
ATOM   10296 H  HG3  . LYS   A  1  666 ? -28.467 -6.626  -10.618 1.000 29.482  0 721  LYS   A HG3  1 c 1 
ATOM   10297 H  HD2  . LYS   A  1  666 ? -28.783 -4.435  -11.334 1.000 28.862  0 721  LYS   A HD2  1 c 1 
ATOM   10298 H  HD3  . LYS   A  1  666 ? -29.202 -4.937  -12.785 1.000 29.372  0 721  LYS   A HD3  1 c 1 
ATOM   10299 H  HE2  . LYS   A  1  666 ? -31.180 -5.798  -12.007 1.000 31.638  0 721  LYS   A HE2  1 c 1 
ATOM   10300 H  HE3  . LYS   A  1  666 ? -30.718 -5.667  -10.497 1.000 31.154  0 721  LYS   A HE3  1 c 1 
ATOM   10301 H  HZ1  . LYS   A  1  666 ? -31.181 -3.495  -12.126 1.000 31.975  0 721  LYS   A HZ1  1 c 1 
ATOM   10302 H  HZ2  . LYS   A  1  666 ? -30.817 -3.403  -10.697 1.000 31.561  0 721  LYS   A HZ2  1 c 1 
ATOM   10303 H  HZ3  . LYS   A  1  666 ? -32.131 -3.952  -11.091 1.000 32.499  0 721  LYS   A HZ3  1 c 1 
ATOM   10304 N  N    . LYS   A  1  667 ? -25.625 -6.385  -9.375  1.000 23.045  0 722  LYS   A N    1 ? 1 
ATOM   10305 C  CA   . LYS   A  1  667 ? -25.655 -6.446  -7.924  1.000 24.033  0 722  LYS   A CA   1 ? 1 
ATOM   10306 C  C    . LYS   A  1  667 ? -25.126 -5.141  -7.325  1.000 19.158  0 722  LYS   A C    1 ? 1 
ATOM   10307 O  O    . LYS   A  1  667 ? -25.787 -4.536  -6.500  1.000 19.467  0 722  LYS   A O    1 ? 1 
ATOM   10308 C  CB   . LYS   A  1  667 ? -24.836 -7.678  -7.410  1.000 26.593  0 722  LYS   A CB   1 ? 1 
ATOM   10309 C  CG   . LYS   A  1  667 ? -24.633 -7.761  -5.895  1.000 27.438  0 722  LYS   A CG   1 ? 1 
ATOM   10310 C  CD   . LYS   A  1  667 ? -24.159 -9.143  -5.497  1.000 41.976  0 722  LYS   A CD   1 ? 1 
ATOM   10311 C  CE   . LYS   A  1  667 ? -23.806 -9.329  -4.047  1.000 52.471  0 722  LYS   A CE   1 ? 1 
ATOM   10312 N  NZ   . LYS   A  1  667 ? -22.417 -8.921  -3.754  1.000 61.127  0 722  LYS   A NZ   1 ? 1 
ATOM   10313 H  H    . LYS   A  1  667 ? -25.170 -7.033  -9.831  1.000 22.801  0 722  LYS   A H    1 c 1 
ATOM   10314 H  HA   . LYS   A  1  667 ? -26.593 -6.558  -7.643  1.000 23.761  0 722  LYS   A HA   1 c 1 
ATOM   10315 H  HB2  . LYS   A  1  667 ? -25.292 -8.493  -7.706  1.000 26.524  0 722  LYS   A HB2  1 c 1 
ATOM   10316 H  HB3  . LYS   A  1  667 ? -23.955 -7.661  -7.838  1.000 25.683  0 722  LYS   A HB3  1 c 1 
ATOM   10317 H  HG2  . LYS   A  1  667 ? -23.969 -7.094  -5.617  1.000 29.333  0 722  LYS   A HG2  1 c 1 
ATOM   10318 H  HG3  . LYS   A  1  667 ? -25.480 -7.561  -5.442  1.000 30.227  0 722  LYS   A HG3  1 c 1 
ATOM   10319 H  HD2  . LYS   A  1  667 ? -24.858 -9.789  -5.728  1.000 40.050  0 722  LYS   A HD2  1 c 1 
ATOM   10320 H  HD3  . LYS   A  1  667 ? -23.369 -9.365  -6.036  1.000 39.323  0 722  LYS   A HD3  1 c 1 
ATOM   10321 H  HE2  . LYS   A  1  667 ? -24.413 -8.801  -3.495  1.000 51.819  0 722  LYS   A HE2  1 c 1 
ATOM   10322 H  HE3  . LYS   A  1  667 ? -23.917 -10.267 -3.804  1.000 51.842  0 722  LYS   A HE3  1 c 1 
ATOM   10323 H  HZ1  . LYS   A  1  667 ? -22.295 -8.053  -3.987  1.000 57.779  0 722  LYS   A HZ1  1 c 1 
ATOM   10324 H  HZ2  . LYS   A  1  667 ? -21.839 -9.438  -4.224  1.000 57.514  0 722  LYS   A HZ2  1 c 1 
ATOM   10325 H  HZ3  . LYS   A  1  667 ? -22.248 -9.018  -2.868  1.000 57.889  0 722  LYS   A HZ3  1 c 1 
ATOM   10326 N  N    . TYR   A  1  668 ? -23.955 -4.704  -7.785  1.000 22.358  0 723  TYR   A N    1 ? 1 
ATOM   10327 C  CA   . TYR   A  1  668 ? -23.309 -3.508  -7.281  1.000 20.011  0 723  TYR   A CA   1 ? 1 
ATOM   10328 C  C    . TYR   A  1  668 ? -24.198 -2.303  -7.540  1.000 24.212  0 723  TYR   A C    1 ? 1 
ATOM   10329 O  O    . TYR   A  1  668 ? -24.480 -1.528  -6.613  1.000 21.414  0 723  TYR   A O    1 ? 1 
ATOM   10330 C  CB   . TYR   A  1  668 ? -21.882 -3.371  -7.905  1.000 21.465  0 723  TYR   A CB   1 ? 1 
ATOM   10331 C  CG   . TYR   A  1  668 ? -20.941 -4.542  -7.609  1.000 20.273  0 723  TYR   A CG   1 ? 1 
ATOM   10332 C  CD1  . TYR   A  1  668 ? -21.136 -5.358  -6.512  1.000 21.743  0 723  TYR   A CD1  1 ? 1 
ATOM   10333 C  CD2  . TYR   A  1  668 ? -19.869 -4.827  -8.438  1.000 20.001  0 723  TYR   A CD2  1 ? 1 
ATOM   10334 C  CE1  . TYR   A  1  668 ? -20.297 -6.438  -6.245  1.000 23.997  0 723  TYR   A CE1  1 ? 1 
ATOM   10335 C  CE2  . TYR   A  1  668 ? -19.012 -5.897  -8.181  1.000 21.720  0 723  TYR   A CE2  1 ? 1 
ATOM   10336 C  CZ   . TYR   A  1  668 ? -19.237 -6.712  -7.089  1.000 30.114  0 723  TYR   A CZ   1 ? 1 
ATOM   10337 O  OH   . TYR   A  1  668 ? -18.441 -7.815  -6.840  1.000 23.039  0 723  TYR   A OH   1 ? 1 
ATOM   10338 H  H    . TYR   A  1  668 ? -23.540 -5.176  -8.448  1.000 20.799  0 723  TYR   A H    1 c 1 
ATOM   10339 H  HA   . TYR   A  1  668 ? -23.211 -3.602  -6.300  1.000 21.283  0 723  TYR   A HA   1 c 1 
ATOM   10340 H  HB2  . TYR   A  1  668 ? -21.978 -3.280  -8.877  1.000 20.921  0 723  TYR   A HB2  1 c 1 
ATOM   10341 H  HB3  . TYR   A  1  668 ? -21.476 -2.545  -7.567  1.000 20.557  0 723  TYR   A HB3  1 c 1 
ATOM   10342 H  HD1  . TYR   A  1  668 ? -21.860 -5.192  -5.934  1.000 22.226  0 723  TYR   A HD1  1 c 1 
ATOM   10343 H  HD2  . TYR   A  1  668 ? -19.715 -4.286  -9.194  1.000 20.477  0 723  TYR   A HD2  1 c 1 
ATOM   10344 H  HE1  . TYR   A  1  668 ? -20.462 -6.993  -5.500  1.000 24.627  0 723  TYR   A HE1  1 c 1 
ATOM   10345 H  HE2  . TYR   A  1  668 ? -18.302 -6.087  -8.772  1.000 22.566  0 723  TYR   A HE2  1 c 1 
ATOM   10346 H  HH   . TYR   A  1  668 ? -18.604 -8.321  -6.170  0.000 13.890  0 723  TYR   A HH   1 c 1 
ATOM   10347 N  N    . ALA   A  1  669 ? -24.748 -2.229  -8.769  1.000 24.270  0 724  ALA   A N    1 ? 1 
ATOM   10348 C  CA   . ALA   A  1  669 ? -25.675 -1.170  -9.133  1.000 21.838  0 724  ALA   A CA   1 ? 1 
ATOM   10349 C  C    . ALA   A  1  669 ? -26.885 -1.167  -8.207  1.000 21.799  0 724  ALA   A C    1 ? 1 
ATOM   10350 O  O    . ALA   A  1  669 ? -27.304 -0.096  -7.725  1.000 19.028  0 724  ALA   A O    1 ? 1 
ATOM   10351 C  CB   . ALA   A  1  669 ? -26.123 -1.286  -10.583 1.000 21.023  0 724  ALA   A CB   1 ? 1 
ATOM   10352 H  H    . ALA   A  1  669 ? -24.529 -2.856  -9.397  1.000 23.506  0 724  ALA   A H    1 c 1 
ATOM   10353 H  HA   . ALA   A  1  669 ? -25.208 -0.308  -9.024  1.000 21.759  0 724  ALA   A HA   1 c 1 
ATOM   10354 H  HB1  . ALA   A  1  669 ? -26.733 -0.560  -10.795 1.000 21.761  0 724  ALA   A HB1  1 c 1 
ATOM   10355 H  HB2  . ALA   A  1  669 ? -25.348 -1.238  -11.168 1.000 21.031  0 724  ALA   A HB2  1 c 1 
ATOM   10356 H  HB3  . ALA   A  1  669 ? -26.576 -2.136  -10.717 1.000 21.629  0 724  ALA   A HB3  1 c 1 
ATOM   10357 N  N    . SER   A  1  670 ? -27.412 -2.371  -7.921  1.000 22.193  0 725  SER   A N    1 ? 1 
ATOM   10358 C  CA   . SER   A  1  670 ? -28.560 -2.482  -7.015  1.000 28.186  0 725  SER   A CA   1 ? 1 
ATOM   10359 C  C    . SER   A  1  670 ? -28.245 -2.036  -5.587  1.000 24.429  0 725  SER   A C    1 ? 1 
ATOM   10360 O  O    . SER   A  1  670 ? -29.088 -1.418  -4.930  1.000 29.099  0 725  SER   A O    1 ? 1 
ATOM   10361 C  CB   . SER   A  1  670 ? -29.147 -3.894  -6.968  1.000 25.199  0 725  SER   A CB   1 ? 1 
ATOM   10362 O  OG   . SER   A  1  670 ? -29.393 -4.355  -8.280  1.000 33.838  0 725  SER   A OG   1 ? 1 
ATOM   10363 H  H    . SER   A  1  670 ? -27.061 -3.128  -8.293  1.000 23.032  0 725  SER   A H    1 c 1 
ATOM   10364 H  HA   . SER   A  1  670 ? -29.267 -1.875  -7.365  1.000 26.105  0 725  SER   A HA   1 c 1 
ATOM   10365 H  HB2  . SER   A  1  670 ? -28.515 -4.498  -6.517  1.000 27.210  0 725  SER   A HB2  1 c 1 
ATOM   10366 H  HB3  . SER   A  1  670 ? -29.987 -3.885  -6.456  1.000 28.118  0 725  SER   A HB3  1 c 1 
ATOM   10367 H  HG   . SER   A  1  670 ? -28.699 -4.747  -8.566  0.000 19.530  0 725  SER   A HG   1 c 1 
ATOM   10368 N  N    . GLU   A  1  671 ? -27.013 -2.309  -5.148  1.000 24.412  0 726  GLU   A N    1 ? 1 
ATOM   10369 C  CA   . GLU   A  1  671 ? -26.599 -2.018  -3.778  1.000 23.150  0 726  GLU   A CA   1 ? 1 
ATOM   10370 C  C    . GLU   A  1  671 ? -26.191 -0.556  -3.596  1.000 24.470  0 726  GLU   A C    1 ? 1 
ATOM   10371 O  O    . GLU   A  1  671 ? -26.330 0.008   -2.521  1.000 28.670  0 726  GLU   A O    1 ? 1 
ATOM   10372 C  CB   . GLU   A  1  671 ? -25.432 -2.936  -3.375  1.000 23.542  0 726  GLU   A CB   1 ? 1 
ATOM   10373 C  CG   . GLU   A  1  671 ? -25.828 -4.406  -3.156  1.000 28.787  0 726  GLU   A CG   1 ? 1 
ATOM   10374 C  CD   . GLU   A  1  671 ? -24.659 -5.360  -2.935  1.000 29.157  0 726  GLU   A CD   1 ? 1 
ATOM   10375 O  OE1  . GLU   A  1  671 ? -23.542 -5.021  -3.360  1.000 30.989  0 726  GLU   A OE1  1 ? 1 
ATOM   10376 O  OE2  . GLU   A  1  671 ? -24.853 -6.443  -2.351  1.000 40.946  0 726  GLU   A OE2  1 ? 1 
ATOM   10377 H  H    . GLU   A  1  671 ? -26.409 -2.694  -5.716  1.000 23.705  0 726  GLU   A H    1 c 1 
ATOM   10378 H  HA   . GLU   A  1  671 ? -27.361 -2.204  -3.182  1.000 24.261  0 726  GLU   A HA   1 c 1 
ATOM   10379 H  HB2  . GLU   A  1  671 ? -24.749 -2.893  -4.076  1.000 23.939  0 726  GLU   A HB2  1 c 1 
ATOM   10380 H  HB3  . GLU   A  1  671 ? -25.035 -2.589  -2.549  1.000 24.061  0 726  GLU   A HB3  1 c 1 
ATOM   10381 H  HG2  . GLU   A  1  671 ? -26.420 -4.460  -2.376  1.000 28.042  0 726  GLU   A HG2  1 c 1 
ATOM   10382 H  HG3  . GLU   A  1  671 ? -26.337 -4.716  -3.934  1.000 27.945  0 726  GLU   A HG3  1 c 1 
ATOM   10383 N  N    . ARG   A  1  672 ? -25.635 0.050   -4.648  1.000 23.243  0 727  ARG   A N    1 ? 1 
ATOM   10384 C  CA   . ARG   A  1  672 ? -24.983 1.338   -4.512  1.000 24.249  0 727  ARG   A CA   1 ? 1 
ATOM   10385 C  C    . ARG   A  1  672 ? -25.783 2.499   -5.101  1.000 24.840  0 727  ARG   A C    1 ? 1 
ATOM   10386 O  O    . ARG   A  1  672 ? -25.337 3.636   -5.046  1.000 21.294  0 727  ARG   A O    1 ? 1 
ATOM   10387 C  CB   . ARG   A  1  672 ? -23.579 1.214   -5.107  1.000 26.266  0 727  ARG   A CB   1 ? 1 
ATOM   10388 C  CG   . ARG   A  1  672 ? -22.686 0.345   -4.215  1.000 27.350  0 727  ARG   A CG   1 ? 1 
ATOM   10389 C  CD   . ARG   A  1  672 ? -21.317 0.038   -4.814  1.000 25.114  0 727  ARG   A CD   1 ? 1 
ATOM   10390 N  NE   . ARG   A  1  672 ? -20.541 1.239   -5.085  1.000 27.079  0 727  ARG   A NE   1 ? 1 
ATOM   10391 C  CZ   . ARG   A  1  672 ? -19.318 1.227   -5.590  1.000 24.140  0 727  ARG   A CZ   1 ? 1 
ATOM   10392 N  NH1  . ARG   A  1  672 ? -18.719 0.094   -5.898  1.000 29.730  0 727  ARG   A NH1  1 ? 1 
ATOM   10393 N  NH2  . ARG   A  1  672 ? -18.684 2.377   -5.792  1.000 22.832  0 727  ARG   A NH2  1 ? 1 
ATOM   10394 H  H    . ARG   A  1  672 ? -25.661 -0.348  -5.470  1.000 23.794  0 727  ARG   A H    1 c 1 
ATOM   10395 H  HA   . ARG   A  1  672 ? -24.879 1.516   -3.550  1.000 24.425  0 727  ARG   A HA   1 c 1 
ATOM   10396 H  HB2  . ARG   A  1  672 ? -23.639 0.814   -5.999  1.000 25.922  0 727  ARG   A HB2  1 c 1 
ATOM   10397 H  HB3  . ARG   A  1  672 ? -23.184 2.107   -5.192  1.000 25.745  0 727  ARG   A HB3  1 c 1 
ATOM   10398 H  HG2  . ARG   A  1  672 ? -22.556 0.798   -3.357  1.000 26.627  0 727  ARG   A HG2  1 c 1 
ATOM   10399 H  HG3  . ARG   A  1  672 ? -23.144 -0.504  -4.035  1.000 26.785  0 727  ARG   A HG3  1 c 1 
ATOM   10400 H  HD2  . ARG   A  1  672 ? -20.816 -0.532  -4.192  1.000 25.817  0 727  ARG   A HD2  1 c 1 
ATOM   10401 H  HD3  . ARG   A  1  672 ? -21.436 -0.462  -5.649  1.000 26.079  0 727  ARG   A HD3  1 c 1 
ATOM   10402 H  HE   . ARG   A  1  672 ? -20.899 2.011   -4.900  1.000 26.087  0 727  ARG   A HE   1 c 1 
ATOM   10403 H  HH11 . ARG   A  1  672 ? -19.122 -0.488  -6.422  1.000 27.819  0 727  ARG   A HH11 1 c 1 
ATOM   10404 H  HH12 . ARG   A  1  672 ? -17.915 -0.077  -5.579  1.000 27.366  0 727  ARG   A HH12 1 c 1 
ATOM   10405 H  HH21 . ARG   A  1  672 ? -17.879 2.377   -6.144  1.000 22.938  0 727  ARG   A HH21 1 c 1 
ATOM   10406 H  HH22 . ARG   A  1  672 ? -19.070 3.136   -5.573  1.000 23.429  0 727  ARG   A HH22 1 c 1 
ATOM   10407 N  N    . ASN   A  1  673 ? -27.031 2.223   -5.507  1.000 22.019  0 728  ASN   A N    1 ? 1 
ATOM   10408 C  CA   . ASN   A  1  673 ? -27.893 3.201   -6.144  1.000 23.894  0 728  ASN   A CA   1 ? 1 
ATOM   10409 C  C    . ASN   A  1  673 ? -27.214 3.620   -7.445  1.000 22.743  0 728  ASN   A C    1 ? 1 
ATOM   10410 O  O    . ASN   A  1  673 ? -26.990 4.797   -7.699  1.000 24.172  0 728  ASN   A O    1 ? 1 
ATOM   10411 C  CB   . ASN   A  1  673 ? -28.229 4.360   -5.242  1.000 21.591  0 728  ASN   A CB   1 ? 1 
ATOM   10412 C  CG   . ASN   A  1  673 ? -29.367 5.200   -5.693  1.000 22.675  0 728  ASN   A CG   1 ? 1 
ATOM   10413 O  OD1  . ASN   A  1  673 ? -30.024 4.914   -6.680  1.000 23.748  0 728  ASN   A OD1  1 ? 1 
ATOM   10414 N  ND2  . ASN   A  1  673 ? -29.647 6.237   -4.941  1.000 24.675  0 728  ASN   A ND2  1 ? 1 
ATOM   10415 H  H    . ASN   A  1  673 ? -27.361 1.381   -5.376  1.000 23.215  0 728  ASN   A H    1 c 1 
ATOM   10416 H  HA   . ASN   A  1  673 ? -28.740 2.750   -6.371  1.000 23.434  0 728  ASN   A HA   1 c 1 
ATOM   10417 H  HB2  . ASN   A  1  673 ? -28.435 4.008   -4.352  1.000 22.252  0 728  ASN   A HB2  1 c 1 
ATOM   10418 H  HB3  . ASN   A  1  673 ? -27.437 4.929   -5.158  1.000 21.817  0 728  ASN   A HB3  1 c 1 
ATOM   10419 H  HD21 . ASN   A  1  673 ? -29.168 6.401   -4.216  1.000 23.807  0 728  ASN   A HD21 1 c 1 
ATOM   10420 H  HD22 . ASN   A  1  673 ? -30.316 6.773   -5.157  1.000 24.659  0 728  ASN   A HD22 1 c 1 
ATOM   10421 N  N    . GLY   A  1  674 ? -26.906 2.610   -8.266  1.000 23.414  0 729  GLY   A N    1 ? 1 
ATOM   10422 C  CA   . GLY   A  1  674 ? -26.226 2.808   -9.533  1.000 22.306  0 729  GLY   A CA   1 ? 1 
ATOM   10423 C  C    . GLY   A  1  674 ? -24.717 2.783   -9.364  1.000 20.899  0 729  GLY   A C    1 ? 1 
ATOM   10424 O  O    . GLY   A  1  674 ? -24.189 3.077   -8.292  1.000 21.271  0 729  GLY   A O    1 ? 1 
ATOM   10425 H  H    . GLY   A  1  674 ? -27.138 1.759   -8.027  1.000 23.025  0 729  GLY   A H    1 c 1 
ATOM   10426 H  HA2  . GLY   A  1  674 ? -26.500 2.092   -10.156 1.000 22.616  0 729  GLY   A HA2  1 c 1 
ATOM   10427 H  HA3  . GLY   A  1  674 ? -26.501 3.676   -9.920  1.000 22.796  0 729  GLY   A HA3  1 c 1 
ATOM   10428 N  N    . VAL   A  1  675 ? -24.033 2.409   -10.445 1.000 23.603  0 730  VAL   A N    1 ? 1 
ATOM   10429 C  CA   . VAL   A  1  675 ? -22.585 2.460   -10.511 1.000 19.602  0 730  VAL   A CA   1 ? 1 
ATOM   10430 C  C    . VAL   A  1  675 ? -22.152 2.933   -11.892 1.000 21.897  0 730  VAL   A C    1 ? 1 
ATOM   10431 O  O    . VAL   A  1  675 ? -22.791 2.603   -12.898 1.000 23.798  0 730  VAL   A O    1 ? 1 
ATOM   10432 C  CB   . VAL   A  1  675 ? -21.855 1.114   -10.184 1.000 18.222  0 730  VAL   A CB   1 ? 1 
ATOM   10433 C  CG1  . VAL   A  1  675 ? -22.027 0.705   -8.704  1.000 17.981  0 730  VAL   A CG1  1 ? 1 
ATOM   10434 C  CG2  . VAL   A  1  675 ? -22.276 -0.015  -11.167 1.000 21.189  0 730  VAL   A CG2  1 ? 1 
ATOM   10435 H  H    . VAL   A  1  675 ? -24.491 2.107   -11.176 1.000 22.345  0 730  VAL   A H    1 c 1 
ATOM   10436 H  HA   . VAL   A  1  675 ? -22.285 3.123   -9.864  1.000 20.247  0 730  VAL   A HA   1 c 1 
ATOM   10437 H  HB   . VAL   A  1  675 ? -20.890 1.276   -10.328 1.000 18.440  0 730  VAL   A HB   1 c 1 
ATOM   10438 H  HG11 . VAL   A  1  675 ? -22.972 0.581   -8.509  1.000 18.443  0 730  VAL   A HG11 1 c 1 
ATOM   10439 H  HG12 . VAL   A  1  675 ? -21.667 1.403   -8.130  1.000 17.832  0 730  VAL   A HG12 1 c 1 
ATOM   10440 H  HG13 . VAL   A  1  675 ? -21.551 -0.128  -8.539  1.000 17.742  0 730  VAL   A HG13 1 c 1 
ATOM   10441 H  HG21 . VAL   A  1  675 ? -21.926 -0.866  -10.852 1.000 20.103  0 730  VAL   A HG21 1 c 1 
ATOM   10442 H  HG22 . VAL   A  1  675 ? -21.920 0.173   -12.053 1.000 20.340  0 730  VAL   A HG22 1 c 1 
ATOM   10443 H  HG23 . VAL   A  1  675 ? -23.247 -0.062  -11.212 1.000 20.815  0 730  VAL   A HG23 1 c 1 
ATOM   10444 N  N    . ASN   A  1  676 ? -21.030 3.656   -11.911 1.000 20.589  0 731  ASN   A N    1 ? 1 
ATOM   10445 C  CA   . ASN   A  1  676 ? -20.247 3.885   -13.111 1.000 23.509  0 731  ASN   A CA   1 ? 1 
ATOM   10446 C  C    . ASN   A  1  676 ? -19.093 2.897   -13.068 1.000 24.419  0 731  ASN   A C    1 ? 1 
ATOM   10447 O  O    . ASN   A  1  676 ? -18.418 2.751   -12.050 1.000 20.200  0 731  ASN   A O    1 ? 1 
ATOM   10448 C  CB   . ASN   A  1  676 ? -19.727 5.346   -13.172 1.000 23.613  0 731  ASN   A CB   1 ? 1 
ATOM   10449 C  CG   . ASN   A  1  676 ? -18.799 5.607   -14.319 1.000 25.941  0 731  ASN   A CG   1 ? 1 
ATOM   10450 O  OD1  . ASN   A  1  676 ? -17.529 5.582   -14.189 1.000 23.121  0 731  ASN   A OD1  1 ? 1 
ATOM   10451 N  ND2  . ASN   A  1  676 ? -19.386 5.818   -15.488 1.000 20.798  0 731  ASN   A ND2  1 ? 1 
ATOM   10452 H  H    . ASN   A  1  676 ? -20.737 4.029   -11.129 1.000 21.186  0 731  ASN   A H    1 c 1 
ATOM   10453 H  HA   . ASN   A  1  676 ? -20.805 3.714   -13.904 1.000 23.440  0 731  ASN   A HA   1 c 1 
ATOM   10454 H  HB2  . ASN   A  1  676 ? -20.495 5.949   -13.242 1.000 24.546  0 731  ASN   A HB2  1 c 1 
ATOM   10455 H  HB3  . ASN   A  1  676 ? -19.261 5.549   -12.335 1.000 23.798  0 731  ASN   A HB3  1 c 1 
ATOM   10456 H  HD21 . ASN   A  1  676 ? -20.247 5.645   -15.590 1.000 22.688  0 731  ASN   A HD21 1 c 1 
ATOM   10457 H  HD22 . ASN   A  1  676 ? -18.915 6.131   -16.169 1.000 22.355  0 731  ASN   A HD22 1 c 1 
ATOM   10458 N  N    . VAL   A  1  677 ? -18.842 2.283   -14.216 1.000 19.720  0 732  VAL   A N    1 ? 1 
ATOM   10459 C  CA   . VAL   A  1  677 ? -17.815 1.269   -14.382 1.000 19.497  0 732  VAL   A CA   1 ? 1 
ATOM   10460 C  C    . VAL   A  1  677 ? -16.855 1.732   -15.480 1.000 22.807  0 732  VAL   A C    1 ? 1 
ATOM   10461 O  O    . VAL   A  1  677 ? -17.304 2.167   -16.537 1.000 20.137  0 732  VAL   A O    1 ? 1 
ATOM   10462 C  CB   . VAL   A  1  677 ? -18.461 -0.079  -14.774 1.000 18.239  0 732  VAL   A CB   1 ? 1 
ATOM   10463 C  CG1  . VAL   A  1  677 ? -17.431 -1.145  -15.022 1.000 18.994  0 732  VAL   A CG1  1 ? 1 
ATOM   10464 C  CG2  . VAL   A  1  677 ? -19.478 -0.505  -13.735 1.000 20.265  0 732  VAL   A CG2  1 ? 1 
ATOM   10465 H  H    . VAL   A  1  677 ? -19.340 2.510   -14.949 1.000 21.167  0 732  VAL   A H    1 c 1 
ATOM   10466 H  HA   . VAL   A  1  677 ? -17.329 1.162   -13.549 1.000 19.398  0 732  VAL   A HA   1 c 1 
ATOM   10467 H  HB   . VAL   A  1  677 ? -18.947 0.067   -15.623 1.000 19.427  0 732  VAL   A HB   1 c 1 
ATOM   10468 H  HG11 . VAL   A  1  677 ? -16.802 -1.168  -14.279 1.000 18.283  0 732  VAL   A HG11 1 c 1 
ATOM   10469 H  HG12 . VAL   A  1  677 ? -16.952 -0.951  -15.846 1.000 18.706  0 732  VAL   A HG12 1 c 1 
ATOM   10470 H  HG13 . VAL   A  1  677 ? -17.870 -2.010  -15.100 1.000 18.823  0 732  VAL   A HG13 1 c 1 
ATOM   10471 H  HG21 . VAL   A  1  677 ? -19.810 -1.394  -13.950 1.000 19.821  0 732  VAL   A HG21 1 c 1 
ATOM   10472 H  HG22 . VAL   A  1  677 ? -20.220 0.124   -13.728 1.000 19.998  0 732  VAL   A HG22 1 c 1 
ATOM   10473 H  HG23 . VAL   A  1  677 ? -19.058 -0.521  -12.857 1.000 19.341  0 732  VAL   A HG23 1 c 1 
ATOM   10474 N  N    . ILE   A  1  678 ? -15.547 1.624   -15.212 1.000 19.482  0 733  ILE   A N    1 ? 1 
ATOM   10475 C  CA   . ILE   A  1  678 ? -14.519 1.777   -16.217 1.000 16.751  0 733  ILE   A CA   1 ? 1 
ATOM   10476 C  C    . ILE   A  1  678 ? -13.695 0.504   -16.180 1.000 14.805  0 733  ILE   A C    1 ? 1 
ATOM   10477 O  O    . ILE   A  1  678 ? -13.158 0.141   -15.141 1.000 16.056  0 733  ILE   A O    1 ? 1 
ATOM   10478 C  CB   . ILE   A  1  678 ? -13.672 3.039   -16.014 1.000 20.621  0 733  ILE   A CB   1 ? 1 
ATOM   10479 C  CG1  . ILE   A  1  678 ? -14.532 4.244   -15.892 1.000 26.148  0 733  ILE   A CG1  1 ? 1 
ATOM   10480 C  CG2  . ILE   A  1  678 ? -12.660 3.215   -17.160 1.000 21.895  0 733  ILE   A CG2  1 ? 1 
ATOM   10481 C  CD1  . ILE   A  1  678 ? -13.702 5.580   -15.525 1.000 36.510  0 733  ILE   A CD1  1 ? 1 
ATOM   10482 H  H    . ILE   A  1  678 ? -15.288 1.448   -14.353 1.000 19.059  0 733  ILE   A H    1 c 1 
ATOM   10483 H  HA   . ILE   A  1  678 ? -14.948 1.841   -17.084 1.000 17.917  0 733  ILE   A HA   1 c 1 
ATOM   10484 H  HB   . ILE   A  1  678 ? -13.168 2.936   -15.169 1.000 20.416  0 733  ILE   A HB   1 c 1 
ATOM   10485 H  HG12 . ILE   A  1  678 ? -15.004 4.385   -16.740 1.000 26.848  0 733  ILE   A HG12 1 c 1 
ATOM   10486 H  HG13 . ILE   A  1  678 ? -15.203 4.089   -15.193 1.000 26.421  0 733  ILE   A HG13 1 c 1 
ATOM   10487 H  HG21 . ILE   A  1  678 ? -13.135 3.383   -17.992 1.000 21.923  0 733  ILE   A HG21 1 c 1 
ATOM   10488 H  HG22 . ILE   A  1  678 ? -12.125 2.408   -17.253 1.000 21.335  0 733  ILE   A HG22 1 c 1 
ATOM   10489 H  HG23 . ILE   A  1  678 ? -12.073 3.966   -16.967 1.000 21.537  0 733  ILE   A HG23 1 c 1 
ATOM   10490 H  HD11 . ILE   A  1  678 ? -13.184 5.866   -16.298 1.000 32.980  0 733  ILE   A HD11 1 c 1 
ATOM   10491 H  HD12 . ILE   A  1  678 ? -13.101 5.397   -14.783 1.000 32.644  0 733  ILE   A HD12 1 c 1 
ATOM   10492 H  HD13 . ILE   A  1  678 ? -14.321 6.288   -15.273 1.000 33.246  0 733  ILE   A HD13 1 c 1 
ATOM   10493 N  N    . SER   A  1  679 ? -13.587 -0.151  -17.330 1.000 16.925  0 734  SER   A N    1 ? 1 
ATOM   10494 C  CA   . SER   A  1  679 ? -12.876 -1.407  -17.431 1.000 16.635  0 734  SER   A CA   1 ? 1 
ATOM   10495 C  C    . SER   A  1  679 ? -11.875 -1.321  -18.574 1.000 17.256  0 734  SER   A C    1 ? 1 
ATOM   10496 O  O    . SER   A  1  679 ? -12.039 -0.557  -19.517 1.000 18.631  0 734  SER   A O    1 ? 1 
ATOM   10497 C  CB   . SER   A  1  679 ? -13.841 -2.548  -17.679 1.000 16.059  0 734  SER   A CB   1 ? 1 
ATOM   10498 O  OG   . SER   A  1  679 ? -14.900 -2.477  -16.741 1.000 18.087  0 734  SER   A OG   1 ? 1 
ATOM   10499 H  H    . SER   A  1  679 ? -13.969 0.198   -18.083 1.000 16.758  0 734  SER   A H    1 c 1 
ATOM   10500 H  HA   . SER   A  1  679 ? -12.386 -1.570  -16.585 1.000 16.266  0 734  SER   A HA   1 c 1 
ATOM   10501 H  HB2  . SER   A  1  679 ? -14.201 -2.487  -18.593 1.000 17.062  0 734  SER   A HB2  1 c 1 
ATOM   10502 H  HB3  . SER   A  1  679 ? -13.370 -3.406  -17.586 1.000 16.623  0 734  SER   A HB3  1 c 1 
ATOM   10503 H  HG   . SER   A  1  679 ? -15.520 -1.991  -17.056 0.000 9.580   0 734  SER   A HG   1 c 1 
ATOM   10504 N  N    . GLY   A  1  680 ? -10.816 -2.105  -18.480 1.000 16.832  0 735  GLY   A N    1 ? 1 
ATOM   10505 C  CA   . GLY   A  1  680 ? -9.848  -2.104  -19.545 1.000 20.149  0 735  GLY   A CA   1 ? 1 
ATOM   10506 C  C    . GLY   A  1  680 ? -8.759  -3.121  -19.289 1.000 16.409  0 735  GLY   A C    1 ? 1 
ATOM   10507 O  O    . GLY   A  1  680 ? -8.735  -3.790  -18.257 1.000 15.597  0 735  GLY   A O    1 ? 1 
ATOM   10508 H  H    . GLY   A  1  680 ? -10.693 -2.645  -17.753 1.000 17.261  0 735  GLY   A H    1 c 1 
ATOM   10509 H  HA2  . GLY   A  1  680 ? -10.307 -2.318  -20.397 1.000 18.783  0 735  GLY   A HA2  1 c 1 
ATOM   10510 H  HA3  . GLY   A  1  680 ? -9.450  -1.201  -19.622 1.000 18.407  0 735  GLY   A HA3  1 c 1 
ATOM   10511 N  N    . PRO   A  1  681 ? -7.853  -3.243  -20.270 1.000 14.318  0 736  PRO   A N    1 ? 1 
ATOM   10512 C  CA   . PRO   A  1  681 ? -6.751  -4.171  -20.204 1.000 17.025  0 736  PRO   A CA   1 ? 1 
ATOM   10513 C  C    . PRO   A  1  681 ? -5.573  -3.555  -19.447 1.000 19.481  0 736  PRO   A C    1 ? 1 
ATOM   10514 O  O    . PRO   A  1  681 ? -5.359  -2.341  -19.500 1.000 21.256  0 736  PRO   A O    1 ? 1 
ATOM   10515 C  CB   . PRO   A  1  681 ? -6.433  -4.346  -21.669 1.000 15.996  0 736  PRO   A CB   1 ? 1 
ATOM   10516 C  CG   . PRO   A  1  681 ? -6.668  -2.936  -22.267 1.000 15.844  0 736  PRO   A CG   1 ? 1 
ATOM   10517 C  CD   . PRO   A  1  681 ? -7.857  -2.446  -21.506 1.000 16.714  0 736  PRO   A CD   1 ? 1 
ATOM   10518 H  HA   . PRO   A  1  681 ? -7.037  -5.029  -19.801 1.000 16.494  0 736  PRO   A HA   1 c 1 
ATOM   10519 H  HB2  . PRO   A  1  681 ? -5.503  -4.631  -21.798 1.000 16.253  0 736  PRO   A HB2  1 c 1 
ATOM   10520 H  HB3  . PRO   A  1  681 ? -7.029  -5.006  -22.083 1.000 16.472  0 736  PRO   A HB3  1 c 1 
ATOM   10521 H  HG2  . PRO   A  1  681 ? -5.892  -2.356  -22.122 1.000 16.076  0 736  PRO   A HG2  1 c 1 
ATOM   10522 H  HG3  . PRO   A  1  681 ? -6.858  -2.987  -23.225 1.000 16.559  0 736  PRO   A HG3  1 c 1 
ATOM   10523 H  HD2  . PRO   A  1  681 ? -7.776  -1.495  -21.307 1.000 15.971  0 736  PRO   A HD2  1 c 1 
ATOM   10524 H  HD3  . PRO   A  1  681 ? -8.677  -2.594  -22.011 1.000 16.324  0 736  PRO   A HD3  1 c 1 
ATOM   10525 N  N    . ILE   A  1  682 ? -4.774  -4.425  -18.825 1.000 18.096  0 737  ILE   A N    1 ? 1 
ATOM   10526 C  CA   . ILE   A  1  682 ? -3.453  -4.058  -18.340 1.000 18.635  0 737  ILE   A CA   1 ? 1 
ATOM   10527 C  C    . ILE   A  1  682 ? -2.407  -5.010  -18.903 1.000 16.570  0 737  ILE   A C    1 ? 1 
ATOM   10528 O  O    . ILE   A  1  682 ? -2.653  -6.214  -19.025 1.000 16.546  0 737  ILE   A O    1 ? 1 
ATOM   10529 C  CB   . ILE   A  1  682 ? -3.476  -4.037  -16.802 1.000 16.242  0 737  ILE   A CB   1 ? 1 
ATOM   10530 C  CG1  . ILE   A  1  682 ? -4.022  -2.717  -16.292 1.000 16.116  0 737  ILE   A CG1  1 ? 1 
ATOM   10531 C  CG2  . ILE   A  1  682 ? -2.066  -4.317  -16.262 1.000 19.551  0 737  ILE   A CG2  1 ? 1 
ATOM   10532 C  CD1  . ILE   A  1  682 ? -4.615  -2.782  -15.025 1.000 16.025  0 737  ILE   A CD1  1 ? 1 
ATOM   10533 H  H    . ILE   A  1  682 ? -5.064  -5.282  -18.696 1.000 18.522  0 737  ILE   A H    1 c 1 
ATOM   10534 H  HA   . ILE   A  1  682 ? -3.248  -3.159  -18.653 1.000 17.696  0 737  ILE   A HA   1 c 1 
ATOM   10535 H  HB   . ILE   A  1  682 ? -4.077  -4.758  -16.495 1.000 17.122  0 737  ILE   A HB   1 c 1 
ATOM   10536 H  HG12 . ILE   A  1  682 ? -3.288  -2.066  -16.260 1.000 16.148  0 737  ILE   A HG12 1 c 1 
ATOM   10537 H  HG13 . ILE   A  1  682 ? -4.688  -2.385  -16.930 1.000 16.404  0 737  ILE   A HG13 1 c 1 
ATOM   10538 H  HG21 . ILE   A  1  682 ? -1.426  -3.720  -16.688 1.000 18.477  0 737  ILE   A HG21 1 c 1 
ATOM   10539 H  HG22 . ILE   A  1  682 ? -1.820  -5.241  -16.445 1.000 18.516  0 737  ILE   A HG22 1 c 1 
ATOM   10540 H  HG23 . ILE   A  1  682 ? -2.052  -4.168  -15.301 1.000 18.149  0 737  ILE   A HG23 1 c 1 
ATOM   10541 H  HD11 . ILE   A  1  682 ? -3.942  -3.012  -14.361 1.000 15.771  0 737  ILE   A HD11 1 c 1 
ATOM   10542 H  HD12 . ILE   A  1  682 ? -5.312  -3.462  -15.026 1.000 16.025  0 737  ILE   A HD12 1 c 1 
ATOM   10543 H  HD13 . ILE   A  1  682 ? -5.006  -1.919  -14.803 1.000 15.913  0 737  ILE   A HD13 1 c 1 
ATOM   10544 N  N    . PHE   A  1  683 ? -1.233  -4.448  -19.212 1.000 14.967  0 738  PHE   A N    1 ? 1 
ATOM   10545 C  CA   . PHE   A  1  683 ? -0.097  -5.216  -19.691 1.000 13.907  0 738  PHE   A CA   1 ? 1 
ATOM   10546 C  C    . PHE   A  1  683 ? 1.067   -4.931  -18.745 1.000 16.776  0 738  PHE   A C    1 ? 1 
ATOM   10547 O  O    . PHE   A  1  683 ? 1.551   -3.801  -18.754 1.000 20.575  0 738  PHE   A O    1 ? 1 
ATOM   10548 C  CB   . PHE   A  1  683 ? 0.322   -4.846  -21.113 1.000 14.610  0 738  PHE   A CB   1 ? 1 
ATOM   10549 C  CG   . PHE   A  1  683 ? -0.804  -4.911  -22.076 1.000 19.622  0 738  PHE   A CG   1 ? 1 
ATOM   10550 C  CD1  . PHE   A  1  683 ? -1.629  -3.799  -22.283 1.000 24.299  0 738  PHE   A CD1  1 ? 1 
ATOM   10551 C  CD2  . PHE   A  1  683 ? -1.040  -6.069  -22.810 1.000 21.661  0 738  PHE   A CD2  1 ? 1 
ATOM   10552 C  CE1  . PHE   A  1  683 ? -2.698  -3.853  -23.201 1.000 19.853  0 738  PHE   A CE1  1 ? 1 
ATOM   10553 C  CE2  . PHE   A  1  683 ? -2.102  -6.117  -23.738 1.000 23.777  0 738  PHE   A CE2  1 ? 1 
ATOM   10554 C  CZ   . PHE   A  1  683 ? -2.925  -5.009  -23.907 1.000 19.984  0 738  PHE   A CZ   1 ? 1 
ATOM   10555 H  H    . PHE   A  1  683 ? -1.136  -3.544  -19.119 1.000 14.990  0 738  PHE   A H    1 c 1 
ATOM   10556 H  HA   . PHE   A  1  683 ? -0.314  -6.182  -19.657 1.000 14.804  0 738  PHE   A HA   1 c 1 
ATOM   10557 H  HB2  . PHE   A  1  683 ? 0.688   -3.937  -21.109 1.000 15.487  0 738  PHE   A HB2  1 c 1 
ATOM   10558 H  HB3  . PHE   A  1  683 ? 1.030   -5.458  -21.402 1.000 15.703  0 738  PHE   A HB3  1 c 1 
ATOM   10559 H  HD1  . PHE   A  1  683 ? -1.478  -3.009  -21.789 1.000 21.619  0 738  PHE   A HD1  1 c 1 
ATOM   10560 H  HD2  . PHE   A  1  683 ? -0.485  -6.823  -22.688 1.000 21.614  0 738  PHE   A HD2  1 c 1 
ATOM   10561 H  HE1  . PHE   A  1  683 ? -3.255  -3.102  -23.326 1.000 20.789  0 738  PHE   A HE1  1 c 1 
ATOM   10562 H  HE2  . PHE   A  1  683 ? -2.267  -6.907  -24.227 1.000 22.612  0 738  PHE   A HE2  1 c 1 
ATOM   10563 H  HZ   . PHE   A  1  683 ? -3.634  -5.045  -24.529 1.000 21.097  0 738  PHE   A HZ   1 c 1 
ATOM   10564 N  N    . ASP   A  1  684 ? 1.503   -5.954  -17.990 1.000 18.103  0 739  ASP   A N    1 ? 1 
ATOM   10565 C  CA   . ASP   A  1  684 ? 2.641   -5.832  -17.099 1.000 19.153  0 739  ASP   A CA   1 ? 1 
ATOM   10566 C  C    . ASP   A  1  684 ? 3.407   -7.153  -17.082 1.000 21.355  0 739  ASP   A C    1 ? 1 
ATOM   10567 O  O    . ASP   A  1  684 ? 3.500   -7.827  -16.044 1.000 18.512  0 739  ASP   A O    1 ? 1 
ATOM   10568 C  CB   . ASP   A  1  684 ? 2.215   -5.390  -15.721 1.000 17.331  0 739  ASP   A CB   1 ? 1 
ATOM   10569 C  CG   . ASP   A  1  684 ? 3.411   -4.991  -14.840 1.000 22.403  0 739  ASP   A CG   1 ? 1 
ATOM   10570 O  OD1  . ASP   A  1  684 ? 4.467   -4.575  -15.408 1.000 16.382  0 739  ASP   A OD1  1 ? 1 
ATOM   10571 O  OD2  . ASP   A  1  684 ? 3.300   -5.120  -13.608 1.000 13.740  0 739  ASP   A OD2  1 ? 1 
ATOM   10572 H  H    . ASP   A  1  684 ? 1.065   -6.755  -18.031 1.000 18.037  0 739  ASP   A H    1 c 1 
ATOM   10573 H  HA   . ASP   A  1  684 ? 3.235   -5.142  -17.463 1.000 19.116  0 739  ASP   A HA   1 c 1 
ATOM   10574 H  HB2  . ASP   A  1  684 ? 1.616   -4.620  -15.801 1.000 18.570  0 739  ASP   A HB2  1 c 1 
ATOM   10575 H  HB3  . ASP   A  1  684 ? 1.726   -6.115  -15.280 1.000 18.563  0 739  ASP   A HB3  1 c 1 
ATOM   10576 N  N    . TYR   A  1  685 ? 3.997   -7.451  -18.254 1.000 19.952  0 740  TYR   A N    1 ? 1 
ATOM   10577 C  CA   . TYR   A  1  685 ? 4.790   -8.642  -18.479 1.000 20.466  0 740  TYR   A CA   1 ? 1 
ATOM   10578 C  C    . TYR   A  1  685 ? 6.060   -8.647  -17.629 1.000 25.737  0 740  TYR   A C    1 ? 1 
ATOM   10579 O  O    . TYR   A  1  685 ? 6.465   -9.738  -17.260 1.000 21.274  0 740  TYR   A O    1 ? 1 
ATOM   10580 C  CB   . TYR   A  1  685 ? 5.104   -8.849  -19.985 1.000 25.030  0 740  TYR   A CB   1 ? 1 
ATOM   10581 C  CG   . TYR   A  1  685 ? 3.937   -9.490  -20.743 1.000 22.440  0 740  TYR   A CG   1 ? 1 
ATOM   10582 C  CD1  . TYR   A  1  685 ? 3.764   -10.871 -20.760 1.000 20.037  0 740  TYR   A CD1  1 ? 1 
ATOM   10583 C  CD2  . TYR   A  1  685 ? 2.959   -8.708  -21.346 1.000 22.265  0 740  TYR   A CD2  1 ? 1 
ATOM   10584 C  CE1  . TYR   A  1  685 ? 2.693   -11.458 -21.424 1.000 22.124  0 740  TYR   A CE1  1 ? 1 
ATOM   10585 C  CE2  . TYR   A  1  685 ? 1.874   -9.283  -21.992 1.000 25.436  0 740  TYR   A CE2  1 ? 1 
ATOM   10586 C  CZ   . TYR   A  1  685 ? 1.745   -10.663 -22.036 1.000 26.026  0 740  TYR   A CZ   1 ? 1 
ATOM   10587 O  OH   . TYR   A  1  685 ? 0.640   -11.238 -22.640 1.000 23.059  0 740  TYR   A OH   1 ? 1 
ATOM   10588 H  H    . TYR   A  1  685 ? 3.884   -6.873  -18.952 1.000 20.593  0 740  TYR   A H    1 c 1 
ATOM   10589 H  HA   . TYR   A  1  685 ? 4.244   -9.415  -18.185 1.000 21.901  0 740  TYR   A HA   1 c 1 
ATOM   10590 H  HB2  . TYR   A  1  685 ? 5.313   -7.981  -20.387 1.000 23.439  0 740  TYR   A HB2  1 c 1 
ATOM   10591 H  HB3  . TYR   A  1  685 ? 5.896   -9.421  -20.068 1.000 23.689  0 740  TYR   A HB3  1 c 1 
ATOM   10592 H  HD1  . TYR   A  1  685 ? 4.412   -11.422 -20.352 1.000 21.182  0 740  TYR   A HD1  1 c 1 
ATOM   10593 H  HD2  . TYR   A  1  685 ? 3.038   -7.769  -21.325 1.000 22.799  0 740  TYR   A HD2  1 c 1 
ATOM   10594 H  HE1  . TYR   A  1  685 ? 2.597   -12.397 -21.432 1.000 22.664  0 740  TYR   A HE1  1 c 1 
ATOM   10595 H  HE2  . TYR   A  1  685 ? 1.225   -8.738  -22.402 1.000 24.735  0 740  TYR   A HE2  1 c 1 
ATOM   10596 H  HH   . TYR   A  1  685 ? 0.559   -12.095 -22.638 0.000 13.310  0 740  TYR   A HH   1 c 1 
ATOM   10597 N  N    . ASN   A  1  686 ? 6.665   -7.474  -17.328 1.000 17.087  0 741  ASN   A N    1 ? 1 
ATOM   10598 C  CA   . ASN   A  1  686 ? 7.828   -7.422  -16.443 1.000 22.766  0 741  ASN   A CA   1 ? 1 
ATOM   10599 C  C    . ASN   A  1  686 ? 7.512   -7.170  -14.966 1.000 23.596  0 741  ASN   A C    1 ? 1 
ATOM   10600 O  O    . ASN   A  1  686 ? 8.420   -6.891  -14.193 1.000 26.407  0 741  ASN   A O    1 ? 1 
ATOM   10601 C  CB   . ASN   A  1  686 ? 8.826   -6.396  -16.922 1.000 22.027  0 741  ASN   A CB   1 ? 1 
ATOM   10602 C  CG   . ASN   A  1  686 ? 8.269   -4.997  -16.941 1.000 22.443  0 741  ASN   A CG   1 ? 1 
ATOM   10603 O  OD1  . ASN   A  1  686 ? 7.073   -4.727  -16.675 1.000 24.050  0 741  ASN   A OD1  1 ? 1 
ATOM   10604 N  ND2  . ASN   A  1  686 ? 9.117   -4.080  -17.256 1.000 27.717  0 741  ASN   A ND2  1 ? 1 
ATOM   10605 H  H    . ASN   A  1  686 ? 6.344   -6.697  -17.685 1.000 19.858  0 741  ASN   A H    1 c 1 
ATOM   10606 H  HA   . ASN   A  1  686 ? 8.279   -8.297  -16.501 1.000 21.728  0 741  ASN   A HA   1 c 1 
ATOM   10607 H  HB2  . ASN   A  1  686 ? 9.612   -6.419  -16.340 1.000 22.477  0 741  ASN   A HB2  1 c 1 
ATOM   10608 H  HB3  . ASN   A  1  686 ? 9.114   -6.636  -17.827 1.000 22.802  0 741  ASN   A HB3  1 c 1 
ATOM   10609 H  HD21 . ASN   A  1  686 ? 9.953   -4.295  -17.446 1.000 26.268  0 741  ASN   A HD21 1 c 1 
ATOM   10610 H  HD22 . ASN   A  1  686 ? 8.863   -3.233  -17.283 1.000 25.879  0 741  ASN   A HD22 1 c 1 
ATOM   10611 N  N    . TYR   A  1  687 ? 6.231   -7.307  -14.577 1.000 20.465  0 742  TYR   A N    1 ? 1 
ATOM   10612 C  CA   . TYR   A  1  687 ? 5.749   -7.196  -13.204 1.000 22.949  0 742  TYR   A CA   1 ? 1 
ATOM   10613 C  C    . TYR   A  1  687 ? 6.411   -6.109  -12.358 1.000 21.613  0 742  TYR   A C    1 ? 1 
ATOM   10614 O  O    . TYR   A  1  687 ? 6.844   -6.355  -11.253 1.000 21.165  0 742  TYR   A O    1 ? 1 
ATOM   10615 C  CB   . TYR   A  1  687 ? 5.831   -8.564  -12.485 1.000 23.483  0 742  TYR   A CB   1 ? 1 
ATOM   10616 C  CG   . TYR   A  1  687 ? 7.154   -9.297  -12.533 1.000 22.443  0 742  TYR   A CG   1 ? 1 
ATOM   10617 C  CD1  . TYR   A  1  687 ? 8.134   -9.084  -11.552 1.000 24.828  0 742  TYR   A CD1  1 ? 1 
ATOM   10618 C  CD2  . TYR   A  1  687 ? 7.419   -10.236 -13.537 1.000 25.215  0 742  TYR   A CD2  1 ? 1 
ATOM   10619 C  CE1  . TYR   A  1  687 ? 9.335   -9.774  -11.583 1.000 22.458  0 742  TYR   A CE1  1 ? 1 
ATOM   10620 C  CE2  . TYR   A  1  687 ? 8.628   -10.906 -13.595 1.000 23.597  0 742  TYR   A CE2  1 ? 1 
ATOM   10621 C  CZ   . TYR   A  1  687 ? 9.579   -10.673 -12.613 1.000 25.049  0 742  TYR   A CZ   1 ? 1 
ATOM   10622 O  OH   . TYR   A  1  687 ? 10.740  -11.344 -12.649 1.000 27.348  0 742  TYR   A OH   1 ? 1 
ATOM   10623 H  H    . TYR   A  1  687 ? 5.609   -7.480  -15.224 1.000 21.760  0 742  TYR   A H    1 c 1 
ATOM   10624 H  HA   . TYR   A  1  687 ? 4.791   -6.964  -13.259 1.000 21.958  0 742  TYR   A HA   1 c 1 
ATOM   10625 H  HB2  . TYR   A  1  687 ? 5.590   -8.427  -11.545 1.000 22.752  0 742  TYR   A HB2  1 c 1 
ATOM   10626 H  HB3  . TYR   A  1  687 ? 5.147   -9.146  -12.876 1.000 23.090  0 742  TYR   A HB3  1 c 1 
ATOM   10627 H  HD1  . TYR   A  1  687 ? 7.970   -8.473  -10.854 1.000 23.283  0 742  TYR   A HD1  1 c 1 
ATOM   10628 H  HD2  . TYR   A  1  687 ? 6.776   -10.386 -14.211 1.000 24.226  0 742  TYR   A HD2  1 c 1 
ATOM   10629 H  HE1  . TYR   A  1  687 ? 9.992   -9.618  -10.925 1.000 23.585  0 742  TYR   A HE1  1 c 1 
ATOM   10630 H  HE2  . TYR   A  1  687 ? 8.796   -11.531 -14.281 1.000 24.745  0 742  TYR   A HE2  1 c 1 
ATOM   10631 H  HH   . TYR   A  1  687 ? 11.337  -11.221 -12.030 0.000 19.080  0 742  TYR   A HH   1 c 1 
ATOM   10632 N  N    . ASP   A  1  688 ? 6.472   -4.896  -12.902 1.000 25.098  0 743  ASP   A N    1 ? 1 
ATOM   10633 C  CA   . ASP   A  1  688 ? 7.098   -3.784  -12.214 1.000 23.054  0 743  ASP   A CA   1 ? 1 
ATOM   10634 C  C    . ASP   A  1  688 ? 6.009   -2.820  -11.748 1.000 23.478  0 743  ASP   A C    1 ? 1 
ATOM   10635 O  O    . ASP   A  1  688 ? 6.283   -1.754  -11.191 1.000 19.121  0 743  ASP   A O    1 ? 1 
ATOM   10636 C  CB   . ASP   A  1  688 ? 8.186   -3.156  -13.124 1.000 21.003  0 743  ASP   A CB   1 ? 1 
ATOM   10637 C  CG   . ASP   A  1  688 ? 7.617   -2.507  -14.375 1.000 22.873  0 743  ASP   A CG   1 ? 1 
ATOM   10638 O  OD1  . ASP   A  1  688 ? 6.378   -2.610  -14.586 1.000 18.723  0 743  ASP   A OD1  1 ? 1 
ATOM   10639 O  OD2  . ASP   A  1  688 ? 8.395   -1.854  -15.107 1.000 21.937  0 743  ASP   A OD2  1 ? 1 
ATOM   10640 H  H    . ASP   A  1  688 ? 6.123   -4.760  -13.736 1.000 23.827  0 743  ASP   A H    1 c 1 
ATOM   10641 H  HA   . ASP   A  1  688 ? 7.552   -4.136  -11.414 1.000 22.938  0 743  ASP   A HA   1 c 1 
ATOM   10642 H  HB2  . ASP   A  1  688 ? 8.676   -2.476  -12.618 1.000 21.868  0 743  ASP   A HB2  1 c 1 
ATOM   10643 H  HB3  . ASP   A  1  688 ? 8.819   -3.852  -13.396 1.000 22.170  0 743  ASP   A HB3  1 c 1 
ATOM   10644 N  N    . GLY   A  1  689 ? 4.750   -3.221  -11.966 1.000 21.901  0 744  GLY   A N    1 ? 1 
ATOM   10645 C  CA   . GLY   A  1  689 ? 3.612   -2.433  -11.538 1.000 17.910  0 744  GLY   A CA   1 ? 1 
ATOM   10646 C  C    . GLY   A  1  689 ? 3.387   -1.237  -12.448 1.000 18.600  0 744  GLY   A C    1 ? 1 
ATOM   10647 O  O    . GLY   A  1  689 ? 2.554   -0.383  -12.152 1.000 18.077  0 744  GLY   A O    1 ? 1 
ATOM   10648 H  H    . GLY   A  1  689 ? 4.592   -4.014  -12.391 1.000 21.450  0 744  GLY   A H    1 c 1 
ATOM   10649 H  HA2  . GLY   A  1  689 ? 2.804   -3.005  -11.540 1.000 18.759  0 744  GLY   A HA2  1 c 1 
ATOM   10650 H  HA3  . GLY   A  1  689 ? 3.764   -2.118  -10.612 1.000 18.680  0 744  GLY   A HA3  1 c 1 
ATOM   10651 N  N    . LEU   A  1  690 ? 4.178   -1.166  -13.524 1.000 15.704  0 745  LEU   A N    1 ? 1 
ATOM   10652 C  CA   . LEU   A  1  690 ? 4.017   -0.108  -14.497 1.000 18.084  0 745  LEU   A CA   1 ? 1 
ATOM   10653 C  C    . LEU   A  1  690 ? 3.564   -0.607  -15.870 1.000 16.692  0 745  LEU   A C    1 ? 1 
ATOM   10654 O  O    . LEU   A  1  690 ? 3.943   -1.690  -16.324 1.000 20.715  0 745  LEU   A O    1 ? 1 
ATOM   10655 C  CB   . LEU   A  1  690 ? 5.380   0.576   -14.648 1.000 25.373  0 745  LEU   A CB   1 ? 1 
ATOM   10656 C  CG   . LEU   A  1  690 ? 6.079   0.988   -13.327 1.000 21.706  0 745  LEU   A CG   1 ? 1 
ATOM   10657 C  CD1  . LEU   A  1  690 ? 7.405   1.620   -13.619 1.000 22.715  0 745  LEU   A CD1  1 ? 1 
ATOM   10658 C  CD2  . LEU   A  1  690 ? 5.277   1.962   -12.549 1.000 22.824  0 745  LEU   A CD2  1 ? 1 
ATOM   10659 H  H    . LEU   A  1  690 ? 4.821   -1.799  -13.666 1.000 17.104  0 745  LEU   A H    1 c 1 
ATOM   10660 H  HA   . LEU   A  1  690 ? 3.359   0.540   -14.158 1.000 18.192  0 745  LEU   A HA   1 c 1 
ATOM   10661 H  HB2  . LEU   A  1  690 ? 5.975   -0.028  -15.136 1.000 22.860  0 745  LEU   A HB2  1 c 1 
ATOM   10662 H  HB3  . LEU   A  1  690 ? 5.261   1.377   -15.197 1.000 22.849  0 745  LEU   A HB3  1 c 1 
ATOM   10663 H  HG   . LEU   A  1  690 ? 6.226   0.182   -12.776 1.000 22.478  0 745  LEU   A HG   1 c 1 
ATOM   10664 H  HD11 . LEU   A  1  690 ? 7.915   1.700   -12.794 1.000 22.373  0 745  LEU   A HD11 1 c 1 
ATOM   10665 H  HD12 . LEU   A  1  690 ? 7.267   2.504   -14.001 1.000 22.634  0 745  LEU   A HD12 1 c 1 
ATOM   10666 H  HD13 . LEU   A  1  690 ? 7.896   1.067   -14.251 1.000 22.777  0 745  LEU   A HD13 1 c 1 
ATOM   10667 H  HD21 . LEU   A  1  690 ? 4.444   1.546   -12.267 1.000 22.098  0 745  LEU   A HD21 1 c 1 
ATOM   10668 H  HD22 . LEU   A  1  690 ? 5.080   2.737   -13.103 1.000 22.513  0 745  LEU   A HD22 1 c 1 
ATOM   10669 H  HD23 . LEU   A  1  690 ? 5.779   2.244   -11.764 1.000 22.277  0 745  LEU   A HD23 1 c 1 
ATOM   10670 N  N    . ARG   A  1  691 ? 2.803   0.253   -16.545 1.000 18.160  0 746  ARG   A N    1 ? 1 
ATOM   10671 C  CA   . ARG   A  1  691 ? 2.403   0.073   -17.921 1.000 20.446  0 746  ARG   A CA   1 ? 1 
ATOM   10672 C  C    . ARG   A  1  691 ? 3.568   -0.343  -18.808 1.000 22.022  0 746  ARG   A C    1 ? 1 
ATOM   10673 O  O    . ARG   A  1  691 ? 4.568   0.341   -18.856 1.000 21.151  0 746  ARG   A O    1 ? 1 
ATOM   10674 C  CB   . ARG   A  1  691 ? 1.804   1.389   -18.429 1.000 23.068  0 746  ARG   A CB   1 ? 1 
ATOM   10675 C  CG   . ARG   A  1  691 ? 1.760   1.497   -19.952 1.000 32.936  0 746  ARG   A CG   1 ? 1 
ATOM   10676 C  CD   . ARG   A  1  691 ? 1.308   2.860   -20.394 1.000 33.035  0 746  ARG   A CD   1 ? 1 
ATOM   10677 N  NE   . ARG   A  1  691 ? 2.405   3.822   -20.441 1.000 33.832  0 746  ARG   A NE   1 ? 1 
ATOM   10678 C  CZ   . ARG   A  1  691 ? 3.393   3.834   -21.333 1.000 41.594  0 746  ARG   A CZ   1 ? 1 
ATOM   10679 N  NH1  . ARG   A  1  691 ? 3.325   3.146   -22.466 1.000 29.608  0 746  ARG   A NH1  1 ? 1 
ATOM   10680 N  NH2  . ARG   A  1  691 ? 4.474   4.567   -21.082 1.000 40.870  0 746  ARG   A NH2  1 ? 1 
ATOM   10681 H  H    . ARG   A  1  691 ? 2.511   1.002   -16.110 1.000 18.159  0 746  ARG   A H    1 c 1 
ATOM   10682 H  HA   . ARG   A  1  691 ? 1.712   -0.627  -17.954 1.000 20.650  0 746  ARG   A HA   1 c 1 
ATOM   10683 H  HB2  . ARG   A  1  691 ? 0.894   1.477   -18.079 1.000 23.964  0 746  ARG   A HB2  1 c 1 
ATOM   10684 H  HB3  . ARG   A  1  691 ? 2.336   2.133   -18.076 1.000 24.092  0 746  ARG   A HB3  1 c 1 
ATOM   10685 H  HG2  . ARG   A  1  691 ? 2.649   1.320   -20.324 1.000 30.511  0 746  ARG   A HG2  1 c 1 
ATOM   10686 H  HG3  . ARG   A  1  691 ? 1.142   0.826   -20.306 1.000 30.500  0 746  ARG   A HG3  1 c 1 
ATOM   10687 H  HD2  . ARG   A  1  691 ? 0.896   2.794   -21.281 1.000 33.492  0 746  ARG   A HD2  1 c 1 
ATOM   10688 H  HD3  . ARG   A  1  691 ? 0.626   3.188   -19.773 1.000 32.735  0 746  ARG   A HD3  1 c 1 
ATOM   10689 H  HE   . ARG   A  1  691 ? 2.412   4.446   -19.832 1.000 35.175  0 746  ARG   A HE   1 c 1 
ATOM   10690 H  HH11 . ARG   A  1  691 ? 2.540   2.898   -22.786 1.000 32.909  0 746  ARG   A HH11 1 c 1 
ATOM   10691 H  HH12 . ARG   A  1  691 ? 4.070   2.942   -22.899 1.000 33.235  0 746  ARG   A HH12 1 c 1 
ATOM   10692 H  HH21 . ARG   A  1  691 ? 5.097   4.654   -21.697 1.000 41.265  0 746  ARG   A HH21 1 c 1 
ATOM   10693 H  HH22 . ARG   A  1  691 ? 4.566   4.962   -20.301 1.000 40.742  0 746  ARG   A HH22 1 c 1 
ATOM   10694 N  N    . ASP   A  1  692 ? 3.404   -1.466  -19.516 1.000 26.164  0 747  ASP   A N    1 ? 1 
ATOM   10695 C  CA   . ASP   A  1  692 ? 4.411   -1.968  -20.432 1.000 23.846  0 747  ASP   A CA   1 ? 1 
ATOM   10696 C  C    . ASP   A  1  692 ? 4.450   -1.068  -21.652 1.000 26.643  0 747  ASP   A C    1 ? 1 
ATOM   10697 O  O    . ASP   A  1  692 ? 3.413   -0.576  -22.080 1.000 26.061  0 747  ASP   A O    1 ? 1 
ATOM   10698 C  CB   . ASP   A  1  692 ? 4.124   -3.400  -20.959 1.000 19.571  0 747  ASP   A CB   1 ? 1 
ATOM   10699 C  CG   . ASP   A  1  692 ? 4.418   -4.482  -19.959 1.000 25.314  0 747  ASP   A CG   1 ? 1 
ATOM   10700 O  OD1  . ASP   A  1  692 ? 4.892   -4.155  -18.852 1.000 17.936  0 747  ASP   A OD1  1 ? 1 
ATOM   10701 O  OD2  . ASP   A  1  692 ? 4.160   -5.655  -20.266 1.000 18.469  0 747  ASP   A OD2  1 ? 1 
ATOM   10702 H  H    . ASP   A  1  692 ? 2.627   -1.939  -19.423 1.000 24.278  0 747  ASP   A H    1 c 1 
ATOM   10703 H  HA   . ASP   A  1  692 ? 5.288   -1.952  -19.985 1.000 23.767  0 747  ASP   A HA   1 c 1 
ATOM   10704 H  HB2  . ASP   A  1  692 ? 3.181   -3.464  -21.214 1.000 21.683  0 747  ASP   A HB2  1 c 1 
ATOM   10705 H  HB3  . ASP   A  1  692 ? 4.668   -3.566  -21.755 1.000 22.141  0 747  ASP   A HB3  1 c 1 
ATOM   10706 N  N    . THR   A  1  693 ? 5.649   -0.930  -22.211 1.000 23.834  0 748  THR   A N    1 ? 1 
ATOM   10707 C  CA   . THR   A  1  693 ? 5.807   -0.454  -23.572 1.000 29.388  0 748  THR   A CA   1 ? 1 
ATOM   10708 C  C    . THR   A  1  693 ? 5.504   -1.618  -24.497 1.000 27.602  0 748  THR   A C    1 ? 1 
ATOM   10709 O  O    . THR   A  1  693 ? 5.449   -2.778  -24.076 1.000 23.317  0 748  THR   A O    1 ? 1 
ATOM   10710 C  CB   . THR   A  1  693 ? 7.189   0.024   -23.788 1.000 30.177  0 748  THR   A CB   1 ? 1 
ATOM   10711 O  OG1  . THR   A  1  693 ? 8.030   -1.112  -23.580 1.000 33.696  0 748  THR   A OG1  1 ? 1 
ATOM   10712 C  CG2  . THR   A  1  693 ? 7.539   1.169   -22.841 1.000 27.842  0 748  THR   A CG2  1 ? 1 
ATOM   10713 H  H    . THR   A  1  693 ? 6.395   -1.148  -21.730 1.000 25.585  0 748  THR   A H    1 c 1 
ATOM   10714 H  HA   . THR   A  1  693 ? 5.171   0.280   -23.738 1.000 27.966  0 748  THR   A HA   1 c 1 
ATOM   10715 H  HB   . THR   A  1  693 ? 7.279   0.332   -24.721 1.000 30.782  0 748  THR   A HB   1 c 1 
ATOM   10716 H  HG1  . THR   A  1  693 ? 7.940   -1.421  -22.792 0.000 22.910  0 748  THR   A HG1  1 c 1 
ATOM   10717 H  HG21 . THR   A  1  693 ? 8.408   1.538   -23.083 1.000 28.745  0 748  THR   A HG21 1 c 1 
ATOM   10718 H  HG22 . THR   A  1  693 ? 7.573   0.839   -21.926 1.000 27.999  0 748  THR   A HG22 1 c 1 
ATOM   10719 H  HG23 . THR   A  1  693 ? 6.862   1.866   -22.909 1.000 28.331  0 748  THR   A HG23 1 c 1 
ATOM   10720 N  N    . GLU   A  1  694 ? 5.395   -1.317  -25.784 1.000 33.359  0 749  GLU   A N    1 ? 1 
ATOM   10721 C  CA   . GLU   A  1  694 ? 4.948   -2.351  -26.687 1.000 39.500  0 749  GLU   A CA   1 ? 1 
ATOM   10722 C  C    . GLU   A  1  694 ? 6.065   -3.372  -26.807 1.000 30.884  0 749  GLU   A C    1 ? 1 
ATOM   10723 O  O    . GLU   A  1  694 ? 5.783   -4.557  -26.972 1.000 31.178  0 749  GLU   A O    1 ? 1 
ATOM   10724 C  CB   . GLU   A  1  694 ? 4.524   -1.821  -28.057 1.000 51.654  0 749  GLU   A CB   1 ? 1 
ATOM   10725 C  CG   . GLU   A  1  694 ? 3.770   -2.927  -28.786 1.000 86.466  0 749  GLU   A CG   1 ? 1 
ATOM   10726 C  CD   . GLU   A  1  694 ? 3.192   -2.579  -30.135 1.000 105.171 0 749  GLU   A CD   1 ? 1 
ATOM   10727 O  OE1  . GLU   A  1  694 ? 3.596   -1.544  -30.710 1.000 104.693 0 749  GLU   A OE1  1 ? 1 
ATOM   10728 O  OE2  . GLU   A  1  694 ? 2.323   -3.343  -30.608 1.000 80.395  0 749  GLU   A OE2  1 ? 1 
ATOM   10729 H  H    . GLU   A  1  694 ? 5.590   -0.482  -26.100 1.000 33.350  0 749  GLU   A H    1 c 1 
ATOM   10730 H  HA   . GLU   A  1  694 ? 4.170   -2.795  -26.276 1.000 37.956  0 749  GLU   A HA   1 c 1 
ATOM   10731 H  HB2  . GLU   A  1  694 ? 3.945   -1.039  -27.944 1.000 54.294  0 749  GLU   A HB2  1 c 1 
ATOM   10732 H  HB3  . GLU   A  1  694 ? 5.317   -1.560  -28.571 1.000 54.697  0 749  GLU   A HB3  1 c 1 
ATOM   10733 H  HG2  . GLU   A  1  694 ? 4.376   -3.688  -28.910 1.000 78.754  0 749  GLU   A HG2  1 c 1 
ATOM   10734 H  HG3  . GLU   A  1  694 ? 3.035   -3.233  -28.213 1.000 78.643  0 749  GLU   A HG3  1 c 1 
ATOM   10735 N  N    . ASP   A  1  695 ? 7.309   -2.895  -26.684 1.000 33.876  0 750  ASP   A N    1 ? 1 
ATOM   10736 C  CA   . ASP   A  1  695 ? 8.482   -3.759  -26.730 1.000 35.301  0 750  ASP   A CA   1 ? 1 
ATOM   10737 C  C    . ASP   A  1  695 ? 8.526   -4.760  -25.582 1.000 30.100  0 750  ASP   A C    1 ? 1 
ATOM   10738 O  O    . ASP   A  1  695 ? 9.181   -5.786  -25.689 1.000 40.835  0 750  ASP   A O    1 ? 1 
ATOM   10739 C  CB   . ASP   A  1  695 ? 9.764   -2.937  -26.683 1.000 51.293  0 750  ASP   A CB   1 ? 1 
ATOM   10740 C  CG   . ASP   A  1  695 ? 9.853   -1.815  -27.687 1.000 77.022  0 750  ASP   A CG   1 ? 1 
ATOM   10741 O  OD1  . ASP   A  1  695 ? 9.042   -1.793  -28.640 1.000 97.633  0 750  ASP   A OD1  1 ? 1 
ATOM   10742 O  OD2  . ASP   A  1  695 ? 10.711  -0.948  -27.511 1.000 103.468 0 750  ASP   A OD2  1 ? 1 
ATOM   10743 H  H    . ASP   A  1  695 ? 7.433   -1.997  -26.574 1.000 33.654  0 750  ASP   A H    1 c 1 
ATOM   10744 H  HA   . ASP   A  1  695 ? 8.464   -4.257  -27.581 1.000 36.850  0 750  ASP   A HA   1 c 1 
ATOM   10745 H  HB2  . ASP   A  1  695 ? 9.855   -2.548  -25.789 1.000 50.710  0 750  ASP   A HB2  1 c 1 
ATOM   10746 H  HB3  . ASP   A  1  695 ? 10.524  -3.536  -26.832 1.000 51.569  0 750  ASP   A HB3  1 c 1 
ATOM   10747 N  N    . GLU   A  1  696 ? 7.835   -4.443  -24.481 1.000 32.243  0 751  GLU   A N    1 ? 1 
ATOM   10748 C  CA   . GLU   A  1  696 ? 7.807   -5.295  -23.315 1.000 28.909  0 751  GLU   A CA   1 ? 1 
ATOM   10749 C  C    . GLU   A  1  696 ? 6.688   -6.352  -23.317 1.000 33.704  0 751  GLU   A C    1 ? 1 
ATOM   10750 O  O    . GLU   A  1  696 ? 6.633   -7.202  -22.428 1.000 26.680  0 751  GLU   A O    1 ? 1 
ATOM   10751 C  CB   . GLU   A  1  696 ? 7.716   -4.368  -22.102 1.000 29.678  0 751  GLU   A CB   1 ? 1 
ATOM   10752 C  CG   . GLU   A  1  696 ? 9.027   -3.668  -21.783 1.000 30.183  0 751  GLU   A CG   1 ? 1 
ATOM   10753 C  CD   . GLU   A  1  696 ? 8.902   -2.562  -20.746 1.000 33.460  0 751  GLU   A CD   1 ? 1 
ATOM   10754 O  OE1  . GLU   A  1  696 ? 7.805   -1.950  -20.593 1.000 31.407  0 751  GLU   A OE1  1 ? 1 
ATOM   10755 O  OE2  . GLU   A  1  696 ? 9.927   -2.324  -20.067 1.000 42.824  0 751  GLU   A OE2  1 ? 1 
ATOM   10756 H  H    . GLU   A  1  696 ? 7.376   -3.654  -24.455 1.000 30.712  0 751  GLU   A H    1 c 1 
ATOM   10757 H  HA   . GLU   A  1  696 ? 8.669   -5.770  -23.269 1.000 30.822  0 751  GLU   A HA   1 c 1 
ATOM   10758 H  HB2  . GLU   A  1  696 ? 7.025   -3.696  -22.269 1.000 29.293  0 751  GLU   A HB2  1 c 1 
ATOM   10759 H  HB3  . GLU   A  1  696 ? 7.441   -4.896  -21.323 1.000 29.105  0 751  GLU   A HB3  1 c 1 
ATOM   10760 H  HG2  . GLU   A  1  696 ? 9.671   -4.331  -21.454 1.000 31.059  0 751  GLU   A HG2  1 c 1 
ATOM   10761 H  HG3  . GLU   A  1  696 ? 9.392   -3.281  -22.607 1.000 31.340  0 751  GLU   A HG3  1 c 1 
ATOM   10762 N  N    . ILE   A  1  697 ? 5.797   -6.328  -24.319 1.000 31.914  0 752  ILE   A N    1 ? 1 
ATOM   10763 C  CA   . ILE   A  1  697 ? 4.729   -7.315  -24.398 1.000 25.964  0 752  ILE   A CA   1 ? 1 
ATOM   10764 C  C    . ILE   A  1  697 ? 5.338   -8.608  -24.924 1.000 24.436  0 752  ILE   A C    1 ? 1 
ATOM   10765 O  O    . ILE   A  1  697 ? 6.055   -8.615  -25.909 1.000 26.734  0 752  ILE   A O    1 ? 1 
ATOM   10766 C  CB   . ILE   A  1  697 ? 3.560   -6.844  -25.276 1.000 36.460  0 752  ILE   A CB   1 ? 1 
ATOM   10767 C  CG1  . ILE   A  1  697 ? 3.206   -5.377  -24.999 1.000 37.772  0 752  ILE   A CG1  1 ? 1 
ATOM   10768 C  CG2  . ILE   A  1  697 ? 2.351   -7.738  -25.140 1.000 30.681  0 752  ILE   A CG2  1 ? 1 
ATOM   10769 C  CD1  . ILE   A  1  697 ? 2.440   -5.169  -23.930 1.000 32.527  0 752  ILE   A CD1  1 ? 1 
ATOM   10770 H  H    . ILE   A  1  697 ? 5.873   -5.702  -24.980 1.000 31.203  0 752  ILE   A H    1 c 1 
ATOM   10771 H  HA   . ILE   A  1  697 ? 4.389   -7.474  -23.499 1.000 27.689  0 752  ILE   A HA   1 c 1 
ATOM   10772 H  HB   . ILE   A  1  697 ? 3.861   -6.898  -26.217 1.000 33.705  0 752  ILE   A HB   1 c 1 
ATOM   10773 H  HG12 . ILE   A  1  697 ? 4.033   -4.866  -24.892 1.000 36.003  0 752  ILE   A HG12 1 c 1 
ATOM   10774 H  HG13 . ILE   A  1  697 ? 2.740   -5.020  -25.785 1.000 36.415  0 752  ILE   A HG13 1 c 1 
ATOM   10775 H  HG21 . ILE   A  1  697 ? 2.124   -7.838  -24.201 1.000 31.687  0 752  ILE   A HG21 1 c 1 
ATOM   10776 H  HG22 . ILE   A  1  697 ? 2.547   -8.613  -25.518 1.000 32.427  0 752  ILE   A HG22 1 c 1 
ATOM   10777 H  HG23 . ILE   A  1  697 ? 1.599   -7.344  -25.614 1.000 32.183  0 752  ILE   A HG23 1 c 1 
ATOM   10778 H  HD11 . ILE   A  1  697 ? 2.764   -5.705  -23.185 1.000 33.592  0 752  ILE   A HD11 1 c 1 
ATOM   10779 H  HD12 . ILE   A  1  697 ? 1.521   -5.416  -24.131 1.000 33.849  0 752  ILE   A HD12 1 c 1 
ATOM   10780 H  HD13 . ILE   A  1  697 ? 2.473   -4.227  -23.686 1.000 33.722  0 752  ILE   A HD13 1 c 1 
ATOM   10781 N  N    . LYS   A  1  698 ? 5.066   -9.719  -24.255 1.000 24.536  0 753  LYS   A N    1 ? 1 
ATOM   10782 C  CA   . LYS   A  1  698 ? 5.729   -10.962 -24.619 1.000 27.146  0 753  LYS   A CA   1 ? 1 
ATOM   10783 C  C    . LYS   A  1  698 ? 4.781   -12.026 -25.154 1.000 31.426  0 753  LYS   A C    1 ? 1 
ATOM   10784 O  O    . LYS   A  1  698 ? 5.233   -13.120 -25.464 1.000 42.328  0 753  LYS   A O    1 ? 1 
ATOM   10785 C  CB   . LYS   A  1  698 ? 6.488   -11.546 -23.418 1.000 29.094  0 753  LYS   A CB   1 ? 1 
ATOM   10786 C  CG   . LYS   A  1  698 ? 7.485   -10.572 -22.827 1.000 36.770  0 753  LYS   A CG   1 ? 1 
ATOM   10787 C  CD   . LYS   A  1  698 ? 8.467   -10.088 -23.878 1.000 43.556  0 753  LYS   A CD   1 ? 1 
ATOM   10788 C  CE   . LYS   A  1  698 ? 9.686   -9.465  -23.257 1.000 46.751  0 753  LYS   A CE   1 ? 1 
ATOM   10789 N  NZ   . LYS   A  1  698 ? 10.895  -9.993  -23.930 1.000 45.924  0 753  LYS   A NZ   1 ? 1 
ATOM   10790 H  H    . LYS   A  1  698 ? 4.468   -9.712  -23.564 1.000 24.595  0 753  LYS   A H    1 c 1 
ATOM   10791 H  HA   . LYS   A  1  698 ? 6.383   -10.764 -25.326 1.000 28.277  0 753  LYS   A HA   1 c 1 
ATOM   10792 H  HB2  . LYS   A  1  698 ? 5.841   -11.800 -22.727 1.000 29.767  0 753  LYS   A HB2  1 c 1 
ATOM   10793 H  HB3  . LYS   A  1  698 ? 6.963   -12.354 -23.704 1.000 30.570  0 753  LYS   A HB3  1 c 1 
ATOM   10794 H  HG2  . LYS   A  1  698 ? 7.005   -9.805  -22.449 1.000 35.388  0 753  LYS   A HG2  1 c 1 
ATOM   10795 H  HG3  . LYS   A  1  698 ? 7.974   -11.015 -22.101 1.000 35.897  0 753  LYS   A HG3  1 c 1 
ATOM   10796 H  HD2  . LYS   A  1  698 ? 8.740   -10.844 -24.440 1.000 43.016  0 753  LYS   A HD2  1 c 1 
ATOM   10797 H  HD3  . LYS   A  1  698 ? 8.030   -9.424  -24.451 1.000 42.222  0 753  LYS   A HD3  1 c 1 
ATOM   10798 H  HE2  . LYS   A  1  698 ? 9.655   -8.494  -23.361 1.000 45.490  0 753  LYS   A HE2  1 c 1 
ATOM   10799 H  HE3  . LYS   A  1  698 ? 9.726   -9.674  -22.305 1.000 45.156  0 753  LYS   A HE3  1 c 1 
ATOM   10800 H  HZ1  . LYS   A  1  698 ? 10.835  -9.857  -24.825 1.000 46.706  0 753  LYS   A HZ1  1 c 1 
ATOM   10801 H  HZ2  . LYS   A  1  698 ? 10.974  -10.882 -23.769 1.000 46.487  0 753  LYS   A HZ2  1 c 1 
ATOM   10802 H  HZ3  . LYS   A  1  698 ? 11.632  -9.569  -23.615 1.000 46.426  0 753  LYS   A HZ3  1 c 1 
ATOM   10803 N  N    . GLN   A  1  699 ? 3.492   -11.702 -25.305 1.000 33.164  0 754  GLN   A N    1 ? 1 
ATOM   10804 C  CA   . GLN   A  1  699 ? 2.560   -12.666 -25.865 1.000 35.155  0 754  GLN   A CA   1 ? 1 
ATOM   10805 C  C    . GLN   A  1  699 ? 1.492   -11.954 -26.686 1.000 34.971  0 754  GLN   A C    1 ? 1 
ATOM   10806 O  O    . GLN   A  1  699 ? 0.982   -10.898 -26.290 1.000 28.672  0 754  GLN   A O    1 ? 1 
ATOM   10807 C  CB   . GLN   A  1  699 ? 1.944   -13.535 -24.760 1.000 30.069  0 754  GLN   A CB   1 ? 1 
ATOM   10808 C  CG   . GLN   A  1  699 ? 0.969   -14.566 -25.285 1.000 45.128  0 754  GLN   A CG   1 ? 1 
ATOM   10809 C  CD   . GLN   A  1  699 ? 0.242   -15.287 -24.188 1.000 57.541  0 754  GLN   A CD   1 ? 1 
ATOM   10810 O  OE1  . GLN   A  1  699 ? 0.501   -15.082 -22.990 1.000 56.732  0 754  GLN   A OE1  1 ? 1 
ATOM   10811 N  NE2  . GLN   A  1  699 ? -0.688  -16.146 -24.591 1.000 54.057  0 754  GLN   A NE2  1 ? 1 
ATOM   10812 H  H    . GLN   A  1  699 ? 3.188   -10.876 -25.059 1.000 32.548  0 754  GLN   A H    1 c 1 
ATOM   10813 H  HA   . GLN   A  1  699 ? 3.065   -13.256 -26.470 1.000 34.282  0 754  GLN   A HA   1 c 1 
ATOM   10814 H  HB2  . GLN   A  1  699 ? 2.667   -13.990 -24.280 1.000 33.934  0 754  GLN   A HB2  1 c 1 
ATOM   10815 H  HB3  . GLN   A  1  699 ? 1.482   -12.951 -24.126 1.000 33.568  0 754  GLN   A HB3  1 c 1 
ATOM   10816 H  HG2  . GLN   A  1  699 ? 0.312   -14.127 -25.864 1.000 43.094  0 754  GLN   A HG2  1 c 1 
ATOM   10817 H  HG3  . GLN   A  1  699 ? 1.457   -15.221 -25.829 1.000 43.617  0 754  GLN   A HG3  1 c 1 
ATOM   10818 H  HE21 . GLN   A  1  699 ? -0.840  -16.263 -25.455 1.000 55.483  0 754  GLN   A HE21 1 c 1 
ATOM   10819 H  HE22 . GLN   A  1  699 ? -1.157  -16.602 -23.996 1.000 55.051  0 754  GLN   A HE22 1 c 1 
ATOM   10820 N  N    . TYR   A  1  700 ? 1.202   -12.550 -27.855 1.000 26.235  0 755  TYR   A N    1 ? 1 
ATOM   10821 C  CA   . TYR   A  1  700 ? 0.244   -12.003 -28.787 1.000 26.385  0 755  TYR   A CA   1 ? 1 
ATOM   10822 C  C    . TYR   A  1  700 ? -0.732  -13.107 -29.160 1.000 26.659  0 755  TYR   A C    1 ? 1 
ATOM   10823 O  O    . TYR   A  1  700 ? -0.379  -14.270 -29.055 1.000 26.596  0 755  TYR   A O    1 ? 1 
ATOM   10824 C  CB   . TYR   A  1  700 ? 0.951   -11.475 -30.024 1.000 24.795  0 755  TYR   A CB   1 ? 1 
ATOM   10825 C  CG   . TYR   A  1  700 ? 1.717   -10.218 -29.776 1.000 22.708  0 755  TYR   A CG   1 ? 1 
ATOM   10826 C  CD1  . TYR   A  1  700 ? 2.955   -10.251 -29.173 1.000 26.165  0 755  TYR   A CD1  1 ? 1 
ATOM   10827 C  CD2  . TYR   A  1  700 ? 1.201   -8.989  -30.131 1.000 23.246  0 755  TYR   A CD2  1 ? 1 
ATOM   10828 C  CE1  . TYR   A  1  700 ? 3.670   -9.098  -28.931 1.000 24.356  0 755  TYR   A CE1  1 ? 1 
ATOM   10829 C  CE2  . TYR   A  1  700 ? 1.910   -7.820  -29.894 1.000 29.631  0 755  TYR   A CE2  1 ? 1 
ATOM   10830 C  CZ   . TYR   A  1  700 ? 3.148   -7.885  -29.281 1.000 27.616  0 755  TYR   A CZ   1 ? 1 
ATOM   10831 O  OH   . TYR   A  1  700 ? 3.879   -6.772  -28.956 1.000 32.181  0 755  TYR   A OH   1 ? 1 
ATOM   10832 H  H    . TYR   A  1  700 ? 1.622   -13.332 -28.072 1.000 28.467  0 755  TYR   A H    1 c 1 
ATOM   10833 H  HA   . TYR   A  1  700 ? -0.253  -11.265 -28.353 1.000 25.629  0 755  TYR   A HA   1 c 1 
ATOM   10834 H  HB2  . TYR   A  1  700 ? 1.566   -12.164 -30.352 1.000 25.156  0 755  TYR   A HB2  1 c 1 
ATOM   10835 H  HB3  . TYR   A  1  700 ? 0.283   -11.310 -30.722 1.000 25.044  0 755  TYR   A HB3  1 c 1 
ATOM   10836 H  HD1  . TYR   A  1  700 ? 3.323   -11.081 -28.921 1.000 24.966  0 755  TYR   A HD1  1 c 1 
ATOM   10837 H  HD2  . TYR   A  1  700 ? 0.357   -8.942  -30.542 1.000 24.569  0 755  TYR   A HD2  1 c 1 
ATOM   10838 H  HE1  . TYR   A  1  700 ? 4.507   -9.142  -28.499 1.000 25.419  0 755  TYR   A HE1  1 c 1 
ATOM   10839 H  HE2  . TYR   A  1  700 ? 1.539   -6.984  -30.123 1.000 27.335  0 755  TYR   A HE2  1 c 1 
ATOM   10840 H  HH   . TYR   A  1  700 ? 4.600   -6.809  -28.552 0.000 19.180  0 755  TYR   A HH   1 c 1 
ATOM   10841 N  N    . VAL   A  1  701 ? -1.946  -12.739 -29.589 1.000 27.571  0 756  VAL   A N    1 ? 1 
ATOM   10842 C  CA   . VAL   A  1  701 ? -2.839  -13.704 -30.218 1.000 30.167  0 756  VAL   A CA   1 ? 1 
ATOM   10843 C  C    . VAL   A  1  701 ? -2.116  -14.230 -31.457 1.000 29.396  0 756  VAL   A C    1 ? 1 
ATOM   10844 O  O    . VAL   A  1  701 ? -1.568  -13.453 -32.270 1.000 27.938  0 756  VAL   A O    1 ? 1 
ATOM   10845 C  CB   . VAL   A  1  701 ? -4.219  -13.089 -30.519 1.000 31.410  0 756  VAL   A CB   1 ? 1 
ATOM   10846 C  CG1  . VAL   A  1  701 ? -5.196  -14.124 -31.102 1.000 30.407  0 756  VAL   A CG1  1 ? 1 
ATOM   10847 C  CG2  . VAL   A  1  701 ? -4.798  -12.423 -29.260 1.000 29.365  0 756  VAL   A CG2  1 ? 1 
ATOM   10848 H  H    . VAL   A  1  701 ? -2.213  -11.869 -29.505 1.000 27.619  0 756  VAL   A H    1 c 1 
ATOM   10849 H  HA   . VAL   A  1  701 ? -2.965  -14.445 -29.598 1.000 29.493  0 756  VAL   A HA   1 c 1 
ATOM   10850 H  HB   . VAL   A  1  701 ? -4.087  -12.384 -31.198 1.000 30.822  0 756  VAL   A HB   1 c 1 
ATOM   10851 H  HG11 . VAL   A  1  701 ? -5.298  -14.862 -30.477 1.000 30.686  0 756  VAL   A HG11 1 c 1 
ATOM   10852 H  HG12 . VAL   A  1  701 ? -4.849  -14.461 -31.946 1.000 31.313  0 756  VAL   A HG12 1 c 1 
ATOM   10853 H  HG13 . VAL   A  1  701 ? -6.061  -13.705 -31.252 1.000 30.840  0 756  VAL   A HG13 1 c 1 
ATOM   10854 H  HG21 . VAL   A  1  701 ? -5.743  -12.238 -29.396 1.000 29.780  0 756  VAL   A HG21 1 c 1 
ATOM   10855 H  HG22 . VAL   A  1  701 ? -4.328  -11.589 -29.085 1.000 29.465  0 756  VAL   A HG22 1 c 1 
ATOM   10856 H  HG23 . VAL   A  1  701 ? -4.691  -13.020 -28.498 1.000 29.485  0 756  VAL   A HG23 1 c 1 
ATOM   10857 N  N    . GLU   A  1  702 ? -2.035  -15.564 -31.534 1.000 30.201  0 757  GLU   A N    1 ? 1 
ATOM   10858 C  CA   . GLU   A  1  702 ? -1.147  -16.218 -32.488 1.000 44.827  0 757  GLU   A CA   1 ? 1 
ATOM   10859 C  C    . GLU   A  1  702 ? -1.327  -15.683 -33.904 1.000 36.482  0 757  GLU   A C    1 ? 1 
ATOM   10860 O  O    . GLU   A  1  702 ? -2.448  -15.462 -34.340 1.000 42.305  0 757  GLU   A O    1 ? 1 
ATOM   10861 C  CB   . GLU   A  1  702 ? -1.364  -17.748 -32.520 1.000 56.719  0 757  GLU   A CB   1 ? 1 
ATOM   10862 C  CG   . GLU   A  1  702 ? -0.166  -18.494 -33.092 1.000 57.355  0 757  GLU   A CG   1 ? 1 
ATOM   10863 C  CD   . GLU   A  1  702 ? -0.398  -19.969 -33.334 1.000 94.124  0 757  GLU   A CD   1 ? 1 
ATOM   10864 O  OE1  . GLU   A  1  702 ? -0.992  -20.314 -34.384 1.000 87.320  0 757  GLU   A OE1  1 ? 1 
ATOM   10865 O  OE2  . GLU   A  1  702 ? -0.018  -20.777 -32.454 1.000 73.253  0 757  GLU   A OE2  1 ? 1 
ATOM   10866 H  H    . GLU   A  1  702 ? -2.551  -16.081 -30.984 1.000 32.636  0 757  GLU   A H    1 c 1 
ATOM   10867 H  HA   . GLU   A  1  702 ? -0.220  -16.043 -32.205 1.000 41.043  0 757  GLU   A HA   1 c 1 
ATOM   10868 H  HB2  . GLU   A  1  702 ? -1.533  -18.063 -31.608 1.000 53.160  0 757  GLU   A HB2  1 c 1 
ATOM   10869 H  HB3  . GLU   A  1  702 ? -2.156  -17.945 -33.062 1.000 53.903  0 757  GLU   A HB3  1 c 1 
ATOM   10870 H  HG2  . GLU   A  1  702 ? 0.090   -18.079 -33.943 1.000 64.010  0 757  GLU   A HG2  1 c 1 
ATOM   10871 H  HG3  . GLU   A  1  702 ? 0.591   -18.396 -32.477 1.000 63.702  0 757  GLU   A HG3  1 c 1 
ATOM   10872 N  N    . GLY   A  1  703 ? -0.207  -15.477 -34.607 1.000 40.007  0 758  GLY   A N    1 ? 1 
ATOM   10873 C  CA   . GLY   A  1  703 ? -0.212  -15.026 -35.988 1.000 38.525  0 758  GLY   A CA   1 ? 1 
ATOM   10874 C  C    . GLY   A  1  703 ? -0.623  -13.569 -36.184 1.000 37.528  0 758  GLY   A C    1 ? 1 
ATOM   10875 O  O    . GLY   A  1  703 ? -0.853  -13.151 -37.310 1.000 65.612  0 758  GLY   A O    1 ? 1 
ATOM   10876 H  H    . GLY   A  1  703 ? 0.599   -15.626 -34.204 1.000 38.712  0 758  GLY   A H    1 c 1 
ATOM   10877 H  HA2  . GLY   A  1  703 ? 0.696   -15.154 -36.362 1.000 39.221  0 758  GLY   A HA2  1 c 1 
ATOM   10878 H  HA3  . GLY   A  1  703 ? -0.828  -15.604 -36.505 1.000 39.253  0 758  GLY   A HA3  1 c 1 
ATOM   10879 N  N    . SER   A  1  704 ? -0.763  -12.826 -35.076 1.000 40.178  0 759  SER   A N    1 ? 1 
ATOM   10880 C  CA   . SER   A  1  704 ? -1.308  -11.479 -35.088 1.000 30.105  0 759  SER   A CA   1 ? 1 
ATOM   10881 C  C    . SER   A  1  704 ? -0.408  -10.573 -34.265 1.000 30.741  0 759  SER   A C    1 ? 1 
ATOM   10882 O  O    . SER   A  1  704 ? 0.495   -11.049 -33.592 1.000 29.360  0 759  SER   A O    1 ? 1 
ATOM   10883 C  CB   . SER   A  1  704 ? -2.703  -11.425 -34.472 1.000 35.173  0 759  SER   A CB   1 ? 1 
ATOM   10884 O  OG   . SER   A  1  704 ? -2.669  -11.310 -33.044 1.000 26.294  0 759  SER   A OG   1 ? 1 
ATOM   10885 H  H    . SER   A  1  704 ? -0.487  -13.170 -34.276 1.000 36.317  0 759  SER   A H    1 c 1 
ATOM   10886 H  HA   . SER   A  1  704 ? -1.343  -11.143 -36.023 1.000 33.509  0 759  SER   A HA   1 c 1 
ATOM   10887 H  HB2  . SER   A  1  704 ? -3.189  -10.655 -34.846 1.000 31.717  0 759  SER   A HB2  1 c 1 
ATOM   10888 H  HB3  . SER   A  1  704 ? -3.195  -12.241 -34.718 1.000 31.888  0 759  SER   A HB3  1 c 1 
ATOM   10889 H  HG   . SER   A  1  704 ? -2.657  -10.486 -32.847 0.000 11.260  0 759  SER   A HG   1 c 1 
ATOM   10890 N  N    . SER   A  1  705 ? -0.707  -9.274  -34.289 1.000 31.303  0 760  SER   A N    1 ? 1 
ATOM   10891 C  CA   . SER   A  1  705 ? -0.107  -8.337  -33.361 1.000 30.520  0 760  SER   A CA   1 ? 1 
ATOM   10892 C  C    . SER   A  1  705 ? -1.140  -7.819  -32.368 1.000 26.301  0 760  SER   A C    1 ? 1 
ATOM   10893 O  O    . SER   A  1  705 ? -1.055  -6.679  -31.890 1.000 27.680  0 760  SER   A O    1 ? 1 
ATOM   10894 C  CB   . SER   A  1  705 ? 0.540   -7.207  -34.144 1.000 36.786  0 760  SER   A CB   1 ? 1 
ATOM   10895 O  OG   . SER   A  1  705 ? -0.446  -6.637  -34.969 1.000 43.575  0 760  SER   A OG   1 ? 1 
ATOM   10896 H  H    . SER   A  1  705 ? -1.305  -8.962  -34.906 1.000 31.358  0 760  SER   A H    1 c 1 
ATOM   10897 H  HA   . SER   A  1  705 ? 0.603   -8.811  -32.853 1.000 30.516  0 760  SER   A HA   1 c 1 
ATOM   10898 H  HB2  . SER   A  1  705 ? 0.899   -6.530  -33.527 1.000 36.209  0 760  SER   A HB2  1 c 1 
ATOM   10899 H  HB3  . SER   A  1  705 ? 1.277   -7.557  -34.693 1.000 37.061  0 760  SER   A HB3  1 c 1 
ATOM   10900 H  HG   . SER   A  1  705 ? -0.826  -5.997  -34.543 0.000 27.800  0 760  SER   A HG   1 c 1 
ATOM   10901 N  N    . ILE   A  1  706 ? -2.109  -8.682  -32.035 1.000 26.184  0 761  ILE   A N    1 ? 1 
ATOM   10902 C  CA   . ILE   A  1  706 ? -3.047  -8.381  -30.971 1.000 28.572  0 761  ILE   A CA   1 ? 1 
ATOM   10903 C  C    . ILE   A  1  706 ? -2.336  -8.776  -29.673 1.000 21.790  0 761  ILE   A C    1 ? 1 
ATOM   10904 O  O    . ILE   A  1  706 ? -2.112  -9.962  -29.437 1.000 21.768  0 761  ILE   A O    1 ? 1 
ATOM   10905 C  CB   . ILE   A  1  706 ? -4.382  -9.098  -31.124 1.000 29.336  0 761  ILE   A CB   1 ? 1 
ATOM   10906 C  CG1  . ILE   A  1  706 ? -4.983  -8.923  -32.512 1.000 35.689  0 761  ILE   A CG1  1 ? 1 
ATOM   10907 C  CG2  . ILE   A  1  706 ? -5.371  -8.634  -30.054 1.000 35.177  0 761  ILE   A CG2  1 ? 1 
ATOM   10908 C  CD1  . ILE   A  1  706 ? -6.277  -9.753  -32.698 1.000 35.670  0 761  ILE   A CD1  1 ? 1 
ATOM   10909 H  H    . ILE   A  1  706 ? -2.178  -9.481  -32.471 1.000 27.299  0 761  ILE   A H    1 c 1 
ATOM   10910 H  HA   . ILE   A  1  706 ? -3.214  -7.423  -30.964 1.000 26.611  0 761  ILE   A HA   1 c 1 
ATOM   10911 H  HB   . ILE   A  1  706 ? -4.221  -10.064 -30.988 1.000 31.163  0 761  ILE   A HB   1 c 1 
ATOM   10912 H  HG12 . ILE   A  1  706 ? -5.186  -7.974  -32.655 1.000 34.141  0 761  ILE   A HG12 1 c 1 
ATOM   10913 H  HG13 . ILE   A  1  706 ? -4.327  -9.200  -33.185 1.000 34.415  0 761  ILE   A HG13 1 c 1 
ATOM   10914 H  HG21 . ILE   A  1  706 ? -5.635  -7.715  -30.232 1.000 33.050  0 761  ILE   A HG21 1 c 1 
ATOM   10915 H  HG22 . ILE   A  1  706 ? -4.954  -8.686  -29.177 1.000 32.543  0 761  ILE   A HG22 1 c 1 
ATOM   10916 H  HG23 . ILE   A  1  706 ? -6.159  -9.204  -30.067 1.000 33.161  0 761  ILE   A HG23 1 c 1 
ATOM   10917 H  HD11 . ILE   A  1  706 ? -7.008  -9.335  -32.210 1.000 35.367  0 761  ILE   A HD11 1 c 1 
ATOM   10918 H  HD12 . ILE   A  1  706 ? -6.138  -10.655 -32.361 1.000 35.657  0 761  ILE   A HD12 1 c 1 
ATOM   10919 H  HD13 . ILE   A  1  706 ? -6.504  -9.793  -33.644 1.000 36.251  0 761  ILE   A HD13 1 c 1 
ATOM   10920 N  N    . PRO   A  1  707 ? -1.990  -7.814  -28.791 1.000 24.219  0 762  PRO   A N    1 ? 1 
ATOM   10921 C  CA   . PRO   A  1  707 ? -1.283  -8.124  -27.549 1.000 20.933  0 762  PRO   A CA   1 ? 1 
ATOM   10922 C  C    . PRO   A  1  707 ? -2.254  -8.754  -26.575 1.000 17.695  0 762  PRO   A C    1 ? 1 
ATOM   10923 O  O    . PRO   A  1  707 ? -3.398  -8.349  -26.540 1.000 19.743  0 762  PRO   A O    1 ? 1 
ATOM   10924 C  CB   . PRO   A  1  707 ? -0.785  -6.765  -27.087 1.000 21.380  0 762  PRO   A CB   1 ? 1 
ATOM   10925 C  CG   . PRO   A  1  707 ? -1.799  -5.797  -27.620 1.000 21.437  0 762  PRO   A CG   1 ? 1 
ATOM   10926 C  CD   . PRO   A  1  707 ? -2.272  -6.370  -28.918 1.000 27.960  0 762  PRO   A CD   1 ? 1 
ATOM   10927 H  HA   . PRO   A  1  707 ? -0.518  -8.726  -27.732 1.000 21.130  0 762  PRO   A HA   1 c 1 
ATOM   10928 H  HB2  . PRO   A  1  707 ? -0.740  -6.721  -26.108 1.000 20.740  0 762  PRO   A HB2  1 c 1 
ATOM   10929 H  HB3  . PRO   A  1  707 ? 0.105   -6.574  -27.453 1.000 21.408  0 762  PRO   A HB3  1 c 1 
ATOM   10930 H  HG2  . PRO   A  1  707 ? -2.545  -5.701  -26.994 1.000 22.340  0 762  PRO   A HG2  1 c 1 
ATOM   10931 H  HG3  . PRO   A  1  707 ? -1.394  -4.918  -27.762 1.000 22.891  0 762  PRO   A HG3  1 c 1 
ATOM   10932 H  HD2  . PRO   A  1  707 ? -3.226  -6.212  -29.043 1.000 25.554  0 762  PRO   A HD2  1 c 1 
ATOM   10933 H  HD3  . PRO   A  1  707 ? -1.785  -5.982  -29.668 1.000 25.878  0 762  PRO   A HD3  1 c 1 
ATOM   10934 N  N    . VAL   A  1  708 ? -1.791  -9.750  -25.818 1.000 19.220  0 763  VAL   A N    1 ? 1 
ATOM   10935 C  CA   . VAL   A  1  708 ? -2.575  -10.345 -24.745 1.000 21.072  0 763  VAL   A CA   1 ? 1 
ATOM   10936 C  C    . VAL   A  1  708 ? -2.384  -9.605  -23.415 1.000 23.325  0 763  VAL   A C    1 ? 1 
ATOM   10937 O  O    . VAL   A  1  708 ? -1.264  -9.566  -22.888 1.000 24.125  0 763  VAL   A O    1 ? 1 
ATOM   10938 C  CB   . VAL   A  1  708 ? -2.180  -11.811 -24.552 1.000 18.951  0 763  VAL   A CB   1 ? 1 
ATOM   10939 C  CG1  . VAL   A  1  708 ? -2.982  -12.440 -23.422 1.000 20.889  0 763  VAL   A CG1  1 ? 1 
ATOM   10940 C  CG2  . VAL   A  1  708 ? -2.310  -12.613 -25.841 1.000 26.104  0 763  VAL   A CG2  1 ? 1 
ATOM   10941 H  H    . VAL   A  1  708 ? -0.950  -10.073 -25.975 1.000 19.450  0 763  VAL   A H    1 c 1 
ATOM   10942 H  HA   . VAL   A  1  708 ? -3.514  -10.311 -24.993 1.000 20.707  0 763  VAL   A HA   1 c 1 
ATOM   10943 H  HB   . VAL   A  1  708 ? -1.228  -11.827 -24.288 1.000 20.770  0 763  VAL   A HB   1 c 1 
ATOM   10944 H  HG11 . VAL   A  1  708 ? -3.913  -12.162 -23.490 1.000 20.150  0 763  VAL   A HG11 1 c 1 
ATOM   10945 H  HG12 . VAL   A  1  708 ? -2.620  -12.154 -22.566 1.000 19.831  0 763  VAL   A HG12 1 c 1 
ATOM   10946 H  HG13 . VAL   A  1  708 ? -2.929  -13.410 -23.486 1.000 20.440  0 763  VAL   A HG13 1 c 1 
ATOM   10947 H  HG21 . VAL   A  1  708 ? -2.124  -13.551 -25.661 1.000 23.895  0 763  VAL   A HG21 1 c 1 
ATOM   10948 H  HG22 . VAL   A  1  708 ? -1.675  -12.279 -26.498 1.000 23.984  0 763  VAL   A HG22 1 c 1 
ATOM   10949 H  HG23 . VAL   A  1  708 ? -3.214  -12.523 -26.190 1.000 23.888  0 763  VAL   A HG23 1 c 1 
ATOM   10950 N  N    . PRO   A  1  709 ? -3.453  -9.037  -22.804 1.000 24.270  0 764  PRO   A N    1 ? 1 
ATOM   10951 C  CA   . PRO   A  1  709 ? -3.364  -8.480  -21.450 1.000 23.398  0 764  PRO   A CA   1 ? 1 
ATOM   10952 C  C    . PRO   A  1  709 ? -2.935  -9.485  -20.385 1.000 21.705  0 764  PRO   A C    1 ? 1 
ATOM   10953 O  O    . PRO   A  1  709 ? -3.251  -10.677 -20.458 1.000 21.241  0 764  PRO   A O    1 ? 1 
ATOM   10954 C  CB   . PRO   A  1  709 ? -4.773  -7.966  -21.179 1.000 23.467  0 764  PRO   A CB   1 ? 1 
ATOM   10955 C  CG   . PRO   A  1  709 ? -5.342  -7.687  -22.598 1.000 22.328  0 764  PRO   A CG   1 ? 1 
ATOM   10956 C  CD   . PRO   A  1  709 ? -4.793  -8.853  -23.391 1.000 23.130  0 764  PRO   A CD   1 ? 1 
ATOM   10957 H  HA   . PRO   A  1  709 ? -2.737  -7.714  -21.458 1.000 23.046  0 764  PRO   A HA   1 c 1 
ATOM   10958 H  HB2  . PRO   A  1  709 ? -5.312  -8.640  -20.712 1.000 22.984  0 764  PRO   A HB2  1 c 1 
ATOM   10959 H  HB3  . PRO   A  1  709 ? -4.753  -7.145  -20.642 1.000 22.770  0 764  PRO   A HB3  1 c 1 
ATOM   10960 H  HG2  . PRO   A  1  709 ? -6.319  -7.683  -22.598 1.000 22.798  0 764  PRO   A HG2  1 c 1 
ATOM   10961 H  HG3  . PRO   A  1  709 ? -5.015  -6.834  -22.950 1.000 22.791  0 764  PRO   A HG3  1 c 1 
ATOM   10962 H  HD2  . PRO   A  1  709 ? -5.341  -9.651  -23.275 1.000 23.408  0 764  PRO   A HD2  1 c 1 
ATOM   10963 H  HD3  . PRO   A  1  709 ? -4.738  -8.636  -24.340 1.000 23.572  0 764  PRO   A HD3  1 c 1 
ATOM   10964 N  N    . THR   A  1  710 ? -2.191  -8.978  -19.404 1.000 17.823  0 765  THR   A N    1 ? 1 
ATOM   10965 C  CA   . THR   A  1  710 ? -1.758  -9.772  -18.260 1.000 16.758  0 765  THR   A CA   1 ? 1 
ATOM   10966 C  C    . THR   A  1  710 ? -2.863  -9.669  -17.227 1.000 16.284  0 765  THR   A C    1 ? 1 
ATOM   10967 O  O    . THR   A  1  710 ? -3.022  -10.541 -16.386 1.000 16.695  0 765  THR   A O    1 ? 1 
ATOM   10968 C  CB   . THR   A  1  710 ? -0.456  -9.268  -17.671 1.000 18.368  0 765  THR   A CB   1 ? 1 
ATOM   10969 O  OG1  . THR   A  1  710 ? -0.611  -7.872  -17.291 1.000 17.011  0 765  THR   A OG1  1 ? 1 
ATOM   10970 C  CG2  . THR   A  1  710 ? 0.689   -9.430  -18.633 1.000 30.157  0 765  THR   A CG2  1 ? 1 
ATOM   10971 H  H    . THR   A  1  710 ? -1.926  -8.105  -19.453 1.000 18.321  0 765  THR   A H    1 c 1 
ATOM   10972 H  HA   . THR   A  1  710 ? -1.652  -10.711 -18.538 1.000 17.482  0 765  THR   A HA   1 c 1 
ATOM   10973 H  HB   . THR   A  1  710 ? -0.263  -9.796  -16.860 1.000 19.213  0 765  THR   A HB   1 c 1 
ATOM   10974 H  HG1  . THR   A  1  710 ? -0.836  -7.419  -18.003 0.000 9.060   0 765  THR   A HG1  1 c 1 
ATOM   10975 H  HG21 . THR   A  1  710 ? 1.510   -9.111  -18.218 1.000 25.701  0 765  THR   A HG21 1 c 1 
ATOM   10976 H  HG22 . THR   A  1  710 ? 0.512   -8.914  -19.440 1.000 25.927  0 765  THR   A HG22 1 c 1 
ATOM   10977 H  HG23 . THR   A  1  710 ? 0.788   -10.371 -18.866 1.000 26.041  0 765  THR   A HG23 1 c 1 
ATOM   10978 N  N    . HIS   A  1  711 ? -3.616  -8.576  -17.305 1.000 18.250  0 766  HIS   A N    1 ? 1 
ATOM   10979 C  CA   . HIS   A  1  711 ? -4.704  -8.347  -16.372 1.000 16.082  0 766  HIS   A CA   1 ? 1 
ATOM   10980 C  C    . HIS   A  1  711 ? -5.873  -7.577  -16.992 1.000 16.023  0 766  HIS   A C    1 ? 1 
ATOM   10981 O  O    . HIS   A  1  711 ? -5.717  -6.945  -18.028 1.000 17.192  0 766  HIS   A O    1 ? 1 
ATOM   10982 C  CB   . HIS   A  1  711 ? -4.180  -7.525  -15.159 1.000 16.123  0 766  HIS   A CB   1 ? 1 
ATOM   10983 C  CG   . HIS   A  1  711 ? -3.066  -8.172  -14.395 1.000 15.048  0 766  HIS   A CG   1 ? 1 
ATOM   10984 N  ND1  . HIS   A  1  711 ? -1.752  -8.126  -14.864 1.000 15.593  0 766  HIS   A ND1  1 ? 1 
ATOM   10985 C  CD2  . HIS   A  1  711 ? -3.110  -8.848  -13.219 1.000 13.443  0 766  HIS   A CD2  1 ? 1 
ATOM   10986 C  CE1  . HIS   A  1  711 ? -1.045  -8.813  -13.966 1.000 18.490  0 766  HIS   A CE1  1 ? 1 
ATOM   10987 N  NE2  . HIS   A  1  711 ? -1.843  -9.252  -12.953 1.000 17.713  0 766  HIS   A NE2  1 ? 1 
ATOM   10988 H  H    . HIS   A  1  711 ? -3.446  -7.946  -17.943 1.000 17.370  0 766  HIS   A H    1 c 1 
ATOM   10989 H  HA   . HIS   A  1  711 ? -5.027  -9.220  -16.050 1.000 16.542  0 766  HIS   A HA   1 c 1 
ATOM   10990 H  HB2  . HIS   A  1  711 ? -3.869  -6.657  -15.482 1.000 15.772  0 766  HIS   A HB2  1 c 1 
ATOM   10991 H  HB3  . HIS   A  1  711 ? -4.926  -7.366  -14.545 1.000 15.664  0 766  HIS   A HB3  1 c 1 
ATOM   10992 H  HD1  . HIS   A  1  711 ? -1.503  -7.746  -15.580 0.000 8.640   0 766  HIS   A HD1  1 c 1 
ATOM   10993 H  HD2  . HIS   A  1  711 ? -3.880  -9.018  -12.698 1.000 14.610  0 766  HIS   A HD2  1 c 1 
ATOM   10994 H  HE1  . HIS   A  1  711 ? -0.113  -8.950  -14.010 1.000 17.676  0 766  HIS   A HE1  1 c 1 
ATOM   10995 H  HE2  . HIS   A  1  711 ? -1.547  -9.734  -12.270 0.000 12.040  0 766  HIS   A HE2  1 c 1 
ATOM   10996 N  N    . TYR   A  1  712 ? -7.010  -7.587  -16.302 1.000 14.434  0 767  TYR   A N    1 ? 1 
ATOM   10997 C  CA   . TYR   A  1  712 ? -8.123  -6.727  -16.624 1.000 17.252  0 767  TYR   A CA   1 ? 1 
ATOM   10998 C  C    . TYR   A  1  712 ? -8.565  -5.998  -15.365 1.000 17.060  0 767  TYR   A C    1 ? 1 
ATOM   10999 O  O    . TYR   A  1  712 ? -8.752  -6.631  -14.334 1.000 19.985  0 767  TYR   A O    1 ? 1 
ATOM   11000 C  CB   . TYR   A  1  712 ? -9.297  -7.525  -17.250 1.000 21.065  0 767  TYR   A CB   1 ? 1 
ATOM   11001 C  CG   . TYR   A  1  712 ? -9.030  -7.913  -18.695 1.000 21.000  0 767  TYR   A CG   1 ? 1 
ATOM   11002 C  CD1  . TYR   A  1  712 ? -9.155  -6.985  -19.724 1.000 21.025  0 767  TYR   A CD1  1 ? 1 
ATOM   11003 C  CD2  . TYR   A  1  712 ? -8.639  -9.201  -19.028 1.000 22.631  0 767  TYR   A CD2  1 ? 1 
ATOM   11004 C  CE1  . TYR   A  1  712 ? -8.894  -7.333  -21.045 1.000 21.089  0 767  TYR   A CE1  1 ? 1 
ATOM   11005 C  CE2  . TYR   A  1  712 ? -8.379  -9.555  -20.341 1.000 21.789  0 767  TYR   A CE2  1 ? 1 
ATOM   11006 C  CZ   . TYR   A  1  712 ? -8.511  -8.616  -21.348 1.000 21.663  0 767  TYR   A CZ   1 ? 1 
ATOM   11007 O  OH   . TYR   A  1  712 ? -8.262  -8.956  -22.648 1.000 21.172  0 767  TYR   A OH   1 ? 1 
ATOM   11008 H  H    . TYR   A  1  712 ? -7.092  -8.160  -15.595 1.000 15.263  0 767  TYR   A H    1 c 1 
ATOM   11009 H  HA   . TYR   A  1  712 ? -7.820  -6.053  -17.281 1.000 17.253  0 767  TYR   A HA   1 c 1 
ATOM   11010 H  HB2  . TYR   A  1  712 ? -9.447  -8.335  -16.720 1.000 20.102  0 767  TYR   A HB2  1 c 1 
ATOM   11011 H  HB3  . TYR   A  1  712 ? -10.110 -6.978  -17.207 1.000 20.161  0 767  TYR   A HB3  1 c 1 
ATOM   11012 H  HD1  . TYR   A  1  712 ? -9.414  -6.101  -19.522 1.000 20.899  0 767  TYR   A HD1  1 c 1 
ATOM   11013 H  HD2  . TYR   A  1  712 ? -8.543  -9.847  -18.348 1.000 21.837  0 767  TYR   A HD2  1 c 1 
ATOM   11014 H  HE1  . TYR   A  1  712 ? -8.986  -6.694  -21.732 1.000 21.460  0 767  TYR   A HE1  1 c 1 
ATOM   11015 H  HE2  . TYR   A  1  712 ? -8.116  -10.437 -20.550 1.000 22.144  0 767  TYR   A HE2  1 c 1 
ATOM   11016 H  HH   . TYR   A  1  712 ? -8.356  -8.391  -23.265 0.000 11.490  0 767  TYR   A HH   1 c 1 
ATOM   11017 N  N    . TYR   A  1  713 ? -8.735  -4.668  -15.474 1.000 15.278  0 768  TYR   A N    1 ? 1 
ATOM   11018 C  CA   . TYR   A  1  713 ? -9.159  -3.828  -14.377 1.000 15.068  0 768  TYR   A CA   1 ? 1 
ATOM   11019 C  C    . TYR   A  1  713 ? -10.609 -3.413  -14.523 1.000 17.957  0 768  TYR   A C    1 ? 1 
ATOM   11020 O  O    . TYR   A  1  713 ? -11.139 -3.388  -15.625 1.000 20.438  0 768  TYR   A O    1 ? 1 
ATOM   11021 C  CB   . TYR   A  1  713 ? -8.298  -2.560  -14.254 1.000 14.913  0 768  TYR   A CB   1 ? 1 
ATOM   11022 C  CG   . TYR   A  1  713 ? -8.531  -1.489  -15.305 1.000 17.774  0 768  TYR   A CG   1 ? 1 
ATOM   11023 C  CD1  . TYR   A  1  713 ? -9.456  -0.478  -15.102 1.000 17.249  0 768  TYR   A CD1  1 ? 1 
ATOM   11024 C  CD2  . TYR   A  1  713 ? -7.805  -1.476  -16.490 1.000 15.430  0 768  TYR   A CD2  1 ? 1 
ATOM   11025 C  CE1  . TYR   A  1  713 ? -9.668  0.519   -16.054 1.000 18.781  0 768  TYR   A CE1  1 ? 1 
ATOM   11026 C  CE2  . TYR   A  1  713 ? -7.986  -0.468  -17.434 1.000 18.164  0 768  TYR   A CE2  1 ? 1 
ATOM   11027 C  CZ   . TYR   A  1  713 ? -8.936  0.517   -17.224 1.000 17.171  0 768  TYR   A CZ   1 ? 1 
ATOM   11028 O  OH   . TYR   A  1  713 ? -9.116  1.513   -18.143 1.000 17.509  0 768  TYR   A OH   1 ? 1 
ATOM   11029 H  H    . TYR   A  1  713 ? -8.576  -4.272  -16.282 1.000 15.850  0 768  TYR   A H    1 c 1 
ATOM   11030 H  HA   . TYR   A  1  713 ? -9.070  -4.344  -13.539 1.000 15.388  0 768  TYR   A HA   1 c 1 
ATOM   11031 H  HB2  . TYR   A  1  713 ? -8.461  -2.168  -13.371 1.000 15.262  0 768  TYR   A HB2  1 c 1 
ATOM   11032 H  HB3  . TYR   A  1  713 ? -7.357  -2.827  -14.287 1.000 15.343  0 768  TYR   A HB3  1 c 1 
ATOM   11033 H  HD1  . TYR   A  1  713 ? -9.964  -0.470  -14.307 1.000 17.529  0 768  TYR   A HD1  1 c 1 
ATOM   11034 H  HD2  . TYR   A  1  713 ? -7.155  -2.141  -16.643 1.000 16.490  0 768  TYR   A HD2  1 c 1 
ATOM   11035 H  HE1  . TYR   A  1  713 ? -10.302 1.199   -15.895 1.000 18.133  0 768  TYR   A HE1  1 c 1 
ATOM   11036 H  HE2  . TYR   A  1  713 ? -7.487  -0.476  -18.234 1.000 17.480  0 768  TYR   A HE2  1 c 1 
ATOM   11037 H  HH   . TYR   A  1  713 ? -9.686  2.144   -17.993 0.000 9.960   0 768  TYR   A HH   1 c 1 
ATOM   11038 N  N    . SER   A  1  714 ? -11.206 -3.001  -13.409 1.000 15.080  0 769  SER   A N    1 ? 1 
ATOM   11039 C  CA   . SER   A  1  714 ? -12.449 -2.258  -13.414 1.000 19.124  0 769  SER   A CA   1 ? 1 
ATOM   11040 C  C    . SER   A  1  714 ? -12.455 -1.297  -12.234 1.000 15.867  0 769  SER   A C    1 ? 1 
ATOM   11041 O  O    . SER   A  1  714 ? -12.008 -1.665  -11.144 1.000 16.746  0 769  SER   A O    1 ? 1 
ATOM   11042 C  CB   . SER   A  1  714 ? -13.665 -3.183  -13.349 1.000 19.348  0 769  SER   A CB   1 ? 1 
ATOM   11043 O  OG   . SER   A  1  714 ? -13.797 -3.903  -14.567 1.000 26.937  0 769  SER   A OG   1 ? 1 
ATOM   11044 H  H    . SER   A  1  714 ? -10.819 -3.196  -12.604 1.000 16.207  0 769  SER   A H    1 c 1 
ATOM   11045 H  HA   . SER   A  1  714 ? -12.492 -1.733  -14.252 1.000 17.803  0 769  SER   A HA   1 c 1 
ATOM   11046 H  HB2  . SER   A  1  714 ? -13.560 -3.809  -12.603 1.000 20.788  0 769  SER   A HB2  1 c 1 
ATOM   11047 H  HB3  . SER   A  1  714 ? -14.477 -2.649  -13.192 1.000 21.010  0 769  SER   A HB3  1 c 1 
ATOM   11048 H  HG   . SER   A  1  714 ? -13.364 -4.630  -14.501 0.000 18.900  0 769  SER   A HG   1 c 1 
ATOM   11049 N  N    . ILE   A  1  715 ? -12.941 -0.080  -12.485 1.000 13.862  0 770  ILE   A N    1 ? 1 
ATOM   11050 C  CA   . ILE   A  1  715 ? -13.152 0.937   -11.472 1.000 17.140  0 770  ILE   A CA   1 ? 1 
ATOM   11051 C  C    . ILE   A  1  715 ? -14.664 1.147   -11.389 1.000 20.343  0 770  ILE   A C    1 ? 1 
ATOM   11052 O  O    . ILE   A  1  715 ? -15.290 1.558   -12.368 1.000 21.993  0 770  ILE   A O    1 ? 1 
ATOM   11053 C  CB   . ILE   A  1  715 ? -12.442 2.242   -11.796 1.000 19.472  0 770  ILE   A CB   1 ? 1 
ATOM   11054 C  CG1  . ILE   A  1  715 ? -10.923 2.018   -11.973 1.000 19.638  0 770  ILE   A CG1  1 ? 1 
ATOM   11055 C  CG2  . ILE   A  1  715 ? -12.772 3.343   -10.759 1.000 17.120  0 770  ILE   A CG2  1 ? 1 
ATOM   11056 C  CD1  . ILE   A  1  715 ? -10.240 3.115   -12.685 1.000 19.801  0 770  ILE   A CD1  1 ? 1 
ATOM   11057 H  H    . ILE   A  1  715 ? -13.156 0.128   -13.348 1.000 15.308  0 770  ILE   A H    1 c 1 
ATOM   11058 H  HA   . ILE   A  1  715 ? -12.828 0.607   -10.616 1.000 16.903  0 770  ILE   A HA   1 c 1 
ATOM   11059 H  HB   . ILE   A  1  715 ? -12.791 2.551   -12.669 1.000 18.913  0 770  ILE   A HB   1 c 1 
ATOM   11060 H  HG12 . ILE   A  1  715 ? -10.514 1.914   -11.088 1.000 19.274  0 770  ILE   A HG12 1 c 1 
ATOM   11061 H  HG13 . ILE   A  1  715 ? -10.780 1.185   -12.471 1.000 19.491  0 770  ILE   A HG13 1 c 1 
ATOM   11062 H  HG21 . ILE   A  1  715 ? -12.602 3.007   -9.862  1.000 17.546  0 770  ILE   A HG21 1 c 1 
ATOM   11063 H  HG22 . ILE   A  1  715 ? -13.708 3.597   -10.837 1.000 18.059  0 770  ILE   A HG22 1 c 1 
ATOM   11064 H  HG23 . ILE   A  1  715 ? -12.214 4.123   -10.922 1.000 17.752  0 770  ILE   A HG23 1 c 1 
ATOM   11065 H  HD11 . ILE   A  1  715 ? -10.292 3.930   -12.156 1.000 19.746  0 770  ILE   A HD11 1 c 1 
ATOM   11066 H  HD12 . ILE   A  1  715 ? -10.669 3.262   -13.546 1.000 20.060  0 770  ILE   A HD12 1 c 1 
ATOM   11067 H  HD13 . ILE   A  1  715 ? -9.306  2.881   -12.825 1.000 19.613  0 770  ILE   A HD13 1 c 1 
ATOM   11068 N  N    . ILE   A  1  716 ? -15.224 0.900   -10.200 1.000 14.468  0 771  ILE   A N    1 ? 1 
ATOM   11069 C  CA   . ILE   A  1  716 ? -16.639 1.040   -9.934  1.000 16.222  0 771  ILE   A CA   1 ? 1 
ATOM   11070 C  C    . ILE   A  1  716 ? -16.869 2.187   -8.967  1.000 21.530  0 771  ILE   A C    1 ? 1 
ATOM   11071 O  O    . ILE   A  1  716 ? -16.566 2.079   -7.767  1.000 18.838  0 771  ILE   A O    1 ? 1 
ATOM   11072 C  CB   . ILE   A  1  716 ? -17.190 -0.284  -9.382  1.000 16.579  0 771  ILE   A CB   1 ? 1 
ATOM   11073 C  CG1  . ILE   A  1  716 ? -16.747 -1.447  -10.292 1.000 16.716  0 771  ILE   A CG1  1 ? 1 
ATOM   11074 C  CG2  . ILE   A  1  716 ? -18.681 -0.194  -9.217  1.000 19.535  0 771  ILE   A CG2  1 ? 1 
ATOM   11075 C  CD1  . ILE   A  1  716 ? -17.052 -2.835  -9.712  1.000 19.260  0 771  ILE   A CD1  1 ? 1 
ATOM   11076 H  H    . ILE   A  1  716 ? -14.685 0.627   -9.515  1.000 15.662  0 771  ILE   A H    1 c 1 
ATOM   11077 H  HA   . ILE   A  1  716 ? -17.095 1.234   -10.769 1.000 17.160  0 771  ILE   A HA   1 c 1 
ATOM   11078 H  HB   . ILE   A  1  716 ? -16.791 -0.430  -8.489  1.000 16.733  0 771  ILE   A HB   1 c 1 
ATOM   11079 H  HG12 . ILE   A  1  716 ? -17.201 -1.361  -11.158 1.000 17.480  0 771  ILE   A HG12 1 c 1 
ATOM   11080 H  HG13 . ILE   A  1  716 ? -15.782 -1.380  -10.449 1.000 16.896  0 771  ILE   A HG13 1 c 1 
ATOM   11081 H  HG21 . ILE   A  1  716 ? -19.095 -0.050  -10.085 1.000 19.026  0 771  ILE   A HG21 1 c 1 
ATOM   11082 H  HG22 . ILE   A  1  716 ? -18.904 0.546   -8.627  1.000 18.815  0 771  ILE   A HG22 1 c 1 
ATOM   11083 H  HG23 . ILE   A  1  716 ? -19.018 -1.022  -8.833  1.000 18.826  0 771  ILE   A HG23 1 c 1 
ATOM   11084 H  HD11 . ILE   A  1  716 ? -18.014 -2.956  -9.646  1.000 18.810  0 771  ILE   A HD11 1 c 1 
ATOM   11085 H  HD12 . ILE   A  1  716 ? -16.655 -2.913  -8.827  1.000 18.221  0 771  ILE   A HD12 1 c 1 
ATOM   11086 H  HD13 . ILE   A  1  716 ? -16.680 -3.520  -10.294 1.000 18.434  0 771  ILE   A HD13 1 c 1 
ATOM   11087 N  N    . THR   A  1  717 ? -17.469 3.249   -9.494  1.000 17.003  0 772  THR   A N    1 ? 1 
ATOM   11088 C  CA   . THR   A  1  717 ? -17.714 4.452   -8.726  1.000 23.791  0 772  THR   A CA   1 ? 1 
ATOM   11089 C  C    . THR   A  1  717 ? -19.210 4.704   -8.541  1.000 24.269  0 772  THR   A C    1 ? 1 
ATOM   11090 O  O    . THR   A  1  717 ? -20.022 4.427   -9.433  1.000 20.050  0 772  THR   A O    1 ? 1 
ATOM   11091 C  CB   . THR   A  1  717 ? -17.063 5.652   -9.429  1.000 21.203  0 772  THR   A CB   1 ? 1 
ATOM   11092 O  OG1  . THR   A  1  717 ? -15.753 5.240   -9.885  1.000 15.716  0 772  THR   A OG1  1 ? 1 
ATOM   11093 C  CG2  . THR   A  1  717 ? -17.025 6.887   -8.545  1.000 20.061  0 772  THR   A CG2  1 ? 1 
ATOM   11094 H  H    . THR   A  1  717 ? -17.738 3.226   -10.367 1.000 19.519  0 772  THR   A H    1 c 1 
ATOM   11095 H  HA   . THR   A  1  717 ? -17.299 4.343   -7.843  1.000 21.354  0 772  THR   A HA   1 c 1 
ATOM   11096 H  HB   . THR   A  1  717 ? -17.610 5.863   -10.223 1.000 20.561  0 772  THR   A HB   1 c 1 
ATOM   11097 H  HG1  . THR   A  1  717 ? -15.285 5.000   -9.218  0.000 7.780   0 772  THR   A HG1  1 c 1 
ATOM   11098 H  HG21 . THR   A  1  717 ? -16.574 7.610   -9.016  1.000 20.529  0 772  THR   A HG21 1 c 1 
ATOM   11099 H  HG22 . THR   A  1  717 ? -16.541 6.685   -7.724  1.000 20.129  0 772  THR   A HG22 1 c 1 
ATOM   11100 H  HG23 . THR   A  1  717 ? -17.932 7.162   -8.326  1.000 20.822  0 772  THR   A HG23 1 c 1 
ATOM   11101 N  N    . SER   A  1  718 ? -19.542 5.262   -7.370  1.000 18.083  0 773  SER   A N    1 ? 1 
ATOM   11102 C  CA   . SER   A  1  718 ? -20.893 5.674   -7.033  1.000 20.060  0 773  SER   A CA   1 ? 1 
ATOM   11103 C  C    . SER   A  1  718 ? -20.833 6.819   -6.019  1.000 27.242  0 773  SER   A C    1 ? 1 
ATOM   11104 O  O    . SER   A  1  718 ? -19.744 7.273   -5.616  1.000 23.492  0 773  SER   A O    1 ? 1 
ATOM   11105 C  CB   . SER   A  1  718 ? -21.735 4.487   -6.534  1.000 24.309  0 773  SER   A CB   1 ? 1 
ATOM   11106 O  OG   . SER   A  1  718 ? -21.193 3.978   -5.341  1.000 19.790  0 773  SER   A OG   1 ? 1 
ATOM   11107 H  H    . SER   A  1  718 ? -18.885 5.391   -6.747  1.000 19.424  0 773  SER   A H    1 c 1 
ATOM   11108 H  HA   . SER   A  1  718 ? -21.317 6.025   -7.862  1.000 21.848  0 773  SER   A HA   1 c 1 
ATOM   11109 H  HB2  . SER   A  1  718 ? -22.660 4.779   -6.379  1.000 22.794  0 773  SER   A HB2  1 c 1 
ATOM   11110 H  HB3  . SER   A  1  718 ? -21.745 3.780   -7.219  1.000 22.252  0 773  SER   A HB3  1 c 1 
ATOM   11111 H  HG   . SER   A  1  718 ? -21.547 4.388   -4.689  0.000 10.510  0 773  SER   A HG   1 c 1 
ATOM   11112 N  N    . CYS   A  1  719 ? -22.014 7.311   -5.631  1.000 23.197  0 774  CYS   A N    1 ? 1 
ATOM   11113 C  CA   . CYS   A  1  719 ? -22.091 8.388   -4.653  1.000 26.501  0 774  CYS   A CA   1 ? 1 
ATOM   11114 C  C    . CYS   A  1  719 ? -21.878 7.836   -3.242  1.000 22.514  0 774  CYS   A C    1 ? 1 
ATOM   11115 O  O    . CYS   A  1  719 ? -22.525 6.875   -2.838  1.000 27.643  0 774  CYS   A O    1 ? 1 
ATOM   11116 C  CB   . CYS   A  1  719 ? -23.436 9.090   -4.791  1.000 24.605  0 774  CYS   A CB   1 ? 1 
ATOM   11117 S  SG   . CYS   A  1  719 ? -23.447 10.758  -4.153  1.000 28.608  0 774  CYS   A SG   1 ? 1 
ATOM   11118 H  H    . CYS   A  1  719 ? -22.787 6.977   -5.986  1.000 25.164  0 774  CYS   A H    1 c 1 
ATOM   11119 H  HA   . CYS   A  1  719 ? -21.377 9.033   -4.852  1.000 24.467  0 774  CYS   A HA   1 c 1 
ATOM   11120 H  HB2  . CYS   A  1  719 ? -23.687 9.118   -5.736  1.000 26.082  0 774  CYS   A HB2  1 c 1 
ATOM   11121 H  HB3  . CYS   A  1  719 ? -24.117 8.572   -4.316  1.000 26.073  0 774  CYS   A HB3  1 c 1 
ATOM   11122 N  N    . LEU   A  1  720 ? -21.011 8.474   -2.463  1.000 20.600  0 775  LEU   A N    1 ? 1 
ATOM   11123 C  CA   . LEU   A  1  720 ? -20.806 8.082   -1.073  1.000 28.784  0 775  LEU   A CA   1 ? 1 
ATOM   11124 C  C    . LEU   A  1  720 ? -22.123 8.232   -0.316  1.000 26.606  0 775  LEU   A C    1 ? 1 
ATOM   11125 O  O    . LEU   A  1  720 ? -22.423 7.455   0.572   1.000 21.981  0 775  LEU   A O    1 ? 1 
ATOM   11126 C  CB   . LEU   A  1  720 ? -19.683 8.918   -0.408  1.000 24.544  0 775  LEU   A CB   1 ? 1 
ATOM   11127 C  CG   . LEU   A  1  720 ? -19.398 8.618   1.056   1.000 34.383  0 775  LEU   A CG   1 ? 1 
ATOM   11128 C  CD1  . LEU   A  1  720 ? -18.820 7.232   1.267   1.000 32.000  0 775  LEU   A CD1  1 ? 1 
ATOM   11129 C  CD2  . LEU   A  1  720 ? -18.452 9.645   1.632   1.000 32.343  0 775  LEU   A CD2  1 ? 1 
ATOM   11130 H  H    . LEU   A  1  720 ? -20.531 9.175   -2.799  1.000 22.507  0 775  LEU   A H    1 c 1 
ATOM   11131 H  HA   . LEU   A  1  720 ? -20.548 7.132   -1.061  1.000 25.322  0 775  LEU   A HA   1 c 1 
ATOM   11132 H  HB2  . LEU   A  1  720 ? -18.858 8.779   -0.916  1.000 26.963  0 775  LEU   A HB2  1 c 1 
ATOM   11133 H  HB3  . LEU   A  1  720 ? -19.919 9.863   -0.488  1.000 27.671  0 775  LEU   A HB3  1 c 1 
ATOM   11134 H  HG   . LEU   A  1  720 ? -20.249 8.675   1.555   1.000 31.764  0 775  LEU   A HG   1 c 1 
ATOM   11135 H  HD11 . LEU   A  1  720 ? -18.786 7.037   2.220   1.000 32.530  0 775  LEU   A HD11 1 c 1 
ATOM   11136 H  HD12 . LEU   A  1  720 ? -17.921 7.195   0.897   1.000 32.132  0 775  LEU   A HD12 1 c 1 
ATOM   11137 H  HD13 . LEU   A  1  720 ? -19.380 6.573   0.822   1.000 32.571  0 775  LEU   A HD13 1 c 1 
ATOM   11138 H  HD21 . LEU   A  1  720 ? -18.876 10.520  1.620   1.000 33.239  0 775  LEU   A HD21 1 c 1 
ATOM   11139 H  HD22 . LEU   A  1  720 ? -17.638 9.672   1.100   1.000 32.528  0 775  LEU   A HD22 1 c 1 
ATOM   11140 H  HD23 . LEU   A  1  720 ? -18.231 9.405   2.549   1.000 32.783  0 775  LEU   A HD23 1 c 1 
ATOM   11141 N  N    . ASP   A  1  721 ? -22.916 9.234   -0.689  1.000 21.710  0 776  ASP   A N    1 ? 1 
ATOM   11142 C  CA   . ASP   A  1  721 ? -24.251 9.386   -0.166  1.000 21.935  0 776  ASP   A CA   1 ? 1 
ATOM   11143 C  C    . ASP   A  1  721 ? -25.156 8.528   -1.050  1.000 21.781  0 776  ASP   A C    1 ? 1 
ATOM   11144 O  O    . ASP   A  1  721 ? -25.600 8.953   -2.124  1.000 23.638  0 776  ASP   A O    1 ? 1 
ATOM   11145 C  CB   . ASP   A  1  721 ? -24.659 10.849  -0.152  1.000 22.728  0 776  ASP   A CB   1 ? 1 
ATOM   11146 C  CG   . ASP   A  1  721 ? -26.081 11.050  0.200   1.000 22.870  0 776  ASP   A CG   1 ? 1 
ATOM   11147 O  OD1  . ASP   A  1  721 ? -26.703 10.088  0.626   1.000 28.058  0 776  ASP   A OD1  1 ? 1 
ATOM   11148 O  OD2  . ASP   A  1  721 ? -26.611 12.162  -0.049  1.000 26.177  0 776  ASP   A OD2  1 ? 1 
ATOM   11149 H  H    . ASP   A  1  721 ? -22.605 9.854   -1.284  1.000 22.685  0 776  ASP   A H    1 c 1 
ATOM   11150 H  HA   . ASP   A  1  721 ? -24.275 9.041   0.757   1.000 22.076  0 776  ASP   A HA   1 c 1 
ATOM   11151 H  HB2  . ASP   A  1  721 ? -24.107 11.331  0.497   1.000 22.430  0 776  ASP   A HB2  1 c 1 
ATOM   11152 H  HB3  . ASP   A  1  721 ? -24.501 11.236  -1.038  1.000 22.516  0 776  ASP   A HB3  1 c 1 
ATOM   11153 N  N    . PHE   A  1  722 ? -25.417 7.302   -0.584  1.000 28.705  0 777  PHE   A N    1 ? 1 
ATOM   11154 C  CA   . PHE   A  1  722 ? -26.130 6.302   -1.368  1.000 26.972  0 777  PHE   A CA   1 ? 1 
ATOM   11155 C  C    . PHE   A  1  722 ? -27.576 6.690   -1.657  1.000 23.456  0 777  PHE   A C    1 ? 1 
ATOM   11156 O  O    . PHE   A  1  722 ? -28.217 6.039   -2.472  1.000 28.307  0 777  PHE   A O    1 ? 1 
ATOM   11157 C  CB   . PHE   A  1  722 ? -26.113 4.913   -0.661  1.000 28.283  0 777  PHE   A CB   1 ? 1 
ATOM   11158 C  CG   . PHE   A  1  722 ? -26.701 4.913   0.738   1.000 24.533  0 777  PHE   A CG   1 ? 1 
ATOM   11159 C  CD1  . PHE   A  1  722 ? -28.068 4.930   0.933   1.000 24.894  0 777  PHE   A CD1  1 ? 1 
ATOM   11160 C  CD2  . PHE   A  1  722 ? -25.875 4.905   1.856   1.000 31.084  0 777  PHE   A CD2  1 ? 1 
ATOM   11161 C  CE1  . PHE   A  1  722 ? -28.598 4.959   2.219   1.000 30.310  0 777  PHE   A CE1  1 ? 1 
ATOM   11162 C  CE2  . PHE   A  1  722 ? -26.412 4.870   3.134   1.000 28.376  0 777  PHE   A CE2  1 ? 1 
ATOM   11163 C  CZ   . PHE   A  1  722 ? -27.765 4.908   3.306   1.000 32.100  0 777  PHE   A CZ   1 ? 1 
ATOM   11164 H  H    . PHE   A  1  722 ? -25.134 7.079   0.256   1.000 26.043  0 777  PHE   A H    1 c 1 
ATOM   11165 H  HA   . PHE   A  1  722 ? -25.663 6.208   -2.237  1.000 26.321  0 777  PHE   A HA   1 c 1 
ATOM   11166 H  HB2  . PHE   A  1  722 ? -26.613 4.278   -1.214  1.000 27.067  0 777  PHE   A HB2  1 c 1 
ATOM   11167 H  HB3  . PHE   A  1  722 ? -25.185 4.602   -0.613  1.000 26.349  0 777  PHE   A HB3  1 c 1 
ATOM   11168 H  HD1  . PHE   A  1  722 ? -28.646 4.960   0.188   1.000 26.455  0 777  PHE   A HD1  1 c 1 
ATOM   11169 H  HD2  . PHE   A  1  722 ? -24.939 4.868   1.741   1.000 27.898  0 777  PHE   A HD2  1 c 1 
ATOM   11170 H  HE1  . PHE   A  1  722 ? -29.534 4.960   2.342   1.000 30.068  0 777  PHE   A HE1  1 c 1 
ATOM   11171 H  HE2  . PHE   A  1  722 ? -25.840 4.867   3.885   1.000 29.381  0 777  PHE   A HE2  1 c 1 
ATOM   11172 H  HZ   . PHE   A  1  722 ? -28.128 4.913   4.177   1.000 31.108  0 777  PHE   A HZ   1 c 1 
ATOM   11173 N  N    . THR   A  1  723 ? -28.098 7.729   -0.991  1.000 23.557  0 778  THR   A N    1 ? 1 
ATOM   11174 C  CA   . THR   A  1  723 ? -29.449 8.182   -1.266  1.000 25.678  0 778  THR   A CA   1 ? 1 
ATOM   11175 C  C    . THR   A  1  723 ? -29.513 8.916   -2.591  1.000 23.466  0 778  THR   A C    1 ? 1 
ATOM   11176 O  O    . THR   A  1  723 ? -30.590 9.249   -3.037  1.000 22.512  0 778  THR   A O    1 ? 1 
ATOM   11177 C  CB   . THR   A  1  723 ? -30.022 9.062   -0.155  1.000 28.564  0 778  THR   A CB   1 ? 1 
ATOM   11178 O  OG1  . THR   A  1  723 ? -29.268 10.274  -0.043  1.000 35.570  0 778  THR   A OG1  1 ? 1 
ATOM   11179 C  CG2  . THR   A  1  723 ? -30.052 8.315   1.183   1.000 30.406  0 778  THR   A CG2  1 ? 1 
ATOM   11180 H  H    . THR   A  1  723 ? -27.614 8.151   -0.342  1.000 23.835  0 778  THR   A H    1 c 1 
ATOM   11181 H  HA   . THR   A  1  723 ? -30.020 7.382   -1.337  1.000 25.576  0 778  THR   A HA   1 c 1 
ATOM   11182 H  HB   . THR   A  1  723 ? -30.949 9.294   -0.401  1.000 30.199  0 778  THR   A HB   1 c 1 
ATOM   11183 H  HG1  . THR   A  1  723 ? -28.447 10.066  0.149   0.000 20.920  0 778  THR   A HG1  1 c 1 
ATOM   11184 H  HG21 . THR   A  1  723 ? -30.466 8.879   1.861   1.000 30.253  0 778  THR   A HG21 1 c 1 
ATOM   11185 H  HG22 . THR   A  1  723 ? -29.144 8.096   1.456   1.000 29.126  0 778  THR   A HG22 1 c 1 
ATOM   11186 H  HG23 . THR   A  1  723 ? -30.568 7.494   1.086   1.000 30.000  0 778  THR   A HG23 1 c 1 
ATOM   11187 N  N    . GLN   A  1  724 ? -28.355 9.230   -3.163  1.000 26.856  0 779  GLN   A N    1 ? 1 
ATOM   11188 C  CA   . GLN   A  1  724 ? -28.303 9.872   -4.473  1.000 33.186  0 779  GLN   A CA   1 ? 1 
ATOM   11189 C  C    . GLN   A  1  724 ? -27.816 8.856   -5.497  1.000 24.793  0 779  GLN   A C    1 ? 1 
ATOM   11190 O  O    . GLN   A  1  724 ? -26.938 8.042   -5.202  1.000 25.158  0 779  GLN   A O    1 ? 1 
ATOM   11191 C  CB   . GLN   A  1  724 ? -27.384 11.114  -4.499  1.000 31.821  0 779  GLN   A CB   1 ? 1 
ATOM   11192 C  CG   . GLN   A  1  724 ? -27.876 12.237  -3.648  1.000 36.277  0 779  GLN   A CG   1 ? 1 
ATOM   11193 C  CD   . GLN   A  1  724 ? -26.841 13.324  -3.524  1.000 47.233  0 779  GLN   A CD   1 ? 1 
ATOM   11194 O  OE1  . GLN   A  1  724 ? -25.888 13.222  -2.766  1.000 55.058  0 779  GLN   A OE1  1 ? 1 
ATOM   11195 N  NE2  . GLN   A  1  724 ? -27.035 14.416  -4.223  1.000 55.684  0 779  GLN   A NE2  1 ? 1 
ATOM   11196 H  H    . GLN   A  1  724 ? -27.570 9.065   -2.726  1.000 26.262  0 779  GLN   A H    1 c 1 
ATOM   11197 H  HA   . GLN   A  1  724 ? -29.212 10.154  -4.714  1.000 30.350  0 779  GLN   A HA   1 c 1 
ATOM   11198 H  HB2  . GLN   A  1  724 ? -26.492 10.847  -4.193  1.000 32.346  0 779  GLN   A HB2  1 c 1 
ATOM   11199 H  HB3  . GLN   A  1  724 ? -27.304 11.423  -5.424  1.000 32.974  0 779  GLN   A HB3  1 c 1 
ATOM   11200 H  HG2  . GLN   A  1  724 ? -28.695 12.609  -4.039  1.000 38.225  0 779  GLN   A HG2  1 c 1 
ATOM   11201 H  HG3  . GLN   A  1  724 ? -28.093 11.897  -2.755  1.000 37.424  0 779  GLN   A HG3  1 c 1 
ATOM   11202 H  HE21 . GLN   A  1  724 ? -27.604 14.415  -4.901  1.000 53.096  0 779  GLN   A HE21 1 c 1 
ATOM   11203 H  HE22 . GLN   A  1  724 ? -26.596 15.155  -4.016  1.000 52.958  0 779  GLN   A HE22 1 c 1 
ATOM   11204 N  N    . PRO   A  1  725 ? -28.419 8.840   -6.711  1.000 24.254  0 780  PRO   A N    1 ? 1 
ATOM   11205 C  CA   . PRO   A  1  725 ? -27.964 7.939   -7.760  1.000 26.439  0 780  PRO   A CA   1 ? 1 
ATOM   11206 C  C    . PRO   A  1  725 ? -26.569 8.328   -8.240  1.000 27.466  0 780  PRO   A C    1 ? 1 
ATOM   11207 O  O    . PRO   A  1  725 ? -26.154 9.471   -8.094  1.000 28.514  0 780  PRO   A O    1 ? 1 
ATOM   11208 C  CB   . PRO   A  1  725 ? -29.031 8.079   -8.842  1.000 28.082  0 780  PRO   A CB   1 ? 1 
ATOM   11209 C  CG   . PRO   A  1  725 ? -29.729 9.347   -8.568  1.000 34.575  0 780  PRO   A CG   1 ? 1 
ATOM   11210 C  CD   . PRO   A  1  725 ? -29.572 9.659   -7.103  1.000 26.039  0 780  PRO   A CD   1 ? 1 
ATOM   11211 H  HA   . PRO   A  1  725 ? -27.961 7.011   -7.417  1.000 26.117  0 780  PRO   A HA   1 c 1 
ATOM   11212 H  HB2  . PRO   A  1  725 ? -28.620 8.099   -9.733  1.000 28.915  0 780  PRO   A HB2  1 c 1 
ATOM   11213 H  HB3  . PRO   A  1  725 ? -29.659 7.327   -8.806  1.000 29.311  0 780  PRO   A HB3  1 c 1 
ATOM   11214 H  HG2  . PRO   A  1  725 ? -29.347 10.066  -9.110  1.000 30.923  0 780  PRO   A HG2  1 c 1 
ATOM   11215 H  HG3  . PRO   A  1  725 ? -30.678 9.266   -8.795  1.000 31.530  0 780  PRO   A HG3  1 c 1 
ATOM   11216 H  HD2  . PRO   A  1  725 ? -29.393 10.607  -6.964  1.000 27.511  0 780  PRO   A HD2  1 c 1 
ATOM   11217 H  HD3  . PRO   A  1  725 ? -30.369 9.406   -6.602  1.000 27.813  0 780  PRO   A HD3  1 c 1 
ATOM   11218 N  N    . ALA   A  1  726 ? -25.857 7.365   -8.822  1.000 31.050  0 781  ALA   A N    1 ? 1 
ATOM   11219 C  CA   . ALA   A  1  726 ? -24.467 7.571   -9.190  1.000 34.174  0 781  ALA   A CA   1 ? 1 
ATOM   11220 C  C    . ALA   A  1  726 ? -24.313 8.694   -10.215 1.000 31.189  0 781  ALA   A C    1 ? 1 
ATOM   11221 O  O    . ALA   A  1  726 ? -23.277 9.352   -10.300 1.000 29.162  0 781  ALA   A O    1 ? 1 
ATOM   11222 C  CB   . ALA   A  1  726 ? -23.903 6.285   -9.754  1.000 33.118  0 781  ALA   A CB   1 ? 1 
ATOM   11223 H  H    . ALA   A  1  726 ? -26.246 6.556   -8.993  1.000 30.852  0 781  ALA   A H    1 c 1 
ATOM   11224 H  HA   . ALA   A  1  726 ? -23.960 7.814   -8.380  1.000 32.346  0 781  ALA   A HA   1 c 1 
ATOM   11225 H  HB1  . ALA   A  1  726 ? -22.982 6.427   -10.029 1.000 32.833  0 781  ALA   A HB1  1 c 1 
ATOM   11226 H  HB2  . ALA   A  1  726 ? -23.934 5.592   -9.074  1.000 32.925  0 781  ALA   A HB2  1 c 1 
ATOM   11227 H  HB3  . ALA   A  1  726 ? -24.431 6.008   -10.522 1.000 33.580  0 781  ALA   A HB3  1 c 1 
ATOM   11228 N  N    . ASP   A  1  727 ? -25.346 8.915   -11.027 1.000 28.082  0 782  ASP   A N    1 ? 1 
ATOM   11229 C  CA   . ASP   A  1  727 ? -25.226 9.917   -12.073 1.000 32.554  0 782  ASP   A CA   1 ? 1 
ATOM   11230 C  C    . ASP   A  1  727 ? -25.777 11.267  -11.622 1.000 28.974  0 782  ASP   A C    1 ? 1 
ATOM   11231 O  O    . ASP   A  1  727 ? -25.820 12.188  -12.417 1.000 31.313  0 782  ASP   A O    1 ? 1 
ATOM   11232 C  CB   . ASP   A  1  727 ? -25.853 9.445   -13.409 1.000 31.377  0 782  ASP   A CB   1 ? 1 
ATOM   11233 C  CG   . ASP   A  1  727 ? -27.301 9.193   -13.356 1.000 30.623  0 782  ASP   A CG   1 ? 1 
ATOM   11234 O  OD1  . ASP   A  1  727 ? -27.923 9.484   -12.285 1.000 37.320  0 782  ASP   A OD1  1 ? 1 
ATOM   11235 O  OD2  . ASP   A  1  727 ? -27.830 8.674   -14.340 1.000 46.831  0 782  ASP   A OD2  1 ? 1 
ATOM   11236 H  H    . ASP   A  1  727 ? -26.125 8.448   -10.936 1.000 30.279  0 782  ASP   A H    1 c 1 
ATOM   11237 H  HA   . ASP   A  1  727 ? -24.265 10.042  -12.250 1.000 30.129  0 782  ASP   A HA   1 c 1 
ATOM   11238 H  HB2  . ASP   A  1  727 ? -25.687 10.124  -14.095 1.000 31.564  0 782  ASP   A HB2  1 c 1 
ATOM   11239 H  HB3  . ASP   A  1  727 ? -25.411 8.618   -13.690 1.000 30.974  0 782  ASP   A HB3  1 c 1 
ATOM   11240 N  N    . LYS   A  1  728 ? -26.166 11.393  -10.345 1.000 29.996  0 783  LYS   A N    1 ? 1 
ATOM   11241 C  CA   . LYS   A  1  728 ? -26.638 12.659  -9.813  1.000 28.956  0 783  LYS   A CA   1 ? 1 
ATOM   11242 C  C    . LYS   A  1  728 ? -26.070 12.814  -8.414  1.000 29.797  0 783  LYS   A C    1 ? 1 
ATOM   11243 O  O    . LYS   A  1  728 ? -26.803 12.968  -7.444  1.000 38.916  0 783  LYS   A O    1 ? 1 
ATOM   11244 C  CB   . LYS   A  1  728 ? -28.156 12.751  -9.778  1.000 40.434  0 783  LYS   A CB   1 ? 1 
ATOM   11245 C  CG   . LYS   A  1  728 ? -28.880 12.766  -11.150 1.000 44.591  0 783  LYS   A CG   1 ? 1 
ATOM   11246 C  CD   . LYS   A  1  728 ? -30.339 13.307  -11.010 1.000 46.449  0 783  LYS   A CD   1 ? 1 
ATOM   11247 C  CE   . LYS   A  1  728 ? -30.898 13.995  -12.248 1.000 79.480  0 783  LYS   A CE   1 ? 1 
ATOM   11248 N  NZ   . LYS   A  1  728 ? -31.150 13.053  -13.379 1.000 79.569  0 783  LYS   A NZ   1 ? 1 
ATOM   11249 H  H    . LYS   A  1  728 ? -26.143 10.667  -9.791  1.000 29.140  0 783  LYS   A H    1 c 1 
ATOM   11250 H  HA   . LYS   A  1  728 ? -26.288 13.387  -10.376 1.000 31.207  0 783  LYS   A HA   1 c 1 
ATOM   11251 H  HB2  . LYS   A  1  728 ? -28.495 11.994  -9.259  1.000 37.953  0 783  LYS   A HB2  1 c 1 
ATOM   11252 H  HB3  . LYS   A  1  728 ? -28.399 13.570  -9.297  1.000 38.450  0 783  LYS   A HB3  1 c 1 
ATOM   11253 H  HG2  . LYS   A  1  728 ? -28.380 13.334  -11.774 1.000 43.887  0 783  LYS   A HG2  1 c 1 
ATOM   11254 H  HG3  . LYS   A  1  728 ? -28.903 11.855  -11.513 1.000 43.701  0 783  LYS   A HG3  1 c 1 
ATOM   11255 H  HD2  . LYS   A  1  728 ? -30.928 12.557  -10.780 1.000 52.050  0 783  LYS   A HD2  1 c 1 
ATOM   11256 H  HD3  . LYS   A  1  728 ? -30.368 13.943  -10.264 1.000 51.900  0 783  LYS   A HD3  1 c 1 
ATOM   11257 H  HE2  . LYS   A  1  728 ? -31.736 14.439  -12.019 1.000 70.383  0 783  LYS   A HE2  1 c 1 
ATOM   11258 H  HE3  . LYS   A  1  728 ? -30.270 14.680  -12.547 1.000 69.565  0 783  LYS   A HE3  1 c 1 
ATOM   11259 H  HZ1  . LYS   A  1  728 ? -31.731 12.407  -13.117 1.000 79.655  0 783  LYS   A HZ1  1 c 1 
ATOM   11260 H  HZ2  . LYS   A  1  728 ? -30.371 12.665  -13.635 1.000 78.737  0 783  LYS   A HZ2  1 c 1 
ATOM   11261 H  HZ3  . LYS   A  1  728 ? -31.503 13.503  -14.082 1.000 80.031  0 783  LYS   A HZ3  1 c 1 
ATOM   11262 N  N    . CYS   A  1  729 ? -24.744 12.764  -8.326  1.000 33.127  0 784  CYS   A N    1 ? 1 
ATOM   11263 C  CA   . CYS   A  1  729 ? -24.060 12.831  -7.049  1.000 31.759  0 784  CYS   A CA   1 ? 1 
ATOM   11264 C  C    . CYS   A  1  729 ? -23.467 14.229  -6.839  1.000 31.638  0 784  CYS   A C    1 ? 1 
ATOM   11265 O  O    . CYS   A  1  729 ? -22.725 14.729  -7.683  1.000 37.276  0 784  CYS   A O    1 ? 1 
ATOM   11266 C  CB   . CYS   A  1  729 ? -23.009 11.732  -7.001  1.000 28.862  0 784  CYS   A CB   1 ? 1 
ATOM   11267 S  SG   . CYS   A  1  729 ? -22.080 11.662  -5.450  1.000 39.072  0 784  CYS   A SG   1 ? 1 
ATOM   11268 H  H    . CYS   A  1  729 ? -24.246 12.690  -9.088  1.000 31.791  0 784  CYS   A H    1 c 1 
ATOM   11269 H  HA   . CYS   A  1  729 ? -24.719 12.658  -6.338  1.000 31.846  0 784  CYS   A HA   1 c 1 
ATOM   11270 H  HB2  . CYS   A  1  729 ? -23.447 10.868  -7.140  1.000 31.048  0 784  CYS   A HB2  1 c 1 
ATOM   11271 H  HB3  . CYS   A  1  729 ? -22.375 11.867  -7.735  1.000 30.865  0 784  CYS   A HB3  1 c 1 
ATOM   11272 N  N    . ASP   A  1  730 ? -23.804 14.863  -5.707  1.000 43.348  0 785  ASP   A N    1 ? 1 
ATOM   11273 C  CA   . ASP   A  1  730 ? -23.279 16.179  -5.356  1.000 40.020  0 785  ASP   A CA   1 ? 1 
ATOM   11274 C  C    . ASP   A  1  730 ? -21.949 16.108  -4.626  1.000 43.114  0 785  ASP   A C    1 ? 1 
ATOM   11275 O  O    . ASP   A  1  730 ? -21.036 16.883  -4.900  1.000 76.394  0 785  ASP   A O    1 ? 1 
ATOM   11276 C  CB   . ASP   A  1  730 ? -24.205 16.945  -4.411  1.000 45.339  0 785  ASP   A CB   1 ? 1 
ATOM   11277 C  CG   . ASP   A  1  730 ? -25.452 17.440  -5.054  1.000 53.339  0 785  ASP   A CG   1 ? 1 
ATOM   11278 O  OD1  . ASP   A  1  730 ? -25.359 17.992  -6.168  1.000 67.409  0 785  ASP   A OD1  1 ? 1 
ATOM   11279 O  OD2  . ASP   A  1  730 ? -26.533 17.288  -4.440  1.000 55.381  0 785  ASP   A OD2  1 ? 1 
ATOM   11280 H  H    . ASP   A  1  730 ? -24.385 14.459  -5.129  1.000 39.436  0 785  ASP   A H    1 c 1 
ATOM   11281 H  HA   . ASP   A  1  730 ? -23.162 16.705  -6.182  1.000 42.376  0 785  ASP   A HA   1 c 1 
ATOM   11282 H  HB2  . ASP   A  1  730 ? -24.453 16.359  -3.666  1.000 45.617  0 785  ASP   A HB2  1 c 1 
ATOM   11283 H  HB3  . ASP   A  1  730 ? -23.725 17.716  -4.046  1.000 45.731  0 785  ASP   A HB3  1 c 1 
ATOM   11284 N  N    . GLY   A  1  731 ? -21.873 15.191  -3.670  1.000 34.337  0 786  GLY   A N    1 ? 1 
ATOM   11285 C  CA   . GLY   A  1  731 ? -20.798 15.212  -2.696  1.000 36.408  0 786  GLY   A CA   1 ? 1 
ATOM   11286 C  C    . GLY   A  1  731 ? -19.652 14.272  -3.039  1.000 32.838  0 786  GLY   A C    1 ? 1 
ATOM   11287 O  O    . GLY   A  1  731 ? -19.409 13.938  -4.203  1.000 30.122  0 786  GLY   A O    1 ? 1 
ATOM   11288 H  H    . GLY   A  1  731 ? -22.505 14.533  -3.617  1.000 36.872  0 786  GLY   A H    1 c 1 
ATOM   11289 H  HA2  . GLY   A  1  731 ? -20.451 16.135  -2.618  1.000 35.532  0 786  GLY   A HA2  1 c 1 
ATOM   11290 H  HA3  . GLY   A  1  731 ? -21.174 14.960  -1.817  1.000 35.266  0 786  GLY   A HA3  1 c 1 
ATOM   11291 N  N    . PRO   A  1  732 ? -18.898 13.820  -2.019  1.000 34.275  0 787  PRO   A N    1 ? 1 
ATOM   11292 C  CA   . PRO   A  1  732 ? -17.837 12.839  -2.236  1.000 32.401  0 787  PRO   A CA   1 ? 1 
ATOM   11293 C  C    . PRO   A  1  732 ? -18.325 11.552  -2.900  1.000 28.719  0 787  PRO   A C    1 ? 1 
ATOM   11294 O  O    . PRO   A  1  732 ? -19.512 11.223  -2.902  1.000 28.402  0 787  PRO   A O    1 ? 1 
ATOM   11295 C  CB   . PRO   A  1  732 ? -17.278 12.599  -0.838  1.000 32.624  0 787  PRO   A CB   1 ? 1 
ATOM   11296 C  CG   . PRO   A  1  732 ? -18.310 13.154  0.092   1.000 31.193  0 787  PRO   A CG   1 ? 1 
ATOM   11297 C  CD   . PRO   A  1  732 ? -18.992 14.262  -0.623  1.000 35.883  0 787  PRO   A CD   1 ? 1 
ATOM   11298 H  HA   . PRO   A  1  732 ? -17.133 13.253  -2.796  1.000 31.832  0 787  PRO   A HA   1 c 1 
ATOM   11299 H  HB2  . PRO   A  1  732 ? -17.142 11.641  -0.674  1.000 31.710  0 787  PRO   A HB2  1 c 1 
ATOM   11300 H  HB3  . PRO   A  1  732 ? -16.421 13.063  -0.721  1.000 31.822  0 787  PRO   A HB3  1 c 1 
ATOM   11301 H  HG2  . PRO   A  1  732 ? -18.955 12.460  0.337   1.000 32.633  0 787  PRO   A HG2  1 c 1 
ATOM   11302 H  HG3  . PRO   A  1  732 ? -17.888 13.486  0.911   1.000 32.467  0 787  PRO   A HG3  1 c 1 
ATOM   11303 H  HD2  . PRO   A  1  732 ? -19.919 14.348  -0.334  1.000 34.993  0 787  PRO   A HD2  1 c 1 
ATOM   11304 H  HD3  . PRO   A  1  732 ? -18.531 15.111  -0.488  1.000 34.615  0 787  PRO   A HD3  1 c 1 
ATOM   11305 N  N    . LEU   A  1  733 ? -17.361 10.851  -3.489  1.000 26.593  0 788  LEU   A N    1 ? 1 
ATOM   11306 C  CA   . LEU   A  1  733 ? -17.613 9.669   -4.274  1.000 22.417  0 788  LEU   A CA   1 ? 1 
ATOM   11307 C  C    . LEU   A  1  733 ? -17.215 8.447   -3.464  1.000 20.855  0 788  LEU   A C    1 ? 1 
ATOM   11308 O  O    . LEU   A  1  733 ? -16.494 8.529   -2.482  1.000 23.665  0 788  LEU   A O    1 ? 1 
ATOM   11309 C  CB   . LEU   A  1  733 ? -16.786 9.748   -5.578  1.000 27.514  0 788  LEU   A CB   1 ? 1 
ATOM   11310 C  CG   . LEU   A  1  733 ? -17.159 10.876  -6.539  1.000 24.484  0 788  LEU   A CG   1 ? 1 
ATOM   11311 C  CD1  . LEU   A  1  733 ? -16.139 10.988  -7.677  1.000 27.896  0 788  LEU   A CD1  1 ? 1 
ATOM   11312 C  CD2  . LEU   A  1  733 ? -18.560 10.659  -7.094  1.000 33.855  0 788  LEU   A CD2  1 ? 1 
ATOM   11313 H  H    . LEU   A  1  733 ? -16.495 11.127  -3.390  1.000 25.728  0 788  LEU   A H    1 c 1 
ATOM   11314 H  HA   . LEU   A  1  733 ? -18.573 9.619   -4.485  1.000 24.243  0 788  LEU   A HA   1 c 1 
ATOM   11315 H  HB2  . LEU   A  1  733 ? -15.844 9.848   -5.336  1.000 25.024  0 788  LEU   A HB2  1 c 1 
ATOM   11316 H  HB3  . LEU   A  1  733 ? -16.878 8.897   -6.050  1.000 25.227  0 788  LEU   A HB3  1 c 1 
ATOM   11317 H  HG   . LEU   A  1  733 ? -17.154 11.726  -6.035  1.000 27.359  0 788  LEU   A HG   1 c 1 
ATOM   11318 H  HD11 . LEU   A  1  733 ? -16.273 11.826  -8.152  1.000 27.072  0 788  LEU   A HD11 1 c 1 
ATOM   11319 H  HD12 . LEU   A  1  733 ? -16.256 10.244  -8.293  1.000 26.693  0 788  LEU   A HD12 1 c 1 
ATOM   11320 H  HD13 . LEU   A  1  733 ? -15.238 10.965  -7.310  1.000 26.389  0 788  LEU   A HD13 1 c 1 
ATOM   11321 H  HD21 . LEU   A  1  733 ? -19.213 10.763  -6.380  1.000 30.967  0 788  LEU   A HD21 1 c 1 
ATOM   11322 H  HD22 . LEU   A  1  733 ? -18.627 9.763   -7.467  1.000 30.659  0 788  LEU   A HD22 1 c 1 
ATOM   11323 H  HD23 . LEU   A  1  733 ? -18.738 11.314  -7.791  1.000 31.113  0 788  LEU   A HD23 1 c 1 
ATOM   11324 N  N    . SER   A  1  734 ? -17.683 7.297   -3.913  1.000 19.174  0 789  SER   A N    1 ? 1 
ATOM   11325 C  CA   . SER   A  1  734 ? -17.283 6.020   -3.354  1.000 24.649  0 789  SER   A CA   1 ? 1 
ATOM   11326 C  C    . SER   A  1  734 ? -16.812 5.102   -4.486  1.000 22.193  0 789  SER   A C    1 ? 1 
ATOM   11327 O  O    . SER   A  1  734 ? -17.464 5.001   -5.545  1.000 20.357  0 789  SER   A O    1 ? 1 
ATOM   11328 C  CB   . SER   A  1  734 ? -18.441 5.407   -2.566  1.000 27.245  0 789  SER   A CB   1 ? 1 
ATOM   11329 O  OG   . SER   A  1  734 ? -18.174 4.051   -2.251  1.000 32.057  0 789  SER   A OG   1 ? 1 
ATOM   11330 H  H    . SER   A  1  734 ? -18.283 7.302   -4.603  1.000 21.033  0 789  SER   A H    1 c 1 
ATOM   11331 H  HA   . SER   A  1  734 ? -16.523 6.173   -2.735  1.000 23.036  0 789  SER   A HA   1 c 1 
ATOM   11332 H  HB2  . SER   A  1  734 ? -18.577 5.916   -1.735  1.000 27.921  0 789  SER   A HB2  1 c 1 
ATOM   11333 H  HB3  . SER   A  1  734 ? -19.266 5.464   -3.099  1.000 28.169  0 789  SER   A HB3  1 c 1 
ATOM   11334 H  HG   . SER   A  1  734 ? -17.774 4.018   -1.497  0.000 22.860  0 789  SER   A HG   1 c 1 
ATOM   11335 N  N    . VAL   A  1  735 ? -15.640 4.496   -4.268  1.000 20.247  0 790  VAL   A N    1 ? 1 
ATOM   11336 C  CA   . VAL   A  1  735 ? -15.019 3.661   -5.271  1.000 20.702  0 790  VAL   A CA   1 ? 1 
ATOM   11337 C  C    . VAL   A  1  735 ? -14.591 2.308   -4.708  1.000 25.387  0 790  VAL   A C    1 ? 1 
ATOM   11338 O  O    . VAL   A  1  735 ? -14.182 2.217   -3.564  1.000 21.460  0 790  VAL   A O    1 ? 1 
ATOM   11339 C  CB   . VAL   A  1  735 ? -13.855 4.453   -5.910  1.000 19.156  0 790  VAL   A CB   1 ? 1 
ATOM   11340 C  CG1  . VAL   A  1  735 ? -12.691 4.674   -4.925  1.000 21.890  0 790  VAL   A CG1  1 ? 1 
ATOM   11341 C  CG2  . VAL   A  1  735 ? -13.375 3.778   -7.191  1.000 17.923  0 790  VAL   A CG2  1 ? 1 
ATOM   11342 H  H    . VAL   A  1  735 ? -15.215 4.609   -3.467  1.000 20.727  0 790  VAL   A H    1 c 1 
ATOM   11343 H  HA   . VAL   A  1  735 ? -15.678 3.495   -5.965  1.000 21.353  0 790  VAL   A HA   1 c 1 
ATOM   11344 H  HB   . VAL   A  1  735 ? -14.208 5.343   -6.157  1.000 19.924  0 790  VAL   A HB   1 c 1 
ATOM   11345 H  HG11 . VAL   A  1  735 ? -12.294 3.817   -4.689  1.000 20.725  0 790  VAL   A HG11 1 c 1 
ATOM   11346 H  HG12 . VAL   A  1  735 ? -13.022 5.109   -4.120  1.000 21.014  0 790  VAL   A HG12 1 c 1 
ATOM   11347 H  HG13 . VAL   A  1  735 ? -12.016 5.237   -5.341  1.000 20.839  0 790  VAL   A HG13 1 c 1 
ATOM   11348 H  HG21 . VAL   A  1  735 ? -12.619 4.271   -7.553  1.000 18.162  0 790  VAL   A HG21 1 c 1 
ATOM   11349 H  HG22 . VAL   A  1  735 ? -14.097 3.768   -7.843  1.000 18.542  0 790  VAL   A HG22 1 c 1 
ATOM   11350 H  HG23 . VAL   A  1  735 ? -13.102 2.865   -6.997  1.000 18.117  0 790  VAL   A HG23 1 c 1 
ATOM   11351 N  N    . SER   A  1  736 ? -14.724 1.265   -5.538  1.000 21.093  0 791  SER   A N    1 ? 1 
ATOM   11352 C  CA   . SER   A  1  736 ? -14.024 -0.005  -5.406  1.000 21.149  0 791  SER   A CA   1 ? 1 
ATOM   11353 C  C    . SER   A  1  736 ? -13.462 -0.398  -6.771  1.000 18.657  0 791  SER   A C    1 ? 1 
ATOM   11354 O  O    . SER   A  1  736 ? -14.053 -0.082  -7.799  1.000 21.488  0 791  SER   A O    1 ? 1 
ATOM   11355 C  CB   . SER   A  1  736 ? -14.958 -1.096  -4.923  1.000 28.439  0 791  SER   A CB   1 ? 1 
ATOM   11356 O  OG   . SER   A  1  736 ? -15.970 -1.354  -5.881  1.000 28.555  0 791  SER   A OG   1 ? 1 
ATOM   11357 H  H    . SER   A  1  736 ? -15.303 1.355   -6.240  1.000 22.301  0 791  SER   A H    1 c 1 
ATOM   11358 H  HA   . SER   A  1  736 ? -13.274 0.100   -4.761  1.000 21.416  0 791  SER   A HA   1 c 1 
ATOM   11359 H  HB2  . SER   A  1  736 ? -14.443 -1.919  -4.759  1.000 26.378  0 791  SER   A HB2  1 c 1 
ATOM   11360 H  HB3  . SER   A  1  736 ? -15.371 -0.820  -4.074  1.000 26.632  0 791  SER   A HB3  1 c 1 
ATOM   11361 H  HG   . SER   A  1  736 ? -15.690 -1.965  -6.395  0.000 22.170  0 791  SER   A HG   1 c 1 
ATOM   11362 N  N    . SER   A  1  737 ? -12.327 -1.084  -6.776  1.000 15.143  0 792  SER   A N    1 ? 1 
ATOM   11363 C  CA   . SER   A  1  737 ? -11.635 -1.417  -8.007  1.000 18.629  0 792  SER   A CA   1 ? 1 
ATOM   11364 C  C    . SER   A  1  737 ? -10.980 -2.777  -7.862  1.000 20.574  0 792  SER   A C    1 ? 1 
ATOM   11365 O  O    . SER   A  1  737 ? -10.736 -3.248  -6.749  1.000 17.205  0 792  SER   A O    1 ? 1 
ATOM   11366 C  CB   . SER   A  1  737 ? -10.546 -0.390  -8.386  1.000 22.172  0 792  SER   A CB   1 ? 1 
ATOM   11367 O  OG   . SER   A  1  737 ? -11.022 0.943   -8.376  1.000 27.865  0 792  SER   A OG   1 ? 1 
ATOM   11368 H  H    . SER   A  1  737 ? -11.966 -1.358  -5.982  1.000 16.502  0 792  SER   A H    1 c 1 
ATOM   11369 H  HA   . SER   A  1  737 ? -12.303 -1.465  -8.741  1.000 19.010  0 792  SER   A HA   1 c 1 
ATOM   11370 H  HB2  . SER   A  1  737 ? -9.798  -0.469  -7.754  1.000 22.140  0 792  SER   A HB2  1 c 1 
ATOM   11371 H  HB3  . SER   A  1  737 ? -10.205 -0.602  -9.284  1.000 22.440  0 792  SER   A HB3  1 c 1 
ATOM   11372 H  HG   . SER   A  1  737 ? -10.913 1.264   -7.604  0.000 20.750  0 792  SER   A HG   1 c 1 
ATOM   11373 N  N    . PHE   A  1  738 ? -10.644 -3.360  -9.013  1.000 18.790  0 793  PHE   A N    1 ? 1 
ATOM   11374 C  CA   . PHE   A  1  738 ? -9.898  -4.602  -9.019  1.000 19.307  0 793  PHE   A CA   1 ? 1 
ATOM   11375 C  C    . PHE   A  1  738 ? -8.968  -4.668  -10.229 1.000 20.909  0 793  PHE   A C    1 ? 1 
ATOM   11376 O  O    . PHE   A  1  738 ? -9.150  -3.916  -11.174 1.000 18.592  0 793  PHE   A O    1 ? 1 
ATOM   11377 C  CB   . PHE   A  1  738 ? -10.845 -5.771  -8.910  1.000 21.824  0 793  PHE   A CB   1 ? 1 
ATOM   11378 C  CG   . PHE   A  1  738 ? -11.820 -5.959  -10.023 1.000 27.824  0 793  PHE   A CG   1 ? 1 
ATOM   11379 C  CD1  . PHE   A  1  738 ? -11.405 -6.437  -11.263 1.000 33.557  0 793  PHE   A CD1  1 ? 1 
ATOM   11380 C  CD2  . PHE   A  1  738 ? -13.156 -5.641  -9.849  1.000 34.900  0 793  PHE   A CD2  1 ? 1 
ATOM   11381 C  CE1  . PHE   A  1  738 ? -12.317 -6.592  -12.306 1.000 36.651  0 793  PHE   A CE1  1 ? 1 
ATOM   11382 C  CE2  . PHE   A  1  738 ? -14.071 -5.826  -10.885 1.000 27.743  0 793  PHE   A CE2  1 ? 1 
ATOM   11383 C  CZ   . PHE   A  1  738 ? -13.642 -6.293  -12.106 1.000 40.416  0 793  PHE   A CZ   1 ? 1 
ATOM   11384 H  H    . PHE   A  1  738 ? -10.884 -2.978  -9.808  1.000 19.497  0 793  PHE   A H    1 c 1 
ATOM   11385 H  HA   . PHE   A  1  738 ? -9.324  -4.609  -8.212  1.000 19.620  0 793  PHE   A HA   1 c 1 
ATOM   11386 H  HB2  . PHE   A  1  738 ? -10.307 -6.586  -8.833  1.000 22.384  0 793  PHE   A HB2  1 c 1 
ATOM   11387 H  HB3  . PHE   A  1  738 ? -11.346 -5.674  -8.073  1.000 22.494  0 793  PHE   A HB3  1 c 1 
ATOM   11388 H  HD1  . PHE   A  1  738 ? -10.495 -6.643  -11.402 1.000 32.367  0 793  PHE   A HD1  1 c 1 
ATOM   11389 H  HD2  . PHE   A  1  738 ? -13.455 -5.325  -9.011  1.000 31.187  0 793  PHE   A HD2  1 c 1 
ATOM   11390 H  HE1  . PHE   A  1  738 ? -12.027 -6.924  -13.140 1.000 36.583  0 793  PHE   A HE1  1 c 1 
ATOM   11391 H  HE2  . PHE   A  1  738 ? -14.980 -5.609  -10.754 1.000 32.149  0 793  PHE   A HE2  1 c 1 
ATOM   11392 H  HZ   . PHE   A  1  738 ? -14.261 -6.406  -12.810 1.000 36.338  0 793  PHE   A HZ   1 c 1 
ATOM   11393 N  N    . ILE   A  1  739 ? -7.965  -5.545  -10.126 1.000 20.248  0 794  ILE   A N    1 ? 1 
ATOM   11394 C  CA   . ILE   A  1  739 ? -7.029  -5.876  -11.182 1.000 19.925  0 794  ILE   A CA   1 ? 1 
ATOM   11395 C  C    . ILE   A  1  739 ? -6.952  -7.398  -11.221 1.000 18.914  0 794  ILE   A C    1 ? 1 
ATOM   11396 O  O    . ILE   A  1  739 ? -6.180  -8.020  -10.485 1.000 14.314  0 794  ILE   A O    1 ? 1 
ATOM   11397 C  CB   . ILE   A  1  739 ? -5.642  -5.242  -10.968 1.000 17.172  0 794  ILE   A CB   1 ? 1 
ATOM   11398 C  CG1  . ILE   A  1  739 ? -5.720  -3.673  -10.908 1.000 17.454  0 794  ILE   A CG1  1 ? 1 
ATOM   11399 C  CG2  . ILE   A  1  739 ? -4.648  -5.698  -12.041 1.000 16.941  0 794  ILE   A CG2  1 ? 1 
ATOM   11400 C  CD1  . ILE   A  1  739 ? -4.449  -3.026  -10.341 1.000 19.721  0 794  ILE   A CD1  1 ? 1 
ATOM   11401 H  H    . ILE   A  1  739 ? -7.859  -5.969  -9.324  1.000 20.167  0 794  ILE   A H    1 c 1 
ATOM   11402 H  HA   . ILE   A  1  739 ? -7.386  -5.557  -12.030 1.000 19.375  0 794  ILE   A HA   1 c 1 
ATOM   11403 H  HB   . ILE   A  1  739 ? -5.304  -5.555  -10.093 1.000 17.433  0 794  ILE   A HB   1 c 1 
ATOM   11404 H  HG12 . ILE   A  1  739 ? -5.876  -3.329  -11.813 1.000 18.036  0 794  ILE   A HG12 1 c 1 
ATOM   11405 H  HG13 . ILE   A  1  739 ? -6.482  -3.412  -10.349 1.000 17.878  0 794  ILE   A HG13 1 c 1 
ATOM   11406 H  HG21 . ILE   A  1  739 ? -5.036  -5.563  -12.923 1.000 17.256  0 794  ILE   A HG21 1 c 1 
ATOM   11407 H  HG22 . ILE   A  1  739 ? -4.443  -6.641  -11.919 1.000 17.098  0 794  ILE   A HG22 1 c 1 
ATOM   11408 H  HG23 . ILE   A  1  739 ? -3.827  -5.181  -11.968 1.000 17.029  0 794  ILE   A HG23 1 c 1 
ATOM   11409 H  HD11 . ILE   A  1  739 ? -3.686  -3.272  -10.889 1.000 18.952  0 794  ILE   A HD11 1 c 1 
ATOM   11410 H  HD12 . ILE   A  1  739 ? -4.305  -3.335  -9.430  1.000 18.775  0 794  ILE   A HD12 1 c 1 
ATOM   11411 H  HD13 . ILE   A  1  739 ? -4.547  -2.058  -10.342 1.000 18.842  0 794  ILE   A HD13 1 c 1 
ATOM   11412 N  N    . LEU   A  1  740 ? -7.809  -7.982  -12.059 1.000 14.106  0 795  LEU   A N    1 ? 1 
ATOM   11413 C  CA   . LEU   A  1  740 ? -7.917  -9.420  -12.170 1.000 15.277  0 795  LEU   A CA   1 ? 1 
ATOM   11414 C  C    . LEU   A  1  740 ? -6.816  -9.937  -13.075 1.000 16.897  0 795  LEU   A C    1 ? 1 
ATOM   11415 O  O    . LEU   A  1  740 ? -6.632  -9.437  -14.190 1.000 19.751  0 795  LEU   A O    1 ? 1 
ATOM   11416 C  CB   . LEU   A  1  740 ? -9.284  -9.800  -12.730 1.000 21.973  0 795  LEU   A CB   1 ? 1 
ATOM   11417 C  CG   . LEU   A  1  740 ? -10.436 -9.721  -11.769 1.000 24.377  0 795  LEU   A CG   1 ? 1 
ATOM   11418 C  CD1  . LEU   A  1  740 ? -11.838 -9.825  -12.516 1.000 24.641  0 795  LEU   A CD1  1 ? 1 
ATOM   11419 C  CD2  . LEU   A  1  740 ? -10.336 -10.851 -10.781 1.000 29.905  0 795  LEU   A CD2  1 ? 1 
ATOM   11420 H  H    . LEU   A  1  740 ? -8.347  -7.460  -12.582 1.000 15.580  0 795  LEU   A H    1 c 1 
ATOM   11421 H  HA   . LEU   A  1  740 ? -7.809  -9.808  -11.275 1.000 16.474  0 795  LEU   A HA   1 c 1 
ATOM   11422 H  HB2  . LEU   A  1  740 ? -9.477  -9.216  -13.490 1.000 20.739  0 795  LEU   A HB2  1 c 1 
ATOM   11423 H  HB3  . LEU   A  1  740 ? -9.231  -10.715 -13.072 1.000 20.940  0 795  LEU   A HB3  1 c 1 
ATOM   11424 H  HG   . LEU   A  1  740 ? -10.391 -8.865  -11.281 1.000 24.651  0 795  LEU   A HG   1 c 1 
ATOM   11425 H  HD11 . LEU   A  1  740 ? -12.543 -9.494  -11.933 1.000 24.718  0 795  LEU   A HD11 1 c 1 
ATOM   11426 H  HD12 . LEU   A  1  740 ? -12.017 -10.754 -12.745 1.000 24.961  0 795  LEU   A HD12 1 c 1 
ATOM   11427 H  HD13 . LEU   A  1  740 ? -11.814 -9.291  -13.329 1.000 24.797  0 795  LEU   A HD13 1 c 1 
ATOM   11428 H  HD21 . LEU   A  1  740 ? -9.549  -10.729 -10.223 1.000 27.602  0 795  LEU   A HD21 1 c 1 
ATOM   11429 H  HD22 . LEU   A  1  740 ? -10.267 -11.696 -11.258 1.000 28.156  0 795  LEU   A HD22 1 c 1 
ATOM   11430 H  HD23 . LEU   A  1  740 ? -11.131 -10.861 -10.219 1.000 28.058  0 795  LEU   A HD23 1 c 1 
ATOM   11431 N  N    . PRO   A  1  741 ? -6.061  -10.960 -12.621 1.000 21.563  0 796  PRO   A N    1 ? 1 
ATOM   11432 C  CA   . PRO   A  1  741 ? -5.068  -11.606 -13.475 1.000 22.219  0 796  PRO   A CA   1 ? 1 
ATOM   11433 C  C    . PRO   A  1  741 ? -5.773  -12.388 -14.580 1.000 20.957  0 796  PRO   A C    1 ? 1 
ATOM   11434 O  O    . PRO   A  1  741 ? -6.784  -13.048 -14.352 1.000 18.368  0 796  PRO   A O    1 ? 1 
ATOM   11435 C  CB   . PRO   A  1  741 ? -4.283  -12.495 -12.521 1.000 24.822  0 796  PRO   A CB   1 ? 1 
ATOM   11436 C  CG   . PRO   A  1  741 ? -5.214  -12.753 -11.358 1.000 38.635  0 796  PRO   A CG   1 ? 1 
ATOM   11437 C  CD   . PRO   A  1  741 ? -6.148  -11.563 -11.273 1.000 29.030  0 796  PRO   A CD   1 ? 1 
ATOM   11438 H  HA   . PRO   A  1  741 ? -4.468  -10.923 -13.864 1.000 22.019  0 796  PRO   A HA   1 c 1 
ATOM   11439 H  HB2  . PRO   A  1  741 ? -4.031  -13.337 -12.956 1.000 26.887  0 796  PRO   A HB2  1 c 1 
ATOM   11440 H  HB3  . PRO   A  1  741 ? -3.468  -12.043 -12.217 1.000 26.487  0 796  PRO   A HB3  1 c 1 
ATOM   11441 H  HG2  . PRO   A  1  741 ? -5.724  -13.576 -11.504 1.000 32.851  0 796  PRO   A HG2  1 c 1 
ATOM   11442 H  HG3  . PRO   A  1  741 ? -4.706  -12.847 -10.527 1.000 32.457  0 796  PRO   A HG3  1 c 1 
ATOM   11443 H  HD2  . PRO   A  1  741 ? -7.059  -11.848 -11.074 1.000 28.471  0 796  PRO   A HD2  1 c 1 
ATOM   11444 H  HD3  . PRO   A  1  741 ? -5.855  -10.933 -10.589 1.000 28.028  0 796  PRO   A HD3  1 c 1 
ATOM   11445 N  N    . HIS   A  1  742 ? -5.243  -12.233 -15.787 1.000 22.251  0 797  HIS   A N    1 ? 1 
ATOM   11446 C  CA   . HIS   A  1  742 ? -5.751  -12.896 -16.981 1.000 20.920  0 797  HIS   A CA   1 ? 1 
ATOM   11447 C  C    . HIS   A  1  742 ? -5.068  -14.256 -17.104 1.000 20.864  0 797  HIS   A C    1 ? 1 
ATOM   11448 O  O    . HIS   A  1  742 ? -4.045  -14.388 -17.772 1.000 25.433  0 797  HIS   A O    1 ? 1 
ATOM   11449 C  CB   . HIS   A  1  742 ? -5.521  -11.997 -18.191 1.000 17.670  0 797  HIS   A CB   1 ? 1 
ATOM   11450 C  CG   . HIS   A  1  742 ? -6.066  -12.568 -19.468 1.000 20.330  0 797  HIS   A CG   1 ? 1 
ATOM   11451 N  ND1  . HIS   A  1  742 ? -5.503  -12.281 -20.691 1.000 18.617  0 797  HIS   A ND1  1 ? 1 
ATOM   11452 C  CD2  . HIS   A  1  742 ? -7.141  -13.357 -19.648 1.000 17.375  0 797  HIS   A CD2  1 ? 1 
ATOM   11453 C  CE1  . HIS   A  1  742 ? -6.222  -12.962 -21.592 1.000 24.622  0 797  HIS   A CE1  1 ? 1 
ATOM   11454 N  NE2  . HIS   A  1  742 ? -7.226  -13.628 -21.002 1.000 20.326  0 797  HIS   A NE2  1 ? 1 
ATOM   11455 H  H    . HIS   A  1  742 ? -4.517  -11.685 -15.877 1.000 21.394  0 797  HIS   A H    1 c 1 
ATOM   11456 H  HA   . HIS   A  1  742 ? -6.722  -13.031 -16.870 1.000 20.519  0 797  HIS   A HA   1 c 1 
ATOM   11457 H  HB2  . HIS   A  1  742 ? -5.946  -11.131 -18.026 1.000 18.662  0 797  HIS   A HB2  1 c 1 
ATOM   11458 H  HB3  . HIS   A  1  742 ? -4.560  -11.847 -18.297 1.000 18.827  0 797  HIS   A HB3  1 c 1 
ATOM   11459 H  HD1  . HIS   A  1  742 ? -4.803  -11.769 -20.832 0.000 9.070   0 797  HIS   A HD1  1 c 1 
ATOM   11460 H  HD2  . HIS   A  1  742 ? -7.696  -13.702 -18.970 1.000 18.600  0 797  HIS   A HD2  1 c 1 
ATOM   11461 H  HE1  . HIS   A  1  742 ? -6.060  -12.954 -22.521 1.000 22.364  0 797  HIS   A HE1  1 c 1 
ATOM   11462 H  HE2  . HIS   A  1  742 ? -7.819  -14.146 -21.419 0.000 9.840   0 797  HIS   A HE2  1 c 1 
ATOM   11463 N  N    . ARG   A  1  743 ? -5.633  -15.269 -16.440 1.000 20.109  0 798  ARG   A N    1 ? 1 
ATOM   11464 C  CA   . ARG   A  1  743 ? -4.978  -16.566 -16.369 1.000 24.918  0 798  ARG   A CA   1 ? 1 
ATOM   11465 C  C    . ARG   A  1  743 ? -5.724  -17.579 -17.237 1.000 25.450  0 798  ARG   A C    1 ? 1 
ATOM   11466 O  O    . ARG   A  1  743 ? -6.947  -17.504 -17.326 1.000 20.803  0 798  ARG   A O    1 ? 1 
ATOM   11467 C  CB   . ARG   A  1  743 ? -4.896  -17.080 -14.917 1.000 23.528  0 798  ARG   A CB   1 ? 1 
ATOM   11468 C  CG   . ARG   A  1  743 ? -4.279  -16.104 -13.947 1.000 23.867  0 798  ARG   A CG   1 ? 1 
ATOM   11469 C  CD   . ARG   A  1  743 ? -2.835  -15.944 -14.187 1.000 32.022  0 798  ARG   A CD   1 ? 1 
ATOM   11470 N  NE   . ARG   A  1  743 ? -2.186  -17.250 -14.230 1.000 44.608  0 798  ARG   A NE   1 ? 1 
ATOM   11471 C  CZ   . ARG   A  1  743 ? -1.291  -17.626 -15.139 1.000 49.813  0 798  ARG   A CZ   1 ? 1 
ATOM   11472 N  NH1  . ARG   A  1  743 ? -0.806  -16.770 -16.026 1.000 49.336  0 798  ARG   A NH1  1 ? 1 
ATOM   11473 N  NH2  . ARG   A  1  743 ? -0.881  -18.894 -15.162 1.000 59.921  0 798  ARG   A NH2  1 ? 1 
ATOM   11474 H  H    . ARG   A  1  743 ? -6.438  -15.152 -16.023 1.000 21.140  0 798  ARG   A H    1 c 1 
ATOM   11475 H  HA   . ARG   A  1  743 ? -4.064  -16.469 -16.717 1.000 23.804  0 798  ARG   A HA   1 c 1 
ATOM   11476 H  HB2  . ARG   A  1  743 ? -5.802  -17.293 -14.613 1.000 24.034  0 798  ARG   A HB2  1 c 1 
ATOM   11477 H  HB3  . ARG   A  1  743 ? -4.376  -17.910 -14.909 1.000 24.405  0 798  ARG   A HB3  1 c 1 
ATOM   11478 H  HG2  . ARG   A  1  743 ? -4.719  -15.232 -14.034 1.000 25.069  0 798  ARG   A HG2  1 c 1 
ATOM   11479 H  HG3  . ARG   A  1  743 ? -4.419  -16.424 -13.030 1.000 25.211  0 798  ARG   A HG3  1 c 1 
ATOM   11480 H  HD2  . ARG   A  1  743 ? -2.694  -15.474 -15.036 1.000 32.196  0 798  ARG   A HD2  1 c 1 
ATOM   11481 H  HD3  . ARG   A  1  743 ? -2.440  -15.404 -13.469 1.000 31.751  0 798  ARG   A HD3  1 c 1 
ATOM   11482 H  HE   . ARG   A  1  743 ? -2.397  -17.827 -13.610 1.000 42.141  0 798  ARG   A HE   1 c 1 
ATOM   11483 H  HH11 . ARG   A  1  743 ? -0.464  -16.004 -15.756 1.000 48.896  0 798  ARG   A HH11 1 c 1 
ATOM   11484 H  HH12 . ARG   A  1  743 ? -0.826  -16.971 -16.885 1.000 49.683  0 798  ARG   A HH12 1 c 1 
ATOM   11485 H  HH21 . ARG   A  1  743 ? -0.261  -19.143 -15.734 1.000 56.870  0 798  ARG   A HH21 1 c 1 
ATOM   11486 H  HH22 . ARG   A  1  743 ? -1.230  -19.479 -14.607 1.000 56.532  0 798  ARG   A HH22 1 c 1 
ATOM   11487 N  N    . PRO   A  1  744 ? -5.000  -18.541 -17.863 1.000 24.354  0 799  PRO   A N    1 ? 1 
ATOM   11488 C  CA   . PRO   A  1  744 ? -5.599  -19.586 -18.690 1.000 25.242  0 799  PRO   A CA   1 ? 1 
ATOM   11489 C  C    . PRO   A  1  744 ? -6.197  -20.759 -17.929 1.000 22.980  0 799  PRO   A C    1 ? 1 
ATOM   11490 O  O    . PRO   A  1  744 ? -6.624  -21.714 -18.565 1.000 22.793  0 799  PRO   A O    1 ? 1 
ATOM   11491 C  CB   . PRO   A  1  744 ? -4.391  -20.065 -19.516 1.000 24.903  0 799  PRO   A CB   1 ? 1 
ATOM   11492 C  CG   . PRO   A  1  744 ? -3.262  -19.895 -18.596 1.000 23.665  0 799  PRO   A CG   1 ? 1 
ATOM   11493 C  CD   . PRO   A  1  744 ? -3.525  -18.626 -17.877 1.000 25.144  0 799  PRO   A CD   1 ? 1 
ATOM   11494 H  HA   . PRO   A  1  744 ? -6.276  -19.187 -19.291 1.000 24.646  0 799  PRO   A HA   1 c 1 
ATOM   11495 H  HB2  . PRO   A  1  744 ? -4.489  -21.004 -19.782 1.000 25.231  0 799  PRO   A HB2  1 c 1 
ATOM   11496 H  HB3  . PRO   A  1  744 ? -4.273  -19.517 -20.320 1.000 24.874  0 799  PRO   A HB3  1 c 1 
ATOM   11497 H  HG2  . PRO   A  1  744 ? -3.214  -20.644 -17.967 1.000 24.551  0 799  PRO   A HG2  1 c 1 
ATOM   11498 H  HG3  . PRO   A  1  744 ? -2.418  -19.844 -19.089 1.000 24.497  0 799  PRO   A HG3  1 c 1 
ATOM   11499 H  HD2  . PRO   A  1  744 ? -3.167  -18.656 -16.970 1.000 24.313  0 799  PRO   A HD2  1 c 1 
ATOM   11500 H  HD3  . PRO   A  1  744 ? -3.134  -17.867 -18.349 1.000 24.358  0 799  PRO   A HD3  1 c 1 
ATOM   11501 N  N    . ASP   A  1  745 ? -6.153  -20.682 -16.588 1.000 24.343  0 800  ASP   A N    1 ? 1 
ATOM   11502 C  CA   . ASP   A  1  745 ? -6.769  -21.642 -15.686 1.000 22.877  0 800  ASP   A CA   1 ? 1 
ATOM   11503 C  C    . ASP   A  1  745 ? -7.264  -20.899 -14.449 1.000 21.953  0 800  ASP   A C    1 ? 1 
ATOM   11504 O  O    . ASP   A  1  745 ? -7.001  -19.712 -14.286 1.000 18.809  0 800  ASP   A O    1 ? 1 
ATOM   11505 C  CB   . ASP   A  1  745 ? -5.784  -22.734 -15.262 1.000 22.949  0 800  ASP   A CB   1 ? 1 
ATOM   11506 C  CG   . ASP   A  1  745 ? -4.547  -22.175 -14.636 1.000 31.087  0 800  ASP   A CG   1 ? 1 
ATOM   11507 O  OD1  . ASP   A  1  745 ? -4.659  -21.617 -13.530 1.000 25.488  0 800  ASP   A OD1  1 ? 1 
ATOM   11508 O  OD2  . ASP   A  1  745 ? -3.469  -22.218 -15.295 1.000 35.559  0 800  ASP   A OD2  1 ? 1 
ATOM   11509 H  H    . ASP   A  1  745 ? -5.693  -19.989 -16.212 1.000 23.214  0 800  ASP   A H    1 c 1 
ATOM   11510 H  HA   . ASP   A  1  745 ? -7.538  -22.060 -16.140 1.000 23.392  0 800  ASP   A HA   1 c 1 
ATOM   11511 H  HB2  . ASP   A  1  745 ? -6.218  -23.330 -14.618 1.000 24.786  0 800  ASP   A HB2  1 c 1 
ATOM   11512 H  HB3  . ASP   A  1  745 ? -5.528  -23.261 -16.046 1.000 25.084  0 800  ASP   A HB3  1 c 1 
ATOM   11513 N  N    . ASN   A  1  746 ? -8.043  -21.591 -13.614 1.000 22.523  0 801  ASN   A N    1 ? 1 
ATOM   11514 C  CA   . ASN   A  1  746 ? -8.497  -21.013 -12.369 1.000 21.665  0 801  ASN   A CA   1 ? 1 
ATOM   11515 C  C    . ASN   A  1  746 ? -7.976  -21.839 -11.191 1.000 19.694  0 801  ASN   A C    1 ? 1 
ATOM   11516 O  O    . ASN   A  1  746 ? -8.689  -22.078 -10.213 1.000 19.019  0 801  ASN   A O    1 ? 1 
ATOM   11517 C  CB   . ASN   A  1  746 ? -9.994  -20.840 -12.383 1.000 24.414  0 801  ASN   A CB   1 ? 1 
ATOM   11518 C  CG   . ASN   A  1  746 ? -10.438 -19.731 -13.311 1.000 28.835  0 801  ASN   A CG   1 ? 1 
ATOM   11519 O  OD1  . ASN   A  1  746 ? -10.157 -18.532 -13.097 1.000 25.712  0 801  ASN   A OD1  1 ? 1 
ATOM   11520 N  ND2  . ASN   A  1  746 ? -11.161 -20.095 -14.368 1.000 24.999  0 801  ASN   A ND2  1 ? 1 
ATOM   11521 H  H    . ASN   A  1  746 ? -8.297  -22.443 -13.828 1.000 22.744  0 801  ASN   A H    1 c 1 
ATOM   11522 H  HA   . ASN   A  1  746 ? -8.106  -20.112 -12.295 1.000 21.454  0 801  ASN   A HA   1 c 1 
ATOM   11523 H  HB2  . ASN   A  1  746 ? -10.409 -21.682 -12.663 1.000 25.106  0 801  ASN   A HB2  1 c 1 
ATOM   11524 H  HB3  . ASN   A  1  746 ? -10.301 -20.638 -11.476 1.000 24.444  0 801  ASN   A HB3  1 c 1 
ATOM   11525 H  HD21 . ASN   A  1  746 ? -11.141 -20.932 -14.652 1.000 26.513  0 801  ASN   A HD21 1 c 1 
ATOM   11526 H  HD22 . ASN   A  1  746 ? -11.663 -19.499 -14.786 1.000 26.150  0 801  ASN   A HD22 1 c 1 
ATOM   11527 N  N    . ASP   A  1  747 ? -6.712  -22.257 -11.306 1.000 19.463  0 802  ASP   A N    1 ? 1 
ATOM   11528 C  CA   . ASP   A  1  747 ? -6.052  -23.025 -10.269 1.000 22.394  0 802  ASP   A CA   1 ? 1 
ATOM   11529 C  C    . ASP   A  1  747 ? -5.910  -22.211 -8.987  1.000 22.896  0 802  ASP   A C    1 ? 1 
ATOM   11530 O  O    . ASP   A  1  747 ? -5.825  -22.782 -7.904  1.000 20.899  0 802  ASP   A O    1 ? 1 
ATOM   11531 C  CB   . ASP   A  1  747 ? -4.674  -23.476 -10.744 1.000 31.452  0 802  ASP   A CB   1 ? 1 
ATOM   11532 C  CG   . ASP   A  1  747 ? -4.709  -24.607 -11.748 1.000 33.496  0 802  ASP   A CG   1 ? 1 
ATOM   11533 O  OD1  . ASP   A  1  747 ? -5.799  -25.165 -11.970 1.000 27.826  0 802  ASP   A OD1  1 ? 1 
ATOM   11534 O  OD2  . ASP   A  1  747 ? -3.654  -24.938 -12.285 1.000 42.522  0 802  ASP   A OD2  1 ? 1 
ATOM   11535 H  H    . ASP   A  1  747 ? -6.240  -22.047 -12.059 1.000 20.248  0 802  ASP   A H    1 c 1 
ATOM   11536 H  HA   . ASP   A  1  747 ? -6.598  -23.823 -10.076 1.000 23.660  0 802  ASP   A HA   1 c 1 
ATOM   11537 H  HB2  . ASP   A  1  747 ? -4.205  -22.717 -11.146 1.000 28.887  0 802  ASP   A HB2  1 c 1 
ATOM   11538 H  HB3  . ASP   A  1  747 ? -4.158  -23.780 -9.971  1.000 29.356  0 802  ASP   A HB3  1 c 1 
ATOM   11539 N  N    . GLU   A  1  748 ? -5.921  -20.881 -9.124  1.000 24.273  0 803  GLU   A N    1 ? 1 
ATOM   11540 C  CA   . GLU   A  1  748 ? -5.884  -19.977 -7.985  1.000 30.127  0 803  GLU   A CA   1 ? 1 
ATOM   11541 C  C    . GLU   A  1  748 ? -7.114  -20.141 -7.091  1.000 30.985  0 803  GLU   A C    1 ? 1 
ATOM   11542 O  O    . GLU   A  1  748 ? -7.013  -20.021 -5.865  1.000 19.085  0 803  GLU   A O    1 ? 1 
ATOM   11543 C  CB   . GLU   A  1  748 ? -5.759  -18.520 -8.458  1.000 31.579  0 803  GLU   A CB   1 ? 1 
ATOM   11544 C  CG   . GLU   A  1  748 ? -5.559  -17.556 -7.282  1.000 40.951  0 803  GLU   A CG   1 ? 1 
ATOM   11545 C  CD   . GLU   A  1  748 ? -5.376  -16.088 -7.611  1.000 26.754  0 803  GLU   A CD   1 ? 1 
ATOM   11546 O  OE1  . GLU   A  1  748 ? -5.369  -15.715 -8.802  1.000 21.652  0 803  GLU   A OE1  1 ? 1 
ATOM   11547 O  OE2  . GLU   A  1  748 ? -5.225  -15.311 -6.656  1.000 26.127  0 803  GLU   A OE2  1 ? 1 
ATOM   11548 H  H    . GLU   A  1  748 ? -5.930  -20.520 -9.963  1.000 24.889  0 803  GLU   A H    1 c 1 
ATOM   11549 H  HA   . GLU   A  1  748 ? -5.086  -20.198 -7.452  1.000 29.138  0 803  GLU   A HA   1 c 1 
ATOM   11550 H  HB2  . GLU   A  1  748 ? -4.998  -18.447 -9.071  1.000 33.038  0 803  GLU   A HB2  1 c 1 
ATOM   11551 H  HB3  . GLU   A  1  748 ? -6.572  -18.272 -8.946  1.000 33.079  0 803  GLU   A HB3  1 c 1 
ATOM   11552 H  HG2  . GLU   A  1  748 ? -6.332  -17.631 -6.684  1.000 34.700  0 803  GLU   A HG2  1 c 1 
ATOM   11553 H  HG3  . GLU   A  1  748 ? -4.773  -17.849 -6.773  1.000 34.814  0 803  GLU   A HG3  1 c 1 
ATOM   11554 N  N    . SER   A  1  749 ? -8.268  -20.426 -7.711  1.000 22.917  0 804  SER   A N    1 ? 1 
ATOM   11555 C  CA   . SER   A  1  749 ? -9.522  -20.557 -6.977  1.000 22.403  0 804  SER   A CA   1 ? 1 
ATOM   11556 C  C    . SER   A  1  749 ? -9.846  -22.032 -6.725  1.000 26.367  0 804  SER   A C    1 ? 1 
ATOM   11557 O  O    . SER   A  1  749 ? -10.276 -22.726 -7.625  1.000 23.234  0 804  SER   A O    1 ? 1 
ATOM   11558 C  CB   . SER   A  1  749 ? -10.639 -19.889 -7.772  1.000 25.492  0 804  SER   A CB   1 ? 1 
ATOM   11559 O  OG   . SER   A  1  749 ? -10.388 -18.509 -8.056  1.000 22.884  0 804  SER   A OG   1 ? 1 
ATOM   11560 H  H    . SER   A  1  749 ? -8.279  -20.533 -8.619  1.000 24.545  0 804  SER   A H    1 c 1 
ATOM   11561 H  HA   . SER   A  1  749 ? -9.431  -20.094 -6.102  1.000 23.424  0 804  SER   A HA   1 c 1 
ATOM   11562 H  HB2  . SER   A  1  749 ? -10.755 -20.369 -8.620  1.000 24.489  0 804  SER   A HB2  1 c 1 
ATOM   11563 H  HB3  . SER   A  1  749 ? -11.480 -19.966 -7.267  1.000 24.389  0 804  SER   A HB3  1 c 1 
ATOM   11564 H  HG   . SER   A  1  749 ? -9.975  -18.470 -8.805  0.000 13.920  0 804  SER   A HG   1 c 1 
ATOM   11565 N  N    . CYS   A  1  750 ? -9.650  -22.528 -5.501  1.000 28.118  0 805  CYS   A N    1 ? 1 
ATOM   11566 C  CA   . CYS   A  1  750 ? -9.751  -23.954 -5.227  1.000 26.810  0 805  CYS   A CA   1 ? 1 
ATOM   11567 C  C    . CYS   A  1  750 ? -11.162 -24.522 -5.396  1.000 22.395  0 805  CYS   A C    1 ? 1 
ATOM   11568 O  O    . CYS   A  1  750 ? -11.315 -25.728 -5.507  1.000 21.416  0 805  CYS   A O    1 ? 1 
ATOM   11569 C  CB   . CYS   A  1  750 ? -9.186  -24.276 -3.840  1.000 23.942  0 805  CYS   A CB   1 ? 1 
ATOM   11570 S  SG   . CYS   A  1  750 ? -7.372  -24.055 -3.730  1.000 28.361  0 805  CYS   A SG   1 ? 1 
ATOM   11571 H  H    . CYS   A  1  750 ? -9.448  -21.960 -4.814  1.000 26.870  0 805  CYS   A H    1 c 1 
ATOM   11572 H  HA   . CYS   A  1  750 ? -9.180  -24.407 -5.886  1.000 25.711  0 805  CYS   A HA   1 c 1 
ATOM   11573 H  HB2  . CYS   A  1  750 ? -9.612  -23.695 -3.177  1.000 25.224  0 805  CYS   A HB2  1 c 1 
ATOM   11574 H  HB3  . CYS   A  1  750 ? -9.401  -25.203 -3.613  1.000 25.859  0 805  CYS   A HB3  1 c 1 
ATOM   11575 N  N    . ASN   A  1  751 ? -12.172 -23.652 -5.388  1.000 20.233  0 806  ASN   A N    1 ? 1 
ATOM   11576 C  CA   . ASN   A  1  751 ? -13.551 -24.073 -5.550  1.000 27.690  0 806  ASN   A CA   1 ? 1 
ATOM   11577 C  C    . ASN   A  1  751 ? -14.068 -23.823 -6.967  1.000 25.464  0 806  ASN   A C    1 ? 1 
ATOM   11578 O  O    . ASN   A  1  751 ? -15.269 -23.882 -7.211  1.000 30.099  0 806  ASN   A O    1 ? 1 
ATOM   11579 C  CB   . ASN   A  1  751 ? -14.356 -23.379 -4.465  1.000 35.960  0 806  ASN   A CB   1 ? 1 
ATOM   11580 C  CG   . ASN   A  1  751 ? -14.039 -23.994 -3.081  1.000 93.174  0 806  ASN   A CG   1 ? 1 
ATOM   11581 O  OD1  . ASN   A  1  751 ? -12.878 -24.016 -2.620  1.000 111.261 0 806  ASN   A OD1  1 ? 1 
ATOM   11582 N  ND2  . ASN   A  1  751 ? -15.053 -24.549 -2.396  1.000 120.866 0 806  ASN   A ND2  1 ? 1 
ATOM   11583 H  H    . ASN   A  1  751 ? -12.000 -22.763 -5.265  1.000 21.845  0 806  ASN   A H    1 c 1 
ATOM   11584 H  HA   . ASN   A  1  751 ? -13.599 -25.042 -5.374  1.000 27.370  0 806  ASN   A HA   1 c 1 
ATOM   11585 H  HB2  . ASN   A  1  751 ? -14.140 -22.425 -4.457  1.000 40.657  0 806  ASN   A HB2  1 c 1 
ATOM   11586 H  HB3  . ASN   A  1  751 ? -15.311 -23.478 -4.655  1.000 41.840  0 806  ASN   A HB3  1 c 1 
ATOM   11587 H  HD21 . ASN   A  1  751 ? -15.865 -24.571 -2.746  1.000 109.419 0 806  ASN   A HD21 1 c 1 
ATOM   11588 H  HD22 . ASN   A  1  751 ? -14.910 -24.892 -1.595  1.000 111.219 0 806  ASN   A HD22 1 c 1 
ATOM   11589 N  N    . SER   A  1  752 ? -13.132 -23.592 -7.904  1.000 26.763  0 807  SER   A N    1 ? 1 
ATOM   11590 C  CA   . SER   A  1  752 ? -13.454 -23.174 -9.253  1.000 27.724  0 807  SER   A CA   1 ? 1 
ATOM   11591 C  C    . SER   A  1  752 ? -14.149 -24.244 -10.108 1.000 28.101  0 807  SER   A C    1 ? 1 
ATOM   11592 O  O    . SER   A  1  752 ? -14.698 -23.943 -11.162 1.000 30.095  0 807  SER   A O    1 ? 1 
ATOM   11593 C  CB   . SER   A  1  752 ? -12.186 -22.662 -9.958  1.000 24.849  0 807  SER   A CB   1 ? 1 
ATOM   11594 O  OG   . SER   A  1  752 ? -11.232 -23.685 -10.195 1.000 21.956  0 807  SER   A OG   1 ? 1 
ATOM   11595 H  H    . SER   A  1  752 ? -12.252 -23.713 -7.690  1.000 26.328  0 807  SER   A H    1 c 1 
ATOM   11596 H  HA   . SER   A  1  752 ? -14.079 -22.412 -9.176  1.000 26.801  0 807  SER   A HA   1 c 1 
ATOM   11597 H  HB2  . SER   A  1  752 ? -12.442 -22.257 -10.818 1.000 24.492  0 807  SER   A HB2  1 c 1 
ATOM   11598 H  HB3  . SER   A  1  752 ? -11.778 -21.962 -9.409  1.000 24.090  0 807  SER   A HB3  1 c 1 
ATOM   11599 H  HG   . SER   A  1  752 ? -11.393 -24.021 -10.959 0.000 11.330  0 807  SER   A HG   1 c 1 
ATOM   11600 N  N    . SER   A  1  753 ? -14.189 -25.489 -9.641  1.000 24.386  0 808  SER   A N    1 ? 1 
ATOM   11601 C  CA   . SER   A  1  753 ? -14.924 -26.536 -10.339 1.000 28.410  0 808  SER   A CA   1 ? 1 
ATOM   11602 C  C    . SER   A  1  753 ? -16.396 -26.531 -9.954  1.000 25.679  0 808  SER   A C    1 ? 1 
ATOM   11603 O  O    . SER   A  1  753 ? -17.178 -27.303 -10.495 1.000 32.326  0 808  SER   A O    1 ? 1 
ATOM   11604 C  CB   . SER   A  1  753 ? -14.306 -27.908 -10.105 1.000 29.248  0 808  SER   A CB   1 ? 1 
ATOM   11605 O  OG   . SER   A  1  753 ? -14.493 -28.258 -8.755  1.000 35.278  0 808  SER   A OG   1 ? 1 
ATOM   11606 H  H    . SER   A  1  753 ? -13.744 -25.702 -8.872  1.000 26.096  0 808  SER   A H    1 c 1 
ATOM   11607 H  HA   . SER   A  1  753 ? -14.869 -26.343 -11.314 1.000 27.205  0 808  SER   A HA   1 c 1 
ATOM   11608 H  HB2  . SER   A  1  753 ? -14.738 -28.573 -10.687 1.000 30.957  0 808  SER   A HB2  1 c 1 
ATOM   11609 H  HB3  . SER   A  1  753 ? -13.345 -27.883 -10.316 1.000 30.290  0 808  SER   A HB3  1 c 1 
ATOM   11610 H  HG   . SER   A  1  753 ? -15.211 -28.674 -8.696  0.000 21.700  0 808  SER   A HG   1 c 1 
ATOM   11611 N  N    . GLU   A  1  754 ? -16.769 -25.626 -9.048  1.000 23.082  0 809  GLU   A N    1 ? 1 
ATOM   11612 C  CA   . GLU   A  1  754 ? -18.164 -25.358 -8.771  1.000 25.835  0 809  GLU   A CA   1 ? 1 
ATOM   11613 C  C    . GLU   A  1  754 ? -18.686 -24.153 -9.562  1.000 27.661  0 809  GLU   A C    1 ? 1 
ATOM   11614 O  O    . GLU   A  1  754 ? -17.932 -23.477 -10.260 1.000 27.106  0 809  GLU   A O    1 ? 1 
ATOM   11615 C  CB   . GLU   A  1  754 ? -18.303 -25.112 -7.290  1.000 27.313  0 809  GLU   A CB   1 ? 1 
ATOM   11616 C  CG   . GLU   A  1  754 ? -17.780 -26.256 -6.434  1.000 40.457  0 809  GLU   A CG   1 ? 1 
ATOM   11617 C  CD   . GLU   A  1  754 ? -17.801 -25.968 -4.936  1.000 48.879  0 809  GLU   A CD   1 ? 1 
ATOM   11618 O  OE1  . GLU   A  1  754 ? -18.923 -25.902 -4.381  1.000 61.159  0 809  GLU   A OE1  1 ? 1 
ATOM   11619 O  OE2  . GLU   A  1  754 ? -16.714 -25.808 -4.325  1.000 52.802  0 809  GLU   A OE2  1 ? 1 
ATOM   11620 H  H    . GLU   A  1  754 ? -16.134 -25.173 -8.572  1.000 23.827  0 809  GLU   A H    1 c 1 
ATOM   11621 H  HA   . GLU   A  1  754 ? -18.695 -26.151 -9.013  1.000 26.545  0 809  GLU   A HA   1 c 1 
ATOM   11622 H  HB2  . GLU   A  1  754 ? -17.816 -24.293 -7.061  1.000 28.640  0 809  GLU   A HB2  1 c 1 
ATOM   11623 H  HB3  . GLU   A  1  754 ? -19.249 -24.967 -7.082  1.000 29.439  0 809  GLU   A HB3  1 c 1 
ATOM   11624 H  HG2  . GLU   A  1  754 ? -18.322 -27.056 -6.605  1.000 38.749  0 809  GLU   A HG2  1 c 1 
ATOM   11625 H  HG3  . GLU   A  1  754 ? -16.858 -26.460 -6.697  1.000 37.817  0 809  GLU   A HG3  1 c 1 
ATOM   11626 N  N    . ASP   A  1  755 ? -19.977 -23.866 -9.392  1.000 28.626  0 810  ASP   A N    1 ? 1 
ATOM   11627 C  CA   . ASP   A  1  755 ? -20.602 -22.687 -9.968  1.000 29.965  0 810  ASP   A CA   1 ? 1 
ATOM   11628 C  C    . ASP   A  1  755 ? -19.846 -21.426 -9.539  1.000 35.216  0 810  ASP   A C    1 ? 1 
ATOM   11629 O  O    . ASP   A  1  755 ? -19.345 -21.349 -8.418  1.000 24.680  0 810  ASP   A O    1 ? 1 
ATOM   11630 C  CB   . ASP   A  1  755 ? -22.078 -22.564 -9.540  1.000 29.972  0 810  ASP   A CB   1 ? 1 
ATOM   11631 C  CG   . ASP   A  1  755 ? -22.838 -21.481 -10.296 1.000 36.583  0 810  ASP   A CG   1 ? 1 
ATOM   11632 O  OD1  . ASP   A  1  755 ? -22.990 -21.618 -11.516 1.000 46.550  0 810  ASP   A OD1  1 ? 1 
ATOM   11633 O  OD2  . ASP   A  1  755 ? -23.259 -20.454 -9.648  1.000 40.258  0 810  ASP   A OD2  1 ? 1 
ATOM   11634 H  H    . ASP   A  1  755 ? -20.497 -24.436 -8.902  1.000 29.200  0 810  ASP   A H    1 c 1 
ATOM   11635 H  HA   . ASP   A  1  755 ? -20.564 -22.764 -10.950 1.000 30.643  0 810  ASP   A HA   1 c 1 
ATOM   11636 H  HB2  . ASP   A  1  755 ? -22.528 -23.420 -9.691  1.000 32.010  0 810  ASP   A HB2  1 c 1 
ATOM   11637 H  HB3  . ASP   A  1  755 ? -22.119 -22.361 -8.583  1.000 31.378  0 810  ASP   A HB3  1 c 1 
ATOM   11638 N  N    . GLU   A  1  756 ? -19.839 -20.441 -10.449 1.000 29.676  0 811  GLU   A N    1 ? 1 
ATOM   11639 C  CA   . GLU   A  1  756 ? -19.164 -19.174 -10.290 1.000 28.644  0 811  GLU   A CA   1 ? 1 
ATOM   11640 C  C    . GLU   A  1  756 ? -19.613 -18.432 -9.043  1.000 27.510  0 811  GLU   A C    1 ? 1 
ATOM   11641 O  O    . GLU   A  1  756 ? -18.852 -17.646 -8.492  1.000 31.337  0 811  GLU   A O    1 ? 1 
ATOM   11642 C  CB   . GLU   A  1  756 ? -19.369 -18.274 -11.536 1.000 25.109  0 811  GLU   A CB   1 ? 1 
ATOM   11643 C  CG   . GLU   A  1  756 ? -18.511 -18.671 -12.725 1.000 29.096  0 811  GLU   A CG   1 ? 1 
ATOM   11644 C  CD   . GLU   A  1  756 ? -19.012 -19.884 -13.484 1.000 31.126  0 811  GLU   A CD   1 ? 1 
ATOM   11645 O  OE1  . GLU   A  1  756 ? -20.115 -20.387 -13.142 1.000 30.321  0 811  GLU   A OE1  1 ? 1 
ATOM   11646 O  OE2  . GLU   A  1  756 ? -18.276 -20.364 -14.374 1.000 36.617  0 811  GLU   A OE2  1 ? 1 
ATOM   11647 H  H    . GLU   A  1  756 ? -20.303 -20.579 -11.225 1.000 30.979  0 811  GLU   A H    1 c 1 
ATOM   11648 H  HA   . GLU   A  1  756 ? -18.202 -19.358 -10.202 1.000 27.548  0 811  GLU   A HA   1 c 1 
ATOM   11649 H  HB2  . GLU   A  1  756 ? -20.313 -18.304 -11.795 1.000 27.127  0 811  GLU   A HB2  1 c 1 
ATOM   11650 H  HB3  . GLU   A  1  756 ? -19.155 -17.350 -11.289 1.000 26.281  0 811  GLU   A HB3  1 c 1 
ATOM   11651 H  HG2  . GLU   A  1  756 ? -18.462 -17.915 -13.348 1.000 28.212  0 811  GLU   A HG2  1 c 1 
ATOM   11652 H  HG3  . GLU   A  1  756 ? -17.600 -18.856 -12.412 1.000 28.070  0 811  GLU   A HG3  1 c 1 
ATOM   11653 N  N    . SER   A  1  757 ? -20.845 -18.678 -8.605  1.000 26.027  0 812  SER   A N    1 ? 1 
ATOM   11654 C  CA   . SER   A  1  757 ? -21.346 -18.067 -7.385  1.000 31.339  0 812  SER   A CA   1 ? 1 
ATOM   11655 C  C    . SER   A  1  757 ? -20.542 -18.437 -6.146  1.000 29.467  0 812  SER   A C    1 ? 1 
ATOM   11656 O  O    . SER   A  1  757 ? -20.707 -17.783 -5.124  1.000 27.118  0 812  SER   A O    1 ? 1 
ATOM   11657 C  CB   . SER   A  1  757 ? -22.801 -18.465 -7.117  1.000 32.261  0 812  SER   A CB   1 ? 1 
ATOM   11658 O  OG   . SER   A  1  757 ? -22.896 -19.859 -6.908  1.000 32.259  0 812  SER   A OG   1 ? 1 
ATOM   11659 H  H    . SER   A  1  757 ? -21.399 -19.223 -9.085  1.000 28.147  0 812  SER   A H    1 c 1 
ATOM   11660 H  HA   . SER   A  1  757 ? -21.304 -17.082 -7.495  1.000 29.599  0 812  SER   A HA   1 c 1 
ATOM   11661 H  HB2  . SER   A  1  757 ? -23.131 -17.988 -6.322  1.000 32.046  0 812  SER   A HB2  1 c 1 
ATOM   11662 H  HB3  . SER   A  1  757 ? -23.359 -18.207 -7.885  1.000 32.313  0 812  SER   A HB3  1 c 1 
ATOM   11663 H  HG   . SER   A  1  757 ? -22.806 -20.025 -6.091  0.000 18.250  0 812  SER   A HG   1 c 1 
ATOM   11664 N  N    . LYS   A  1  758 ? -19.734 -19.504 -6.232  1.000 27.576  0 813  LYS   A N    1 ? 1 
ATOM   11665 C  CA   . LYS   A  1  758 ? -18.982 -20.001 -5.086  1.000 29.863  0 813  LYS   A CA   1 ? 1 
ATOM   11666 C  C    . LYS   A  1  758 ? -17.549 -19.481 -5.013  1.000 29.133  0 813  LYS   A C    1 ? 1 
ATOM   11667 O  O    . LYS   A  1  758 ? -16.856 -19.679 -4.012  1.000 37.426  0 813  LYS   A O    1 ? 1 
ATOM   11668 C  CB   . LYS   A  1  758 ? -18.849 -21.547 -5.113  1.000 31.783  0 813  LYS   A CB   1 ? 1 
ATOM   11669 C  CG   . LYS   A  1  758 ? -20.148 -22.357 -5.252  1.000 35.414  0 813  LYS   A CG   1 ? 1 
ATOM   11670 C  CD   . LYS   A  1  758 ? -21.122 -22.092 -4.147  1.000 48.535  0 813  LYS   A CD   1 ? 1 
ATOM   11671 C  CE   . LYS   A  1  758 ? -22.335 -22.990 -4.226  1.000 48.737  0 813  LYS   A CE   1 ? 1 
ATOM   11672 N  NZ   . LYS   A  1  758 ? -22.973 -23.117 -2.893  1.000 70.913  0 813  LYS   A NZ   1 ? 1 
ATOM   11673 H  H    . LYS   A  1  758 ? -19.661 -19.951 -7.025  1.000 28.722  0 813  LYS   A H    1 c 1 
ATOM   11674 H  HA   . LYS   A  1  758 ? -19.455 -19.739 -4.262  1.000 29.713  0 813  LYS   A HA   1 c 1 
ATOM   11675 H  HB2  . LYS   A  1  758 ? -18.260 -21.788 -5.859  1.000 31.951  0 813  LYS   A HB2  1 c 1 
ATOM   11676 H  HB3  . LYS   A  1  758 ? -18.403 -21.828 -4.287  1.000 32.024  0 813  LYS   A HB3  1 c 1 
ATOM   11677 H  HG2  . LYS   A  1  758 ? -20.569 -22.136 -6.110  1.000 37.324  0 813  LYS   A HG2  1 c 1 
ATOM   11678 H  HG3  . LYS   A  1  758 ? -19.926 -23.312 -5.262  1.000 37.600  0 813  LYS   A HG3  1 c 1 
ATOM   11679 H  HD2  . LYS   A  1  758 ? -20.676 -22.231 -3.285  1.000 44.938  0 813  LYS   A HD2  1 c 1 
ATOM   11680 H  HD3  . LYS   A  1  758 ? -21.414 -21.156 -4.192  1.000 44.585  0 813  LYS   A HD3  1 c 1 
ATOM   11681 H  HE2  . LYS   A  1  758 ? -22.980 -22.619 -4.857  1.000 53.268  0 813  LYS   A HE2  1 c 1 
ATOM   11682 H  HE3  . LYS   A  1  758 ? -22.072 -23.875 -4.541  1.000 53.190  0 813  LYS   A HE3  1 c 1 
ATOM   11683 H  HZ1  . LYS   A  1  758 ? -23.172 -22.294 -2.568  1.000 62.635  0 813  LYS   A HZ1  1 c 1 
ATOM   11684 H  HZ2  . LYS   A  1  758 ? -22.409 -23.535 -2.320  1.000 62.771  0 813  LYS   A HZ2  1 c 1 
ATOM   11685 H  HZ3  . LYS   A  1  758 ? -23.737 -23.601 -2.964  1.000 63.501  0 813  LYS   A HZ3  1 c 1 
ATOM   11686 N  N    . TRP   A  1  759 ? -17.050 -18.878 -6.085  1.000 25.990  0 814  TRP   A N    1 ? 1 
ATOM   11687 C  CA   . TRP   A  1  759 ? -15.634 -18.538 -6.069  1.000 24.049  0 814  TRP   A CA   1 ? 1 
ATOM   11688 C  C    . TRP   A  1  759 ? -15.230 -17.239 -6.763  1.000 22.893  0 814  TRP   A C    1 ? 1 
ATOM   11689 O  O    . TRP   A  1  759 ? -14.211 -16.690 -6.385  1.000 19.634  0 814  TRP   A O    1 ? 1 
ATOM   11690 C  CB   . TRP   A  1  759 ? -14.818 -19.698 -6.648  1.000 21.315  0 814  TRP   A CB   1 ? 1 
ATOM   11691 C  CG   . TRP   A  1  759 ? -15.186 -20.070 -8.050  1.000 24.341  0 814  TRP   A CG   1 ? 1 
ATOM   11692 C  CD1  . TRP   A  1  759 ? -16.211 -20.877 -8.450  1.000 30.107  0 814  TRP   A CD1  1 ? 1 
ATOM   11693 C  CD2  . TRP   A  1  759 ? -14.535 -19.630 -9.244  1.000 23.234  0 814  TRP   A CD2  1 ? 1 
ATOM   11694 N  NE1  . TRP   A  1  759 ? -16.217 -20.992 -9.821  1.000 25.787  0 814  TRP   A NE1  1 ? 1 
ATOM   11695 C  CE2  . TRP   A  1  759 ? -15.208 -20.234 -10.338 1.000 24.835  0 814  TRP   A CE2  1 ? 1 
ATOM   11696 C  CE3  . TRP   A  1  759 ? -13.420 -18.816 -9.498  1.000 20.528  0 814  TRP   A CE3  1 ? 1 
ATOM   11697 C  CZ2  . TRP   A  1  759 ? -14.806 -20.057 -11.656 1.000 23.101  0 814  TRP   A CZ2  1 ? 1 
ATOM   11698 C  CZ3  . TRP   A  1  759 ? -13.027 -18.622 -10.821 1.000 32.382  0 814  TRP   A CZ3  1 ? 1 
ATOM   11699 C  CH2  . TRP   A  1  759 ? -13.727 -19.223 -11.885 1.000 24.110  0 814  TRP   A CH2  1 ? 1 
ATOM   11700 H  H    . TRP   A  1  759 ? -17.564 -18.691 -6.816  1.000 26.335  0 814  TRP   A H    1 c 1 
ATOM   11701 H  HA   . TRP   A  1  759 ? -15.371 -18.453 -5.124  1.000 23.517  0 814  TRP   A HA   1 c 1 
ATOM   11702 H  HB2  . TRP   A  1  759 ? -13.871 -19.452 -6.620  1.000 22.192  0 814  TRP   A HB2  1 c 1 
ATOM   11703 H  HB3  . TRP   A  1  759 ? -14.940 -20.478 -6.068  1.000 22.825  0 814  TRP   A HB3  1 c 1 
ATOM   11704 H  HD1  . TRP   A  1  759 ? -16.821 -21.309 -7.874  1.000 27.915  0 814  TRP   A HD1  1 c 1 
ATOM   11705 H  HE1  . TRP   A  1  759 ? -16.793 -21.460 -10.288 1.000 26.974  0 814  TRP   A HE1  1 c 1 
ATOM   11706 H  HE3  . TRP   A  1  759 ? -12.951 -18.408 -8.788  1.000 22.890  0 814  TRP   A HE3  1 c 1 
ATOM   11707 H  HZ2  . TRP   A  1  759 ? -15.282 -20.450 -12.366 1.000 24.292  0 814  TRP   A HZ2  1 c 1 
ATOM   11708 H  HZ3  . TRP   A  1  759 ? -12.290 -18.062 -11.010 1.000 26.334  0 814  TRP   A HZ3  1 c 1 
ATOM   11709 H  HH2  . TRP   A  1  759 ? -13.442 -19.072 -12.769 1.000 25.357  0 814  TRP   A HH2  1 c 1 
ATOM   11710 N  N    . VAL   A  1  760 ? -15.992 -16.756 -7.773  1.000 19.425  0 815  VAL   A N    1 ? 1 
ATOM   11711 C  CA   . VAL   A  1  760 ? -15.519 -15.643 -8.574  1.000 17.175  0 815  VAL   A CA   1 ? 1 
ATOM   11712 C  C    . VAL   A  1  760 ? -15.362 -14.377 -7.737  1.000 15.570  0 815  VAL   A C    1 ? 1 
ATOM   11713 O  O    . VAL   A  1  760 ? -14.382 -13.667 -7.891  1.000 19.002  0 815  VAL   A O    1 ? 1 
ATOM   11714 C  CB   . VAL   A  1  760 ? -16.394 -15.361 -9.809  1.000 18.928  0 815  VAL   A CB   1 ? 1 
ATOM   11715 C  CG1  . VAL   A  1  760 ? -15.976 -14.067 -10.486 1.000 18.280  0 815  VAL   A CG1  1 ? 1 
ATOM   11716 C  CG2  . VAL   A  1  760 ? -16.342 -16.521 -10.789 1.000 22.869  0 815  VAL   A CG2  1 ? 1 
ATOM   11717 H  H    . VAL   A  1  760 ? -16.806 -17.127 -7.960  1.000 20.166  0 815  VAL   A H    1 c 1 
ATOM   11718 H  HA   . VAL   A  1  760 ? -14.633 -15.884 -8.899  1.000 17.408  0 815  VAL   A HA   1 c 1 
ATOM   11719 H  HB   . VAL   A  1  760 ? -17.328 -15.260 -9.500  1.000 19.405  0 815  VAL   A HB   1 c 1 
ATOM   11720 H  HG11 . VAL   A  1  760 ? -15.005 -14.005 -10.496 1.000 18.070  0 815  VAL   A HG11 1 c 1 
ATOM   11721 H  HG12 . VAL   A  1  760 ? -16.345 -13.310 -9.999  1.000 18.233  0 815  VAL   A HG12 1 c 1 
ATOM   11722 H  HG13 . VAL   A  1  760 ? -16.310 -14.056 -11.399 1.000 18.613  0 815  VAL   A HG13 1 c 1 
ATOM   11723 H  HG21 . VAL   A  1  760 ? -16.908 -16.325 -11.556 1.000 21.914  0 815  VAL   A HG21 1 c 1 
ATOM   11724 H  HG22 . VAL   A  1  760 ? -16.659 -17.331 -10.352 1.000 21.982  0 815  VAL   A HG22 1 c 1 
ATOM   11725 H  HG23 . VAL   A  1  760 ? -15.426 -16.653 -11.089 1.000 21.509  0 815  VAL   A HG23 1 c 1 
ATOM   11726 N  N    . GLU   A  1  761 ? -16.361 -14.045 -6.926  1.000 15.959  0 816  GLU   A N    1 ? 1 
ATOM   11727 C  CA   . GLU   A  1  761 ? -16.346 -12.783 -6.207  1.000 22.639  0 816  GLU   A CA   1 ? 1 
ATOM   11728 C  C    . GLU   A  1  761 ? -15.245 -12.743 -5.143  1.000 26.113  0 816  GLU   A C    1 ? 1 
ATOM   11729 O  O    . GLU   A  1  761 ? -14.736 -11.674 -4.839  1.000 22.851  0 816  GLU   A O    1 ? 1 
ATOM   11730 C  CB   . GLU   A  1  761 ? -17.714 -12.516 -5.544  1.000 24.708  0 816  GLU   A CB   1 ? 1 
ATOM   11731 C  CG   . GLU   A  1  761 ? -17.861 -11.080 -5.065  1.000 29.610  0 816  GLU   A CG   1 ? 1 
ATOM   11732 C  CD   . GLU   A  1  761 ? -19.269 -10.698 -4.702  1.000 33.537  0 816  GLU   A CD   1 ? 1 
ATOM   11733 O  OE1  . GLU   A  1  761 ? -20.159 -11.569 -4.821  1.000 55.246  0 816  GLU   A OE1  1 ? 1 
ATOM   11734 O  OE2  . GLU   A  1  761 ? -19.493 -9.529  -4.323  1.000 43.349  0 816  GLU   A OE2  1 ? 1 
ATOM   11735 H  H    . GLU   A  1  761 ? -17.069 -14.612 -6.817  1.000 17.560  0 816  GLU   A H    1 c 1 
ATOM   11736 H  HA   . GLU   A  1  761 ? -16.172 -12.065 -6.858  1.000 21.462  0 816  GLU   A HA   1 c 1 
ATOM   11737 H  HB2  . GLU   A  1  761 ? -18.421 -12.714 -6.192  1.000 25.832  0 816  GLU   A HB2  1 c 1 
ATOM   11738 H  HB3  . GLU   A  1  761 ? -17.820 -13.122 -4.781  1.000 25.536  0 816  GLU   A HB3  1 c 1 
ATOM   11739 H  HG2  . GLU   A  1  761 ? -17.290 -10.945 -4.279  1.000 28.716  0 816  GLU   A HG2  1 c 1 
ATOM   11740 H  HG3  . GLU   A  1  761 ? -17.546 -10.475 -5.769  1.000 28.757  0 816  GLU   A HG3  1 c 1 
ATOM   11741 N  N    . GLU   A  1  762 ? -14.901 -13.912 -4.591  1.000 21.503  0 817  GLU   A N    1 ? 1 
ATOM   11742 C  CA   . GLU   A  1  762 ? -13.784 -14.041 -3.668  1.000 28.950  0 817  GLU   A CA   1 ? 1 
ATOM   11743 C  C    . GLU   A  1  762 ? -12.446 -13.843 -4.390  1.000 25.236  0 817  GLU   A C    1 ? 1 
ATOM   11744 O  O    . GLU   A  1  762 ? -11.523 -13.219 -3.866  1.000 20.599  0 817  GLU   A O    1 ? 1 
ATOM   11745 C  CB   . GLU   A  1  762 ? -13.865 -15.415 -2.960  1.000 28.386  0 817  GLU   A CB   1 ? 1 
ATOM   11746 C  CG   . GLU   A  1  762 ? -13.192 -15.444 -1.606  1.000 53.382  0 817  GLU   A CG   1 ? 1 
ATOM   11747 C  CD   . GLU   A  1  762 ? -13.869 -14.675 -0.476  1.000 57.551  0 817  GLU   A CD   1 ? 1 
ATOM   11748 O  OE1  . GLU   A  1  762 ? -15.071 -14.340 -0.591  1.000 45.448  0 817  GLU   A OE1  1 ? 1 
ATOM   11749 O  OE2  . GLU   A  1  762 ? -13.179 -14.400 0.532   1.000 58.700  0 817  GLU   A OE2  1 ? 1 
ATOM   11750 H  H    . GLU   A  1  762 ? -15.385 -14.660 -4.796  1.000 24.406  0 817  GLU   A H    1 c 1 
ATOM   11751 H  HA   . GLU   A  1  762 ? -13.872 -13.336 -2.986  1.000 26.295  0 817  GLU   A HA   1 c 1 
ATOM   11752 H  HB2  . GLU   A  1  762 ? -14.809 -15.656 -2.850  1.000 33.198  0 817  GLU   A HB2  1 c 1 
ATOM   11753 H  HB3  . GLU   A  1  762 ? -13.448 -16.089 -3.537  1.000 33.005  0 817  GLU   A HB3  1 c 1 
ATOM   11754 H  HG2  . GLU   A  1  762 ? -13.109 -16.380 -1.324  1.000 46.412  0 817  GLU   A HG2  1 c 1 
ATOM   11755 H  HG3  . GLU   A  1  762 ? -12.282 -15.095 -1.707  1.000 45.807  0 817  GLU   A HG3  1 c 1 
ATOM   11756 N  N    . LEU   A  1  763 ? -12.340 -14.309 -5.639  1.000 18.041  0 818  LEU   A N    1 ? 1 
ATOM   11757 C  CA   . LEU   A  1  763 ? -11.157 -14.020 -6.431  1.000 17.660  0 818  LEU   A CA   1 ? 1 
ATOM   11758 C  C    . LEU   A  1  763 ? -10.989 -12.513 -6.613  1.000 25.681  0 818  LEU   A C    1 ? 1 
ATOM   11759 O  O    . LEU   A  1  763 ? -9.886  -11.946 -6.495  1.000 20.739  0 818  LEU   A O    1 ? 1 
ATOM   11760 C  CB   . LEU   A  1  763 ? -11.264 -14.731 -7.767  1.000 28.597  0 818  LEU   A CB   1 ? 1 
ATOM   11761 C  CG   . LEU   A  1  763 ? -10.127 -14.536 -8.739  1.000 24.959  0 818  LEU   A CG   1 ? 1 
ATOM   11762 C  CD1  . LEU   A  1  763 ? -8.821  -15.175 -8.201  1.000 29.182  0 818  LEU   A CD1  1 ? 1 
ATOM   11763 C  CD2  . LEU   A  1  763 ? -10.492 -15.081 -10.082 1.000 30.260  0 818  LEU   A CD2  1 ? 1 
ATOM   11764 H  H    . LEU   A  1  763 ? -13.008 -14.818 -5.999  1.000 19.886  0 818  LEU   A H    1 c 1 
ATOM   11765 H  HA   . LEU   A  1  763 ? -10.374 -14.364 -5.945  1.000 20.522  0 818  LEU   A HA   1 c 1 
ATOM   11766 H  HB2  . LEU   A  1  763 ? -11.355 -15.689 -7.592  1.000 24.948  0 818  LEU   A HB2  1 c 1 
ATOM   11767 H  HB3  . LEU   A  1  763 ? -12.088 -14.436 -8.201  1.000 24.822  0 818  LEU   A HB3  1 c 1 
ATOM   11768 H  HG   . LEU   A  1  763 ? -9.971  -13.565 -8.839  1.000 26.950  0 818  LEU   A HG   1 c 1 
ATOM   11769 H  HD11 . LEU   A  1  763 ? -8.080  -14.941 -8.787  1.000 27.692  0 818  LEU   A HD11 1 c 1 
ATOM   11770 H  HD12 . LEU   A  1  763 ? -8.920  -16.142 -8.175  1.000 28.084  0 818  LEU   A HD12 1 c 1 
ATOM   11771 H  HD13 . LEU   A  1  763 ? -8.640  -14.843 -7.305  1.000 27.488  0 818  LEU   A HD13 1 c 1 
ATOM   11772 H  HD21 . LEU   A  1  763 ? -11.271 -14.609 -10.424 1.000 28.691  0 818  LEU   A HD21 1 c 1 
ATOM   11773 H  HD22 . LEU   A  1  763 ? -10.697 -16.029 -10.003 1.000 28.933  0 818  LEU   A HD22 1 c 1 
ATOM   11774 H  HD23 . LEU   A  1  763 ? -9.746  -14.962 -10.695 1.000 28.566  0 818  LEU   A HD23 1 c 1 
ATOM   11775 N  N    . MET   A  1  764 ? -12.110 -11.859 -6.917  1.000 26.678  0 819  MET   A N    1 ? 1 
ATOM   11776 C  CA   . MET   A  1  764 ? -12.086 -10.440 -7.204  1.000 26.043  0 819  MET   A CA   1 ? 1 
ATOM   11777 C  C    . MET   A  1  764 ? -11.636 -9.698  -5.953  1.000 23.572  0 819  MET   A C    1 ? 1 
ATOM   11778 O  O    . MET   A  1  764 ? -10.772 -8.843  -6.055  1.000 22.765  0 819  MET   A O    1 ? 1 
ATOM   11779 C  CB   . MET   A  1  764 ? -13.458 -9.976  -7.671  1.000 21.976  0 819  MET   A CB   1 ? 1 
ATOM   11780 C  CG   . MET   A  1  764 ? -13.693 -10.266 -9.171  1.000 28.220  0 819  MET   A CG   1 ? 1 
ATOM   11781 S  SD   . MET   A  1  764 ? -15.464 -10.215 -9.540  1.000 27.199  0 819  MET   A SD   1 ? 1 
ATOM   11782 C  CE   . MET   A  1  764 ? -15.733 -8.469  -9.143  1.000 33.783  0 819  MET   A CE   1 ? 1 
ATOM   11783 H  H    . MET   A  1  764 ? -12.905 -12.307 -6.954  1.000 26.443  0 819  MET   A H    1 c 1 
ATOM   11784 H  HA   . MET   A  1  764 ? -11.427 -10.280 -7.918  1.000 24.730  0 819  MET   A HA   1 c 1 
ATOM   11785 H  HB2  . MET   A  1  764 ? -14.146 -10.426 -7.143  1.000 24.374  0 819  MET   A HB2  1 c 1 
ATOM   11786 H  HB3  . MET   A  1  764 ? -13.538 -9.014  -7.513  1.000 24.060  0 819  MET   A HB3  1 c 1 
ATOM   11787 H  HG2  . MET   A  1  764 ? -13.226 -9.597  -9.715  1.000 26.176  0 819  MET   A HG2  1 c 1 
ATOM   11788 H  HG3  . MET   A  1  764 ? -13.338 -11.153 -9.396  1.000 26.455  0 819  MET   A HG3  1 c 1 
ATOM   11789 H  HE1  . MET   A  1  764 ? -15.709 -8.350  -8.186  1.000 31.602  0 819  MET   A HE1  1 c 1 
ATOM   11790 H  HE2  . MET   A  1  764 ? -15.041 -7.938  -9.552  1.000 31.571  0 819  MET   A HE2  1 c 1 
ATOM   11791 H  HE3  . MET   A  1  764 ? -16.594 -8.193  -9.480  1.000 31.993  0 819  MET   A HE3  1 c 1 
ATOM   11792 N  N    . LYS   A  1  765 ? -12.216 -10.055 -4.796  1.000 21.424  0 820  LYS   A N    1 ? 1 
ATOM   11793 C  CA   . LYS   A  1  765 ? -11.895 -9.392  -3.543  1.000 23.274  0 820  LYS   A CA   1 ? 1 
ATOM   11794 C  C    . LYS   A  1  765 ? -10.403 -9.495  -3.225  1.000 20.869  0 820  LYS   A C    1 ? 1 
ATOM   11795 O  O    . LYS   A  1  765 ? -9.821  -8.524  -2.754  1.000 21.348  0 820  LYS   A O    1 ? 1 
ATOM   11796 C  CB   . LYS   A  1  765 ? -12.739 -9.988  -2.393  1.000 24.859  0 820  LYS   A CB   1 ? 1 
ATOM   11797 C  CG   . LYS   A  1  765 ? -14.192 -9.620  -2.438  1.000 29.865  0 820  LYS   A CG   1 ? 1 
ATOM   11798 C  CD   . LYS   A  1  765 ? -14.986 -10.574 -1.576  1.000 44.460  0 820  LYS   A CD   1 ? 1 
ATOM   11799 C  CE   . LYS   A  1  765 ? -16.263 -10.000 -1.080  1.000 45.702  0 820  LYS   A CE   1 ? 1 
ATOM   11800 N  NZ   . LYS   A  1  765 ? -16.861 -10.920 -0.066  1.000 55.447  0 820  LYS   A NZ   1 ? 1 
ATOM   11801 H  H    . LYS   A  1  765 ? -12.834 -10.728 -4.792  1.000 22.756  0 820  LYS   A H    1 c 1 
ATOM   11802 H  HA   . LYS   A  1  765 ? -12.125 -8.439  -3.637  1.000 22.570  0 820  LYS   A HA   1 c 1 
ATOM   11803 H  HB2  . LYS   A  1  765 ? -12.660 -10.964 -2.422  1.000 25.765  0 820  LYS   A HB2  1 c 1 
ATOM   11804 H  HB3  . LYS   A  1  765 ? -12.365 -9.682  -1.540  1.000 25.389  0 820  LYS   A HB3  1 c 1 
ATOM   11805 H  HG2  . LYS   A  1  765 ? -14.307 -8.703  -2.109  1.000 31.270  0 820  LYS   A HG2  1 c 1 
ATOM   11806 H  HG3  . LYS   A  1  765 ? -14.514 -9.661  -3.363  1.000 31.274  0 820  LYS   A HG3  1 c 1 
ATOM   11807 H  HD2  . LYS   A  1  765 ? -15.184 -11.382 -2.095  1.000 40.967  0 820  LYS   A HD2  1 c 1 
ATOM   11808 H  HD3  . LYS   A  1  765 ? -14.439 -10.839 -0.806  1.000 40.679  0 820  LYS   A HD3  1 c 1 
ATOM   11809 H  HE2  . LYS   A  1  765 ? -16.102 -9.130  -0.671  1.000 47.126  0 820  LYS   A HE2  1 c 1 
ATOM   11810 H  HE3  . LYS   A  1  765 ? -16.887 -9.883  -1.821  1.000 47.606  0 820  LYS   A HE3  1 c 1 
ATOM   11811 H  HZ1  . LYS   A  1  765 ? -16.293 -11.017 0.635   1.000 52.128  0 820  LYS   A HZ1  1 c 1 
ATOM   11812 H  HZ2  . LYS   A  1  765 ? -17.014 -11.732 -0.440  1.000 52.534  0 820  LYS   A HZ2  1 c 1 
ATOM   11813 H  HZ3  . LYS   A  1  765 ? -17.646 -10.578 0.234   1.000 52.567  0 820  LYS   A HZ3  1 c 1 
ATOM   11814 N  N    . MET   A  1  766 ? -9.798  -10.653 -3.519  1.000 23.583  0 821  MET   A N    1 ? 1 
ATOM   11815 C  CA   . MET   A  1  766 ? -8.374  -10.876 -3.326  1.000 22.094  0 821  MET   A CA   1 ? 1 
ATOM   11816 C  C    . MET   A  1  766 ? -7.555  -9.939  -4.190  1.000 23.412  0 821  MET   A C    1 ? 1 
ATOM   11817 O  O    . MET   A  1  766 ? -6.495  -9.503  -3.755  1.000 19.268  0 821  MET   A O    1 ? 1 
ATOM   11818 C  CB   . MET   A  1  766 ? -7.989  -12.294 -3.688  1.000 21.971  0 821  MET   A CB   1 ? 1 
ATOM   11819 C  CG   . MET   A  1  766 ? -6.544  -12.646 -3.455  1.000 29.881  0 821  MET   A CG   1 ? 1 
ATOM   11820 S  SD   . MET   A  1  766 ? -6.078  -12.551 -1.680  1.000 31.989  0 821  MET   A SD   1 ? 1 
ATOM   11821 C  CE   . MET   A  1  766 ? -4.631  -13.177 -1.737  1.000 39.186  0 821  MET   A CE   1 ? 1 
ATOM   11822 H  H    . MET   A  1  766 ? -10.302 -11.339 -3.852  1.000 22.863  0 821  MET   A H    1 c 1 
ATOM   11823 H  HA   . MET   A  1  766 ? -8.159  -10.704 -2.381  1.000 22.482  0 821  MET   A HA   1 c 1 
ATOM   11824 H  HB2  . MET   A  1  766 ? -8.547  -12.906 -3.170  1.000 23.869  0 821  MET   A HB2  1 c 1 
ATOM   11825 H  HB3  . MET   A  1  766 ? -8.196  -12.438 -4.632  1.000 23.738  0 821  MET   A HB3  1 c 1 
ATOM   11826 H  HG2  . MET   A  1  766 ? -6.379  -13.558 -3.776  1.000 28.148  0 821  MET   A HG2  1 c 1 
ATOM   11827 H  HG3  . MET   A  1  766 ? -5.970  -12.038 -3.968  1.000 27.618  0 821  MET   A HG3  1 c 1 
ATOM   11828 H  HE1  . MET   A  1  766 ? -4.686  -14.084 -2.062  1.000 37.099  0 821  MET   A HE1  1 c 1 
ATOM   11829 H  HE2  . MET   A  1  766 ? -4.078  -12.656 -2.330  1.000 36.398  0 821  MET   A HE2  1 c 1 
ATOM   11830 H  HE3  . MET   A  1  766 ? -4.245  -13.175 -0.853  1.000 36.834  0 821  MET   A HE3  1 c 1 
ATOM   11831 N  N    . HIS   A  1  767 ? -8.060  -9.643  -5.393  1.000 19.099  0 822  HIS   A N    1 ? 1 
ATOM   11832 C  CA   . HIS   A  1  767 ? -7.362  -8.764  -6.317  1.000 15.434  0 822  HIS   A CA   1 ? 1 
ATOM   11833 C  C    . HIS   A  1  767 ? -7.934  -7.338  -6.366  1.000 18.475  0 822  HIS   A C    1 ? 1 
ATOM   11834 O  O    . HIS   A  1  767 ? -7.833  -6.629  -7.370  1.000 13.930  0 822  HIS   A O    1 ? 1 
ATOM   11835 C  CB   . HIS   A  1  767 ? -7.302  -9.438  -7.700  1.000 19.958  0 822  HIS   A CB   1 ? 1 
ATOM   11836 C  CG   . HIS   A  1  767 ? -6.433  -10.650 -7.751  1.000 16.874  0 822  HIS   A CG   1 ? 1 
ATOM   11837 N  ND1  . HIS   A  1  767 ? -6.963  -11.914 -7.569  1.000 20.275  0 822  HIS   A ND1  1 ? 1 
ATOM   11838 C  CD2  . HIS   A  1  767 ? -5.103  -10.764 -7.888  1.000 12.745  0 822  HIS   A CD2  1 ? 1 
ATOM   11839 C  CE1  . HIS   A  1  767 ? -5.948  -12.744 -7.631  1.000 12.296  0 822  HIS   A CE1  1 ? 1 
ATOM   11840 N  NE2  . HIS   A  1  767 ? -4.818  -12.107 -7.823  1.000 16.406  0 822  HIS   A NE2  1 ? 1 
ATOM   11841 H  H    . HIS   A  1  767 ? -8.856  -10.009 -5.652  1.000 19.370  0 822  HIS   A H    1 c 1 
ATOM   11842 H  HA   . HIS   A  1  767 ? -6.433  -8.694  -5.996  1.000 17.234  0 822  HIS   A HA   1 c 1 
ATOM   11843 H  HB2  . HIS   A  1  767 ? -8.210  -9.692  -7.965  1.000 18.279  0 822  HIS   A HB2  1 c 1 
ATOM   11844 H  HB3  . HIS   A  1  767 ? -6.970  -8.790  -8.350  1.000 17.975  0 822  HIS   A HB3  1 c 1 
ATOM   11845 H  HD1  . HIS   A  1  767 ? -7.838  -12.094 -7.472  0.000 13.960  0 822  HIS   A HD1  1 c 1 
ATOM   11846 H  HD2  . HIS   A  1  767 ? -4.492  -10.065 -8.022  1.000 14.213  0 822  HIS   A HD2  1 c 1 
ATOM   11847 H  HE1  . HIS   A  1  767 ? -6.027  -13.671 -7.558  1.000 15.069  0 822  HIS   A HE1  1 c 1 
ATOM   11848 H  HE2  . HIS   A  1  767 ? -4.032  -12.504 -7.903  0.000 10.200  0 822  HIS   A HE2  1 c 1 
ATOM   11849 N  N    . THR   A  1  768 ? -8.538  -6.897  -5.262  1.000 18.058  0 823  THR   A N    1 ? 1 
ATOM   11850 C  CA   . THR   A  1  768 ? -8.896  -5.497  -5.077  1.000 16.581  0 823  THR   A CA   1 ? 1 
ATOM   11851 C  C    . THR   A  1  768 ? -7.686  -4.593  -5.253  1.000 20.143  0 823  THR   A C    1 ? 1 
ATOM   11852 O  O    . THR   A  1  768 ? -6.548  -5.027  -5.110  1.000 24.285  0 823  THR   A O    1 ? 1 
ATOM   11853 C  CB   . THR   A  1  768 ? -9.518  -5.286  -3.685  1.000 19.737  0 823  THR   A CB   1 ? 1 
ATOM   11854 O  OG1  . THR   A  1  768 ? -10.055 -3.956  -3.605  1.000 20.995  0 823  THR   A OG1  1 ? 1 
ATOM   11855 C  CG2  . THR   A  1  768 ? -8.515  -5.515  -2.604  1.000 14.150  0 823  THR   A CG2  1 ? 1 
ATOM   11856 H  H    . THR   A  1  768 ? -8.748  -7.491  -4.601  1.000 17.890  0 823  THR   A H    1 c 1 
ATOM   11857 H  HA   . THR   A  1  768 ? -9.566  -5.264  -5.759  1.000 18.189  0 823  THR   A HA   1 c 1 
ATOM   11858 H  HB   . THR   A  1  768 ? -10.255 -5.934  -3.576  1.000 18.353  0 823  THR   A HB   1 c 1 
ATOM   11859 H  HG1  . THR   A  1  768 ? -9.425  -3.389  -3.733  0.000 16.080  0 823  THR   A HG1  1 c 1 
ATOM   11860 H  HG21 . THR   A  1  768 ? -8.958  -5.475  -1.738  1.000 15.673  0 823  THR   A HG21 1 c 1 
ATOM   11861 H  HG22 . THR   A  1  768 ? -7.827  -4.829  -2.645  1.000 15.407  0 823  THR   A HG22 1 c 1 
ATOM   11862 H  HG23 . THR   A  1  768 ? -8.105  -6.391  -2.717  1.000 15.609  0 823  THR   A HG23 1 c 1 
ATOM   11863 N  N    . ALA   A  1  769 ? -7.948  -3.354  -5.655  1.000 22.424  0 824  ALA   A N    1 ? 1 
ATOM   11864 C  CA   . ALA   A  1  769 ? -6.893  -2.427  -6.002  1.000 18.663  0 824  ALA   A CA   1 ? 1 
ATOM   11865 C  C    . ALA   A  1  769 ? -7.340  -0.994  -5.721  1.000 17.531  0 824  ALA   A C    1 ? 1 
ATOM   11866 O  O    . ALA   A  1  769 ? -8.528  -0.715  -5.521  1.000 18.523  0 824  ALA   A O    1 ? 1 
ATOM   11867 C  CB   . ALA   A  1  769 ? -6.507  -2.579  -7.469  1.000 23.894  0 824  ALA   A CB   1 ? 1 
ATOM   11868 H  H    . ALA   A  1  769 ? -8.816  -3.075  -5.714  1.000 21.028  0 824  ALA   A H    1 c 1 
ATOM   11869 H  HA   . ALA   A  1  769 ? -6.105  -2.623  -5.443  1.000 19.784  0 824  ALA   A HA   1 c 1 
ATOM   11870 H  HB1  . ALA   A  1  769 ? -5.795  -1.953  -7.684  1.000 22.145  0 824  ALA   A HB1  1 c 1 
ATOM   11871 H  HB2  . ALA   A  1  769 ? -6.199  -3.487  -7.632  1.000 22.236  0 824  ALA   A HB2  1 c 1 
ATOM   11872 H  HB3  . ALA   A  1  769 ? -7.279  -2.395  -8.029  1.000 22.369  0 824  ALA   A HB3  1 c 1 
ATOM   11873 N  N    . ARG   A  1  770 ? -6.344  -0.110  -5.655  1.000 14.531  0 825  ARG   A N    1 ? 1 
ATOM   11874 C  CA   . ARG   A  1  770 ? -6.546  1.325   -5.666  1.000 16.802  0 825  ARG   A CA   1 ? 1 
ATOM   11875 C  C    . ARG   A  1  770 ? -6.636  1.802   -7.113  1.000 15.992  0 825  ARG   A C    1 ? 1 
ATOM   11876 O  O    . ARG   A  1  770 ? -5.991  1.251   -8.002  1.000 15.007  0 825  ARG   A O    1 ? 1 
ATOM   11877 C  CB   . ARG   A  1  770 ? -5.367  2.095   -4.986  1.000 14.936  0 825  ARG   A CB   1 ? 1 
ATOM   11878 C  CG   . ARG   A  1  770 ? -4.982  1.626   -3.539  1.000 12.164  0 825  ARG   A CG   1 ? 1 
ATOM   11879 C  CD   . ARG   A  1  770 ? -3.702  2.291   -3.061  1.000 12.960  0 825  ARG   A CD   1 ? 1 
ATOM   11880 N  NE   . ARG   A  1  770 ? -2.600  2.150   -3.994  1.000 13.646  0 825  ARG   A NE   1 ? 1 
ATOM   11881 C  CZ   . ARG   A  1  770 ? -1.688  3.063   -4.287  1.000 15.033  0 825  ARG   A CZ   1 ? 1 
ATOM   11882 N  NH1  . ARG   A  1  770 ? -1.603  4.205   -3.624  1.000 18.727  0 825  ARG   A NH1  1 ? 1 
ATOM   11883 N  NH2  . ARG   A  1  770 ? -0.827  2.815   -5.268  1.000 18.817  0 825  ARG   A NH2  1 ? 1 
ATOM   11884 H  H    . ARG   A  1  770 ? -5.487  -0.423  -5.600  1.000 15.586  0 825  ARG   A H    1 c 1 
ATOM   11885 H  HA   . ARG   A  1  770 ? -7.387  1.536   -5.199  1.000 15.960  0 825  ARG   A HA   1 c 1 
ATOM   11886 H  HB2  . ARG   A  1  770 ? -4.578  2.011   -5.559  1.000 14.600  0 825  ARG   A HB2  1 c 1 
ATOM   11887 H  HB3  . ARG   A  1  770 ? -5.604  3.044   -4.949  1.000 14.706  0 825  ARG   A HB3  1 c 1 
ATOM   11888 H  HG2  . ARG   A  1  770 ? -5.709  1.846   -2.920  1.000 12.942  0 825  ARG   A HG2  1 c 1 
ATOM   11889 H  HG3  . ARG   A  1  770 ? -4.859  0.653   -3.533  1.000 12.856  0 825  ARG   A HG3  1 c 1 
ATOM   11890 H  HD2  . ARG   A  1  770 ? -3.876  3.245   -2.915  1.000 13.080  0 825  ARG   A HD2  1 c 1 
ATOM   11891 H  HD3  . ARG   A  1  770 ? -3.443  1.900   -2.200  1.000 12.930  0 825  ARG   A HD3  1 c 1 
ATOM   11892 H  HE   . ARG   A  1  770 ? -2.527  1.382   -4.398  1.000 13.867  0 825  ARG   A HE   1 c 1 
ATOM   11893 H  HH11 . ARG   A  1  770 ? -1.665  4.207   -2.744  1.000 17.356  0 825  ARG   A HH11 1 c 1 
ATOM   11894 H  HH12 . ARG   A  1  770 ? -1.483  4.959   -4.065  1.000 17.592  0 825  ARG   A HH12 1 c 1 
ATOM   11895 H  HH21 . ARG   A  1  770 ? -0.229  3.421   -5.488  1.000 17.616  0 825  ARG   A HH21 1 c 1 
ATOM   11896 H  HH22 . ARG   A  1  770 ? -0.855  2.048   -5.696  1.000 17.511  0 825  ARG   A HH22 1 c 1 
ATOM   11897 N  N    . VAL   A  1  771 ? -7.351  2.908   -7.320  1.000 19.844  0 826  VAL   A N    1 ? 1 
ATOM   11898 C  CA   . VAL   A  1  771 ? -7.405  3.517   -8.631  1.000 15.051  0 826  VAL   A CA   1 ? 1 
ATOM   11899 C  C    . VAL   A  1  771 ? -5.952  3.824   -8.993  1.000 15.531  0 826  VAL   A C    1 ? 1 
ATOM   11900 O  O    . VAL   A  1  771 ? -5.547  3.660   -10.139 1.000 14.603  0 826  VAL   A O    1 ? 1 
ATOM   11901 C  CB   . VAL   A  1  771 ? -8.360  4.704   -8.674  1.000 13.628  0 826  VAL   A CB   1 ? 1 
ATOM   11902 C  CG1  . VAL   A  1  771 ? -8.252  5.456   -9.992  1.000 14.329  0 826  VAL   A CG1  1 ? 1 
ATOM   11903 C  CG2  . VAL   A  1  771 ? -9.815  4.288   -8.460  1.000 14.912  0 826  VAL   A CG2  1 ? 1 
ATOM   11904 H  H    . VAL   A  1  771 ? -7.812  3.291   -6.629  1.000 17.554  0 826  VAL   A H    1 c 1 
ATOM   11905 H  HA   . VAL   A  1  771 ? -7.734  2.847   -9.257  1.000 15.714  0 826  VAL   A HA   1 c 1 
ATOM   11906 H  HB   . VAL   A  1  771 ? -8.106  5.321   -7.946  1.000 14.170  0 826  VAL   A HB   1 c 1 
ATOM   11907 H  HG11 . VAL   A  1  771 ? -8.341  4.830   -10.732 1.000 14.289  0 826  VAL   A HG11 1 c 1 
ATOM   11908 H  HG12 . VAL   A  1  771 ? -7.388  5.900   -10.045 1.000 14.170  0 826  VAL   A HG12 1 c 1 
ATOM   11909 H  HG13 . VAL   A  1  771 ? -8.960  6.121   -10.046 1.000 14.496  0 826  VAL   A HG13 1 c 1 
ATOM   11910 H  HG21 . VAL   A  1  771 ? -10.379 5.079   -8.432  1.000 14.859  0 826  VAL   A HG21 1 c 1 
ATOM   11911 H  HG22 . VAL   A  1  771 ? -9.896  3.804   -7.620  1.000 14.520  0 826  VAL   A HG22 1 c 1 
ATOM   11912 H  HG23 . VAL   A  1  771 ? -10.100 3.714   -9.193  1.000 14.711  0 826  VAL   A HG23 1 c 1 
ATOM   11913 N  N    . ARG   A  1  772 ? -5.153  4.228   -7.999  1.000 14.162  0 827  ARG   A N    1 ? 1 
ATOM   11914 C  CA   . ARG   A  1  772 ? -3.792  4.668   -8.254  1.000 15.369  0 827  ARG   A CA   1 ? 1 
ATOM   11915 C  C    . ARG   A  1  772 ? -2.947  3.523   -8.828  1.000 14.686  0 827  ARG   A C    1 ? 1 
ATOM   11916 O  O    . ARG   A  1  772 ? -2.061  3.715   -9.666  1.000 13.848  0 827  ARG   A O    1 ? 1 
ATOM   11917 C  CB   . ARG   A  1  772 ? -3.257  5.266   -6.934  1.000 19.843  0 827  ARG   A CB   1 ? 1 
ATOM   11918 C  CG   . ARG   A  1  772 ? -2.018  6.035   -7.015  1.000 20.600  0 827  ARG   A CG   1 ? 1 
ATOM   11919 C  CD   . ARG   A  1  772 ? -2.237  7.400   -7.635  1.000 26.948  0 827  ARG   A CD   1 ? 1 
ATOM   11920 N  NE   . ARG   A  1  772 ? -0.943  8.015   -7.916  1.000 24.902  0 827  ARG   A NE   1 ? 1 
ATOM   11921 C  CZ   . ARG   A  1  772 ? -0.380  8.083   -9.103  1.000 33.676  0 827  ARG   A CZ   1 ? 1 
ATOM   11922 N  NH1  . ARG   A  1  772 ? -1.082  7.901   -10.203 1.000 32.259  0 827  ARG   A NH1  1 ? 1 
ATOM   11923 N  NH2  . ARG   A  1  772 ? 0.908   8.409   -9.192  1.000 33.433  0 827  ARG   A NH2  1 ? 1 
ATOM   11924 H  H    . ARG   A  1  772 ? -5.468  4.246   -7.141  1.000 14.722  0 827  ARG   A H    1 c 1 
ATOM   11925 H  HA   . ARG   A  1  772 ? -3.830  5.385   -8.927  1.000 15.970  0 827  ARG   A HA   1 c 1 
ATOM   11926 H  HB2  . ARG   A  1  772 ? -3.951  5.848   -6.562  1.000 18.809  0 827  ARG   A HB2  1 c 1 
ATOM   11927 H  HB3  . ARG   A  1  772 ? -3.121  4.530   -6.301  1.000 18.613  0 827  ARG   A HB3  1 c 1 
ATOM   11928 H  HG2  . ARG   A  1  772 ? -1.647  6.149   -6.114  1.000 21.492  0 827  ARG   A HG2  1 c 1 
ATOM   11929 H  HG3  . ARG   A  1  772 ? -1.362  5.541   -7.552  1.000 21.590  0 827  ARG   A HG3  1 c 1 
ATOM   11930 H  HD2  . ARG   A  1  772 ? -2.752  7.309   -8.463  1.000 25.015  0 827  ARG   A HD2  1 c 1 
ATOM   11931 H  HD3  . ARG   A  1  772 ? -2.745  7.966   -7.015  1.000 24.927  0 827  ARG   A HD3  1 c 1 
ATOM   11932 H  HE   . ARG   A  1  772 ? -0.510  8.367   -7.245  1.000 27.235  0 827  ARG   A HE   1 c 1 
ATOM   11933 H  HH11 . ARG   A  1  772 ? -1.809  8.379   -10.344 1.000 32.784  0 827  ARG   A HH11 1 c 1 
ATOM   11934 H  HH12 . ARG   A  1  772 ? -0.823  7.302   -10.795 1.000 32.743  0 827  ARG   A HH12 1 c 1 
ATOM   11935 H  HH21 . ARG   A  1  772 ? 1.264   8.569   -9.980  1.000 33.690  0 827  ARG   A HH21 1 c 1 
ATOM   11936 H  HH22 . ARG   A  1  772 ? 1.399   8.464   -8.465  1.000 33.295  0 827  ARG   A HH22 1 c 1 
ATOM   11937 N  N    . ASP   A  1  773 ? -3.215  2.298   -8.388  1.000 14.531  0 828  ASP   A N    1 ? 1 
ATOM   11938 C  CA   . ASP   A  1  773 ? -2.493  1.149   -8.907  1.000 13.731  0 828  ASP   A CA   1 ? 1 
ATOM   11939 C  C    . ASP   A  1  773 ? -2.798  0.954   -10.386 1.000 17.052  0 828  ASP   A C    1 ? 1 
ATOM   11940 O  O    . ASP   A  1  773 ? -1.912  0.603   -11.172 1.000 21.164  0 828  ASP   A O    1 ? 1 
ATOM   11941 C  CB   . ASP   A  1  773 ? -2.847  -0.119  -8.173  1.000 16.514  0 828  ASP   A CB   1 ? 1 
ATOM   11942 C  CG   . ASP   A  1  773 ? -2.517  -0.101  -6.728  1.000 23.100  0 828  ASP   A CG   1 ? 1 
ATOM   11943 O  OD1  . ASP   A  1  773 ? -1.373  0.347   -6.381  1.000 17.933  0 828  ASP   A OD1  1 ? 1 
ATOM   11944 O  OD2  . ASP   A  1  773 ? -3.364  -0.555  -5.943  1.000 21.626  0 828  ASP   A OD2  1 ? 1 
ATOM   11945 H  H    . ASP   A  1  773 ? -3.856  2.171   -7.750  1.000 14.351  0 828  ASP   A H    1 c 1 
ATOM   11946 H  HA   . ASP   A  1  773 ? -1.527  1.314   -8.802  1.000 14.884  0 828  ASP   A HA   1 c 1 
ATOM   11947 H  HB2  . ASP   A  1  773 ? -3.807  -0.283  -8.268  1.000 17.116  0 828  ASP   A HB2  1 c 1 
ATOM   11948 H  HB3  . ASP   A  1  773 ? -2.369  -0.867  -8.585  1.000 17.094  0 828  ASP   A HB3  1 c 1 
ATOM   11949 N  N    . ILE   A  1  774 ? -4.044  1.239   -10.759 1.000 17.347  0 829  ILE   A N    1 ? 1 
ATOM   11950 C  CA   . ILE   A  1  774 ? -4.454  1.068   -12.141 1.000 18.248  0 829  ILE   A CA   1 ? 1 
ATOM   11951 C  C    . ILE   A  1  774 ? -3.837  2.184   -12.986 1.000 17.169  0 829  ILE   A C    1 ? 1 
ATOM   11952 O  O    . ILE   A  1  774 ? -3.414  1.956   -14.126 1.000 19.203  0 829  ILE   A O    1 ? 1 
ATOM   11953 C  CB   . ILE   A  1  774 ? -5.986  1.005   -12.230 1.000 16.519  0 829  ILE   A CB   1 ? 1 
ATOM   11954 C  CG1  . ILE   A  1  774 ? -6.496  -0.286  -11.547 1.000 14.473  0 829  ILE   A CG1  1 ? 1 
ATOM   11955 C  CG2  . ILE   A  1  774 ? -6.428  1.144   -13.714 1.000 23.694  0 829  ILE   A CG2  1 ? 1 
ATOM   11956 C  CD1  . ILE   A  1  774 ? -7.988  -0.267  -11.260 1.000 14.320  0 829  ILE   A CD1  1 ? 1 
ATOM   11957 H  H    . ILE   A  1  774 ? -4.654  1.533   -10.145 1.000 17.302  0 829  ILE   A H    1 c 1 
ATOM   11958 H  HA   . ILE   A  1  774 ? -4.101  0.217   -12.459 1.000 17.560  0 829  ILE   A HA   1 c 1 
ATOM   11959 H  HB   . ILE   A  1  774 ? -6.351  1.775   -11.730 1.000 17.439  0 829  ILE   A HB   1 c 1 
ATOM   11960 H  HG12 . ILE   A  1  774 ? -6.295  -1.052  -12.126 1.000 14.917  0 829  ILE   A HG12 1 c 1 
ATOM   11961 H  HG13 . ILE   A  1  774 ? -6.015  -0.410  -10.702 1.000 14.658  0 829  ILE   A HG13 1 c 1 
ATOM   11962 H  HG21 . ILE   A  1  774 ? -5.898  0.545   -14.269 1.000 21.364  0 829  ILE   A HG21 1 c 1 
ATOM   11963 H  HG22 . ILE   A  1  774 ? -6.297  2.061   -14.011 1.000 21.420  0 829  ILE   A HG22 1 c 1 
ATOM   11964 H  HG23 . ILE   A  1  774 ? -7.368  0.911   -13.797 1.000 21.340  0 829  ILE   A HG23 1 c 1 
ATOM   11965 H  HD11 . ILE   A  1  774 ? -8.480  -0.171  -12.093 1.000 14.676  0 829  ILE   A HD11 1 c 1 
ATOM   11966 H  HD12 . ILE   A  1  774 ? -8.197  0.481   -10.674 1.000 14.360  0 829  ILE   A HD12 1 c 1 
ATOM   11967 H  HD13 . ILE   A  1  774 ? -8.247  -1.099  -10.826 1.000 14.364  0 829  ILE   A HD13 1 c 1 
ATOM   11968 N  N    . GLU   A  1  775 ? -3.775  3.389   -12.411 1.000 16.878  0 830  GLU   A N    1 ? 1 
ATOM   11969 C  CA   . GLU   A  1  775 ? -3.149  4.496   -13.103 1.000 19.663  0 830  GLU   A CA   1 ? 1 
ATOM   11970 C  C    . GLU   A  1  775 ? -1.698  4.163   -13.451 1.000 19.742  0 830  GLU   A C    1 ? 1 
ATOM   11971 O  O    . GLU   A  1  775 ? -1.251  4.435   -14.568 1.000 18.463  0 830  GLU   A O    1 ? 1 
ATOM   11972 C  CB   . GLU   A  1  775 ? -3.264  5.761   -12.263 1.000 20.022  0 830  GLU   A CB   1 ? 1 
ATOM   11973 C  CG   . GLU   A  1  775 ? -4.682  6.298   -12.179 1.000 22.558  0 830  GLU   A CG   1 ? 1 
ATOM   11974 C  CD   . GLU   A  1  775 ? -4.772  7.683   -11.541 1.000 28.294  0 830  GLU   A CD   1 ? 1 
ATOM   11975 O  OE1  . GLU   A  1  775 ? -4.022  7.909   -10.567 1.000 26.822  0 830  GLU   A OE1  1 ? 1 
ATOM   11976 O  OE2  . GLU   A  1  775 ? -5.573  8.542   -11.989 1.000 23.386  0 830  GLU   A OE2  1 ? 1 
ATOM   11977 H  H    . GLU   A  1  775 ? -4.136  3.525   -11.583 1.000 17.392  0 830  GLU   A H    1 c 1 
ATOM   11978 H  HA   . GLU   A  1  775 ? -3.639  4.641   -13.945 1.000 19.454  0 830  GLU   A HA   1 c 1 
ATOM   11979 H  HB2  . GLU   A  1  775 ? -2.941  5.567   -11.358 1.000 20.180  0 830  GLU   A HB2  1 c 1 
ATOM   11980 H  HB3  . GLU   A  1  775 ? -2.684  6.449   -12.650 1.000 20.598  0 830  GLU   A HB3  1 c 1 
ATOM   11981 H  HG2  . GLU   A  1  775 ? -5.060  6.344   -13.081 1.000 23.141  0 830  GLU   A HG2  1 c 1 
ATOM   11982 H  HG3  . GLU   A  1  775 ? -5.231  5.676   -11.657 1.000 22.843  0 830  GLU   A HG3  1 c 1 
ATOM   11983 N  N    . HIS   A  1  776 ? -0.949  3.592   -12.493 1.000 27.463  0 831  HIS   A N    1 ? 1 
ATOM   11984 C  CA   . HIS   A  1  776 ? 0.442   3.227   -12.736 1.000 24.747  0 831  HIS   A CA   1 ? 1 
ATOM   11985 C  C    . HIS   A  1  776 ? 0.489   2.195   -13.852 1.000 23.626  0 831  HIS   A C    1 ? 1 
ATOM   11986 O  O    . HIS   A  1  776 ? 1.374   2.223   -14.717 1.000 17.388  0 831  HIS   A O    1 ? 1 
ATOM   11987 C  CB   . HIS   A  1  776 ? 1.131   2.592   -11.522 1.000 26.954  0 831  HIS   A CB   1 ? 1 
ATOM   11988 C  CG   . HIS   A  1  776 ? 1.339   3.500   -10.347 1.000 24.717  0 831  HIS   A CG   1 ? 1 
ATOM   11989 N  ND1  . HIS   A  1  776 ? 1.597   4.822   -10.510 1.000 30.056  0 831  HIS   A ND1  1 ? 1 
ATOM   11990 C  CD2  . HIS   A  1  776 ? 1.268   3.221   -9.017  1.000 34.774  0 831  HIS   A CD2  1 ? 1 
ATOM   11991 C  CE1  . HIS   A  1  776 ? 1.705   5.336   -9.285  1.000 32.503  0 831  HIS   A CE1  1 ? 1 
ATOM   11992 N  NE2  . HIS   A  1  776 ? 1.517   4.388   -8.354  1.000 31.357  0 831  HIS   A NE2  1 ? 1 
ATOM   11993 H  H    . HIS   A  1  776 ? -1.312  3.430   -11.670 1.000 24.322  0 831  HIS   A H    1 c 1 
ATOM   11994 H  HA   . HIS   A  1  776 ? 0.939   4.034   -13.009 1.000 25.576  0 831  HIS   A HA   1 c 1 
ATOM   11995 H  HB2  . HIS   A  1  776 ? 0.594   1.828   -11.230 1.000 25.705  0 831  HIS   A HB2  1 c 1 
ATOM   11996 H  HB3  . HIS   A  1  776 ? 2.003   2.250   -11.806 1.000 25.905  0 831  HIS   A HB3  1 c 1 
ATOM   11997 H  HD1  . HIS   A  1  776 ? 1.656   5.231   -11.273 0.000 24.490  0 831  HIS   A HD1  1 c 1 
ATOM   11998 H  HD2  . HIS   A  1  776 ? 1.099   2.376   -8.630  1.000 31.116  0 831  HIS   A HD2  1 c 1 
ATOM   11999 H  HE1  . HIS   A  1  776 ? 1.898   6.236   -9.099  1.000 31.766  0 831  HIS   A HE1  1 c 1 
ATOM   12000 H  HE2  . HIS   A  1  776 ? 1.542   4.512   -7.467  0.000 25.790  0 831  HIS   A HE2  1 c 1 
ATOM   12001 N  N    . LEU   A  1  777 ? -0.434  1.234   -13.772 1.000 15.770  0 832  LEU   A N    1 ? 1 
ATOM   12002 C  CA   . LEU   A  1  777 ? -0.428  0.143   -14.746 1.000 20.127  0 832  LEU   A CA   1 ? 1 
ATOM   12003 C  C    . LEU   A  1  777 ? -0.927  0.485   -16.160 1.000 16.662  0 832  LEU   A C    1 ? 1 
ATOM   12004 O  O    . LEU   A  1  777 ? -0.686  -0.295  -17.084 1.000 22.990  0 832  LEU   A O    1 ? 1 
ATOM   12005 C  CB   . LEU   A  1  777 ? -1.230  -1.030  -14.146 1.000 16.541  0 832  LEU   A CB   1 ? 1 
ATOM   12006 C  CG   . LEU   A  1  777 ? -0.425  -1.799  -13.076 1.000 16.322  0 832  LEU   A CG   1 ? 1 
ATOM   12007 C  CD1  . LEU   A  1  777 ? -1.316  -2.591  -12.172 1.000 18.959  0 832  LEU   A CD1  1 ? 1 
ATOM   12008 C  CD2  . LEU   A  1  777 ? 0.576   -2.725  -13.726 1.000 16.462  0 832  LEU   A CD2  1 ? 1 
ATOM   12009 H  H    . LEU   A  1  777 ? -1.065  1.246   -13.110 1.000 18.075  0 832  LEU   A H    1 c 1 
ATOM   12010 H  HA   . LEU   A  1  777 ? 0.508   -0.149  -14.838 1.000 17.909  0 832  LEU   A HA   1 c 1 
ATOM   12011 H  HB2  . LEU   A  1  777 ? -2.052  -0.683  -13.744 1.000 17.160  0 832  LEU   A HB2  1 c 1 
ATOM   12012 H  HB3  . LEU   A  1  777 ? -1.479  -1.646  -14.863 1.000 17.413  0 832  LEU   A HB3  1 c 1 
ATOM   12013 H  HG   . LEU   A  1  777 ? 0.069   -1.142  -12.527 1.000 16.684  0 832  LEU   A HG   1 c 1 
ATOM   12014 H  HD11 . LEU   A  1  777 ? -0.797  -2.935  -11.424 1.000 17.908  0 832  LEU   A HD11 1 c 1 
ATOM   12015 H  HD12 . LEU   A  1  777 ? -1.704  -3.334  -12.666 1.000 18.159  0 832  LEU   A HD12 1 c 1 
ATOM   12016 H  HD13 . LEU   A  1  777 ? -2.027  -2.019  -11.835 1.000 17.962  0 832  LEU   A HD13 1 c 1 
ATOM   12017 H  HD21 . LEU   A  1  777 ? 1.240   -2.201  -14.207 1.000 16.659  0 832  LEU   A HD21 1 c 1 
ATOM   12018 H  HD22 . LEU   A  1  777 ? 0.116   -3.314  -14.349 1.000 16.653  0 832  LEU   A HD22 1 c 1 
ATOM   12019 H  HD23 . LEU   A  1  777 ? 1.017   -3.258  -13.042 1.000 16.413  0 832  LEU   A HD23 1 c 1 
ATOM   12020 N  N    . THR   A  1  778 ? -1.582  1.636   -16.350 1.000 15.015  0 833  THR   A N    1 ? 1 
ATOM   12021 C  CA   . THR   A  1  778 ? -2.197  1.943   -17.638 1.000 17.197  0 833  THR   A CA   1 ? 1 
ATOM   12022 C  C    . THR   A  1  778 ? -1.714  3.242   -18.261 1.000 20.306  0 833  THR   A C    1 ? 1 
ATOM   12023 O  O    . THR   A  1  778 ? -1.892  3.446   -19.455 1.000 22.213  0 833  THR   A O    1 ? 1 
ATOM   12024 C  CB   . THR   A  1  778 ? -3.712  2.078   -17.488 1.000 16.278  0 833  THR   A CB   1 ? 1 
ATOM   12025 O  OG1  . THR   A  1  778 ? -3.987  3.123   -16.514 1.000 17.454  0 833  THR   A OG1  1 ? 1 
ATOM   12026 C  CG2  . THR   A  1  778 ? -4.371  0.792   -17.071 1.000 14.795  0 833  THR   A CG2  1 ? 1 
ATOM   12027 H  H    . THR   A  1  778 ? -1.676  2.227   -15.659 1.000 15.743  0 833  THR   A H    1 c 1 
ATOM   12028 H  HA   . THR   A  1  778 ? -2.006  1.205   -18.261 1.000 17.291  0 833  THR   A HA   1 c 1 
ATOM   12029 H  HB   . THR   A  1  778 ? -4.085  2.352   -18.360 1.000 16.768  0 833  THR   A HB   1 c 1 
ATOM   12030 H  HG1  . THR   A  1  778 ? -3.640  2.913   -15.769 0.000 9.740   0 833  THR   A HG1  1 c 1 
ATOM   12031 H  HG21 . THR   A  1  778 ? -5.328  0.935   -16.968 1.000 15.206  0 833  THR   A HG21 1 c 1 
ATOM   12032 H  HG22 . THR   A  1  778 ? -3.996  0.492   -16.224 1.000 14.916  0 833  THR   A HG22 1 c 1 
ATOM   12033 H  HG23 . THR   A  1  778 ? -4.216  0.112   -17.751 1.000 15.339  0 833  THR   A HG23 1 c 1 
ATOM   12034 N  N    . GLY   A  1  779 ? -1.157  4.141   -17.438 1.000 18.191  0 834  GLY   A N    1 ? 1 
ATOM   12035 C  CA   . GLY   A  1  779 ? -0.766  5.440   -17.933 1.000 17.152  0 834  GLY   A CA   1 ? 1 
ATOM   12036 C  C    . GLY   A  1  779 ? -1.949  6.369   -18.172 1.000 18.593  0 834  GLY   A C    1 ? 1 
ATOM   12037 O  O    . GLY   A  1  779 ? -1.810  7.383   -18.844 1.000 18.740  0 834  GLY   A O    1 ? 1 
ATOM   12038 H  H    . GLY   A  1  779 ? -1.021  3.943   -16.556 1.000 17.955  0 834  GLY   A H    1 c 1 
ATOM   12039 H  HA2  . GLY   A  1  779 ? -0.153  5.858   -17.278 1.000 17.611  0 834  GLY   A HA2  1 c 1 
ATOM   12040 H  HA3  . GLY   A  1  779 ? -0.267  5.323   -18.780 1.000 18.052  0 834  GLY   A HA3  1 c 1 
ATOM   12041 N  N    . LEU   A  1  780 ? -3.084  6.058   -17.546 1.000 17.301  0 835  LEU   A N    1 ? 1 
ATOM   12042 C  CA   . LEU   A  1  780 ? -4.239  6.920   -17.556 1.000 16.431  0 835  LEU   A CA   1 ? 1 
ATOM   12043 C  C    . LEU   A  1  780 ? -4.345  7.729   -16.271 1.000 18.016  0 835  LEU   A C    1 ? 1 
ATOM   12044 O  O    . LEU   A  1  780 ? -3.905  7.282   -15.220 1.000 21.257  0 835  LEU   A O    1 ? 1 
ATOM   12045 C  CB   . LEU   A  1  780 ? -5.473  5.994   -17.681 1.000 18.095  0 835  LEU   A CB   1 ? 1 
ATOM   12046 C  CG   . LEU   A  1  780 ? -5.489  5.157   -18.966 1.000 16.883  0 835  LEU   A CG   1 ? 1 
ATOM   12047 C  CD1  . LEU   A  1  780 ? -6.591  4.129   -18.949 1.000 19.374  0 835  LEU   A CD1  1 ? 1 
ATOM   12048 C  CD2  . LEU   A  1  780 ? -5.598  6.075   -20.245 1.000 22.498  0 835  LEU   A CD2  1 ? 1 
ATOM   12049 H  H    . LEU   A  1  780 ? -3.134  5.274   -17.079 1.000 17.059  0 835  LEU   A H    1 c 1 
ATOM   12050 H  HA   . LEU   A  1  780 ? -4.187  7.526   -18.325 1.000 17.674  0 835  LEU   A HA   1 c 1 
ATOM   12051 H  HB2  . LEU   A  1  780 ? -5.493  5.392   -16.911 1.000 17.028  0 835  LEU   A HB2  1 c 1 
ATOM   12052 H  HB3  . LEU   A  1  780 ? -6.281  6.544   -17.653 1.000 17.492  0 835  LEU   A HB3  1 c 1 
ATOM   12053 H  HG   . LEU   A  1  780 ? -4.630  4.671   -19.019 1.000 18.301  0 835  LEU   A HG   1 c 1 
ATOM   12054 H  HD11 . LEU   A  1  780 ? -6.444  3.484   -19.663 1.000 18.703  0 835  LEU   A HD11 1 c 1 
ATOM   12055 H  HD12 . LEU   A  1  780 ? -7.448  4.569   -19.082 1.000 18.745  0 835  LEU   A HD12 1 c 1 
ATOM   12056 H  HD13 . LEU   A  1  780 ? -6.593  3.668   -18.092 1.000 18.223  0 835  LEU   A HD13 1 c 1 
ATOM   12057 H  HD21 . LEU   A  1  780 ? -4.786  6.603   -20.337 1.000 20.855  0 835  LEU   A HD21 1 c 1 
ATOM   12058 H  HD22 . LEU   A  1  780 ? -6.363  6.670   -20.154 1.000 20.949  0 835  LEU   A HD22 1 c 1 
ATOM   12059 H  HD23 . LEU   A  1  780 ? -5.714  5.519   -21.035 1.000 21.026  0 835  LEU   A HD23 1 c 1 
ATOM   12060 N  N    . ASP   A  1  781 ? -5.106  8.816   -16.338 1.000 21.041  0 836  ASP   A N    1 ? 1 
ATOM   12061 C  CA   . ASP   A  1  781 ? -5.442  9.620   -15.173 1.000 17.845  0 836  ASP   A CA   1 ? 1 
ATOM   12062 C  C    . ASP   A  1  781 ? -6.952  9.811   -15.102 1.000 21.716  0 836  ASP   A C    1 ? 1 
ATOM   12063 O  O    . ASP   A  1  781 ? -7.552  10.380  -16.023 1.000 21.172  0 836  ASP   A O    1 ? 1 
ATOM   12064 C  CB   . ASP   A  1  781 ? -4.713  10.983  -15.270 1.000 18.737  0 836  ASP   A CB   1 ? 1 
ATOM   12065 C  CG   . ASP   A  1  781 ? -4.592  11.723  -13.937 1.000 24.711  0 836  ASP   A CG   1 ? 1 
ATOM   12066 O  OD1  . ASP   A  1  781 ? -3.928  11.162  -12.995 1.000 24.400  0 836  ASP   A OD1  1 ? 1 
ATOM   12067 O  OD2  . ASP   A  1  781 ? -5.176  12.832  -13.818 1.000 24.160  0 836  ASP   A OD2  1 ? 1 
ATOM   12068 H  H    . ASP   A  1  781 ? -5.436  9.073   -17.151 1.000 19.888  0 836  ASP   A H    1 c 1 
ATOM   12069 H  HA   . ASP   A  1  781 ? -5.137  9.153   -14.363 1.000 18.850  0 836  ASP   A HA   1 c 1 
ATOM   12070 H  HB2  . ASP   A  1  781 ? -3.811  10.834  -15.619 1.000 19.848  0 836  ASP   A HB2  1 c 1 
ATOM   12071 H  HB3  . ASP   A  1  781 ? -5.191  11.559  -15.900 1.000 20.234  0 836  ASP   A HB3  1 c 1 
ATOM   12072 N  N    . PHE   A  1  782 ? -7.567  9.330   -14.016 1.000 18.972  0 837  PHE   A N    1 ? 1 
ATOM   12073 C  CA   . PHE   A  1  782 ? -9.019  9.326   -13.868 1.000 19.007  0 837  PHE   A CA   1 ? 1 
ATOM   12074 C  C    . PHE   A  1  782 ? -9.507  10.469  -12.984 1.000 18.225  0 837  PHE   A C    1 ? 1 
ATOM   12075 O  O    . PHE   A  1  782 ? -8.705  11.144  -12.347 1.000 19.084  0 837  PHE   A O    1 ? 1 
ATOM   12076 C  CB   . PHE   A  1  782 ? -9.454  8.005   -13.263 1.000 19.303  0 837  PHE   A CB   1 ? 1 
ATOM   12077 C  CG   . PHE   A  1  782 ? -9.022  6.783   -14.033 1.000 17.429  0 837  PHE   A CG   1 ? 1 
ATOM   12078 C  CD1  . PHE   A  1  782 ? -9.789  6.299   -15.096 1.000 20.847  0 837  PHE   A CD1  1 ? 1 
ATOM   12079 C  CD2  . PHE   A  1  782 ? -7.843  6.117   -13.710 1.000 14.309  0 837  PHE   A CD2  1 ? 1 
ATOM   12080 C  CE1  . PHE   A  1  782 ? -9.387  5.166   -15.806 1.000 20.086  0 837  PHE   A CE1  1 ? 1 
ATOM   12081 C  CE2  . PHE   A  1  782 ? -7.425  5.008   -14.447 1.000 21.048  0 837  PHE   A CE2  1 ? 1 
ATOM   12082 C  CZ   . PHE   A  1  782 ? -8.215  4.516   -15.471 1.000 21.959  0 837  PHE   A CZ   1 ? 1 
ATOM   12083 H  H    . PHE   A  1  782 ? -7.061  8.989   -13.336 1.000 19.157  0 837  PHE   A H    1 c 1 
ATOM   12084 H  HA   . PHE   A  1  782 ? -9.435  9.419   -14.762 1.000 19.302  0 837  PHE   A HA   1 c 1 
ATOM   12085 H  HB2  . PHE   A  1  782 ? -9.092  7.948   -12.354 1.000 18.433  0 837  PHE   A HB2  1 c 1 
ATOM   12086 H  HB3  . PHE   A  1  782 ? -10.431 8.004   -13.194 1.000 18.955  0 837  PHE   A HB3  1 c 1 
ATOM   12087 H  HD1  . PHE   A  1  782 ? -10.598 6.731   -15.322 1.000 20.174  0 837  PHE   A HD1  1 c 1 
ATOM   12088 H  HD2  . PHE   A  1  782 ? -7.306  6.442   -13.007 1.000 16.180  0 837  PHE   A HD2  1 c 1 
ATOM   12089 H  HE1  . PHE   A  1  782 ? -9.917  4.845   -16.518 1.000 20.937  0 837  PHE   A HE1  1 c 1 
ATOM   12090 H  HE2  . PHE   A  1  782 ? -6.631  4.558   -14.208 1.000 18.948  0 837  PHE   A HE2  1 c 1 
ATOM   12091 H  HZ   . PHE   A  1  782 ? -7.936  3.759   -15.962 1.000 21.177  0 837  PHE   A HZ   1 c 1 
ATOM   12092 N  N    . TYR   A  1  783 ? -10.820 10.717  -13.006 1.000 16.970  0 838  TYR   A N    1 ? 1 
ATOM   12093 C  CA   . TYR   A  1  783 ? -11.479 11.708  -12.162 1.000 19.222  0 838  TYR   A CA   1 ? 1 
ATOM   12094 C  C    . TYR   A  1  783 ? -11.015 13.154  -12.366 1.000 23.034  0 838  TYR   A C    1 ? 1 
ATOM   12095 O  O    . TYR   A  1  783 ? -10.886 13.928  -11.424 1.000 23.022  0 838  TYR   A O    1 ? 1 
ATOM   12096 C  CB   . TYR   A  1  783 ? -11.352 11.337  -10.677 1.000 21.978  0 838  TYR   A CB   1 ? 1 
ATOM   12097 C  CG   . TYR   A  1  783 ? -11.870 9.953   -10.310 1.000 21.875  0 838  TYR   A CG   1 ? 1 
ATOM   12098 C  CD1  . TYR   A  1  783 ? -13.218 9.650   -10.373 1.000 28.873  0 838  TYR   A CD1  1 ? 1 
ATOM   12099 C  CD2  . TYR   A  1  783 ? -11.013 8.977   -9.849  1.000 29.945  0 838  TYR   A CD2  1 ? 1 
ATOM   12100 C  CE1  . TYR   A  1  783 ? -13.696 8.385   -10.023 1.000 31.678  0 838  TYR   A CE1  1 ? 1 
ATOM   12101 C  CE2  . TYR   A  1  783 ? -11.468 7.709   -9.518  1.000 27.930  0 838  TYR   A CE2  1 ? 1 
ATOM   12102 C  CZ   . TYR   A  1  783 ? -12.812 7.413   -9.601  1.000 25.192  0 838  TYR   A CZ   1 ? 1 
ATOM   12103 O  OH   . TYR   A  1  783 ? -13.226 6.160   -9.229  1.000 21.416  0 838  TYR   A OH   1 ? 1 
ATOM   12104 H  H    . TYR   A  1  783 ? -11.339 10.236  -13.586 1.000 17.925  0 838  TYR   A H    1 c 1 
ATOM   12105 H  HA   . TYR   A  1  783 ? -12.444 11.683  -12.387 1.000 20.158  0 838  TYR   A HA   1 c 1 
ATOM   12106 H  HB2  . TYR   A  1  783 ? -10.409 11.400  -10.421 1.000 21.031  0 838  TYR   A HB2  1 c 1 
ATOM   12107 H  HB3  . TYR   A  1  783 ? -11.846 12.001  -10.152 1.000 21.436  0 838  TYR   A HB3  1 c 1 
ATOM   12108 H  HD1  . TYR   A  1  783 ? -13.826 10.305  -10.672 1.000 28.003  0 838  TYR   A HD1  1 c 1 
ATOM   12109 H  HD2  . TYR   A  1  783 ? -10.090 9.160   -9.800  1.000 26.882  0 838  TYR   A HD2  1 c 1 
ATOM   12110 H  HE1  . TYR   A  1  783 ? -14.616 8.191   -10.086 1.000 29.452  0 838  TYR   A HE1  1 c 1 
ATOM   12111 H  HE2  . TYR   A  1  783 ? -10.862 7.056   -9.214  1.000 26.854  0 838  TYR   A HE2  1 c 1 
ATOM   12112 H  HH   . TYR   A  1  783 ? -14.060 5.955   -9.255  0.000 14.030  0 838  TYR   A HH   1 c 1 
ATOM   12113 N  N    . ARG   A  1  784 ? -10.797 13.516  -13.623 1.000 20.621  0 839  ARG   A N    1 ? 1 
ATOM   12114 C  CA   . ARG   A  1  784 ? -10.248 14.809  -14.001 1.000 24.868  0 839  ARG   A CA   1 ? 1 
ATOM   12115 C  C    . ARG   A  1  784 ? -11.291 15.920  -14.022 1.000 24.934  0 839  ARG   A C    1 ? 1 
ATOM   12116 O  O    . ARG   A  1  784 ? -10.934 17.084  -13.940 1.000 28.754  0 839  ARG   A O    1 ? 1 
ATOM   12117 C  CB   . ARG   A  1  784 ? -9.587  14.652  -15.398 1.000 24.576  0 839  ARG   A CB   1 ? 1 
ATOM   12118 C  CG   . ARG   A  1  784 ? -8.411  13.739  -15.318 1.000 25.064  0 839  ARG   A CG   1 ? 1 
ATOM   12119 C  CD   . ARG   A  1  784 ? -7.610  13.687  -16.581 1.000 32.321  0 839  ARG   A CD   1 ? 1 
ATOM   12120 N  NE   . ARG   A  1  784 ? -7.106  14.985  -16.993 1.000 25.354  0 839  ARG   A NE   1 ? 1 
ATOM   12121 C  CZ   . ARG   A  1  784 ? -5.848  15.393  -16.878 1.000 24.398  0 839  ARG   A CZ   1 ? 1 
ATOM   12122 N  NH1  . ARG   A  1  784 ? -4.994  14.812  -16.056 1.000 23.505  0 839  ARG   A NH1  1 ? 1 
ATOM   12123 N  NH2  . ARG   A  1  784 ? -5.459  16.466  -17.551 1.000 22.983  0 839  ARG   A NH2  1 ? 1 
ATOM   12124 H  H    . ARG   A  1  784 ? -11.008 12.926  -14.289 1.000 22.071  0 839  ARG   A H    1 c 1 
ATOM   12125 H  HA   . ARG   A  1  784 ? -9.550  15.050  -13.349 1.000 23.633  0 839  ARG   A HA   1 c 1 
ATOM   12126 H  HB2  . ARG   A  1  784 ? -10.243 14.288  -16.029 1.000 25.085  0 839  ARG   A HB2  1 c 1 
ATOM   12127 H  HB3  . ARG   A  1  784 ? -9.301  15.532  -15.719 1.000 25.244  0 839  ARG   A HB3  1 c 1 
ATOM   12128 H  HG2  . ARG   A  1  784 ? -7.827  14.033  -14.587 1.000 26.004  0 839  ARG   A HG2  1 c 1 
ATOM   12129 H  HG3  . ARG   A  1  784 ? -8.722  12.834  -15.106 1.000 25.919  0 839  ARG   A HG3  1 c 1 
ATOM   12130 H  HD2  . ARG   A  1  784 ? -6.855  13.074  -16.454 1.000 28.130  0 839  ARG   A HD2  1 c 1 
ATOM   12131 H  HD3  . ARG   A  1  784 ? -8.171  13.321  -17.298 1.000 28.776  0 839  ARG   A HD3  1 c 1 
ATOM   12132 H  HE   . ARG   A  1  784 ? -7.675  15.542  -17.348 1.000 26.912  0 839  ARG   A HE   1 c 1 
ATOM   12133 H  HH11 . ARG   A  1  784 ? -5.268  14.529  -15.267 1.000 23.361  0 839  ARG   A HH11 1 c 1 
ATOM   12134 H  HH12 . ARG   A  1  784 ? -4.152  14.712  -16.297 1.000 23.597  0 839  ARG   A HH12 1 c 1 
ATOM   12135 H  HH21 . ARG   A  1  784 ? -4.646  16.782  -17.438 1.000 23.591  0 839  ARG   A HH21 1 c 1 
ATOM   12136 H  HH22 . ARG   A  1  784 ? -6.012  16.860  -18.110 1.000 23.989  0 839  ARG   A HH22 1 c 1 
ATOM   12137 N  N    . LYS   A  1  785 ? -12.577 15.566  -14.142 1.000 29.328  0 840  LYS   A N    1 ? 1 
ATOM   12138 C  CA   . LYS   A  1  785 ? -13.623 16.572  -14.126 1.000 34.979  0 840  LYS   A CA   1 ? 1 
ATOM   12139 C  C    . LYS   A  1  785 ? -14.707 16.236  -13.108 1.000 29.976  0 840  LYS   A C    1 ? 1 
ATOM   12140 O  O    . LYS   A  1  785 ? -15.646 15.515  -13.403 1.000 34.538  0 840  LYS   A O    1 ? 1 
ATOM   12141 C  CB   . LYS   A  1  785 ? -14.222 16.775  -15.519 1.000 37.528  0 840  LYS   A CB   1 ? 1 
ATOM   12142 C  CG   . LYS   A  1  785 ? -14.995 18.099  -15.638 1.000 50.306  0 840  LYS   A CG   1 ? 1 
ATOM   12143 C  CD   . LYS   A  1  785 ? -15.694 18.306  -16.967 1.000 67.336  0 840  LYS   A CD   1 ? 1 
ATOM   12144 C  CE   . LYS   A  1  785 ? -16.453 19.620  -16.964 1.000 77.630  0 840  LYS   A CE   1 ? 1 
ATOM   12145 N  NZ   . LYS   A  1  785 ? -17.186 19.840  -18.235 1.000 87.367  0 840  LYS   A NZ   1 ? 1 
ATOM   12146 H  H    . LYS   A  1  785 ? -12.805 14.687  -14.243 1.000 28.913  0 840  LYS   A H    1 c 1 
ATOM   12147 H  HA   . LYS   A  1  785 ? -13.213 17.424  -13.852 1.000 33.311  0 840  LYS   A HA   1 c 1 
ATOM   12148 H  HB2  . LYS   A  1  785 ? -13.498 16.768  -16.180 1.000 39.353  0 840  LYS   A HB2  1 c 1 
ATOM   12149 H  HB3  . LYS   A  1  785 ? -14.827 16.030  -15.720 1.000 39.278  0 840  LYS   A HB3  1 c 1 
ATOM   12150 H  HG2  . LYS   A  1  785 ? -15.665 18.134  -14.923 1.000 50.099  0 840  LYS   A HG2  1 c 1 
ATOM   12151 H  HG3  . LYS   A  1  785 ? -14.368 18.839  -15.493 1.000 50.225  0 840  LYS   A HG3  1 c 1 
ATOM   12152 H  HD2  . LYS   A  1  785 ? -15.030 18.315  -17.689 1.000 64.936  0 840  LYS   A HD2  1 c 1 
ATOM   12153 H  HD3  . LYS   A  1  785 ? -16.319 17.568  -17.128 1.000 64.888  0 840  LYS   A HD3  1 c 1 
ATOM   12154 H  HE2  . LYS   A  1  785 ? -17.092 19.625  -16.226 1.000 77.295  0 840  LYS   A HE2  1 c 1 
ATOM   12155 H  HE3  . LYS   A  1  785 ? -15.829 20.357  -16.827 1.000 77.350  0 840  LYS   A HE3  1 c 1 
ATOM   12156 H  HZ1  . LYS   A  1  785 ? -17.752 19.147  -18.387 1.000 84.429  0 840  LYS   A HZ1  1 c 1 
ATOM   12157 H  HZ2  . LYS   A  1  785 ? -16.597 19.899  -18.923 1.000 84.514  0 840  LYS   A HZ2  1 c 1 
ATOM   12158 H  HZ3  . LYS   A  1  785 ? -17.664 20.609  -18.186 1.000 84.976  0 840  LYS   A HZ3  1 c 1 
ATOM   12159 N  N    . THR   A  1  786 ? -14.547 16.765  -11.895 1.000 33.731  0 841  THR   A N    1 ? 1 
ATOM   12160 C  CA   . THR   A  1  786 ? -15.541 16.618  -10.848 1.000 28.517  0 841  THR   A CA   1 ? 1 
ATOM   12161 C  C    . THR   A  1  786 ? -15.725 17.950  -10.131 1.000 31.657  0 841  THR   A C    1 ? 1 
ATOM   12162 O  O    . THR   A  1  786 ? -14.957 18.885  -10.313 1.000 31.341  0 841  THR   A O    1 ? 1 
ATOM   12163 C  CB   . THR   A  1  786 ? -15.134 15.529  -9.833  1.000 32.486  0 841  THR   A CB   1 ? 1 
ATOM   12164 O  OG1  . THR   A  1  786 ? -13.972 15.984  -9.099  1.000 22.465  0 841  THR   A OG1  1 ? 1 
ATOM   12165 C  CG2  . THR   A  1  786 ? -14.896 14.154  -10.500 1.000 26.828  0 841  THR   A CG2  1 ? 1 
ATOM   12166 H  H    . THR   A  1  786 ? -13.784 17.233  -11.710 1.000 31.417  0 841  THR   A H    1 c 1 
ATOM   12167 H  HA   . THR   A  1  786 ? -16.397 16.362  -11.262 1.000 31.066  0 841  THR   A HA   1 c 1 
ATOM   12168 H  HB   . THR   A  1  786 ? -15.878 15.428  -9.193  1.000 28.568  0 841  THR   A HB   1 c 1 
ATOM   12169 H  HG1  . THR   A  1  786 ? -13.332 16.120  -9.645  0.000 12.840  0 841  THR   A HG1  1 c 1 
ATOM   12170 H  HG21 . THR   A  1  786 ? -14.725 13.484  -9.814  1.000 27.849  0 841  THR   A HG21 1 c 1 
ATOM   12171 H  HG22 . THR   A  1  786 ? -14.128 14.209  -11.096 1.000 28.134  0 841  THR   A HG22 1 c 1 
ATOM   12172 H  HG23 . THR   A  1  786 ? -15.685 13.899  -11.011 1.000 28.499  0 841  THR   A HG23 1 c 1 
ATOM   12173 N  N    . SER   A  1  787 ? -16.740 17.990  -9.275  1.000 37.550  0 842  SER   A N    1 ? 1 
ATOM   12174 C  CA   . SER   A  1  787 ? -17.012 19.137  -8.438  1.000 41.819  0 842  SER   A CA   1 ? 1 
ATOM   12175 C  C    . SER   A  1  787 ? -16.206 19.087  -7.144  1.000 30.788  0 842  SER   A C    1 ? 1 
ATOM   12176 O  O    . SER   A  1  787 ? -16.386 19.958  -6.307  1.000 33.047  0 842  SER   A O    1 ? 1 
ATOM   12177 C  CB   . SER   A  1  787 ? -18.510 19.203  -8.141  1.000 41.515  0 842  SER   A CB   1 ? 1 
ATOM   12178 O  OG   . SER   A  1  787 ? -18.930 17.957  -7.617  1.000 39.410  0 842  SER   A OG   1 ? 1 
ATOM   12179 H  H    . SER   A  1  787 ? -17.295 17.266  -9.213  1.000 36.658  0 842  SER   A H    1 c 1 
ATOM   12180 H  HA   . SER   A  1  787 ? -16.752 19.958  -8.938  1.000 38.880  0 842  SER   A HA   1 c 1 
ATOM   12181 H  HB2  . SER   A  1  787 ? -18.692 19.918  -7.491  1.000 41.461  0 842  SER   A HB2  1 c 1 
ATOM   12182 H  HB3  . SER   A  1  787 ? -19.005 19.400  -8.969  1.000 41.674  0 842  SER   A HB3  1 c 1 
ATOM   12183 H  HG   . SER   A  1  787 ? -18.854 17.999  -6.775  0.000 28.470  0 842  SER   A HG   1 c 1 
ATOM   12184 N  N    . ARG   A  1  788 ? -15.302 18.110  -7.013  1.000 35.852  0 843  ARG   A N    1 ? 1 
ATOM   12185 C  CA   . ARG   A  1  788 ? -14.458 17.972  -5.825  1.000 34.533  0 843  ARG   A CA   1 ? 1 
ATOM   12186 C  C    . ARG   A  1  788 ? -13.064 18.556  -6.053  1.000 31.747  0 843  ARG   A C    1 ? 1 
ATOM   12187 O  O    . ARG   A  1  788 ? -12.606 18.661  -7.183  1.000 32.550  0 843  ARG   A O    1 ? 1 
ATOM   12188 C  CB   . ARG   A  1  788 ? -14.270 16.488  -5.409  1.000 28.884  0 843  ARG   A CB   1 ? 1 
ATOM   12189 C  CG   . ARG   A  1  788 ? -15.490 15.549  -5.562  1.000 33.017  0 843  ARG   A CG   1 ? 1 
ATOM   12190 C  CD   . ARG   A  1  788 ? -16.742 16.060  -4.874  1.000 28.255  0 843  ARG   A CD   1 ? 1 
ATOM   12191 N  NE   . ARG   A  1  788 ? -16.524 16.289  -3.446  1.000 38.070  0 843  ARG   A NE   1 ? 1 
ATOM   12192 C  CZ   . ARG   A  1  788 ? -17.302 17.021  -2.652  1.000 33.901  0 843  ARG   A CZ   1 ? 1 
ATOM   12193 N  NH1  . ARG   A  1  788 ? -18.358 17.672  -3.113  1.000 48.550  0 843  ARG   A NH1  1 ? 1 
ATOM   12194 N  NH2  . ARG   A  1  788 ? -16.997 17.119  -1.365  1.000 33.665  0 843  ARG   A NH2  1 ? 1 
ATOM   12195 H  H    . ARG   A  1  788 ? -15.206 17.496  -7.682  1.000 34.011  0 843  ARG   A H    1 c 1 
ATOM   12196 H  HA   . ARG   A  1  788 ? -14.884 18.457  -5.081  1.000 33.434  0 843  ARG   A HA   1 c 1 
ATOM   12197 H  HB2  . ARG   A  1  788 ? -13.534 16.117  -5.939  1.000 30.525  0 843  ARG   A HB2  1 c 1 
ATOM   12198 H  HB3  . ARG   A  1  788 ? -13.989 16.473  -4.470  1.000 30.681  0 843  ARG   A HB3  1 c 1 
ATOM   12199 H  HG2  . ARG   A  1  788 ? -15.683 15.429  -6.516  1.000 30.884  0 843  ARG   A HG2  1 c 1 
ATOM   12200 H  HG3  . ARG   A  1  788 ? -15.265 14.670  -5.190  1.000 30.363  0 843  ARG   A HG3  1 c 1 
ATOM   12201 H  HD2  . ARG   A  1  788 ? -17.024 16.899  -5.297  1.000 32.032  0 843  ARG   A HD2  1 c 1 
ATOM   12202 H  HD3  . ARG   A  1  788 ? -17.463 15.407  -4.990  1.000 31.533  0 843  ARG   A HD3  1 c 1 
ATOM   12203 H  HE   . ARG   A  1  788 ? -15.832 15.911  -3.084  1.000 33.866  0 843  ARG   A HE   1 c 1 
ATOM   12204 H  HH11 . ARG   A  1  788 ? -18.795 17.363  -3.815  1.000 43.348  0 843  ARG   A HH11 1 c 1 
ATOM   12205 H  HH12 . ARG   A  1  788 ? -18.625 18.412  -2.712  1.000 43.664  0 843  ARG   A HH12 1 c 1 
ATOM   12206 H  HH21 . ARG   A  1  788 ? -17.517 17.580  -0.825  1.000 34.220  0 843  ARG   A HH21 1 c 1 
ATOM   12207 H  HH22 . ARG   A  1  788 ? -16.278 16.722  -1.052  1.000 33.353  0 843  ARG   A HH22 1 c 1 
ATOM   12208 N  N    . SER   A  1  789 ? -12.381 18.915  -4.964  1.000 32.569  0 844  SER   A N    1 ? 1 
ATOM   12209 C  CA   . SER   A  1  789 ? -11.005 19.391  -5.022  1.000 35.184  0 844  SER   A CA   1 ? 1 
ATOM   12210 C  C    . SER   A  1  789 ? -10.036 18.274  -5.421  1.000 27.698  0 844  SER   A C    1 ? 1 
ATOM   12211 O  O    . SER   A  1  789 ? -10.287 17.100  -5.132  1.000 30.402  0 844  SER   A O    1 ? 1 
ATOM   12212 C  CB   . SER   A  1  789 ? -10.583 19.933  -3.655  1.000 30.894  0 844  SER   A CB   1 ? 1 
ATOM   12213 O  OG   . SER   A  1  789 ? -10.279 18.831  -2.807  1.000 24.965  0 844  SER   A OG   1 ? 1 
ATOM   12214 H  H    . SER   A  1  789 ? -12.790 18.859  -4.149  1.000 32.918  0 844  SER   A H    1 c 1 
ATOM   12215 H  HA   . SER   A  1  789 ? -10.948 20.122  -5.694  1.000 32.765  0 844  SER   A HA   1 c 1 
ATOM   12216 H  HB2  . SER   A  1  789 ? -9.792  20.510  -3.754  1.000 30.417  0 844  SER   A HB2  1 c 1 
ATOM   12217 H  HB3  . SER   A  1  789 ? -11.314 20.465  -3.266  1.000 30.688  0 844  SER   A HB3  1 c 1 
ATOM   12218 H  HG   . SER   A  1  789 ? -9.453  18.646  -2.902  0.000 15.870  0 844  SER   A HG   1 c 1 
ATOM   12219 N  N    . TYR   A  1  790 ? -8.921  18.646  -6.061  1.000 21.672  0 845  TYR   A N    1 ? 1 
ATOM   12220 C  CA   . TYR   A  1  790 ? -7.997  17.647  -6.556  1.000 31.387  0 845  TYR   A CA   1 ? 1 
ATOM   12221 C  C    . TYR   A  1  790 ? -7.374  16.835  -5.417  1.000 27.112  0 845  TYR   A C    1 ? 1 
ATOM   12222 O  O    . TYR   A  1  790 ? -7.167  15.633  -5.540  1.000 26.131  0 845  TYR   A O    1 ? 1 
ATOM   12223 C  CB   . TYR   A  1  790 ? -6.957  18.300  -7.433  1.000 26.035  0 845  TYR   A CB   1 ? 1 
ATOM   12224 C  CG   . TYR   A  1  790 ? -5.987  17.330  -8.083  1.000 24.962  0 845  TYR   A CG   1 ? 1 
ATOM   12225 C  CD1  . TYR   A  1  790 ? -6.441  16.212  -8.790  1.000 29.100  0 845  TYR   A CD1  1 ? 1 
ATOM   12226 C  CD2  . TYR   A  1  790 ? -4.620  17.569  -8.056  1.000 28.141  0 845  TYR   A CD2  1 ? 1 
ATOM   12227 C  CE1  . TYR   A  1  790 ? -5.539  15.339  -9.423  1.000 27.711  0 845  TYR   A CE1  1 ? 1 
ATOM   12228 C  CE2  . TYR   A  1  790 ? -3.718  16.708  -8.659  1.000 24.961  0 845  TYR   A CE2  1 ? 1 
ATOM   12229 C  CZ   . TYR   A  1  790 ? -4.175  15.591  -9.336  1.000 31.797  0 845  TYR   A CZ   1 ? 1 
ATOM   12230 O  OH   . TYR   A  1  790 ? -3.211  14.798  -9.900  1.000 23.895  0 845  TYR   A OH   1 ? 1 
ATOM   12231 H  H    . TYR   A  1  790 ? -8.736  19.532  -6.187  1.000 25.336  0 845  TYR   A H    1 c 1 
ATOM   12232 H  HA   . TYR   A  1  790 ? -8.514  17.018  -7.120  1.000 27.227  0 845  TYR   A HA   1 c 1 
ATOM   12233 H  HB2  . TYR   A  1  790 ? -7.417  18.805  -8.136  1.000 27.401  0 845  TYR   A HB2  1 c 1 
ATOM   12234 H  HB3  . TYR   A  1  790 ? -6.450  18.938  -6.889  1.000 27.118  0 845  TYR   A HB3  1 c 1 
ATOM   12235 H  HD1  . TYR   A  1  790 ? -7.366  16.039  -8.842  1.000 27.844  0 845  TYR   A HD1  1 c 1 
ATOM   12236 H  HD2  . TYR   A  1  790 ? -4.294  18.321  -7.588  1.000 26.846  0 845  TYR   A HD2  1 c 1 
ATOM   12237 H  HE1  . TYR   A  1  790 ? -5.852  14.574  -9.874  1.000 28.678  0 845  TYR   A HE1  1 c 1 
ATOM   12238 H  HE2  . TYR   A  1  790 ? -2.792  16.880  -8.605  1.000 27.040  0 845  TYR   A HE2  1 c 1 
ATOM   12239 H  HH   . TYR   A  1  790 ? -3.405  14.093  -10.331 0.000 15.750  0 845  TYR   A HH   1 c 1 
ATOM   12240 N  N    . SER   A  1  791 ? -7.115  17.488  -4.290  1.000 24.225  0 846  SER   A N    1 ? 1 
ATOM   12241 C  CA   . SER   A  1  791 ? -6.656  16.789  -3.100  1.000 26.818  0 846  SER   A CA   1 ? 1 
ATOM   12242 C  C    . SER   A  1  791 ? -7.612  15.685  -2.666  1.000 20.835  0 846  SER   A C    1 ? 1 
ATOM   12243 O  O    . SER   A  1  791 ? -7.178  14.571  -2.353  1.000 22.026  0 846  SER   A O    1 ? 1 
ATOM   12244 C  CB   . SER   A  1  791 ? -6.488  17.784  -1.935  1.000 26.283  0 846  SER   A CB   1 ? 1 
ATOM   12245 O  OG   . SER   A  1  791 ? -5.438  18.679  -2.231  1.000 56.003  0 846  SER   A OG   1 ? 1 
ATOM   12246 H  H    . SER   A  1  791 ? -7.226  18.394  -4.256  1.000 25.950  0 846  SER   A H    1 c 1 
ATOM   12247 H  HA   . SER   A  1  791 ? -5.771  16.380  -3.300  1.000 24.637  0 846  SER   A HA   1 c 1 
ATOM   12248 H  HB2  . SER   A  1  791 ? -7.325  18.284  -1.801  1.000 31.889  0 846  SER   A HB2  1 c 1 
ATOM   12249 H  HB3  . SER   A  1  791 ? -6.282  17.295  -1.109  1.000 31.345  0 846  SER   A HB3  1 c 1 
ATOM   12250 H  HG   . SER   A  1  791 ? -5.771  19.365  -2.661  0.000 47.360  0 846  SER   A HG   1 c 1 
ATOM   12251 N  N    . GLU   A  1  792 ? -8.903  16.030  -2.552  1.000 23.644  0 847  GLU   A N    1 ? 1 
ATOM   12252 C  CA   . GLU   A  1  792 ? -9.921  15.037  -2.249  1.000 28.199  0 847  GLU   A CA   1 ? 1 
ATOM   12253 C  C    . GLU   A  1  792 ? -9.882  13.866  -3.238  1.000 25.929  0 847  GLU   A C    1 ? 1 
ATOM   12254 O  O    . GLU   A  1  792 ? -9.919  12.705  -2.822  1.000 28.159  0 847  GLU   A O    1 ? 1 
ATOM   12255 C  CB   . GLU   A  1  792 ? -11.304 15.658  -2.219  1.000 26.916  0 847  GLU   A CB   1 ? 1 
ATOM   12256 C  CG   . GLU   A  1  792 ? -12.340 14.734  -1.562  1.000 36.453  0 847  GLU   A CG   1 ? 1 
ATOM   12257 C  CD   . GLU   A  1  792 ? -13.789 15.097  -1.846  1.000 42.877  0 847  GLU   A CD   1 ? 1 
ATOM   12258 O  OE1  . GLU   A  1  792 ? -14.211 16.169  -1.364  1.000 37.989  0 847  GLU   A OE1  1 ? 1 
ATOM   12259 O  OE2  . GLU   A  1  792 ? -14.498 14.340  -2.558  1.000 45.103  0 847  GLU   A OE2  1 ? 1 
ATOM   12260 H  H    . GLU   A  1  792 ? -9.152  16.902  -2.664  1.000 24.365  0 847  GLU   A H    1 c 1 
ATOM   12261 H  HA   . GLU   A  1  792 ? -9.729  14.681  -1.351  1.000 26.323  0 847  GLU   A HA   1 c 1 
ATOM   12262 H  HB2  . GLU   A  1  792 ? -11.263 16.502  -1.722  1.000 29.408  0 847  GLU   A HB2  1 c 1 
ATOM   12263 H  HB3  . GLU   A  1  792 ? -11.584 15.856  -3.137  1.000 29.375  0 847  GLU   A HB3  1 c 1 
ATOM   12264 H  HG2  . GLU   A  1  792 ? -12.188 13.815  -1.867  1.000 34.731  0 847  GLU   A HG2  1 c 1 
ATOM   12265 H  HG3  . GLU   A  1  792 ? -12.204 14.747  -0.590  1.000 34.997  0 847  GLU   A HG3  1 c 1 
ATOM   12266 N  N    . ILE   A  1  793 ? -9.784  14.177  -4.545  1.000 23.341  0 848  ILE   A N    1 ? 1 
ATOM   12267 C  CA   . ILE   A  1  793 ? -9.678  13.165  -5.592  1.000 22.629  0 848  ILE   A CA   1 ? 1 
ATOM   12268 C  C    . ILE   A  1  793 ? -8.427  12.295  -5.408  1.000 22.185  0 848  ILE   A C    1 ? 1 
ATOM   12269 O  O    . ILE   A  1  793 ? -8.486  11.083  -5.554  1.000 18.934  0 848  ILE   A O    1 ? 1 
ATOM   12270 C  CB   . ILE   A  1  793 ? -9.731  13.846  -6.999  1.000 23.453  0 848  ILE   A CB   1 ? 1 
ATOM   12271 C  CG1  . ILE   A  1  793 ? -11.153 14.394  -7.293  1.000 19.225  0 848  ILE   A CG1  1 ? 1 
ATOM   12272 C  CG2  . ILE   A  1  793 ? -9.285  12.933  -8.102  1.000 25.626  0 848  ILE   A CG2  1 ? 1 
ATOM   12273 C  CD1  . ILE   A  1  793 ? -12.300 13.306  -7.201  1.000 21.215  0 848  ILE   A CD1  1 ? 1 
ATOM   12274 H  H    . ILE   A  1  793 ? -9.790  15.058  -4.789  1.000 24.141  0 848  ILE   A H    1 c 1 
ATOM   12275 H  HA   . ILE   A  1  793 ? -10.451 12.582  -5.516  1.000 22.784  0 848  ILE   A HA   1 c 1 
ATOM   12276 H  HB   . ILE   A  1  793 ? -9.114  14.617  -6.980  1.000 22.893  0 848  ILE   A HB   1 c 1 
ATOM   12277 H  HG12 . ILE   A  1  793 ? -11.350 15.112  -6.654  1.000 20.825  0 848  ILE   A HG12 1 c 1 
ATOM   12278 H  HG13 . ILE   A  1  793 ? -11.160 14.783  -8.193  1.000 20.951  0 848  ILE   A HG13 1 c 1 
ATOM   12279 H  HG21 . ILE   A  1  793 ? -9.708  12.063  -7.997  1.000 24.651  0 848  ILE   A HG21 1 c 1 
ATOM   12280 H  HG22 . ILE   A  1  793 ? -8.318  12.829  -8.071  1.000 24.628  0 848  ILE   A HG22 1 c 1 
ATOM   12281 H  HG23 . ILE   A  1  793 ? -9.539  13.312  -8.962  1.000 25.074  0 848  ILE   A HG23 1 c 1 
ATOM   12282 H  HD11 . ILE   A  1  793 ? -12.464 13.080  -6.269  1.000 20.522  0 848  ILE   A HD11 1 c 1 
ATOM   12283 H  HD12 . ILE   A  1  793 ? -12.031 12.505  -7.685  1.000 20.437  0 848  ILE   A HD12 1 c 1 
ATOM   12284 H  HD13 . ILE   A  1  793 ? -13.116 13.661  -7.595  1.000 21.005  0 848  ILE   A HD13 1 c 1 
ATOM   12285 N  N    . LEU   A  1  794 ? -7.283  12.905  -5.063  1.000 19.940  0 849  LEU   A N    1 ? 1 
ATOM   12286 C  CA   . LEU   A  1  794 ? -6.115  12.098  -4.735  1.000 19.762  0 849  LEU   A CA   1 ? 1 
ATOM   12287 C  C    . LEU   A  1  794 ? -6.390  11.100  -3.603  1.000 18.618  0 849  LEU   A C    1 ? 1 
ATOM   12288 O  O    . LEU   A  1  794 ? -5.993  9.933   -3.671  1.000 20.003  0 849  LEU   A O    1 ? 1 
ATOM   12289 C  CB   . LEU   A  1  794 ? -4.902  13.006  -4.408  1.000 17.910  0 849  LEU   A CB   1 ? 1 
ATOM   12290 C  CG   . LEU   A  1  794 ? -4.347  13.815  -5.546  1.000 20.515  0 849  LEU   A CG   1 ? 1 
ATOM   12291 C  CD1  . LEU   A  1  794 ? -3.066  14.582  -5.119  1.000 26.122  0 849  LEU   A CD1  1 ? 1 
ATOM   12292 C  CD2  . LEU   A  1  794 ? -4.024  12.931  -6.757  1.000 21.700  0 849  LEU   A CD2  1 ? 1 
ATOM   12293 H  H    . LEU   A  1  794 ? -7.228  13.816  -5.035  1.000 20.728  0 849  LEU   A H    1 c 1 
ATOM   12294 H  HA   . LEU   A  1  794 ? -5.897  11.571  -5.536  1.000 19.155  0 849  LEU   A HA   1 c 1 
ATOM   12295 H  HB2  . LEU   A  1  794 ? -5.165  13.621  -3.695  1.000 18.979  0 849  LEU   A HB2  1 c 1 
ATOM   12296 H  HB3  . LEU   A  1  794 ? -4.185  12.441  -4.056  1.000 18.590  0 849  LEU   A HB3  1 c 1 
ATOM   12297 H  HG   . LEU   A  1  794 ? -5.027  14.476  -5.819  1.000 21.449  0 849  LEU   A HG   1 c 1 
ATOM   12298 H  HD11 . LEU   A  1  794 ? -2.790  15.177  -5.837  1.000 24.591  0 849  LEU   A HD11 1 c 1 
ATOM   12299 H  HD12 . LEU   A  1  794 ? -2.353  13.947  -4.933  1.000 24.082  0 849  LEU   A HD12 1 c 1 
ATOM   12300 H  HD13 . LEU   A  1  794 ? -3.251  15.104  -4.318  1.000 24.407  0 849  LEU   A HD13 1 c 1 
ATOM   12301 H  HD21 . LEU   A  1  794 ? -4.850  12.680  -7.207  1.000 21.364  0 849  LEU   A HD21 1 c 1 
ATOM   12302 H  HD22 . LEU   A  1  794 ? -3.560  12.129  -6.460  1.000 21.027  0 849  LEU   A HD22 1 c 1 
ATOM   12303 H  HD23 . LEU   A  1  794 ? -3.456  13.423  -7.376  1.000 21.506  0 849  LEU   A HD23 1 c 1 
ATOM   12304 N  N    . THR   A  1  795 ? -7.146  11.518  -2.590  1.000 22.135  0 850  THR   A N    1 ? 1 
ATOM   12305 C  CA   . THR   A  1  795 ? -7.497  10.606  -1.506  1.000 18.238  0 850  THR   A CA   1 ? 1 
ATOM   12306 C  C    . THR   A  1  795 ? -8.319  9.425   -2.022  1.000 19.270  0 850  THR   A C    1 ? 1 
ATOM   12307 O  O    . THR   A  1  795 ? -8.051  8.258   -1.696  1.000 17.360  0 850  THR   A O    1 ? 1 
ATOM   12308 C  CB   . THR   A  1  795 ? -8.210  11.397  -0.426  1.000 24.715  0 850  THR   A CB   1 ? 1 
ATOM   12309 O  OG1  . THR   A  1  795 ? -7.358  12.475  -0.012  1.000 25.134  0 850  THR   A OG1  1 ? 1 
ATOM   12310 C  CG2  . THR   A  1  795 ? -8.574  10.542  0.758   1.000 29.078  0 850  THR   A CG2  1 ? 1 
ATOM   12311 H  H    . THR   A  1  795 ? -7.445  12.382  -2.564  1.000 20.684  0 850  THR   A H    1 c 1 
ATOM   12312 H  HA   . THR   A  1  795 ? -6.658  10.255  -1.128  1.000 19.906  0 850  THR   A HA   1 c 1 
ATOM   12313 H  HB   . THR   A  1  795 ? -9.035  11.772  -0.809  1.000 24.407  0 850  THR   A HB   1 c 1 
ATOM   12314 H  HG1  . THR   A  1  795 ? -6.622  12.155  0.293   0.000 18.250  0 850  THR   A HG1  1 c 1 
ATOM   12315 H  HG21 . THR   A  1  795 ? -8.896  11.108  1.482   1.000 27.842  0 850  THR   A HG21 1 c 1 
ATOM   12316 H  HG22 . THR   A  1  795 ? -7.789  10.051  1.057   1.000 27.464  0 850  THR   A HG22 1 c 1 
ATOM   12317 H  HG23 . THR   A  1  795 ? -9.273  9.912   0.505   1.000 27.619  0 850  THR   A HG23 1 c 1 
ATOM   12318 N  N    . LEU   A  1  796 ? -9.313  9.741   -2.859  1.000 16.515  0 851  LEU   A N    1 ? 1 
ATOM   12319 C  CA   . LEU   A  1  796 ? -10.185 8.733   -3.451  1.000 18.413  0 851  LEU   A CA   1 ? 1 
ATOM   12320 C  C    . LEU   A  1  796 ? -9.389  7.713   -4.256  1.000 19.289  0 851  LEU   A C    1 ? 1 
ATOM   12321 O  O    . LEU   A  1  796 ? -9.589  6.508   -4.132  1.000 19.461  0 851  LEU   A O    1 ? 1 
ATOM   12322 C  CB   . LEU   A  1  796 ? -11.198 9.477   -4.345  1.000 19.773  0 851  LEU   A CB   1 ? 1 
ATOM   12323 C  CG   . LEU   A  1  796 ? -12.243 8.626   -5.049  1.000 20.613  0 851  LEU   A CG   1 ? 1 
ATOM   12324 C  CD1  . LEU   A  1  796 ? -13.304 8.099   -4.063  1.000 21.816  0 851  LEU   A CD1  1 ? 1 
ATOM   12325 C  CD2  . LEU   A  1  796 ? -12.914 9.439   -6.132  1.000 23.324  0 851  LEU   A CD2  1 ? 1 
ATOM   12326 H  H    . LEU   A  1  796 ? -9.458  10.620  -3.065  1.000 17.878  0 851  LEU   A H    1 c 1 
ATOM   12327 H  HA   . LEU   A  1  796 ? -10.661 8.266   -2.727  1.000 18.382  0 851  LEU   A HA   1 c 1 
ATOM   12328 H  HB2  . LEU   A  1  796 ? -11.663 10.136  -3.793  1.000 19.921  0 851  LEU   A HB2  1 c 1 
ATOM   12329 H  HB3  . LEU   A  1  796 ? -10.697 9.969   -5.026  1.000 19.773  0 851  LEU   A HB3  1 c 1 
ATOM   12330 H  HG   . LEU   A  1  796 ? -11.793 7.853   -5.470  1.000 20.851  0 851  LEU   A HG   1 c 1 
ATOM   12331 H  HD11 . LEU   A  1  796 ? -13.827 7.399   -4.492  1.000 21.548  0 851  LEU   A HD11 1 c 1 
ATOM   12332 H  HD12 . LEU   A  1  796 ? -13.892 8.827   -3.799  1.000 21.781  0 851  LEU   A HD12 1 c 1 
ATOM   12333 H  HD13 . LEU   A  1  796 ? -12.864 7.736   -3.275  1.000 21.231  0 851  LEU   A HD13 1 c 1 
ATOM   12334 H  HD21 . LEU   A  1  796 ? -12.253 9.708   -6.793  1.000 22.546  0 851  LEU   A HD21 1 c 1 
ATOM   12335 H  HD22 . LEU   A  1  796 ? -13.320 10.231  -5.739  1.000 22.858  0 851  LEU   A HD22 1 c 1 
ATOM   12336 H  HD23 . LEU   A  1  796 ? -13.602 8.902   -6.563  1.000 22.742  0 851  LEU   A HD23 1 c 1 
ATOM   12337 N  N    . LYS   A  1  797 ? -8.412  8.210   -5.033  1.000 22.504  0 852  LYS   A N    1 ? 1 
ATOM   12338 C  CA   . LYS   A  1  797 ? -7.592  7.336   -5.859  1.000 19.941  0 852  LYS   A CA   1 ? 1 
ATOM   12339 C  C    . LYS   A  1  797 ? -6.642  6.449   -5.058  1.000 18.541  0 852  LYS   A C    1 ? 1 
ATOM   12340 O  O    . LYS   A  1  797 ? -6.198  5.422   -5.565  1.000 15.377  0 852  LYS   A O    1 ? 1 
ATOM   12341 C  CB   . LYS   A  1  797 ? -6.723  8.140   -6.842  1.000 20.158  0 852  LYS   A CB   1 ? 1 
ATOM   12342 C  CG   . LYS   A  1  797 ? -7.462  8.865   -7.976  1.000 25.671  0 852  LYS   A CG   1 ? 1 
ATOM   12343 C  CD   . LYS   A  1  797 ? -6.397  9.595   -8.779  1.000 31.096  0 852  LYS   A CD   1 ? 1 
ATOM   12344 C  CE   . LYS   A  1  797 ? -6.912  10.365  -9.927  1.000 45.608  0 852  LYS   A CE   1 ? 1 
ATOM   12345 N  NZ   . LYS   A  1  797 ? -5.763  10.887  -10.739 1.000 37.410  0 852  LYS   A NZ   1 ? 1 
ATOM   12346 H  H    . LYS   A  1  797 ? -8.258  9.110   -5.052  1.000 21.201  0 852  LYS   A H    1 c 1 
ATOM   12347 H  HA   . LYS   A  1  797 ? -8.194  6.757   -6.377  1.000 20.180  0 852  LYS   A HA   1 c 1 
ATOM   12348 H  HB2  . LYS   A  1  797 ? -6.221  8.807   -6.329  1.000 21.278  0 852  LYS   A HB2  1 c 1 
ATOM   12349 H  HB3  . LYS   A  1  797 ? -6.072  7.528   -7.245  1.000 21.113  0 852  LYS   A HB3  1 c 1 
ATOM   12350 H  HG2  . LYS   A  1  797 ? -7.933  8.216   -8.542  1.000 25.433  0 852  LYS   A HG2  1 c 1 
ATOM   12351 H  HG3  . LYS   A  1  797 ? -8.109  9.502   -7.606  1.000 25.538  0 852  LYS   A HG3  1 c 1 
ATOM   12352 H  HD2  . LYS   A  1  797 ? -5.919  10.209  -8.182  1.000 32.227  0 852  LYS   A HD2  1 c 1 
ATOM   12353 H  HD3  . LYS   A  1  797 ? -5.749  8.938   -9.109  1.000 32.085  0 852  LYS   A HD3  1 c 1 
ATOM   12354 H  HE2  . LYS   A  1  797 ? -7.471  9.794   -10.487 1.000 39.692  0 852  LYS   A HE2  1 c 1 
ATOM   12355 H  HE3  . LYS   A  1  797 ? -7.453  11.113  -9.612  1.000 40.008  0 852  LYS   A HE3  1 c 1 
ATOM   12356 H  HZ1  . LYS   A  1  797 ? -5.257  10.200  -11.037 1.000 39.473  0 852  LYS   A HZ1  1 c 1 
ATOM   12357 H  HZ2  . LYS   A  1  797 ? -5.250  11.434  -10.228 1.000 39.696  0 852  LYS   A HZ2  1 c 1 
ATOM   12358 H  HZ3  . LYS   A  1  797 ? -6.077  11.355  -11.449 1.000 39.934  0 852  LYS   A HZ3  1 c 1 
ATOM   12359 N  N    . THR   A  1  798 ? -6.309  6.857   -3.829  1.000 16.414  0 853  THR   A N    1 ? 1 
ATOM   12360 C  CA   . THR   A  1  798 ? -5.492  6.016   -2.958  1.000 22.309  0 853  THR   A CA   1 ? 1 
ATOM   12361 C  C    . THR   A  1  798 ? -6.271  5.059   -2.060  1.000 15.762  0 853  THR   A C    1 ? 1 
ATOM   12362 O  O    . THR   A  1  798 ? -5.655  4.228   -1.419  1.000 22.661  0 853  THR   A O    1 ? 1 
ATOM   12363 C  CB   . THR   A  1  798 ? -4.527  6.911   -2.090  1.000 19.522  0 853  THR   A CB   1 ? 1 
ATOM   12364 O  OG1  . THR   A  1  798 ? -5.236  7.913   -1.341  1.000 23.286  0 853  THR   A OG1  1 ? 1 
ATOM   12365 C  CG2  . THR   A  1  798 ? -3.542  7.613   -2.960  1.000 18.183  0 853  THR   A CG2  1 ? 1 
ATOM   12366 H  H    . THR   A  1  798 ? -6.582  7.675   -3.528  1.000 18.268  0 853  THR   A H    1 c 1 
ATOM   12367 H  HA   . THR   A  1  798 ? -4.925  5.465   -3.545  1.000 18.988  0 853  THR   A HA   1 c 1 
ATOM   12368 H  HB   . THR   A  1  798 ? -4.039  6.326   -1.463  1.000 20.183  0 853  THR   A HB   1 c 1 
ATOM   12369 H  HG1  . THR   A  1  798 ? -5.654  8.421   -1.899  0.000 17.760  0 853  THR   A HG1  1 c 1 
ATOM   12370 H  HG21 . THR   A  1  798 ? -2.952  8.158   -2.409  1.000 18.602  0 853  THR   A HG21 1 c 1 
ATOM   12371 H  HG22 . THR   A  1  798 ? -4.012  8.184   -3.592  1.000 18.753  0 853  THR   A HG22 1 c 1 
ATOM   12372 H  HG23 . THR   A  1  798 ? -3.012  6.957   -3.448  1.000 18.492  0 853  THR   A HG23 1 c 1 
ATOM   12373 N  N    . TYR   A  1  799 ? -7.594  5.183   -2.019  1.000 23.879  0 854  TYR   A N    1 ? 1 
ATOM   12374 C  CA   . TYR   A  1  799 ? -8.454  4.300   -1.247  1.000 28.125  0 854  TYR   A CA   1 ? 1 
ATOM   12375 C  C    . TYR   A  1  799 ? -8.387  2.864   -1.775  1.000 31.456  0 854  TYR   A C    1 ? 1 
ATOM   12376 O  O    . TYR   A  1  799 ? -8.355  2.650   -2.982  1.000 16.857  0 854  TYR   A O    1 ? 1 
ATOM   12377 C  CB   . TYR   A  1  799 ? -9.908  4.815   -1.271  1.000 23.039  0 854  TYR   A CB   1 ? 1 
ATOM   12378 C  CG   . TYR   A  1  799 ? -10.923 3.879   -0.608  1.000 35.515  0 854  TYR   A CG   1 ? 1 
ATOM   12379 C  CD1  . TYR   A  1  799 ? -11.074 3.842   0.783   1.000 29.181  0 854  TYR   A CD1  1 ? 1 
ATOM   12380 C  CD2  . TYR   A  1  799 ? -11.724 3.026   -1.368  1.000 35.657  0 854  TYR   A CD2  1 ? 1 
ATOM   12381 C  CE1  . TYR   A  1  799 ? -12.011 2.995   1.395   1.000 32.647  0 854  TYR   A CE1  1 ? 1 
ATOM   12382 C  CE2  . TYR   A  1  799 ? -12.687 2.185   -0.758  1.000 21.630  0 854  TYR   A CE2  1 ? 1 
ATOM   12383 C  CZ   . TYR   A  1  799 ? -12.810 2.169   0.616   1.000 33.522  0 854  TYR   A CZ   1 ? 1 
ATOM   12384 O  OH   . TYR   A  1  799 ? -13.709 1.322   1.189   1.000 38.104  0 854  TYR   A OH   1 ? 1 
ATOM   12385 H  H    . TYR   A  1  799 ? -7.986  5.857   -2.496  1.000 22.447  0 854  TYR   A H    1 c 1 
ATOM   12386 H  HA   . TYR   A  1  799 ? -8.138  4.303   -0.310  1.000 26.822  0 854  TYR   A HA   1 c 1 
ATOM   12387 H  HB2  . TYR   A  1  799 ? -9.936  5.685   -0.820  1.000 26.658  0 854  TYR   A HB2  1 c 1 
ATOM   12388 H  HB3  . TYR   A  1  799 ? -10.172 4.954   -2.204  1.000 26.593  0 854  TYR   A HB3  1 c 1 
ATOM   12389 H  HD1  . TYR   A  1  799 ? -10.541 4.404   1.321   1.000 31.155  0 854  TYR   A HD1  1 c 1 
ATOM   12390 H  HD2  . TYR   A  1  799 ? -11.654 3.040   -2.308  1.000 31.393  0 854  TYR   A HD2  1 c 1 
ATOM   12391 H  HE1  . TYR   A  1  799 ? -12.096 2.982   2.332   1.000 32.135  0 854  TYR   A HE1  1 c 1 
ATOM   12392 H  HE2  . TYR   A  1  799 ? -13.217 1.611   -1.285  1.000 26.993  0 854  TYR   A HE2  1 c 1 
ATOM   12393 H  HH   . TYR   A  1  799 ? -13.793 1.303   2.038   0.000 31.480  0 854  TYR   A HH   1 c 1 
ATOM   12394 N  N    . LEU   A  1  800 ? -8.323  1.898   -0.847  1.000 29.410  0 855  LEU   A N    1 ? 1 
ATOM   12395 C  CA   . LEU   A  1  800 ? -8.427  0.471   -1.134  1.000 24.018  0 855  LEU   A CA   1 ? 1 
ATOM   12396 C  C    . LEU   A  1  800 ? -9.592  -0.145  -0.350  1.000 30.090  0 855  LEU   A C    1 ? 1 
ATOM   12397 O  O    . LEU   A  1  800 ? -9.629  -0.091  0.881   1.000 23.900  0 855  LEU   A O    1 ? 1 
ATOM   12398 C  CB   . LEU   A  1  800 ? -7.117  -0.223  -0.769  1.000 20.543  0 855  LEU   A CB   1 ? 1 
ATOM   12399 C  CG   . LEU   A  1  800 ? -6.989  -1.760  -1.073  1.000 25.753  0 855  LEU   A CG   1 ? 1 
ATOM   12400 C  CD1  . LEU   A  1  800 ? -6.663  -2.070  -2.505  1.000 12.148  0 855  LEU   A CD1  1 ? 1 
ATOM   12401 C  CD2  . LEU   A  1  800 ? -5.944  -2.343  -0.170  1.000 27.540  0 855  LEU   A CD2  1 ? 1 
ATOM   12402 H  H    . LEU   A  1  800 ? -8.205  2.148   0.024   1.000 28.473  0 855  LEU   A H    1 c 1 
ATOM   12403 H  HA   . LEU   A  1  800 ? -8.598  0.356   -2.097  1.000 25.342  0 855  LEU   A HA   1 c 1 
ATOM   12404 H  HB2  . LEU   A  1  800 ? -6.394  0.238   -1.238  1.000 22.243  0 855  LEU   A HB2  1 c 1 
ATOM   12405 H  HB3  . LEU   A  1  800 ? -6.967  -0.091  0.189   1.000 22.363  0 855  LEU   A HB3  1 c 1 
ATOM   12406 H  HG   . LEU   A  1  800 ? -7.852  -2.190  -0.857  1.000 21.425  0 855  LEU   A HG   1 c 1 
ATOM   12407 H  HD11 . LEU   A  1  800 ? -6.674  -3.033  -2.640  1.000 15.096  0 855  LEU   A HD11 1 c 1 
ATOM   12408 H  HD12 . LEU   A  1  800 ? -5.779  -1.723  -2.719  1.000 14.940  0 855  LEU   A HD12 1 c 1 
ATOM   12409 H  HD13 . LEU   A  1  800 ? -7.324  -1.654  -3.084  1.000 15.159  0 855  LEU   A HD13 1 c 1 
ATOM   12410 H  HD21 . LEU   A  1  800 ? -6.246  -2.290  0.754   1.000 26.948  0 855  LEU   A HD21 1 c 1 
ATOM   12411 H  HD22 . LEU   A  1  800 ? -5.115  -1.843  -0.267  1.000 26.874  0 855  LEU   A HD22 1 c 1 
ATOM   12412 H  HD23 . LEU   A  1  800 ? -5.790  -3.274  -0.407  1.000 26.828  0 855  LEU   A HD23 1 c 1 
ATOM   12413 N  N    . HIS   A  1  801 ? -10.571 -0.706  -1.073  1.000 31.693  0 856  HIS   A N    1 ? 1 
ATOM   12414 C  CA   . HIS   A  1  801 ? -11.681 -1.421  -0.451  1.000 32.376  0 856  HIS   A CA   1 ? 1 
ATOM   12415 C  C    . HIS   A  1  801 ? -11.181 -2.814  -0.067  1.000 28.136  0 856  HIS   A C    1 ? 1 
ATOM   12416 O  O    . HIS   A  1  801 ? -10.614 -3.521  -0.901  1.000 33.791  0 856  HIS   A O    1 ? 1 
ATOM   12417 C  CB   . HIS   A  1  801 ? -12.848 -1.482  -1.425  1.000 34.173  0 856  HIS   A CB   1 ? 1 
ATOM   12418 C  CG   . HIS   A  1  801 ? -14.198 -1.792  -0.847  1.000 49.151  0 856  HIS   A CG   1 ? 1 
ATOM   12419 N  ND1  . HIS   A  1  801 ? -15.213 -0.862  -0.885  1.000 57.763  0 856  HIS   A ND1  1 ? 1 
ATOM   12420 C  CD2  . HIS   A  1  801 ? -14.673 -2.928  -0.303  1.000 55.177  0 856  HIS   A CD2  1 ? 1 
ATOM   12421 C  CE1  . HIS   A  1  801 ? -16.259 -1.447  -0.334  1.000 69.692  0 856  HIS   A CE1  1 ? 1 
ATOM   12422 N  NE2  . HIS   A  1  801 ? -15.968 -2.691  0.038   1.000 67.390  0 856  HIS   A NE2  1 ? 1 
ATOM   12423 H  H    . HIS   A  1  801 ? -10.547 -0.642  -1.985  1.000 31.379  0 856  HIS   A H    1 c 1 
ATOM   12424 H  HA   . HIS   A  1  801 ? -11.961 -0.932  0.359   1.000 31.807  0 856  HIS   A HA   1 c 1 
ATOM   12425 H  HB2  . HIS   A  1  801 ? -12.907 -0.619  -1.884  1.000 36.568  0 856  HIS   A HB2  1 c 1 
ATOM   12426 H  HB3  . HIS   A  1  801 ? -12.645 -2.159  -2.102  1.000 36.589  0 856  HIS   A HB3  1 c 1 
ATOM   12427 H  HD1  . HIS   A  1  801 ? -15.157 -0.056  -1.217  0.000 52.520  0 856  HIS   A HD1  1 c 1 
ATOM   12428 H  HD2  . HIS   A  1  801 ? -14.187 -3.724  -0.155  1.000 56.055  0 856  HIS   A HD2  1 c 1 
ATOM   12429 H  HE1  . HIS   A  1  801 ? -17.098 -1.035  -0.212  1.000 66.287  0 856  HIS   A HE1  1 c 1 
ATOM   12430 H  HE2  . HIS   A  1  801 ? -16.529 -3.257  0.444   0.000 63.320  0 856  HIS   A HE2  1 c 1 
ATOM   12431 N  N    . THR   A  1  802 ? -11.315 -3.196  1.206   1.000 39.044  0 857  THR   A N    1 ? 1 
ATOM   12432 C  CA   . THR   A  1  802 ? -10.583 -4.362  1.689   1.000 43.057  0 857  THR   A CA   1 ? 1 
ATOM   12433 C  C    . THR   A  1  802 ? -11.475 -5.563  1.995   1.000 34.024  0 857  THR   A C    1 ? 1 
ATOM   12434 O  O    . THR   A  1  802 ? -11.021 -6.710  1.940   1.000 53.142  0 857  THR   A O    1 ? 1 
ATOM   12435 C  CB   . THR   A  1  802 ? -9.760  -4.009  2.904   1.000 38.282  0 857  THR   A CB   1 ? 1 
ATOM   12436 O  OG1  . THR   A  1  802 ? -10.681 -3.604  3.899   1.000 40.073  0 857  THR   A OG1  1 ? 1 
ATOM   12437 C  CG2  . THR   A  1  802 ? -8.764  -2.942  2.634   1.000 46.372  0 857  THR   A CG2  1 ? 1 
ATOM   12438 H  H    . THR   A  1  802 ? -11.851 -2.727  1.779   1.000 36.943  0 857  THR   A H    1 c 1 
ATOM   12439 H  HA   . THR   A  1  802 ? -9.957  -4.632  0.979   1.000 39.217  0 857  THR   A HA   1 c 1 
ATOM   12440 H  HB   . THR   A  1  802 ? -9.288  -4.820  3.211   1.000 40.823  0 857  THR   A HB   1 c 1 
ATOM   12441 H  HG1  . THR   A  1  802 ? -11.139 -2.949  3.615   0.000 32.820  0 857  THR   A HG1  1 c 1 
ATOM   12442 H  HG21 . THR   A  1  802 ? -8.194  -2.828  3.415   1.000 43.549  0 857  THR   A HG21 1 c 1 
ATOM   12443 H  HG22 . THR   A  1  802 ? -9.225  -2.106  2.445   1.000 43.481  0 857  THR   A HG22 1 c 1 
ATOM   12444 H  HG23 . THR   A  1  802 ? -8.218  -3.192  1.867   1.000 43.469  0 857  THR   A HG23 1 c 1 
ATOM   12445 N  N    . TYR   A  1  803 ? -12.735 -5.295  2.350   1.000 41.870  0 858  TYR   A N    1 ? 1 
ATOM   12446 C  CA   . TYR   A  1  803 ? -13.701 -6.355  2.612   1.000 60.266  0 858  TYR   A CA   1 ? 1 
ATOM   12447 C  C    . TYR   A  1  803 ? -13.453 -7.051  3.953   1.000 79.568  0 858  TYR   A C    1 ? 1 
ATOM   12448 O  O    . TYR   A  1  803 ? -13.826 -8.207  4.124   1.000 46.763  0 858  TYR   A O    1 ? 1 
ATOM   12449 C  CB   . TYR   A  1  803 ? -13.703 -7.390  1.438   1.000 42.923  0 858  TYR   A CB   1 ? 1 
ATOM   12450 C  CG   . TYR   A  1  803 ? -14.021 -6.763  0.099   1.000 54.708  0 858  TYR   A CG   1 ? 1 
ATOM   12451 C  CD1  . TYR   A  1  803 ? -15.339 -6.555  -0.298  1.000 44.312  0 858  TYR   A CD1  1 ? 1 
ATOM   12452 C  CD2  . TYR   A  1  803 ? -13.001 -6.320  -0.752  1.000 45.703  0 858  TYR   A CD2  1 ? 1 
ATOM   12453 C  CE1  . TYR   A  1  803 ? -15.639 -5.949  -1.518  1.000 97.163  0 858  TYR   A CE1  1 ? 1 
ATOM   12454 C  CE2  . TYR   A  1  803 ? -13.291 -5.702  -1.969  1.000 44.065  0 858  TYR   A CE2  1 ? 1 
ATOM   12455 C  CZ   . TYR   A  1  803 ? -14.612 -5.525  -2.351  1.000 91.110  0 858  TYR   A CZ   1 ? 1 
ATOM   12456 O  OH   . TYR   A  1  803 ? -14.919 -4.925  -3.549  1.000 82.718  0 858  TYR   A OH   1 ? 1 
ATOM   12457 H  H    . TYR   A  1  803 ? -13.003 -4.427  2.443   1.000 43.136  0 858  TYR   A H    1 c 1 
ATOM   12458 H  HA   . TYR   A  1  803 ? -14.601 -5.941  2.652   1.000 55.729  0 858  TYR   A HA   1 c 1 
ATOM   12459 H  HB2  . TYR   A  1  803 ? -12.829 -7.827  1.391   1.000 48.643  0 858  TYR   A HB2  1 c 1 
ATOM   12460 H  HB3  . TYR   A  1  803 ? -14.372 -8.079  1.631   1.000 49.185  0 858  TYR   A HB3  1 c 1 
ATOM   12461 H  HD1  . TYR   A  1  803 ? -16.043 -6.838  0.262   1.000 56.306  0 858  TYR   A HD1  1 c 1 
ATOM   12462 H  HD2  . TYR   A  1  803 ? -12.102 -6.437  -0.497  1.000 47.236  0 858  TYR   A HD2  1 c 1 
ATOM   12463 H  HE1  . TYR   A  1  803 ? -16.537 -5.824  -1.777  1.000 78.272  0 858  TYR   A HE1  1 c 1 
ATOM   12464 H  HE2  . TYR   A  1  803 ? -12.593 -5.421  -2.537  1.000 52.669  0 858  TYR   A HE2  1 c 1 
ATOM   12465 H  HH   . TYR   A  1  803 ? -15.732 -4.812  -3.787  0.000 75.000  0 858  TYR   A HH   1 c 1 
ATOM   12466 N  N    . GLU   A  1  804 ? -12.852 -6.328  4.907   1.000 71.980  0 859  GLU   A N    1 ? 1 
ATOM   12467 C  CA   . GLU   A  1  804 ? -12.410 -6.902  6.168   1.000 71.410  0 859  GLU   A CA   1 ? 1 
ATOM   12468 C  C    . GLU   A  1  804 ? -13.294 -6.433  7.308   1.000 72.348  0 859  GLU   A C    1 ? 1 
ATOM   12469 O  O    . GLU   A  1  804 ? -14.088 -7.206  7.815   1.000 60.188  0 859  GLU   A O    1 ? 1 
ATOM   12470 C  CB   . GLU   A  1  804 ? -10.950 -6.512  6.434   1.000 71.316  0 859  GLU   A CB   1 ? 1 
ATOM   12471 C  CG   . GLU   A  1  804 ? -9.948  -7.308  5.632   1.000 46.776  0 859  GLU   A CG   1 ? 1 
ATOM   12472 C  CD   . GLU   A  1  804 ? -9.714  -8.726  6.128   1.000 75.126  0 859  GLU   A CD   1 ? 1 
ATOM   12473 O  OE1  . GLU   A  1  804 ? -9.459  -8.908  7.347   1.000 48.924  0 859  GLU   A OE1  1 ? 1 
ATOM   12474 O  OE2  . GLU   A  1  804 ? -9.747  -9.651  5.282   1.000 59.673  0 859  GLU   A OE2  1 ? 1 
ATOM   12475 H  H    . GLU   A  1  804 ? -12.722 -5.434  4.769   1.000 72.874  0 859  GLU   A H    1 c 1 
ATOM   12476 H  HA   . GLU   A  1  804 ? -12.470 -7.883  6.106   1.000 71.631  0 859  GLU   A HA   1 c 1 
ATOM   12477 H  HB2  . GLU   A  1  804 ? -10.839 -5.561  6.226   1.000 64.398  0 859  GLU   A HB2  1 c 1 
ATOM   12478 H  HB3  . GLU   A  1  804 ? -10.763 -6.633  7.388   1.000 64.594  0 859  GLU   A HB3  1 c 1 
ATOM   12479 H  HG2  . GLU   A  1  804 ? -10.253 -7.353  4.701   1.000 57.101  0 859  GLU   A HG2  1 c 1 
ATOM   12480 H  HG3  . GLU   A  1  804 ? -9.094  -6.834  5.638   1.000 56.504  0 859  GLU   A HG3  1 c 1 
HETATM 12481 C  C1   . NAG   B  2  .   ? 7.639   3.295   -6.682  1.000 24.509  0 1    NAG   B C1   1 ? 1 
HETATM 12482 C  C2   . NAG   B  2  .   ? 7.302   2.946   -8.124  1.000 20.557  0 1    NAG   B C2   1 ? 1 
HETATM 12483 C  C3   . NAG   B  2  .   ? 8.570   2.637   -8.900  1.000 17.664  0 1    NAG   B C3   1 ? 1 
HETATM 12484 C  C4   . NAG   B  2  .   ? 9.572   3.780   -8.773  1.000 22.373  0 1    NAG   B C4   1 ? 1 
HETATM 12485 C  C5   . NAG   B  2  .   ? 9.812   4.102   -7.308  1.000 25.134  0 1    NAG   B C5   1 ? 1 
HETATM 12486 C  C6   . NAG   B  2  .   ? 10.691  5.304   -7.108  1.000 28.136  0 1    NAG   B C6   1 ? 1 
HETATM 12487 C  C7   . NAG   B  2  .   ? 5.139   1.872   -8.557  1.000 17.970  0 1    NAG   B C7   1 ? 1 
HETATM 12488 C  C8   . NAG   B  2  .   ? 4.458   0.542   -8.701  1.000 18.350  0 1    NAG   B C8   1 ? 1 
HETATM 12489 N  N2   . NAG   B  2  .   ? 6.419   1.809   -8.187  1.000 23.460  0 1    NAG   B N2   1 ? 1 
HETATM 12490 O  O3   . NAG   B  2  .   ? 8.238   2.433   -10.254 1.000 15.334  0 1    NAG   B O3   1 ? 1 
HETATM 12491 O  O4   . NAG   B  2  .   ? 10.815  3.366   -9.327  1.000 26.182  0 1    NAG   B O4   1 ? 1 
HETATM 12492 O  O5   . NAG   B  2  .   ? 8.568   4.383   -6.654  1.000 19.595  0 1    NAG   B O5   1 ? 1 
HETATM 12493 O  O6   . NAG   B  2  .   ? 10.200  6.448   -7.787  1.000 25.160  0 1    NAG   B O6   1 ? 1 
HETATM 12494 O  O7   . NAG   B  2  .   ? 4.582   2.951   -8.771  1.000 22.514  0 1    NAG   B O7   1 ? 1 
HETATM 12495 H  H1   . NAG   B  2  .   ? 8.068   2.505   -6.257  1.000 22.130  0 1    NAG   B H1   1 c 1 
HETATM 12496 H  H2   . NAG   B  2  .   ? 6.867   3.730   -8.537  1.000 21.132  0 1    NAG   B H2   1 c 1 
HETATM 12497 H  H3   . NAG   B  2  .   ? 8.973   1.808   -8.534  1.000 18.373  0 1    NAG   B H3   1 c 1 
HETATM 12498 H  H4   . NAG   B  2  .   ? 9.236   4.582   -9.247  1.000 22.792  0 1    NAG   B H4   1 c 1 
HETATM 12499 H  H5   . NAG   B  2  .   ? 10.233  3.320   -6.875  1.000 23.869  0 1    NAG   B H5   1 c 1 
HETATM 12500 H  H61  . NAG   B  2  .   ? 11.592  5.102   -7.433  1.000 27.298  0 1    NAG   B H61  1 c 1 
HETATM 12501 H  H62  . NAG   B  2  .   ? 10.753  5.503   -6.153  1.000 26.542  0 1    NAG   B H62  1 c 1 
HETATM 12502 H  H81  . NAG   B  2  .   ? 5.086   -0.173  -8.509  1.000 18.303  0 1    NAG   B H81  1 c 1 
HETATM 12503 H  H82  . NAG   B  2  .   ? 4.127   0.443   -9.608  1.000 18.331  0 1    NAG   B H82  1 c 1 
HETATM 12504 H  H83  . NAG   B  2  .   ? 3.713   0.490   -8.080  1.000 18.024  0 1    NAG   B H83  1 c 1 
HETATM 12505 H  HN2  . NAG   B  2  .   ? 6.745   1.027   -7.965  1.000 21.255  0 1    NAG   B HN2  1 c 1 
HETATM 12506 H  HO3  . NAG   B  2  .   ? 8.691   2.944   -10.722 0.000 8.770   0 1    NAG   B HO3  1 c 1 
HETATM 12507 H  HO4  . NAG   B  2  .   ? 11.075  2.655   -8.961  1.000 25.174  0 1    NAG   B HO4  1 c 1 
HETATM 12508 H  HO6  . NAG   B  2  .   ? 9.595   6.233   -8.153  0.000 18.860  0 1    NAG   B HO6  1 c 1 
HETATM 12509 C  C1   . NAG   B  2  .   ? 11.372  4.171   -10.310 1.000 44.723  0 2    NAG   B C1   1 ? 1 
HETATM 12510 C  C2   . NAG   B  2  .   ? 12.864  3.863   -10.351 1.000 46.317  0 2    NAG   B C2   1 ? 1 
HETATM 12511 C  C3   . NAG   B  2  .   ? 13.524  4.581   -11.517 1.000 50.962  0 2    NAG   B C3   1 ? 1 
HETATM 12512 C  C4   . NAG   B  2  .   ? 12.740  4.438   -12.811 1.000 36.963  0 2    NAG   B C4   1 ? 1 
HETATM 12513 C  C5   . NAG   B  2  .   ? 11.268  4.782   -12.597 1.000 52.231  0 2    NAG   B C5   1 ? 1 
HETATM 12514 C  C6   . NAG   B  2  .   ? 10.379  4.587   -13.813 1.000 52.369  0 2    NAG   B C6   1 ? 1 
HETATM 12515 C  C7   . NAG   B  2  .   ? 13.805  3.348   -8.153  1.000 69.646  0 2    NAG   B C7   1 ? 1 
HETATM 12516 C  C8   . NAG   B  2  .   ? 14.089  3.877   -6.780  1.000 67.843  0 2    NAG   B C8   1 ? 1 
HETATM 12517 N  N2   . NAG   B  2  .   ? 13.458  4.247   -9.087  1.000 48.181  0 2    NAG   B N2   1 ? 1 
HETATM 12518 O  O3   . NAG   B  2  .   ? 14.836  4.068   -11.679 1.000 67.723  0 2    NAG   B O3   1 ? 1 
HETATM 12519 O  O4   . NAG   B  2  .   ? 13.368  5.371   -13.688 1.000 73.611  0 2    NAG   B O4   1 ? 1 
HETATM 12520 O  O5   . NAG   B  2  .   ? 10.752  3.921   -11.554 1.000 39.727  0 2    NAG   B O5   1 ? 1 
HETATM 12521 O  O6   . NAG   B  2  .   ? 10.401  3.235   -14.257 1.000 89.623  0 2    NAG   B O6   1 ? 1 
HETATM 12522 O  O7   . NAG   B  2  .   ? 13.870  2.144   -8.381  1.000 115.737 0 2    NAG   B O7   1 ? 1 
HETATM 12523 H  H1   . NAG   B  2  .   ? 11.250  5.118   -10.067 1.000 39.211  0 2    NAG   B H1   1 c 1 
HETATM 12524 H  H2   . NAG   B  2  .   ? 12.970  2.891   -10.484 1.000 47.583  0 2    NAG   B H2   1 c 1 
HETATM 12525 H  H3   . NAG   B  2  .   ? 13.583  5.544   -11.287 1.000 49.949  0 2    NAG   B H3   1 c 1 
HETATM 12526 H  H4   . NAG   B  2  .   ? 12.829  3.518   -13.168 1.000 47.829  0 2    NAG   B H4   1 c 1 
HETATM 12527 H  H5   . NAG   B  2  .   ? 11.202  5.722   -12.299 1.000 46.321  0 2    NAG   B H5   1 c 1 
HETATM 12528 H  H61  . NAG   B  2  .   ? 10.676  5.173   -14.536 1.000 60.237  0 2    NAG   B H61  1 c 1 
HETATM 12529 H  H62  . NAG   B  2  .   ? 9.459   4.834   -13.583 1.000 59.289  0 2    NAG   B H62  1 c 1 
HETATM 12530 H  H81  . NAG   B  2  .   ? 13.945  4.836   -6.762  1.000 68.051  0 2    NAG   B H81  1 c 1 
HETATM 12531 H  H82  . NAG   B  2  .   ? 15.011  3.684   -6.543  1.000 68.541  0 2    NAG   B H82  1 c 1 
HETATM 12532 H  H83  . NAG   B  2  .   ? 13.497  3.450   -6.140  1.000 67.950  0 2    NAG   B H83  1 c 1 
HETATM 12533 H  HN2  . NAG   B  2  .   ? 13.596  5.098   -8.935  1.000 52.326  0 2    NAG   B HN2  1 c 1 
HETATM 12534 H  HO3  . NAG   B  2  .   ? 14.951  3.786   -12.429 0.000 53.850  0 2    NAG   B HO3  1 c 1 
HETATM 12535 H  HO6  . NAG   B  2  .   ? 11.012  2.736   -13.733 0.000 68.300  0 2    NAG   B HO6  1 c 1 
HETATM 12536 C  C1   . BMA   B  2  .   ? 13.303  5.263   -15.087 1.000 103.014 0 3    BMA   B C1   1 ? 1 
HETATM 12537 C  C2   . BMA   B  2  .   ? 14.268  6.257   -15.676 1.000 110.407 0 3    BMA   B C2   1 ? 1 
HETATM 12538 C  C3   . BMA   B  2  .   ? 14.205  6.175   -17.188 1.000 109.997 0 3    BMA   B C3   1 ? 1 
HETATM 12539 C  C4   . BMA   B  2  .   ? 14.468  4.744   -17.638 1.000 84.440  0 3    BMA   B C4   1 ? 1 
HETATM 12540 C  C5   . BMA   B  2  .   ? 13.475  3.808   -16.966 1.000 94.156  0 3    BMA   B C5   1 ? 1 
HETATM 12541 C  C6   . BMA   B  2  .   ? 13.660  2.346   -17.312 1.000 106.359 0 3    BMA   B C6   1 ? 1 
HETATM 12542 O  O2   . BMA   B  2  .   ? 15.576  6.023   -15.160 1.000 91.128  0 3    BMA   B O2   1 ? 1 
HETATM 12543 O  O3   . BMA   B  2  .   ? 15.141  7.080   -17.765 1.000 93.710  0 3    BMA   B O3   1 ? 1 
HETATM 12544 O  O4   . BMA   B  2  .   ? 14.307  4.628   -19.045 1.000 62.205  0 3    BMA   B O4   1 ? 1 
HETATM 12545 O  O5   . BMA   B  2  .   ? 13.585  3.934   -15.538 1.000 68.173  0 3    BMA   B O5   1 ? 1 
HETATM 12546 O  O6   . BMA   B  2  .   ? 15.031  1.987   -17.448 1.000 109.115 0 3    BMA   B O6   1 ? 1 
HETATM 12547 H  H1   . BMA   B  2  .   ? 12.392  5.505   -15.376 1.000 93.368  0 3    BMA   B H1   1 c 1 
HETATM 12548 H  H2   . BMA   B  2  .   ? 13.976  7.158   -15.398 1.000 104.797 0 3    BMA   B H2   1 c 1 
HETATM 12549 H  H3   . BMA   B  2  .   ? 13.295  6.434   -17.479 1.000 101.106 0 3    BMA   B H3   1 c 1 
HETATM 12550 H  H4   . BMA   B  2  .   ? 15.387  4.488   -17.388 1.000 85.276  0 3    BMA   B H4   1 c 1 
HETATM 12551 H  H5   . BMA   B  2  .   ? 12.565  4.079   -17.231 1.000 88.241  0 3    BMA   B H5   1 c 1 
HETATM 12552 H  H61  . BMA   B  2  .   ? 13.195  2.154   -18.153 1.000 104.053 0 3    BMA   B H61  1 c 1 
HETATM 12553 H  H62  . BMA   B  2  .   ? 13.254  1.795   -16.610 1.000 103.302 0 3    BMA   B H62  1 c 1 
HETATM 12554 H  HO2  . BMA   B  2  .   ? 15.636  5.355   -14.527 0.000 30.000  0 3    BMA   B HO2  1 c 1 
HETATM 12555 H  HO3  . BMA   B  2  .   ? 15.769  7.462   -16.996 0.000 30.000  0 3    BMA   B HO3  1 c 1 
HETATM 12556 H  HO4  . BMA   B  2  .   ? 14.404  5.410   -19.297 0.000 30.000  0 3    BMA   B HO4  1 c 1 
HETATM 12557 H  HO6  . BMA   B  2  .   ? 15.432  1.253   -17.492 0.000 30.000  0 3    BMA   B HO6  1 c 1 
HETATM 12558 S  S    . SCN   C  3  .   ? -18.121 7.756   -32.079 1.000 57.997  0 901  SCN   A S    1 ? 1 
HETATM 12559 C  C    . SCN   C  3  .   ? -16.815 8.628   -32.329 1.000 59.895  0 901  SCN   A C    1 ? 1 
HETATM 12560 N  N    . SCN   C  3  .   ? -15.874 9.280   -32.481 1.000 30.291  0 901  SCN   A N    1 ? 1 
HETATM 12561 S  S    . SCN   D  3  .   ? -19.309 -12.488 -21.771 1.000 75.769  0 902  SCN   A S    1 ? 1 
HETATM 12562 C  C    . SCN   D  3  .   ? -18.291 -11.411 -22.150 1.000 60.215  0 902  SCN   A C    1 ? 1 
HETATM 12563 N  N    . SCN   D  3  .   ? -17.574 -10.593 -22.460 1.000 32.478  0 902  SCN   A N    1 ? 1 
HETATM 12564 S  S    . SCN   E  3  .   ? -4.826  -7.067  -37.569 1.000 83.536  0 903  SCN   A S    1 ? 1 
HETATM 12565 C  C    . SCN   E  3  .   ? -3.704  -7.686  -36.663 1.000 61.168  0 903  SCN   A C    1 ? 1 
HETATM 12566 N  N    . SCN   E  3  .   ? -2.867  -8.161  -36.047 1.000 34.848  0 903  SCN   A N    1 ? 1 
HETATM 12567 ZN ZN   . ZN    F  4  .   ? 7.257   -8.950  15.775  1.000 21.563  0 904  ZN    A ZN   1 ? 1 
HETATM 12568 ZN ZN   . ZN    G  4  .   ? 7.726   -4.769  13.952  1.000 20.260  0 905  ZN    A ZN   1 ? 1 
HETATM 12569 CA CA   . CA    H  5  .   ? 5.464   -3.192  -16.796 1.000 20.974  0 906  CA    A CA   1 ? 1 
HETATM 12570 I  I    . IOD   I  6  .   ? 10.581  -12.342 6.192   1.000 30.295  0 907  IOD   A I    1 ? 1 
HETATM 12571 I  I    . IOD   J  6  .   ? -27.333 5.967   -11.879 1.000 70.797  0 908  IOD   A I    1 ? 1 
HETATM 12572 C  C1   . A1IG1 K  7  .   ? 14.989  0.853   9.603   1.000 28.275  0 909  A1IG1 A C1   1 ? 1 
HETATM 12573 C  C2   . A1IG1 K  7  .   ? 14.727  2.000   11.791  1.000 24.188  0 909  A1IG1 A C2   1 ? 1 
HETATM 12574 C  C3   . A1IG1 K  7  .   ? 13.326  3.666   12.242  1.000 26.805  0 909  A1IG1 A C3   1 ? 1 
HETATM 12575 C  C4   . A1IG1 K  7  .   ? 12.214  4.552   11.908  1.000 34.457  0 909  A1IG1 A C4   1 ? 1 
HETATM 12576 C  C5   . A1IG1 K  7  .   ? 11.761  4.603   10.597  1.000 32.086  0 909  A1IG1 A C5   1 ? 1 
HETATM 12577 N  N5   . A1IG1 K  7  .   ? 20.743  3.103   7.135   1.000 33.943  0 909  A1IG1 A N5   1 ? 1 
HETATM 12578 C  C10  . A1IG1 K  7  .   ? 14.034  3.704   13.391  1.000 32.368  0 909  A1IG1 A C10  1 ? 1 
HETATM 12579 C  C11  . A1IG1 K  7  .   ? 16.295  0.154   11.783  1.000 29.323  0 909  A1IG1 A C11  1 ? 1 
HETATM 12580 C  C6   . A1IG1 K  7  .   ? 10.745  5.471   10.244  1.000 55.940  0 909  A1IG1 A C6   1 ? 1 
HETATM 12581 C  C7   . A1IG1 K  7  .   ? 10.212  6.267   11.221  1.000 57.905  0 909  A1IG1 A C7   1 ? 1 
HETATM 12582 C  C9   . A1IG1 K  7  .   ? 11.643  5.383   12.881  1.000 29.819  0 909  A1IG1 A C9   1 ? 1 
HETATM 12583 N  N1   . A1IG1 K  7  .   ? 15.322  0.960   11.079  1.000 32.611  0 909  A1IG1 A N1   1 ? 1 
HETATM 12584 N  N2   . A1IG1 K  7  .   ? 13.767  2.736   11.303  1.000 19.720  0 909  A1IG1 A N2   1 ? 1 
HETATM 12585 F  F1   . A1IG1 K  7  .   ? 9.217   7.115   10.849  1.000 52.057  0 909  A1IG1 A F1   1 ? 1 
HETATM 12586 C  C8   . A1IG1 K  7  .   ? 10.639  6.265   12.529  1.000 42.311  0 909  A1IG1 A C8   1 ? 1 
HETATM 12587 S  S1   . A1IG1 K  7  .   ? 15.274  2.511   13.362  1.000 45.452  0 909  A1IG1 A S1   1 ? 1 
HETATM 12588 C  C12  . A1IG1 K  7  .   ? 16.207  -0.537  13.018  1.000 27.917  0 909  A1IG1 A C12  1 ? 1 
HETATM 12589 C  C13  . A1IG1 K  7  .   ? 15.144  -1.010  13.947  1.000 25.793  0 909  A1IG1 A C13  1 ? 1 
HETATM 12590 C  C14  . A1IG1 K  7  .   ? 14.562  0.027   14.850  1.000 34.625  0 909  A1IG1 A C14  1 ? 1 
HETATM 12591 C  C15  . A1IG1 K  7  .   ? 15.538  0.629   15.754  1.000 36.870  0 909  A1IG1 A C15  1 ? 1 
HETATM 12592 N  N3   . A1IG1 K  7  .   ? 16.251  1.200   16.437  1.000 18.484  0 909  A1IG1 A N3   1 ? 1 
HETATM 12593 N  N4   . A1IG1 K  7  .   ? 17.441  -1.033  13.359  1.000 32.974  0 909  A1IG1 A N4   1 ? 1 
HETATM 12594 C  C16  . A1IG1 K  7  .   ? 18.297  -0.574  12.444  1.000 47.606  0 909  A1IG1 A C16  1 ? 1 
HETATM 12595 C  C17  . A1IG1 K  7  .   ? 19.684  -0.788  12.328  1.000 65.763  0 909  A1IG1 A C17  1 ? 1 
HETATM 12596 C  C18  . A1IG1 K  7  .   ? 20.325  -0.203  11.277  1.000 65.969  0 909  A1IG1 A C18  1 ? 1 
HETATM 12597 C  C19  . A1IG1 K  7  .   ? 19.620  0.595   10.369  1.000 30.614  0 909  A1IG1 A C19  1 ? 1 
HETATM 12598 C  C20  . A1IG1 K  7  .   ? 20.362  1.162   9.207   1.000 30.554  0 909  A1IG1 A C20  1 ? 1 
HETATM 12599 C  C21  . A1IG1 K  7  .   ? 19.390  1.338   8.036   1.000 26.421  0 909  A1IG1 A C21  1 ? 1 
HETATM 12600 C  C22  . A1IG1 K  7  .   ? 20.119  1.825   6.811   1.000 26.979  0 909  A1IG1 A C22  1 ? 1 
HETATM 12601 S  S2   . A1IG1 K  7  .   ? 21.062  4.006   5.822   1.000 31.559  0 909  A1IG1 A S2   1 ? 1 
HETATM 12602 C  C23  . A1IG1 K  7  .   ? 22.371  3.178   5.006   1.000 26.761  0 909  A1IG1 A C23  1 ? 1 
HETATM 12603 O  O1   . A1IG1 K  7  .   ? 21.474  5.285   6.290   1.000 36.123  0 909  A1IG1 A O1   1 ? 1 
HETATM 12604 O  O2   . A1IG1 K  7  .   ? 19.899  3.933   4.998   1.000 47.871  0 909  A1IG1 A O2   1 ? 1 
HETATM 12605 C  C24  . A1IG1 K  7  .   ? 21.757  2.989   8.183   1.000 25.020  0 909  A1IG1 A C24  1 ? 1 
HETATM 12606 C  C25  . A1IG1 K  7  .   ? 21.130  2.458   9.463   1.000 31.274  0 909  A1IG1 A C25  1 ? 1 
HETATM 12607 N  N6   . A1IG1 K  7  .   ? 18.298  0.800   10.437  1.000 23.974  0 909  A1IG1 A N6   1 ? 1 
HETATM 12608 N  N7   . A1IG1 K  7  .   ? 17.673  0.154   11.486  1.000 31.534  0 909  A1IG1 A N7   1 ? 1 
HETATM 12609 H  H1   . A1IG1 K  7  .   ? 15.532  0.160   9.198   1.000 29.454  0 909  A1IG1 A H1   1 c 1 
HETATM 12610 H  H2   . A1IG1 K  7  .   ? 15.170  1.701   9.167   1.000 29.240  0 909  A1IG1 A H2   1 c 1 
HETATM 12611 H  H3   . A1IG1 K  7  .   ? 14.051  0.631   9.497   1.000 28.720  0 909  A1IG1 A H3   1 c 1 
HETATM 12612 H  H4   . A1IG1 K  7  .   ? 12.155  4.047   9.936   1.000 36.611  0 909  A1IG1 A H4   1 c 1 
HETATM 12613 H  H8   . A1IG1 K  7  .   ? 13.879  4.292   14.103  1.000 32.854  0 909  A1IG1 A H8   1 c 1 
HETATM 12614 H  H5   . A1IG1 K  7  .   ? 10.427  5.511   9.360   1.000 48.503  0 909  A1IG1 A H5   1 c 1 
HETATM 12615 H  H7   . A1IG1 K  7  .   ? 11.967  5.367   13.773  1.000 33.850  0 909  A1IG1 A H7   1 c 1 
HETATM 12616 H  H6   . A1IG1 K  7  .   ? 10.238  6.824   13.170  1.000 41.590  0 909  A1IG1 A H6   1 c 1 
HETATM 12617 H  H9   . A1IG1 K  7  .   ? 15.513  -1.731  14.499  1.000 28.343  0 909  A1IG1 A H9   1 c 1 
HETATM 12618 H  H10  . A1IG1 K  7  .   ? 14.420  -1.396  13.412  1.000 27.638  0 909  A1IG1 A H10  1 c 1 
HETATM 12619 H  H11  . A1IG1 K  7  .   ? 13.851  -0.383  15.390  1.000 32.273  0 909  A1IG1 A H11  1 c 1 
HETATM 12620 H  H12  . A1IG1 K  7  .   ? 14.146  0.735   14.311  1.000 32.327  0 909  A1IG1 A H12  1 c 1 
HETATM 12621 H  H13  . A1IG1 K  7  .   ? 20.149  -1.304  12.960  1.000 60.103  0 909  A1IG1 A H13  1 c 1 
HETATM 12622 H  H14  . A1IG1 K  7  .   ? 21.256  -0.316  11.182  1.000 53.932  0 909  A1IG1 A H14  1 c 1 
HETATM 12623 H  H15  . A1IG1 K  7  .   ? 21.033  0.495   8.914   1.000 30.371  0 909  A1IG1 A H15  1 c 1 
HETATM 12624 H  H16  . A1IG1 K  7  .   ? 18.955  0.481   7.843   1.000 27.020  0 909  A1IG1 A H16  1 c 1 
HETATM 12625 H  H17  . A1IG1 K  7  .   ? 18.696  1.985   8.283   1.000 26.946  0 909  A1IG1 A H17  1 c 1 
HETATM 12626 H  H19  . A1IG1 K  7  .   ? 20.809  1.167   6.544   1.000 28.557  0 909  A1IG1 A H19  1 c 1 
HETATM 12627 H  H18  . A1IG1 K  7  .   ? 19.480  1.931   6.062   1.000 27.998  0 909  A1IG1 A H18  1 c 1 
HETATM 12628 H  H22  . A1IG1 K  7  .   ? 23.110  3.790   4.886   1.000 28.400  0 909  A1IG1 A H22  1 c 1 
HETATM 12629 H  H20  . A1IG1 K  7  .   ? 22.063  2.867   4.144   1.000 27.846  0 909  A1IG1 A H20  1 c 1 
HETATM 12630 H  H21  . A1IG1 K  7  .   ? 22.656  2.425   5.541   1.000 28.157  0 909  A1IG1 A H21  1 c 1 
HETATM 12631 H  H23  . A1IG1 K  7  .   ? 22.162  3.875   8.355   1.000 28.545  0 909  A1IG1 A H23  1 c 1 
HETATM 12632 H  H24  . A1IG1 K  7  .   ? 22.475  2.375   7.887   1.000 28.605  0 909  A1IG1 A H24  1 c 1 
HETATM 12633 H  H26  . A1IG1 K  7  .   ? 20.517  3.126   9.829   1.000 29.293  0 909  A1IG1 A H26  1 c 1 
HETATM 12634 H  H25  . A1IG1 K  7  .   ? 21.831  2.293   10.129  1.000 29.927  0 909  A1IG1 A H25  1 c 1 
HETATM 12635 S  S    . SCN   L  3  .   ? -4.778  21.568  -4.967  1.000 74.259  0 910  SCN   A S    1 ? 1 
HETATM 12636 C  C    . SCN   L  3  .   ? -6.116  20.800  -4.591  1.000 39.932  0 910  SCN   A C    1 ? 1 
HETATM 12637 N  N    . SCN   L  3  .   ? -7.100  20.259  -4.351  1.000 49.664  0 910  SCN   A N    1 ? 1 
HETATM 12638 I  I    . IOD   M  6  .   ? 17.229  -16.022 3.534   1.000 79.571  0 911  IOD   A I    1 ? 1 
HETATM 12639 S  S    . SCN   N  3  .   ? 5.512   -5.827  -8.742  1.000 47.965  0 912  SCN   A S    1 ? 1 
HETATM 12640 C  C    . SCN   N  3  .   ? 4.879   -4.369  -8.484  1.000 55.803  0 912  SCN   A C    1 ? 1 
HETATM 12641 N  N    . SCN   N  3  .   ? 4.434   -3.295  -8.264  1.000 19.176  0 912  SCN   A N    1 ? 1 
HETATM 12642 S  S    . SCN   O  3  .   ? 15.732  24.886  13.803  1.000 59.909  0 913  SCN   A S    1 ? 1 
HETATM 12643 C  C    . SCN   O  3  .   ? 14.796  23.651  14.119  1.000 49.535  0 913  SCN   A C    1 ? 1 
HETATM 12644 N  N    . SCN   O  3  .   ? 14.088  22.765  14.309  1.000 38.540  0 913  SCN   A N    1 ? 1 
HETATM 12645 S  S    . SCN   P  3  .   ? 0.768   14.072  -7.312  1.000 68.879  0 914  SCN   A S    1 ? 1 
HETATM 12646 C  C    . SCN   P  3  .   ? 0.958   15.573  -7.821  1.000 57.908  0 914  SCN   A C    1 ? 1 
HETATM 12647 N  N    . SCN   P  3  .   ? 1.100   16.677  -8.227  1.000 30.062  0 914  SCN   A N    1 ? 1 
HETATM 12648 S  S    . SCN   Q  3  .   ? 20.640  -3.534  18.980  1.000 75.844  0 915  SCN   A S    1 ? 1 
HETATM 12649 C  C    . SCN   Q  3  .   ? 20.267  -2.835  17.610  1.000 82.626  0 915  SCN   A C    1 ? 1 
HETATM 12650 N  N    . SCN   Q  3  .   ? 20.024  -2.302  16.629  1.000 54.527  0 915  SCN   A N    1 ? 1 
HETATM 12651 S  S    . SCN   R  3  .   ? -12.788 2.597   9.681   1.000 71.440  0 916  SCN   A S    1 ? 1 
HETATM 12652 C  C    . SCN   R  3  .   ? -12.376 1.313   10.499  1.000 56.730  0 916  SCN   A C    1 ? 1 
HETATM 12653 N  N    . SCN   R  3  .   ? -12.122 0.365   11.099  1.000 30.346  0 916  SCN   A N    1 ? 1 
HETATM 12654 S  S    . SCN   S  3  .   ? -33.905 -5.932  -32.816 1.000 77.871  0 917  SCN   A S    1 ? 1 
HETATM 12655 C  C    . SCN   S  3  .   ? -35.357 -6.299  -32.301 1.000 67.404  0 917  SCN   A C    1 ? 1 
HETATM 12656 N  N    . SCN   S  3  .   ? -36.421 -6.566  -31.952 1.000 51.072  0 917  SCN   A N    1 ? 1 
HETATM 12657 S  S    . SCN   T  3  .   ? 21.265  4.173   1.283   1.000 68.811  0 918  SCN   A S    1 ? 1 
HETATM 12658 C  C    . SCN   T  3  .   ? 20.603  5.456   0.632   1.000 46.148  0 918  SCN   A C    1 ? 1 
HETATM 12659 N  N    . SCN   T  3  .   ? 20.156  6.423   0.188   1.000 35.195  0 918  SCN   A N    1 ? 1 
HETATM 12660 S  S    . SCN   U  3  .   ? 20.814  -2.806  -7.797  1.000 59.912  0 919  SCN   A S    1 ? 1 
HETATM 12661 C  C    . SCN   U  3  .   ? 19.465  -2.197  -8.386  1.000 62.733  0 919  SCN   A C    1 ? 1 
HETATM 12662 N  N    . SCN   U  3  .   ? 18.489  -1.781  -8.851  1.000 42.231  0 919  SCN   A N    1 ? 1 
HETATM 12663 S  S    . SCN   V  3  .   ? -17.746 -3.796  -3.859  1.000 74.999  0 920  SCN   A S    1 ? 1 
HETATM 12664 C  C    . SCN   V  3  .   ? -18.721 -3.042  -4.833  1.000 40.944  0 920  SCN   A C    1 ? 1 
HETATM 12665 N  N    . SCN   V  3  .   ? -19.461 -2.480  -5.485  1.000 31.787  0 920  SCN   A N    1 ? 1 
HETATM 12666 S  S    . SCN   W  3  .   ? -17.755 -9.581  -41.757 1.000 88.562  0 921  SCN   A S    1 ? 1 
HETATM 12667 C  C    . SCN   W  3  .   ? -16.412 -8.892  -41.347 1.000 48.863  0 921  SCN   A C    1 ? 1 
HETATM 12668 N  N    . SCN   W  3  .   ? -15.451 -8.347  -41.088 1.000 38.436  0 921  SCN   A N    1 ? 1 
HETATM 12669 S  S    . SCN   X  3  .   ? 27.480  2.331   6.070   1.000 84.937  0 922  SCN   A S    1 ? 1 
HETATM 12670 C  C    . SCN   X  3  .   ? 27.898  0.907   5.559   1.000 47.130  0 922  SCN   A C    1 ? 1 
HETATM 12671 N  N    . SCN   X  3  .   ? 28.230  -0.117  5.147   1.000 43.348  0 922  SCN   A N    1 ? 1 
HETATM 12672 S  S    . SCN   Y  3  .   ? 16.744  14.943  -1.215  1.000 55.272  0 923  SCN   A S    1 ? 1 
HETATM 12673 C  C    . SCN   Y  3  .   ? 16.018  14.927  -2.612  1.000 61.887  0 923  SCN   A C    1 ? 1 
HETATM 12674 N  N    . SCN   Y  3  .   ? 15.449  14.926  -3.605  1.000 39.090  0 923  SCN   A N    1 ? 1 
HETATM 12675 S  S    . SCN   Z  3  .   ? -20.330 13.302  -10.436 1.000 90.808  0 924  SCN   A S    1 ? 1 
HETATM 12676 C  C    . SCN   Z  3  .   ? -21.850 12.911  -10.521 1.000 76.758  0 924  SCN   A C    1 ? 1 
HETATM 12677 N  N    . SCN   Z  3  .   ? -22.968 12.647  -10.557 1.000 34.038  0 924  SCN   A N    1 ? 1 
HETATM 12678 S  S    . SCN   AA 3  .   ? -7.695  20.490  3.774   1.000 66.323  0 925  SCN   A S    1 ? 1 
HETATM 12679 C  C    . SCN   AA 3  .   ? -6.331  21.054  4.355   1.000 65.822  0 925  SCN   A C    1 ? 1 
HETATM 12680 N  N    . SCN   AA 3  .   ? -5.312  21.466  4.736   1.000 35.400  0 925  SCN   A N    1 ? 1 
HETATM 12681 S  S    . SCN   BA 3  .   ? -8.229  23.546  10.177  1.000 79.028  0 926  SCN   A S    1 ? 1 
HETATM 12682 C  C    . SCN   BA 3  .   ? -8.130  22.813  11.578  1.000 67.738  0 926  SCN   A C    1 ? 1 
HETATM 12683 N  N    . SCN   BA 3  .   ? -8.054  22.229  12.567  1.000 30.633  0 926  SCN   A N    1 ? 1 
HETATM 12684 S  S    . SCN   CA 3  .   ? 16.542  18.924  31.430  1.000 65.862  0 927  SCN   A S    1 ? 1 
HETATM 12685 C  C    . SCN   CA 3  .   ? 16.054  17.842  30.389  1.000 51.240  0 927  SCN   A C    1 ? 1 
HETATM 12686 N  N    . SCN   CA 3  .   ? 15.647  17.104  29.606  1.000 40.440  0 927  SCN   A N    1 ? 1 
HETATM 12687 S  S    . SCN   DA 3  .   ? 23.682  14.549  23.521  1.000 75.107  0 928  SCN   A S    1 ? 1 
HETATM 12688 C  C    . SCN   DA 3  .   ? 23.281  14.544  25.043  1.000 63.146  0 928  SCN   A C    1 ? 1 
HETATM 12689 N  N    . SCN   DA 3  .   ? 23.026  14.576  26.158  1.000 45.902  0 928  SCN   A N    1 ? 1 
HETATM 12690 S  S    . SCN   EA 3  .   ? 12.014  6.718   39.778  1.000 71.843  0 929  SCN   A S    1 ? 1 
HETATM 12691 C  C    . SCN   EA 3  .   ? 11.162  6.106   40.945  1.000 61.595  0 929  SCN   A C    1 ? 1 
HETATM 12692 N  N    . SCN   EA 3  .   ? 10.533  5.765   41.824  1.000 54.338  0 929  SCN   A N    1 ? 1 
HETATM 12693 S  S    . SCN   FA 3  .   ? 7.227   11.000  34.781  1.000 67.501  0 930  SCN   A S    1 ? 1 
HETATM 12694 C  C    . SCN   FA 3  .   ? 7.009   9.544   34.221  1.000 68.817  0 930  SCN   A C    1 ? 1 
HETATM 12695 N  N    . SCN   FA 3  .   ? 6.892   8.467   33.842  1.000 41.690  0 930  SCN   A N    1 ? 1 
HETATM 12696 S  S    . SCN   GA 3  .   ? 15.405  -24.057 4.867   1.000 72.966  0 931  SCN   A S    1 ? 1 
HETATM 12697 C  C    . SCN   GA 3  .   ? 14.209  -23.840 5.861   1.000 66.158  0 931  SCN   A C    1 ? 1 
HETATM 12698 N  N    . SCN   GA 3  .   ? 13.320  -23.613 6.562   1.000 43.183  0 931  SCN   A N    1 ? 1 
HETATM 12699 S  S    . SCN   HA 3  .   ? -8.341  -20.844 11.248  1.000 76.444  0 932  SCN   A S    1 ? 1 
HETATM 12700 C  C    . SCN   HA 3  .   ? -8.009  -19.428 10.613  1.000 62.733  0 932  SCN   A C    1 ? 1 
HETATM 12701 N  N    . SCN   HA 3  .   ? -7.795  -18.393 10.133  1.000 41.778  0 932  SCN   A N    1 ? 1 
HETATM 12702 S  S    . SCN   IA 3  .   ? -7.909  2.955   2.319   1.000 84.941  0 933  SCN   A S    1 ? 1 
HETATM 12703 C  C    . SCN   IA 3  .   ? -8.862  1.888   2.980   1.000 70.889  0 933  SCN   A C    1 ? 1 
HETATM 12704 N  N    . SCN   IA 3  .   ? -9.540  1.082   3.436   1.000 50.340  0 933  SCN   A N    1 ? 1 
HETATM 12705 S  S    . SCN   JA 3  .   ? -0.865  -13.909 -17.385 1.000 92.026  0 934  SCN   A S    1 ? 1 
HETATM 12706 C  C    . SCN   JA 3  .   ? -1.100  -13.665 -18.934 1.000 60.638  0 934  SCN   A C    1 ? 1 
HETATM 12707 N  N    . SCN   JA 3  .   ? -1.250  -13.512 -20.064 1.000 49.886  0 934  SCN   A N    1 ? 1 
HETATM 12708 S  S    . SCN   KA 3  .   ? -10.353 -27.462 -8.876  1.000 64.974  0 935  SCN   A S    1 ? 1 
HETATM 12709 C  C    . SCN   KA 3  .   ? -11.697 -27.164 -8.078  1.000 56.179  0 935  SCN   A C    1 ? 1 
HETATM 12710 N  N    . SCN   KA 3  .   ? -12.710 -26.950 -7.531  1.000 31.675  0 935  SCN   A N    1 ? 1 
HETATM 12711 S  S    . SCN   LA 3  .   ? -30.132 2.161   -0.959  1.000 87.702  0 936  SCN   A S    1 ? 1 
HETATM 12712 C  C    . SCN   LA 3  .   ? -30.043 1.465   -2.375  1.000 72.046  0 936  SCN   A C    1 ? 1 
HETATM 12713 N  N    . SCN   LA 3  .   ? -29.933 0.967   -3.412  1.000 50.267  0 936  SCN   A N    1 ? 1 
HETATM 12714 S  S    . SCN   MA 3  .   ? -16.035 4.754   0.388   1.000 75.828  0 937  SCN   A S    1 ? 1 
HETATM 12715 C  C    . SCN   MA 3  .   ? -15.068 4.899   -0.846  1.000 49.010  0 937  SCN   A C    1 ? 1 
HETATM 12716 N  N    . SCN   MA 3  .   ? -14.339 4.968   -1.732  1.000 26.754  0 937  SCN   A N    1 ? 1 
HETATM 12717 S  S    . SCN   NA 3  .   ? 24.682  20.815  44.215  1.000 74.131  0 938  SCN   A S    1 ? 1 
HETATM 12718 C  C    . SCN   NA 3  .   ? 23.392  21.457  43.630  1.000 62.350  0 938  SCN   A C    1 ? 1 
HETATM 12719 N  N    . SCN   NA 3  .   ? 22.476  21.983  43.229  1.000 51.680  0 938  SCN   A N    1 ? 1 
HETATM 12720 C  C1   . GOL   OA 8  .   ? 1.651   14.190  1.481   1.000 52.988  0 939  GOL   A C1   1 ? 1 
HETATM 12721 O  O1   . GOL   OA 8  .   ? 1.134   13.536  0.327   1.000 32.928  0 939  GOL   A O1   1 ? 1 
HETATM 12722 C  C2   . GOL   OA 8  .   ? 0.609   15.069  2.142   1.000 48.005  0 939  GOL   A C2   1 ? 1 
HETATM 12723 O  O2   . GOL   OA 8  .   ? -0.179  15.737  1.163   1.000 42.465  0 939  GOL   A O2   1 ? 1 
HETATM 12724 C  C3   . GOL   OA 8  .   ? 1.197   16.080  3.103   1.000 38.752  0 939  GOL   A C3   1 ? 1 
HETATM 12725 O  O3   . GOL   OA 8  .   ? 0.461   17.295  3.073   1.000 80.589  0 939  GOL   A O3   1 ? 1 
HETATM 12726 H  H11  . GOL   OA 8  .   ? 2.425   14.742  1.226   1.000 45.325  0 939  GOL   A H11  1 c 1 
HETATM 12727 H  H12  . GOL   OA 8  .   ? 1.957   13.510  2.129   1.000 45.715  0 939  GOL   A H12  1 c 1 
HETATM 12728 H  HO1  . GOL   OA 8  .   ? 1.754   13.051  -0.005  0.000 25.200  0 939  GOL   A HO1  1 c 1 
HETATM 12729 H  H2   . GOL   OA 8  .   ? 0.013   14.484  2.659   1.000 44.887  0 939  GOL   A H2   1 c 1 
HETATM 12730 H  HO2  . GOL   OA 8  .   ? -0.143  16.562  1.329   0.000 35.090  0 939  GOL   A HO2  1 c 1 
HETATM 12731 H  H31  . GOL   OA 8  .   ? 2.134   16.256  2.864   1.000 48.194  0 939  GOL   A H31  1 c 1 
HETATM 12732 H  H32  . GOL   OA 8  .   ? 1.175   15.711  4.018   1.000 48.004  0 939  GOL   A H32  1 c 1 
HETATM 12733 H  HO3  . GOL   OA 8  .   ? 0.499   17.610  2.281   1.000 63.615  0 939  GOL   A HO3  1 c 1 
HETATM 12734 S  S    . SCN   PA 3  .   ? -29.188 1.145   -19.426 1.000 87.673  0 940  SCN   A S    1 ? 1 
HETATM 12735 C  C    . SCN   PA 3  .   ? -27.962 0.828   -20.298 1.000 59.603  0 940  SCN   A C    1 ? 1 
HETATM 12736 N  N    . SCN   PA 3  .   ? -27.054 0.636   -20.928 1.000 56.514  0 940  SCN   A N    1 ? 1 
HETATM 12737 S  S    . SCN   QA 3  .   ? -15.675 -19.948 -21.066 1.000 79.846  0 941  SCN   A S    1 ? 1 
HETATM 12738 C  C    . SCN   QA 3  .   ? -15.611 -21.440 -20.555 1.000 71.526  0 941  SCN   A C    1 ? 1 
HETATM 12739 N  N    . SCN   QA 3  .   ? -15.623 -22.528 -20.178 1.000 58.609  0 941  SCN   A N    1 ? 1 
HETATM 12740 S  S    . SCN   RA 3  .   ? -16.031 -15.322 -34.509 1.000 73.053  0 942  SCN   A S    1 ? 1 
HETATM 12741 C  C    . SCN   RA 3  .   ? -16.870 -14.159 -35.149 1.000 52.659  0 942  SCN   A C    1 ? 1 
HETATM 12742 N  N    . SCN   RA 3  .   ? -17.461 -13.277 -35.588 1.000 37.746  0 942  SCN   A N    1 ? 1 
HETATM 12743 S  S    . SCN   SA 3  .   ? -16.948 -20.293 -24.585 1.000 86.015  0 943  SCN   A S    1 ? 1 
HETATM 12744 C  C    . SCN   SA 3  .   ? -15.461 -19.881 -24.647 1.000 32.814  0 943  SCN   A C    1 ? 1 
HETATM 12745 N  N    . SCN   SA 3  .   ? -14.386 -19.483 -24.659 1.000 70.303  0 943  SCN   A N    1 ? 1 
HETATM 12746 S  S    . SCN   TA 3  .   ? -10.807 -5.506  17.998  1.000 71.940  0 944  SCN   A S    1 ? 1 
HETATM 12747 C  C    . SCN   TA 3  .   ? -10.129 -5.301  16.580  1.000 48.111  0 944  SCN   A C    1 ? 1 
HETATM 12748 N  N    . SCN   TA 3  .   ? -9.591  -5.180  15.561  1.000 47.197  0 944  SCN   A N    1 ? 1 
HETATM 12749 S  S    . SCN   UA 3  .   ? -9.872  -2.995  8.139   1.000 75.413  0 945  SCN   A S    1 ? 1 
HETATM 12750 C  C    . SCN   UA 3  .   ? -8.837  -3.417  7.016   1.000 60.484  0 945  SCN   A C    1 ? 1 
HETATM 12751 N  N    . SCN   UA 3  .   ? -8.116  -3.699  6.166   1.000 40.910  0 945  SCN   A N    1 ? 1 
HETATM 12752 S  S    . SCN   VA 3  .   ? 17.815  -1.497  -3.334  1.000 85.729  0 946  SCN   A S    1 ? 1 
HETATM 12753 C  C    . SCN   VA 3  .   ? 19.283  -1.890  -2.942  1.000 40.620  0 946  SCN   A C    1 ? 1 
HETATM 12754 N  N    . SCN   VA 3  .   ? 20.363  -2.208  -2.710  1.000 38.976  0 946  SCN   A N    1 ? 1 
HETATM 12755 P  P    . PO4   WA 9  .   ? 9.555   -8.671  13.872  1.000 84.965  0 947  PO4   A P    1 ? 1 
HETATM 12756 O  O1   . PO4   WA 9  .   ? 9.282   -8.462  12.355  1.000 26.986  0 947  PO4   A O1   1 ? 1 
HETATM 12757 O  O2   . PO4   WA 9  .   ? 9.021   -9.999  14.386  1.000 45.802  0 947  PO4   A O2   1 ? 1 
HETATM 12758 O  O3   . PO4   WA 9  .   ? 11.055  -8.626  14.114  1.000 119.239 0 947  PO4   A O3   1 ? 1 
HETATM 12759 O  O4   . PO4   WA 9  .   ? 8.878   -7.566  14.630  1.000 44.317  0 947  PO4   A O4   1 ? 1 
HETATM 12760 S  S    . SCN   XA 3  .   ? -1.100  12.645  -29.831 1.000 84.622  0 948  SCN   A S    1 ? 1 
HETATM 12761 C  C    . SCN   XA 3  .   ? -0.841  14.191  -29.604 1.000 57.931  0 948  SCN   A C    1 ? 1 
HETATM 12762 N  N    . SCN   XA 3  .   ? -0.607  15.304  -29.443 1.000 49.104  0 948  SCN   A N    1 ? 1 
HETATM 12763 C  C1   . GOL   YA 8  .   ? -4.714  -14.010 4.887   1.000 35.861  0 949  GOL   A C1   1 ? 1 
HETATM 12764 O  O1   . GOL   YA 8  .   ? -5.758  -14.600 5.663   1.000 27.733  0 949  GOL   A O1   1 ? 1 
HETATM 12765 C  C2   . GOL   YA 8  .   ? -4.511  -14.759 3.586   1.000 41.909  0 949  GOL   A C2   1 ? 1 
HETATM 12766 O  O2   . GOL   YA 8  .   ? -5.761  -15.277 3.149   1.000 52.425  0 949  GOL   A O2   1 ? 1 
HETATM 12767 C  C3   . GOL   YA 8  .   ? -3.918  -13.914 2.481   1.000 44.596  0 949  GOL   A C3   1 ? 1 
HETATM 12768 O  O3   . GOL   YA 8  .   ? -4.879  -13.009 1.947   1.000 37.061  0 949  GOL   A O3   1 ? 1 
HETATM 12769 H  H11  . GOL   YA 8  .   ? -3.873  -14.023 5.406   1.000 34.698  0 949  GOL   A H11  1 c 1 
HETATM 12770 H  H12  . GOL   YA 8  .   ? -4.944  -13.069 4.690   1.000 34.444  0 949  GOL   A H12  1 c 1 
HETATM 12771 H  HO1  . GOL   YA 8  .   ? -5.836  -14.160 6.371   0.000 20.340  0 949  GOL   A HO1  1 c 1 
HETATM 12772 H  H2   . GOL   YA 8  .   ? -3.902  -15.516 3.757   1.000 42.620  0 949  GOL   A H2   1 c 1 
HETATM 12773 H  HO2  . GOL   YA 8  .   ? -5.901  -14.982 2.355   0.000 42.960  0 949  GOL   A HO2  1 c 1 
HETATM 12774 H  H31  . GOL   YA 8  .   ? -3.589  -14.505 1.760   1.000 42.024  0 949  GOL   A H31  1 c 1 
HETATM 12775 H  H32  . GOL   YA 8  .   ? -3.153  -13.406 2.838   1.000 41.329  0 949  GOL   A H32  1 c 1 
HETATM 12776 H  HO3  . GOL   YA 8  .   ? -5.506  -13.461 1.599   1.000 39.331  0 949  GOL   A HO3  1 c 1 
HETATM 12777 C  C1   . GOL   ZA 8  .   ? -1.870  -19.691 -8.873  1.000 45.972  0 950  GOL   A C1   1 ? 1 
HETATM 12778 O  O1   . GOL   ZA 8  .   ? -1.878  -18.455 -8.183  1.000 46.638  0 950  GOL   A O1   1 ? 1 
HETATM 12779 C  C2   . GOL   ZA 8  .   ? -1.374  -20.796 -7.973  1.000 49.364  0 950  GOL   A C2   1 ? 1 
HETATM 12780 O  O2   . GOL   ZA 8  .   ? -2.237  -20.965 -6.842  1.000 29.077  0 950  GOL   A O2   1 ? 1 
HETATM 12781 C  C3   . GOL   ZA 8  .   ? -1.179  -22.096 -8.724  1.000 39.369  0 950  GOL   A C3   1 ? 1 
HETATM 12782 O  O3   . GOL   ZA 8  .   ? -2.350  -22.892 -8.717  1.000 63.494  0 950  GOL   A O3   1 ? 1 
HETATM 12783 H  H11  . GOL   ZA 8  .   ? -1.284  -19.622 -9.665  1.000 46.896  0 950  GOL   A H11  1 c 1 
HETATM 12784 H  H12  . GOL   ZA 8  .   ? -2.786  -19.904 -9.179  1.000 47.012  0 950  GOL   A H12  1 c 1 
HETATM 12785 H  HO1  . GOL   ZA 8  .   ? -2.178  -17.849 -8.736  0.000 39.920  0 950  GOL   A HO1  1 c 1 
HETATM 12786 H  H2   . GOL   ZA 8  .   ? -0.490  -20.521 -7.637  1.000 41.414  0 950  GOL   A H2   1 c 1 
HETATM 12787 H  HO2  . GOL   ZA 8  .   ? -2.462  -21.771 -6.826  0.000 20.770  0 950  GOL   A HO2  1 c 1 
HETATM 12788 H  H31  . GOL   ZA 8  .   ? -0.443  -22.602 -8.305  1.000 46.347  0 950  GOL   A H31  1 c 1 
HETATM 12789 H  H32  . GOL   ZA 8  .   ? -0.926  -21.898 -9.658  1.000 46.362  0 950  GOL   A H32  1 c 1 
HETATM 12790 H  HO3  . GOL   ZA 8  .   ? -2.948  -22.501 -8.263  1.000 54.280  0 950  GOL   A HO3  1 c 1 
HETATM 12791 I  I    . IOD   AB 6  .   ? 6.708   28.277  10.031  1.000 67.292  0 951  IOD   A I    1 ? ? 
HETATM 12792 I  I    . IOD   BB 6  .   ? 22.739  -3.651  22.641  1.000 93.349  0 952  IOD   A I    1 ? ? 
HETATM 12793 I  I    . IOD   CB 6  .   ? 8.346   2.274   25.473  1.000 90.851  0 953  IOD   A I    1 ? ? 
HETATM 12794 I  I    . IOD   DB 6  .   ? -32.583 -14.774 -31.184 1.000 105.107 0 954  IOD   A I    1 ? ? 
HETATM 12795 S  S    . SCN   EB 3  .   ? -3.829  31.348  11.958  1.000 70.931  0 955  SCN   A S    1 ? ? 
HETATM 12796 C  C    . SCN   EB 3  .   ? -2.899  30.461  11.013  1.000 65.046  0 955  SCN   A C    1 ? ? 
HETATM 12797 N  N    . SCN   EB 3  .   ? -2.184  29.785  10.381  1.000 35.355  0 955  SCN   A N    1 ? ? 
HETATM 12798 O  O    . HOH   FB 10 .   ? -8.735  -10.731 8.120   1.000 31.834  0 5601 HOH   A O    1 ? 1 
HETATM 12799 O  O    . HOH   FB 10 .   ? -9.435  -19.419 -30.118 1.000 27.998  0 5602 HOH   A O    1 ? ? 
HETATM 12800 O  O    . HOH   FB 10 .   ? 28.774  -2.309  1.357   1.000 23.727  0 5603 HOH   A O    1 ? ? 
HETATM 12801 O  O    . HOH   FB 10 .   ? -14.381 12.176  -3.180  1.000 10.228  0 5604 HOH   A O    1 ? ? 
HETATM 12802 O  O    . HOH   FB 10 .   ? -2.515  9.377   -13.208 1.000 32.365  0 5605 HOH   A O    1 ? ? 
HETATM 12803 O  O    . HOH   FB 10 .   ? -25.929 13.424  -16.246 1.000 57.423  0 5606 HOH   A O    1 ? ? 
HETATM 12804 O  O    . HOH   FB 10 .   ? -8.364  13.261  16.451  1.000 29.259  0 5607 HOH   A O    1 ? 1 
HETATM 12805 O  O    . HOH   FB 10 .   ? -0.216  0.739   -2.579  1.000 20.583  0 5608 HOH   A O    1 ? 1 
HETATM 12806 O  O    . HOH   FB 10 .   ? -30.306 -5.413  -20.828 1.000 32.326  0 5609 HOH   A O    1 ? ? 
HETATM 12807 O  O    . HOH   FB 10 .   ? -16.238 6.601   -46.746 1.000 43.280  0 5610 HOH   A O    1 ? ? 
HETATM 12808 O  O    . HOH   FB 10 .   ? -3.075  2.621   -21.674 1.000 35.691  0 5611 HOH   A O    1 ? ? 
HETATM 12809 O  O    . HOH   FB 10 .   ? -3.545  27.828  10.923  1.000 62.266  0 5612 HOH   A O    1 ? ? 
HETATM 12810 O  O    . HOH   FB 10 .   ? -11.905 16.091  -10.409 1.000 26.470  0 5613 HOH   A O    1 ? ? 
HETATM 12811 O  O    . HOH   FB 10 .   ? 42.666  6.699   15.349  1.000 41.637  0 5614 HOH   A O    1 ? ? 
HETATM 12812 O  O    . HOH   FB 10 .   ? 7.493   18.970  0.301   1.000 39.854  0 5615 HOH   A O    1 ? ? 
HETATM 12813 O  O    . HOH   FB 10 .   ? 0.816   20.630  23.456  1.000 26.221  0 5616 HOH   A O    1 ? ? 
HETATM 12814 O  O    . HOH   FB 10 .   ? -9.917  -0.067  15.665  1.000 42.065  0 5617 HOH   A O    1 ? ? 
HETATM 12815 O  O    . HOH   FB 10 .   ? 12.060  -21.438 -8.334  1.000 38.081  0 5618 HOH   A O    1 ? ? 
HETATM 12816 O  O    . HOH   FB 10 .   ? 24.653  5.869   15.810  1.000 43.039  0 5619 HOH   A O    1 ? ? 
HETATM 12817 O  O    . HOH   FB 10 .   ? -9.111  3.874   -5.026  1.000 15.636  0 5620 HOH   A O    1 ? ? 
HETATM 12818 O  O    . HOH   FB 10 .   ? 10.260  11.646  34.624  1.000 33.595  0 5621 HOH   A O    1 ? ? 
HETATM 12819 O  O    . HOH   FB 10 .   ? -17.033 -3.965  -17.807 1.000 19.071  0 5622 HOH   A O    1 ? ? 
HETATM 12820 O  O    . HOH   FB 10 .   ? -2.579  -1.850  -0.907  1.000 40.681  0 5623 HOH   A O    1 ? ? 
HETATM 12821 O  O    . HOH   FB 10 .   ? 8.688   -15.564 -2.972  1.000 23.924  0 5624 HOH   A O    1 ? 1 
HETATM 12822 O  O    . HOH   FB 10 .   ? -0.109  -20.614 13.556  1.000 67.512  0 5625 HOH   A O    1 ? ? 
HETATM 12823 O  O    . HOH   FB 10 .   ? -0.719  17.349  36.604  1.000 31.402  0 5626 HOH   A O    1 ? ? 
HETATM 12824 O  O    . HOH   FB 10 .   ? -8.886  9.231   -22.921 1.000 31.938  0 5627 HOH   A O    1 ? ? 
HETATM 12825 O  O    . HOH   FB 10 .   ? -3.278  12.307  -10.836 1.000 30.842  0 5628 HOH   A O    1 ? ? 
HETATM 12826 O  O    . HOH   FB 10 .   ? -13.595 18.362  -2.466  1.000 37.798  0 5629 HOH   A O    1 ? ? 
HETATM 12827 O  O    . HOH   FB 10 .   ? 31.153  7.705   17.690  1.000 50.077  0 5630 HOH   A O    1 ? ? 
HETATM 12828 O  O    . HOH   FB 10 .   ? 7.719   -0.530  -6.924  1.000 23.695  0 5631 HOH   A O    1 ? 1 
HETATM 12829 O  O    . HOH   FB 10 .   ? 5.242   10.671  -4.223  1.000 27.446  0 5632 HOH   A O    1 ? 1 
HETATM 12830 O  O    . HOH   FB 10 .   ? 4.746   -4.802  -0.641  1.000 26.795  0 5633 HOH   A O    1 ? ? 
HETATM 12831 O  O    . HOH   FB 10 .   ? 16.040  -12.987 10.388  1.000 35.572  0 5634 HOH   A O    1 ? ? 
HETATM 12832 O  O    . HOH   FB 10 .   ? 39.974  10.891  23.616  1.000 52.268  0 5635 HOH   A O    1 ? ? 
HETATM 12833 O  O    . HOH   FB 10 .   ? 20.669  11.022  27.853  1.000 27.692  0 5636 HOH   A O    1 ? ? 
HETATM 12834 O  O    . HOH   FB 10 .   ? -21.228 -7.007  -2.533  1.000 39.404  0 5637 HOH   A O    1 ? ? 
HETATM 12835 O  O    . HOH   FB 10 .   ? -2.883  -14.913 -9.769  1.000 26.503  0 5638 HOH   A O    1 ? ? 
HETATM 12836 O  O    . HOH   FB 10 .   ? -8.305  -21.052 -20.394 1.000 25.133  0 5639 HOH   A O    1 ? ? 
HETATM 12837 O  O    . HOH   FB 10 .   ? 0.247   6.402   -3.477  1.000 14.079  0 5640 HOH   A O    1 ? 1 
HETATM 12838 O  O    . HOH   FB 10 .   ? -15.009 0.340   -27.945 1.000 23.590  0 5641 HOH   A O    1 ? ? 
HETATM 12839 O  O    . HOH   FB 10 .   ? 32.457  12.951  17.332  1.000 59.265  0 5642 HOH   A O    1 ? ? 
HETATM 12840 O  O    . HOH   FB 10 .   ? 0.665   6.634   31.521  1.000 36.038  0 5643 HOH   A O    1 ? ? 
HETATM 12841 O  O    . HOH   FB 10 .   ? 1.836   14.903  -18.273 1.000 40.044  0 5644 HOH   A O    1 ? ? 
HETATM 12842 O  O    . HOH   FB 10 .   ? -24.779 1.216   -19.849 1.000 37.975  0 5645 HOH   A O    1 ? ? 
HETATM 12843 O  O    . HOH   FB 10 .   ? -2.299  3.023   -26.789 1.000 35.526  0 5646 HOH   A O    1 ? ? 
HETATM 12844 O  O    . HOH   FB 10 .   ? -4.404  -28.116 6.512   1.000 45.547  0 5647 HOH   A O    1 ? ? 
HETATM 12845 O  O    . HOH   FB 10 .   ? 10.666  -11.993 14.570  1.000 48.263  0 5648 HOH   A O    1 ? ? 
HETATM 12846 O  O    . HOH   FB 10 .   ? -20.974 9.034   -8.812  1.000 26.538  0 5649 HOH   A O    1 ? ? 
HETATM 12847 O  O    . HOH   FB 10 .   ? -0.082  21.746  27.957  1.000 42.121  0 5650 HOH   A O    1 ? ? 
HETATM 12848 O  O    . HOH   FB 10 .   ? 8.415   -1.717  -9.707  1.000 31.692  0 5651 HOH   A O    1 ? ? 
HETATM 12849 O  O    . HOH   FB 10 .   ? -24.407 -13.792 -35.130 1.000 32.298  0 5652 HOH   A O    1 ? ? 
HETATM 12850 O  O    . HOH   FB 10 .   ? 5.654   -34.110 7.665   1.000 38.392  0 5653 HOH   A O    1 ? ? 
HETATM 12851 O  O    . HOH   FB 10 .   ? -28.401 2.054   -16.759 1.000 37.803  0 5654 HOH   A O    1 ? ? 
HETATM 12852 O  O    . HOH   FB 10 .   ? 23.814  8.632   31.855  1.000 38.022  0 5655 HOH   A O    1 ? ? 
HETATM 12853 O  O    . HOH   FB 10 .   ? 0.234   -2.611  -0.632  1.000 21.740  0 5656 HOH   A O    1 ? ? 
HETATM 12854 O  O    . HOH   FB 10 .   ? -31.576 1.946   -26.238 1.000 32.727  0 5657 HOH   A O    1 ? ? 
HETATM 12855 O  O    . HOH   FB 10 .   ? -24.784 -18.800 -10.983 1.000 53.251  0 5658 HOH   A O    1 ? ? 
HETATM 12856 O  O    . HOH   FB 10 .   ? -2.664  -23.225 -17.573 1.000 49.479  0 5659 HOH   A O    1 ? ? 
HETATM 12857 O  O    . HOH   FB 10 .   ? -2.659  -16.876 20.365  1.000 38.391  0 5660 HOH   A O    1 ? ? 
HETATM 12858 O  O    . HOH   FB 10 .   ? 16.801  -6.970  15.019  1.000 49.121  0 5661 HOH   A O    1 ? ? 
HETATM 12859 O  O    . HOH   FB 10 .   ? -19.624 -12.663 -30.248 1.000 33.135  0 5662 HOH   A O    1 ? ? 
HETATM 12860 O  O    . HOH   FB 10 .   ? 1.753   10.984  0.452   1.000 16.305  0 5663 HOH   A O    1 ? ? 
HETATM 12861 O  O    . HOH   FB 10 .   ? 6.997   -4.500  -2.015  1.000 23.302  0 5664 HOH   A O    1 ? ? 
HETATM 12862 O  O    . HOH   FB 10 .   ? 14.387  -10.319 16.165  1.000 46.862  0 5665 HOH   A O    1 ? ? 
HETATM 12863 O  O    . HOH   FB 10 .   ? 21.556  15.227  9.800   1.000 35.672  0 5666 HOH   A O    1 ? ? 
HETATM 12864 O  O    . HOH   FB 10 .   ? 24.039  5.259   37.706  1.000 39.798  0 5667 HOH   A O    1 ? ? 
HETATM 12865 O  O    . HOH   FB 10 .   ? -15.378 -0.686  -25.255 1.000 20.273  0 5668 HOH   A O    1 ? ? 
HETATM 12866 O  O    . HOH   FB 10 .   ? 3.058   4.002   -15.698 1.000 34.040  0 5669 HOH   A O    1 ? ? 
HETATM 12867 O  O    . HOH   FB 10 .   ? 16.480  -14.318 -3.037  1.000 32.837  0 5670 HOH   A O    1 ? ? 
HETATM 12868 O  O    . HOH   FB 10 .   ? -4.446  5.150   14.175  1.000 29.904  0 5671 HOH   A O    1 ? ? 
HETATM 12869 O  O    . HOH   FB 10 .   ? -2.868  22.510  15.199  1.000 36.489  0 5672 HOH   A O    1 ? ? 
HETATM 12870 O  O    . HOH   FB 10 .   ? -8.431  -2.361  12.280  1.000 39.925  0 5673 HOH   A O    1 ? 1 
HETATM 12871 O  O    . HOH   FB 10 .   ? -2.913  -4.745  0.089   1.000 22.747  0 5674 HOH   A O    1 ? ? 
HETATM 12872 O  O    . HOH   FB 10 .   ? -9.190  18.801  -29.726 1.000 64.611  0 5675 HOH   A O    1 ? ? 
HETATM 12873 O  O    . HOH   FB 10 .   ? 18.923  23.986  14.076  1.000 40.665  0 5676 HOH   A O    1 ? ? 
HETATM 12874 O  O    . HOH   FB 10 .   ? 19.379  25.015  36.583  1.000 32.446  0 5677 HOH   A O    1 ? ? 
HETATM 12875 O  O    . HOH   FB 10 .   ? -4.352  9.887   -30.368 1.000 31.239  0 5678 HOH   A O    1 ? ? 
HETATM 12876 O  O    . HOH   FB 10 .   ? -14.125 -3.234  3.279   1.000 40.769  0 5679 HOH   A O    1 ? ? 
HETATM 12877 O  O    . HOH   FB 10 .   ? 13.467  7.396   -3.283  1.000 21.476  0 5680 HOH   A O    1 ? 1 
HETATM 12878 O  O    . HOH   FB 10 .   ? -24.820 -7.600  -14.320 1.000 23.810  0 5681 HOH   A O    1 ? ? 
HETATM 12879 O  O    . HOH   FB 10 .   ? -13.259 -1.721  -37.375 1.000 36.019  0 5682 HOH   A O    1 ? ? 
HETATM 12880 O  O    . HOH   FB 10 .   ? 7.302   13.119  33.048  1.000 25.353  0 5683 HOH   A O    1 ? ? 
HETATM 12881 O  O    . HOH   FB 10 .   ? 3.331   -7.148  -9.651  1.000 30.021  0 5684 HOH   A O    1 ? ? 
HETATM 12882 O  O    . HOH   FB 10 .   ? -16.731 1.045   -1.960  1.000 53.111  0 5685 HOH   A O    1 ? ? 
HETATM 12883 O  O    . HOH   FB 10 .   ? -10.605 -1.094  -3.896  1.000 28.953  0 5686 HOH   A O    1 ? ? 
HETATM 12884 O  O    . HOH   FB 10 .   ? -16.991 -0.258  -29.688 1.000 21.415  0 5687 HOH   A O    1 ? ? 
HETATM 12885 O  O    . HOH   FB 10 .   ? 5.318   9.219   0.896   1.000 16.016  0 5688 HOH   A O    1 ? ? 
HETATM 12886 O  O    . HOH   FB 10 .   ? 6.822   -15.581 11.207  1.000 23.175  0 5689 HOH   A O    1 ? ? 
HETATM 12887 O  O    . HOH   FB 10 .   ? 16.303  10.501  17.074  1.000 19.619  0 5690 HOH   A O    1 ? 1 
HETATM 12888 O  O    . HOH   FB 10 .   ? -0.170  -4.096  -31.214 1.000 43.272  0 5691 HOH   A O    1 ? ? 
HETATM 12889 O  O    . HOH   FB 10 .   ? 6.012   25.674  22.576  1.000 25.729  0 5692 HOH   A O    1 ? 1 
HETATM 12890 O  O    . HOH   FB 10 .   ? -23.265 4.305   -3.490  1.000 22.719  0 5693 HOH   A O    1 ? ? 
HETATM 12891 O  O    . HOH   FB 10 .   ? 0.982   -32.688 -2.921  1.000 30.157  0 5694 HOH   A O    1 ? ? 
HETATM 12892 O  O    . HOH   FB 10 .   ? 0.564   -29.398 6.930   1.000 29.741  0 5695 HOH   A O    1 ? ? 
HETATM 12893 O  O    . HOH   FB 10 .   ? -11.105 -4.093  -29.526 1.000 29.987  0 5696 HOH   A O    1 ? ? 
HETATM 12894 O  O    . HOH   FB 10 .   ? 12.890  7.535   -0.561  1.000 19.246  0 5697 HOH   A O    1 ? 1 
HETATM 12895 O  O    . HOH   FB 10 .   ? -16.703 7.266   -16.127 1.000 28.735  0 5698 HOH   A O    1 ? ? 
HETATM 12896 O  O    . HOH   FB 10 .   ? 21.092  14.392  41.566  1.000 40.487  0 5699 HOH   A O    1 ? ? 
HETATM 12897 O  O    . HOH   FB 10 .   ? -15.833 4.374   -12.493 1.000 17.111  0 5700 HOH   A O    1 ? ? 
HETATM 12898 O  O    . HOH   FB 10 .   ? -8.299  -26.309 9.463   1.000 51.344  0 5701 HOH   A O    1 ? ? 
HETATM 12899 O  O    . HOH   FB 10 .   ? 23.923  9.135   18.305  1.000 29.902  0 5702 HOH   A O    1 ? 1 
HETATM 12900 O  O    . HOH   FB 10 .   ? 6.143   6.487   3.937   1.000 13.050  0 5703 HOH   A O    1 ? ? 
HETATM 12901 O  O    . HOH   FB 10 .   ? -6.836  13.332  -11.763 1.000 26.681  0 5704 HOH   A O    1 ? ? 
HETATM 12902 O  O    . HOH   FB 10 .   ? -11.674 3.686   -47.466 1.000 51.280  0 5705 HOH   A O    1 ? ? 
HETATM 12903 O  O    . HOH   FB 10 .   ? -19.432 -17.164 -16.048 1.000 48.136  0 5706 HOH   A O    1 ? ? 
HETATM 12904 O  O    . HOH   FB 10 .   ? 1.722   3.831   -27.558 1.000 35.088  0 5707 HOH   A O    1 ? ? 
HETATM 12905 O  O    . HOH   FB 10 .   ? -4.293  -8.098  -8.560  1.000 16.454  0 5708 HOH   A O    1 ? ? 
HETATM 12906 O  O    . HOH   FB 10 .   ? 18.375  21.211  11.125  1.000 30.757  0 5709 HOH   A O    1 ? ? 
HETATM 12907 O  O    . HOH   FB 10 .   ? 11.141  -6.980  -13.525 1.000 34.428  0 5710 HOH   A O    1 ? ? 
HETATM 12908 O  O    . HOH   FB 10 .   ? 1.661   -14.417 3.818   1.000 18.301  0 5711 HOH   A O    1 ? ? 
HETATM 12909 O  O    . HOH   FB 10 .   ? 7.697   -12.258 12.722  1.000 40.252  0 5712 HOH   A O    1 ? ? 
HETATM 12910 O  O    . HOH   FB 10 .   ? -1.072  -0.337  -35.107 1.000 37.600  0 5713 HOH   A O    1 ? ? 
HETATM 12911 O  O    . HOH   FB 10 .   ? 1.564   19.571  1.913   1.000 38.286  0 5714 HOH   A O    1 ? ? 
HETATM 12912 O  O    . HOH   FB 10 .   ? 29.266  -10.399 -1.104  1.000 37.664  0 5715 HOH   A O    1 ? ? 
HETATM 12913 O  O    . HOH   FB 10 .   ? -24.947 -1.451  -26.140 1.000 27.665  0 5716 HOH   A O    1 ? ? 
HETATM 12914 O  O    . HOH   FB 10 .   ? -21.806 -2.957  -3.623  1.000 36.718  0 5717 HOH   A O    1 ? ? 
HETATM 12915 O  O    . HOH   FB 10 .   ? -15.033 9.655   -15.582 1.000 27.365  0 5718 HOH   A O    1 ? ? 
HETATM 12916 O  O    . HOH   FB 10 .   ? 6.311   2.307   -18.162 1.000 40.523  0 5719 HOH   A O    1 ? ? 
HETATM 12917 O  O    . HOH   FB 10 .   ? 1.400   1.410   -23.282 1.000 41.954  0 5720 HOH   A O    1 ? ? 
HETATM 12918 O  O    . HOH   FB 10 .   ? 31.134  0.888   28.580  1.000 50.781  0 5721 HOH   A O    1 ? ? 
HETATM 12919 O  O    . HOH   FB 10 .   ? -6.419  11.309  28.095  1.000 28.248  0 5722 HOH   A O    1 ? ? 
HETATM 12920 O  O    . HOH   FB 10 .   ? -1.964  4.793   -0.678  1.000 17.748  0 5723 HOH   A O    1 ? ? 
HETATM 12921 O  O    . HOH   FB 10 .   ? -13.717 -11.940 1.568   1.000 54.985  0 5724 HOH   A O    1 ? ? 
HETATM 12922 O  O    . HOH   FB 10 .   ? -1.003  -1.643  -19.432 1.000 22.194  0 5725 HOH   A O    1 ? ? 
HETATM 12923 O  O    . HOH   FB 10 .   ? 11.201  -11.952 11.182  1.000 44.470  0 5726 HOH   A O    1 ? ? 
HETATM 12924 O  O    . HOH   FB 10 .   ? 16.209  -1.260  19.465  1.000 39.460  0 5727 HOH   A O    1 ? 1 
HETATM 12925 O  O    . HOH   FB 10 .   ? 20.879  1.154   38.864  1.000 61.243  0 5728 HOH   A O    1 ? ? 
HETATM 12926 O  O    . HOH   FB 10 .   ? -8.695  21.297  -6.674  1.000 37.178  0 5729 HOH   A O    1 ? ? 
HETATM 12927 O  O    . HOH   FB 10 .   ? -6.646  9.858   5.014   1.000 20.711  0 5730 HOH   A O    1 ? 1 
HETATM 12928 O  O    . HOH   FB 10 .   ? -4.497  -13.017 22.323  1.000 31.058  0 5731 HOH   A O    1 ? ? 
HETATM 12929 O  O    . HOH   FB 10 .   ? 5.107   -18.175 24.441  1.000 44.104  0 5732 HOH   A O    1 ? ? 
HETATM 12930 O  O    . HOH   FB 10 .   ? 1.060   0.573   2.845   1.000 20.378  0 5733 HOH   A O    1 ? 1 
HETATM 12931 O  O    . HOH   FB 10 .   ? 15.194  -13.513 -0.172  1.000 25.412  0 5734 HOH   A O    1 ? 1 
HETATM 12932 O  O    . HOH   FB 10 .   ? 11.634  -19.556 -6.397  1.000 29.003  0 5735 HOH   A O    1 ? 1 
HETATM 12933 O  O    . HOH   FB 10 .   ? -3.828  8.716   0.879   1.000 23.551  0 5736 HOH   A O    1 ? ? 
HETATM 12934 O  O    . HOH   FB 10 .   ? 7.166   -1.785  -17.567 1.000 22.269  0 5737 HOH   A O    1 ? ? 
HETATM 12935 O  O    . HOH   FB 10 .   ? -0.844  -13.724 3.984   1.000 19.472  0 5738 HOH   A O    1 ? ? 
HETATM 12936 O  O    . HOH   FB 10 .   ? 2.085   -4.717  -8.474  1.000 38.036  0 5739 HOH   A O    1 ? ? 
HETATM 12937 O  O    . HOH   FB 10 .   ? -20.029 14.523  -7.154  1.000 39.805  0 5740 HOH   A O    1 ? ? 
HETATM 12938 O  O    . HOH   FB 10 .   ? -10.585 1.608   -5.732  1.000 16.765  0 5741 HOH   A O    1 ? ? 
HETATM 12939 O  O    . HOH   FB 10 .   ? 18.849  30.459  13.995  1.000 37.236  0 5742 HOH   A O    1 ? ? 
HETATM 12940 O  O    . HOH   FB 10 .   ? -1.595  -14.609 26.999  1.000 27.176  0 5743 HOH   A O    1 ? ? 
HETATM 12941 O  O    . HOH   FB 10 .   ? 0.178   26.969  1.076   1.000 43.202  0 5744 HOH   A O    1 ? ? 
HETATM 12942 O  O    . HOH   FB 10 .   ? -8.871  -16.923 -14.946 1.000 29.596  0 5745 HOH   A O    1 ? ? 
HETATM 12943 O  O    . HOH   FB 10 .   ? 16.932  23.122  37.741  1.000 50.585  0 5746 HOH   A O    1 ? ? 
HETATM 12944 O  O    . HOH   FB 10 .   ? -3.727  -23.813 -3.323  1.000 22.379  0 5747 HOH   A O    1 ? ? 
HETATM 12945 O  O    . HOH   FB 10 .   ? -12.313 9.096   -14.698 1.000 33.570  0 5748 HOH   A O    1 ? ? 
HETATM 12946 O  O    . HOH   FB 10 .   ? -9.025  -18.448 -10.479 1.000 20.882  0 5749 HOH   A O    1 ? ? 
HETATM 12947 O  O    . HOH   FB 10 .   ? -11.156 -24.929 -12.683 1.000 41.658  0 5750 HOH   A O    1 ? 1 
HETATM 12948 O  O    . HOH   FB 10 .   ? -22.110 13.757  -12.970 1.000 50.821  0 5751 HOH   A O    1 ? ? 
HETATM 12949 O  O    . HOH   FB 10 .   ? 1.934   3.804   -5.488  1.000 19.950  0 5752 HOH   A O    1 ? 1 
HETATM 12950 O  O    . HOH   FB 10 .   ? 17.642  9.433   38.787  1.000 26.689  0 5753 HOH   A O    1 ? ? 
HETATM 12951 O  O    . HOH   FB 10 .   ? 19.638  21.892  44.692  1.000 29.891  0 5754 HOH   A O    1 ? ? 
HETATM 12952 O  O    . HOH   FB 10 .   ? -14.159 -10.931 -44.076 1.000 44.682  0 5755 HOH   A O    1 ? ? 
HETATM 12953 O  O    . HOH   FB 10 .   ? -8.118  -12.125 -44.706 1.000 56.727  0 5756 HOH   A O    1 ? ? 
HETATM 12954 O  O    . HOH   FB 10 .   ? -24.622 1.124   -27.091 1.000 26.365  0 5757 HOH   A O    1 ? ? 
HETATM 12955 O  O    . HOH   FB 10 .   ? -1.794  12.852  36.303  1.000 51.735  0 5758 HOH   A O    1 ? ? 
HETATM 12956 O  O    . HOH   FB 10 .   ? -8.723  -21.012 -3.157  1.000 24.536  0 5759 HOH   A O    1 ? ? 
HETATM 12957 O  O    . HOH   FB 10 .   ? -5.333  0.462   -20.532 1.000 29.153  0 5760 HOH   A O    1 ? ? 
HETATM 12958 O  O    . HOH   FB 10 .   ? -18.995 -15.444 -6.746  1.000 28.740  0 5761 HOH   A O    1 ? ? 
HETATM 12959 O  O    . HOH   FB 10 .   ? -0.766  -10.579 -10.652 1.000 23.492  0 5762 HOH   A O    1 ? ? 
HETATM 12960 O  O    . HOH   FB 10 .   ? -3.758  -17.637 2.016   1.000 40.888  0 5763 HOH   A O    1 ? ? 
HETATM 12961 O  O    . HOH   FB 10 .   ? 8.601   -7.919  -20.543 1.000 27.059  0 5764 HOH   A O    1 ? ? 
HETATM 12962 O  O    . HOH   FB 10 .   ? 7.506   19.689  11.665  1.000 20.632  0 5765 HOH   A O    1 ? 1 
HETATM 12963 O  O    . HOH   FB 10 .   ? 2.308   20.734  -8.197  1.000 35.227  0 5766 HOH   A O    1 ? ? 
HETATM 12964 O  O    . HOH   FB 10 .   ? 0.788   -0.002  0.178   1.000 28.784  0 5767 HOH   A O    1 ? ? 
HETATM 12965 O  O    . HOH   FB 10 .   ? 2.446   -8.179  -6.209  1.000 19.473  0 5768 HOH   A O    1 ? ? 
HETATM 12966 O  O    . HOH   FB 10 .   ? 17.976  25.869  7.413   1.000 50.960  0 5769 HOH   A O    1 ? ? 
HETATM 12967 O  O    . HOH   FB 10 .   ? 2.753   -14.764 -28.677 1.000 40.141  0 5770 HOH   A O    1 ? ? 
HETATM 12968 O  O    . HOH   FB 10 .   ? 1.849   6.784   -12.531 1.000 48.540  0 5771 HOH   A O    1 ? ? 
HETATM 12969 O  O    . HOH   FB 10 .   ? 1.274   -18.894 -9.845  1.000 23.327  0 5772 HOH   A O    1 ? ? 
HETATM 12970 O  O    . HOH   FB 10 .   ? -1.962  -1.068  -3.534  1.000 13.668  0 5773 HOH   A O    1 ? 1 
HETATM 12971 O  O    . HOH   FB 10 .   ? -4.471  -6.476  -6.384  1.000 19.681  0 5774 HOH   A O    1 ? ? 
HETATM 12972 O  O    . HOH   FB 10 .   ? -1.301  -12.437 -15.168 1.000 30.941  0 5775 HOH   A O    1 ? ? 
HETATM 12973 O  O    . HOH   FB 10 .   ? -6.188  15.434  0.735   1.000 33.505  0 5776 HOH   A O    1 ? ? 
HETATM 12974 O  O    . HOH   FB 10 .   ? -7.483  7.095   0.829   1.000 32.277  0 5777 HOH   A O    1 ? 1 
HETATM 12975 O  O    . HOH   FB 10 .   ? -30.382 -7.447  -29.621 1.000 35.410  0 5778 HOH   A O    1 ? ? 
HETATM 12976 O  O    . HOH   FB 10 .   ? 10.988  -24.483 7.975   1.000 25.675  0 5779 HOH   A O    1 ? ? 
HETATM 12977 O  O    . HOH   FB 10 .   ? 22.830  -9.518  9.443   1.000 55.169  0 5780 HOH   A O    1 ? ? 
HETATM 12978 O  O    . HOH   FB 10 .   ? 1.632   13.995  30.734  1.000 23.267  0 5781 HOH   A O    1 ? ? 
HETATM 12979 O  O    . HOH   FB 10 .   ? 13.139  11.611  32.971  1.000 28.453  0 5782 HOH   A O    1 ? ? 
HETATM 12980 O  O    . HOH   FB 10 .   ? 0.609   -0.936  -21.765 1.000 42.476  0 5783 HOH   A O    1 ? ? 
HETATM 12981 O  O    . HOH   FB 10 .   ? -21.307 -14.451 -5.940  1.000 41.410  0 5784 HOH   A O    1 ? ? 
HETATM 12982 O  O    . HOH   FB 10 .   ? -29.355 4.393   -9.911  1.000 30.810  0 5785 HOH   A O    1 ? ? 
HETATM 12983 O  O    . HOH   FB 10 .   ? -4.900  -22.542 -0.974  1.000 21.610  0 5786 HOH   A O    1 ? ? 
HETATM 12984 O  O    . HOH   FB 10 .   ? 0.757   -0.413  -9.944  1.000 21.373  0 5787 HOH   A O    1 ? 1 
HETATM 12985 O  O    . HOH   FB 10 .   ? 6.191   16.021  -5.461  1.000 35.920  0 5788 HOH   A O    1 ? 1 
HETATM 12986 O  O    . HOH   FB 10 .   ? 1.719   -29.120 17.852  1.000 52.087  0 5789 HOH   A O    1 ? ? 
HETATM 12987 O  O    . HOH   FB 10 .   ? 1.585   -6.558  19.783  1.000 25.150  0 5790 HOH   A O    1 ? 1 
HETATM 12988 O  O    . HOH   FB 10 .   ? -4.363  -22.299 -5.476  1.000 20.461  0 5791 HOH   A O    1 ? ? 
HETATM 12989 O  O    . HOH   FB 10 .   ? -24.704 6.328   -5.767  1.000 25.649  0 5792 HOH   A O    1 ? ? 
HETATM 12990 O  O    . HOH   FB 10 .   ? 24.873  2.303   21.890  1.000 32.430  0 5793 HOH   A O    1 ? 1 
HETATM 12991 O  O    . HOH   FB 10 .   ? -7.015  -16.403 -11.042 1.000 23.421  0 5794 HOH   A O    1 ? ? 
HETATM 12992 O  O    . HOH   FB 10 .   ? -8.502  4.255   -38.081 1.000 32.577  0 5795 HOH   A O    1 ? ? 
HETATM 12993 O  O    . HOH   FB 10 .   ? 12.969  -2.646  -7.881  1.000 40.040  0 5796 HOH   A O    1 ? ? 
HETATM 12994 O  O    . HOH   FB 10 .   ? -8.159  -15.124 -12.905 1.000 29.358  0 5797 HOH   A O    1 ? ? 
HETATM 12995 O  O    . HOH   FB 10 .   ? -10.540 -4.005  -32.974 1.000 23.017  0 5798 HOH   A O    1 ? ? 
HETATM 12996 O  O    . HOH   FB 10 .   ? 12.840  9.875   30.657  1.000 31.915  0 5799 HOH   A O    1 ? ? 
HETATM 12997 O  O    . HOH   FB 10 .   ? 17.344  22.048  30.481  1.000 33.153  0 5800 HOH   A O    1 ? ? 
HETATM 12998 O  O    . HOH   FB 10 .   ? 3.569   0.898   9.202   1.000 18.918  0 5801 HOH   A O    1 ? 1 
HETATM 12999 O  O    . HOH   FB 10 .   ? -21.846 11.953  -1.356  1.000 26.517  0 5802 HOH   A O    1 ? ? 
HETATM 13000 O  O    . HOH   FB 10 .   ? 13.398  -14.421 -11.295 1.000 48.804  0 5803 HOH   A O    1 ? ? 
HETATM 13001 O  O    . HOH   FB 10 .   ? 19.789  -6.932  -10.424 1.000 39.098  0 5804 HOH   A O    1 ? ? 
HETATM 13002 O  O    . HOH   FB 10 .   ? 4.451   5.193   -7.284  1.000 23.109  0 5805 HOH   A O    1 ? 1 
HETATM 13003 O  O    . HOH   FB 10 .   ? -14.625 4.969   -47.691 1.000 50.110  0 5806 HOH   A O    1 ? ? 
HETATM 13004 O  O    . HOH   FB 10 .   ? -16.942 -15.990 -4.654  1.000 26.499  0 5807 HOH   A O    1 ? ? 
HETATM 13005 O  O    . HOH   FB 10 .   ? 7.230   -36.488 3.854   1.000 58.129  0 5808 HOH   A O    1 ? ? 
HETATM 13006 O  O    . HOH   FB 10 .   ? 8.044   0.652   -27.394 1.000 39.149  0 5809 HOH   A O    1 ? ? 
HETATM 13007 O  O    . HOH   FB 10 .   ? -9.625  18.711  26.555  1.000 43.563  0 5810 HOH   A O    1 ? ? 
HETATM 13008 O  O    . HOH   FB 10 .   ? 2.447   -3.823  0.221   1.000 28.370  0 5811 HOH   A O    1 ? ? 
HETATM 13009 O  O    . HOH   FB 10 .   ? -3.496  5.676   1.288   1.000 19.753  0 5812 HOH   A O    1 ? ? 
HETATM 13010 O  O    . HOH   FB 10 .   ? 2.367   -9.320  -8.768  1.000 37.033  0 5813 HOH   A O    1 ? ? 
HETATM 13011 O  O    . HOH   FB 10 .   ? 17.944  -30.012 3.464   1.000 42.504  0 5814 HOH   A O    1 ? ? 
HETATM 13012 O  O    . HOH   FB 10 .   ? 16.290  -6.152  -7.858  1.000 31.537  0 5815 HOH   A O    1 ? 1 
HETATM 13013 O  O    . HOH   FB 10 .   ? 12.914  18.213  29.656  1.000 30.921  0 5816 HOH   A O    1 ? ? 
HETATM 13014 O  O    . HOH   FB 10 .   ? 23.098  18.718  6.495   1.000 53.446  0 5817 HOH   A O    1 ? ? 
HETATM 13015 O  O    . HOH   FB 10 .   ? 14.818  6.683   45.017  1.000 51.950  0 5818 HOH   A O    1 ? ? 
HETATM 13016 O  O    . HOH   FB 10 .   ? -26.708 7.750   -23.347 1.000 49.392  0 5819 HOH   A O    1 ? ? 
HETATM 13017 O  O    . HOH   FB 10 .   ? 7.323   10.738  -5.765  1.000 29.701  0 5820 HOH   A O    1 ? ? 
HETATM 13018 O  O    . HOH   FB 10 .   ? -19.457 -8.856  -39.314 1.000 43.586  0 5821 HOH   A O    1 ? ? 
HETATM 13019 O  O    . HOH   FB 10 .   ? -7.754  -9.934  10.895  1.000 38.722  0 5822 HOH   A O    1 ? ? 
HETATM 13020 O  O    . HOH   FB 10 .   ? -10.914 -13.124 -0.963  1.000 36.670  0 5823 HOH   A O    1 ? ? 
HETATM 13021 O  O    . HOH   FB 10 .   ? 24.278  28.588  17.015  1.000 41.205  0 5824 HOH   A O    1 ? ? 
HETATM 13022 O  O    . HOH   FB 10 .   ? -4.446  21.170  -0.944  1.000 44.312  0 5825 HOH   A O    1 ? ? 
HETATM 13023 O  O    . HOH   FB 10 .   ? 16.158  -21.324 -6.838  1.000 41.715  0 5826 HOH   A O    1 ? 1 
HETATM 13024 O  O    . HOH   FB 10 .   ? 3.139   12.023  -6.150  1.000 25.213  0 5827 HOH   A O    1 ? 1 
HETATM 13025 O  O    . HOH   FB 10 .   ? 3.708   -4.790  -32.828 1.000 47.073  0 5828 HOH   A O    1 ? ? 
HETATM 13026 O  O    . HOH   FB 10 .   ? -13.362 -18.408 -29.449 1.000 40.680  0 5829 HOH   A O    1 ? ? 
HETATM 13027 O  O    . HOH   FB 10 .   ? -5.589  -19.241 -11.608 1.000 27.762  0 5830 HOH   A O    1 ? ? 
HETATM 13028 O  O    . HOH   FB 10 .   ? 16.103  -13.784 -8.308  1.000 38.654  0 5831 HOH   A O    1 ? ? 
HETATM 13029 O  O    . HOH   FB 10 .   ? 3.539   22.973  -4.638  1.000 34.801  0 5832 HOH   A O    1 ? ? 
HETATM 13030 O  O    . HOH   FB 10 .   ? -24.745 -5.712  -38.142 1.000 50.652  0 5833 HOH   A O    1 ? ? 
HETATM 13031 O  O    . HOH   FB 10 .   ? -2.415  5.099   -35.848 1.000 31.853  0 5834 HOH   A O    1 ? ? 
HETATM 13032 O  O    . HOH   FB 10 .   ? 12.514  -2.825  -12.916 1.000 42.435  0 5835 HOH   A O    1 ? ? 
HETATM 13033 O  O    . HOH   FB 10 .   ? 2.457   -9.329  -13.411 1.000 29.129  0 5836 HOH   A O    1 ? ? 
HETATM 13034 O  O    . HOH   FB 10 .   ? -21.747 -25.770 -7.881  1.000 39.109  0 5837 HOH   A O    1 ? ? 
HETATM 13035 O  O    . HOH   FB 10 .   ? 19.320  8.632   11.610  1.000 26.488  0 5838 HOH   A O    1 ? ? 
HETATM 13036 O  O    . HOH   FB 10 .   ? -4.757  -18.674 19.319  1.000 40.854  0 5839 HOH   A O    1 ? ? 
HETATM 13037 O  O    . HOH   FB 10 .   ? 25.391  15.558  11.676  1.000 56.541  0 5840 HOH   A O    1 ? ? 
HETATM 13038 O  O    . HOH   FB 10 .   ? -13.055 15.179  12.209  1.000 30.171  0 5841 HOH   A O    1 ? 1 
HETATM 13039 O  O    . HOH   FB 10 .   ? -3.692  21.847  17.694  1.000 27.649  0 5842 HOH   A O    1 ? ? 
HETATM 13040 O  O    . HOH   FB 10 .   ? 13.047  8.567   44.320  1.000 38.484  0 5843 HOH   A O    1 ? ? 
HETATM 13041 O  O    . HOH   FB 10 .   ? 3.271   25.096  11.154  1.000 31.846  0 5844 HOH   A O    1 ? ? 
HETATM 13042 O  O    . HOH   FB 10 .   ? 26.350  15.665  19.542  1.000 39.920  0 5845 HOH   A O    1 ? ? 
HETATM 13043 O  O    . HOH   FB 10 .   ? -12.218 -20.719 -4.544  1.000 32.159  0 5846 HOH   A O    1 ? ? 
HETATM 13044 O  O    . HOH   FB 10 .   ? -5.066  -33.938 -3.089  1.000 44.211  0 5847 HOH   A O    1 ? 1 
HETATM 13045 O  O    . HOH   FB 10 .   ? -31.705 -4.969  -24.356 1.000 31.579  0 5848 HOH   A O    1 ? ? 
HETATM 13046 O  O    . HOH   FB 10 .   ? 16.403  12.171  48.654  1.000 50.071  0 5849 HOH   A O    1 ? ? 
HETATM 13047 O  O    . HOH   FB 10 .   ? -2.534  19.078  16.893  1.000 34.541  0 5850 HOH   A O    1 ? ? 
HETATM 13048 O  O    . HOH   FB 10 .   ? 2.594   5.887   -18.179 1.000 32.440  0 5851 HOH   A O    1 ? ? 
HETATM 13049 O  O    . HOH   FB 10 .   ? -28.201 2.226   -30.394 1.000 46.604  0 5852 HOH   A O    1 ? ? 
HETATM 13050 O  O    . HOH   FB 10 .   ? -3.657  -12.047 -37.930 1.000 39.930  0 5853 HOH   A O    1 ? ? 
HETATM 13051 O  O    . HOH   FB 10 .   ? 1.390   24.117  34.288  1.000 38.924  0 5854 HOH   A O    1 ? ? 
HETATM 13052 O  O    . HOH   FB 10 .   ? -9.003  -6.948  -44.655 1.000 48.097  0 5855 HOH   A O    1 ? ? 
HETATM 13053 O  O    . HOH   FB 10 .   ? 6.850   -33.569 -4.638  1.000 36.475  0 5856 HOH   A O    1 ? ? 
HETATM 13054 O  O    . HOH   FB 10 .   ? 29.101  -10.999 1.369   1.000 35.737  0 5857 HOH   A O    1 ? ? 
HETATM 13055 O  O    . HOH   FB 10 .   ? -11.992 18.436  -11.320 1.000 37.844  0 5858 HOH   A O    1 ? ? 
HETATM 13056 O  O    . HOH   FB 10 .   ? -6.261  22.700  31.388  1.000 40.833  0 5859 HOH   A O    1 ? ? 
HETATM 13057 O  O    . HOH   FB 10 .   ? -17.171 12.079  -32.980 1.000 53.605  0 5860 HOH   A O    1 ? ? 
HETATM 13058 O  O    . HOH   FB 10 .   ? 7.224   -22.762 19.027  1.000 44.795  0 5861 HOH   A O    1 ? ? 
HETATM 13059 O  O    . HOH   FB 10 .   ? 8.253   7.513   -7.973  1.000 34.208  0 5862 HOH   A O    1 ? ? 
HETATM 13060 O  O    . HOH   FB 10 .   ? 22.342  25.623  24.671  1.000 45.772  0 5863 HOH   A O    1 ? ? 
HETATM 13061 O  O    . HOH   FB 10 .   ? 13.709  -17.671 -7.340  1.000 33.689  0 5864 HOH   A O    1 ? 1 
HETATM 13062 O  O    . HOH   FB 10 .   ? 28.461  13.182  42.945  1.000 38.614  0 5865 HOH   A O    1 ? ? 
HETATM 13063 O  O    . HOH   FB 10 .   ? -13.954 15.281  -20.616 1.000 36.911  0 5866 HOH   A O    1 ? ? 
HETATM 13064 O  O    . HOH   FB 10 .   ? -5.673  -30.438 -6.981  1.000 44.632  0 5867 HOH   A O    1 ? 1 
HETATM 13065 O  O    . HOH   FB 10 .   ? 2.360   7.050   -6.748  1.000 29.312  0 5868 HOH   A O    1 ? ? 
HETATM 13066 O  O    . HOH   FB 10 .   ? -0.546  23.385  -17.870 1.000 51.174  0 5869 HOH   A O    1 ? ? 
HETATM 13067 O  O    . HOH   FB 10 .   ? -17.926 -15.493 -27.054 1.000 47.716  0 5870 HOH   A O    1 ? ? 
HETATM 13068 O  O    . HOH   FB 10 .   ? -1.457  26.125  3.207   1.000 45.528  0 5871 HOH   A O    1 ? ? 
HETATM 13069 O  O    . HOH   FB 10 .   ? 21.064  -19.872 -0.578  1.000 41.929  0 5872 HOH   A O    1 ? ? 
HETATM 13070 O  O    . HOH   FB 10 .   ? -14.303 10.466  -1.218  1.000 43.955  0 5873 HOH   A O    1 ? ? 
HETATM 13071 O  O    . HOH   FB 10 .   ? -6.218  -3.980  14.444  1.000 34.018  0 5874 HOH   A O    1 ? ? 
HETATM 13072 O  O    . HOH   FB 10 .   ? 17.642  -4.903  -4.761  1.000 34.904  0 5875 HOH   A O    1 ? ? 
HETATM 13073 O  O    . HOH   FB 10 .   ? -13.144 -5.956  -6.040  1.000 38.485  0 5876 HOH   A O    1 ? ? 
HETATM 13074 O  O    . HOH   FB 10 .   ? 30.777  -1.363  28.707  1.000 48.987  0 5877 HOH   A O    1 ? ? 
HETATM 13075 O  O    . HOH   FB 10 .   ? -5.038  20.990  -10.787 1.000 40.424  0 5878 HOH   A O    1 ? ? 
HETATM 13076 O  O    . HOH   FB 10 .   ? -32.849 -7.280  -14.200 1.000 41.998  0 5879 HOH   A O    1 ? ? 
HETATM 13077 O  O    . HOH   FB 10 .   ? 23.166  10.548  28.633  1.000 46.111  0 5880 HOH   A O    1 ? ? 
HETATM 13078 O  O    . HOH   FB 10 .   ? 25.866  -13.820 4.584   1.000 53.313  0 5881 HOH   A O    1 ? ? 
HETATM 13079 O  O    . HOH   FB 10 .   ? 8.616   28.923  23.356  1.000 44.994  0 5882 HOH   A O    1 ? ? 
HETATM 13080 O  O    . HOH   FB 10 .   ? -10.729 21.368  25.030  1.000 40.938  0 5883 HOH   A O    1 ? ? 
HETATM 13081 O  O    . HOH   FB 10 .   ? -29.836 -1.814  -18.803 1.000 46.186  0 5884 HOH   A O    1 ? ? 
HETATM 13082 O  O    . HOH   FB 10 .   ? 23.011  21.193  11.929  1.000 59.360  0 5885 HOH   A O    1 ? ? 
HETATM 13083 O  O    . HOH   FB 10 .   ? 16.069  -20.548 5.336   1.000 50.057  0 5886 HOH   A O    1 ? ? 
HETATM 13084 O  O    . HOH   FB 10 .   ? 21.923  12.513  -4.588  1.000 46.167  0 5887 HOH   A O    1 ? ? 
HETATM 13085 O  O    . HOH   FB 10 .   ? -9.371  15.457  -19.334 1.000 37.660  0 5888 HOH   A O    1 ? ? 
HETATM 13086 O  O    . HOH   FB 10 .   ? -9.461  5.245   17.120  1.000 40.760  0 5889 HOH   A O    1 ? ? 
HETATM 13087 O  O    . HOH   FB 10 .   ? -13.935 -19.358 -2.512  1.000 47.306  0 5890 HOH   A O    1 ? ? 
HETATM 13088 O  O    . HOH   FB 10 .   ? 5.506   8.567   -23.424 1.000 37.447  0 5891 HOH   A O    1 ? ? 
HETATM 13089 O  O    . HOH   FB 10 .   ? 0.898   -21.293 21.712  1.000 64.880  0 5892 HOH   A O    1 ? ? 
HETATM 13090 O  O    . HOH   FB 10 .   ? 30.450  -5.551  1.039   1.000 49.650  0 5893 HOH   A O    1 ? ? 
HETATM 13091 O  O    . HOH   FB 10 .   ? -10.276 -21.112 -28.069 1.000 48.112  0 5894 HOH   A O    1 ? ? 
HETATM 13092 O  O    . HOH   FB 10 .   ? 27.954  14.227  27.420  1.000 40.577  0 5895 HOH   A O    1 ? ? 
HETATM 13093 O  O    . HOH   FB 10 .   ? 5.445   -27.706 16.138  1.000 48.844  0 5896 HOH   A O    1 ? ? 
HETATM 13094 O  O    . HOH   FB 10 .   ? 5.438   11.693  37.328  1.000 54.008  0 5897 HOH   A O    1 ? ? 
HETATM 13095 O  O    . HOH   FB 10 .   ? -30.841 -3.435  -41.514 1.000 44.837  0 5898 HOH   A O    1 ? ? 
HETATM 13096 O  O    . HOH   FB 10 .   ? -8.095  16.885  0.610   1.000 34.451  0 5899 HOH   A O    1 ? ? 
HETATM 13097 O  O    . HOH   FB 10 .   ? -31.560 -8.584  -31.700 1.000 45.613  0 5900 HOH   A O    1 ? ? 
HETATM 13098 O  O    . HOH   FB 10 .   ? 30.427  -1.450  24.015  1.000 34.543  0 5901 HOH   A O    1 ? ? 
HETATM 13099 O  O    . HOH   FB 10 .   ? 30.547  2.356   -1.466  1.000 39.237  0 5902 HOH   A O    1 ? ? 
HETATM 13100 O  O    . HOH   FB 10 .   ? -28.380 14.065  -15.104 1.000 48.675  0 5903 HOH   A O    1 ? ? 
HETATM 13101 O  O    . HOH   FB 10 .   ? 5.306   10.244  -21.315 1.000 44.360  0 5904 HOH   A O    1 ? ? 
HETATM 13102 O  O    . HOH   FB 10 .   ? 5.575   4.682   -24.623 1.000 44.571  0 5905 HOH   A O    1 ? ? 
HETATM 13103 O  O    . HOH   FB 10 .   ? -13.528 -17.516 2.054   1.000 56.388  0 5906 HOH   A O    1 ? ? 
HETATM 13104 O  O    . HOH   FB 10 .   ? 11.169  -33.237 -10.773 1.000 61.439  0 5907 HOH   A O    1 ? ? 
HETATM 13105 O  O    . HOH   FB 10 .   ? -8.938  -16.382 4.109   1.000 56.253  0 5908 HOH   A O    1 ? ? 
HETATM 13106 O  O    . HOH   FB 10 .   ? 39.932  1.754   31.500  1.000 54.779  0 5909 HOH   A O    1 ? ? 
HETATM 13107 O  O    . HOH   FB 10 .   ? 11.314  -31.149 -5.651  1.000 46.428  0 5910 HOH   A O    1 ? ? 
HETATM 13108 O  O    . HOH   FB 10 .   ? -4.737  20.053  -17.058 1.000 43.692  0 5911 HOH   A O    1 ? ? 
HETATM 13109 O  O    . HOH   FB 10 .   ? -2.461  -28.821 -9.622  1.000 44.949  0 5912 HOH   A O    1 ? ? 
HETATM 13110 O  O    . HOH   FB 10 .   ? 7.207   -2.455  28.173  1.000 34.811  0 5913 HOH   A O    1 ? ? 
HETATM 13111 O  O    . HOH   FB 10 .   ? 5.103   5.250   -11.093 1.000 47.826  0 5914 HOH   A O    1 ? ? 
HETATM 13112 O  O    . HOH   FB 10 .   ? 1.905   11.307  32.844  1.000 49.221  0 5915 HOH   A O    1 ? ? 
HETATM 13113 O  O    . HOH   FB 10 .   ? -31.145 7.920   -12.707 1.000 46.537  0 5916 HOH   A O    1 ? ? 
HETATM 13114 O  O    . HOH   FB 10 .   ? 7.474   -21.413 11.215  1.000 23.352  0 5917 HOH   A O    1 ? ? 
HETATM 13115 O  O    . HOH   FB 10 .   ? 0.232   -9.985  33.645  1.000 36.530  0 5918 HOH   A O    1 ? ? 
HETATM 13116 O  O    . HOH   FB 10 .   ? 3.795   2.271   -26.001 1.000 34.830  0 5919 HOH   A O    1 ? ? 
HETATM 13117 O  O    . HOH   FB 10 .   ? -20.243 2.374   -35.920 1.000 49.098  0 5920 HOH   A O    1 ? ? 
HETATM 13118 O  O    . HOH   FB 10 .   ? -23.232 -20.847 -15.100 1.000 38.388  0 5921 HOH   A O    1 ? ? 
HETATM 13119 O  O    . HOH   FB 10 .   ? -12.436 -23.288 -18.512 1.000 50.474  0 5922 HOH   A O    1 ? ? 
HETATM 13120 O  O    . HOH   FB 10 .   ? -2.894  28.772  -5.463  1.000 36.480  0 5923 HOH   A O    1 ? ? 
HETATM 13121 O  O    . HOH   FB 10 .   ? 23.340  28.281  12.765  1.000 47.059  0 5924 HOH   A O    1 ? ? 
HETATM 13122 O  O    . HOH   FB 10 .   ? -5.420  -2.000  -44.235 1.000 46.440  0 5925 HOH   A O    1 ? ? 
HETATM 13123 O  O    . HOH   FB 10 .   ? 23.915  -28.488 1.185   1.000 54.303  0 5926 HOH   A O    1 ? ? 
HETATM 13124 O  O    . HOH   FB 10 .   ? -21.645 12.102  1.351   1.000 42.432  0 5927 HOH   A O    1 ? ? 
HETATM 13125 O  O    . HOH   FB 10 .   ? -0.836  12.076  -10.890 1.000 40.924  0 5928 HOH   A O    1 ? ? 
HETATM 13126 O  O    . HOH   FB 10 .   ? -25.767 0.556   -35.330 1.000 45.127  0 5929 HOH   A O    1 ? ? 
HETATM 13127 O  O    . HOH   FB 10 .   ? -18.112 -18.194 -20.312 1.000 42.828  0 5930 HOH   A O    1 ? ? 
HETATM 13128 O  O    . HOH   FB 10 .   ? 30.619  -1.454  -0.358  1.000 44.518  0 5931 HOH   A O    1 ? ? 
HETATM 13129 O  O    . HOH   FB 10 .   ? -32.434 -7.007  -25.152 1.000 42.305  0 5932 HOH   A O    1 ? ? 
HETATM 13130 O  O    . HOH   FB 10 .   ? -28.920 12.771  2.963   1.000 40.058  0 5933 HOH   A O    1 ? ? 
HETATM 13131 O  O    . HOH   FB 10 .   ? -13.081 10.134  8.691   1.000 42.171  0 5934 HOH   A O    1 ? 1 
HETATM 13132 O  O    . HOH   FB 10 .   ? 16.088  -23.810 13.766  1.000 49.734  0 5935 HOH   A O    1 ? ? 
HETATM 13133 O  O    . HOH   FB 10 .   ? -6.235  8.853   2.462   1.000 38.448  0 5936 HOH   A O    1 ? ? 
HETATM 13134 O  O    . HOH   FB 10 .   ? -9.094  -16.936 -4.592  1.000 45.946  0 5937 HOH   A O    1 ? ? 
HETATM 13135 O  O    . HOH   FB 10 .   ? 14.815  -17.629 7.763   1.000 49.463  0 5938 HOH   A O    1 ? ? 
HETATM 13136 O  O    . HOH   FB 10 .   ? -11.014 12.917  3.515   1.000 57.129  0 5939 HOH   A O    1 ? ? 
HETATM 13137 O  O    . HOH   FB 10 .   ? -8.074  16.183  27.200  1.000 53.408  0 5940 HOH   A O    1 ? ? 
HETATM 13138 O  O    . HOH   FB 10 .   ? 15.785  7.573   -4.519  1.000 39.358  0 5941 HOH   A O    1 ? ? 
HETATM 13139 O  O    . HOH   FB 10 .   ? 7.692   19.812  -2.028  1.000 39.204  0 5942 HOH   A O    1 ? ? 
HETATM 13140 O  O    . HOH   FB 10 .   ? 8.004   18.257  -4.561  1.000 34.277  0 5943 HOH   A O    1 ? ? 
HETATM 13141 O  O    . HOH   FB 10 .   ? 8.276   20.203  46.684  1.000 57.869  0 5944 HOH   A O    1 ? 1 
HETATM 13142 O  O    . HOH   FB 10 .   ? 18.299  -3.846  28.738  1.000 52.103  0 5945 HOH   A O    1 ? ? 
HETATM 13143 O  O    . HOH   FB 10 .   ? 1.825   -12.039 -15.402 1.000 35.447  0 5946 HOH   A O    1 ? ? 
HETATM 13144 O  O    . HOH   FB 10 .   ? 18.475  7.244   48.717  1.000 61.954  0 5947 HOH   A O    1 ? ? 
HETATM 13145 O  O    . HOH   FB 10 .   ? 16.872  10.599  -5.806  1.000 47.908  0 5948 HOH   A O    1 ? ? 
HETATM 13146 O  O    . HOH   FB 10 .   ? 21.082  -12.265 18.298  1.000 62.356  0 5949 HOH   A O    1 ? ? 
HETATM 13147 O  O    . HOH   FB 10 .   ? -13.244 7.333   8.481   1.000 32.260  0 5950 HOH   A O    1 ? ? 
HETATM 13148 O  O    . HOH   FB 10 .   ? 5.546   15.951  -8.211  1.000 56.747  0 5951 HOH   A O    1 ? ? 
HETATM 13149 O  O    . HOH   FB 10 .   ? -32.232 -8.301  -27.822 1.000 32.523  0 5952 HOH   A O    1 ? ? 
HETATM 13150 O  O    . HOH   FB 10 .   ? -9.420  -32.425 -3.639  1.000 46.105  0 5953 HOH   A O    1 ? ? 
HETATM 13151 O  O    . HOH   FB 10 .   ? -10.901 7.458   1.837   1.000 36.279  0 5954 HOH   A O    1 ? ? 
HETATM 13152 O  O    . HOH   FB 10 .   ? -12.427 4.589   4.235   1.000 42.445  0 5955 HOH   A O    1 ? ? 
HETATM 13153 O  O    . HOH   FB 10 .   ? -9.731  -2.944  -49.621 1.000 52.728  0 5956 HOH   A O    1 ? ? 
HETATM 13154 O  O    . HOH   FB 10 .   ? 19.880  -21.675 4.402   1.000 49.186  0 5957 HOH   A O    1 ? ? 
HETATM 13155 O  O    . HOH   FB 10 .   ? -31.090 -8.523  -12.422 1.000 49.277  0 5958 HOH   A O    1 ? ? 
HETATM 13156 O  O    . HOH   FB 10 .   ? 5.325   -14.945 -21.053 1.000 55.521  0 5959 HOH   A O    1 ? ? 
HETATM 13157 O  O    . HOH   FB 10 .   ? -11.759 -2.098  -51.842 1.000 50.801  0 5960 HOH   A O    1 ? ? 
HETATM 13158 O  O    . HOH   FB 10 .   ? 19.084  -17.134 -6.717  1.000 46.544  0 5961 HOH   A O    1 ? ? 
HETATM 13159 O  O    . HOH   FB 10 .   ? -31.802 -3.137  -44.679 1.000 49.649  0 5962 HOH   A O    1 ? ? 
HETATM 13160 O  O    . HOH   FB 10 .   ? 11.362  -11.681 19.388  1.000 50.015  0 5963 HOH   A O    1 ? ? 
HETATM 13161 O  O    . HOH   FB 10 .   ? -38.151 1.444   -14.741 1.000 52.103  0 5964 HOH   A O    1 ? ? 
HETATM 13162 O  O    . HOH   FB 10 .   ? 7.610   4.748   -11.582 1.000 27.823  0 5965 HOH   A O    1 ? ? 
HETATM 13163 O  O    . HOH   FB 10 .   ? 15.177  12.175  -9.833  1.000 64.277  0 5966 HOH   A O    1 ? ? 
HETATM 13164 O  O    . HOH   FB 10 .   ? -30.504 9.668   -32.934 1.000 60.680  0 5967 HOH   A O    1 ? ? 
HETATM 13165 O  O    . HOH   FB 10 .   ? 12.012  5.029   -19.219 1.000 62.216  0 5968 HOH   A O    1 ? ? 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.pdbx_PDB_ins_code 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1     N  N    . GLY   A  1   ? 0.63853252 0.88823223 0.78528816 -0.11061149 -0.20150760 -0.02700366 56   GLY   A N    
2     C  CA   . GLY   A  1   ? 0.54177755 0.78175735 0.67829609 -0.09944700 -0.20453253 -0.02377561 56   GLY   A CA   
3     C  C    . GLY   A  1   ? 0.55351764 0.76887929 0.66364086 -0.09925573 -0.20596637 -0.02140348 56   GLY   A C    
4     O  O    . GLY   A  1   ? 0.57887197 0.78598750 0.67872894 -0.09148037 -0.21117073 -0.01888598 56   GLY   A O    
5     H  H1   . GLY   A  1   ? 0.60206342 0.86798513 0.76480889 -0.11048687 -0.20257728 -0.02862105 56   GLY   A H1   
6     H  H2   . GLY   A  1   ? 0.61221999 0.85804051 0.75291693 -0.11515290 -0.20620270 -0.02814103 56   GLY   A H2   
7     H  H3   . GLY   A  1   ? 0.60063672 0.84434044 0.74412382 -0.11347536 -0.19385363 -0.02636529 56   GLY   A H3   
8     H  HA2  . GLY   A  1   ? 0.55686623 0.79745132 0.69695485 -0.09541056 -0.19827004 -0.02246920 56   GLY   A HA2  
9     H  HA3  . GLY   A  1   ? 0.56729794 0.81709594 0.71142018 -0.09544804 -0.21205376 -0.02444123 56   GLY   A HA3  
10    N  N    . SER   A  2   ? 0.58746910 0.79098713 0.68649209 -0.10784990 -0.20123427 -0.02225272 57   SER   A N    
11    C  CA   . SER   A  2   ? 0.64075273 0.82302850 0.71587443 -0.10888574 -0.20318861 -0.02112072 57   SER   A CA   
12    C  C    . SER   A  2   ? 0.60234606 0.76812172 0.66495532 -0.11096717 -0.19206242 -0.01951619 57   SER   A C    
13    O  O    . SER   A  2   ? 0.54539007 0.71495593 0.61605412 -0.11621193 -0.18439598 -0.02047536 57   SER   A O    
14    C  CB   . SER   A  2   ? 0.62929553 0.81142128 0.70061105 -0.11739138 -0.21033935 -0.02452971 57   SER   A CB   
15    O  OG   . SER   A  2   ? 0.69829434 0.85937297 0.74582082 -0.11862066 -0.21106386 -0.02391916 57   SER   A OG   
16    H  H    . SER   A  2   ? 0.58504951 0.79357886 0.69133025 -0.11309092 -0.19647858 -0.02359052 57   SER   A H    
17    H  HA   . SER   A  2   ? 0.62452996 0.80263984 0.69324172 -0.10255905 -0.20734410 -0.01921149 57   SER   A HA   
18    H  HB2  . SER   A  2   ? 0.65190578 0.84396160 0.73009562 -0.11578117 -0.21821293 -0.02546028 57   SER   A HB2  
19    H  HB3  . SER   A  2   ? 0.64481223 0.83186901 0.72354770 -0.12382749 -0.20674588 -0.02640716 57   SER   A HB3  
21    N  N    . CYS   A  3   ? 0.58960336 0.73720068 0.63223481 -0.10705661 -0.19152394 -0.01706497 58   CYS   A N    
22    C  CA   . CYS   A  3   ? 0.68772638 0.81896496 0.71701336 -0.10895778 -0.18212409 -0.01584706 58   CYS   A CA   
23    C  C    . CYS   A  3   ? 0.63785106 0.75696707 0.65324116 -0.11653960 -0.18335307 -0.01835541 58   CYS   A C    
24    O  O    . CYS   A  3   ? 0.63250995 0.73824406 0.63729233 -0.11884541 -0.17598507 -0.01804179 58   CYS   A O    
25    C  CB   . CYS   A  3   ? 0.81495237 0.93402511 0.83139473 -0.10079242 -0.17960882 -0.01193396 58   CYS   A CB   
26    S  SG   . CYS   A  3   ? 0.48927912 0.61778045 0.51999223 -0.09290201 -0.17397398 -0.00915588 58   CYS   A SG   
27    H  H    . CYS   A  3   ? 0.62301111 0.76854873 0.66024119 -0.10308914 -0.19721103 -0.01610287 58   CYS   A H    
28    H  HA   . CYS   A  3   ? 0.66322654 0.79952437 0.70154423 -0.11075826 -0.17618996 -0.01602418 58   CYS   A HA   
29    H  HB2  . CYS   A  3   ? 0.71371126 0.83040875 0.72367573 -0.09809705 -0.18602186 -0.01135266 58   CYS   A HB2  
30    H  HB3  . CYS   A  3   ? 0.70562488 0.81296587 0.71113265 -0.10246618 -0.17475308 -0.01149595 58   CYS   A HB3  
31    N  N    . LYS   A  4   ? 0.61075103 0.73473728 0.62660462 -0.12029316 -0.19281605 -0.02108612 59   LYS   A N    
32    C  CA   . LYS   A  4   ? 0.50426960 0.61710405 0.50738579 -0.12777796 -0.19464883 -0.02411795 59   LYS   A CA   
33    C  C    . LYS   A  4   ? 0.55192584 0.66404903 0.56103468 -0.13522191 -0.18665169 -0.02574950 59   LYS   A C    
34    O  O    . LYS   A  4   ? 0.83858496 0.96583581 0.86590552 -0.13893308 -0.18571123 -0.02676722 59   LYS   A O    
35    C  CB   . LYS   A  4   ? 0.60348916 0.72419298 0.60901469 -0.13112816 -0.20637323 -0.02704782 59   LYS   A CB   
36    C  CG   . LYS   A  4   ? 0.91905522 1.02465630 0.90587008 -0.13682140 -0.20992659 -0.03000402 59   LYS   A CG   
37    C  CD   . LYS   A  4   ? 1.10975635 1.21703255 1.08961082 -0.13527955 -0.22246769 -0.03101739 59   LYS   A CD   
38    C  CE   . LYS   A  4   ? 1.11560595 1.20606244 1.07384133 -0.13954201 -0.22555846 -0.03376882 59   LYS   A CE   
39    N  NZ   . LYS   A  4   ? 1.36307895 1.45418715 1.32516015 -0.14982994 -0.22639537 -0.03847747 59   LYS   A NZ   
40    H  H    . LYS   A  4   ? 0.59000397 0.72424304 0.61409473 -0.11802073 -0.19840723 -0.02118300 59   LYS   A H    
41    H  HA   . LYS   A  4   ? 0.55813056 0.65780473 0.54622561 -0.12554462 -0.19320281 -0.02307181 59   LYS   A HA   
42    H  HB2  . LYS   A  4   ? 0.63746661 0.76175314 0.64306390 -0.12567219 -0.21133740 -0.02552293 59   LYS   A HB2  
43    H  HB3  . LYS   A  4   ? 0.62925225 0.76218230 0.64910758 -0.13500650 -0.20720886 -0.02867882 59   LYS   A HB3  
44    H  HG2  . LYS   A  4   ? 0.86464483 0.97203124 0.85612178 -0.14347945 -0.20902295 -0.03252573 59   LYS   A HG2  
45    H  HG3  . LYS   A  4   ? 0.85838789 0.95083386 0.83233231 -0.13501017 -0.20503502 -0.02887378 59   LYS   A HG3  
46    H  HD2  . LYS   A  4   ? 1.05923414 1.16628635 1.03642666 -0.12864602 -0.22373562 -0.02821688 59   LYS   A HD2  
47    H  HD3  . LYS   A  4   ? 1.06478143 1.18506837 1.05743527 -0.13788348 -0.22762474 -0.03264946 59   LYS   A HD3  
48    H  HE2  . LYS   A  4   ? 1.16910052 1.24726200 1.11562693 -0.13754250 -0.21966952 -0.03255128 59   LYS   A HE2  
49    H  HE3  . LYS   A  4   ? 1.17795503 1.26864457 1.13038325 -0.13751039 -0.23301551 -0.03374419 59   LYS   A HE3  
50    H  HZ1  . LYS   A  4   ? 1.26960659 1.35854483 1.23500872 -0.15181971 -0.21944053 -0.03836441 59   LYS   A HZ1  
51    H  HZ2  . LYS   A  4   ? 1.27858853 1.38204908 1.25268161 -0.15205903 -0.23140119 -0.03960876 59   LYS   A HZ2  
52    H  HZ3  . LYS   A  4   ? 1.29092848 1.37207270 1.23988342 -0.15207878 -0.22892597 -0.04041665 59   LYS   A HZ3  
53    N  N    . GLY   A  5   ? 0.73770154 0.83196700 0.73113996 -0.13680489 -0.18046193 -0.02570185 60   GLY   A N    
54    C  CA   . GLY   A  5   ? 0.50533384 0.59478104 0.50072289 -0.14316441 -0.17279144 -0.02676168 60   GLY   A CA   
55    C  C    . GLY   A  5   ? 0.48335671 0.57287800 0.48387140 -0.13925011 -0.16281202 -0.02347608 60   GLY   A C    
56    O  O    . GLY   A  5   ? 0.64315188 0.72766441 0.64430416 -0.14385973 -0.15613459 -0.02376028 60   GLY   A O    
57    H  H    . GLY   A  5   ? 0.63096571 0.71550822 0.61174935 -0.13364780 -0.18113746 -0.02493877 60   GLY   A H    
58    H  HA2  . GLY   A  5   ? 0.55521196 0.63174677 0.53768802 -0.14528987 -0.17220096 -0.02805742 60   GLY   A HA2  
59    H  HA3  . GLY   A  5   ? 0.54916644 0.64765596 0.55493158 -0.14853835 -0.17491572 -0.02859629 60   GLY   A HA3  
60    N  N    . ARG   A  6   ? 0.60514027 0.69953597 0.60869229 -0.13087440 -0.16204102 -0.02034760 61   ARG   A N    
61    C  CA   . ARG   A  6   ? 0.38190567 0.48015776 0.39376453 -0.12741640 -0.15362072 -0.01761426 61   ARG   A CA   
62    C  C    . ARG   A  6   ? 0.40929693 0.49792230 0.41106653 -0.11928960 -0.14932826 -0.01418395 61   ARG   A C    
63    O  O    . ARG   A  6   ? 0.44525054 0.53742933 0.45387414 -0.11590891 -0.14299530 -0.01196071 61   ARG   A O    
64    C  CB   . ARG   A  6   ? 0.50078428 0.61978507 0.53311855 -0.12547751 -0.15583341 -0.01741439 61   ARG   A CB   
65    C  CG   . ARG   A  6   ? 0.58289456 0.71571386 0.63043094 -0.13386610 -0.15750311 -0.02036229 61   ARG   A CG   
66    C  CD   . ARG   A  6   ? 0.48695818 0.64152300 0.55434263 -0.13072179 -0.16124883 -0.02066739 61   ARG   A CD   
67    N  NE   . ARG   A  6   ? 0.48233318 0.64224219 0.55716711 -0.12392061 -0.15485972 -0.01811852 61   ARG   A NE   
68    C  CZ   . ARG   A  6   ? 0.50215495 0.67606056 0.58931369 -0.11713824 -0.15795937 -0.01766132 61   ARG   A CZ   
69    N  NH1  . ARG   A  6   ? 0.44819701 0.63270748 0.54207933 -0.11573510 -0.16758844 -0.01925155 61   ARG   A NH1  
70    N  NH2  . ARG   A  6   ? 0.38081372 0.55753142 0.47314939 -0.11121800 -0.15161391 -0.01565488 61   ARG   A NH2  
71    H  H    . ARG   A  6   ? 0.51686656 0.61172068 0.51680231 -0.12730302 -0.16698538 -0.01991351 61   ARG   A H    
72    H  HA   . ARG   A  6   ? 0.44037652 0.53532052 0.45275801 -0.13182323 -0.14885765 -0.01818299 61   ARG   A HA   
73    H  HB2  . ARG   A  6   ? 0.48386410 0.60613090 0.51587486 -0.12148029 -0.16157338 -0.01712336 61   ARG   A HB2  
74    H  HB3  . ARG   A  6   ? 0.47203648 0.59273493 0.50837570 -0.12222199 -0.15046617 -0.01556677 61   ARG   A HB3  
75    H  HG2  . ARG   A  6   ? 0.53791761 0.66888112 0.58735436 -0.13741779 -0.15140386 -0.02018239 61   ARG   A HG2  
76    H  HG3  . ARG   A  6   ? 0.54994190 0.67945528 0.59252524 -0.13800897 -0.16226414 -0.02237317 61   ARG   A HG3  
77    H  HD2  . ARG   A  6   ? 0.50723004 0.67111194 0.58464980 -0.13654445 -0.16169593 -0.02256660 61   ARG   A HD2  
78    H  HD3  . ARG   A  6   ? 0.51152188 0.66780949 0.57703960 -0.12762715 -0.16807206 -0.02095075 61   ARG   A HD3  
79    H  HE   . ARG   A  6   ? 0.48323542 0.63654321 0.55409610 -0.12421237 -0.14875478 -0.01694151 61   ARG   A HE   
80    H  HH11 . ARG   A  6   ? 0.46927160 0.65938723 0.56768227 -0.12095191 -0.17083062 -0.02132329 61   ARG   A HH11 
81    H  HH12 . ARG   A  6   ? 0.46471012 0.65060240 0.55854869 -0.10959480 -0.17093848 -0.01821011 61   ARG   A HH12 
82    H  HH21 . ARG   A  6   ? 0.40953875 0.59419703 0.50900823 -0.10618027 -0.15381809 -0.01542270 61   ARG   A HH21 
83    H  HH22 . ARG   A  6   ? 0.40976477 0.58022714 0.49826407 -0.11227047 -0.14538191 -0.01464472 61   ARG   A HH22 
84    N  N    . CYS   A  7   ? 0.46011055 0.53690493 0.44559726 -0.11631450 -0.15266739 -0.01374952 62   CYS   A N    
85    C  CA   . CYS   A  7   ? 0.41428864 0.48273984 0.39052492 -0.10911018 -0.14892462 -0.01036657 62   CYS   A CA   
86    C  C    . CYS   A  7   ? 0.35630140 0.41782337 0.33100218 -0.10898104 -0.13882102 -0.00894575 62   CYS   A C    
87    O  O    . CYS   A  7   ? 0.42797878 0.48037612 0.39593482 -0.11347437 -0.13523954 -0.01050732 62   CYS   A O    
88    C  CB   . CYS   A  7   ? 0.46935171 0.52502489 0.42681155 -0.10743291 -0.15281333 -0.01033775 62   CYS   A CB   
89    S  SG   . CYS   A  7   ? 0.39790842 0.46079969 0.35530323 -0.10546497 -0.16522665 -0.01076736 62   CYS   A SG   
90    H  H    . CYS   A  7   ? 0.44923180 0.52302480 0.42903635 -0.11900969 -0.15717235 -0.01558749 62   CYS   A H    
91    H  HA   . CYS   A  7   ? 0.41378444 0.49011743 0.39741617 -0.10506305 -0.15070540 -0.00889208 62   CYS   A HA   
92    H  HB2  . CYS   A  7   ? 0.44640526 0.49494943 0.39685687 -0.11145024 -0.15191673 -0.01236344 62   CYS   A HB2  
93    H  HB3  . CYS   A  7   ? 0.43825424 0.48798066 0.38948172 -0.10340340 -0.14940234 -0.00807169 62   CYS   A HB3  
94    N  N    . PHE   A  8   ? 0.34205437 0.40752435 0.32264379 -0.10348299 -0.13476267 -0.00604183 63   PHE   A N    
95    C  CA   . PHE   A  8   ? 0.35496038 0.41464174 0.33431372 -0.10259494 -0.12574613 -0.00438474 63   PHE   A CA   
96    C  C    . PHE   A  8   ? 0.35873958 0.42238235 0.34687820 -0.10906068 -0.12172287 -0.00610571 63   PHE   A C    
97    O  O    . PHE   A  8   ? 0.45488259 0.50943869 0.43748057 -0.11089440 -0.11556857 -0.00580893 63   PHE   A O    
98    C  CB   . PHE   A  8   ? 0.33426857 0.37767512 0.29576856 -0.10112567 -0.12286277 -0.00363517 63   PHE   A CB   
99    C  CG   . PHE   A  8   ? 0.35842299 0.39830512 0.31099200 -0.09563589 -0.12693286 -0.00167446 63   PHE   A CG   
100   C  CD1  . PHE   A  8   ? 0.38061762 0.42270529 0.33602852 -0.08966754 -0.12513664 0.00154233  63   PHE   A CD1  
101   C  CD2  . PHE   A  8   ? 0.41198349 0.44640163 0.35328346 -0.09670062 -0.13302529 -0.00304139 63   PHE   A CD2  
102   C  CE1  . PHE   A  8   ? 0.41009504 0.44802293 0.35671660 -0.08505294 -0.12920010 0.00370881  63   PHE   A CE1  
103   C  CE2  . PHE   A  8   ? 0.42470884 0.45555907 0.35699955 -0.09201617 -0.13700980 -0.00083899 63   PHE   A CE2  
104   C  CZ   . PHE   A  8   ? 0.41925773 0.45154685 0.35415274 -0.08633244 -0.13502498 0.00268591  63   PHE   A CZ   
105   H  H    . PHE   A  8   ? 0.34714428 0.41898939 0.33259386 -0.10005408 -0.13797152 -0.00512165 63   PHE   A H    
106   H  HA   . PHE   A  8   ? 0.34077287 0.40507716 0.32553279 -0.09850723 -0.12426967 -0.00255191 63   PHE   A HA   
107   H  HB2  . PHE   A  8   ? 0.35146749 0.38975003 0.30736408 -0.10489904 -0.12392771 -0.00568775 63   PHE   A HB2  
108   H  HB3  . PHE   A  8   ? 0.33876762 0.37904289 0.30013296 -0.10013847 -0.11716543 -0.00243458 63   PHE   A HB3  
109   H  HD1  . PHE   A  8   ? 0.37087888 0.41663641 0.33358532 -0.08886801 -0.12109856 0.00230947  63   PHE   A HD1  
110   H  HD2  . PHE   A  8   ? 0.40779725 0.44037962 0.34689844 -0.10080432 -0.13454199 -0.00546890 63   PHE   A HD2  
111   H  HE1  . PHE   A  8   ? 0.39891618 0.43742335 0.34709519 -0.08119250 -0.12796764 0.00591145  63   PHE   A HE1  
112   H  HE2  . PHE   A  8   ? 0.43359876 0.46032345 0.35727447 -0.09292186 -0.14103916 -0.00174988 63   PHE   A HE2  
113   H  HZ   . PHE   A  8   ? 0.42464954 0.45370209 0.35288298 -0.08341538 -0.13777420 0.00440011  63   PHE   A HZ   
114   N  N    . GLU   A  9   ? 0.39216754 0.46957150 0.39405119 -0.11250587 -0.12540656 -0.00780427 64   GLU   A N    
115   C  CA   . GLU   A  9   ? 0.51522917 0.59847510 0.52705705 -0.11911666 -0.12165572 -0.00909215 64   GLU   A CA   
116   C  C    . GLU   A  9   ? 0.46959522 0.55236059 0.48479778 -0.11691688 -0.11305099 -0.00671686 64   GLU   A C    
117   O  O    . GLU   A  9   ? 0.40809840 0.49510619 0.42682323 -0.11050991 -0.11157365 -0.00473481 64   GLU   A O    
118   C  CB   . GLU   A  9   ? 0.48778328 0.58937871 0.51656389 -0.12175199 -0.12619844 -0.01080259 64   GLU   A CB   
119   C  CG   . GLU   A  9   ? 0.69111478 0.80532193 0.73093516 -0.11450650 -0.12695068 -0.00930326 64   GLU   A CG   
120   C  CD   . GLU   A  9   ? 0.85032117 0.98318315 0.90642357 -0.11563412 -0.13302901 -0.01136846 64   GLU   A CD   
121   O  OE1  . GLU   A  9   ? 0.56730759 0.70459878 0.62749380 -0.12317323 -0.13606095 -0.01392263 64   GLU   A OE1  
122   O  OE2  . GLU   A  9   ? 0.60323852 0.74615133 0.66806054 -0.10894355 -0.13503717 -0.01058083 64   GLU   A OE2  
123   H  H    . GLU   A  9   ? 0.41060847 0.49414229 0.41580737 -0.11074369 -0.13049431 -0.00811058 64   GLU   A H    
124   H  HA   . GLU   A  9   ? 0.48221630 0.55773306 0.48747432 -0.12347867 -0.12160927 -0.01043057 64   GLU   A HA   
125   H  HB2  . GLU   A  9   ? 0.53204197 0.63716322 0.56691599 -0.12659913 -0.12304935 -0.01146528 64   GLU   A HB2  
126   H  HB3  . GLU   A  9   ? 0.54034710 0.64224541 0.56699997 -0.12367442 -0.13196497 -0.01244564 64   GLU   A HB3  
127   H  HG2  . GLU   A  9   ? 0.65798992 0.76658130 0.69039112 -0.10951199 -0.12899435 -0.00805443 64   GLU   A HG2  
128   H  HG3  . GLU   A  9   ? 0.65170139 0.76737040 0.69536388 -0.11353096 -0.12124312 -0.00814738 64   GLU   A HG3  
129   N  N    . LEU   A  10  ? 0.49564010 0.57266259 0.50929630 -0.12245554 -0.10783922 -0.00699696 65   LEU   A N    
130   C  CA   . LEU   A  10  ? 0.48056602 0.55499351 0.49513543 -0.12117884 -0.09984659 -0.00477527 65   LEU   A CA   
131   C  C    . LEU   A  10  ? 0.61947876 0.70975137 0.65026706 -0.12264252 -0.09714044 -0.00458580 65   LEU   A C    
132   O  O    . LEU   A  10  ? 1.04476762 1.13868070 1.07938695 -0.11789472 -0.09286574 -0.00276607 65   LEU   A O    
133   C  CB   . LEU   A  10  ? 0.42827392 0.48877949 0.43327057 -0.12628588 -0.09615409 -0.00506886 65   LEU   A CB   
134   C  CG   . LEU   A  10  ? 0.45166266 0.49604717 0.44041574 -0.12277196 -0.09612143 -0.00485644 65   LEU   A CG   
135   C  CD1  . LEU   A  10  ? 0.48847795 0.51962495 0.46883988 -0.12726527 -0.09306508 -0.00559243 65   LEU   A CD1  
136   C  CD2  . LEU   A  10  ? 0.41916341 0.46145046 0.40473497 -0.11488234 -0.09240000 -0.00202664 65   LEU   A CD2  
137   H  H    . LEU   A  10  ? 0.49282512 0.56708050 0.50446182 -0.12730005 -0.10959123 -0.00862778 65   LEU   A H    
138   H  HA   . LEU   A  10  ? 0.48865390 0.55958784 0.49886972 -0.11578225 -0.09872876 -0.00325044 65   LEU   A HA   
139   H  HB2  . LEU   A  10  ? 0.45065185 0.51230872 0.45747212 -0.13163729 -0.09852175 -0.00681720 65   LEU   A HB2  
140   H  HB3  . LEU   A  10  ? 0.44130993 0.50215769 0.44901204 -0.12681668 -0.09129641 -0.00374943 65   LEU   A HB3  
141   H  HG   . LEU   A  10  ? 0.45420307 0.49814790 0.43963391 -0.12247047 -0.10093095 -0.00620340 65   LEU   A HG   
142   H  HD11 . LEU   A  10  ? 0.48293710 0.50498039 0.45357594 -0.12513730 -0.09366111 -0.00608046 65   LEU   A HD11 
143   H  HD12 . LEU   A  10  ? 0.47352493 0.50366473 0.45550805 -0.12699276 -0.08843672 -0.00399195 65   LEU   A HD12 
144   H  HD13 . LEU   A  10  ? 0.48394290 0.51642931 0.46680152 -0.13258547 -0.09519190 -0.00723108 65   LEU   A HD13 
145   H  HD21 . LEU   A  10  ? 0.42500275 0.47247946 0.41262916 -0.11159365 -0.09543903 -0.00177118 65   LEU   A HD21 
146   H  HD22 . LEU   A  10  ? 0.42007333 0.46578443 0.41100281 -0.11475289 -0.08844457 -0.00075670 65   LEU   A HD22 
147   H  HD23 . LEU   A  10  ? 0.42775989 0.46001676 0.40380216 -0.11351048 -0.09108226 -0.00185252 65   LEU   A HD23 
148   N  N    . GLN   A  11  ? 0.75563836 0.85575950 0.79598993 -0.12928925 -0.09971004 -0.00670815 66   GLN   A N    
149   C  CA   . GLN   A  11  ? 0.97762895 1.09561360 1.03480291 -0.13065533 -0.09790745 -0.00712827 66   GLN   A CA   
150   C  C    . GLN   A  11  ? 0.75749147 0.88858247 0.82374555 -0.12461020 -0.10373440 -0.00798405 66   GLN   A C    
151   O  O    . GLN   A  11  ? 0.71509331 0.85300386 0.78580230 -0.12682487 -0.11068679 -0.01010781 66   GLN   A O    
152   C  CB   . GLN   A  11  ? 0.96871853 1.09264946 1.03308105 -0.14083807 -0.09787151 -0.00896693 66   GLN   A CB   
153   C  CG   . GLN   A  11  ? 1.11444557 1.22620535 1.17125142 -0.14627419 -0.09124419 -0.00751923 66   GLN   A CG   
154   C  CD   . GLN   A  11  ? 1.39692402 1.51556742 1.46203601 -0.15648656 -0.08965936 -0.00858860 66   GLN   A CD   
155   O  OE1  . GLN   A  11  ? 1.25947630 1.39386809 1.33759391 -0.16005394 -0.09313846 -0.01067573 66   GLN   A OE1  
156   N  NE2  . GLN   A  11  ? 1.48234558 1.58921349 1.54007649 -0.16154376 -0.08442578 -0.00706007 66   GLN   A NE2  
157   H  H    . GLN   A  11  ? 0.76819408 0.86399889 0.80457962 -0.13321562 -0.10255741 -0.00807328 66   GLN   A H    
158   H  HA   . GLN   A  11  ? 0.87557209 0.99304366 0.93337750 -0.12873375 -0.09263535 -0.00558900 66   GLN   A HA   
159   H  HB2  . GLN   A  11  ? 1.00681615 1.12892902 1.06870580 -0.14329219 -0.10297748 -0.01054957 66   GLN   A HB2  
160   H  HB3  . GLN   A  11  ? 0.99826634 1.13592458 1.07472420 -0.14151041 -0.09730230 -0.00957316 66   GLN   A HB3  
161   H  HG2  . GLN   A  11  ? 1.12830913 1.23941159 1.18486142 -0.14287570 -0.08659350 -0.00576395 66   GLN   A HG2  
162   H  HG3  . GLN   A  11  ? 1.13826239 1.23714840 1.18397868 -0.14634627 -0.09249023 -0.00750290 66   GLN   A HG3  
163   H  HE21 . GLN   A  11  ? 1.45337975 1.54928410 1.50206673 -0.15865733 -0.08244498 -0.00572700 66   GLN   A HE21 
164   H  HE22 . GLN   A  11  ? 1.45765543 1.56762409 1.51951528 -0.16781901 -0.08302277 -0.00732348 66   GLN   A HE22 
165   N  N    . GLU   A  12  ? 0.71344894 0.84679151 0.78150249 -0.11675539 -0.10115001 -0.00627714 67   GLU   A N    
166   C  CA   . GLU   A  12  ? 0.65930825 0.80428964 0.73625630 -0.10987438 -0.10588396 -0.00673914 67   GLU   A CA   
167   C  C    . GLU   A  12  ? 1.04764628 1.21335793 1.14367998 -0.11278174 -0.10678178 -0.00911110 67   GLU   A C    
168   O  O    . GLU   A  12  ? 1.15770423 1.32991433 1.26116323 -0.11724859 -0.10042284 -0.00938953 67   GLU   A O    
169   C  CB   . GLU   A  12  ? 1.02011585 1.16187263 1.09492624 -0.10192072 -0.10144748 -0.00450780 67   GLU   A CB   
170   C  CG   . GLU   A  12  ? 1.14698398 1.29842484 1.22983837 -0.09380078 -0.10590789 -0.00472391 67   GLU   A CG   
171   C  CD   . GLU   A  12  ? 1.08696449 1.24107170 1.17403889 -0.08777440 -0.10025913 -0.00364825 67   GLU   A CD   
172   O  OE1  . GLU   A  12  ? 0.82755578 0.96864402 0.90354806 -0.08564894 -0.09577328 -0.00140118 67   GLU   A OE1  
173   O  OE2  . GLU   A  12  ? 1.14436388 1.31406152 1.24618137 -0.08502624 -0.10049000 -0.00532792 67   GLU   A OE2  
174   H  H    . GLU   A  12  ? 0.71296358 0.83979958 0.77623838 -0.11557054 -0.09637054 -0.00477638 67   GLU   A H    
175   H  HA   . GLU   A  12  ? 0.79531026 0.93657023 0.86703026 -0.10840835 -0.11142971 -0.00700256 67   GLU   A HA   
176   H  HB2  . GLU   A  12  ? 0.94316590 1.07239223 1.00629938 -0.10047888 -0.10077608 -0.00303967 67   GLU   A HB2  
177   H  HB3  . GLU   A  12  ? 0.93678802 1.08158016 1.01579595 -0.10360713 -0.09592951 -0.00431482 67   GLU   A HB3  
178   H  HG2  . GLU   A  12  ? 1.10235620 1.26572394 1.19566333 -0.09525754 -0.10896414 -0.00655732 67   GLU   A HG2  
179   H  HG3  . GLU   A  12  ? 1.09698820 1.24119091 1.17186713 -0.09075737 -0.11009259 -0.00387301 67   GLU   A HG3  
180   N  N    . VAL   A  13  ? 1.19708443 1.37336957 1.30088425 -0.11018529 -0.11473116 -0.01077228 68   VAL   A N    
181   C  CA   . VAL   A  13  ? 0.89934903 1.09727263 1.02274811 -0.11191266 -0.11644085 -0.01334762 68   VAL   A CA   
182   C  C    . VAL   A  13  ? 1.00076842 1.20930421 1.13462317 -0.10351604 -0.11363745 -0.01317065 68   VAL   A C    
183   O  O    . VAL   A  13  ? 0.95110714 1.15244913 1.07845938 -0.09498771 -0.11550818 -0.01153342 68   VAL   A O    
184   C  CB   . VAL   A  13  ? 0.90263510 1.10772681 1.03021622 -0.11281583 -0.12695421 -0.01544452 68   VAL   A CB   
185   C  CG1  . VAL   A  13  ? 1.39098752 1.62026227 1.54046297 -0.11499655 -0.12888916 -0.01841786 68   VAL   A CG1  
186   C  CG2  . VAL   A  13  ? 0.86105621 1.05379188 0.97653198 -0.12085494 -0.12972015 -0.01595272 68   VAL   A CG2  
187   H  H    . VAL   A  13  ? 1.07913256 1.24916184 1.17580342 -0.10715208 -0.11930409 -0.01028321 68   VAL   A H    
188   H  HA   . VAL   A  13  ? 0.97225320 1.17337823 1.09944689 -0.11829466 -0.11250903 -0.01399191 68   VAL   A HA   
189   H  HB   . VAL   A  13  ? 0.96962696 1.17134714 1.09309292 -0.10629392 -0.13101056 -0.01457534 68   VAL   A HB   
190   H  HG11 . VAL   A  13  ? 1.21472144 1.44801593 1.36885357 -0.12099512 -0.12381447 -0.01898660 68   VAL   A HG11 
191   H  HG12 . VAL   A  13  ? 1.20679748 1.44364738 1.36348081 -0.10863358 -0.12858607 -0.01842899 68   VAL   A HG12 
192   H  HG13 . VAL   A  13  ? 1.21698344 1.45015752 1.36853695 -0.11680701 -0.13553381 -0.01980460 68   VAL   A HG13 
193   H  HG21 . VAL   A  13  ? 0.88297945 1.08130062 1.00184727 -0.12198459 -0.13632186 -0.01751972 68   VAL   A HG21 
194   H  HG22 . VAL   A  13  ? 0.88067532 1.05912352 0.98272574 -0.11856011 -0.12929291 -0.01434515 68   VAL   A HG22 
195   H  HG23 . VAL   A  13  ? 0.87628394 1.06966233 0.99386549 -0.12719430 -0.12538324 -0.01640528 68   VAL   A HG23 
196   N  N    . GLY   A  14  ? 1.11994720 1.34538722 1.26974416 -0.10630997 -0.10896222 -0.01499283 69   GLY   A N    
197   C  CA   . GLY   A  14  ? 1.08032274 1.31765079 1.24157965 -0.09884640 -0.10573900 -0.01567075 69   GLY   A CA   
198   C  C    . GLY   A  14  ? 1.18446147 1.43563521 1.35780776 -0.09170447 -0.11409749 -0.01762927 69   GLY   A C    
199   O  O    . GLY   A  14  ? 0.78608966 1.03849125 0.95921832 -0.09304652 -0.12265939 -0.01837376 69   GLY   A O    
200   H  H    . GLY   A  14  ? 1.08042979 1.31005192 1.23392403 -0.11324323 -0.10762457 -0.01595281 69   GLY   A H    
201   H  HA2  . GLY   A  14  ? 1.10542417 1.33232784 1.25802696 -0.09445116 -0.10294310 -0.01382683 69   GLY   A HA2  
202   H  HA3  . GLY   A  14  ? 1.10682189 1.35341263 1.27647352 -0.10275421 -0.10056663 -0.01672981 69   GLY   A HA3  
203   N  N    . PRO   A  15  ? 1.15453470 1.41604519 1.33837330 -0.08355137 -0.11210258 -0.01862628 70   PRO   A N    
204   C  CA   . PRO   A  15  ? 0.72573203 1.00010133 0.92147553 -0.07563792 -0.12018638 -0.02049235 70   PRO   A CA   
205   C  C    . PRO   A  15  ? 0.89709955 1.19627464 1.11421597 -0.07991356 -0.12169899 -0.02433108 70   PRO   A C    
206   O  O    . PRO   A  15  ? 0.63856113 0.94879246 0.86513245 -0.08604193 -0.11394938 -0.02588632 70   PRO   A O    
207   C  CB   . PRO   A  15  ? 0.84145117 1.11481857 1.03856230 -0.06544740 -0.11646226 -0.02015685 70   PRO   A CB   
208   C  CG   . PRO   A  15  ? 0.79444170 1.06496656 0.98899633 -0.07006313 -0.10472256 -0.01971414 70   PRO   A CG   
209   C  CD   . PRO   A  15  ? 1.02125919 1.28181279 1.20533144 -0.08124200 -0.10236027 -0.01814874 70   PRO   A CD   
210   H  HA   . PRO   A  15  ? 0.85454154 1.12070096 1.04230523 -0.07402404 -0.12667646 -0.01933150 70   PRO   A HA   
211   H  HB2  . PRO   A  15  ? 0.80370051 1.09104776 1.01402986 -0.06105834 -0.11856182 -0.02238096 70   PRO   A HB2  
212   H  HB3  . PRO   A  15  ? 0.80600393 1.06628621 0.99203610 -0.06078883 -0.11932939 -0.01803861 70   PRO   A HB3  
213   H  HG2  . PRO   A  15  ? 0.84750491 1.13265514 1.05496645 -0.07050914 -0.10134023 -0.02202789 70   PRO   A HG2  
214   H  HG3  . PRO   A  15  ? 0.84885293 1.10911012 1.03533316 -0.06540011 -0.10229719 -0.01816525 70   PRO   A HG3  
215   H  HD2  . PRO   A  15  ? 0.98982388 1.25867248 1.18066955 -0.08680809 -0.09740927 -0.01929116 70   PRO   A HD2  
216   H  HD3  . PRO   A  15  ? 0.99225354 1.23771918 1.16315806 -0.08099341 -0.09992331 -0.01582113 70   PRO   A HD3  
217   N  N    . PRO   A  16  ? 0.85266101 1.16141808 1.07787561 -0.07644045 -0.13197409 -0.02586382 71   PRO   A N    
218   C  CA   . PRO   A  16  ? 0.86822462 1.16354656 1.08156991 -0.06845811 -0.14071873 -0.02368826 71   PRO   A CA   
219   C  C    . PRO   A  16  ? 1.22602069 1.51103795 1.42743421 -0.07383519 -0.14873548 -0.02257481 71   PRO   A C    
220   O  O    . PRO   A  16  ? 1.44966626 1.73185265 1.64760327 -0.06802223 -0.15835845 -0.02192524 71   PRO   A O    
221   C  CB   . PRO   A  16  ? 0.91553587 1.23001742 1.14737594 -0.05956267 -0.14672974 -0.02638173 71   PRO   A CB   
222   C  CG   . PRO   A  16  ? 1.02832234 1.36801505 1.28144121 -0.06756239 -0.14562392 -0.03045845 71   PRO   A CG   
223   C  CD   . PRO   A  16  ? 0.68842345 1.02210808 0.93509376 -0.07930245 -0.13590029 -0.02971211 71   PRO   A CD   
224   H  HA   . PRO   A  16  ? 0.92560804 1.20817089 1.12860262 -0.06455211 -0.13743377 -0.02157157 71   PRO   A HA   
225   H  HB2  . PRO   A  16  ? 0.93743545 1.24825931 1.16555572 -0.05569046 -0.15481888 -0.02563493 71   PRO   A HB2  
226   H  HB3  . PRO   A  16  ? 0.92546904 1.24070036 1.15995073 -0.05351022 -0.14293320 -0.02647175 71   PRO   A HB3  
227   H  HG2  . PRO   A  16  ? 0.91790122 1.26213098 1.17378557 -0.06941292 -0.15300986 -0.03122181 71   PRO   A HG2  
228   H  HG3  . PRO   A  16  ? 0.91031700 1.26419640 1.17727828 -0.06324956 -0.14371058 -0.03261990 71   PRO   A HG3  
229   H  HD2  . PRO   A  16  ? 0.79177469 1.12529683 1.03688025 -0.08636764 -0.13882598 -0.02997231 71   PRO   A HD2  
230   H  HD3  . PRO   A  16  ? 0.78425252 1.12960076 1.04158449 -0.08094301 -0.12971543 -0.03137768 71   PRO   A HD3  
231   N  N    . ASP   A  17  ? 1.17261529 1.45106483 1.36679697 -0.08464996 -0.14518800 -0.02235801 72   ASP   A N    
232   C  CA   . ASP   A  17  ? 0.94470608 1.21392393 1.12789774 -0.08967154 -0.15291983 -0.02199315 72   ASP   A CA   
233   C  C    . ASP   A  17  ? 0.85890985 1.10375190 1.01934779 -0.08529401 -0.15366271 -0.01835424 72   ASP   A C    
234   O  O    . ASP   A  17  ? 0.95592821 1.18908906 1.10747170 -0.08383267 -0.14570746 -0.01622492 72   ASP   A O    
235   C  CB   . ASP   A  17  ? 0.88638198 1.15615070 1.06944919 -0.10244515 -0.14965273 -0.02332359 72   ASP   A CB   
236   C  CG   . ASP   A  17  ? 0.86578190 1.16044474 1.07173491 -0.10768948 -0.14834593 -0.02679359 72   ASP   A CG   
237   O  OD1  . ASP   A  17  ? 0.83953100 1.14627182 1.05791152 -0.10422232 -0.14195579 -0.02752769 72   ASP   A OD1  
238   O  OD2  . ASP   A  17  ? 0.55424362 0.85650265 0.76559389 -0.11560067 -0.15362917 -0.02895746 72   ASP   A OD2  
239   H  H    . ASP   A  17  ? 1.11870372 1.39784193 1.31424069 -0.08878561 -0.13813159 -0.02246704 72   ASP   A H    
240   H  HA   . ASP   A  17  ? 0.95951909 1.23805845 1.15012288 -0.08714688 -0.16028066 -0.02331125 72   ASP   A HA   
241   H  HB2  . ASP   A  17  ? 0.89835161 1.15830839 1.07361782 -0.10481063 -0.14278981 -0.02190212 72   ASP   A HB2  
242   H  HB3  . ASP   A  17  ? 0.90007192 1.16331851 1.07546759 -0.10530939 -0.15517250 -0.02336591 72   ASP   A HB3  
243   N  N    . CYS   A  18  ? 0.67121488 0.90921903 0.82259309 -0.08305893 -0.16338068 -0.01767974 73   CYS   A N    
244   C  CA   . CYS   A  18  ? 0.60271025 0.81950003 0.73348552 -0.07809033 -0.16476852 -0.01422381 73   CYS   A CA   
245   C  C    . CYS   A  18  ? 0.68469977 0.88378108 0.79905260 -0.08471489 -0.15762572 -0.01280088 73   CYS   A C    
246   O  O    . CYS   A  18  ? 0.59040344 0.79164469 0.70693874 -0.09370616 -0.15449843 -0.01453220 73   CYS   A O    
247   C  CB   . CYS   A  18  ? 0.53459096 0.74849093 0.65875995 -0.07538230 -0.17669199 -0.01392134 73   CYS   A CB   
248   S  SG   . CYS   A  18  ? 0.69474936 0.90818250 0.81428736 -0.08639172 -0.18244386 -0.01641364 73   CYS   A SG   
249   H  H    . CYS   A  18  ? 0.69998115 0.94686258 0.85798478 -0.08488563 -0.16925056 -0.01940032 73   CYS   A H    
250   H  HA   . CYS   A  18  ? 0.61280185 0.82883883 0.74485207 -0.07175250 -0.16245240 -0.01299352 73   CYS   A HA   
251   H  HB2  . CYS   A  18  ? 0.57865149 0.77894467 0.68938553 -0.07177737 -0.17721613 -0.01144776 73   CYS   A HB2  
252   H  HB3  . CYS   A  18  ? 0.57818472 0.80369067 0.71352983 -0.07075636 -0.18126535 -0.01481248 73   CYS   A HB3  
253   N  N    . ARG   A  19  ? 0.63807893 0.81965613 0.73632246 -0.08018055 -0.15493345 -0.00963644 74   ARG   A N    
254   C  CA   . ARG   A  19  ? 0.55716431 0.72295755 0.64138830 -0.08486486 -0.14731655 -0.00825942 74   ARG   A CA   
255   C  C    . ARG   A  19  ? 0.47947654 0.62758780 0.54351580 -0.08537885 -0.15130040 -0.00676678 74   ARG   A C    
256   O  O    . ARG   A  19  ? 0.43941453 0.58516544 0.49820781 -0.08059774 -0.15895021 -0.00580187 74   ARG   A O    
257   C  CB   . ARG   A  19  ? 0.50282663 0.66353196 0.58565146 -0.07990374 -0.13894838 -0.00604881 74   ARG   A CB   
258   C  CG   . ARG   A  19  ? 0.58684611 0.76464254 0.68851608 -0.07718781 -0.13534738 -0.00749977 74   ARG   A CG   
259   C  CD   . ARG   A  19  ? 0.54871774 0.72187579 0.64899695 -0.07642079 -0.12523675 -0.00623602 74   ARG   A CD   
260   N  NE   . ARG   A  19  ? 0.79585201 0.95145702 0.88023412 -0.07173030 -0.12336998 -0.00306735 74   ARG   A NE   
261   C  CZ   . ARG   A  19  ? 0.74646050 0.89690840 0.82849252 -0.06875894 -0.11626013 -0.00161261 74   ARG   A CZ   
262   N  NH1  . ARG   A  19  ? 0.82676679 0.98847377 0.92132717 -0.06820529 -0.11077189 -0.00300541 74   ARG   A NH1  
263   N  NH2  . ARG   A  19  ? 0.80897659 0.94299197 0.87569898 -0.06630898 -0.11469045 0.00118118  74   ARG   A NH2  
264   H  H    . ARG   A  19  ? 0.63088667 0.81038040 0.72697622 -0.07400999 -0.15801470 -0.00830149 74   ARG   A H    
265   H  HA   . ARG   A  19  ? 0.54402488 0.71385324 0.63268256 -0.09117870 -0.14471854 -0.00985292 74   ARG   A HA   
266   H  HB2  . ARG   A  19  ? 0.53178573 0.68505442 0.60706484 -0.07464833 -0.14108931 -0.00418029 74   ARG   A HB2  
267   H  HB3  . ARG   A  19  ? 0.53142899 0.68419027 0.60757434 -0.08367128 -0.13364539 -0.00551290 74   ARG   A HB3  
268   H  HG2  . ARG   A  19  ? 0.55693078 0.74530256 0.66816896 -0.08188035 -0.13576786 -0.00962343 74   ARG   A HG2  
269   H  HG3  . ARG   A  19  ? 0.55863214 0.74096221 0.66460538 -0.07116684 -0.13956234 -0.00736831 74   ARG   A HG3  
270   H  HD2  . ARG   A  19  ? 0.60737509 0.77962136 0.70705098 -0.08252403 -0.12108049 -0.00675121 74   ARG   A HD2  
271   H  HD3  . ARG   A  19  ? 0.60419238 0.78773594 0.71549881 -0.07327762 -0.12375735 -0.00718409 74   ARG   A HD3  
272   H  HE   . ARG   A  19  ? 0.71950579 0.86759531 0.79522800 -0.07098652 -0.12723334 -0.00209192 74   ARG   A HE   
273   H  HH11 . ARG   A  19  ? 0.79448324 0.96724540 0.89958370 -0.06607772 -0.11277370 -0.00451840 74   ARG   A HH11 
274   H  HH12 . ARG   A  19  ? 0.79571736 0.95390660 0.88792169 -0.06983815 -0.10512417 -0.00246370 74   ARG   A HH12 
275   H  HH21 . ARG   A  19  ? 0.78609264 0.91739053 0.85189396 -0.06304871 -0.11153050 0.00215656  74   ARG   A HH21 
276   H  HH22 . ARG   A  19  ? 0.79005969 0.91619563 0.84770578 -0.06806895 -0.11674544 0.00193927  74   ARG   A HH22 
277   N  N    . CYS   A  20  ? 0.56061268 0.69636065 0.61330980 -0.09113348 -0.14589639 -0.00664137 75   CYS   A N    
278   C  CA   . CYS   A  20  ? 0.44401902 0.56256878 0.47710428 -0.09202494 -0.14770788 -0.00564895 75   CYS   A CA   
279   C  C    . CYS   A  20  ? 0.48917931 0.59380281 0.51132077 -0.09255353 -0.13869578 -0.00387846 75   CYS   A C    
280   O  O    . CYS   A  20  ? 0.47156698 0.56292760 0.47924131 -0.09546392 -0.13791825 -0.00401000 75   CYS   A O    
281   C  CB   . CYS   A  20  ? 0.52728307 0.64569187 0.55773151 -0.09958725 -0.15249288 -0.00859261 75   CYS   A CB   
282   S  SG   . CYS   A  20  ? 0.43811440 0.57572949 0.48445377 -0.10035123 -0.16293174 -0.01121871 75   CYS   A SG   
283   H  H    . CYS   A  20  ? 0.50281745 0.64116740 0.56034648 -0.09464580 -0.14079526 -0.00730840 75   CYS   A H    
284   H  HA   . CYS   A  20  ? 0.49144265 0.60744631 0.51983339 -0.08723488 -0.15197305 -0.00428684 75   CYS   A HA   
285   H  HB2  . CYS   A  20  ? 0.48632044 0.60437417 0.51890838 -0.10454417 -0.14798999 -0.00963807 75   CYS   A HB2  
286   H  HB3  . CYS   A  20  ? 0.49551398 0.60312778 0.51279813 -0.09949274 -0.15444969 -0.00817671 75   CYS   A HB3  
287   N  N    . ASP   A  21  ? 0.36570466 0.47381559 0.39504176 -0.08962286 -0.13202493 -0.00250572 76   ASP   A N    
288   C  CA   . ASP   A  21  ? 0.45153102 0.54862612 0.47294113 -0.09045825 -0.12348089 -0.00101376 76   ASP   A CA   
289   C  C    . ASP   A  21  ? 0.39977306 0.48539704 0.40892959 -0.08409287 -0.12278587 0.00197390  76   ASP   A C    
290   O  O    . ASP   A  21  ? 0.38294554 0.46900493 0.38995206 -0.07928965 -0.12871511 0.00305117  76   ASP   A O    
291   C  CB   . ASP   A  21  ? 0.40163594 0.50802058 0.43607584 -0.09118792 -0.11669707 -0.00113705 76   ASP   A CB   
292   C  CG   . ASP   A  21  ? 0.47385919 0.58929938 0.51791149 -0.08401029 -0.11701752 -0.00016155 76   ASP   A CG   
293   O  OD1  . ASP   A  21  ? 0.52691388 0.65501791 0.58205086 -0.08226182 -0.12265049 -0.00158406 76   ASP   A OD1  
294   O  OD2  . ASP   A  21  ? 0.42436850 0.53404671 0.46482432 -0.07994516 -0.11189828 0.00186330  76   ASP   A OD2  
295   H  H    . ASP   A  21  ? 0.40712571 0.52469206 0.44641715 -0.08680337 -0.13297610 -0.00258239 76   ASP   A H    
296   H  HA   . ASP   A  21  ? 0.41875425 0.50963408 0.43391293 -0.09497140 -0.12268904 -0.00195710 76   ASP   A HA   
297   H  HB2  . ASP   A  21  ? 0.42406297 0.52291983 0.45292974 -0.09209779 -0.11139129 -0.00017252 76   ASP   A HB2  
298   H  HB3  . ASP   A  21  ? 0.42703333 0.54098064 0.46914193 -0.09567047 -0.11722708 -0.00294383 76   ASP   A HB3  
299   N  N    . ASN   A  22  ? 0.36236361 0.43768132 0.36349750 -0.08433016 -0.11566481 0.00339460  77   ASN   A N    
300   C  CA   . ASN   A  22  ? 0.39138085 0.45554534 0.38076305 -0.07953341 -0.11381030 0.00617466  77   ASN   A CA   
301   C  C    . ASN   A  22  ? 0.38890171 0.45722479 0.38338476 -0.07270342 -0.11506337 0.00821441  77   ASN   A C    
302   O  O    . ASN   A  22  ? 0.36232883 0.42212194 0.34686247 -0.06878113 -0.11629980 0.01058379  77   ASN   A O    
303   C  CB   . ASN   A  22  ? 0.38203073 0.43807092 0.36641821 -0.08065247 -0.10538820 0.00716159  77   ASN   A CB   
304   C  CG   . ASN   A  22  ? 0.40768683 0.45456284 0.38252240 -0.08561433 -0.10347509 0.00581087  77   ASN   A CG   
305   O  OD1  . ASN   A  22  ? 0.35279718 0.40062076 0.32689828 -0.08989845 -0.10754998 0.00346052  77   ASN   A OD1  
306   N  ND2  . ASN   A  22  ? 0.31829739 0.35627699 0.28614411 -0.08518986 -0.09730116 0.00699299  77   ASN   A ND2  
307   H  H    . ASN   A  22  ? 0.37470263 0.45003313 0.37786752 -0.08784390 -0.11184320 0.00261369  77   ASN   A H    
308   H  HA   . ASN   A  22  ? 0.39203709 0.45001525 0.37217024 -0.07984130 -0.11700026 0.00623269  77   ASN   A HA   
309   H  HB2  . ASN   A  22  ? 0.38144585 0.44341129 0.37438965 -0.08128734 -0.10228143 0.00684915  77   ASN   A HB2  
310   H  HB3  . ASN   A  22  ? 0.38600284 0.43694657 0.36511505 -0.07715177 -0.10415905 0.00905299  77   ASN   A HB3  
311   H  HD21 . ASN   A  22  ? 0.33673108 0.37535667 0.30685553 -0.08285795 -0.09432001 0.00837833  77   ASN   A HD21 
312   H  HD22 . ASN   A  22  ? 0.34346569 0.37503603 0.30454281 -0.08714577 -0.09630460 0.00627543  77   ASN   A HD22 
313   N  N    . LEU   A  23  ? 0.38423896 0.46512762 0.39385223 -0.07152481 -0.11414456 0.00721681  78   LEU   A N    
314   C  CA   . LEU   A  23  ? 0.36809069 0.45269161 0.38351804 -0.06486747 -0.11408654 0.00862593  78   LEU   A CA   
315   C  C    . LEU   A  23  ? 0.43999815 0.53628498 0.46605110 -0.06127155 -0.12159907 0.00751850  78   LEU   A C    
316   O  O    . LEU   A  23  ? 0.39912704 0.49997231 0.43204990 -0.05529950 -0.12208540 0.00807845  78   LEU   A O    
317   C  CB   . LEU   A  23  ? 0.38444322 0.47410190 0.40860295 -0.06536973 -0.10628899 0.00812489  78   LEU   A CB   
318   C  CG   . LEU   A  23  ? 0.38015503 0.45832527 0.39481613 -0.06570126 -0.09916236 0.01002696  78   LEU   A CG   
319   C  CD1  . LEU   A  23  ? 0.38566443 0.47023511 0.40965471 -0.06548879 -0.09273806 0.00944882  78   LEU   A CD1  
320   C  CD2  . LEU   A  23  ? 0.42509601 0.49279851 0.42940736 -0.06053664 -0.10026015 0.01281745  78   LEU   A CD2  
321   H  H    . LEU   A  23  ? 0.37924024 0.46645221 0.39565098 -0.07505243 -0.11336121 0.00549517  78   LEU   A H    
322   H  HA   . LEU   A  23  ? 0.39010012 0.46585813 0.39643788 -0.06225667 -0.11411288 0.01063285  78   LEU   A HA   
323   H  HB2  . LEU   A  23  ? 0.37761581 0.47334567 0.40769857 -0.06952588 -0.10516758 0.00641191  78   LEU   A HB2  
324   H  HB3  . LEU   A  23  ? 0.37683088 0.47247821 0.40818256 -0.06137177 -0.10705000 0.00803565  78   LEU   A HB3  
325   H  HG   . LEU   A  23  ? 0.39161891 0.46481454 0.40052274 -0.06969584 -0.09783003 0.00976643  78   LEU   A HG   
326   H  HD11 . LEU   A  23  ? 0.38001686 0.45761174 0.39810151 -0.06625612 -0.08850946 0.01052069  78   LEU   A HD11 
327   H  HD12 . LEU   A  23  ? 0.38276961 0.47117430 0.41155362 -0.06117374 -0.09366008 0.00958306  78   LEU   A HD12 
328   H  HD13 . LEU   A  23  ? 0.38048983 0.47224107 0.41138816 -0.06894850 -0.09195139 0.00781785  78   LEU   A HD13 
329   H  HD21 . LEU   A  23  ? 0.41723359 0.47928181 0.41349590 -0.06131800 -0.10327960 0.01340169  78   LEU   A HD21 
330   H  HD22 . LEU   A  23  ? 0.41232860 0.48399913 0.42151237 -0.05647084 -0.10269291 0.01304090  78   LEU   A HD22 
331   H  HD23 . LEU   A  23  ? 0.40867099 0.47123647 0.40936214 -0.06060562 -0.09554832 0.01377586  78   LEU   A HD23 
332   N  N    . CYS   A  24  ? 0.35659704 0.45760265 0.38404000 -0.06459790 -0.12777704 0.00577903  79   CYS   A N    
333   C  CA   . CYS   A  24  ? 0.38007849 0.49430871 0.41976231 -0.06134926 -0.13504770 0.00437999  79   CYS   A CA   
334   C  C    . CYS   A  24  ? 0.33211011 0.44080585 0.36615831 -0.05346794 -0.14071515 0.00693928  79   CYS   A C    
335   O  O    . CYS   A  24  ? 0.46998036 0.58837724 0.51527315 -0.04787919 -0.14455484 0.00640698  79   CYS   A O    
336   C  CB   . CYS   A  24  ? 0.36421317 0.48492032 0.40663385 -0.06684437 -0.14115649 0.00189772  79   CYS   A CB   
337   S  SG   . CYS   A  24  ? 0.40996170 0.51645821 0.43283200 -0.06812740 -0.14824964 0.00313576  79   CYS   A SG   
338   H  H    . CYS   A  24  ? 0.38300937 0.47913581 0.40396261 -0.06870230 -0.12766938 0.00533871  79   CYS   A H    
339   H  HA   . CYS   A  24  ? 0.35568699 0.47913694 0.40670985 -0.06059708 -0.13213742 0.00322979  79   CYS   A HA   
340   H  HB2  . CYS   A  24  ? 0.37659615 0.50833791 0.42975903 -0.06481784 -0.14523709 0.00068474  79   CYS   A HB2  
341   H  HB3  . CYS   A  24  ? 0.37369028 0.49628961 0.41862372 -0.07208611 -0.13723898 0.00051438  79   CYS   A HB3  
342   N  N    . LYS   A  25  ? 0.44965941 0.54264832 0.46615663 -0.05298970 -0.14134629 0.00970187  80   LYS   A N    
343   C  CA   . LYS   A  25  ? 0.47967178 0.56528491 0.48869729 -0.04630793 -0.14651856 0.01269788  80   LYS   A CA   
344   C  C    . LYS   A  25  ? 0.66143626 0.74737608 0.67634988 -0.04026689 -0.14262410 0.01391015  80   LYS   A C    
345   O  O    . LYS   A  25  ? 0.67568707 0.76317322 0.69387352 -0.03366711 -0.14816807 0.01492541  80   LYS   A O    
346   C  CB   . LYS   A  25  ? 0.45692098 0.52550638 0.44533274 -0.04788887 -0.14647418 0.01552518  80   LYS   A CB   
347   C  CG   . LYS   A  25  ? 0.51537907 0.58180201 0.49546880 -0.05274570 -0.15153854 0.01433448  80   LYS   A CG   
348   C  CD   . LYS   A  25  ? 0.57043505 0.64041770 0.55055922 -0.04960879 -0.16249423 0.01465416  80   LYS   A CD   
349   C  CE   . LYS   A  25  ? 0.67504478 0.73152554 0.63922757 -0.04550496 -0.16630910 0.01873881  80   LYS   A CE   
350   N  NZ   . LYS   A  25  ? 0.72728908 0.78698909 0.69095564 -0.04263993 -0.17755589 0.01909753  80   LYS   A NZ   
351   H  H    . LYS   A  25  ? 0.42274439 0.50936782 0.43162534 -0.05694026 -0.13849291 0.00973830  80   LYS   A H    
352   H  HA   . LYS   A  25  ? 0.50247765 0.59398717 0.51587880 -0.04451818 -0.15311171 0.01205666  80   LYS   A HA   
353   H  HB2  . LYS   A  25  ? 0.46945953 0.53304720 0.45418555 -0.04991537 -0.14006026 0.01589190  80   LYS   A HB2  
354   H  HB3  . LYS   A  25  ? 0.48131716 0.54463595 0.46481276 -0.04361269 -0.14931913 0.01782790  80   LYS   A HB3  
355   H  HG2  . LYS   A  25  ? 0.50725651 0.57985735 0.49371582 -0.05680519 -0.14967304 0.01185781  80   LYS   A HG2  
356   H  HG3  . LYS   A  25  ? 0.51721495 0.57323903 0.48475668 -0.05435383 -0.14936177 0.01567691  80   LYS   A HG3  
357   H  HD2  . LYS   A  25  ? 0.57540983 0.65508777 0.56788468 -0.04650750 -0.16463086 0.01380512  80   LYS   A HD2  
358   H  HD3  . LYS   A  25  ? 0.58342505 0.65532076 0.56198674 -0.05347218 -0.16532294 0.01290474  80   LYS   A HD3  
359   H  HE2  . LYS   A  25  ? 0.66275537 0.71014404 0.61482030 -0.04855471 -0.16375735 0.01949641  80   LYS   A HE2  
360   H  HE3  . LYS   A  25  ? 0.65645623 0.71077454 0.62228024 -0.04170463 -0.16399635 0.02045649  80   LYS   A HE3  
361   H  HZ1  . LYS   A  25  ? 0.71486509 0.77660322 0.67692924 -0.04632385 -0.17989397 0.01736458  80   LYS   A HZ1  
362   H  HZ2  . LYS   A  25  ? 0.71097726 0.77945495 0.68631846 -0.03940617 -0.18000044 0.01831662  80   LYS   A HZ2  
363   H  HZ3  . LYS   A  25  ? 0.72157425 0.77241564 0.67472869 -0.04040367 -0.17991178 0.02180596  80   LYS   A HZ3  
364   N  N    . SER   A  26  ? 0.55706823 0.64142388 0.57328427 -0.04244852 -0.13351589 0.01361660  81   SER   A N    
365   C  CA   . SER   A  26  ? 0.53855109 0.62274683 0.55965352 -0.03749484 -0.12909748 0.01430821  81   SER   A CA   
366   C  C    . SER   A  26  ? 0.61663955 0.71724719 0.65658569 -0.03413614 -0.12978995 0.01136442  81   SER   A C    
367   O  O    . SER   A  26  ? 0.64089501 0.74208766 0.68551910 -0.02855279 -0.12798846 0.01151963  81   SER   A O    
368   C  CB   . SER   A  26  ? 0.41361931 0.49219486 0.43079111 -0.04113059 -0.11953281 0.01461581  81   SER   A CB   
369   O  OG   . SER   A  26  ? 0.43096462 0.49515969 0.43171811 -0.04360946 -0.11811800 0.01713553  81   SER   A OG   
370   H  H    . SER   A  26  ? 0.56914353 0.65207320 0.58271354 -0.04716534 -0.13012783 0.01290978  81   SER   A H    
371   H  HA   . SER   A  26  ? 0.53627962 0.61294830 0.55069435 -0.03360495 -0.13189743 0.01651669  81   SER   A HA   
372   H  HB2  . SER   A  26  ? 0.43547168 0.52051258 0.45842832 -0.04507405 -0.11683926 0.01269264  81   SER   A HB2  
373   H  HB3  . SER   A  26  ? 0.43842691 0.51721579 0.45898539 -0.03782786 -0.11692747 0.01485976  81   SER   A HB3  
375   N  N    . TYR   A  27  ? 0.50144386 0.61532474 0.55209291 -0.03793406 -0.13180539 0.00845685  82   TYR   A N    
376   C  CA   . TYR   A  27  ? 0.60836363 0.73989666 0.67785567 -0.03489145 -0.13328230 0.00539760  82   TYR   A CA   
377   C  C    . TYR   A  27  ? 0.59007466 0.72791660 0.66423768 -0.03056313 -0.14395939 0.00500903  82   TYR   A C    
378   O  O    . TYR   A  27  ? 0.57752919 0.73128152 0.66811454 -0.02749009 -0.14665546 0.00227879  82   TYR   A O    
379   C  CB   . TYR   A  27  ? 0.70909601 0.85299432 0.78919232 -0.04228108 -0.12833504 0.00235760  82   TYR   A CB   
380   C  CG   . TYR   A  27  ? 0.88343722 1.02737367 0.96568984 -0.04476918 -0.11806280 0.00188010  82   TYR   A CG   
381   C  CD1  . TYR   A  27  ? 0.77604771 0.90474135 0.84489852 -0.04488570 -0.11281633 0.00446112  82   TYR   A CD1  
382   C  CD2  . TYR   A  27  ? 0.99719280 1.15664995 1.09450305 -0.04763736 -0.11365411 -0.00112155 82   TYR   A CD2  
383   C  CE1  . TYR   A  27  ? 0.81007951 0.93863171 0.88033700 -0.04719083 -0.10406325 0.00409529  82   TYR   A CE1  
384   C  CE2  . TYR   A  27  ? 0.83341545 0.99233335 0.93138635 -0.05023600 -0.10448581 -0.00134990 82   TYR   A CE2  
385   C  CZ   . TYR   A  27  ? 0.99541104 1.13862062 1.07966256 -0.04985934 -0.09997729 0.00127797  82   TYR   A CZ   
386   O  OH   . TYR   A  27  ? 1.05987620 1.20266604 1.14456820 -0.05235383 -0.09146550 0.00107671  82   TYR   A OH   
387   H  H    . TYR   A  27  ? 0.55039895 0.66249442 0.59668446 -0.04268734 -0.13209216 0.00823344  82   TYR   A H    
388   H  HA   . TYR   A  27  ? 0.59449029 0.72610563 0.66715175 -0.03069463 -0.13046780 0.00546944  82   TYR   A HA   
389   H  HB2  . TYR   A  27  ? 0.71989208 0.85981655 0.79366452 -0.04714924 -0.12952884 0.00262774  82   TYR   A HB2  
390   H  HB3  . TYR   A  27  ? 0.71905667 0.87555909 0.81118006 -0.04102444 -0.13121863 0.00027174  82   TYR   A HB3  
391   H  HD1  . TYR   A  27  ? 0.80972564 0.92822927 0.86837685 -0.04337186 -0.11530890 0.00651539  82   TYR   A HD1  
392   H  HD2  . TYR   A  27  ? 0.92574918 1.09653068 1.03295064 -0.04790360 -0.11699376 -0.00300926 82   TYR   A HD2  
393   H  HE1  . TYR   A  27  ? 0.83900702 0.95765471 0.90055132 -0.04713995 -0.10091651 0.00579395  82   TYR   A HE1  
394   H  HE2  . TYR   A  27  ? 0.89950687 1.06897593 1.00723565 -0.05236538 -0.10139294 -0.00327869 82   TYR   A HE2  
396   N  N    . SER   A  28  ? 0.69642484 0.82193398 0.75598359 -0.03004074 -0.15012948 0.00776237  83   SER   A N    
397   C  CA   . SER   A  28  ? 0.66799015 0.79830575 0.72971070 -0.02709920 -0.16093253 0.00762495  83   SER   A CA   
398   C  C    . SER   A  28  ? 0.65222907 0.80107039 0.72967696 -0.03138531 -0.16336115 0.00366621  83   SER   A C    
399   O  O    . SER   A  28  ? 0.54658049 0.70753682 0.63573599 -0.02702467 -0.17080742 0.00213097  83   SER   A O    
400   C  CB   . SER   A  28  ? 0.69436526 0.82576460 0.76117468 -0.01702555 -0.16615006 0.00857475  83   SER   A CB   
401   O  OG   . SER   A  28  ? 0.81718278 0.93071812 0.86900604 -0.01364788 -0.16428672 0.01240230  83   SER   A OG   
402   H  H    . SER   A  28  ? 0.66248786 0.77639985 0.71027803 -0.03150731 -0.14762414 0.00979702  83   SER   A H    
403   H  HA   . SER   A  28  ? 0.68309414 0.80333233 0.73196769 -0.02900381 -0.16370250 0.00953253  83   SER   A HA   
404   H  HB2  . SER   A  28  ? 0.70835567 0.85008860 0.78800583 -0.01483514 -0.16337931 0.00636820  83   SER   A HB2  
405   H  HB3  . SER   A  28  ? 0.72117680 0.85557914 0.78909755 -0.01498817 -0.17382842 0.00862312  83   SER   A HB3  
407   N  N    . SER   A  29  ? 0.56368834 0.71435028 0.64124197 -0.03998183 -0.15728158 0.00208884  84   SER   A N    
408   C  CA   . SER   A  29  ? 0.46170181 0.62965089 0.55448359 -0.04539620 -0.15793879 -0.00165183 84   SER   A CA   
409   C  C    . SER   A  29  ? 0.41755474 0.58174610 0.50213832 -0.05361822 -0.16120540 -0.00231503 84   SER   A C    
410   O  O    . SER   A  29  ? 0.46289611 0.63784117 0.55703855 -0.06041644 -0.15971674 -0.00515116 84   SER   A O    
411   C  CB   . SER   A  29  ? 0.61663091 0.79202116 0.71934754 -0.04869930 -0.14758801 -0.00340073 84   SER   A CB   
412   O  OG   . SER   A  29  ? 0.73496526 0.89730632 0.82480931 -0.05494320 -0.14058906 -0.00205302 84   SER   A OG   
413   H  H    . SER   A  29  ? 0.55656010 0.69714129 0.62423432 -0.04266045 -0.15275745 0.00343165  84   SER   A H    
414   H  HA   . SER   A  29  ? 0.49802917 0.67631757 0.60099548 -0.04141942 -0.16323073 -0.00284556 84   SER   A HA   
415   H  HB2  . SER   A  29  ? 0.59390759 0.78244632 0.70853829 -0.05171365 -0.14808311 -0.00589968 84   SER   A HB2  
416   H  HB3  . SER   A  29  ? 0.59390402 0.77039176 0.70039684 -0.04339350 -0.14530301 -0.00307172 84   SER   A HB3  
418   N  N    . CYS   A  30  ? 0.44000900 0.58832228 0.50617236 -0.05336184 -0.16532539 0.00022219  85   CYS   A N    
419   C  CA   . CYS   A  30  ? 0.39771309 0.54040122 0.45394462 -0.06077888 -0.16798249 -0.00064894 85   CYS   A CA   
420   C  C    . CYS   A  30  ? 0.46973222 0.62580824 0.53579515 -0.06166315 -0.17797332 -0.00310085 85   CYS   A C    
421   O  O    . CYS   A  30  ? 0.41708750 0.57958817 0.48935437 -0.05472650 -0.18507563 -0.00258014 85   CYS   A O    
422   C  CB   . CYS   A  30  ? 0.46132535 0.58446050 0.49529514 -0.05988816 -0.16954339 0.00244860  85   CYS   A CB   
423   S  SG   . CYS   A  30  ? 0.54104334 0.64857006 0.56310624 -0.05801629 -0.15914600 0.00563217  85   CYS   A SG   
424   H  H    . CYS   A  30  ? 0.42928958 0.57000583 0.48872620 -0.04853936 -0.16644213 0.00245280  85   CYS   A H    
425   H  HA   . CYS   A  30  ? 0.42321086 0.56656104 0.48109776 -0.06600550 -0.16236977 -0.00186120 85   CYS   A HA   
426   H  HB2  . CYS   A  30  ? 0.46809644 0.59032595 0.49968216 -0.05540018 -0.17580847 0.00371860  85   CYS   A HB2  
427   H  HB3  . CYS   A  30  ? 0.46401680 0.58359790 0.49162057 -0.06498069 -0.17058252 0.00141091  85   CYS   A HB3  
428   N  N    . CYS   A  31  ? 0.47345769 0.63225961 0.53954816 -0.07006387 -0.17910558 -0.00566078 86   CYS   A N    
429   C  CA   . CYS   A  31  ? 0.40932268 0.57834923 0.48141223 -0.07173987 -0.18950602 -0.00788693 86   CYS   A CA   
430   C  C    . CYS   A  31  ? 0.49739540 0.65481210 0.55372310 -0.06677133 -0.19824396 -0.00532276 86   CYS   A C    
431   O  O    . CYS   A  31  ? 0.56990427 0.71000111 0.60858452 -0.06470012 -0.19533858 -0.00222432 86   CYS   A O    
432   C  CB   . CYS   A  31  ? 0.39371738 0.56459004 0.46566230 -0.08219599 -0.18934219 -0.01099116 86   CYS   A CB   
433   S  SG   . CYS   A  31  ? 0.63441885 0.81611454 0.72178376 -0.08953724 -0.17875211 -0.01341921 86   CYS   A SG   
434   H  H    . CYS   A  31  ? 0.45111161 0.60514271 0.51336896 -0.07480696 -0.17358479 -0.00606634 86   CYS   A H    
435   H  HA   . CYS   A  31  ? 0.42878470 0.61152613 0.51572716 -0.06895263 -0.19133647 -0.00904488 86   CYS   A HA   
436   H  HB2  . CYS   A  31  ? 0.43960020 0.59699452 0.49666089 -0.08447135 -0.18836908 -0.01014915 86   CYS   A HB2  
437   H  HB3  . CYS   A  31  ? 0.44051564 0.61948657 0.51777756 -0.08312226 -0.19660762 -0.01259940 86   CYS   A HB3  
438   N  N    . HIS   A  32  ? 0.52728969 0.69479507 0.59010637 -0.06526668 -0.20912127 -0.00664202 87   HIS   A N    
439   C  CA   . HIS   A  32  ? 0.51713175 0.67578912 0.56712013 -0.05948967 -0.21853471 -0.00395537 87   HIS   A CA   
440   C  C    . HIS   A  32  ? 0.49112105 0.63049698 0.51678836 -0.06410913 -0.21866523 -0.00268676 87   HIS   A C    
441   O  O    . HIS   A  32  ? 0.58840936 0.71333086 0.59738553 -0.05973580 -0.22060370 0.00090973  87   HIS   A O    
442   C  CB   . HIS   A  32  ? 0.65940082 0.83451068 0.72272211 -0.05771572 -0.23061766 -0.00613980 87   HIS   A CB   
443   C  CG   . HIS   A  32  ? 0.83012992 1.00900435 0.89196622 -0.06647676 -0.23593372 -0.00944594 87   HIS   A CG   
444   N  ND1  . HIS   A  32  ? 0.85651344 1.02485216 0.90098512 -0.06743392 -0.24501479 -0.00864627 87   HIS   A ND1  
445   C  CD2  . HIS   A  32  ? 1.10828424 1.29920113 1.18279409 -0.07482368 -0.23328173 -0.01346728 87   HIS   A CD2  
446   C  CE1  . HIS   A  32  ? 0.88448268 1.05892551 0.93201923 -0.07606849 -0.24779330 -0.01251320 87   HIS   A CE1  
447   N  NE2  . HIS   A  32  ? 1.13491607 1.32282543 1.20055211 -0.08094197 -0.24096569 -0.01541717 87   HIS   A NE2  
448   H  H    . HIS   A  32  ? 0.51564521 0.69593406 0.59112620 -0.06805593 -0.21081710 -0.00921938 87   HIS   A H    
449   H  HA   . HIS   A  32  ? 0.53369886 0.68853050 0.58254540 -0.05339203 -0.21695179 -0.00154776 87   HIS   A HA   
450   H  HB2  . HIS   A  32  ? 0.66468471 0.83481431 0.72143054 -0.05220965 -0.23669411 -0.00390150 87   HIS   A HB2  
451   H  HB3  . HIS   A  32  ? 0.64745861 0.83620870 0.72756660 -0.05579682 -0.22923408 -0.00761654 87   HIS   A HB3  
453   H  HD2  . HIS   A  32  ? 1.01632333 1.21583200 1.10303903 -0.07634038 -0.22736393 -0.01470128 87   HIS   A HD2  
454   H  HE1  . HIS   A  32  ? 0.94165611 1.11129177 0.97951198 -0.07864064 -0.25376803 -0.01314076 87   HIS   A HE1  
456   N  N    . ASP   A  33  ? 0.66640925 0.80521512 0.68983996 -0.07314401 -0.21611200 -0.00574373 88   ASP   A N    
457   C  CA   . ASP   A  33  ? 0.73077971 0.85304391 0.73231268 -0.07773996 -0.21704392 -0.00562642 88   ASP   A CA   
458   C  C    . ASP   A  33  ? 0.61902785 0.72612011 0.60798490 -0.07962559 -0.20554443 -0.00418355 88   ASP   A C    
459   O  O    . ASP   A  33  ? 0.57346988 0.66785240 0.54621571 -0.08429751 -0.20399264 -0.00496787 88   ASP   A O    
460   C  CB   . ASP   A  33  ? 0.58489484 0.71393496 0.58981222 -0.08608682 -0.22235925 -0.01008438 88   ASP   A CB   
461   C  CG   . ASP   A  33  ? 0.79422855 0.93504554 0.81597275 -0.09284969 -0.21623930 -0.01347660 88   ASP   A CG   
462   O  OD1  . ASP   A  33  ? 0.67476130 0.81928360 0.70610207 -0.09102812 -0.20740333 -0.01246594 88   ASP   A OD1  
463   O  OD2  . ASP   A  33  ? 0.55576825 0.70175612 0.58061254 -0.10033741 -0.22035816 -0.01712819 88   ASP   A OD2  
464   H  H    . ASP   A  33  ? 0.61781240 0.76660007 0.65349734 -0.07653926 -0.21367380 -0.00804352 88   ASP   A H    
465   H  HA   . ASP   A  33  ? 0.67577964 0.79224324 0.66789556 -0.07388905 -0.22266006 -0.00359357 88   ASP   A HA   
466   H  HB2  . ASP   A  33  ? 0.66706771 0.78450000 0.65704334 -0.08917570 -0.22229077 -0.01035630 88   ASP   A HB2  
467   H  HB3  . ASP   A  33  ? 0.66617769 0.80302578 0.67619789 -0.08424722 -0.23065059 -0.01056920 88   ASP   A HB3  
468   N  N    . PHE   A  34  ? 0.55133665 0.65953773 0.54731750 -0.07552247 -0.19772927 -0.00216644 89   PHE   A N    
469   C  CA   . PHE   A  34  ? 0.56241953 0.65845025 0.54918349 -0.07722463 -0.18686962 -0.00096999 89   PHE   A CA   
470   C  C    . PHE   A  34  ? 0.52519774 0.60296488 0.48907602 -0.07538594 -0.18688415 0.00188323  89   PHE   A C    
471   O  O    . PHE   A  34  ? 0.45819569 0.52491593 0.40906209 -0.07997163 -0.18250339 0.00095426  89   PHE   A O    
472   C  CB   . PHE   A  34  ? 0.43223864 0.53346348 0.43087342 -0.07274636 -0.17950562 0.00066628  89   PHE   A CB   
473   C  CG   . PHE   A  34  ? 0.36294532 0.45175371 0.35212916 -0.07357794 -0.16893969 0.00232536  89   PHE   A CG   
474   C  CD1  . PHE   A  34  ? 0.35350037 0.44253588 0.34594512 -0.07962053 -0.16149317 0.00023890  89   PHE   A CD1  
475   C  CD2  . PHE   A  34  ? 0.41597503 0.49286193 0.39299482 -0.06850724 -0.16685751 0.00603525  89   PHE   A CD2  
476   C  CE1  . PHE   A  34  ? 0.36077669 0.43887088 0.34486634 -0.08005220 -0.15255785 0.00168447  89   PHE   A CE1  
477   C  CE2  . PHE   A  34  ? 0.40136009 0.46830505 0.37098864 -0.06937814 -0.15746951 0.00734659  89   PHE   A CE2  
478   C  CZ   . PHE   A  34  ? 0.35546193 0.42330480 0.32881188 -0.07488034 -0.15057163 0.00510013  89   PHE   A CZ   
479   H  H    . PHE   A  34  ? 0.56387043 0.68062723 0.57061499 -0.07143005 -0.19930911 -0.00163480 89   PHE   A H    
480   H  HA   . PHE   A  34  ? 0.52468896 0.62087190 0.51216012 -0.08291209 -0.18403430 -0.00329340 89   PHE   A HA   
481   H  HB2  . PHE   A  34  ? 0.43155929 0.54419452 0.44399208 -0.07470443 -0.17855044 -0.00137710 89   PHE   A HB2  
482   H  HB3  . PHE   A  34  ? 0.43918872 0.54138166 0.43883330 -0.06711434 -0.18293551 0.00258174  89   PHE   A HB3  
483   H  HD1  . PHE   A  34  ? 0.35751677 0.45399919 0.35767549 -0.08363619 -0.16278760 -0.00216433 89   PHE   A HD1  
484   H  HD2  . PHE   A  34  ? 0.40601629 0.48176715 0.38017368 -0.06443822 -0.17191578 0.00774722  89   PHE   A HD2  
485   H  HE1  . PHE   A  34  ? 0.35279334 0.43075752 0.33900762 -0.08395001 -0.14791046 0.00037235  89   PHE   A HE1  
486   H  HE2  . PHE   A  34  ? 0.39534712 0.45471931 0.35717195 -0.06628765 -0.15607159 0.00983549  89   PHE   A HE2  
487   H  HZ   . PHE   A  34  ? 0.36207235 0.42332348 0.33050758 -0.07521095 -0.14461027 0.00598420  89   PHE   A HZ   
488   N  N    . ASP   A  35  ? 0.49495116 0.56957042 0.45398521 -0.06860777 -0.19177519 0.00532633  90   ASP   A N    
489   C  CA   . ASP   A  35  ? 0.56993890 0.62783408 0.50729966 -0.06693145 -0.19188863 0.00851370  90   ASP   A CA   
490   C  C    . ASP   A  35  ? 0.62390649 0.67481780 0.54656708 -0.07240660 -0.19607204 0.00633889  90   ASP   A C    
491   O  O    . ASP   A  35  ? 0.70967025 0.74753851 0.61605340 -0.07490143 -0.19105741 0.00666955  90   ASP   A O    
492   C  CB   . ASP   A  35  ? 0.54994029 0.60602605 0.48421168 -0.05963805 -0.19901519 0.01236023  90   ASP   A CB   
493   C  CG   . ASP   A  35  ? 0.58546627 0.64184868 0.52691990 -0.05357405 -0.19426237 0.01528966  90   ASP   A CG   
494   O  OD1  . ASP   A  35  ? 0.74716055 0.80629778 0.69688714 -0.05499997 -0.18516243 0.01427002  90   ASP   A OD1  
495   O  OD2  . ASP   A  35  ? 0.69722819 0.75025463 0.63527381 -0.04739684 -0.19986832 0.01863937  90   ASP   A OD2  
496   H  H    . ASP   A  35  ? 0.51553148 0.59847319 0.48486915 -0.06497973 -0.19503121 0.00571902  90   ASP   A H    
497   H  HA   . ASP   A  35  ? 0.55365902 0.60532200 0.48712093 -0.06715333 -0.18447432 0.00953543  90   ASP   A HA   
498   H  HB2  . ASP   A  35  ? 0.56889617 0.63366890 0.51096058 -0.05863512 -0.20603359 0.01122408  90   ASP   A HB2  
499   H  HB3  . ASP   A  35  ? 0.57617414 0.62171519 0.49500889 -0.05973308 -0.20064735 0.01412477  90   ASP   A HB3  
500   N  N    . GLU   A  36  ? 0.75527668 0.81583762 0.68478400 -0.07441115 -0.20502551 0.00366417  91   GLU   A N    
501   C  CA   . GLU   A  36  ? 0.70297068 0.75713444 0.61786920 -0.07868579 -0.21138905 0.00171520  91   GLU   A CA   
502   C  C    . GLU   A  36  ? 0.57127440 0.62007689 0.48115581 -0.08612068 -0.20472142 -0.00206309 91   GLU   A C    
503   O  O    . GLU   A  36  ? 0.59260124 0.62879670 0.48372996 -0.08873735 -0.20448433 -0.00278716 91   GLU   A O    
504   C  CB   . GLU   A  36  ? 0.89049828 0.95792431 0.81604016 -0.07890423 -0.22332528 -0.00035014 91   GLU   A CB   
505   C  CG   . GLU   A  36  ? 1.01716447 1.09347510 0.95365423 -0.07096450 -0.22974406 0.00264991  91   GLU   A CG   
506   C  CD   . GLU   A  36  ? 1.06199396 1.15053535 1.00696588 -0.07043989 -0.24262504 0.00085961  91   GLU   A CD   
507   O  OE1  . GLU   A  36  ? 0.92398345 1.02456391 0.88159430 -0.07600587 -0.24460512 -0.00351835 91   GLU   A OE1  
508   O  OE2  . GLU   A  36  ? 0.74359035 0.82954502 0.68252122 -0.06447010 -0.25103930 0.00399129  91   GLU   A OE2  
509   H  H    . GLU   A  36  ? 0.70211345 0.77385187 0.64593685 -0.07319338 -0.20718464 0.00284985  91   GLU   A H    
510   H  HA   . GLU   A  36  ? 0.72198868 0.76625085 0.62267220 -0.07648017 -0.21254097 0.00420413  91   GLU   A HA   
511   H  HB2  . GLU   A  36  ? 0.85886526 0.93495786 0.79609758 -0.08269630 -0.22207709 -0.00333163 91   GLU   A HB2  
512   H  HB3  . GLU   A  36  ? 0.87996280 0.94159031 0.79342848 -0.08079702 -0.22839564 -0.00099078 91   GLU   A HB3  
513   H  HG2  . GLU   A  36  ? 0.99636352 1.06314194 0.92135799 -0.06724011 -0.23003803 0.00597360  91   GLU   A HG2  
514   H  HG3  . GLU   A  36  ? 0.97759092 1.06112146 0.92737710 -0.06935498 -0.22509131 0.00262982  91   GLU   A HG3  
515   N  N    . LEU   A  37  ? 0.54248619 0.60069263 0.46886438 -0.08943298 -0.19947995 -0.00453147 92   LEU   A N    
516   C  CA   . LEU   A  37  ? 0.51834399 0.57224286 0.44209495 -0.09664984 -0.19417089 -0.00828003 92   LEU   A CA   
517   C  C    . LEU   A  37  ? 0.59236103 0.63654333 0.51082397 -0.09644032 -0.18240975 -0.00708603 92   LEU   A C    
518   O  O    . LEU   A  37  ? 0.56430465 0.59768784 0.47058961 -0.10039694 -0.17863470 -0.00920346 92   LEU   A O    
519   C  CB   . LEU   A  37  ? 0.55457515 0.62343943 0.49833545 -0.10148356 -0.19524549 -0.01158605 92   LEU   A CB   
520   C  CG   . LEU   A  37  ? 0.66035897 0.73744643 0.60785073 -0.10549700 -0.20611560 -0.01483437 92   LEU   A CG   
521   C  CD1  . LEU   A  37  ? 0.69479340 0.77454400 0.63867146 -0.09968108 -0.21627292 -0.01257490 92   LEU   A CD1  
522   C  CD2  . LEU   A  37  ? 0.83248675 0.92687625 0.80263120 -0.10953647 -0.20636319 -0.01732552 92   LEU   A CD2  
523   H  H    . LEU   A  37  ? 0.53573066 0.60309458 0.47523463 -0.08708562 -0.19924109 -0.00384163 92   LEU   A H    
524   H  HA   . LEU   A  37  ? 0.55697143 0.60424757 0.46887481 -0.09898547 -0.19775370 -0.00971947 92   LEU   A HA   
525   H  HB2  . LEU   A  37  ? 0.55506176 0.63257861 0.51107550 -0.09836254 -0.19392869 -0.01013608 92   LEU   A HB2  
526   H  HB3  . LEU   A  37  ? 0.56017065 0.62531567 0.50335729 -0.10536809 -0.18956558 -0.01313407 92   LEU   A HB3  
527   H  HG   . LEU   A  37  ? 0.68159914 0.75045907 0.61826706 -0.10967056 -0.20654801 -0.01698204 92   LEU   A HG   
528   H  HD11 . LEU   A  37  ? 0.69237977 0.77887028 0.64048678 -0.10223786 -0.22329728 -0.01475059 92   LEU   A HD11 
529   H  HD12 . LEU   A  37  ? 0.67993724 0.76604760 0.63296974 -0.09491376 -0.21563461 -0.01034585 92   LEU   A HD12 
530   H  HD13 . LEU   A  37  ? 0.69256222 0.76078451 0.62058020 -0.09819712 -0.21649772 -0.01120866 92   LEU   A HD13 
531   H  HD21 . LEU   A  37  ? 0.76470196 0.85633248 0.73595607 -0.11355362 -0.20021810 -0.01857299 92   LEU   A HD21 
532   H  HD22 . LEU   A  37  ? 0.76276982 0.86566305 0.74382663 -0.10531081 -0.20568515 -0.01554875 92   LEU   A HD22 
533   H  HD23 . LEU   A  37  ? 0.77739084 0.87720692 0.75003219 -0.11243430 -0.21335530 -0.01950623 92   LEU   A HD23 
534   N  N    . CYS   A  38  ? 0.59960908 0.64786112 0.52747607 -0.09173527 -0.17701606 -0.00402204 93   CYS   A N    
535   C  CA   . CYS   A  38  ? 0.68706602 0.72881174 0.61346906 -0.09159691 -0.16614331 -0.00297806 93   CYS   A CA   
536   C  C    . CYS   A  38  ? 0.67076123 0.70068341 0.58272535 -0.08688162 -0.16238773 0.00071386  93   CYS   A C    
537   O  O    . CYS   A  38  ? 0.51159114 0.53350323 0.41768205 -0.08752048 -0.15406899 0.00103962  93   CYS   A O    
538   C  CB   . CYS   A  38  ? 0.59571916 0.64923477 0.54153013 -0.09042773 -0.16154224 -0.00241700 93   CYS   A CB   
539   S  SG   . CYS   A  38  ? 0.49889499 0.57008541 0.46489137 -0.09518542 -0.16633500 -0.00597411 93   CYS   A SG   
540   H  H    . CYS   A  38  ? 0.60941368 0.66481072 0.54497021 -0.08839373 -0.18045221 -0.00265744 93   CYS   A H    
541   H  HA   . CYS   A  38  ? 0.64817065 0.68531501 0.57025111 -0.09584945 -0.16372713 -0.00530593 93   CYS   A HA   
542   H  HB2  . CYS   A  38  ? 0.58898890 0.64467835 0.53743756 -0.08561473 -0.16216891 0.00004356  93   CYS   A HB2  
543   H  HB3  . CYS   A  38  ? 0.58536267 0.63462901 0.53014278 -0.09172248 -0.15477619 -0.00244104 93   CYS   A HB3  
544   N  N    . LEU   A  39  ? 0.52475870 0.55394608 0.43174028 -0.08213440 -0.16850172 0.00365962  94   LEU   A N    
545   C  CA   . LEU   A  39  ? 0.50004089 0.51785952 0.39282262 -0.07836611 -0.16533890 0.00745163  94   LEU   A CA   
546   C  C    . LEU   A  39  ? 0.55757463 0.56566072 0.43091679 -0.07893510 -0.17109551 0.00791593  94   LEU   A C    
547   O  O    . LEU   A  39  ? 0.57896602 0.58215761 0.44390830 -0.07487796 -0.17419012 0.01174026  94   LEU   A O    
548   C  CB   . LEU   A  39  ? 0.47787517 0.50034046 0.37925625 -0.07203063 -0.16636711 0.01131542  94   LEU   A CB   
549   C  CG   . LEU   A  39  ? 0.50137353 0.53345013 0.42119262 -0.07083711 -0.16056694 0.01096815  94   LEU   A CG   
550   C  CD1  . LEU   A  39  ? 0.48622292 0.52089447 0.41189608 -0.06429730 -0.16209576 0.01438646  94   LEU   A CD1  
551   C  CD2  . LEU   A  39  ? 0.54092300 0.56708312 0.45827845 -0.07316748 -0.14998956 0.01063215  94   LEU   A CD2  
552   H  H    . LEU   A  39  ? 0.55287439 0.58868957 0.46542144 -0.08131829 -0.17477700 0.00337817  94   LEU   A H    
553   H  HA   . LEU   A  39  ? 0.50626683 0.51929986 0.39616564 -0.07963508 -0.15838514 0.00718402  94   LEU   A HA   
554   H  HB2  . LEU   A  39  ? 0.49659383 0.52339494 0.40040189 -0.07033446 -0.17353712 0.01161741  94   LEU   A HB2  
555   H  HB3  . LEU   A  39  ? 0.49381626 0.50815356 0.38538653 -0.07005702 -0.16412455 0.01392818  94   LEU   A HB3  
556   H  HG   . LEU   A  39  ? 0.49672282 0.53761816 0.42679143 -0.07288898 -0.16289014 0.00853407  94   LEU   A HG   
557   H  HD11 . LEU   A  39  ? 0.47962552 0.52008712 0.41624150 -0.06356124 -0.15809466 0.01396106  94   LEU   A HD11 
558   H  HD12 . LEU   A  39  ? 0.49358201 0.51933193 0.40887409 -0.06261985 -0.16022158 0.01692741  94   LEU   A HD12 
559   H  HD13 . LEU   A  39  ? 0.49584606 0.53514493 0.42459041 -0.06237848 -0.16906425 0.01448734  94   LEU   A HD13 
560   H  HD21 . LEU   A  39  ? 0.52569896 0.55031359 0.44035316 -0.07723030 -0.14892851 0.00816372  94   LEU   A HD21 
561   H  HD22 . LEU   A  39  ? 0.52792734 0.54591894 0.43534216 -0.07156927 -0.14761545 0.01280779  94   LEU   A HD22 
562   H  HD23 . LEU   A  39  ? 0.51390857 0.54593325 0.44223404 -0.07219880 -0.14671694 0.01066725  94   LEU   A HD23 
563   N  N    . LYS   A  40  ? 0.56375933 0.56792450 0.42881307 -0.08410234 -0.17217752 0.00406355  95   LYS   A N    
564   C  CA   . LYS   A  40  ? 0.63816226 0.63232183 0.48307693 -0.08517434 -0.17673656 0.00392002  95   LYS   A CA   
565   C  C    . LYS   A  40  ? 0.59878469 0.58034754 0.42728576 -0.08388732 -0.16936576 0.00636195  95   LYS   A C    
566   O  O    . LYS   A  40  ? 0.55036825 0.52908957 0.38017511 -0.08489040 -0.16017161 0.00548703  95   LYS   A O    
567   C  CB   . LYS   A  40  ? 0.61016071 0.60286653 0.45060074 -0.09117937 -0.17900042 -0.00147422 95   LYS   A CB   
568   C  CG   . LYS   A  40  ? 0.65300977 0.65814763 0.50824130 -0.09362233 -0.18706991 -0.00419938 95   LYS   A CG   
569   C  CD   . LYS   A  40  ? 0.71079850 0.71354604 0.56186545 -0.10038515 -0.18877761 -0.00979164 95   LYS   A CD   
570   C  CE   . LYS   A  40  ? 0.75001824 0.76618481 0.61670202 -0.10334376 -0.19693011 -0.01230895 95   LYS   A CE   
571   N  NZ   . LYS   A  40  ? 0.88445729 0.89721626 0.74561262 -0.11023669 -0.19976853 -0.01764034 95   LYS   A NZ   
572   H  H    . LYS   A  40  ? 0.57142973 0.57882488 0.44310203 -0.08711809 -0.16993454 0.00140740  95   LYS   A H    
573   H  HA   . LYS   A  40  ? 0.61567056 0.61208355 0.46002433 -0.08290917 -0.18351825 0.00567724  95   LYS   A HA   
574   H  HB2  . LYS   A  40  ? 0.62173116 0.61192954 0.46311104 -0.09316064 -0.17249836 -0.00319634 95   LYS   A HB2  
575   H  HB3  . LYS   A  40  ? 0.63966024 0.62512374 0.46564043 -0.09176891 -0.18150471 -0.00167392 95   LYS   A HB3  
576   H  HG2  . LYS   A  40  ? 0.65895367 0.66642082 0.51267004 -0.09153297 -0.19407333 -0.00271820 95   LYS   A HG2  
577   H  HG3  . LYS   A  40  ? 0.64097989 0.65387583 0.51058275 -0.09287272 -0.18456016 -0.00381140 95   LYS   A HG3  
578   H  HD2  . LYS   A  40  ? 0.70162934 0.70155698 0.55416346 -0.10226399 -0.18205333 -0.01121179 95   LYS   A HD2  
579   H  HD3  . LYS   A  40  ? 0.71849597 0.71346033 0.55483532 -0.10106841 -0.19124524 -0.01045003 95   LYS   A HD3  
580   H  HE2  . LYS   A  40  ? 0.77118409 0.79107285 0.63792098 -0.10085173 -0.20368685 -0.01072317 95   LYS   A HE2  
581   H  HE3  . LYS   A  40  ? 0.75235695 0.77621758 0.63332289 -0.10319129 -0.19380552 -0.01201579 95   LYS   A HE3  
582   H  HZ1  . LYS   A  40  ? 0.85143596 0.85711437 0.69902313 -0.11039893 -0.20271771 -0.01815114 95   LYS   A HZ1  
583   H  HZ2  . LYS   A  40  ? 0.83828348 0.84719801 0.69946778 -0.11239403 -0.19374637 -0.01911362 95   LYS   A HZ2  
584   H  HZ3  . LYS   A  40  ? 0.84157395 0.86297452 0.71266413 -0.11228029 -0.20468357 -0.01905645 95   LYS   A HZ3  
585   N  N    . THR   A  41  ? 0.50146449 0.47578323 0.31464624 -0.08177456 -0.17353083 0.00952595  96   THR   A N    
586   C  CA   . THR   A  41  ? 0.57910657 0.54231131 0.37660164 -0.08091298 -0.16677599 0.01220269  96   THR   A CA   
587   C  C    . THR   A  41  ? 0.56836641 0.52137184 0.34336379 -0.08320249 -0.16952711 0.01137477  96   THR   A C    
588   O  O    . THR   A  41  ? 0.50422883 0.44840291 0.26541674 -0.08354371 -0.16291854 0.01256777  96   THR   A O    
589   C  CB   . THR   A  41  ? 0.61576337 0.57807016 0.41481280 -0.07594354 -0.16677767 0.01818159  96   THR   A CB   
590   O  OG1  . THR   A  41  ? 0.59617555 0.55994713 0.39307043 -0.07356041 -0.17765702 0.02040651  96   THR   A OG1  
591   C  CG2  . THR   A  41  ? 0.58819461 0.55856597 0.40675265 -0.07357163 -0.16181378 0.01893729  96   THR   A CG2  
592   H  H    . THR   A  41  ? 0.54794407 0.52453363 0.36064592 -0.08088040 -0.18078956 0.01018298  96   THR   A H    
593   H  HA   . THR   A  41  ? 0.55618846 0.51868522 0.35645086 -0.08212218 -0.15965213 0.01068025  96   THR   A HA   
594   H  HB   . THR   A  41  ? 0.60450244 0.55917037 0.39193004 -0.07604809 -0.16263126 0.01995901  96   THR   A HB   
596   H  HG21 . THR   A  41  ? 0.59017754 0.55903429 0.40869045 -0.07046729 -0.16206753 0.02250887  96   THR   A HG21 
597   H  HG22 . THR   A  41  ? 0.58521056 0.56362152 0.41544297 -0.07361575 -0.16544312 0.01716731  96   THR   A HG22 
598   H  HG23 . THR   A  41  ? 0.58417118 0.55313176 0.40348238 -0.07514116 -0.15477438 0.01756480  96   THR   A HG23 
599   N  N    . ALA   A  42  ? 0.60359949 0.55836296 0.37513140 -0.08494759 -0.17909841 0.00913237  97   ALA   A N    
600   C  CA   . ALA   A  42  ? 0.58070064 0.52589303 0.33007625 -0.08703813 -0.18290474 0.00834279  97   ALA   A CA   
601   C  C    . ALA   A  42  ? 0.67356431 0.61043787 0.41069078 -0.09015657 -0.17354915 0.00485554  97   ALA   A C    
602   O  O    . ALA   A  42  ? 0.62618423 0.56552231 0.37158915 -0.09258121 -0.16892092 0.00028703  97   ALA   A O    
603   C  CB   . ALA   A  42  ? 0.54861790 0.49816772 0.29865724 -0.08931875 -0.19397661 0.00505442  97   ALA   A CB   
604   H  H    . ALA   A  42  ? 0.58169007 0.54403090 0.36489803 -0.08496727 -0.18335260 0.00796377  97   ALA   A H    
605   H  HA   . ALA   A  42  ? 0.59946132 0.54050523 0.34076717 -0.08481192 -0.18449369 0.01235432  97   ALA   A HA   
606   H  HB1  . ALA   A  42  ? 0.57456917 0.51735204 0.30896410 -0.09055922 -0.19678363 0.00470738  97   ALA   A HB1  
607   H  HB2  . ALA   A  42  ? 0.55777895 0.51337755 0.31649435 -0.08694510 -0.19982725 0.00718304  97   ALA   A HB2  
608   H  HB3  . ALA   A  42  ? 0.55491018 0.50794649 0.31224534 -0.09197394 -0.19250172 0.00111306  97   ALA   A HB3  
609   N  N    . ARG   A  43  ? 0.51981926 0.44686329 0.23758492 -0.08978671 -0.17050530 0.00738786  98   ARG   A N    
610   C  CA   . ARG   A  43  ? 0.55198419 0.47060701 0.25459406 -0.09219780 -0.16233550 0.00432745  98   ARG   A CA   
611   C  C    . ARG   A  43  ? 0.52479875 0.44432142 0.23583327 -0.09137425 -0.15042783 0.00403852  98   ARG   A C    
612   O  O    . ARG   A  43  ? 0.57219833 0.48631394 0.27377895 -0.09299992 -0.14335920 0.00061657  98   ARG   A O    
613   C  CB   . ARG   A  43  ? 0.55302250 0.46963739 0.24968049 -0.09608295 -0.16545695 -0.00248639 98   ARG   A CB   
614   C  CG   . ARG   A  43  ? 0.61319542 0.52644044 0.29555532 -0.09739463 -0.17640366 -0.00251066 98   ARG   A CG   
615   C  CD   . ARG   A  43  ? 0.75530958 0.65739763 0.41276306 -0.09941261 -0.17357570 -0.00440504 98   ARG   A CD   
616   N  NE   . ARG   A  43  ? 0.73465228 0.63407564 0.38760328 -0.10307798 -0.17396623 -0.01193512 98   ARG   A NE   
617   C  CZ   . ARG   A  43  ? 0.73045063 0.62055111 0.36336958 -0.10518284 -0.17058316 -0.01586587 98   ARG   A CZ   
618   N  NH1  . ARG   A  43  ? 0.77038294 0.65413260 0.38888836 -0.10416982 -0.16271916 -0.01371276 98   ARG   A NH1  
619   N  NH2  . ARG   A  43  ? 0.82432163 0.71157581 0.45179480 -0.10857400 -0.17488080 -0.02240404 98   ARG   A NH2  
620   H  H    . ARG   A  43  ? 0.56152773 0.48710340 0.27527493 -0.08784433 -0.17372738 0.01133371  98   ARG   A H    
621   H  HA   . ARG   A  43  ? 0.55442750 0.46713760 0.24300544 -0.09190670 -0.16269344 0.00687127  98   ARG   A HA   
622   H  HB2  . ARG   A  43  ? 0.55536598 0.47783393 0.26567107 -0.09676591 -0.16649906 -0.00470052 98   ARG   A HB2  
623   H  HB3  . ARG   A  43  ? 0.56868505 0.48017880 0.25714019 -0.09718782 -0.15918481 -0.00492355 98   ARG   A HB3  
624   H  HG2  . ARG   A  43  ? 0.62646061 0.54124320 0.30978680 -0.09518254 -0.18070297 0.00192576  98   ARG   A HG2  
625   H  HG3  . ARG   A  43  ? 0.62686998 0.54387689 0.31537908 -0.09913079 -0.18150827 -0.00570515 98   ARG   A HG3  
626   H  HD2  . ARG   A  43  ? 0.71259207 0.61185038 0.36676621 -0.09855442 -0.16563128 -0.00314130 98   ARG   A HD2  
627   H  HD3  . ARG   A  43  ? 0.72771376 0.62682652 0.37459084 -0.09915012 -0.17938650 -0.00185359 98   ARG   A HD3  
628   H  HE   . ARG   A  43  ? 0.72813910 0.63227808 0.39230394 -0.10401123 -0.17653471 -0.01415485 98   ARG   A HE   
629   H  HH11 . ARG   A  43  ? 0.75075018 0.63642007 0.37480456 -0.10231465 -0.15800366 -0.01039212 98   ARG   A HH11 
630   H  HH12 . ARG   A  43  ? 0.77405113 0.65180832 0.37739626 -0.10551310 -0.16211849 -0.01570850 98   ARG   A HH12 
631   H  HH21 . ARG   A  43  ? 0.80600226 0.68680626 0.41889137 -0.10985154 -0.17372398 -0.02497677 98   ARG   A HH21 
632   H  HH22 . ARG   A  43  ? 0.78941643 0.68117452 0.42775679 -0.10966112 -0.17881249 -0.02421016 98   ARG   A HH22 
633   N  N    . GLY   A  44  ? 0.48780090 0.41398951 0.21582668 -0.08863642 -0.14851111 0.00747474  99   GLY   A N    
634   C  CA   . GLY   A  44  ? 0.51336151 0.44047743 0.24906868 -0.08755265 -0.13789216 0.00802671  99   GLY   A CA   
635   C  C    . GLY   A  44  ? 0.48890626 0.41901350 0.23512703 -0.08923807 -0.13303649 0.00261004  99   GLY   A C    
636   O  O    . GLY   A  44  ? 0.46403587 0.39764053 0.21690625 -0.09117118 -0.13824379 -0.00094333 99   GLY   A O    
637   H  H    . GLY   A  44  ? 0.49917048 0.42955911 0.23421216 -0.08727731 -0.15408124 0.00945561  99   GLY   A H    
638   H  HA2  . GLY   A  44  ? 0.49137986 0.42236948 0.23656318 -0.08537786 -0.13817616 0.01135346  99   GLY   A HA2  
639   H  HA3  . GLY   A  44  ? 0.50799793 0.42963862 0.23226884 -0.08776154 -0.13342446 0.00893807  99   GLY   A HA3  
640   N  N    . TRP   A  45  ? 0.50123137 0.42955142 0.24834129 -0.08867804 -0.12317359 0.00203276  100  TRP   A N    
641   C  CA   . TRP   A  45  ? 0.48551756 0.41666996 0.24474441 -0.08931144 -0.11807742 -0.00172464 100  TRP   A CA   
642   C  C    . TRP   A  45  ? 0.45723268 0.38170245 0.20600562 -0.09060036 -0.11172654 -0.00661741 100  TRP   A C    
643   O  O    . TRP   A  45  ? 0.44730330 0.37265873 0.20480102 -0.09068670 -0.10695711 -0.00949338 100  TRP   A O    
644   C  CB   . TRP   A  45  ? 0.44237912 0.37869424 0.21569353 -0.08673293 -0.11244821 0.00186580  100  TRP   A CB   
645   C  CG   . TRP   A  45  ? 0.52429795 0.46641248 0.30684382 -0.08484815 -0.11820596 0.00637378  100  TRP   A CG   
646   C  CD1  . TRP   A  45  ? 0.57692093 0.51774883 0.35526484 -0.08258592 -0.11894099 0.01163813  100  TRP   A CD1  
647   C  CD2  . TRP   A  45  ? 0.48494342 0.43501323 0.28247041 -0.08495529 -0.12427556 0.00589117  100  TRP   A CD2  
648   N  NE1  . TRP   A  45  ? 0.58985233 0.53693521 0.37981024 -0.08062634 -0.12526794 0.01426537  100  TRP   A NE1  
649   C  CE2  . TRP   A  45  ? 0.51560229 0.46920708 0.31772333 -0.08200426 -0.12848906 0.01070802  100  TRP   A CE2  
650   C  CE3  . TRP   A  45  ? 0.42569423 0.38022834 0.23324794 -0.08739963 -0.12635425 0.00187055  100  TRP   A CE3  
651   C  CZ2  . TRP   A  45  ? 0.53349340 0.49588645 0.35037720 -0.08095443 -0.13441522 0.01118542  100  TRP   A CZ2  
652   C  CZ3  . TRP   A  45  ? 0.44054651 0.40416062 0.26277745 -0.08705764 -0.13187890 0.00266476  100  TRP   A CZ3  
653   C  CH2  . TRP   A  45  ? 0.45084950 0.41884774 0.27800441 -0.08362341 -0.13572510 0.00708855  100  TRP   A CH2  
654   H  H    . TRP   A  45  ? 0.49845555 0.42365333 0.23829380 -0.08790103 -0.11961533 0.00418640  100  TRP   A H    
655   H  HA   . TRP   A  45  ? 0.47230220 0.40674451 0.23847839 -0.09052488 -0.12276658 -0.00343349 100  TRP   A HA   
656   H  HB2  . TRP   A  45  ? 0.46680003 0.40017825 0.23407455 -0.08587831 -0.10737502 0.00320067  100  TRP   A HB2  
657   H  HB3  . TRP   A  45  ? 0.45768356 0.39620256 0.23973460 -0.08718153 -0.10994337 -0.00032980 100  TRP   A HB3  
658   H  HD1  . TRP   A  45  ? 0.57093048 0.50723302 0.33981600 -0.08242658 -0.11563461 0.01320390  100  TRP   A HD1  
659   H  HE1  . TRP   A  45  ? 0.56591493 0.51268882 0.35527983 -0.07884274 -0.12703882 0.01759790  100  TRP   A HE1  
660   H  HE3  . TRP   A  45  ? 0.44640875 0.39777768 0.25079611 -0.08929962 -0.12385906 -0.00138165 100  TRP   A HE3  
661   H  HZ2  . TRP   A  45  ? 0.50528157 0.46976742 0.32534859 -0.07850371 -0.13711244 0.01419476  100  TRP   A HZ2  
662   H  HZ3  . TRP   A  45  ? 0.43704063 0.40396351 0.26607192 -0.08920362 -0.13323119 0.00004361  100  TRP   A HZ3  
663   H  HH2  . TRP   A  45  ? 0.45942068 0.43425786 0.29709947 -0.08318090 -0.13944931 0.00720868  100  TRP   A HH2  
664   N  N    . GLU   A  46  ? 0.49355781 0.41122305 0.22352108 -0.09144852 -0.11195351 -0.00757949 101  GLU   A N    
665   C  CA   . GLU   A  46  ? 0.57327390 0.48453498 0.29166472 -0.09207331 -0.10546227 -0.01237160 101  GLU   A CA   
666   C  C    . GLU   A  46  ? 0.56463200 0.46956885 0.26751438 -0.09468172 -0.11087793 -0.01687163 101  GLU   A C    
667   O  O    . GLU   A  46  ? 0.56280094 0.46556950 0.25397447 -0.09545397 -0.11640257 -0.01460501 101  GLU   A O    
668   C  CB   . GLU   A  46  ? 0.58280337 0.49167317 0.29101485 -0.09064563 -0.09800860 -0.00961370 101  GLU   A CB   
669   C  CG   . GLU   A  46  ? 0.61123967 0.52551973 0.33294776 -0.08831092 -0.09173976 -0.00566397 101  GLU   A CG   
670   C  CD   . GLU   A  46  ? 0.63642120 0.54885650 0.34826815 -0.08768740 -0.08451316 -0.00301908 101  GLU   A CD   
671   O  OE1  . GLU   A  46  ? 0.73747087 0.64453965 0.43246773 -0.08891396 -0.08262908 -0.00535911 101  GLU   A OE1  
672   O  OE2  . GLU   A  46  ? 0.72440612 0.64078057 0.44491988 -0.08628468 -0.08069022 0.00125441  101  GLU   A OE2  
673   H  H    . GLU   A  46  ? 0.50936139 0.42627811 0.23321109 -0.09154072 -0.11637291 -0.00524345 101  GLU   A H    
674   H  HA   . GLU   A  46  ? 0.54414374 0.45648134 0.27083495 -0.09178720 -0.10210460 -0.01476030 101  GLU   A HA   
675   H  HB2  . GLU   A  46  ? 0.60077798 0.50796711 0.30029848 -0.09113296 -0.10142025 -0.00691316 101  GLU   A HB2  
676   H  HB3  . GLU   A  46  ? 0.59882182 0.50391537 0.29913053 -0.09094277 -0.09389911 -0.01325487 101  GLU   A HB3  
677   H  HG2  . GLU   A  46  ? 0.59804559 0.51377237 0.32794598 -0.08774686 -0.08851031 -0.00819574 101  GLU   A HG2  
678   H  HG3  . GLU   A  46  ? 0.59754908 0.51534128 0.32694051 -0.08782531 -0.09568232 -0.00227899 101  GLU   A HG3  
679   N  N    . CYS   A  47  ? 0.53190583 0.43301660 0.23374161 -0.09597270 -0.10927689 -0.02323677 102  CYS   A N    
680   C  CA   . CYS   A  47  ? 0.57998091 0.47345203 0.26446548 -0.09828160 -0.11257008 -0.02837414 102  CYS   A CA   
681   C  C    . CYS   A  47  ? 0.57452202 0.46286482 0.24043189 -0.09733360 -0.10687626 -0.02803075 102  CYS   A C    
682   O  O    . CYS   A  47  ? 0.58155471 0.47111198 0.24926883 -0.09509129 -0.09801336 -0.02676915 102  CYS   A O    
683   C  CB   . CYS   A  47  ? 0.62001801 0.50903505 0.30670601 -0.09954019 -0.11099002 -0.03546229 102  CYS   A CB   
684   S  SG   . CYS   A  47  ? 0.71327728 0.60686082 0.41733751 -0.10265289 -0.11936881 -0.03666785 102  CYS   A SG   
685   H  H    . CYS   A  47  ? 0.53735352 0.44017082 0.24906333 -0.09543683 -0.10631735 -0.02444004 102  CYS   A H    
686   H  HA   . CYS   A  47  ? 0.58114153 0.47555166 0.26408821 -0.09978540 -0.11992321 -0.02737544 102  CYS   A HA   
687   H  HB2  . CYS   A  47  ? 0.61927080 0.50835574 0.31048974 -0.09765528 -0.10429121 -0.03604820 102  CYS   A HB2  
688   H  HB3  . CYS   A  47  ? 0.64037400 0.52346337 0.31384495 -0.10064039 -0.11177459 -0.03913632 102  CYS   A HB3  
689   N  N    . THR   A  48  ? 0.56133103 0.44435352 0.20937371 -0.09931171 -0.11211618 -0.02912848 103  THR   A N    
690   C  CA   . THR   A  48  ? 0.61738420 0.49439496 0.24519712 -0.09925479 -0.10665560 -0.03030992 103  THR   A CA   
691   C  C    . THR   A  48  ? 0.61923939 0.48847669 0.23360834 -0.10126106 -0.10877412 -0.03822653 103  THR   A C    
692   O  O    . THR   A  48  ? 0.59563607 0.46433717 0.21515018 -0.10326204 -0.11639144 -0.04112109 103  THR   A O    
693   C  CB   . THR   A  48  ? 0.66185629 0.53834724 0.27825287 -0.09993015 -0.11100653 -0.02398898 103  THR   A CB   
694   O  OG1  . THR   A  48  ? 0.66335893 0.53875929 0.27654338 -0.10200402 -0.12280622 -0.02415873 103  THR   A OG1  
695   C  CG2  . THR   A  48  ? 0.66971231 0.55272508 0.29910627 -0.09787572 -0.10893691 -0.01624858 103  THR   A CG2  
696   H  H    . THR   A  48  ? 0.58103091 0.46440384 0.22935390 -0.10084473 -0.11937205 -0.02916573 103  THR   A H    
697   H  HA   . THR   A  48  ? 0.60574293 0.48393801 0.23649408 -0.09753347 -0.09888424 -0.03032807 103  THR   A HA   
698   H  HB   . THR   A  48  ? 0.66968977 0.54188335 0.27150285 -0.10037491 -0.10720499 -0.02498985 103  THR   A HB   
700   H  HG21 . THR   A  48  ? 0.66983473 0.55124140 0.29068029 -0.09834207 -0.11187020 -0.01232321 103  THR   A HG21 
701   H  HG22 . THR   A  48  ? 0.65026307 0.53771800 0.29368320 -0.09734141 -0.11256838 -0.01533042 103  THR   A HG22 
702   H  HG23 . THR   A  48  ? 0.65654546 0.54067326 0.28845355 -0.09668960 -0.10113908 -0.01629735 103  THR   A HG23 
703   N  N    . LYS   A  49  ? 0.65386999 0.51726431 0.25093791 -0.10092385 -0.10203312 -0.04184166 104  LYS   A N    
704   C  CA   . LYS   A  49  ? 0.74702442 0.60226589 0.33116999 -0.10216501 -0.10231133 -0.05027417 104  LYS   A CA   
705   C  C    . LYS   A  49  ? 0.74142361 0.59224075 0.31392857 -0.10573688 -0.11384155 -0.05159626 104  LYS   A C    
706   O  O    . LYS   A  49  ? 0.74176282 0.58735192 0.31138051 -0.10750316 -0.11760115 -0.05813484 104  LYS   A O    
707   C  CB   . LYS   A  49  ? 0.79103625 0.64158666 0.35772815 -0.10083748 -0.09247626 -0.05392578 104  LYS   A CB   
708   C  CG   . LYS   A  49  ? 1.04969418 0.90288448 0.62746024 -0.09717670 -0.08152716 -0.05660361 104  LYS   A CG   
709   C  CD   . LYS   A  49  ? 1.30704796 1.15726900 0.86920631 -0.09556383 -0.07148712 -0.06068414 104  LYS   A CD   
710   C  CE   . LYS   A  49  ? 1.48917031 1.32973051 1.03468108 -0.09630178 -0.07253014 -0.06964283 104  LYS   A CE   
711   N  NZ   . LYS   A  49  ? 1.50539911 1.34435606 1.03808987 -0.09399990 -0.06160485 -0.07420816 104  LYS   A NZ   
712   H  H    . LYS   A  49  ? 0.66496533 0.52950084 0.25813127 -0.09994856 -0.09701441 -0.03909910 104  LYS   A H    
713   H  HA   . LYS   A  49  ? 0.72372729 0.57917601 0.31830198 -0.10155178 -0.10136903 -0.05334741 104  LYS   A HA   
714   H  HB2  . LYS   A  49  ? 0.83528715 0.68711388 0.39480117 -0.10115366 -0.09134392 -0.04965120 104  LYS   A HB2  
715   H  HB3  . LYS   A  49  ? 0.85076094 0.69517881 0.40530723 -0.10212273 -0.09455968 -0.05889669 104  LYS   A HB3  
716   H  HG2  . LYS   A  49  ? 1.00881910 0.85996139 0.59335411 -0.09685621 -0.08289942 -0.06059626 104  LYS   A HG2  
717   H  HG3  . LYS   A  49  ? 0.99719107 0.85643280 0.58673310 -0.09607068 -0.07964411 -0.05170020 104  LYS   A HG3  
718   H  HD2  . LYS   A  49  ? 1.26557970 1.11919928 0.83702636 -0.09294821 -0.06482179 -0.06126835 104  LYS   A HD2  
719   H  HD3  . LYS   A  49  ? 1.28048849 1.13192713 0.83402282 -0.09658457 -0.07054650 -0.05682836 104  LYS   A HD3  
720   H  HE2  . LYS   A  49  ? 1.44914865 1.28637707 0.98395741 -0.09898296 -0.07886463 -0.06908756 104  LYS   A HE2  
721   H  HE3  . LYS   A  49  ? 1.44440436 1.28282332 0.99793160 -0.09569873 -0.07432593 -0.07327018 104  LYS   A HE3  
722   H  HZ1  . LYS   A  49  ? 1.50824022 1.34920585 1.03332794 -0.09493506 -0.05963383 -0.07070557 104  LYS   A HZ1  
723   H  HZ2  . LYS   A  49  ? 1.49436569 1.33655691 1.03722382 -0.09130136 -0.05599988 -0.07505216 104  LYS   A HZ2  
724   H  HZ3  . LYS   A  49  ? 1.51781940 1.35059059 1.03991604 -0.09434861 -0.06238463 -0.07977629 104  LYS   A HZ3  
725   N  N    . ASP   A  50  ? 0.73226988 0.58486581 0.29818100 -0.10677108 -0.11969070 -0.04533372 105  ASP   A N    
726   C  CA   . ASP   A  50  ? 0.73459399 0.58390987 0.28979826 -0.10983603 -0.13147058 -0.04578224 105  ASP   A CA   
727   C  C    . ASP   A  50  ? 0.67595696 0.53080642 0.24980193 -0.11116027 -0.14088388 -0.04555081 105  ASP   A C    
728   O  O    . ASP   A  50  ? 0.67580110 0.52847230 0.24337286 -0.11403029 -0.15092631 -0.04768705 105  ASP   A O    
729   C  CB   . ASP   A  50  ? 0.74879766 0.59782374 0.29120189 -0.11010581 -0.13518572 -0.03870862 105  ASP   A CB   
730   C  CG   . ASP   A  50  ? 1.04202557 0.89925003 0.60137320 -0.10791989 -0.13558926 -0.03023891 105  ASP   A CG   
731   O  OD1  . ASP   A  50  ? 1.04151988 0.90151191 0.60694110 -0.10574041 -0.12573034 -0.02760484 105  ASP   A OD1  
732   O  OD2  . ASP   A  50  ? 1.08684063 0.94801456 0.65400350 -0.10826358 -0.14584035 -0.02655458 105  ASP   A OD2  
733   H  H    . ASP   A  50  ? 0.72729748 0.58299166 0.29519671 -0.10549082 -0.11637427 -0.04062742 105  ASP   A H    
734   H  HA   . ASP   A  50  ? 0.74281025 0.58591068 0.28550065 -0.11110134 -0.13124315 -0.05120794 105  ASP   A HA   
735   H  HB2  . ASP   A  50  ? 0.81224787 0.65903413 0.34743071 -0.11197645 -0.14349109 -0.03921575 105  ASP   A HB2  
736   H  HB3  . ASP   A  50  ? 0.80990064 0.65512967 0.33906674 -0.10991405 -0.12923998 -0.03913720 105  ASP   A HB3  
737   N  N    . ARG   A  51  ? 0.61359131 0.47597405 0.21009740 -0.10932752 -0.13774103 -0.04306403 106  ARG   A N    
738   C  CA   . ARG   A  51  ? 0.63001323 0.49823201 0.24499841 -0.11092828 -0.14523870 -0.04350622 106  ARG   A CA   
739   C  C    . ARG   A  51  ? 0.60923535 0.47382087 0.22991166 -0.11270677 -0.14351776 -0.05092902 106  ARG   A C    
740   O  O    . ARG   A  51  ? 0.60386062 0.47202301 0.23693433 -0.11531050 -0.15032089 -0.05226408 106  ARG   A O    
741   C  CB   . ARG   A  51  ? 0.59061033 0.46882766 0.22723228 -0.10843078 -0.14348012 -0.03709186 106  ARG   A CB   
742   C  CG   . ARG   A  51  ? 0.58587372 0.46764806 0.21974987 -0.10672922 -0.14699309 -0.02945332 106  ARG   A CG   
743   C  CD   . ARG   A  51  ? 0.52804786 0.41932595 0.18336298 -0.10444641 -0.14680280 -0.02403368 106  ARG   A CD   
744   N  NE   . ARG   A  51  ? 0.50953150 0.40731782 0.18113427 -0.10620973 -0.15417247 -0.02572369 106  ARG   A NE   
745   C  CZ   . ARG   A  51  ? 0.45394212 0.36075085 0.14685069 -0.10488905 -0.15390420 -0.02290523 106  ARG   A CZ   
746   N  NH1  . ARG   A  51  ? 0.44564316 0.35613683 0.14601913 -0.10149709 -0.14857699 -0.01753546 106  ARG   A NH1  
747   N  NH2  . ARG   A  51  ? 0.43690097 0.34927678 0.14366026 -0.10734621 -0.15928987 -0.02556634 106  ARG   A NH2  
748   H  H    . ARG   A  51  ? 0.62141907 0.48563665 0.22193265 -0.10721793 -0.13085553 -0.04099405 106  ARG   A H    
749   H  HA   . ARG   A  51  ? 0.62614864 0.49445689 0.23639840 -0.11270162 -0.15340757 -0.04301399 106  ARG   A HA   
750   H  HB2  . ARG   A  51  ? 0.58477783 0.46299270 0.22559208 -0.10664917 -0.13558656 -0.03729318 106  ARG   A HB2  
751   H  HB3  . ARG   A  51  ? 0.58445722 0.46676043 0.23327002 -0.10968281 -0.14778766 -0.03786383 106  ARG   A HB3  
752   H  HG2  . ARG   A  51  ? 0.58968830 0.47062337 0.21719569 -0.10823023 -0.15483257 -0.02937971 106  ARG   A HG2  
753   H  HG3  . ARG   A  51  ? 0.58361816 0.46176529 0.20676650 -0.10567307 -0.14175411 -0.02819196 106  ARG   A HG3  
754   H  HD2  . ARG   A  51  ? 0.53469008 0.42717546 0.18729933 -0.10317720 -0.14911984 -0.01928830 106  ARG   A HD2  
755   H  HD3  . ARG   A  51  ? 0.52327758 0.41532582 0.18454668 -0.10299869 -0.13922137 -0.02398665 106  ARG   A HD3  
756   H  HE   . ARG   A  51  ? 0.51091373 0.40677077 0.17784402 -0.10845982 -0.15915102 -0.02881763 106  ARG   A HE   
757   H  HH11 . ARG   A  51  ? 0.44935012 0.35739845 0.14128825 -0.10018946 -0.14747104 -0.01469341 106  ARG   A HH11 
758   H  HH12 . ARG   A  51  ? 0.43122452 0.34641635 0.14476113 -0.10071442 -0.14618430 -0.01679457 106  ARG   A HH12 
759   H  HH21 . ARG   A  51  ? 0.42779595 0.34543672 0.14817372 -0.10676509 -0.15745082 -0.02453069 106  ARG   A HH21 
760   H  HH22 . ARG   A  51  ? 0.45032415 0.36119306 0.15249157 -0.10973686 -0.16464201 -0.02834500 106  ARG   A HH22 
761   N  N    . CYS   A  52  ? 0.60571063 0.46325994 0.21761075 -0.11130110 -0.13442653 -0.05570469 107  CYS   A N    
762   C  CA   . CYS   A  52  ? 0.63964856 0.49242890 0.25713339 -0.11208479 -0.13162075 -0.06238148 107  CYS   A CA   
763   C  C    . CYS   A  52  ? 0.59881854 0.44546962 0.20825537 -0.11666108 -0.14070554 -0.06831317 107  CYS   A C    
764   O  O    . CYS   A  52  ? 0.64282173 0.48218697 0.23204878 -0.11774915 -0.14256050 -0.07186868 107  CYS   A O    
765   C  CB   . CYS   A  52  ? 0.67086095 0.51704186 0.27882916 -0.10894042 -0.12056983 -0.06663385 107  CYS   A CB   
766   S  SG   . CYS   A  52  ? 0.83289027 0.68670356 0.45463580 -0.10393875 -0.10927212 -0.06097599 107  CYS   A SG   
767   H  H    . CYS   A  52  ? 0.62126648 0.47682217 0.22336590 -0.10974672 -0.12982720 -0.05478300 107  CYS   A H    
768   H  HA   . CYS   A  52  ? 0.60983092 0.46779704 0.24331602 -0.11170749 -0.13109881 -0.06030082 107  CYS   A HA   
769   H  HB2  . CYS   A  52  ? 0.70491189 0.54704285 0.29711950 -0.10904917 -0.12014625 -0.06796919 107  CYS   A HB2  
770   H  HB3  . CYS   A  52  ? 0.69328165 0.53459293 0.30241269 -0.10956854 -0.11995279 -0.07164274 107  CYS   A HB3  
771   N  N    . GLY   A  53  ? 0.61232424 0.46201485 0.23743051 -0.11956418 -0.14595294 -0.06936183 108  GLY   A N    
772   C  CA   . GLY   A  53  ? 0.63810974 0.48325911 0.25837207 -0.12473959 -0.15533626 -0.07464688 108  GLY   A CA   
773   C  C    . GLY   A  53  ? 0.68736577 0.53760517 0.30261520 -0.12703772 -0.16618535 -0.07143725 108  GLY   A C    
774   O  O    . GLY   A  53  ? 0.72610873 0.57065189 0.32824239 -0.13070269 -0.17369457 -0.07600305 108  GLY   A O    
775   H  H    . GLY   A  53  ? 0.59475452 0.44964302 0.23408307 -0.11852991 -0.14355907 -0.06669050 108  GLY   A H    
776   H  HA2  . GLY   A  53  ? 0.63523245 0.48253581 0.26856866 -0.12655510 -0.15665694 -0.07534624 108  GLY   A HA2  
777   H  HA3  . GLY   A  53  ? 0.65728110 0.49354041 0.26435372 -0.12506111 -0.15344834 -0.07992024 108  GLY   A HA3  
778   N  N    . GLU   A  54  ? 0.67111522 0.53168082 0.29654264 -0.12465965 -0.16727035 -0.06366116 109  GLU   A N    
779   C  CA   . GLU   A  54  ? 0.68636680 0.55299699 0.31083715 -0.12615801 -0.17826255 -0.05999069 109  GLU   A CA   
780   C  C    . GLU   A  54  ? 0.69349730 0.56528890 0.33108345 -0.13104141 -0.18794984 -0.06259442 109  GLU   A C    
781   O  O    . GLU   A  54  ? 0.66442549 0.53773749 0.31661612 -0.13281338 -0.18526702 -0.06488150 109  GLU   A O    
782   C  CB   . GLU   A  54  ? 0.65921032 0.53558820 0.29478896 -0.12210551 -0.17685963 -0.05130579 109  GLU   A CB   
783   C  CG   . GLU   A  54  ? 0.64976114 0.53577268 0.31115162 -0.12117570 -0.17374355 -0.04862223 109  GLU   A CG   
784   C  CD   . GLU   A  54  ? 0.58555013 0.47936803 0.25793096 -0.11664040 -0.16952074 -0.04100156 109  GLU   A CD   
785   O  OE1  . GLU   A  54  ? 0.53715938 0.42883313 0.19737653 -0.11405731 -0.16868202 -0.03701095 109  GLU   A OE1  
786   O  OE2  . GLU   A  54  ? 0.54288679 0.44442582 0.23545688 -0.11590382 -0.16695389 -0.03903422 109  GLU   A OE2  
787   H  H    . GLU   A  54  ? 0.66043925 0.52409995 0.29344326 -0.12188275 -0.16119410 -0.06066701 109  GLU   A H    
788   H  HA   . GLU   A  54  ? 0.69954175 0.56042826 0.30709904 -0.12665923 -0.18050361 -0.06149872 109  GLU   A HA   
789   H  HB2  . GLU   A  54  ? 0.66956204 0.54911327 0.30310243 -0.12262785 -0.18437234 -0.04894446 109  GLU   A HB2  
790   H  HB3  . GLU   A  54  ? 0.66538900 0.53837574 0.29250190 -0.11954229 -0.17063963 -0.04972262 109  GLU   A HB3  
791   H  HG2  . GLU   A  54  ? 0.63163394 0.51391572 0.29505897 -0.12142628 -0.16791967 -0.05176326 109  GLU   A HG2  
792   H  HG3  . GLU   A  54  ? 0.63300008 0.52397251 0.30321941 -0.12368423 -0.18046513 -0.04923260 109  GLU   A HG3  
793   N  N    . VAL   A  55  ? 0.65416539 0.52878481 0.28637403 -0.13345663 -0.19947352 -0.06214506 110  VAL   A N    
794   C  CA   . VAL   A  55  ? 0.62996775 0.51522559 0.28007019 -0.13690582 -0.20906253 -0.06167312 110  VAL   A CA   
795   C  C    . VAL   A  55  ? 0.67103612 0.56932825 0.34338206 -0.13336904 -0.20672803 -0.05466989 110  VAL   A C    
796   O  O    . VAL   A  55  ? 0.67124081 0.57149351 0.34099501 -0.12858418 -0.20400618 -0.04886857 110  VAL   A O    
797   C  CB   . VAL   A  55  ? 0.64697397 0.53357774 0.28662774 -0.13926728 -0.22218417 -0.06200421 110  VAL   A CB   
798   C  CG1  . VAL   A  55  ? 0.62133384 0.52084434 0.28145874 -0.14278322 -0.23201819 -0.06173137 110  VAL   A CG1  
799   C  CG2  . VAL   A  55  ? 0.65573907 0.52884978 0.27183568 -0.14273427 -0.22441405 -0.06911819 110  VAL   A CG2  
800   H  H    . VAL   A  55  ? 0.67307675 0.54324567 0.29023188 -0.13291040 -0.20136301 -0.06206577 110  VAL   A H    
801   H  HA   . VAL   A  55  ? 0.64495426 0.52814227 0.29983038 -0.14009382 -0.20853937 -0.06586866 110  VAL   A HA   
802   H  HB   . VAL   A  55  ? 0.64093620 0.52902269 0.27554762 -0.13595784 -0.22280787 -0.05745679 110  VAL   A HB   
803   H  HG11 . VAL   A  55  ? 0.62301075 0.52200282 0.29070449 -0.14598890 -0.23028727 -0.06529176 110  VAL   A HG11 
804   H  HG12 . VAL   A  55  ? 0.61311209 0.52138507 0.28603184 -0.13996002 -0.23154417 -0.05689450 110  VAL   A HG12 
805   H  HG13 . VAL   A  55  ? 0.63903797 0.53866315 0.29191777 -0.14471677 -0.24058893 -0.06290013 110  VAL   A HG13 
806   H  HG21 . VAL   A  55  ? 0.67060298 0.54539245 0.28261340 -0.14505546 -0.23358798 -0.06988806 110  VAL   A HG21 
807   H  HG22 . VAL   A  55  ? 0.66741264 0.53386521 0.26925272 -0.14016294 -0.21950340 -0.06853998 110  VAL   A HG22 
808   H  HG23 . VAL   A  55  ? 0.66019988 0.52945930 0.27925140 -0.14525004 -0.22162513 -0.07361381 110  VAL   A HG23 
809   N  N    . ARG   A  56  ? 0.72789073 0.63471168 0.42168114 -0.13602968 -0.20771554 -0.05533951 111  ARG   A N    
810   C  CA   . ARG   A  56  ? 0.62908006 0.54822576 0.34445304 -0.13294613 -0.20492810 -0.04954694 111  ARG   A CA   
811   C  C    . ARG   A  56  ? 0.71972108 0.64926732 0.44010895 -0.13058698 -0.21395269 -0.04444882 111  ARG   A C    
812   O  O    . ARG   A  56  ? 0.59896350 0.53409785 0.32207364 -0.13383307 -0.22472793 -0.04612855 111  ARG   A O    
813   C  CB   . ARG   A  56  ? 0.65814435 0.58431476 0.39425939 -0.13718291 -0.20464599 -0.05176862 111  ARG   A CB   
814   C  CG   . ARG   A  56  ? 0.64155912 0.58209443 0.40044767 -0.13448082 -0.20322463 -0.04621162 111  ARG   A CG   
815   C  CD   . ARG   A  56  ? 0.65133667 0.59772241 0.42872202 -0.13936169 -0.20189472 -0.04861796 111  ARG   A CD   
816   N  NE   . ARG   A  56  ? 0.65677357 0.59466422 0.43406391 -0.13943379 -0.19128226 -0.05019577 111  ARG   A NE   
817   C  CZ   . ARG   A  56  ? 0.59265995 0.53306979 0.37871864 -0.13518183 -0.18252374 -0.04618471 111  ARG   A CZ   
818   N  NH1  . ARG   A  56  ? 0.59631479 0.52676803 0.37671834 -0.13373861 -0.17321756 -0.04745506 111  ARG   A NH1  
819   N  NH2  . ARG   A  56  ? 0.64957535 0.60325050 0.45170176 -0.13250312 -0.18339056 -0.04116593 111  ARG   A NH2  
820   H  H    . ARG   A  56  ? 0.69430709 0.59901798 0.38892418 -0.14003465 -0.21012990 -0.05958486 111  ARG   A H    
821   H  HA   . ARG   A  56  ? 0.65851456 0.57475954 0.37209010 -0.12955061 -0.19718014 -0.04740383 111  ARG   A HA   
822   H  HB2  . ARG   A  56  ? 0.64856893 0.56787330 0.38242167 -0.13793321 -0.19828558 -0.05426423 111  ARG   A HB2  
823   H  HB3  . ARG   A  56  ? 0.65750718 0.58528447 0.39398596 -0.14125060 -0.21178874 -0.05467648 111  ARG   A HB3  
824   H  HG2  . ARG   A  56  ? 0.64583385 0.59353280 0.40804577 -0.13357586 -0.20989157 -0.04400198 111  ARG   A HG2  
825   H  HG3  . ARG   A  56  ? 0.63716435 0.57606494 0.39548564 -0.13051783 -0.19650377 -0.04326531 111  ARG   A HG3  
826   H  HD2  . ARG   A  56  ? 0.65897310 0.60476434 0.43466210 -0.14392333 -0.20774454 -0.05224387 111  ARG   A HD2  
827   H  HD3  . ARG   A  56  ? 0.64018500 0.59734440 0.43209529 -0.13824400 -0.20301390 -0.04552975 111  ARG   A HD3  
828   H  HE   . ARG   A  56  ? 0.65079588 0.58135283 0.42182046 -0.14236431 -0.19089468 -0.05405189 111  ARG   A HE   
829   H  HH11 . ARG   A  56  ? 0.60621583 0.52779472 0.37602717 -0.13507737 -0.17248373 -0.05096977 111  ARG   A HH11 
830   H  HH12 . ARG   A  56  ? 0.58354652 0.51630402 0.37077457 -0.13130155 -0.16790488 -0.04488983 111  ARG   A HH12 
831   H  HH21 . ARG   A  56  ? 0.61663473 0.57100630 0.41901058 -0.12843655 -0.17946032 -0.03794678 111  ARG   A HH21 
832   H  HH22 . ARG   A  56  ? 0.62248468 0.58423269 0.43503922 -0.13480994 -0.18780139 -0.04121901 111  ARG   A HH22 
833   N  N    . ASN   A  57  ? 0.63564241 0.56757009 0.35748801 -0.12484279 -0.20962763 -0.03828489 112  ASN   A N    
834   C  CA   . ASN   A  57  ? 0.68634325 0.62913227 0.41800845 -0.12157721 -0.21682769 -0.03282933 112  ASN   A CA   
835   C  C    . ASN   A  57  ? 0.63637942 0.59042305 0.39219710 -0.11928210 -0.21175341 -0.02958503 112  ASN   A C    
836   O  O    . ASN   A  57  ? 0.57588094 0.52677393 0.33298290 -0.11637276 -0.20162883 -0.02734643 112  ASN   A O    
837   C  CB   . ASN   A  57  ? 0.72814935 0.66449249 0.44254464 -0.11696270 -0.21697882 -0.02799037 112  ASN   A CB   
838   C  CG   . ASN   A  57  ? 0.81761980 0.76264638 0.53801918 -0.11386795 -0.22710569 -0.02315759 112  ASN   A CG   
839   O  OD1  . ASN   A  57  ? 0.74437797 0.70195878 0.48643434 -0.11212479 -0.22905169 -0.02094341 112  ASN   A OD1  
840   N  ND2  . ASN   A  57  ? 0.88533980 0.82394177 0.58667386 -0.11305347 -0.23407586 -0.02163260 112  ASN   A ND2  
841   H  H    . ASN   A  57  ? 0.66085005 0.58739197 0.37748393 -0.12283985 -0.20213594 -0.03752746 112  ASN   A H    
842   H  HA   . ASN   A  57  ? 0.67997277 0.62700564 0.41379195 -0.12403353 -0.22524473 -0.03454087 112  ASN   A HA   
843   H  HB2  . ASN   A  57  ? 0.75412822 0.68206453 0.45188564 -0.11862232 -0.21807209 -0.03043716 112  ASN   A HB2  
844   H  HB3  . ASN   A  57  ? 0.72772336 0.66200066 0.44285128 -0.11435293 -0.20912528 -0.02562644 112  ASN   A HB3  
845   H  HD21 . ASN   A  57  ? 0.87811911 0.80784249 0.56380695 -0.11422818 -0.23189688 -0.02319547 112  ASN   A HD21 
846   H  HD22 . ASN   A  57  ? 0.87067670 0.81379777 0.57471603 -0.11125457 -0.24094366 -0.01904100 112  ASN   A HD22 
847   N  N    . GLU   A  58  ? 0.53660828 0.50419915 0.31130210 -0.12057381 -0.21886306 -0.02943489 113  GLU   A N    
848   C  CA   . GLU   A  58  ? 0.60187411 0.58087873 0.39990449 -0.11930759 -0.21421368 -0.02735997 113  GLU   A CA   
849   C  C    . GLU   A  58  ? 0.56156731 0.54426408 0.36483455 -0.11231381 -0.21087304 -0.02088305 113  GLU   A C    
850   O  O    . GLU   A  58  ? 0.55920362 0.54732823 0.37701267 -0.11046161 -0.20380202 -0.01896026 113  GLU   A O    
851   C  CB   . GLU   A  58  ? 0.61599338 0.60962653 0.43265784 -0.12288915 -0.22293758 -0.02935321 113  GLU   A CB   
852   C  CG   . GLU   A  58  ? 0.65038711 0.64215672 0.46765617 -0.13086344 -0.22471258 -0.03574714 113  GLU   A CG   
853   C  CD   . GLU   A  58  ? 0.75908530 0.74632978 0.58185732 -0.13387629 -0.21418658 -0.03792765 113  GLU   A CD   
854   O  OE1  . GLU   A  58  ? 0.68150759 0.66590220 0.50563973 -0.12965354 -0.20475021 -0.03475276 113  GLU   A OE1  
855   O  OE2  . GLU   A  58  ? 0.96002328 0.94622195 0.78557897 -0.14060988 -0.21573600 -0.04276068 113  GLU   A OE2  
856   H  H    . GLU   A  58  ? 0.58368164 0.55378509 0.35661787 -0.12231978 -0.22681955 -0.03075570 113  GLU   A H    
857   H  HA   . GLU   A  58  ? 0.57552493 0.55050910 0.37454844 -0.12105179 -0.20725369 -0.02920409 113  GLU   A HA   
858   H  HB2  . GLU   A  58  ? 0.62462890 0.62141895 0.43872464 -0.12145313 -0.23070300 -0.02820917 113  GLU   A HB2  
859   H  HB3  . GLU   A  58  ? 0.60398000 0.60597664 0.43576968 -0.12129856 -0.22006413 -0.02741005 113  GLU   A HB3  
860   H  HG2  . GLU   A  58  ? 0.68123019 0.66433793 0.48300394 -0.13234392 -0.22754905 -0.03796627 113  GLU   A HG2  
861   H  HG3  . GLU   A  58  ? 0.66594607 0.66794002 0.49490654 -0.13303533 -0.23088396 -0.03659647 113  GLU   A HG3  
862   N  N    . GLU   A  59  ? 0.54285651 0.52134293 0.33283502 -0.10853916 -0.21583575 -0.01744090 114  GLU   A N    
863   C  CA   . GLU   A  59  ? 0.60294390 0.58349490 0.39650738 -0.10213289 -0.21371324 -0.01125347 114  GLU   A CA   
864   C  C    . GLU   A  59  ? 0.56912863 0.54095888 0.35644019 -0.10021611 -0.20123029 -0.00934315 114  GLU   A C    
865   O  O    . GLU   A  59  ? 0.53626740 0.51028907 0.32976705 -0.09558380 -0.19751316 -0.00466404 114  GLU   A O    
866   C  CB   . GLU   A  59  ? 0.60290712 0.57933682 0.38183528 -0.09908179 -0.22269084 -0.00788215 114  GLU   A CB   
867   C  CG   . GLU   A  59  ? 0.89535701 0.88087279 0.68027997 -0.10029615 -0.23602355 -0.00946238 114  GLU   A CG   
868   C  CD   . GLU   A  59  ? 1.08511543 1.08672881 0.89439762 -0.09692118 -0.24041075 -0.00748344 114  GLU   A CD   
869   O  OE1  . GLU   A  59  ? 1.39519048 1.39760172 1.20571947 -0.09073486 -0.24210727 -0.00223859 114  GLU   A OE1  
870   O  OE2  . GLU   A  59  ? 1.30979323 1.32303190 1.13662744 -0.10048414 -0.24214117 -0.01122111 114  GLU   A OE2  
871   H  H    . GLU   A  59  ? 0.57989991 0.55358547 0.35783139 -0.11008032 -0.22068667 -0.01892812 114  GLU   A H    
872   H  HA   . GLU   A  59  ? 0.57073355 0.56139302 0.38085860 -0.10094727 -0.21487688 -0.01040261 114  GLU   A HA   
873   H  HB2  . GLU   A  59  ? 0.66690528 0.63335901 0.42890039 -0.10037392 -0.22108358 -0.00866195 114  GLU   A HB2  
874   H  HB3  . GLU   A  59  ? 0.65099943 0.62812591 0.43239820 -0.09486071 -0.22130421 -0.00368210 114  GLU   A HB3  
875   H  HG2  . GLU   A  59  ? 0.83956730 0.82555270 0.62464619 -0.10487401 -0.23717745 -0.01381444 114  GLU   A HG2  
876   H  HG3  . GLU   A  59  ? 0.85211158 0.83234847 0.62380713 -0.09896141 -0.24141026 -0.00774775 114  GLU   A HG3  
877   N  N    . ASN   A  60  ? 0.53823233 0.50008166 0.31304753 -0.10360768 -0.19507049 -0.01313729 115  ASN   A N    
878   C  CA   . ASN   A  60  ? 0.56826442 0.52182847 0.33550757 -0.10177753 -0.18377826 -0.01173180 115  ASN   A CA   
879   C  C    . ASN   A  60  ? 0.58518237 0.54469287 0.37063015 -0.10072730 -0.17544743 -0.01097743 115  ASN   A C    
880   O  O    . ASN   A  60  ? 0.45951605 0.42557299 0.25922507 -0.10360389 -0.17558615 -0.01389244 115  ASN   A O    
881   C  CB   . ASN   A  60  ? 0.55876285 0.50053108 0.30831856 -0.10504320 -0.17924534 -0.01651559 115  ASN   A CB   
882   C  CG   . ASN   A  60  ? 0.65862393 0.59197068 0.38585958 -0.10527883 -0.18444407 -0.01639359 115  ASN   A CG   
883   O  OD1  . ASN   A  60  ? 0.58519220 0.51710397 0.30531782 -0.10193914 -0.18626864 -0.01122626 115  ASN   A OD1  
884   N  ND2  . ASN   A  60  ? 0.58661056 0.51364082 0.30174518 -0.10945135 -0.18730482 -0.02211784 115  ASN   A ND2  
885   H  H    . ASN   A  60  ? 0.56171036 0.52194595 0.33265305 -0.10704713 -0.19811738 -0.01682073 115  ASN   A H    
886   H  HA   . ASN   A  60  ? 0.56635737 0.51739305 0.32687411 -0.09880518 -0.18403630 -0.00796463 115  ASN   A HA   
887   H  HB2  . ASN   A  60  ? 0.57994592 0.52297938 0.33402485 -0.10829516 -0.18062985 -0.02043290 115  ASN   A HB2  
888   H  HB3  . ASN   A  60  ? 0.57413912 0.51249135 0.32253087 -0.10379135 -0.17130660 -0.01593180 115  ASN   A HB3  
889   H  HD21 . ASN   A  60  ? 0.60733086 0.53499740 0.32799628 -0.11187856 -0.18613617 -0.02564549 115  ASN   A HD21 
890   H  HD22 . ASN   A  60  ? 0.62394071 0.54580259 0.32520542 -0.10982382 -0.19037893 -0.02235533 115  ASN   A HD22 
891   N  N    . ALA   A  61  ? 0.52910691 0.48552215 0.31258842 -0.09699009 -0.16798961 -0.00703321 116  ALA   A N    
892   C  CA   . ALA   A  61  ? 0.51691079 0.47784030 0.31538957 -0.09557330 -0.15985976 -0.00588946 116  ALA   A CA   
893   C  C    . ALA   A  61  ? 0.45395011 0.41164422 0.25403449 -0.09924899 -0.15395561 -0.01083137 116  ALA   A C    
894   O  O    . ALA   A  61  ? 0.43095917 0.39511263 0.24681646 -0.10054920 -0.15185107 -0.01185648 116  ALA   A O    
895   C  CB   . ALA   A  61  ? 0.51574647 0.47184268 0.30806065 -0.09162875 -0.15294254 -0.00134996 116  ALA   A CB   
896   H  H    . ALA   A  61  ? 0.54874700 0.49994934 0.32082522 -0.09548101 -0.16804476 -0.00496358 116  ALA   A H    
897   H  HA   . ALA   A  61  ? 0.49646616 0.46570575 0.30816105 -0.09483325 -0.16289067 -0.00484141 116  ALA   A HA   
898   H  HB1  . ALA   A  61  ? 0.50292343 0.46218610 0.30525663 -0.09066696 -0.14792283 -0.00061965 116  ALA   A HB1  
899   H  HB2  . ALA   A  61  ? 0.51846248 0.47560227 0.30917343 -0.08939167 -0.15698080 0.00188097  116  ALA   A HB2  
900   H  HB3  . ALA   A  61  ? 0.52205694 0.47081992 0.30193642 -0.09241898 -0.14959745 -0.00247948 116  ALA   A HB3  
901   N  N    . CYS   A  62  ? 0.44142872 0.38852286 0.22460857 -0.10058582 -0.15066476 -0.01368178 117  CYS   A N    
902   C  CA   . CYS   A  62  ? 0.50570214 0.44783950 0.28849158 -0.10351094 -0.14548172 -0.01864820 117  CYS   A CA   
903   C  C    . CYS   A  62  ? 0.57371515 0.50665581 0.33825126 -0.10637419 -0.14892311 -0.02334773 117  CYS   A C    
904   O  O    . CYS   A  62  ? 0.50467360 0.43477061 0.25591004 -0.10573331 -0.15377645 -0.02214625 117  CYS   A O    
905   C  CB   . CYS   A  62  ? 0.48198414 0.42086738 0.26604041 -0.10088257 -0.13465084 -0.01748506 117  CYS   A CB   
906   S  SG   . CYS   A  62  ? 0.50020647 0.43170291 0.26658460 -0.09744348 -0.12918514 -0.01479658 117  CYS   A SG   
907   H  H    . CYS   A  62  ? 0.46975541 0.41238064 0.24119842 -0.09955114 -0.15159099 -0.01253525 117  CYS   A H    
908   H  HA   . CYS   A  62  ? 0.48968720 0.43699843 0.28391087 -0.10551719 -0.14747171 -0.01984608 117  CYS   A HA   
909   H  HB2  . CYS   A  62  ? 0.48837113 0.42344207 0.27181858 -0.10257547 -0.13175748 -0.02090592 117  CYS   A HB2  
910   H  HB3  . CYS   A  62  ? 0.47515658 0.42008635 0.27127302 -0.09952305 -0.13318323 -0.01489039 117  CYS   A HB3  
911   N  N    . HIS   A  63  ? 0.54982024 0.47741896 0.31293893 -0.10966802 -0.14690685 -0.02881468 118  HIS   A N    
912   C  CA   . HIS   A  63  ? 0.48681286 0.40619496 0.23414986 -0.11294807 -0.15147950 -0.03404334 118  HIS   A CA   
913   C  C    . HIS   A  63  ? 0.48967400 0.39710692 0.22229925 -0.11265367 -0.14432563 -0.03853543 118  HIS   A C    
914   O  O    . HIS   A  63  ? 0.49760050 0.40318018 0.23559862 -0.11089826 -0.13605094 -0.03886468 118  HIS   A O    
915   C  CB   . HIS   A  63  ? 0.51458585 0.43801820 0.27175909 -0.11809523 -0.15870206 -0.03746273 118  HIS   A CB   
916   C  CG   . HIS   A  63  ? 0.52172852 0.45775449 0.29222554 -0.11822543 -0.16660677 -0.03379073 118  HIS   A CG   
917   N  ND1  . HIS   A  63  ? 0.46937048 0.40716171 0.23273002 -0.11928673 -0.17636858 -0.03386992 118  HIS   A ND1  
918   C  CD2  . HIS   A  63  ? 0.56746149 0.51470768 0.35738844 -0.11692534 -0.16585873 -0.03011017 118  HIS   A CD2  
919   C  CE1  . HIS   A  63  ? 0.45264077 0.40296310 0.23204516 -0.11841290 -0.18151477 -0.03043360 118  HIS   A CE1  
920   N  NE2  . HIS   A  63  ? 0.50837547 0.46475685 0.30379787 -0.11686075 -0.17517979 -0.02811371 118  HIS   A NE2  
921   H  H    . HIS   A  63  ? 0.52453297 0.45310408 0.29613048 -0.10987370 -0.14278476 -0.02932820 118  HIS   A H    
922   H  HA   . HIS   A  63  ? 0.51096714 0.43039805 0.25031644 -0.11218061 -0.15568981 -0.03240260 118  HIS   A HA   
923   H  HB2  . HIS   A  63  ? 0.50398731 0.42735189 0.26935017 -0.11913905 -0.15480755 -0.03869652 118  HIS   A HB2  
924   H  HB3  . HIS   A  63  ? 0.52447385 0.44209909 0.27093667 -0.12048942 -0.16207947 -0.04115493 118  HIS   A HB3  
926   H  HD2  . HIS   A  63  ? 0.52330500 0.47187334 0.32122368 -0.11598243 -0.16008073 -0.02910416 118  HIS   A HD2  
927   H  HE1  . HIS   A  63  ? 0.47521135 0.42960733 0.25434157 -0.11858458 -0.18877314 -0.02972172 118  HIS   A HE1  
929   N  N    . CYS   A  64  ? 0.48920491 0.38879120 0.20295781 -0.11407062 -0.14777820 -0.04201912 119  CYS   A N    
930   C  CA   . CYS   A  64  ? 0.55383074 0.44206429 0.25188875 -0.11357634 -0.14154270 -0.04703868 119  CYS   A CA   
931   C  C    . CYS   A  64  ? 0.56000096 0.44043389 0.24789718 -0.11807957 -0.14736442 -0.05401171 119  CYS   A C    
932   O  O    . CYS   A  64  ? 0.60812664 0.47836447 0.27968380 -0.11781917 -0.14397228 -0.05891565 119  CYS   A O    
933   C  CB   . CYS   A  64  ? 0.55035102 0.43528703 0.23211403 -0.11043236 -0.13782366 -0.04466116 119  CYS   A CB   
934   S  SG   . CYS   A  64  ? 0.59275419 0.48662627 0.28503656 -0.10605334 -0.13335235 -0.03587994 119  CYS   A SG   
935   H  H    . CYS   A  64  ? 0.51130795 0.41281819 0.22168648 -0.11518378 -0.15427063 -0.04127233 119  CYS   A H    
936   H  HA   . CYS   A  64  ? 0.52936888 0.41697294 0.23422876 -0.11233754 -0.13552848 -0.04756379 119  CYS   A HA   
937   H  HB2  . CYS   A  64  ? 0.57473618 0.45807087 0.24670254 -0.11186926 -0.14359885 -0.04500165 119  CYS   A HB2  
938   H  HB3  . CYS   A  64  ? 0.56874949 0.44761270 0.24265324 -0.10948858 -0.13210617 -0.04778558 119  CYS   A HB3  
939   N  N    . SER   A  65  ? 0.58189130 0.46755224 0.27957830 -0.12224445 -0.15614451 -0.05456771 120  SER   A N    
940   C  CA   . SER   A  65  ? 0.60118228 0.48031026 0.29188025 -0.12743941 -0.16251257 -0.06109749 120  SER   A CA   
941   C  C    . SER   A  65  ? 0.64927936 0.52182168 0.34579733 -0.12938423 -0.15770434 -0.06583367 120  SER   A C    
942   O  O    . SER   A  65  ? 0.59018505 0.46580970 0.29978210 -0.12713130 -0.15089497 -0.06326769 120  SER   A O    
943   C  CB   . SER   A  65  ? 0.58617091 0.47499365 0.28718129 -0.13133338 -0.17357537 -0.05957191 120  SER   A CB   
944   O  OG   . SER   A  65  ? 0.65797234 0.55898499 0.38139829 -0.13096786 -0.17332503 -0.05495769 120  SER   A OG   
945   H  H    . SER   A  65  ? 0.56489778 0.45874605 0.27443877 -0.12193739 -0.15821208 -0.05085479 120  SER   A H    
946   H  HA   . SER   A  65  ? 0.62012768 0.49249631 0.29478309 -0.12722597 -0.16308440 -0.06356401 120  SER   A HA   
947   H  HB2  . SER   A  65  ? 0.61758542 0.50258672 0.31628394 -0.13537599 -0.17755009 -0.06399965 120  SER   A HB2  
948   H  HB3  . SER   A  65  ? 0.61437213 0.50470608 0.30780497 -0.13034613 -0.17772681 -0.05770164 120  SER   A HB3  
950   N  N    . GLU   A  66  ? 0.69471514 0.55759430 0.38116932 -0.13368466 -0.16170628 -0.07269484 121  GLU   A N    
951   C  CA   . GLU   A  66  ? 0.64421284 0.49801517 0.33318084 -0.13550645 -0.15762725 -0.07762876 121  GLU   A CA   
952   C  C    . GLU   A  66  ? 0.60148883 0.46235895 0.31159568 -0.13944167 -0.15963919 -0.07572069 121  GLU   A C    
953   O  O    . GLU   A  66  ? 0.63320547 0.48831707 0.34890133 -0.13973233 -0.15444654 -0.07740860 121  GLU   A O    
954   C  CB   . GLU   A  66  ? 0.82730389 0.66796863 0.49894905 -0.13929543 -0.16197379 -0.08567806 121  GLU   A CB   
955   C  CG   . GLU   A  66  ? 1.02275848 0.84958851 0.68924284 -0.13842928 -0.15528625 -0.09146419 121  GLU   A CG   
956   C  CD   . GLU   A  66  ? 1.19554162 1.01597953 0.84980482 -0.13157205 -0.14556953 -0.09266447 121  GLU   A CD   
957   O  OE1  . GLU   A  66  ? 1.35959041 1.18294036 1.00289190 -0.12877680 -0.14493132 -0.09077878 121  GLU   A OE1  
958   O  OE2  . GLU   A  66  ? 0.99484688 0.80770695 0.65082175 -0.12899502 -0.13858710 -0.09529900 121  GLU   A OE2  
959   H  H    . GLU   A  66  ? 0.68754071 0.54902899 0.36504048 -0.13553475 -0.16736345 -0.07430796 121  GLU   A H    
960   H  HA   . GLU   A  66  ? 0.66804594 0.51876134 0.35542911 -0.13153808 -0.15017951 -0.07720711 121  GLU   A HA   
961   H  HB2  . GLU   A  66  ? 0.82296896 0.66154039 0.48153299 -0.13775720 -0.16284022 -0.08632647 121  GLU   A HB2  
962   H  HB3  . GLU   A  66  ? 0.81478769 0.65787977 0.49095243 -0.14403205 -0.16890280 -0.08666357 121  GLU   A HB3  
963   H  HG2  . GLU   A  66  ? 1.01720667 0.83647978 0.67575985 -0.14201750 -0.15954696 -0.09650058 121  GLU   A HG2  
964   H  HG3  . GLU   A  66  ? 0.98687571 0.81590664 0.66625261 -0.13906667 -0.15322497 -0.08981635 121  GLU   A HG3  
965   N  N    . ASP   A  67  ? 0.60952896 0.48283714 0.33112055 -0.14239351 -0.16713648 -0.07225015 122  ASP   A N    
966   C  CA   . ASP   A  67  ? 0.62121195 0.50375885 0.36384320 -0.14593767 -0.16839629 -0.06980129 122  ASP   A CA   
967   C  C    . ASP   A  67  ? 0.57829881 0.47102168 0.33642232 -0.14134902 -0.16186979 -0.06311544 122  ASP   A C    
968   O  O    . ASP   A  67  ? 0.58057022 0.48167315 0.35619342 -0.14406025 -0.16222991 -0.06085436 122  ASP   A O    
969   C  CB   . ASP   A  67  ? 0.67432326 0.56712103 0.42326897 -0.15080810 -0.17928849 -0.06944884 122  ASP   A CB   
970   C  CG   . ASP   A  67  ? 0.85096991 0.75619555 0.60347915 -0.14691900 -0.18291226 -0.06384730 122  ASP   A CG   
971   O  OD1  . ASP   A  67  ? 0.71169138 0.61499155 0.45605856 -0.14074118 -0.17768162 -0.06079583 122  ASP   A OD1  
972   O  OD2  . ASP   A  67  ? 0.88922620 0.80601490 0.65262133 -0.15003975 -0.19109459 -0.06254779 122  ASP   A OD2  
973   H  H    . ASP   A  67  ? 0.61847961 0.49473092 0.33450687 -0.14216521 -0.17163287 -0.07144992 122  ASP   A H    
974   H  HA   . ASP   A  67  ? 0.62509525 0.50063962 0.36805379 -0.14874151 -0.16700204 -0.07306825 122  ASP   A HA   
975   H  HB2  . ASP   A  67  ? 0.68790746 0.58571947 0.44976446 -0.15429954 -0.18031171 -0.06904142 122  ASP   A HB2  
976   H  HB3  . ASP   A  67  ? 0.70934319 0.59562349 0.44738895 -0.15359977 -0.18375549 -0.07365730 122  ASP   A HB3  
977   N  N    . CYS   A  68  ? 0.53970742 0.43186927 0.29139128 -0.13478178 -0.15582412 -0.06003314 123  CYS   A N    
978   C  CA   . CYS   A  68  ? 0.49723798 0.39949059 0.26263636 -0.13047501 -0.15073481 -0.05357046 123  CYS   A CA   
979   C  C    . CYS   A  68  ? 0.49469262 0.39610195 0.27256292 -0.13076365 -0.14406532 -0.05302782 123  CYS   A C    
980   O  O    . CYS   A  68  ? 0.47672445 0.38871405 0.27121741 -0.13093914 -0.14346972 -0.04885732 123  CYS   A O    
981   C  CB   . CYS   A  68  ? 0.49599075 0.39745045 0.25151849 -0.12411688 -0.14584363 -0.05034895 123  CYS   A CB   
982   S  SG   . CYS   A  68  ? 0.54408407 0.43277234 0.28653133 -0.11986494 -0.13517749 -0.05328654 123  CYS   A SG   
983   H  H    . CYS   A  68  ? 0.55189824 0.43731394 0.29033458 -0.13313144 -0.15479027 -0.06205525 123  CYS   A H    
984   H  HA   . CYS   A  68  ? 0.49865270 0.41008395 0.27275619 -0.13184436 -0.15564877 -0.05125476 123  CYS   A HA   
985   H  HB2  . CYS   A  68  ? 0.49063718 0.39978755 0.25596562 -0.12192657 -0.14422806 -0.04595568 123  CYS   A HB2  
986   H  HB3  . CYS   A  68  ? 0.51247776 0.41365063 0.25913024 -0.12437459 -0.15046321 -0.05069266 123  CYS   A HB3  
987   N  N    . LEU   A  69  ? 0.49662179 0.38524449 0.26612142 -0.13058907 -0.13916783 -0.05728307 124  LEU   A N    
988   C  CA   . LEU   A  69  ? 0.54571843 0.43167162 0.32542640 -0.13105796 -0.13361204 -0.05693588 124  LEU   A CA   
989   C  C    . LEU   A  69  ? 0.53891104 0.43015862 0.33255458 -0.13790278 -0.13845971 -0.05685949 124  LEU   A C    
990   O  O    . LEU   A  69  ? 0.54320467 0.44164765 0.35144490 -0.13794911 -0.13534847 -0.05297284 124  LEU   A O    
991   C  CB   . LEU   A  69  ? 0.58362174 0.45374501 0.35082439 -0.12965561 -0.12889814 -0.06220952 124  LEU   A CB   
992   C  CG   . LEU   A  69  ? 0.60981649 0.47664726 0.36879101 -0.12238565 -0.12110387 -0.06150937 124  LEU   A CG   
993   C  CD1  . LEU   A  69  ? 0.58760381 0.43938789 0.33429053 -0.12088037 -0.11736081 -0.06759612 124  LEU   A CD1  
994   C  CD2  . LEU   A  69  ? 0.60193419 0.47633058 0.37441912 -0.11859038 -0.11480196 -0.05587743 124  LEU   A CD2  
995   H  H    . LEU   A  69  ? 0.52196300 0.40318170 0.27893069 -0.13000061 -0.13932382 -0.06046090 124  LEU   A H    
996   H  HA   . LEU   A  69  ? 0.52439618 0.41574591 0.31045723 -0.12753168 -0.12939063 -0.05303709 124  LEU   A HA   
997   H  HB2  . LEU   A  69  ? 0.59728706 0.46154279 0.35520577 -0.13218096 -0.13289385 -0.06623427 124  LEU   A HB2  
998   H  HB3  . LEU   A  69  ? 0.58075714 0.44802332 0.35434693 -0.13132565 -0.12717634 -0.06250220 124  LEU   A HB3  
999   H  HG   . LEU   A  69  ? 0.60158002 0.47129497 0.35400730 -0.12099978 -0.12262972 -0.06080267 124  LEU   A HG   
1000  H  HD11 . LEU   A  69  ? 0.60254812 0.45316201 0.34266531 -0.11650666 -0.11305004 -0.06768603 124  LEU   A HD11 
1001  H  HD12 . LEU   A  69  ? 0.59544986 0.44406286 0.34837636 -0.12112363 -0.11492105 -0.06762245 124  LEU   A HD12 
1002  H  HD13 . LEU   A  69  ? 0.61186177 0.45805559 0.35073403 -0.12401211 -0.12173173 -0.07154001 124  LEU   A HD13 
1003  H  HD21 . LEU   A  69  ? 0.58817482 0.47196078 0.36703146 -0.11854349 -0.11664877 -0.05209097 124  LEU   A HD21 
1004  H  HD22 . LEU   A  69  ? 0.59477329 0.46743077 0.37447408 -0.12048820 -0.11407419 -0.05595696 124  LEU   A HD22 
1005  H  HD23 . LEU   A  69  ? 0.59753275 0.46904683 0.36497328 -0.11432177 -0.10966639 -0.05601203 124  LEU   A HD23 
1006  N  N    . SER   A  70  ? 0.50067079 0.38928145 0.29005253 -0.14392091 -0.14609349 -0.06101313 125  SER   A N    
1007  C  CA   . SER   A  70  ? 0.55621380 0.45044053 0.35877281 -0.15129119 -0.15080807 -0.06124051 125  SER   A CA   
1008  C  C    . SER   A  70  ? 0.53675336 0.44956475 0.35525614 -0.15161048 -0.15426034 -0.05624027 125  SER   A C    
1009  O  O    . SER   A  70  ? 0.62069327 0.54137087 0.45453635 -0.15568498 -0.15435724 -0.05444494 125  SER   A O    
1010  C  CB   . SER   A  70  ? 0.64329278 0.53041112 0.43711150 -0.15796694 -0.15861180 -0.06719062 125  SER   A CB   
1011  O  OG   . SER   A  70  ? 1.02015078 0.91175437 0.80585194 -0.15705371 -0.16515504 -0.06787999 125  SER   A OG   
1012  H  H    . SER   A  70  ? 0.53550673 0.41882700 0.31337070 -0.14365436 -0.14839810 -0.06384729 125  SER   A H    
1013  H  HA   . SER   A  70  ? 0.54901564 0.43959236 0.35642302 -0.15203808 -0.14663164 -0.06085087 125  SER   A HA   
1014  H  HB2  . SER   A  70  ? 0.68518722 0.57669771 0.48866445 -0.16327740 -0.16148543 -0.06717159 125  SER   A HB2  
1015  H  HB3  . SER   A  70  ? 0.69735789 0.57196772 0.48125321 -0.15782557 -0.15638414 -0.07072651 125  SER   A HB3  
1017  N  N    . ARG   A  71  ? 0.53244543 0.45189595 0.34700117 -0.14722843 -0.15693170 -0.05402453 126  ARG   A N    
1018  C  CA   . ARG   A  71  ? 0.54950017 0.48588231 0.37894565 -0.14595963 -0.15970220 -0.04913400 126  ARG   A CA   
1019  C  C    . ARG   A  71  ? 0.45879537 0.40047830 0.29789430 -0.14055458 -0.15162055 -0.04388981 126  ARG   A C    
1020  O  O    . ARG   A  71  ? 0.53799415 0.49316001 0.39229366 -0.14011823 -0.15242106 -0.04019449 126  ARG   A O    
1021  C  CB   . ARG   A  71  ? 0.57512939 0.51567471 0.39653203 -0.14335757 -0.16639747 -0.04845716 126  ARG   A CB   
1022  C  CG   . ARG   A  71  ? 0.68138385 0.61833948 0.49394196 -0.14897989 -0.17565644 -0.05353347 126  ARG   A CG   
1023  C  CD   . ARG   A  71  ? 0.71958321 0.66951871 0.54887223 -0.15518451 -0.18271632 -0.05383328 126  ARG   A CD   
1024  N  NE   . ARG   A  71  ? 0.81638622 0.78323698 0.66138834 -0.15191737 -0.18440659 -0.04869148 126  ARG   A NE   
1025  C  CZ   . ARG   A  71  ? 0.75499630 0.72879177 0.59781319 -0.14828175 -0.19063823 -0.04656705 126  ARG   A CZ   
1026  N  NH1  . ARG   A  71  ? 0.67162848 0.63950527 0.49920660 -0.14915910 -0.19768120 -0.04933731 126  ARG   A NH1  
1027  N  NH2  . ARG   A  71  ? 0.69834590 0.68500757 0.55436468 -0.14370355 -0.19016032 -0.04161508 126  ARG   A NH2  
1028  H  H    . ARG   A  71  ? 0.54764366 0.46080369 0.34992731 -0.14497915 -0.15706941 -0.05559868 126  ARG   A H    
1029  H  HA   . ARG   A  71  ? 0.53161907 0.47374198 0.37069595 -0.15072650 -0.16303423 -0.04978229 126  ARG   A HA   
1030  H  HB2  . ARG   A  71  ? 0.58930314 0.52399135 0.40057063 -0.13910936 -0.16297127 -0.04780626 126  ARG   A HB2  
1031  H  HB3  . ARG   A  71  ? 0.57888496 0.53038764 0.41060627 -0.14199257 -0.16820309 -0.04518492 126  ARG   A HB3  
1032  H  HG2  . ARG   A  71  ? 0.67472464 0.60096633 0.47889298 -0.15108173 -0.17392834 -0.05717343 126  ARG   A HG2  
1033  H  HG3  . ARG   A  71  ? 0.67265719 0.60930860 0.47643578 -0.14656025 -0.17891459 -0.05316290 126  ARG   A HG3  
1034  H  HD2  . ARG   A  71  ? 0.72902262 0.67724943 0.56452358 -0.15869863 -0.17987368 -0.05489815 126  ARG   A HD2  
1035  H  HD3  . ARG   A  71  ? 0.74400437 0.69245303 0.56735760 -0.15835989 -0.18922962 -0.05680807 126  ARG   A HD3  
1036  H  HE   . ARG   A  71  ? 0.76169938 0.73418480 0.61809868 -0.15225430 -0.18117546 -0.04691784 126  ARG   A HE   
1037  H  HH11 . ARG   A  71  ? 0.70986879 0.67211235 0.53190142 -0.15335128 -0.20003377 -0.05308491 126  ARG   A HH11 
1038  H  HH12 . ARG   A  71  ? 0.70072448 0.67009413 0.52344549 -0.14564253 -0.20017309 -0.04741321 126  ARG   A HH12 
1039  H  HH21 . ARG   A  71  ? 0.71187866 0.70406717 0.56834340 -0.14187689 -0.19532201 -0.04036970 126  ARG   A HH21 
1040  H  HH22 . ARG   A  71  ? 0.70102215 0.69033551 0.56504178 -0.14240748 -0.18479931 -0.03965769 126  ARG   A HH22 
1041  N  N    . GLY   A  72  ? 0.46091899 0.39231586 0.29170850 -0.13644701 -0.14382386 -0.04384267 127  GLY   A N    
1042  C  CA   . GLY   A  72  ? 0.40912411 0.34482130 0.24802878 -0.13144343 -0.13635121 -0.03913721 127  GLY   A CA   
1043  C  C    . GLY   A  72  ? 0.42951855 0.37186098 0.26694575 -0.12539352 -0.13610227 -0.03494213 127  GLY   A C    
1044  O  O    . GLY   A  72  ? 0.49574113 0.44701856 0.34466785 -0.12251320 -0.13323168 -0.03052257 127  GLY   A O    
1045  H  H    . GLY   A  72  ? 0.46268910 0.38437212 0.28253949 -0.13665789 -0.14322244 -0.04694674 127  GLY   A H    
1046  H  HA2  . GLY   A  72  ? 0.42544574 0.35265583 0.25889790 -0.12994522 -0.13133995 -0.04020370 127  GLY   A HA2  
1047  H  HA3  . GLY   A  72  ? 0.41532469 0.35771126 0.26642668 -0.13361181 -0.13612548 -0.03760836 127  GLY   A HA3  
1048  N  N    . ASP   A  73  ? 0.45268002 0.38965076 0.27495879 -0.12352260 -0.13881868 -0.03632643 128  ASP   A N    
1049  C  CA   . ASP   A  73  ? 0.42742598 0.36971816 0.24698514 -0.11869508 -0.13980913 -0.03222010 128  ASP   A CA   
1050  C  C    . ASP   A  73  ? 0.45610365 0.38869303 0.25657693 -0.11545378 -0.13751736 -0.03313730 128  ASP   A C    
1051  O  O    . ASP   A  73  ? 0.46410179 0.39892054 0.25795022 -0.11321199 -0.14106312 -0.03074285 128  ASP   A O    
1052  C  CB   . ASP   A  73  ? 0.43541330 0.38774282 0.26073617 -0.12069938 -0.14951181 -0.03136767 128  ASP   A CB   
1053  C  CG   . ASP   A  73  ? 0.45073265 0.39914727 0.26701126 -0.12543896 -0.15745942 -0.03601659 128  ASP   A CG   
1054  O  OD1  . ASP   A  73  ? 0.49188054 0.42797297 0.29281276 -0.12645464 -0.15587009 -0.04003994 128  ASP   A OD1  
1055  O  OD2  . ASP   A  73  ? 0.48662204 0.44452155 0.31125593 -0.12803636 -0.16537525 -0.03589386 128  ASP   A OD2  
1056  H  H    . ASP   A  73  ? 0.45507950 0.38453537 0.26809844 -0.12539333 -0.14011911 -0.03987188 128  ASP   A H    
1057  H  HA   . ASP   A  73  ? 0.42535675 0.37208468 0.25294498 -0.11611821 -0.13576311 -0.02900410 128  ASP   A HA   
1058  H  HB2  . ASP   A  73  ? 0.43297797 0.38792157 0.25591439 -0.11727218 -0.15042876 -0.02846061 128  ASP   A HB2  
1059  H  HB3  . ASP   A  73  ? 0.42521533 0.38523555 0.26392442 -0.12212467 -0.14995778 -0.03029907 128  ASP   A HB3  
1060  N  N    . CYS   A  74  ? 0.41573077 0.33773941 0.20759515 -0.11501206 -0.13138059 -0.03642759 129  CYS   A N    
1061  C  CA   . CYS   A  74  ? 0.43556380 0.34964830 0.21078251 -0.11155298 -0.12735209 -0.03725764 129  CYS   A CA   
1062  C  C    . CYS   A  74  ? 0.48668775 0.40612608 0.26599556 -0.10655949 -0.12194797 -0.03157028 129  CYS   A C    
1063  O  O    . CYS   A  74  ? 0.41676444 0.34286407 0.21076506 -0.10543085 -0.11911564 -0.02831616 129  CYS   A O    
1064  C  CB   . CYS   A  74  ? 0.44424328 0.34702903 0.21133879 -0.11130650 -0.12139538 -0.04213680 129  CYS   A CB   
1065  S  SG   . CYS   A  74  ? 0.50673693 0.40099278 0.27056736 -0.11732344 -0.12637116 -0.04905623 129  CYS   A SG   
1066  H  H    . CYS   A  74  ? 0.42654657 0.34631631 0.22302598 -0.11682840 -0.12957337 -0.03818436 129  CYS   A H    
1067  H  HA   . CYS   A  74  ? 0.45390886 0.36671299 0.22032192 -0.11250296 -0.13210000 -0.03821633 129  CYS   A HA   
1068  H  HB2  . CYS   A  74  ? 0.44315624 0.34703436 0.21773262 -0.10955239 -0.11633057 -0.04065933 129  CYS   A HB2  
1069  H  HB3  . CYS   A  74  ? 0.46006060 0.35841697 0.21557501 -0.10927267 -0.11925036 -0.04306430 129  CYS   A HB3  
1070  N  N    . CYS   A  75  ? 0.43837851 0.35439676 0.20388117 -0.10394944 -0.12044663 -0.03051687 130  CYS   A N    
1071  C  CA   . CYS   A  75  ? 0.45394608 0.37271324 0.22077581 -0.09969748 -0.11425041 -0.02582812 130  CYS   A CA   
1072  C  C    . CYS   A  75  ? 0.43972939 0.35462642 0.20930550 -0.09790422 -0.10537495 -0.02771136 130  CYS   A C    
1073  O  O    . CYS   A  75  ? 0.40304509 0.31050768 0.16710261 -0.09923722 -0.10405105 -0.03296993 130  CYS   A O    
1074  C  CB   . CYS   A  75  ? 0.43801117 0.35306096 0.18810423 -0.09822661 -0.11443259 -0.02452090 130  CYS   A CB   
1075  S  SG   . CYS   A  75  ? 0.52491158 0.44303954 0.26955459 -0.09998044 -0.12609100 -0.02228763 130  CYS   A SG   
1076  H  H    . CYS   A  75  ? 0.46722353 0.37896407 0.22191343 -0.10511483 -0.12335097 -0.03278334 130  CYS   A H    
1077  H  HA   . CYS   A  75  ? 0.43222326 0.35777199 0.20953454 -0.09909981 -0.11579062 -0.02237124 130  CYS   A HA   
1078  H  HB2  . CYS   A  75  ? 0.46706286 0.37572062 0.20679100 -0.09863085 -0.11225726 -0.02811620 130  CYS   A HB2  
1079  H  HB3  . CYS   A  75  ? 0.45032030 0.36728543 0.20194298 -0.09579530 -0.11018842 -0.02126246 130  CYS   A HB3  
1080  N  N    . THR   A  76  ? 0.44213712 0.36167705 0.21987000 -0.09471783 -0.09967581 -0.02351889 131  THR   A N    
1081  C  CA   . THR   A  76  ? 0.40034068 0.31714895 0.18155923 -0.09257603 -0.09166752 -0.02491105 131  THR   A CA   
1082  C  C    . THR   A  76  ? 0.41856897 0.32720146 0.18471354 -0.09111015 -0.08685128 -0.02909599 131  THR   A C    
1083  O  O    . THR   A  76  ? 0.48538995 0.38968682 0.25281176 -0.08979192 -0.08195826 -0.03233255 131  THR   A O    
1084  C  CB   . THR   A  76  ? 0.36874157 0.29238418 0.16110118 -0.08960263 -0.08688229 -0.01968067 131  THR   A CB   
1085  O  OG1  . THR   A  76  ? 0.36891973 0.29371965 0.15353543 -0.08764207 -0.08507307 -0.01643872 131  THR   A OG1  
1086  C  CG2  . THR   A  76  ? 0.34808138 0.27945867 0.15549000 -0.09076833 -0.09081931 -0.01649384 131  THR   A CG2  
1087  H  H    . THR   A  76  ? 0.42349511 0.34770849 0.20444600 -0.09378587 -0.10098851 -0.01984608 131  THR   A H    
1088  H  HA   . THR   A  76  ? 0.40269095 0.31843287 0.18969694 -0.09420212 -0.09270176 -0.02690747 131  THR   A HA   
1089  H  HB   . THR   A  76  ? 0.36601537 0.28775868 0.16070941 -0.08826467 -0.08205872 -0.02091344 131  THR   A HB   
1091  H  HG21 . THR   A  76  ? 0.34136984 0.27627125 0.15527439 -0.08885148 -0.08748007 -0.01365524 131  THR   A HG21 
1092  H  HG22 . THR   A  76  ? 0.35484895 0.28873116 0.16087827 -0.09160436 -0.09564571 -0.01515349 131  THR   A HG22 
1093  H  HG23 . THR   A  76  ? 0.35053721 0.28097060 0.16263720 -0.09263390 -0.09192393 -0.01865286 131  THR   A HG23 
1094  N  N    . ASN   A  77  ? 0.45306268 0.35928556 0.20460638 -0.09128548 -0.08837279 -0.02928324 132  ASN   A N    
1095  C  CA   . ASN   A  77  ? 0.44781768 0.34732288 0.18465629 -0.08977411 -0.08299118 -0.03327366 132  ASN   A CA   
1096  C  C    . ASN   A  77  ? 0.44247514 0.33359760 0.16633935 -0.09227276 -0.08715166 -0.03949361 132  ASN   A C    
1097  O  O    . ASN   A  77  ? 0.47826785 0.36386722 0.18713892 -0.09142698 -0.08402315 -0.04289705 132  ASN   A O    
1098  C  CB   . ASN   A  77  ? 0.42630205 0.32758531 0.15291739 -0.08848816 -0.08024399 -0.02971818 132  ASN   A CB   
1099  C  CG   . ASN   A  77  ? 0.46260327 0.36352009 0.17977265 -0.09092703 -0.08802063 -0.02763722 132  ASN   A CG   
1100  O  OD1  . ASN   A  77  ? 0.52273941 0.42478365 0.24441034 -0.09331306 -0.09606528 -0.02778473 132  ASN   A OD1  
1101  N  ND2  . ASN   A  77  ? 0.47402769 0.37368384 0.17828558 -0.09052055 -0.08604962 -0.02550600 132  ASN   A ND2  
1102  H  H    . ASN   A  77  ? 0.44430238 0.35317096 0.19487977 -0.09225354 -0.09271310 -0.02687427 132  ASN   A H    
1103  H  HA   . ASN   A  77  ? 0.43670344 0.33560115 0.17800201 -0.08784072 -0.07782525 -0.03448668 132  ASN   A HA   
1104  H  HB2  . ASN   A  77  ? 0.44544870 0.34316337 0.16351093 -0.08741263 -0.07572389 -0.03254354 132  ASN   A HB2  
1105  H  HB3  . ASN   A  77  ? 0.42804077 0.33418176 0.16263610 -0.08706550 -0.07762167 -0.02590730 132  ASN   A HB3  
1106  H  HD21 . ASN   A  77  ? 0.46999747 0.37093377 0.17418632 -0.08899426 -0.08054079 -0.02414571 132  ASN   A HD21 
1107  H  HD22 . ASN   A  77  ? 0.48343611 0.38093942 0.17880231 -0.09193017 -0.09025202 -0.02534996 132  ASN   A HD22 
1108  N  N    . TYR   A  78  ? 0.52471530 0.41497889 0.25437564 -0.09555943 -0.09393026 -0.04124392 133  TYR   A N    
1109  C  CA   . TYR   A  78  ? 0.48565501 0.36812550 0.20312750 -0.09866226 -0.09918105 -0.04694052 133  TYR   A CA   
1110  C  C    . TYR   A  78  ? 0.52149767 0.39413512 0.22974174 -0.09710307 -0.09367172 -0.05361816 133  TYR   A C    
1111  O  O    . TYR   A  78  ? 0.52225232 0.38826370 0.21358562 -0.09732591 -0.09375208 -0.05785059 133  TYR   A O    
1112  C  CB   . TYR   A  78  ? 0.51569086 0.40019232 0.24353594 -0.10290864 -0.10701196 -0.04737419 133  TYR   A CB   
1113  C  CG   . TYR   A  78  ? 0.55393076 0.42979693 0.27153459 -0.10678136 -0.11249090 -0.05384167 133  TYR   A CG   
1114  C  CD1  . TYR   A  78  ? 0.53173852 0.40549040 0.23539782 -0.10891011 -0.11877693 -0.05527350 133  TYR   A CD1  
1115  C  CD2  . TYR   A  78  ? 0.58168185 0.45091665 0.30322570 -0.10858650 -0.11190858 -0.05840675 133  TYR   A CD2  
1116  C  CE1  . TYR   A  78  ? 0.57770348 0.44322121 0.27161828 -0.11280783 -0.12423276 -0.06156188 133  TYR   A CE1  
1117  C  CE2  . TYR   A  78  ? 0.58456159 0.44504237 0.29661217 -0.11254321 -0.11718697 -0.06451627 133  TYR   A CE2  
1118  C  CZ   . TYR   A  78  ? 0.56918263 0.42805579 0.26756176 -0.11467210 -0.12329468 -0.06625461 133  TYR   A CZ   
1119  O  OH   . TYR   A  78  ? 0.59211600 0.44201732 0.28123564 -0.11879185 -0.12858821 -0.07259187 133  TYR   A OH   
1120  H  H    . TYR   A  78  ? 0.47714567 0.37179548 0.21844462 -0.09608031 -0.09525795 -0.03897975 133  TYR   A H    
1121  H  HA   . TYR   A  78  ? 0.51353478 0.39585507 0.22128579 -0.09914122 -0.10160368 -0.04618662 133  TYR   A HA   
1122  H  HB2  . TYR   A  78  ? 0.50729847 0.39787716 0.23888522 -0.10366425 -0.11108781 -0.04375249 133  TYR   A HB2  
1123  H  HB3  . TYR   A  78  ? 0.50270236 0.38873637 0.24133205 -0.10252035 -0.10461736 -0.04674433 133  TYR   A HB3  
1124  H  HD1  . TYR   A  78  ? 0.54617983 0.42358223 0.24632937 -0.10778534 -0.11951067 -0.05199412 133  TYR   A HD1  
1125  H  HD2  . TYR   A  78  ? 0.56382364 0.43399835 0.29427472 -0.10719012 -0.10798354 -0.05731983 133  TYR   A HD2  
1126  H  HE1  . TYR   A  78  ? 0.57952559 0.44355938 0.26348048 -0.11424008 -0.12867408 -0.06254943 133  TYR   A HE1  
1127  H  HE2  . TYR   A  78  ? 0.58188474 0.43703061 0.29636982 -0.11384933 -0.11673871 -0.06749114 133  TYR   A HE2  
1129  N  N    . GLN   A  79  ? 0.52492350 0.39617383 0.24386936 -0.09542435 -0.08922374 -0.05474763 134  GLN   A N    
1130  C  CA   . GLN   A  79  ? 0.59550464 0.45692450 0.30729538 -0.09328275 -0.08442247 -0.06125354 134  GLN   A CA   
1131  C  C    . GLN   A  79  ? 0.56085324 0.42217016 0.26225698 -0.08888784 -0.07667239 -0.06225336 134  GLN   A C    
1132  O  O    . GLN   A  79  ? 0.63151747 0.48469946 0.32203746 -0.08709988 -0.07342266 -0.06849144 134  GLN   A O    
1133  C  CB   . GLN   A  79  ? 0.57421654 0.43389297 0.29933587 -0.09151528 -0.08081304 -0.06160794 134  GLN   A CB   
1134  C  CG   . GLN   A  79  ? 0.64575464 0.50575650 0.38283974 -0.09590737 -0.08670849 -0.06037922 134  GLN   A CG   
1135  C  CD   . GLN   A  79  ? 0.83530664 0.68454492 0.56416911 -0.09974047 -0.09179214 -0.06661651 134  GLN   A CD   
1136  O  OE1  . GLN   A  79  ? 0.83020568 0.66889876 0.55176020 -0.09771554 -0.08868486 -0.07219939 134  GLN   A OE1  
1137  N  NE2  . GLN   A  79  ? 0.84687072 0.69850504 0.57675314 -0.10527520 -0.09994276 -0.06604719 134  GLN   A NE2  
1138  H  H    . GLN   A  79  ? 0.52193838 0.39819640 0.25258112 -0.09544501 -0.08927239 -0.05145221 134  GLN   A H    
1139  H  HA   . GLN   A  79  ? 0.58427215 0.43952501 0.28827369 -0.09569597 -0.08835199 -0.06525093 134  GLN   A HA   
1140  H  HB2  . GLN   A  79  ? 0.58208013 0.44749019 0.31373617 -0.08885676 -0.07661207 -0.05810995 134  GLN   A HB2  
1141  H  HB3  . GLN   A  79  ? 0.60443425 0.45683718 0.32344943 -0.08979428 -0.07813726 -0.06623454 134  GLN   A HB3  
1142  H  HG2  . GLN   A  79  ? 0.65033126 0.51722819 0.39206681 -0.09788134 -0.09022339 -0.05665945 134  GLN   A HG2  
1143  H  HG3  . GLN   A  79  ? 0.64881694 0.50943661 0.39477620 -0.09437945 -0.08368875 -0.05906966 134  GLN   A HG3  
1144  H  HE21 . GLN   A  79  ? 0.82352400 0.68208575 0.56287897 -0.10678940 -0.10202681 -0.06226800 134  GLN   A HE21 
1145  H  HE22 . GLN   A  79  ? 0.85073251 0.69727898 0.57192975 -0.10735962 -0.10329068 -0.06957064 134  GLN   A HE22 
1146  N  N    . VAL   A  80  ? 0.55032480 0.42071834 0.25575167 -0.08720592 -0.07348097 -0.05624963 135  VAL   A N    
1147  C  CA   . VAL   A  80  ? 0.54935431 0.42151192 0.24731115 -0.08355996 -0.06541546 -0.05636008 135  VAL   A CA   
1148  C  C    . VAL   A  80  ? 0.65616566 0.52474147 0.33466938 -0.08524611 -0.06701718 -0.05839230 135  VAL   A C    
1149  O  O    . VAL   A  80  ? 0.69260752 0.55596173 0.35860032 -0.08337443 -0.06213436 -0.06376218 135  VAL   A O    
1150  C  CB   . VAL   A  80  ? 0.56661654 0.44924358 0.27611902 -0.08192649 -0.06177934 -0.04897383 135  VAL   A CB   
1151  C  CG1  . VAL   A  80  ? 0.55756032 0.44311589 0.25813034 -0.07961371 -0.05430507 -0.04822798 135  VAL   A CG1  
1152  C  CG2  . VAL   A  80  ? 0.48258203 0.36808580 0.20937935 -0.07974429 -0.05910348 -0.04766890 135  VAL   A CG2  
1153  H  H    . VAL   A  80  ? 0.53935194 0.41510490 0.25272384 -0.08847085 -0.07632852 -0.05199086 135  VAL   A H    
1154  H  HA   . VAL   A  80  ? 0.57336289 0.44200587 0.27125481 -0.08111474 -0.06123945 -0.06009865 135  VAL   A HA   
1155  H  HB   . VAL   A  80  ? 0.53913182 0.42480856 0.25045928 -0.08418101 -0.06660324 -0.04528066 135  VAL   A HB   
1156  H  HG11 . VAL   A  80  ? 0.56759608 0.44987649 0.26399118 -0.07749727 -0.04999427 -0.05268143 135  VAL   A HG11 
1157  H  HG12 . VAL   A  80  ? 0.56994784 0.45469993 0.26049662 -0.08147822 -0.05658906 -0.04736952 135  VAL   A HG12 
1158  H  HG13 . VAL   A  80  ? 0.54963946 0.44113842 0.25863132 -0.07848402 -0.05158875 -0.04418664 135  VAL   A HG13 
1159  H  HG21 . VAL   A  80  ? 0.49020860 0.38199103 0.22347204 -0.07877734 -0.05683342 -0.04335023 135  VAL   A HG21 
1160  H  HG22 . VAL   A  80  ? 0.49739224 0.38178641 0.22991629 -0.08177470 -0.06380547 -0.04744386 135  VAL   A HG22 
1161  H  HG23 . VAL   A  80  ? 0.50421613 0.38628098 0.22971013 -0.07732169 -0.05503200 -0.05140201 135  VAL   A HG23 
1162  N  N    . VAL   A  81  ? 0.63407570 0.50545710 0.31008199 -0.08863309 -0.07409900 -0.05415873 136  VAL   A N    
1163  C  CA   . VAL   A  81  ? 0.68614906 0.55429518 0.34345943 -0.09058206 -0.07676840 -0.05488100 136  VAL   A CA   
1164  C  C    . VAL   A  81  ? 0.73463887 0.59303492 0.37970078 -0.09290385 -0.08168277 -0.06216919 136  VAL   A C    
1165  O  O    . VAL   A  81  ? 0.61695760 0.46946555 0.24444687 -0.09260441 -0.07911304 -0.06665333 136  VAL   A O    
1166  C  CB   . VAL   A  81  ? 0.64892316 0.52307343 0.30866039 -0.09283560 -0.08333303 -0.04757999 136  VAL   A CB   
1167  C  CG1  . VAL   A  81  ? 0.74911010 0.61913180 0.38906404 -0.09515750 -0.08768925 -0.04778298 136  VAL   A CG1  
1168  C  CG2  . VAL   A  81  ? 0.58916104 0.47134867 0.25881284 -0.09051010 -0.07782693 -0.04099457 136  VAL   A CG2  
1169  H  H    . VAL   A  81  ? 0.63468480 0.51009297 0.32089555 -0.08964609 -0.07748301 -0.05072199 136  VAL   A H    
1170  H  HA   . VAL   A  81  ? 0.68155640 0.54991013 0.33223936 -0.08876585 -0.07078250 -0.05532096 136  VAL   A HA   
1171  H  HB   . VAL   A  81  ? 0.65300530 0.52841747 0.32148856 -0.09436619 -0.08879632 -0.04702511 136  VAL   A HB   
1172  H  HG11 . VAL   A  81  ? 0.72984850 0.59806979 0.36004362 -0.09401692 -0.08211109 -0.04898995 136  VAL   A HG11 
1173  H  HG12 . VAL   A  81  ? 0.73198259 0.59733796 0.36677325 -0.09699778 -0.09234368 -0.05167458 136  VAL   A HG12 
1174  H  HG13 . VAL   A  81  ? 0.71818793 0.59190607 0.36006588 -0.09599409 -0.09150061 -0.04282436 136  VAL   A HG13 
1175  H  HG21 . VAL   A  81  ? 0.60034621 0.48525071 0.26980302 -0.09165621 -0.08184786 -0.03661067 136  VAL   A HG21 
1176  H  HG22 . VAL   A  81  ? 0.58875018 0.47386104 0.27155733 -0.08937308 -0.07643747 -0.04039102 136  VAL   A HG22 
1177  H  HG23 . VAL   A  81  ? 0.60583651 0.48745006 0.26875049 -0.08906944 -0.07172802 -0.04179491 136  VAL   A HG23 
1178  N  N    . CYS   A  82  ? 0.67889321 0.53548551 0.33304632 -0.09546246 -0.08847967 -0.06360129 137  CYS   A N    
1179  C  CA   . CYS   A  82  ? 0.61489612 0.46246201 0.25780767 -0.09875103 -0.09479564 -0.06995276 137  CYS   A CA   
1180  C  C    . CYS   A  82  ? 0.63340789 0.47141311 0.27471644 -0.09751385 -0.09145333 -0.07764710 137  CYS   A C    
1181  O  O    . CYS   A  82  ? 0.71203089 0.54088247 0.33972418 -0.09962654 -0.09501184 -0.08390164 137  CYS   A O    
1182  C  CB   . CYS   A  82  ? 0.56865060 0.41947559 0.22003743 -0.10330608 -0.10532664 -0.06750541 137  CYS   A CB   
1183  S  SG   . CYS   A  82  ? 0.63710731 0.49756747 0.28900927 -0.10435984 -0.11106449 -0.05923121 137  CYS   A SG   
1184  H  H    . CYS   A  82  ? 0.65531206 0.51635766 0.32265800 -0.09540814 -0.08918179 -0.06064244 137  CYS   A H    
1185  H  HA   . CYS   A  82  ? 0.63467538 0.47981369 0.26363090 -0.09910455 -0.09501349 -0.07105172 137  CYS   A HA   
1186  H  HB2  . CYS   A  82  ? 0.57855719 0.43190610 0.24346301 -0.10332984 -0.10507191 -0.06639498 137  CYS   A HB2  
1187  H  HB3  . CYS   A  82  ? 0.60316235 0.44801629 0.24657306 -0.10580323 -0.10970099 -0.07183708 137  CYS   A HB3  
1188  N  N    . LYS   A  83  ? 0.58885080 0.42818522 0.24357355 -0.09421536 -0.08542849 -0.07729381 138  LYS   A N    
1189  C  CA   . LYS   A  83  ? 0.57353187 0.40285718 0.22749773 -0.09263935 -0.08286843 -0.08422235 138  LYS   A CA   
1190  C  C    . LYS   A  83  ? 0.59184307 0.42042351 0.24496144 -0.08637901 -0.07245462 -0.08660909 138  LYS   A C    
1191  O  O    . LYS   A  83  ? 0.81734192 0.63875169 0.47353324 -0.08392133 -0.06985696 -0.09121445 138  LYS   A O    
1192  C  CB   . LYS   A  83  ? 0.59377038 0.42271018 0.26448122 -0.09482692 -0.08662792 -0.08282471 138  LYS   A CB   
1193  C  CG   . LYS   A  83  ? 0.65219021 0.48145717 0.32504624 -0.10145208 -0.09710185 -0.08195142 138  LYS   A CG   
1194  C  CD   . LYS   A  83  ? 0.67325962 0.49123132 0.32984293 -0.10493573 -0.10261335 -0.08930167 138  LYS   A CD   
1195  C  CE   . LYS   A  83  ? 0.72985041 0.55041933 0.39059025 -0.11159376 -0.11309168 -0.08792451 138  LYS   A CE   
1196  N  NZ   . LYS   A  83  ? 0.85025948 0.66197819 0.49341792 -0.11510176 -0.11911277 -0.09411297 138  LYS   A NZ   
1197  H  H    . LYS   A  83  ? 0.57775950 0.42395851 0.24204177 -0.09285862 -0.08311891 -0.07263521 138  LYS   A H    
1198  H  HA   . LYS   A  83  ? 0.60352778 0.42581174 0.24587119 -0.09442155 -0.08585294 -0.08888558 138  LYS   A HA   
1199  H  HB2  . LYS   A  83  ? 0.58255678 0.41857970 0.26446590 -0.09324452 -0.08401958 -0.07812889 138  LYS   A HB2  
1200  H  HB3  . LYS   A  83  ? 0.60355496 0.42499349 0.27315724 -0.09347211 -0.08464629 -0.08720890 138  LYS   A HB3  
1201  H  HG2  . LYS   A  83  ? 0.63208783 0.46878865 0.30634445 -0.10234924 -0.09930640 -0.07760049 138  LYS   A HG2  
1202  H  HG3  . LYS   A  83  ? 0.62918788 0.45920163 0.31347299 -0.10277525 -0.09839972 -0.08064795 138  LYS   A HG3  
1203  H  HD2  . LYS   A  83  ? 0.69164979 0.50145507 0.34683704 -0.10409418 -0.10074721 -0.09375063 138  LYS   A HD2  
1204  H  HD3  . LYS   A  83  ? 0.69397420 0.51095062 0.33837903 -0.10368109 -0.10120899 -0.09071041 138  LYS   A HD3  
1205  H  HE2  . LYS   A  83  ? 0.72545964 0.55497265 0.39114839 -0.11189833 -0.11480775 -0.08283384 138  LYS   A HE2  
1206  H  HE3  . LYS   A  83  ? 0.73006576 0.54957736 0.40067720 -0.11345292 -0.11445820 -0.08791817 138  LYS   A HE3  
1207  H  HZ1  . LYS   A  83  ? 0.82185841 0.63451457 0.45529175 -0.11361796 -0.11799433 -0.09393915 138  LYS   A HZ1  
1208  H  HZ2  . LYS   A  83  ? 0.82625389 0.62912989 0.46448186 -0.11476834 -0.11760671 -0.09907094 138  LYS   A HZ2  
1209  H  HZ3  . LYS   A  83  ? 0.81814682 0.63214749 0.46478590 -0.11914511 -0.12556210 -0.09325492 138  LYS   A HZ3  
1210  N  N    . GLY   A  84  ? 0.63781726 0.47368985 0.28681493 -0.08387024 -0.06666948 -0.08352645 139  GLY   A N    
1211  C  CA   . GLY   A  84  ? 0.63077050 0.46724004 0.27742314 -0.07821277 -0.05664069 -0.08641326 139  GLY   A CA   
1212  C  C    . GLY   A  84  ? 0.61988616 0.46187267 0.28463769 -0.07413290 -0.05133124 -0.08356150 139  GLY   A C    
1213  O  O    . GLY   A  84  ? 0.64239895 0.48468664 0.30728203 -0.06906556 -0.04361365 -0.08667751 139  GLY   A O    
1214  H  H    . GLY   A  84  ? 0.61930096 0.46007356 0.26704028 -0.08580367 -0.06906918 -0.07948390 139  GLY   A H    
1215  H  HA2  . GLY   A  84  ? 0.63667542 0.47757280 0.27676624 -0.07800486 -0.05388462 -0.08453236 139  GLY   A HA2  
1216  H  HA3  . GLY   A  84  ? 0.64837426 0.47692376 0.28650612 -0.07710393 -0.05575057 -0.09264235 139  GLY   A HA3  
1217  N  N    . GLU   A  85  ? 0.60995328 0.45665243 0.29009354 -0.07620311 -0.05549412 -0.07781392 140  GLU   A N    
1218  C  CA   . GLU   A  85  ? 0.63269365 0.48430604 0.32928672 -0.07272341 -0.05115423 -0.07483047 140  GLU   A CA   
1219  C  C    . GLU   A  85  ? 0.55053759 0.41399041 0.25207722 -0.07074150 -0.04551282 -0.06904118 140  GLU   A C    
1220  O  O    . GLU   A  85  ? 0.53440094 0.40241158 0.22904907 -0.07314949 -0.04666080 -0.06567834 140  GLU   A O    
1221  C  CB   . GLU   A  85  ? 0.65722716 0.50884360 0.36738920 -0.07602160 -0.05746686 -0.07131673 140  GLU   A CB   
1222  C  CG   . GLU   A  85  ? 0.68645531 0.52554178 0.39290458 -0.07795470 -0.06201477 -0.07728191 140  GLU   A CG   
1223  C  CD   . GLU   A  85  ? 0.93321824 0.77156925 0.65361464 -0.08104303 -0.06673198 -0.07437780 140  GLU   A CD   
1224  O  OE1  . GLU   A  85  ? 0.78335142 0.63116938 0.51722056 -0.08095472 -0.06593874 -0.06792226 140  GLU   A OE1  
1225  O  OE2  . GLU   A  85  ? 0.83185810 0.65990925 0.54923737 -0.08387986 -0.07117107 -0.07864843 140  GLU   A OE2  
1226  H  H    . GLU   A  85  ? 0.61589664 0.46305725 0.29629523 -0.07981709 -0.06117142 -0.07572506 140  GLU   A H    
1227  H  HA   . GLU   A  85  ? 0.62147403 0.46824479 0.31676319 -0.06946670 -0.04764965 -0.07923479 140  GLU   A HA   
1228  H  HB2  . GLU   A  85  ? 0.64749968 0.50342011 0.35846812 -0.07919516 -0.06148697 -0.06769454 140  GLU   A HB2  
1229  H  HB3  . GLU   A  85  ? 0.64035892 0.49595147 0.36103243 -0.07385368 -0.05459221 -0.06867135 140  GLU   A HB3  
1230  H  HG2  . GLU   A  85  ? 0.73511428 0.56888872 0.43826553 -0.07446516 -0.05811983 -0.08151481 140  GLU   A HG2  
1231  H  HG3  . GLU   A  85  ? 0.73956919 0.57536775 0.43650833 -0.08079290 -0.06582677 -0.07940884 140  GLU   A HG3  
1232  N  N    . SER   A  86  ? 0.51396656 0.38178998 0.22692074 -0.06638102 -0.03957491 -0.06798724 141  SER   A N    
1233  C  CA   . SER   A  86  ? 0.53817487 0.41723686 0.25703472 -0.06474126 -0.03409420 -0.06270161 141  SER   A CA   
1234  C  C    . SER   A  86  ? 0.47326329 0.35912639 0.20528114 -0.06743512 -0.03822101 -0.05501314 141  SER   A C    
1235  O  O    . SER   A  86  ? 0.56844825 0.45152986 0.30906430 -0.06886192 -0.04296366 -0.05426567 141  SER   A O    
1236  C  CB   . SER   A  86  ? 0.58279645 0.46445966 0.30871058 -0.05888383 -0.02636908 -0.06509922 141  SER   A CB   
1237  O  OG   . SER   A  86  ? 0.54354316 0.42088434 0.28075972 -0.05717099 -0.02845160 -0.06579886 141  SER   A OG   
1238  H  H    . SER   A  86  ? 0.52908993 0.39260009 0.24611518 -0.06449514 -0.03913962 -0.07057694 141  SER   A H    
1239  H  HA   . SER   A  86  ? 0.53609765 0.41668987 0.24538571 -0.06574591 -0.03277610 -0.06265004 141  SER   A HA   
1240  H  HB2  . SER   A  86  ? 0.55377209 0.44337124 0.28479832 -0.05825929 -0.02309267 -0.06130503 141  SER   A HB2  
1241  H  HB3  . SER   A  86  ? 0.57477182 0.45323139 0.29206148 -0.05686460 -0.02313990 -0.07000997 141  SER   A HB3  
1243  N  N    . HIS   A  87  ? 0.45603293 0.35054594 0.18954606 -0.06819139 -0.03620182 -0.04940522 142  HIS   A N    
1244  C  CA   . HIS   A  87  ? 0.46547931 0.36734647 0.21359272 -0.06894712 -0.03769891 -0.04262270 142  HIS   A CA   
1245  C  C    . HIS   A  87  ? 0.41314170 0.31713626 0.17515633 -0.06527815 -0.03394996 -0.04269079 142  HIS   A C    
1246  O  O    . HIS   A  87  ? 0.46609819 0.36993510 0.22736934 -0.06130794 -0.02797450 -0.04633695 142  HIS   A O    
1247  C  CB   . HIS   A  87  ? 0.43442076 0.34403265 0.18105555 -0.06970474 -0.03493856 -0.03728777 142  HIS   A CB   
1248  C  CG   . HIS   A  87  ? 0.46461248 0.37294203 0.19991514 -0.07348085 -0.03985518 -0.03497127 142  HIS   A CG   
1249  N  ND1  . HIS   A  87  ? 0.51513988 0.42376396 0.25485247 -0.07638499 -0.04765466 -0.03134852 142  HIS   A ND1  
1250  C  CD2  . HIS   A  87  ? 0.44617099 0.35329723 0.16634169 -0.07458115 -0.03793186 -0.03561209 142  HIS   A CD2  
1251  C  CE1  . HIS   A  87  ? 0.52374572 0.43104154 0.25113648 -0.07880832 -0.05078712 -0.02981230 142  HIS   A CE1  
1252  N  NE2  . HIS   A  87  ? 0.49507654 0.40091461 0.20967561 -0.07803290 -0.04507398 -0.03218166 142  HIS   A NE2  
1253  H  H    . HIS   A  87  ? 0.47159255 0.36711258 0.19653411 -0.06833395 -0.03381493 -0.04983447 142  HIS   A H    
1254  H  HA   . HIS   A  87  ? 0.44563317 0.34593409 0.19564810 -0.07152775 -0.04331455 -0.04127827 142  HIS   A HA   
1255  H  HB2  . HIS   A  87  ? 0.44976446 0.36097488 0.19303949 -0.06773765 -0.02941141 -0.03898875 142  HIS   A HB2  
1256  H  HB3  . HIS   A  87  ? 0.43367973 0.34790286 0.19058293 -0.06953450 -0.03508753 -0.03341836 142  HIS   A HB3  
1258  H  HD2  . HIS   A  87  ? 0.46914572 0.37648758 0.18366152 -0.07317746 -0.03264059 -0.03799791 142  HIS   A HD2  
1259  H  HE1  . HIS   A  87  ? 0.51472598 0.42211971 0.24213919 -0.08076411 -0.05632775 -0.02749220 142  HIS   A HE1  
1261  N  N    . TRP   A  88  ? 0.45744342 0.36366183 0.23200679 -0.06648958 -0.03756632 -0.03871478 143  TRP   A N    
1262  C  CA   . TRP   A  88  ? 0.41289410 0.32129854 0.20045224 -0.06346033 -0.03476248 -0.03773951 143  TRP   A CA   
1263  C  C    . TRP   A  88  ? 0.41355422 0.32969105 0.20465115 -0.06000834 -0.02761700 -0.03627129 143  TRP   A C    
1264  O  O    . TRP   A  88  ? 0.51151192 0.42730856 0.30649415 -0.05583575 -0.02333826 -0.03915623 143  TRP   A O    
1265  C  CB   . TRP   A  88  ? 0.43277669 0.34431273 0.23218030 -0.06611597 -0.03951624 -0.03254630 143  TRP   A CB   
1266  C  CG   . TRP   A  88  ? 0.39059508 0.30526549 0.20281246 -0.06346699 -0.03683754 -0.03042889 143  TRP   A CG   
1267  C  CD1  . TRP   A  88  ? 0.47464997 0.38362402 0.29176223 -0.06190502 -0.03715993 -0.03265697 143  TRP   A CD1  
1268  C  CD2  . TRP   A  88  ? 0.42375040 0.34727478 0.24446350 -0.06207515 -0.03353531 -0.02573909 143  TRP   A CD2  
1269  N  NE1  . TRP   A  88  ? 0.48073411 0.39478755 0.30882400 -0.05948435 -0.03445676 -0.02946776 143  TRP   A NE1  
1270  C  CE2  . TRP   A  88  ? 0.44224888 0.36549050 0.27292606 -0.05959830 -0.03219874 -0.02540306 143  TRP   A CE2  
1271  C  CE3  . TRP   A  88  ? 0.37386954 0.30487689 0.19437715 -0.06297349 -0.03195362 -0.02159278 143  TRP   A CE3  
1272  C  CZ2  . TRP   A  88  ? 0.37702996 0.30776343 0.21741825 -0.05804539 -0.02951351 -0.02136694 143  TRP   A CZ2  
1273  C  CZ3  . TRP   A  88  ? 0.40299842 0.34096649 0.23331708 -0.06155133 -0.02907236 -0.01775859 143  TRP   A CZ3  
1274  C  CH2  . TRP   A  88  ? 0.32272485 0.26089019 0.16290379 -0.05914618 -0.02795230 -0.01775253 143  TRP   A CH2  
1275  H  H    . TRP   A  88  ? 0.43262005 0.33913714 0.20753925 -0.06928612 -0.04201230 -0.03654214 143  TRP   A H    
1276  H  HA   . TRP   A  88  ? 0.43182266 0.33429310 0.21818197 -0.06201623 -0.03466570 -0.04164701 143  TRP   A HA   
1277  H  HB2  . TRP   A  88  ? 0.42169559 0.32846445 0.21977371 -0.06820638 -0.04359951 -0.03404113 143  TRP   A HB2  
1278  H  HB3  . TRP   A  88  ? 0.41369492 0.32983363 0.21302518 -0.06773750 -0.04059312 -0.02913629 143  TRP   A HB3  
1279  H  HD1  . TRP   A  88  ? 0.46254575 0.36461115 0.27572459 -0.06246514 -0.03909523 -0.03590260 143  TRP   A HD1  
1280  H  HE1  . TRP   A  88  ? 0.46453589 0.37591043 0.29683134 -0.05818949 -0.03437787 -0.02994359 143  TRP   A HE1  
1281  H  HE3  . TRP   A  88  ? 0.39808208 0.32885367 0.21141548 -0.06460375 -0.03297320 -0.02146408 143  TRP   A HE3  
1282  H  HZ2  . TRP   A  88  ? 0.37116629 0.30144542 0.21757923 -0.05639663 -0.02892479 -0.02111750 143  TRP   A HZ2  
1283  H  HZ3  . TRP   A  88  ? 0.37091941 0.31323054 0.20088883 -0.06234573 -0.02805511 -0.01501448 143  TRP   A HZ3  
1284  H  HH2  . TRP   A  88  ? 0.34239498 0.28540385 0.18878715 -0.05829931 -0.02618895 -0.01520220 143  TRP   A HH2  
1285  N  N    . VAL   A  89  ? 0.42747200 0.35038829 0.21698131 -0.06181370 -0.02653786 -0.03188409 144  VAL   A N    
1286  C  CA   . VAL   A  89  ? 0.43094808 0.36185396 0.22355193 -0.05970778 -0.01992191 -0.03007834 144  VAL   A CA   
1287  C  C    . VAL   A  89  ? 0.46946704 0.40017951 0.25444418 -0.05657318 -0.01348856 -0.03554078 144  VAL   A C    
1288  O  O    . VAL   A  89  ? 0.52795774 0.46555516 0.31837654 -0.05386684 -0.00753404 -0.03544263 144  VAL   A O    
1289  C  CB   . VAL   A  89  ? 0.44036132 0.37651730 0.23011929 -0.06310099 -0.02058158 -0.02436300 144  VAL   A CB   
1290  C  CG1  . VAL   A  89  ? 0.44344196 0.37581295 0.21679370 -0.06555335 -0.02143091 -0.02588364 144  VAL   A CG1  
1291  C  CG2  . VAL   A  89  ? 0.46574533 0.41069573 0.26224983 -0.06184300 -0.01457895 -0.02132336 144  VAL   A CG2  
1292  H  H    . VAL   A  89  ? 0.42601302 0.34850514 0.21251109 -0.06456051 -0.03019236 -0.02988788 144  VAL   A H    
1293  H  HA   . VAL   A  89  ? 0.42719486 0.36077070 0.22952990 -0.05813114 -0.01911776 -0.02868999 144  VAL   A HA   
1294  H  HB   . VAL   A  89  ? 0.43427986 0.37027544 0.22872984 -0.06473541 -0.02492917 -0.02142446 144  VAL   A HB   
1295  H  HG11 . VAL   A  89  ? 0.45342255 0.38682598 0.22179797 -0.06421991 -0.01662083 -0.02840358 144  VAL   A HG11 
1296  H  HG12 . VAL   A  89  ? 0.45278868 0.37964490 0.22212534 -0.06624268 -0.02519383 -0.02834119 144  VAL   A HG12 
1297  H  HG13 . VAL   A  89  ? 0.44527525 0.37962669 0.21698745 -0.06780252 -0.02309785 -0.02188953 144  VAL   A HG13 
1298  H  HG21 . VAL   A  89  ? 0.45086581 0.39817169 0.24763003 -0.06407952 -0.01597917 -0.01715108 144  VAL   A HG21 
1299  H  HG22 . VAL   A  89  ? 0.44700170 0.39382678 0.25286621 -0.05983679 -0.01383310 -0.02126437 144  VAL   A HG22 
1300  H  HG23 . VAL   A  89  ? 0.46218860 0.40845290 0.25326571 -0.06090242 -0.01020083 -0.02366867 144  VAL   A HG23 
1301  N  N    . ASP   A  90  ? 0.45087865 0.37417203 0.22325826 -0.05693214 -0.01459401 -0.04061377 145  ASP   A N    
1302  C  CA   . ASP   A  90  ? 0.50420541 0.42718279 0.26874104 -0.05369117 -0.00825973 -0.04644234 145  ASP   A CA   
1303  C  C    . ASP   A  90  ? 0.55730319 0.47567618 0.32725114 -0.04857376 -0.00680048 -0.05196817 145  ASP   A C    
1304  O  O    . ASP   A  90  ? 0.49370980 0.41186464 0.25892910 -0.04477471 -0.00145331 -0.05750591 145  ASP   A O    
1305  C  CB   . ASP   A  90  ? 0.54843867 0.46529561 0.29541698 -0.05630653 -0.00976332 -0.04961088 145  ASP   A CB   
1306  C  CG   . ASP   A  90  ? 0.60168254 0.52276659 0.34169295 -0.06073016 -0.01045932 -0.04421587 145  ASP   A CG   
1307  O  OD1  . ASP   A  90  ? 0.52857679 0.45828646 0.27269897 -0.06070184 -0.00533893 -0.04058624 145  ASP   A OD1  
1308  O  OD2  . ASP   A  90  ? 0.68685615 0.60243940 0.41709056 -0.06427639 -0.01624826 -0.04361155 145  ASP   A OD2  
1309  H  H    . ASP   A  90  ? 0.47036093 0.38901970 0.23892781 -0.05922088 -0.01927922 -0.04060446 145  ASP   A H    
1310  H  HA   . ASP   A  90  ? 0.50548828 0.43550387 0.27224919 -0.05310607 -0.00373165 -0.04470762 145  ASP   A HA   
1311  H  HB2  . ASP   A  90  ? 0.55641109 0.46669874 0.30129674 -0.05751337 -0.01478418 -0.05094558 145  ASP   A HB2  
1312  H  HB3  . ASP   A  90  ? 0.56176353 0.47793972 0.30328083 -0.05392827 -0.00542729 -0.05408734 145  ASP   A HB3  
1313  N  N    . ASP   A  91  ? 0.49554068 0.40988034 0.27494544 -0.04841007 -0.01154260 -0.05054256 146  ASP   A N    
1314  C  CA   . ASP   A  91  ? 0.53686386 0.44595557 0.32172078 -0.04357164 -0.01066218 -0.05484021 146  ASP   A CA   
1315  C  C    . ASP   A  91  ? 0.47988802 0.39803410 0.27854508 -0.03990338 -0.00661201 -0.05202872 146  ASP   A C    
1316  O  O    . ASP   A  91  ? 0.60709852 0.53269398 0.41337544 -0.04231584 -0.00726547 -0.04588776 146  ASP   A O    
1317  C  CB   . ASP   A  91  ? 0.59192002 0.49129528 0.37893593 -0.04575320 -0.01769565 -0.05467124 146  ASP   A CB   
1318  C  CG   . ASP   A  91  ? 0.56893003 0.45995206 0.34376454 -0.05004038 -0.02274262 -0.05714075 146  ASP   A CG   
1319  O  OD1  . ASP   A  91  ? 0.57495403 0.46332192 0.33746487 -0.04941202 -0.02046824 -0.06180158 146  ASP   A OD1  
1320  O  OD2  . ASP   A  91  ? 0.59224725 0.47987685 0.36998677 -0.05417237 -0.02898660 -0.05448046 146  ASP   A OD2  
1321  H  H    . ASP   A  91  ? 0.50877029 0.42338556 0.29101241 -0.05136402 -0.01543927 -0.04681933 146  ASP   A H    
1322  H  HA   . ASP   A  91  ? 0.54028988 0.44622001 0.31818384 -0.04123687 -0.00805876 -0.05984414 146  ASP   A HA   
1323  H  HB2  . ASP   A  91  ? 0.55921721 0.46221852 0.35373288 -0.04768047 -0.01980095 -0.04996191 146  ASP   A HB2  
1324  H  HB3  . ASP   A  91  ? 0.57317400 0.46795845 0.36273855 -0.04248744 -0.01709586 -0.05756825 146  ASP   A HB3  
1325  N  N    . ASP   A  92  ? 0.57882059 0.49615157 0.38065088 -0.03388036 -0.00273833 -0.05671955 147  ASP   A N    
1326  C  CA   . ASP   A  92  ? 0.58564866 0.51145339 0.40090826 -0.02997666 0.00046435  -0.05451594 147  ASP   A CA   
1327  C  C    . ASP   A  92  ? 0.52355379 0.44553739 0.34844440 -0.03087872 -0.00492759 -0.05036582 147  ASP   A C    
1328  O  O    . ASP   A  92  ? 0.44958034 0.36081862 0.27085623 -0.03270326 -0.01001922 -0.05137294 147  ASP   A O    
1329  C  CB   . ASP   A  92  ? 0.67009783 0.59573263 0.48707408 -0.02256494 0.00522595  -0.06086347 147  ASP   A CB   
1330  C  CG   . ASP   A  92  ? 0.81956780 0.74749804 0.62642229 -0.02090085 0.01088042  -0.06641720 147  ASP   A CG   
1331  O  OD1  . ASP   A  92  ? 0.81155097 0.74959004 0.61660385 -0.02359941 0.01493469  -0.06403730 147  ASP   A OD1  
1332  O  OD2  . ASP   A  92  ? 0.87974703 0.79880059 0.67984009 -0.01695936 0.01138007  -0.07331257 147  ASP   A OD2  
1333  H  H    . ASP   A  92  ? 0.56833833 0.47963855 0.36390343 -0.03202157 -0.00230381 -0.06148884 147  ASP   A H    
1334  H  HA   . ASP   A  92  ? 0.57722092 0.51158512 0.39456320 -0.03157328 0.00292018  -0.05145602 147  ASP   A HA   
1335  H  HB2  . ASP   A  92  ? 0.68444097 0.60110980 0.50068140 -0.02076696 0.00240109  -0.06327118 147  ASP   A HB2  
1336  H  HB3  . ASP   A  92  ? 0.67184067 0.60463059 0.49797061 -0.02028015 0.00730149  -0.05904608 147  ASP   A HB3  
1337  N  N    . CYS   A  93  ? 0.53025579 0.46105999 0.36705157 -0.02981824 -0.00364413 -0.04590357 148  CYS   A N    
1338  C  CA   . CYS   A  93  ? 0.58365059 0.51114857 0.42965138 -0.02953155 -0.00773013 -0.04260636 148  CYS   A CA   
1339  C  C    . CYS   A  93  ? 0.49396950 0.40915421 0.33751112 -0.02563877 -0.00971016 -0.04754047 148  CYS   A C    
1340  O  O    . CYS   A  93  ? 0.49425039 0.40862739 0.33635205 -0.02001855 -0.00615996 -0.05277411 148  CYS   A O    
1341  C  CB   . CYS   A  93  ? 0.47820431 0.41615611 0.33648181 -0.02687570 -0.00515188 -0.03921225 148  CYS   A CB   
1342  S  SG   . CYS   A  93  ? 0.65388709 0.60561484 0.51531017 -0.03129493 -0.00250490 -0.03358287 148  CYS   A SG   
1343  H  H    . CYS   A  93  ? 0.53451741 0.47346848 0.37337631 -0.02948257 -0.00013877 -0.04490388 148  CYS   A H    
1344  H  HA   . CYS   A  93  ? 0.52963853 0.45547140 0.37491864 -0.03376131 -0.01114476 -0.03949524 148  CYS   A HA   
1345  H  HB2  . CYS   A  93  ? 0.53239286 0.47224730 0.39225668 -0.02241966 -0.00208144 -0.04243020 148  CYS   A HB2  
1346  H  HB3  . CYS   A  93  ? 0.52283418 0.45786059 0.38610536 -0.02695217 -0.00810586 -0.03696857 148  CYS   A HB3  
1347  N  N    . GLU   A  94  ? 0.58539534 0.49113777 0.42900467 -0.02850571 -0.01525138 -0.04583017 149  GLU   A N    
1348  C  CA   . GLU   A  94  ? 0.57757556 0.47083551 0.42016923 -0.02509361 -0.01754739 -0.04934485 149  GLU   A CA   
1349  C  C    . GLU   A  94  ? 0.51632464 0.40665025 0.36679512 -0.02695251 -0.02160367 -0.04421428 149  GLU   A C    
1350  O  O    . GLU   A  94  ? 0.66997761 0.55862981 0.51992881 -0.03300499 -0.02532011 -0.04076355 149  GLU   A O    
1351  C  CB   . GLU   A  94  ? 0.65196890 0.53300923 0.48265824 -0.02756407 -0.02032737 -0.05400509 149  GLU   A CB   
1352  C  CG   . GLU   A  94  ? 0.77381432 0.64115644 0.60161650 -0.02286827 -0.02157090 -0.05910577 149  GLU   A CG   
1353  C  CD   . GLU   A  94  ? 1.16386008 1.01707351 0.98050570 -0.02622428 -0.02548728 -0.06327001 149  GLU   A CD   
1354  O  OE1  . GLU   A  94  ? 0.92578793 0.78032303 0.73714602 -0.03249015 -0.02770888 -0.06211317 149  GLU   A OE1  
1355  O  OE2  . GLU   A  94  ? 0.98641962 0.82682931 0.79958975 -0.02251464 -0.02668381 -0.06774967 149  GLU   A OE2  
1356  H  H    . GLU   A  94  ? 0.55107099 0.45803657 0.39532393 -0.03272760 -0.01763230 -0.04241126 149  GLU   A H    
1357  H  HA   . GLU   A  94  ? 0.58161223 0.47622663 0.42606479 -0.01990961 -0.01464995 -0.05207320 149  GLU   A HA   
1358  H  HB2  . GLU   A  94  ? 0.66344035 0.54750407 0.48851240 -0.02755024 -0.01793598 -0.05640522 149  GLU   A HB2  
1359  H  HB3  . GLU   A  94  ? 0.65664470 0.53556383 0.48673809 -0.03245548 -0.02385184 -0.05133003 149  GLU   A HB3  
1360  H  HG2  . GLU   A  94  ? 0.80720747 0.67230558 0.64090484 -0.02222450 -0.02337539 -0.05647155 149  GLU   A HG2  
1361  H  HG3  . GLU   A  94  ? 0.81709129 0.68662286 0.64465970 -0.01780009 -0.01799837 -0.06251511 149  GLU   A HG3  
1362  N  N    . GLU   A  95  ? 0.51883417 0.40884972 0.37645903 -0.02167124 -0.02089839 -0.04381186 150  GLU   A N    
1363  C  CA   . GLU   A  95  ? 0.42624938 0.31248397 0.29011667 -0.02302029 -0.02452724 -0.03913627 150  GLU   A CA   
1364  C  C    . GLU   A  95  ? 0.42956820 0.30245617 0.28771776 -0.02802667 -0.02949985 -0.03903335 150  GLU   A C    
1365  O  O    . GLU   A  95  ? 0.50847340 0.36918315 0.35929155 -0.02665772 -0.03083037 -0.04384868 150  GLU   A O    
1366  C  CB   . GLU   A  95  ? 0.58924258 0.47294217 0.45859843 -0.01574783 -0.02392027 -0.04016784 150  GLU   A CB   
1367  C  CG   . GLU   A  95  ? 0.62306023 0.50534177 0.49915731 -0.01711654 -0.02710907 -0.03441118 150  GLU   A CG   
1368  C  CD   . GLU   A  95  ? 0.63937527 0.52234709 0.52215648 -0.00990673 -0.02668859 -0.03431169 150  GLU   A CD   
1369  O  OE1  . GLU   A  95  ? 0.65342194 0.53573072 0.53565645 -0.00314840 -0.02438162 -0.03942226 150  GLU   A OE1  
1370  O  OE2  . GLU   A  95  ? 0.54858261 0.43305072 0.43711048 -0.01082855 -0.02873007 -0.02928106 150  GLU   A OE2  
1371  H  H    . GLU   A  95  ? 0.50026035 0.39266479 0.35876557 -0.01702756 -0.01806511 -0.04657265 150  GLU   A H    
1372  H  HA   . GLU   A  95  ? 0.45358196 0.34788489 0.32211566 -0.02557264 -0.02427672 -0.03508713 150  GLU   A HA   
1373  H  HB2  . GLU   A  95  ? 0.54675329 0.43918109 0.41966480 -0.01239043 -0.02059555 -0.04105099 150  GLU   A HB2  
1374  H  HB3  . GLU   A  95  ? 0.56100368 0.43514889 0.42568615 -0.01327406 -0.02476257 -0.04393664 150  GLU   A HB3  
1375  H  HG2  . GLU   A  95  ? 0.62047440 0.49309564 0.49291983 -0.01986298 -0.03016910 -0.03401906 150  GLU   A HG2  
1376  H  HG3  . GLU   A  95  ? 0.60447061 0.49483672 0.48403722 -0.02049393 -0.02673447 -0.03080633 150  GLU   A HG3  
1377  N  N    . ILE   A  96  ? 0.44497284 0.32082340 0.30636472 -0.03423002 -0.03208067 -0.03377665 151  ILE   A N    
1378  C  CA   . ILE   A  96  ? 0.47821292 0.34354007 0.33669087 -0.03961833 -0.03664263 -0.03265788 151  ILE   A CA   
1379  C  C    . ILE   A  96  ? 0.42307568 0.28299570 0.28666279 -0.03821328 -0.03827175 -0.02935380 151  ILE   A C    
1380  O  O    . ILE   A  96  ? 0.44630116 0.31328431 0.31659615 -0.04042188 -0.03850016 -0.02410506 151  ILE   A O    
1381  C  CB   . ILE   A  96  ? 0.52502501 0.39737749 0.38465428 -0.04688951 -0.03840400 -0.02910537 151  ILE   A CB   
1382  C  CG1  . ILE   A  96  ? 0.61459994 0.49370021 0.46919802 -0.04770399 -0.03674121 -0.03150490 151  ILE   A CG1  
1383  C  CG2  . ILE   A  96  ? 0.53558362 0.39754254 0.39232352 -0.05301732 -0.04303624 -0.02867173 151  ILE   A CG2  
1384  C  CD1  . ILE   A  96  ? 0.57693452 0.46564078 0.43458879 -0.05293764 -0.03794279 -0.02731419 151  ILE   A CD1  
1385  H  H    . ILE   A  96  ? 0.43660975 0.32156071 0.30235288 -0.03519272 -0.03085326 -0.03086587 151  ILE   A H    
1386  H  HA   . ILE   A  96  ? 0.48136276 0.33831802 0.33359507 -0.03933839 -0.03758469 -0.03649648 151  ILE   A HA   
1387  H  HB   . ILE   A  96  ? 0.51754290 0.39702520 0.38334164 -0.04721314 -0.03771325 -0.02526752 151  ILE   A HB   
1388  H  HG12 . ILE   A  96  ? 0.59636045 0.46840665 0.44440407 -0.04858416 -0.03806326 -0.03500953 151  ILE   A HG12 
1389  H  HG13 . ILE   A  96  ? 0.58315480 0.46687740 0.43847281 -0.04368055 -0.03355913 -0.03260733 151  ILE   A HG13 
1390  H  HG21 . ILE   A  96  ? 0.54576963 0.39920399 0.39645261 -0.05249520 -0.04396491 -0.03250163 151  ILE   A HG21 
1391  H  HG22 . ILE   A  96  ? 0.53213251 0.39125308 0.39229685 -0.05319951 -0.04384198 -0.02620736 151  ILE   A HG22 
1392  H  HG23 . ILE   A  96  ? 0.53011668 0.39692533 0.38759723 -0.05729461 -0.04424000 -0.02707824 151  ILE   A HG23 
1393  H  HD11 . ILE   A  96  ? 0.58164829 0.46706173 0.43981528 -0.05682718 -0.04090576 -0.02609298 151  ILE   A HD11 
1394  H  HD12 . ILE   A  96  ? 0.57434767 0.47010437 0.43783504 -0.05185533 -0.03636260 -0.02423053 151  ILE   A HD12 
1395  H  HD13 . ILE   A  96  ? 0.58611047 0.47726458 0.43931729 -0.05352892 -0.03741895 -0.02893179 151  ILE   A HD13 
1396  N  N    . LYS   A  97  ? 0.47937146 0.32629672 0.33913898 -0.03419133 -0.03941356 -0.03256920 152  LYS   A N    
1397  C  CA   . LYS   A  97  ? 0.52235663 0.36225176 0.38542321 -0.03194377 -0.04122146 -0.02969261 152  LYS   A CA   
1398  C  C    . LYS   A  97  ? 0.62380940 0.45571649 0.48540127 -0.03948212 -0.04505050 -0.02598256 152  LYS   A C    
1399  O  O    . LYS   A  97  ? 0.69822824 0.52884495 0.56366622 -0.04019549 -0.04623909 -0.02141418 152  LYS   A O    
1400  C  CB   . LYS   A  97  ? 0.62861812 0.45602468 0.48744911 -0.02480933 -0.04157382 -0.03451338 152  LYS   A CB   
1401  C  CG   . LYS   A  97  ? 0.70799917 0.54410404 0.57062757 -0.01607409 -0.03754158 -0.03781411 152  LYS   A CG   
1402  C  CD   . LYS   A  97  ? 0.77795321 0.60165769 0.63826811 -0.00816787 -0.03850182 -0.04181574 152  LYS   A CD   
1403  C  CE   . LYS   A  97  ? 0.82973325 0.66345465 0.69621390 0.00078868  -0.03478196 -0.04446384 152  LYS   A CE   
1404  N  NZ   . LYS   A  97  ? 0.99236500 0.83033884 0.85474390 0.00337909  -0.03080745 -0.05091003 152  LYS   A NZ   
1405  H  H    . LYS   A  97  ? 0.48734415 0.32910845 0.34181011 -0.03269226 -0.03918514 -0.03673468 152  LYS   A H    
1406  H  HA   . LYS   A  97  ? 0.53350806 0.38208073 0.40258691 -0.03011627 -0.03976214 -0.02693433 152  LYS   A HA   
1407  H  HB2  . LYS   A  97  ? 0.63000369 0.44958776 0.48247033 -0.02630367 -0.04259028 -0.03791397 152  LYS   A HB2  
1408  H  HB3  . LYS   A  97  ? 0.62528622 0.44561720 0.48483151 -0.02436684 -0.04367265 -0.03231601 152  LYS   A HB3  
1409  H  HG2  . LYS   A  97  ? 0.68958795 0.53519875 0.55872273 -0.01535954 -0.03640551 -0.03449949 152  LYS   A HG2  
1410  H  HG3  . LYS   A  97  ? 0.69963849 0.54042029 0.55982840 -0.01633207 -0.03540794 -0.04068918 152  LYS   A HG3  
1411  H  HD2  . LYS   A  97  ? 0.78849530 0.60334295 0.64208472 -0.00843141 -0.03917164 -0.04577925 152  LYS   A HD2  
1412  H  HD3  . LYS   A  97  ? 0.77803403 0.59478074 0.63907886 -0.00868109 -0.04123231 -0.03886667 152  LYS   A HD3  
1413  H  HE2  . LYS   A  97  ? 0.85726309 0.68365353 0.72421294 0.00569911  -0.03626902 -0.04536323 152  LYS   A HE2  
1414  H  HE3  . LYS   A  97  ? 0.83644199 0.68144506 0.70931590 0.00010764  -0.03349543 -0.04103034 152  LYS   A HE3  
1415  H  HZ1  . LYS   A  97  ? 0.95024502 0.77756047 0.80663395 0.00458619  -0.03195939 -0.05449295 152  LYS   A HZ1  
1416  H  HZ2  . LYS   A  97  ? 0.93306327 0.77683473 0.79420787 -0.00124253 -0.02977872 -0.04998356 152  LYS   A HZ2  
1417  H  HZ3  . LYS   A  97  ? 0.93681324 0.78224063 0.80365282 0.00836654  -0.02821835 -0.05232391 152  LYS   A HZ3  
1418  N  N    . VAL   A  98  ? 0.70868093 0.53583425 0.56459486 -0.04533533 -0.04690999 -0.02804946 153  VAL   A N    
1419  C  CA   . VAL   A  98  ? 0.57915884 0.40009505 0.43395549 -0.05339004 -0.05030289 -0.02516221 153  VAL   A CA   
1420  C  C    . VAL   A  98  ? 0.52632856 0.35522395 0.38069215 -0.05989001 -0.05096769 -0.02549073 153  VAL   A C    
1421  O  O    . VAL   A  98  ? 0.65102971 0.48206475 0.50112718 -0.05853791 -0.05013444 -0.02970148 153  VAL   A O    
1422  C  CB   . VAL   A  98  ? 0.57642841 0.37758565 0.42330897 -0.05319680 -0.05324422 -0.02835233 153  VAL   A CB   
1423  C  CG1  . VAL   A  98  ? 0.47503740 0.26985148 0.31380928 -0.05292679 -0.05379708 -0.03498385 153  VAL   A CG1  
1424  C  CG2  . VAL   A  98  ? 0.81691080 0.61025631 0.66318005 -0.06102216 -0.05642682 -0.02460197 153  VAL   A CG2  
1425  H  H    . VAL   A  98  ? 0.65155363 0.47964644 0.50412095 -0.04437381 -0.04601347 -0.03152218 153  VAL   A H    
1426  H  HA   . VAL   A  98  ? 0.57918942 0.40327373 0.43853170 -0.05438542 -0.05029526 -0.02103839 153  VAL   A HA   
1427  H  HB   . VAL   A  98  ? 0.59104311 0.38820624 0.43829465 -0.04767755 -0.05265546 -0.02862783 153  VAL   A HB   
1428  H  HG11 . VAL   A  98  ? 0.50322044 0.30041403 0.34106719 -0.05859316 -0.05508428 -0.03479895 153  VAL   A HG11 
1429  H  HG12 . VAL   A  98  ? 0.50240862 0.30349422 0.34157428 -0.04835200 -0.05130187 -0.03724702 153  VAL   A HG12 
1430  H  HG13 . VAL   A  98  ? 0.51712143 0.29903039 0.35095781 -0.05169894 -0.05543055 -0.03726107 153  VAL   A HG13 
1431  H  HG21 . VAL   A  98  ? 0.74147201 0.52162731 0.58226240 -0.06111244 -0.05836479 -0.02662019 153  VAL   A HG21 
1432  H  HG22 . VAL   A  98  ? 0.72169137 0.51796126 0.57217306 -0.06071179 -0.05596219 -0.02060243 153  VAL   A HG22 
1433  H  HG23 . VAL   A  98  ? 0.72068411 0.51917517 0.56770694 -0.06639788 -0.05704100 -0.02417572 153  VAL   A HG23 
1434  N  N    . PRO   A  99  ? 0.46383023 0.29765087 0.32236499 -0.06699584 -0.05255195 -0.02126835 154  PRO   A N    
1435  C  CA   . PRO   A  99  ? 0.44096500 0.28114343 0.29900974 -0.07292195 -0.05408804 -0.02206071 154  PRO   A CA   
1436  C  C    . PRO   A  99  ? 0.54009074 0.36740443 0.38944405 -0.07593963 -0.05716560 -0.02701147 154  PRO   A C    
1437  O  O    . PRO   A  99  ? 0.52675879 0.34051698 0.37259775 -0.07780735 -0.05920930 -0.02754460 154  PRO   A O    
1438  C  CB   . PRO   A  99  ? 0.42539439 0.27228203 0.29052174 -0.07909831 -0.05503002 -0.01671064 154  PRO   A CB   
1439  C  CG   . PRO   A  99  ? 0.41442376 0.25243735 0.28029764 -0.07822991 -0.05494592 -0.01381075 154  PRO   A CG   
1440  C  CD   . PRO   A  99  ? 0.41688132 0.25065961 0.28054380 -0.06954288 -0.05297534 -0.01581553 154  PRO   A CD   
1441  H  HA   . PRO   A  99  ? 0.45130506 0.29986399 0.31027940 -0.07067294 -0.05243058 -0.02268074 154  PRO   A HA   
1442  H  HB2  . PRO   A  99  ? 0.42709196 0.27267301 0.29118994 -0.08429445 -0.05725147 -0.01731760 154  PRO   A HB2  
1443  H  HB3  . PRO   A  99  ? 0.41201609 0.26966280 0.28189322 -0.07823443 -0.05349451 -0.01463115 154  PRO   A HB3  
1444  H  HG2  . PRO   A  99  ? 0.42734444 0.25585741 0.28973973 -0.08176592 -0.05703351 -0.01451293 154  PRO   A HG2  
1445  H  HG3  . PRO   A  99  ? 0.40860993 0.25327671 0.27970558 -0.07970666 -0.05413590 -0.01006602 154  PRO   A HG3  
1446  H  HD2  . PRO   A  99  ? 0.43887389 0.26204041 0.29959345 -0.06862658 -0.05402841 -0.01600286 154  PRO   A HD2  
1447  H  HD3  . PRO   A  99  ? 0.41708708 0.25889397 0.28542265 -0.06675831 -0.05103504 -0.01351496 154  PRO   A HD3  
1448  N  N    . GLU   A  100 ? 0.52354461 0.35417253 0.36846301 -0.07616621 -0.05755098 -0.03079920 155  GLU   A N    
1449  C  CA   . GLU   A  100 ? 0.56897777 0.38852268 0.40531528 -0.07966387 -0.06084717 -0.03573221 155  GLU   A CA   
1450  C  C    . GLU   A  100 ? 0.47562420 0.30359229 0.31414533 -0.08710104 -0.06383388 -0.03461934 155  GLU   A C    
1451  O  O    . GLU   A  100 ? 0.45910925 0.29627094 0.29662853 -0.08631822 -0.06347478 -0.03562648 155  GLU   A O    
1452  C  CB   . GLU   A  100 ? 0.59978628 0.41526285 0.42788184 -0.07353500 -0.05906874 -0.04165607 155  GLU   A CB   
1453  C  CG   . GLU   A  100 ? 0.80576992 0.61809713 0.63482767 -0.06517418 -0.05549987 -0.04215143 155  GLU   A CG   
1454  C  CD   . GLU   A  100 ? 0.93474829 0.74191457 0.75587869 -0.05882310 -0.05338342 -0.04860664 155  GLU   A CD   
1455  O  OE1  . GLU   A  100 ? 0.97920299 0.79561001 0.79809380 -0.05790327 -0.05144823 -0.05032697 155  GLU   A OE1  
1456  O  OE2  . GLU   A  100 ? 1.03534520 0.82903546 0.85220206 -0.05468514 -0.05360847 -0.05194248 155  GLU   A OE2  
1457  H  H    . GLU   A  100 ? 0.52530348 0.36505929 0.37217298 -0.07422877 -0.05581904 -0.03028046 155  GLU   A H    
1458  H  HA   . GLU   A  100 ? 0.55490530 0.36425078 0.38956195 -0.08128210 -0.06235321 -0.03584856 155  GLU   A HA   
1459  H  HB2  . GLU   A  100 ? 0.62473780 0.44929904 0.45311192 -0.07319669 -0.05807438 -0.04172796 155  GLU   A HB2  
1460  H  HB3  . GLU   A  100 ? 0.64508015 0.45098621 0.46677023 -0.07545524 -0.06132480 -0.04523487 155  GLU   A HB3  
1461  H  HG2  . GLU   A  100 ? 0.77620441 0.57998735 0.60555309 -0.06554972 -0.05672065 -0.04122663 155  GLU   A HG2  
1462  H  HG3  . GLU   A  100 ? 0.75614369 0.57857490 0.59121406 -0.06330806 -0.05326561 -0.03895360 155  GLU   A HG3  
1463  N  N    . CYS   A  101 ? 0.46485999 0.28987285 0.30659336 -0.09419288 -0.06671974 -0.03232516 156  CYS   A N    
1464  C  CA   . CYS   A  101 ? 0.43710393 0.27170789 0.28370678 -0.10140216 -0.06957172 -0.03056731 156  CYS   A CA   
1465  C  C    . CYS   A  101 ? 0.46390617 0.28776950 0.30480039 -0.10824713 -0.07418293 -0.03415591 156  CYS   A C    
1466  O  O    . CYS   A  101 ? 0.50782955 0.31606108 0.34253955 -0.10837714 -0.07496004 -0.03649114 156  CYS   A O    
1467  C  CB   . CYS   A  101 ? 0.39644077 0.23985028 0.25351581 -0.10429955 -0.06839670 -0.02452059 156  CYS   A CB   
1468  S  SG   . CYS   A  101 ? 0.48420233 0.34138346 0.34856459 -0.09731231 -0.06357783 -0.02018209 156  CYS   A SG   
1469  H  H    . CYS   A  101 ? 0.46936065 0.28597897 0.31031859 -0.09452580 -0.06690034 -0.03182125 156  CYS   A H    
1470  H  HA   . CYS   A  101 ? 0.43324792 0.27577695 0.27983621 -0.09987123 -0.06931409 -0.03116004 156  CYS   A HA   
1471  H  HB2  . CYS   A  101 ? 0.42487234 0.26011169 0.28131807 -0.10568705 -0.06844361 -0.02365214 156  CYS   A HB2  
1472  H  HB3  . CYS   A  101 ? 0.41642749 0.26603711 0.27706605 -0.10918235 -0.07040393 -0.02374243 156  CYS   A HB3  
1473  N  N    . PRO   A  102 ? 0.47650206 0.30797076 0.31937853 -0.11431086 -0.07777835 -0.03473147 157  PRO   A N    
1474  C  CA   . PRO   A  102 ? 0.46261355 0.28504443 0.30153447 -0.12204777 -0.08253968 -0.03775144 157  PRO   A CA   
1475  C  C    . PRO   A  102 ? 0.47364226 0.29063022 0.31735644 -0.12806749 -0.08285503 -0.03446303 157  PRO   A C    
1476  O  O    . PRO   A  102 ? 0.45594853 0.28006119 0.30757067 -0.12729605 -0.07987180 -0.02939435 157  PRO   A O    
1477  C  CB   . PRO   A  102 ? 0.45737115 0.29361987 0.30055636 -0.12661678 -0.08607497 -0.03780859 157  PRO   A CB   
1478  C  CG   . PRO   A  102 ? 0.43385568 0.28283805 0.27943155 -0.12018105 -0.08340651 -0.03607388 157  PRO   A CG   
1479  C  CD   . PRO   A  102 ? 0.48820078 0.33674991 0.33701840 -0.11397696 -0.07788835 -0.03266480 157  PRO   A CD   
1480  H  HA   . PRO   A  102 ? 0.48161083 0.29358751 0.31211466 -0.12032678 -0.08332235 -0.04182024 157  PRO   A HA   
1481  H  HB2  . PRO   A  102 ? 0.45035052 0.29224190 0.30069923 -0.13151807 -0.08707222 -0.03519843 157  PRO   A HB2  
1482  H  HB3  . PRO   A  102 ? 0.46533799 0.29623389 0.30235377 -0.12879424 -0.08914001 -0.04160574 157  PRO   A HB3  
1483  H  HG2  . PRO   A  102 ? 0.44000003 0.29989368 0.29203987 -0.12256085 -0.08466694 -0.03390370 157  PRO   A HG2  
1484  H  HG3  . PRO   A  102 ? 0.45393318 0.30020350 0.29241127 -0.11757024 -0.08391991 -0.03925044 157  PRO   A HG3  
1485  H  HD2  . PRO   A  102 ? 0.45654580 0.31283236 0.31322074 -0.11540272 -0.07695036 -0.02887571 157  PRO   A HD2  
1486  H  HD3  . PRO   A  102 ? 0.46223313 0.31321818 0.30860797 -0.10870729 -0.07575499 -0.03321999 157  PRO   A HD3  
1487  N  N    . ALA   A  103 ? 0.53921485 0.34379143 0.37782633 -0.13471465 -0.08658981 -0.03729471 158  ALA   A N    
1488  C  CA   . ALA   A  103 ? 0.54026520 0.34096479 0.38341698 -0.14250872 -0.08736929 -0.03404419 158  ALA   A CA   
1489  C  C    . ALA   A  103 ? 0.54762882 0.36790222 0.40345663 -0.14757019 -0.08736782 -0.02992477 158  ALA   A C    
1490  O  O    . ALA   A  103 ? 0.73867428 0.57209003 0.59816885 -0.14777599 -0.08922113 -0.03102438 158  ALA   A O    
1491  C  CB   . ALA   A  103 ? 0.59746790 0.38333893 0.43331909 -0.15001325 -0.09203333 -0.03816010 158  ALA   A CB   
1492  H  H    . ALA   A  103 ? 0.53495294 0.33315772 0.36679637 -0.13461548 -0.08863743 -0.04135178 158  ALA   A H    
1493  H  HA   . ALA   A  103 ? 0.55107963 0.34629345 0.39387697 -0.13966663 -0.08484554 -0.03181133 158  ALA   A HA   
1494  H  HB1  . ALA   A  103 ? 0.58865196 0.37201878 0.42750037 -0.15562405 -0.09232394 -0.03571891 158  ALA   A HB1  
1495  H  HB2  . ALA   A  103 ? 0.59652883 0.36955398 0.42413709 -0.14638336 -0.09203741 -0.04106689 158  ALA   A HB2  
1496  H  HB3  . ALA   A  103 ? 0.58632165 0.37790760 0.42258555 -0.15291280 -0.09480315 -0.04039076 158  ALA   A HB3  
1497  N  N    . GLY   A  104 ? 0.57262397 0.39449605 0.43481702 -0.15146014 -0.08529361 -0.02517776 159  GLY   A N    
1498  C  CA   . GLY   A  104 ? 0.55241692 0.39241719 0.42696029 -0.15639165 -0.08479255 -0.02149987 159  GLY   A CA   
1499  C  C    . GLY   A  104 ? 0.49766308 0.34969258 0.37873828 -0.14956887 -0.08018177 -0.01729977 159  GLY   A C    
1500  O  O    . GLY   A  104 ? 0.66444033 0.52694321 0.55456531 -0.15294281 -0.07819557 -0.01326230 159  GLY   A O    
1501  H  H    . GLY   A  104 ? 0.56970620 0.38115329 0.42833552 -0.15095291 -0.08414656 -0.02424945 159  GLY   A H    
1502  H  HA2  . GLY   A  104 ? 0.55162048 0.38863355 0.42814425 -0.16253939 -0.08495426 -0.01985718 159  GLY   A HA2  
1503  H  HA3  . GLY   A  104 ? 0.54668295 0.39416057 0.42338639 -0.15833850 -0.08744400 -0.02348468 159  GLY   A HA3  
1504  N  N    . PHE   A  105 ? 0.46067804 0.31102496 0.33693743 -0.14034112 -0.07841662 -0.01851466 160  PHE   A N    
1505  C  CA   . PHE   A  105 ? 0.52541780 0.38588226 0.40689206 -0.13362515 -0.07425468 -0.01492665 160  PHE   A CA   
1506  C  C    . PHE   A  105 ? 0.47248012 0.32613990 0.35424531 -0.13292958 -0.07098591 -0.01099132 160  PHE   A C    
1507  O  O    . PHE   A  105 ? 0.64888752 0.48746568 0.52281070 -0.12982954 -0.07060769 -0.01202690 160  PHE   A O    
1508  C  CB   . PHE   A  105 ? 0.44766992 0.30742794 0.32348585 -0.12473008 -0.07316139 -0.01743310 160  PHE   A CB   
1509  C  CG   . PHE   A  105 ? 0.39113018 0.26307404 0.26885223 -0.12358181 -0.07493251 -0.01903169 160  PHE   A CG   
1510  C  CD1  . PHE   A  105 ? 0.47738507 0.34901547 0.35261598 -0.12858008 -0.07956425 -0.02252132 160  PHE   A CD1  
1511  C  CD2  . PHE   A  105 ? 0.40795636 0.29105583 0.28942585 -0.11764269 -0.07231981 -0.01695652 160  PHE   A CD2  
1512  C  CE1  . PHE   A  105 ? 0.41402823 0.29649612 0.29031765 -0.12734693 -0.08176985 -0.02368254 160  PHE   A CE1  
1513  C  CE2  . PHE   A  105 ? 0.46962383 0.36266339 0.35185406 -0.11657840 -0.07426085 -0.01803045 160  PHE   A CE2  
1514  C  CZ   . PHE   A  105 ? 0.39323890 0.28586942 0.27269328 -0.12125064 -0.07907686 -0.02130203 160  PHE   A CZ   
1515  H  H    . PHE   A  105 ? 0.49279529 0.33561933 0.36229444 -0.13835037 -0.07981013 -0.02181198 160  PHE   A H    
1516  H  HA   . PHE   A  105 ? 0.47451013 0.34740210 0.36322099 -0.13546808 -0.07429872 -0.01333414 160  PHE   A HA   
1517  H  HB2  . PHE   A  105 ? 0.45967874 0.30800357 0.32813254 -0.12372360 -0.07409242 -0.02032578 160  PHE   A HB2  
1518  H  HB3  . PHE   A  105 ? 0.44175720 0.30348504 0.31932572 -0.12037890 -0.07019815 -0.01512264 160  PHE   A HB3  
1519  H  HD1  . PHE   A  105 ? 0.45229840 0.31616780 0.32494289 -0.13303685 -0.08150069 -0.02403585 160  PHE   A HD1  
1520  H  HD2  . PHE   A  105 ? 0.40806016 0.29161081 0.29126528 -0.11436871 -0.06937414 -0.01471637 160  PHE   A HD2  
1521  H  HE1  . PHE   A  105 ? 0.43035674 0.31255841 0.30473489 -0.13076553 -0.08529242 -0.02607174 160  PHE   A HE1  
1522  H  HE2  . PHE   A  105 ? 0.42064434 0.32039109 0.30502105 -0.11275648 -0.07250186 -0.01645395 160  PHE   A HE2  
1523  H  HZ   . PHE   A  105 ? 0.40949902 0.30852532 0.28902838 -0.12041612 -0.08071612 -0.02184782 160  PHE   A HZ   
1524  N  N    . VAL   A  106 ? 0.41577408 0.28050333 0.30629480 -0.13550960 -0.06874741 -0.00658249 161  VAL   A N    
1525  C  CA   . VAL   A  106 ? 0.44351012 0.30243856 0.33384585 -0.13554959 -0.06584192 -0.00249304 161  VAL   A CA   
1526  C  C    . VAL   A  106 ? 0.49202389 0.35607174 0.38393468 -0.12700820 -0.06233349 -0.00013201 161  VAL   A C    
1527  O  O    . VAL   A  106 ? 0.51096499 0.36922058 0.40137810 -0.12549019 -0.06025939 0.00297110  161  VAL   A O    
1528  C  CB   . VAL   A  106 ? 0.49905688 0.36562622 0.39680511 -0.14424852 -0.06513827 0.00078811  161  VAL   A CB   
1529  C  CG1  . VAL   A  106 ? 0.55335629 0.41623810 0.45046255 -0.15323475 -0.06887247 -0.00182952 161  VAL   A CG1  
1530  C  CG2  . VAL   A  106 ? 0.48571968 0.37246522 0.39417514 -0.14306110 -0.06308310 0.00280702  161  VAL   A CG2  
1531  H  H    . VAL   A  106 ? 0.42611045 0.30215201 0.32259554 -0.13716924 -0.06910079 -0.00616945 161  VAL   A H    
1532  H  HA   . VAL   A  106 ? 0.46984169 0.31549835 0.35360295 -0.13584997 -0.06677198 -0.00350477 161  VAL   A HA   
1533  H  HB   . VAL   A  106 ? 0.49883530 0.35881415 0.39444774 -0.14493725 -0.06353363 0.00336406  161  VAL   A HB   
1534  H  HG11 . VAL   A  106 ? 0.53557014 0.40657640 0.43572322 -0.15318190 -0.07061920 -0.00398758 161  VAL   A HG11 
1535  H  HG12 . VAL   A  106 ? 0.55178207 0.40115938 0.44142240 -0.15329759 -0.07041240 -0.00361189 161  VAL   A HG12 
1536  H  HG13 . VAL   A  106 ? 0.54078150 0.40664917 0.44180125 -0.15904069 -0.06804615 0.00038967  161  VAL   A HG13 
1537  H  HG21 . VAL   A  106 ? 0.48412588 0.37623295 0.39749682 -0.14874014 -0.06267378 0.00427314  161  VAL   A HG21 
1538  H  HG22 . VAL   A  106 ? 0.47841743 0.36659640 0.38714826 -0.13839598 -0.06063255 0.00480943  161  VAL   A HG22 
1539  H  HG23 . VAL   A  106 ? 0.48101062 0.37374580 0.39100435 -0.14130560 -0.06469259 0.00057470  161  VAL   A HG23 
1540  N  N    . ARG   A  107 ? 0.44759792 0.32231897 0.34224096 -0.12171168 -0.06188848 -0.00145762 162  ARG   A N    
1541  C  CA   . ARG   A  107 ? 0.40571123 0.28422034 0.30105448 -0.11371937 -0.05887865 0.00013148  162  ARG   A CA   
1542  C  C    . ARG   A  107 ? 0.44074816 0.32513803 0.33491910 -0.10881988 -0.05947863 -0.00297285 162  ARG   A C    
1543  O  O    . ARG   A  107 ? 0.36183077 0.25115994 0.25686806 -0.11195099 -0.06204266 -0.00515000 162  ARG   A O    
1544  C  CB   . ARG   A  107 ? 0.38953736 0.28041127 0.29325122 -0.11460301 -0.05623793 0.00450944  162  ARG   A CB   
1545  C  CG   . ARG   A  107 ? 0.44927168 0.35605443 0.36095423 -0.11693890 -0.05695377 0.00436235  162  ARG   A CG   
1546  C  CD   . ARG   A  107 ? 0.44964564 0.36810657 0.36985552 -0.11903340 -0.05443473 0.00814682  162  ARG   A CD   
1547  N  NE   . ARG   A  107 ? 0.43188339 0.34680796 0.35312396 -0.12637033 -0.05407977 0.00992739  162  ARG   A NE   
1548  C  CZ   . ARG   A  107 ? 0.48931909 0.41018745 0.41557720 -0.13354433 -0.05559461 0.00926764  162  ARG   A CZ   
1549  N  NH1  . ARG   A  107 ? 0.44263971 0.37048179 0.37189236 -0.13444486 -0.05864847 0.00632648  162  ARG   A NH1  
1550  N  NH2  . ARG   A  107 ? 0.57218695 0.49165919 0.50011408 -0.14025566 -0.05419635 0.01158827  162  ARG   A NH2  
1551  H  H    . ARG   A  107 ? 0.44522411 0.32497346 0.34126490 -0.12332883 -0.06362081 -0.00330022 162  ARG   A H    
1552  H  HA   . ARG   A  107 ? 0.42446256 0.29338896 0.31522283 -0.11111650 -0.05831076 0.00019458  162  ARG   A HA   
1553  H  HB2  . ARG   A  107 ? 0.39904135 0.29105294 0.30269235 -0.10960831 -0.05438980 0.00563528  162  ARG   A HB2  
1554  H  HB3  . ARG   A  107 ? 0.40914395 0.29639208 0.31307140 -0.11853781 -0.05587975 0.00637747  162  ARG   A HB3  
1555  H  HG2  . ARG   A  107 ? 0.43905738 0.34496522 0.35058391 -0.12128845 -0.05925568 0.00264081  162  ARG   A HG2  
1556  H  HG3  . ARG   A  107 ? 0.42867917 0.33926550 0.34003651 -0.11267965 -0.05696694 0.00325391  162  ARG   A HG3  
1557  H  HD2  . ARG   A  107 ? 0.43492943 0.36324066 0.36010486 -0.11936985 -0.05508717 0.00768218  162  ARG   A HD2  
1558  H  HD3  . ARG   A  107 ? 0.43637094 0.35519999 0.35635900 -0.11496507 -0.05233320 0.00981797  162  ARG   A HD3  
1559  H  HE   . ARG   A  107 ? 0.45453715 0.36313462 0.37290880 -0.12618622 -0.05280579 0.01158682  162  ARG   A HE   
1560  H  HH11 . ARG   A  107 ? 0.45940569 0.38224322 0.38423052 -0.13259345 -0.06050132 0.00413789  162  ARG   A HH11 
1561  H  HH12 . ARG   A  107 ? 0.45109808 0.38859934 0.38666272 -0.13681300 -0.05888384 0.00652597  162  ARG   A HH12 
1562  H  HH21 . ARG   A  107 ? 0.54713380 0.47040200 0.47846067 -0.14537558 -0.05518026 0.01100019  162  ARG   A HH21 
1563  H  HH22 . ARG   A  107 ? 0.54563743 0.46051383 0.47118673 -0.13970377 -0.05230076 0.01374944  162  ARG   A HH22 
1564  N  N    . PRO   A  108 ? 0.34456366 0.22885850 0.23657677 -0.10129014 -0.05725706 -0.00322180 163  PRO   A N    
1565  C  CA   . PRO   A  108 ? 0.35971093 0.25090274 0.25075656 -0.09722907 -0.05719485 -0.00542159 163  PRO   A CA   
1566  C  C    . PRO   A  108 ? 0.35061741 0.25709373 0.24954467 -0.09851652 -0.05702910 -0.00298840 163  PRO   A C    
1567  O  O    . PRO   A  108 ? 0.38171887 0.29472595 0.28677022 -0.09818229 -0.05491751 0.00060867  163  PRO   A O    
1568  C  CB   . PRO   A  108 ? 0.38603291 0.27410460 0.27426830 -0.08953976 -0.05420629 -0.00560587 163  PRO   A CB   
1569  C  CG   . PRO   A  108 ? 0.37754822 0.26044297 0.26752856 -0.08924618 -0.05284074 -0.00243757 163  PRO   A CG   
1570  C  CD   . PRO   A  108 ? 0.39802170 0.27564093 0.28828850 -0.09660976 -0.05490498 -0.00139927 163  PRO   A CD   
1571  H  HA   . PRO   A  108 ? 0.36847842 0.25535607 0.25512826 -0.09855260 -0.05922534 -0.00844003 163  PRO   A HA   
1572  H  HB2  . PRO   A  108 ? 0.36899322 0.26523665 0.25989646 -0.08698861 -0.05282890 -0.00468245 163  PRO   A HB2  
1573  H  HB3  . PRO   A  108 ? 0.38581836 0.26701164 0.26843747 -0.08761513 -0.05468394 -0.00866895 163  PRO   A HB3  
1574  H  HG2  . PRO   A  108 ? 0.37330493 0.26359105 0.26787698 -0.08792976 -0.05117697 0.00018638  163  PRO   A HG2  
1575  H  HG3  . PRO   A  108 ? 0.38838926 0.26391715 0.27452475 -0.08562265 -0.05231981 -0.00369537 163  PRO   A HG3  
1576  H  HD2  . PRO   A  108 ? 0.37668681 0.25768363 0.27085820 -0.09808445 -0.05381976 0.00173324  163  PRO   A HD2  
1577  H  HD3  . PRO   A  108 ? 0.39178568 0.25851589 0.27710015 -0.09683841 -0.05587263 -0.00277129 163  PRO   A HD3  
1578  N  N    . PRO   A  109 ? 0.37006569 0.28243858 0.26890069 -0.10000867 -0.05954721 -0.00489806 164  PRO   A N    
1579  C  CA   . PRO   A  109 ? 0.32596612 0.25216818 0.23190793 -0.09993596 -0.05965593 -0.00268803 164  PRO   A CA   
1580  C  C    . PRO   A  109 ? 0.27567858 0.20658955 0.18261397 -0.09379279 -0.05633308 -0.00070087 164  PRO   A C    
1581  O  O    . PRO   A  109 ? 0.31661010 0.24182519 0.21795136 -0.08939998 -0.05455494 -0.00203708 164  PRO   A O    
1582  C  CB   . PRO   A  109 ? 0.33357254 0.26209065 0.23630725 -0.10124972 -0.06339192 -0.00555989 164  PRO   A CB   
1583  C  CG   . PRO   A  109 ? 0.37880623 0.29499143 0.27427533 -0.10458694 -0.06573960 -0.00930451 164  PRO   A CG   
1584  C  CD   . PRO   A  109 ? 0.36060643 0.26616129 0.25203577 -0.10152858 -0.06266724 -0.00927286 164  PRO   A CD   
1585  H  HA   . PRO   A  109 ? 0.32075578 0.25107363 0.23223178 -0.10317922 -0.05978325 -0.00094970 164  PRO   A HA   
1586  H  HB2  . PRO   A  109 ? 0.33718067 0.26676032 0.23677266 -0.09757292 -0.06268696 -0.00602741 164  PRO   A HB2  
1587  H  HB3  . PRO   A  109 ? 0.33506250 0.27099618 0.24305636 -0.10378876 -0.06507966 -0.00466517 164  PRO   A HB3  
1588  H  HG2  . PRO   A  109 ? 0.37168908 0.28610921 0.26197696 -0.10376012 -0.06736792 -0.01177293 164  PRO   A HG2  
1589  H  HG3  . PRO   A  109 ? 0.36875778 0.28578666 0.26740831 -0.10937779 -0.06759211 -0.00919181 164  PRO   A HG3  
1590  H  HD2  . PRO   A  109 ? 0.37302625 0.27535039 0.25944722 -0.09753365 -0.06165585 -0.01093621 164  PRO   A HD2  
1591  H  HD3  . PRO   A  109 ? 0.37834221 0.27637389 0.26760846 -0.10460293 -0.06383453 -0.01036179 164  PRO   A HD3  
1592  N  N    . LEU   A  110 ? 0.27072090 0.21255803 0.18472564 -0.09357201 -0.05580827 0.00201047  165  LEU   A N    
1593  C  CA   . LEU   A  110 ? 0.30033931 0.24740893 0.21521533 -0.08852567 -0.05340820 0.00372007  165  LEU   A CA   
1594  C  C    . LEU   A  110 ? 0.26400083 0.21919867 0.18031974 -0.08831330 -0.05566213 0.00380393  165  LEU   A C    
1595  O  O    . LEU   A  110 ? 0.29007304 0.25199702 0.21243806 -0.09129159 -0.05777649 0.00458186  165  LEU   A O    
1596  C  CB   . LEU   A  110 ? 0.26797783 0.21961157 0.18940961 -0.08789312 -0.05071128 0.00714133  165  LEU   A CB   
1597  C  CG   . LEU   A  110 ? 0.27414536 0.23239312 0.19794740 -0.08374686 -0.04870043 0.00916499  165  LEU   A CG   
1598  C  CD1  . LEU   A  110 ? 0.29228377 0.24611367 0.21051171 -0.07939062 -0.04676107 0.00823429  165  LEU   A CD1  
1599  C  CD2  . LEU   A  110 ? 0.29309186 0.25540292 0.22295502 -0.08386391 -0.04649396 0.01210557  165  LEU   A CD2  
1600  H  H    . LEU   A  110 ? 0.27551657 0.22165945 0.19401366 -0.09670793 -0.05696766 0.00272297  165  LEU   A H    
1601  H  HA   . LEU   A  110 ? 0.28521669 0.22754461 0.19532683 -0.08574311 -0.05220085 0.00259106  165  LEU   A HA   
1602  H  HB2  . LEU   A  110 ? 0.27936172 0.22532798 0.19906704 -0.08747934 -0.04940816 0.00729932  165  LEU   A HB2  
1603  H  HB3  . LEU   A  110 ? 0.27487165 0.23040295 0.20071569 -0.09098110 -0.05163632 0.00787704  165  LEU   A HB3  
1604  H  HG   . LEU   A  110 ? 0.27631193 0.23946640 0.20140253 -0.08397403 -0.05020632 0.00913201  165  LEU   A HG   
1605  H  HD11 . LEU   A  110 ? 0.28168321 0.23987204 0.20152374 -0.07728813 -0.04556502 0.00959795  165  LEU   A HD11 
1606  H  HD12 . LEU   A  110 ? 0.28940374 0.23856953 0.20668519 -0.07868920 -0.04552712 0.00822714  165  LEU   A HD12 
1607  H  HD13 . LEU   A  110 ? 0.29242921 0.24373311 0.20630127 -0.07936785 -0.04793667 0.00621187  165  LEU   A HD13 
1608  H  HD21 . LEU   A  110 ? 0.28369707 0.24975565 0.21747097 -0.08666556 -0.04741448 0.01252996  165  LEU   A HD21 
1609  H  HD22 . LEU   A  110 ? 0.28742868 0.24469617 0.21572560 -0.08368168 -0.04531120 0.01237298  165  LEU   A HD22 
1610  H  HD23 . LEU   A  110 ? 0.27954605 0.24565873 0.21072905 -0.08135916 -0.04539374 0.01323302  165  LEU   A HD23 
1611  N  N    . ILE   A  111 ? 0.28042954 0.23520765 0.19140238 -0.08465135 -0.05502281 0.00319163  166  ILE   A N    
1612  C  CA   . ILE   A  111 ? 0.26892728 0.23026542 0.18005069 -0.08369315 -0.05691947 0.00403705  166  ILE   A CA   
1613  C  C    . ILE   A  111 ? 0.26265779 0.22756809 0.17514068 -0.07974520 -0.05371666 0.00663347  166  ILE   A C    
1614  O  O    . ILE   A  111 ? 0.27358684 0.23485845 0.18140562 -0.07697550 -0.05089173 0.00614085  166  ILE   A O    
1615  C  CB   . ILE   A  111 ? 0.29347244 0.25070563 0.19565693 -0.08375084 -0.05927189 0.00125573  166  ILE   A CB   
1616  C  CG1  . ILE   A  111 ? 0.34426826 0.29673025 0.24441555 -0.08799125 -0.06261779 -0.00177659 166  ILE   A CG1  
1617  C  CG2  . ILE   A  111 ? 0.32770187 0.29087707 0.22940020 -0.08282537 -0.06164588 0.00268947  166  ILE   A CG2  
1618  C  CD1  . ILE   A  111 ? 0.41401935 0.36105269 0.30381894 -0.08819783 -0.06505258 -0.00518027 166  ILE   A CD1  
1619  H  H    . ILE   A  111 ? 0.27764931 0.22772488 0.18457103 -0.08268835 -0.05332635 0.00225242  166  ILE   A H    
1620  H  HA   . ILE   A  111 ? 0.27136672 0.23746218 0.18746290 -0.08566681 -0.05884852 0.00476879  166  ILE   A HA   
1621  H  HB   . ILE   A  111 ? 0.30608207 0.25925279 0.20352644 -0.08153920 -0.05692902 0.00040588  166  ILE   A HB   
1622  H  HG12 . ILE   A  111 ? 0.34263945 0.29996079 0.24803936 -0.09037387 -0.06490650 -0.00104136 166  ILE   A HG12 
1623  H  HG13 . ILE   A  111 ? 0.34667003 0.29456490 0.24702080 -0.08849495 -0.06103560 -0.00234257 166  ILE   A HG13 
1624  H  HG21 . ILE   A  111 ? 0.31282133 0.28085834 0.22018804 -0.08433669 -0.06375938 0.00362691  166  ILE   A HG21 
1625  H  HG22 . ILE   A  111 ? 0.31171799 0.27644956 0.21345852 -0.08034758 -0.05938350 0.00437826  166  ILE   A HG22 
1626  H  HG23 . ILE   A  111 ? 0.32343930 0.28392556 0.21891661 -0.08320176 -0.06345347 0.00098328  166  ILE   A HG23 
1627  H  HD11 . ILE   A  111 ? 0.39463443 0.34583575 0.28430679 -0.08864344 -0.06765129 -0.00467041 166  ILE   A HD11 
1628  H  HD12 . ILE   A  111 ? 0.39684716 0.34076706 0.28174105 -0.08543017 -0.06252741 -0.00574201 166  ILE   A HD12 
1629  H  HD13 . ILE   A  111 ? 0.40136206 0.34380412 0.28941536 -0.09068859 -0.06656654 -0.00734842 166  ILE   A HD13 
1630  N  N    . ILE   A  112 ? 0.29875547 0.27102369 0.21788529 -0.07957768 -0.05425286 0.00914178  167  ILE   A N    
1631  C  CA   . ILE   A  112 ? 0.26968232 0.24536934 0.19008781 -0.07641541 -0.05205311 0.01161129  167  ILE   A CA   
1632  C  C    . ILE   A  112 ? 0.30702698 0.28435412 0.22319520 -0.07543847 -0.05446910 0.01201246  167  ILE   A C    
1633  O  O    . ILE   A  112 ? 0.27991080 0.26120073 0.19876763 -0.07654691 -0.05818046 0.01226349  167  ILE   A O    
1634  C  CB   . ILE   A  112 ? 0.31045392 0.29227194 0.23980436 -0.07652329 -0.05130183 0.01390070  167  ILE   A CB   
1635  C  CG1  . ILE   A  112 ? 0.33956528 0.31974873 0.27255663 -0.07855194 -0.04963423 0.01371760  167  ILE   A CG1  
1636  C  CG2  . ILE   A  112 ? 0.31400430 0.29774377 0.24408332 -0.07347159 -0.04882257 0.01614110  167  ILE   A CG2  
1637  C  CD1  . ILE   A  112 ? 0.32481295 0.31159082 0.26594606 -0.08014878 -0.04981977 0.01499921  167  ILE   A CD1  
1638  H  H    . ILE   A  112 ? 0.28153533 0.25685298 0.20468974 -0.08157859 -0.05611538 0.00918918  167  ILE   A H    
1639  H  HA   . ILE   A  112 ? 0.28876662 0.26153430 0.20669746 -0.07488582 -0.04952350 0.01150270  167  ILE   A HA   
1640  H  HB   . ILE   A  112 ? 0.30662471 0.29230571 0.23880309 -0.07744525 -0.05375739 0.01399107  167  ILE   A HB   
1641  H  HG12 . ILE   A  112 ? 0.32863194 0.30638754 0.26045361 -0.07700626 -0.04722146 0.01428560  167  ILE   A HG12 
1642  H  HG13 . ILE   A  112 ? 0.33418345 0.31090403 0.26484579 -0.08041923 -0.05076801 0.01208853  167  ILE   A HG13 
1643  H  HG21 . ILE   A  112 ? 0.31255287 0.29312682 0.23967980 -0.07240494 -0.04669297 0.01592062  167  ILE   A HG21 
1644  H  HG22 . ILE   A  112 ? 0.31235871 0.29738748 0.24074115 -0.07260969 -0.05017624 0.01667686  167  ILE   A HG22 
1645  H  HG23 . ILE   A  112 ? 0.30869663 0.29544795 0.24375114 -0.07349889 -0.04806083 0.01722426  167  ILE   A HG23 
1646  H  HD11 . ILE   A  112 ? 0.32417077 0.31372571 0.26732674 -0.07820391 -0.04861828 0.01641597  167  ILE   A HD11 
1647  H  HD12 . ILE   A  112 ? 0.32881671 0.31884468 0.27191821 -0.08147078 -0.05229336 0.01436139  167  ILE   A HD12 
1648  H  HD13 . ILE   A  112 ? 0.32845038 0.31354171 0.27084911 -0.08185274 -0.04868209 0.01498992  167  ILE   A HD13 
1649  N  N    . PHE   A  113 ? 0.36857250 0.34285811 0.27798456 -0.07343266 -0.05237709 0.01204581  168  PHE   A N    
1650  C  CA   . PHE   A  113 ? 0.32272041 0.29756185 0.22673099 -0.07253743 -0.05394025 0.01314407  168  PHE   A CA   
1651  C  C    . PHE   A  113 ? 0.29275990 0.27079013 0.20011075 -0.07057951 -0.05197714 0.01630838  168  PHE   A C    
1652  O  O    . PHE   A  113 ? 0.27656275 0.25351050 0.18238707 -0.06928925 -0.04813741 0.01685987  168  PHE   A O    
1653  C  CB   . PHE   A  113 ? 0.32033652 0.28987521 0.21435355 -0.07218109 -0.05232754 0.01103318  168  PHE   A CB   
1654  C  CG   . PHE   A  113 ? 0.28044003 0.24882245 0.16600834 -0.07230859 -0.05456533 0.01148968  168  PHE   A CG   
1655  C  CD1  . PHE   A  113 ? 0.27652991 0.24637753 0.16026999 -0.07112254 -0.05363973 0.01451814  168  PHE   A CD1  
1656  C  CD2  . PHE   A  113 ? 0.32385114 0.28908896 0.20267822 -0.07394647 -0.05801952 0.00901971  168  PHE   A CD2  
1657  C  CE1  . PHE   A  113 ? 0.33042902 0.29815522 0.20505860 -0.07150626 -0.05585434 0.01538290  168  PHE   A CE1  
1658  C  CE2  . PHE   A  113 ? 0.31454051 0.27822796 0.18446317 -0.07414588 -0.06040043 0.00965694  168  PHE   A CE2  
1659  C  CZ   . PHE   A  113 ? 0.33392343 0.29870918 0.20155001 -0.07291087 -0.05930750 0.01303047  168  PHE   A CZ   
1660  H  H    . PHE   A  113 ? 0.34069356 0.31245875 0.24872975 -0.07264778 -0.04983199 0.01140122  168  PHE   A H    
1661  H  HA   . PHE   A  113 ? 0.32611036 0.30249751 0.23067093 -0.07355297 -0.05741398 0.01305679  168  PHE   A HA   
1662  H  HB2  . PHE   A  113 ? 0.31397569 0.28085816 0.20683406 -0.07322887 -0.05293593 0.00877838  168  PHE   A HB2  
1663  H  HB3  . PHE   A  113 ? 0.30797940 0.27713954 0.20194864 -0.07082832 -0.04893750 0.01139030  168  PHE   A HB3  
1664  H  HD1  . PHE   A  113 ? 0.28150254 0.25326663 0.16956614 -0.07020730 -0.05148650 0.01604079  168  PHE   A HD1  
1665  H  HD2  . PHE   A  113 ? 0.31317466 0.27691236 0.19304422 -0.07507896 -0.05883368 0.00691200  168  PHE   A HD2  
1666  H  HE1  . PHE   A  113 ? 0.31708506 0.28507522 0.19004792 -0.07096710 -0.05521572 0.01765152  168  PHE   A HE1  
1667  H  HE2  . PHE   A  113 ? 0.32982290 0.29126668 0.19477661 -0.07530774 -0.06291901 0.00785822  168  PHE   A HE2  
1668  H  HZ   . PHE   A  113 ? 0.33630228 0.29939821 0.19713116 -0.07320749 -0.06100742 0.01373258  168  PHE   A HZ   
1669  N  N    . SER   A  114 ? 0.28668365 0.26866823 0.19868897 -0.07030583 -0.05478352 0.01814282  169  SER   A N    
1670  C  CA   . SER   A  114 ? 0.33302146 0.31719562 0.24835190 -0.06854827 -0.05340651 0.02084470  169  SER   A CA   
1671  C  C    . SER   A  114 ? 0.35480922 0.33737016 0.26408589 -0.06771202 -0.05559039 0.02278686  169  SER   A C    
1672  O  O    . SER   A  114 ? 0.30375841 0.28641179 0.21079072 -0.06793466 -0.06006069 0.02276134  169  SER   A O    
1673  C  CB   . SER   A  114 ? 0.31794369 0.30721325 0.24297211 -0.06828422 -0.05444298 0.02142265  169  SER   A CB   
1674  O  OG   . SER   A  114 ? 0.32271791 0.31499657 0.25001675 -0.06859354 -0.05908844 0.02108135  169  SER   A OG   
1675  H  H    . SER   A  114 ? 0.29994214 0.28328067 0.21319668 -0.07117468 -0.05777000 0.01753817  169  SER   A H    
1676  H  HA   . SER   A  114 ? 0.31872016 0.30184045 0.23362719 -0.06809381 -0.05016957 0.02101596  169  SER   A HA   
1677  H  HB2  . SER   A  114 ? 0.31715342 0.30720222 0.24389513 -0.06700965 -0.05331592 0.02295878  169  SER   A HB2  
1678  H  HB3  . SER   A  114 ? 0.31778646 0.30756935 0.24585953 -0.06916849 -0.05292330 0.02043169  169  SER   A HB3  
1680  N  N    . VAL   A  115 ? 0.25218856 0.23319989 0.15890390 -0.06690833 -0.05260231 0.02465630  170  VAL   A N    
1681  C  CA   . VAL   A  115 ? 0.28205878 0.26003742 0.18135574 -0.06671683 -0.05382442 0.02688745  170  VAL   A CA   
1682  C  C    . VAL   A  115 ? 0.31823614 0.29688028 0.22161433 -0.06545465 -0.05340021 0.02955568  170  VAL   A C    
1683  O  O    . VAL   A  115 ? 0.32802990 0.30800632 0.23552735 -0.06528775 -0.04979650 0.02974099  170  VAL   A O    
1684  C  CB   . VAL   A  115 ? 0.32848144 0.30318093 0.21876207 -0.06779659 -0.05033031 0.02644745  170  VAL   A CB   
1685  C  CG1  . VAL   A  115 ? 0.33728564 0.30961132 0.22036630 -0.06882662 -0.05230961 0.02416556  170  VAL   A CG1  
1686  C  CG2  . VAL   A  115 ? 0.29001433 0.26629150 0.18384674 -0.06762043 -0.04508483 0.02523817  170  VAL   A CG2  
1687  H  H    . VAL   A  115 ? 0.27412754 0.25589788 0.18370759 -0.06666337 -0.04980800 0.02464534  170  VAL   A H    
1688  H  HA   . VAL   A  115 ? 0.29520965 0.27276841 0.19259734 -0.06673612 -0.05740197 0.02689410  170  VAL   A HA   
1689  H  HB   . VAL   A  115 ? 0.31754723 0.29050353 0.20386694 -0.06793279 -0.05032424 0.02852551  170  VAL   A HB   
1690  H  HG11 . VAL   A  115 ? 0.33463877 0.30810019 0.22136146 -0.06896070 -0.05265211 0.02215499  170  VAL   A HG11 
1691  H  HG12 . VAL   A  115 ? 0.34115803 0.31247529 0.22143739 -0.06889633 -0.05588397 0.02513693  170  VAL   A HG12 
1692  H  HG13 . VAL   A  115 ? 0.34116790 0.31172079 0.21857758 -0.06933291 -0.04974281 0.02366112  170  VAL   A HG13 
1693  H  HG21 . VAL   A  115 ? 0.30314875 0.27817494 0.19186303 -0.06808805 -0.04278580 0.02502362  170  VAL   A HG21 
1694  H  HG22 . VAL   A  115 ? 0.29427499 0.27207729 0.19261140 -0.06710605 -0.04416258 0.02658622  170  VAL   A HG22 
1695  H  HG23 . VAL   A  115 ? 0.29697049 0.27392778 0.19357738 -0.06754982 -0.04505756 0.02328849  170  VAL   A HG23 
1696  N  N    . ASP   A  116 ? 0.26905814 0.24636784 0.17111540 -0.06440024 -0.05749039 0.03149230  171  ASP   A N    
1697  C  CA   . ASP   A  116 ? 0.31427947 0.29126182 0.22012092 -0.06285521 -0.05780562 0.03363369  171  ASP   A CA   
1698  C  C    . ASP   A  116 ? 0.31235689 0.28468516 0.21133029 -0.06399342 -0.05519497 0.03608530  171  ASP   A C    
1699  O  O    . ASP   A  116 ? 0.30803126 0.27625069 0.19771557 -0.06521836 -0.05596292 0.03741601  171  ASP   A O    
1700  C  CB   . ASP   A  116 ? 0.27780062 0.25480014 0.18519852 -0.06075937 -0.06340197 0.03453725  171  ASP   A CB   
1701  C  CG   . ASP   A  116 ? 0.31372377 0.29228663 0.22861207 -0.05848077 -0.06355330 0.03518380  171  ASP   A CG   
1702  O  OD1  . ASP   A  116 ? 0.33111319 0.30603808 0.24391919 -0.05864237 -0.06120289 0.03697821  171  ASP   A OD1  
1703  O  OD2  . ASP   A  116 ? 0.25626197 0.24029486 0.17974122 -0.05678007 -0.06551877 0.03353656  171  ASP   A OD2  
1704  H  H    . ASP   A  116 ? 0.29569644 0.27192390 0.19415155 -0.06452407 -0.06035699 0.03139868  171  ASP   A H    
1705  H  HA   . ASP   A  116 ? 0.28850466 0.26841933 0.20063579 -0.06247296 -0.05599281 0.03274529  171  ASP   A HA   
1706  H  HB2  . ASP   A  116 ? 0.29381654 0.27381307 0.20390971 -0.06070991 -0.06530520 0.03292961  171  ASP   A HB2  
1707  H  HB3  . ASP   A  116 ? 0.30228817 0.27524406 0.20299770 -0.06086027 -0.06526149 0.03621129  171  ASP   A HB3  
1708  N  N    . GLY   A  117 ? 0.28995687 0.26303428 0.19335075 -0.06391432 -0.05215255 0.03669908  172  GLY   A N    
1709  C  CA   . GLY   A  117 ? 0.29989946 0.26913816 0.19816454 -0.06548202 -0.04981085 0.03910042  172  GLY   A CA   
1710  C  C    . GLY   A  117 ? 0.30398303 0.27321804 0.19634292 -0.06801163 -0.04565339 0.03880901  172  GLY   A C    
1711  O  O    . GLY   A  117 ? 0.32368025 0.28936324 0.20935562 -0.07002318 -0.04433120 0.04112135  172  GLY   A O    
1712  H  H    . GLY   A  117 ? 0.28931901 0.26539043 0.19892654 -0.06310994 -0.05154383 0.03559425  172  GLY   A H    
1713  H  HA2  . GLY   A  117 ? 0.29408622 0.26435605 0.19691655 -0.06513970 -0.04847554 0.03919845  172  GLY   A HA2  
1714  H  HA3  . GLY   A  117 ? 0.30484650 0.27020523 0.19893527 -0.06523426 -0.05242593 0.04097563  172  GLY   A HA3  
1715  N  N    . PHE   A  118 ? 0.25519103 0.22826554 0.15003085 -0.06791267 -0.04356981 0.03589749  173  PHE   A N    
1716  C  CA   . PHE   A  118 ? 0.26387939 0.23794049 0.15449803 -0.06943559 -0.03938425 0.03470990  173  PHE   A CA   
1717  C  C    . PHE   A  118 ? 0.38721114 0.36441839 0.28290552 -0.06998396 -0.03516130 0.03483905  173  PHE   A C    
1718  O  O    . PHE   A  118 ? 0.34066680 0.32146639 0.24318126 -0.06882674 -0.03362466 0.03294332  173  PHE   A O    
1719  C  CB   . PHE   A  118 ? 0.33668065 0.31242412 0.22775690 -0.06868680 -0.03931304 0.03132156  173  PHE   A CB   
1720  C  CG   . PHE   A  118 ? 0.28348401 0.25876558 0.16740862 -0.06976916 -0.03607756 0.02977636  173  PHE   A CG   
1721  C  CD1  . PHE   A  118 ? 0.27620989 0.25459841 0.16214059 -0.06995075 -0.03113591 0.02880283  173  PHE   A CD1  
1722  C  CD2  . PHE   A  118 ? 0.34134033 0.31338215 0.21638688 -0.07047956 -0.03807826 0.02914978  173  PHE   A CD2  
1723  C  CE1  . PHE   A  118 ? 0.35448807 0.33320475 0.23428100 -0.07055555 -0.02779078 0.02697964  173  PHE   A CE1  
1724  C  CE2  . PHE   A  118 ? 0.31894922 0.29051119 0.18672551 -0.07137377 -0.03474684 0.02738479  173  PHE   A CE2  
1725  C  CZ   . PHE   A  118 ? 0.46101266 0.43612841 0.33141506 -0.07129692 -0.02935994 0.02620714  173  PHE   A CZ   
1726  H  H    . PHE   A  118 ? 0.26309675 0.23816596 0.16250549 -0.06679247 -0.04477563 0.03453278  173  PHE   A H    
1727  H  HA   . PHE   A  118 ? 0.30108756 0.27243456 0.18476802 -0.07069869 -0.03944231 0.03602158  173  PHE   A HA   
1728  H  HB2  . PHE   A  118 ? 0.30525708 0.27981535 0.19540638 -0.06826158 -0.04264010 0.03117582  173  PHE   A HB2  
1729  H  HB3  . PHE   A  118 ? 0.29757956 0.27579874 0.19473045 -0.06786104 -0.03826827 0.03013952  173  PHE   A HB3  
1730  H  HD1  . PHE   A  118 ? 0.28840083 0.26899621 0.18007387 -0.06953121 -0.03007168 0.02922017  173  PHE   A HD1  
1731  H  HD2  . PHE   A  118 ? 0.32489944 0.29523525 0.19885430 -0.07026321 -0.04179860 0.02980410  173  PHE   A HD2  
1732  H  HE1  . PHE   A  118 ? 0.35028106 0.33189604 0.23226970 -0.07038842 -0.02442761 0.02613354  173  PHE   A HE1  
1733  H  HE2  . PHE   A  118 ? 0.35967255 0.32875401 0.22079104 -0.07192289 -0.03619291 0.02684098  173  PHE   A HE2  
1734  H  HZ   . PHE   A  118 ? 0.39884403 0.37417221 0.26467782 -0.07164394 -0.02681637 0.02470351  173  PHE   A HZ   
1735  N  N    . ARG   A  119 ? 0.39097136 0.36647499 0.28297073 -0.07201546 -0.03363812 0.03730951  174  ARG   A N    
1736  C  CA   . ARG   A  119 ? 0.34471542 0.32354581 0.24088323 -0.07324349 -0.02985708 0.03759864  174  ARG   A CA   
1737  C  C    . ARG   A  119 ? 0.29121816 0.27513504 0.18884417 -0.07309178 -0.02562267 0.03491448  174  ARG   A C    
1738  O  O    . ARG   A  119 ? 0.34396726 0.32750079 0.23562640 -0.07339311 -0.02439250 0.03367458  174  ARG   A O    
1739  C  CB   . ARG   A  119 ? 0.34939101 0.32455441 0.23925708 -0.07637289 -0.02921122 0.04088602  174  ARG   A CB   
1740  C  CG   . ARG   A  119 ? 0.47071362 0.44921923 0.36458185 -0.07847030 -0.02578201 0.04149166  174  ARG   A CG   
1741  C  CD   . ARG   A  119 ? 0.39215463 0.36637276 0.27926150 -0.08231357 -0.02514014 0.04486479  174  ARG   A CD   
1742  N  NE   . ARG   A  119 ? 0.39344427 0.37245834 0.28534585 -0.08487827 -0.02146148 0.04497201  174  ARG   A NE   
1743  C  CZ   . ARG   A  119 ? 0.34545404 0.32136935 0.23654011 -0.08801451 -0.02160947 0.04755344  174  ARG   A CZ   
1744  N  NH1  . ARG   A  119 ? 0.38069445 0.34802297 0.26725504 -0.08820467 -0.02552961 0.05014386  174  ARG   A NH1  
1745  N  NH2  . ARG   A  119 ? 0.52791691 0.50943398 0.42299917 -0.09101208 -0.01791394 0.04741810  174  ARG   A NH2  
1746  H  H    . ARG   A  119 ? 0.38402063 0.35603246 0.27056628 -0.07284141 -0.03520963 0.03896607  174  ARG   A H    
1747  H  HA   . ARG   A  119 ? 0.33477148 0.31458995 0.23662248 -0.07220369 -0.03070744 0.03747313  174  ARG   A HA   
1748  H  HB2  . ARG   A  119 ? 0.37698868 0.34816375 0.26572943 -0.07597512 -0.03228299 0.04247171  174  ARG   A HB2  
1749  H  HB3  . ARG   A  119 ? 0.38126096 0.35537103 0.26488659 -0.07754071 -0.02826931 0.04109455  174  ARG   A HB3  
1750  H  HG2  . ARG   A  119 ? 0.41306502 0.39608204 0.30867189 -0.07852072 -0.02282353 0.03980659  174  ARG   A HG2  
1751  H  HG3  . ARG   A  119 ? 0.41052854 0.38970599 0.30995724 -0.07737794 -0.02686663 0.04126475  174  ARG   A HG3  
1752  H  HD2  . ARG   A  119 ? 0.41051674 0.37978581 0.29626840 -0.08199253 -0.02823061 0.04653195  174  ARG   A HD2  
1753  H  HD3  . ARG   A  119 ? 0.41683102 0.38991845 0.29753470 -0.08351052 -0.02417629 0.04529024  174  ARG   A HD3  
1754  H  HE   . ARG   A  119 ? 0.37770098 0.36199254 0.27337372 -0.08432724 -0.01914476 0.04312634  174  ARG   A HE   
1755  H  HH11 . ARG   A  119 ? 0.36854768 0.33392245 0.25699946 -0.08556826 -0.02831119 0.04964163  174  ARG   A HH11 
1756  H  HH12 . ARG   A  119 ? 0.37807167 0.34156802 0.25972348 -0.09093466 -0.02536120 0.05236505  174  ARG   A HH12 
1757  H  HH21 . ARG   A  119 ? 0.45918611 0.43855622 0.35399890 -0.09336111 -0.01814747 0.04902332  174  ARG   A HH21 
1758  H  HH22 . ARG   A  119 ? 0.45393074 0.44135335 0.35208380 -0.09063137 -0.01534395 0.04565284  174  ARG   A HH22 
1759  N  N    . ALA   A  120 ? 0.39983693 0.38837564 0.30520028 -0.07237334 -0.02354840 0.03387029  175  ALA   A N    
1760  C  CA   . ALA   A  120 ? 0.35996979 0.35348615 0.26838636 -0.07115924 -0.02014865 0.03107138  175  ALA   A CA   
1761  C  C    . ALA   A  120 ? 0.29871908 0.29463676 0.20205906 -0.07310979 -0.01609292 0.03081673  175  ALA   A C    
1762  O  O    . ALA   A  120 ? 0.30149585 0.29896307 0.20269895 -0.07183552 -0.01403129 0.02815254  175  ALA   A O    
1763  C  CB   . ALA   A  120 ? 0.31424117 0.31219327 0.23164803 -0.07011644 -0.01924404 0.03057439  175  ALA   A CB   
1764  H  H    . ALA   A  120 ? 0.35448030 0.34289730 0.26323691 -0.07246523 -0.02446526 0.03488130  175  ALA   A H    
1765  H  HA   . ALA   A  120 ? 0.34403765 0.33646825 0.25188488 -0.06959593 -0.02116221 0.02944518  175  ALA   A HA   
1766  H  HB1  . ALA   A  120 ? 0.32347065 0.32427970 0.24298902 -0.06874658 -0.01753214 0.02865592  175  ALA   A HB1  
1767  H  HB2  . ALA   A  120 ? 0.32062429 0.31698349 0.24060443 -0.06911211 -0.02154450 0.03078812  175  ALA   A HB2  
1768  H  HB3  . ALA   A  120 ? 0.32481006 0.32420215 0.24300373 -0.07186964 -0.01818320 0.03193069  175  ALA   A HB3  
1769  N  N    . SER   A  121 ? 0.28263649 0.27819467 0.18319835 -0.07641545 -0.01497250 0.03356690  176  SER   A N    
1770  C  CA   . SER   A  121 ? 0.37677652 0.37529647 0.27249539 -0.07905050 -0.01055184 0.03361977  176  SER   A CA   
1771  C  C    . SER   A  121 ? 0.40875930 0.40325251 0.29369220 -0.07970247 -0.01038153 0.03334789  176  SER   A C    
1772  O  O    . SER   A  121 ? 0.37252182 0.37031513 0.25327185 -0.08120495 -0.00600441 0.03231766  176  SER   A O    
1773  C  CB   . SER   A  121 ? 0.38163459 0.38018182 0.27682579 -0.08325188 -0.00945484 0.03694661  176  SER   A CB   
1774  O  OG   . SER   A  121 ? 0.43832192 0.42935154 0.33076206 -0.08387846 -0.01395887 0.03986421  176  SER   A OG   
1775  H  H    . SER   A  121 ? 0.30507302 0.29845208 0.20669048 -0.07717519 -0.01685152 0.03539581  176  SER   A H    
1776  H  HA   . SER   A  121 ? 0.35721684 0.36102867 0.25734219 -0.07779868 -0.00796649 0.03141297  176  SER   A HA   
1777  H  HB2  . SER   A  121 ? 0.40023726 0.39938259 0.29021993 -0.08562645 -0.00685811 0.03754902  176  SER   A HB2  
1778  H  HB3  . SER   A  121 ? 0.39031792 0.39352757 0.29223579 -0.08321651 -0.00818436 0.03637030  176  SER   A HB3  
1780  N  N    . TYR   A  122 ? 0.37485927 0.36293304 0.25548506 -0.07849527 -0.01503611 0.03394575  177  TYR   A N    
1781  C  CA   . TYR   A  122 ? 0.42055345 0.40484375 0.29091781 -0.07878648 -0.01556386 0.03320707  177  TYR   A CA   
1782  C  C    . TYR   A  122 ? 0.39583379 0.38388926 0.26633483 -0.07667398 -0.01234882 0.02872400  177  TYR   A C    
1783  O  O    . TYR   A  122 ? 0.40463936 0.39132744 0.26604605 -0.07763885 -0.01057743 0.02764374  177  TYR   A O    
1784  C  CB   . TYR   A  122 ? 0.37049228 0.34848374 0.23804213 -0.07742310 -0.02176894 0.03411920  177  TYR   A CB   
1785  C  CG   . TYR   A  122 ? 0.35562938 0.32823083 0.22061270 -0.07880707 -0.02567055 0.03831455  177  TYR   A CG   
1786  C  CD1  . TYR   A  122 ? 0.36575294 0.33648509 0.22620830 -0.08221965 -0.02381415 0.04162806  177  TYR   A CD1  
1787  C  CD2  . TYR   A  122 ? 0.40024868 0.36952654 0.26742050 -0.07667845 -0.03124557 0.03884831  177  TYR   A CD2  
1788  C  CE1  . TYR   A  122 ? 0.39801136 0.36222500 0.25538003 -0.08317628 -0.02776098 0.04543484  177  TYR   A CE1  
1789  C  CE2  . TYR   A  122 ? 0.34686220 0.31094739 0.21194190 -0.07711659 -0.03503757 0.04232651  177  TYR   A CE2  
1790  C  CZ   . TYR   A  122 ? 0.42235273 0.38327986 0.28238571 -0.08020349 -0.03340985 0.04563640  177  TYR   A CZ   
1791  O  OH   . TYR   A  122 ? 0.41436130 0.36880445 0.27199066 -0.08030695 -0.03747255 0.04900538  177  TYR   A OH   
1792  H  H    . TYR   A  122 ? 0.38511518 0.37139079 0.26914552 -0.07753522 -0.01794197 0.03473777  177  TYR   A H    
1793  H  HA   . TYR   A  122 ? 0.40502226 0.38815373 0.26936167 -0.08143361 -0.01400642 0.03503866  177  TYR   A HA   
1794  H  HB2  . TYR   A  122 ? 0.36995322 0.34933233 0.24380754 -0.07528570 -0.02309457 0.03257571  177  TYR   A HB2  
1795  H  HB3  . TYR   A  122 ? 0.38294053 0.35898390 0.24406824 -0.07746843 -0.02215440 0.03310686  177  TYR   A HB3  
1796  H  HD1  . TYR   A  122 ? 0.37408686 0.34781975 0.23343615 -0.08396284 -0.01984896 0.04128443  177  TYR   A HD1  
1797  H  HD2  . TYR   A  122 ? 0.37098572 0.34160626 0.24128810 -0.07485416 -0.03247716 0.03672618  177  TYR   A HD2  
1798  H  HE1  . TYR   A  122 ? 0.40177092 0.36404285 0.25583670 -0.08578093 -0.02650721 0.04775725  177  TYR   A HE1  
1799  H  HE2  . TYR   A  122 ? 0.37208205 0.33480722 0.23950581 -0.07531781 -0.03866837 0.04237391  177  TYR   A HE2  
1801  N  N    . MET   A  123 ? 0.46182996 0.45413423 0.34190878 -0.07373091 -0.01150930 0.02605146  178  MET   A N    
1802  C  CA   . MET   A  123 ? 0.39150828 0.38678139 0.27207634 -0.07124963 -0.00841477 0.02168069  178  MET   A CA   
1803  C  C    . MET   A  123 ? 0.58650392 0.58751935 0.46469173 -0.07247496 -0.00227903 0.02042418  178  MET   A C    
1804  O  O    . MET   A  123 ? 0.48856312 0.49072129 0.36361513 -0.07063771 0.00040994  0.01666003  178  MET   A O    
1805  C  CB   . MET   A  123 ? 0.40349984 0.40155506 0.29459387 -0.06780435 -0.00890716 0.01957658  178  MET   A CB   
1806  C  CG   . MET   A  123 ? 0.46127903 0.45427492 0.35396308 -0.06631888 -0.01384369 0.01938631  178  MET   A CG   
1807  S  SD   . MET   A  123 ? 0.48377478 0.47018352 0.36680999 -0.06599480 -0.01648784 0.01685323  178  MET   A SD   
1808  C  CE   . MET   A  123 ? 0.59095621 0.57452905 0.48076341 -0.06472240 -0.02149484 0.01702059  178  MET   A CE   
1809  H  H    . MET   A  123 ? 0.41867167 0.41155055 0.30466267 -0.07313014 -0.01303559 0.02693805  178  MET   A H    
1810  H  HA   . MET   A  123 ? 0.44209540 0.43351388 0.31716713 -0.07081150 -0.01007615 0.02053703  178  MET   A HA   
1811  H  HB2  . MET   A  123 ? 0.40695852 0.40820301 0.30346531 -0.06832292 -0.00827451 0.02103984  178  MET   A HB2  
1812  H  HB3  . MET   A  123 ? 0.41447741 0.41475484 0.30603006 -0.06609014 -0.00642139 0.01680682  178  MET   A HB3  
1813  H  HG2  . MET   A  123 ? 0.44457147 0.43628275 0.33822009 -0.06754225 -0.01610607 0.02191905  178  MET   A HG2  
1814  H  HG3  . MET   A  123 ? 0.44251961 0.43698728 0.34100136 -0.06434903 -0.01375608 0.01811827  178  MET   A HG3  
1815  H  HE1  . MET   A  123 ? 0.55456519 0.53831726 0.44639707 -0.06568880 -0.02323011 0.01949906  178  MET   A HE1  
1816  H  HE2  . MET   A  123 ? 0.55409527 0.53920221 0.44904375 -0.06311828 -0.02045076 0.01588468  178  MET   A HE2  
1817  H  HE3  . MET   A  123 ? 0.55982399 0.54016459 0.44599113 -0.06476910 -0.02349473 0.01572810  178  MET   A HE3  
1818  N  N    . LYS   A  124 ? 0.51287067 0.51747119 0.39231473 -0.07575123 0.00006865  0.02336759  179  LYS   A N    
1819  C  CA   . LYS   A  124 ? 0.49250522 0.50367343 0.37011388 -0.07775694 0.00626017  0.02247305  179  LYS   A CA   
1820  C  C    . LYS   A  124 ? 0.53087306 0.53825021 0.39477226 -0.08022062 0.00802578  0.02259461  179  LYS   A C    
1821  O  O    . LYS   A  124 ? 0.60906219 0.62185115 0.47024286 -0.08083045 0.01366264  0.02029357  179  LYS   A O    
1822  C  CB   . LYS   A  124 ? 0.50215960 0.51764810 0.38443595 -0.08161616 0.00794923  0.02593436  179  LYS   A CB   
1823  C  CG   . LYS   A  124 ? 0.61993867 0.64138871 0.51553583 -0.07968544 0.00751838  0.02535197  179  LYS   A CG   
1824  C  CD   . LYS   A  124 ? 0.67670518 0.70291770 0.57633644 -0.08432270 0.00952685  0.02843508  179  LYS   A CD   
1825  C  CE   . LYS   A  124 ? 0.93507290 0.96718985 0.84752750 -0.08262920 0.00851958  0.02786289  179  LYS   A CE   
1826  N  NZ   . LYS   A  124 ? 0.83221400 0.85765445 0.74719280 -0.08043703 0.00267713  0.02905068  179  LYS   A NZ   
1827  H  H    . LYS   A  124 ? 0.51645172 0.51950449 0.39811665 -0.07688046 -0.00215005 0.02589333  179  LYS   A H    
1828  H  HA   . LYS   A  124 ? 0.50242895 0.51811641 0.38477951 -0.07508565 0.00844669  0.01934342  179  LYS   A HA   
1829  H  HB2  . LYS   A  124 ? 0.52635300 0.53642774 0.40461543 -0.08373577 0.00516981  0.02900997  179  LYS   A HB2  
1830  H  HB3  . LYS   A  124 ? 0.53073651 0.55024940 0.41047961 -0.08372316 0.01210949  0.02567093  179  LYS   A HB3  
1831  H  HG2  . LYS   A  124 ? 0.59605587 0.62239873 0.49581996 -0.07703178 0.00971522  0.02228870  179  LYS   A HG2  
1832  H  HG3  . LYS   A  124 ? 0.59401101 0.61135066 0.49164626 -0.07807288 0.00358303  0.02594061  179  LYS   A HG3  
1833  H  HD2  . LYS   A  124 ? 0.71777928 0.73822248 0.61269748 -0.08682951 0.00725960  0.03145107  179  LYS   A HD2  
1834  H  HD3  . LYS   A  124 ? 0.72013199 0.75109243 0.61808968 -0.08622586 0.01371963  0.02784244  179  LYS   A HD3  
1835  H  HE2  . LYS   A  124 ? 0.84344816 0.87886298 0.75800216 -0.08590059 0.01000121  0.02949475  179  LYS   A HE2  
1836  H  HE3  . LYS   A  124 ? 0.84068722 0.87814224 0.75786883 -0.07976240 0.01034139  0.02495832  179  LYS   A HE3  
1837  H  HZ1  . LYS   A  124 ? 0.86195838 0.88211966 0.77237141 -0.08248081 0.00081270  0.03142830  179  LYS   A HZ1  
1838  H  HZ2  . LYS   A  124 ? 0.85531211 0.87868220 0.76970232 -0.07747599 0.00144176  0.02735868  179  LYS   A HZ2  
1839  H  HZ3  . LYS   A  124 ? 0.85440856 0.88312060 0.77599168 -0.08005117 0.00219736  0.02903632  179  LYS   A HZ3  
1840  N  N    . LYS   A  125 ? 0.65368140 0.65216500 0.50907332 -0.08147009 0.00316447  0.02515697  180  LYS   A N    
1841  C  CA   . LYS   A  125 ? 0.54296029 0.53644419 0.38397276 -0.08396477 0.00364214  0.02588625  180  LYS   A CA   
1842  C  C    . LYS   A  125 ? 0.57343268 0.56860745 0.40927923 -0.08177632 0.00704265  0.02076502  180  LYS   A C    
1843  O  O    . LYS   A  125 ? 0.60589778 0.60137033 0.43159473 -0.08435475 0.01094603  0.02057601  180  LYS   A O    
1844  C  CB   . LYS   A  125 ? 0.59462255 0.57854557 0.42889717 -0.08421987 -0.00340259 0.02862942  180  LYS   A CB   
1845  C  CG   . LYS   A  125 ? 0.61345148 0.59265661 0.44388536 -0.08788607 -0.00585727 0.03432664  180  LYS   A CG   
1846  C  CD   . LYS   A  125 ? 0.97885704 0.95574856 0.79571974 -0.09258231 -0.00246319 0.03675984  180  LYS   A CD   
1847  C  CE   . LYS   A  125 ? 1.13304794 1.10033369 0.94038177 -0.09523120 -0.00752832 0.04210298  180  LYS   A CE   
1848  N  NZ   . LYS   A  125 ? 1.08668935 1.05269897 0.90112954 -0.09656569 -0.00937556 0.04590145  180  LYS   A NZ   
1849  H  H    . LYS   A  125 ? 0.58665073 0.58223265 0.44531646 -0.08068689 -0.00068797 0.02651173  180  LYS   A H    
1850  H  HA   . LYS   A  125 ? 0.58382511 0.57883894 0.42189562 -0.08724546 0.00639866  0.02807359  180  LYS   A HA   
1851  H  HB2  . LYS   A  125 ? 0.57831186 0.56167775 0.41886240 -0.08164325 -0.00648413 0.02762781  180  LYS   A HB2  
1852  H  HB3  . LYS   A  125 ? 0.59560454 0.57658327 0.42148870 -0.08430682 -0.00366449 0.02742418  180  LYS   A HB3  
1853  H  HG2  . LYS   A  125 ? 0.66571629 0.64806795 0.50368422 -0.08830056 -0.00489641 0.03535344  180  LYS   A HG2  
1854  H  HG3  . LYS   A  125 ? 0.67336512 0.64751709 0.50241613 -0.08688866 -0.01079885 0.03551745  180  LYS   A HG3  
1855  H  HD2  . LYS   A  125 ? 0.90422505 0.88116217 0.71517634 -0.09198713 -0.00099966 0.03430473  180  LYS   A HD2  
1856  H  HD3  . LYS   A  125 ? 0.90390575 0.88567454 0.72377676 -0.09458144 0.00185983  0.03715573  180  LYS   A HD3  
1857  H  HE2  . LYS   A  125 ? 1.08890271 1.05210614 0.89418864 -0.09310149 -0.01208206 0.04166995  180  LYS   A HE2  
1858  H  HE3  . LYS   A  125 ? 1.09902549 1.06445193 0.89678025 -0.09822562 -0.00529633 0.04350907  180  LYS   A HE3  
1859  H  HZ1  . LYS   A  125 ? 1.08664680 1.05370736 0.90896326 -0.09381944 -0.01179873 0.04479078  180  LYS   A HZ1  
1860  H  HZ2  . LYS   A  125 ? 1.09720314 1.06746423 0.91444045 -0.09862621 -0.00534728 0.04611826  180  LYS   A HZ2  
1861  H  HZ3  . LYS   A  125 ? 1.10473704 1.06451726 0.91271341 -0.09810454 -0.01218047 0.04906958  180  LYS   A HZ3  
1862  N  N    . GLY   A  126 ? 0.54223102 0.53775358 0.38410571 -0.07721529 0.00558593  0.01662932  181  GLY   A N    
1863  C  CA   . GLY   A  126 ? 0.58280951 0.58095336 0.42242265 -0.07444399 0.00964619  0.01109131  181  GLY   A CA   
1864  C  C    . GLY   A  126 ? 0.54224199 0.53280395 0.36985478 -0.07382550 0.00713131  0.00854587  181  GLY   A C    
1865  O  O    . GLY   A  126 ? 0.51449698 0.49810028 0.33550727 -0.07561705 0.00180431  0.01127290  181  GLY   A O    
1866  H  H    . GLY   A  126 ? 0.54956841 0.54331791 0.39682034 -0.07581342 0.00200817  0.01723194  181  GLY   A H    
1867  H  HA2  . GLY   A  126 ? 0.55555153 0.55621129 0.40358835 -0.07136218 0.00960540  0.00894789  181  GLY   A HA2  
1868  H  HA3  . GLY   A  126 ? 0.56674325 0.56974280 0.40479785 -0.07586640 0.01450575  0.01073374  181  GLY   A HA3  
1869  N  N    . SER   A  127 ? 0.60894191 0.60114765 0.43399689 -0.07108836 0.01094412  0.00303817  182  SER   A N    
1870  C  CA   . SER   A  127 ? 0.57753348 0.56268096 0.39293528 -0.06964225 0.00862895  -0.00081866 182  SER   A CA   
1871  C  C    . SER   A  127 ? 0.84135920 0.82132006 0.64031345 -0.07338855 0.00807328  0.00055619  182  SER   A C    
1872  O  O    . SER   A  127 ? 0.56982648 0.54261434 0.36016548 -0.07310776 0.00401698  -0.00138418 182  SER   A O    
1873  C  CB   . SER   A  127 ? 0.64676100 0.63514817 0.46370721 -0.06547950 0.01361786  -0.00734787 182  SER   A CB   
1874  O  OG   . SER   A  127 ? 0.74613380 0.73997593 0.55635142 -0.06695143 0.02069613  -0.00875374 182  SER   A OG   
1875  H  H    . SER   A  127 ? 0.58367294 0.58183324 0.41341075 -0.07000561 0.01521926  0.00143334  182  SER   A H    
1876  H  HA   . SER   A  127 ? 0.63064146 0.61177492 0.44921708 -0.06864294 0.00377952  -0.00044716 182  SER   A HA   
1877  H  HB2  . SER   A  127 ? 0.65516973 0.63799632 0.46745703 -0.06410333 0.01122344  -0.01013596 182  SER   A HB2  
1878  H  HB3  . SER   A  127 ? 0.64186084 0.63401568 0.46914199 -0.06306139 0.01425179  -0.00795282 182  SER   A HB3  
1880  N  N    . LYS   A  128 ? 0.69493014 0.67826039 0.48903865 -0.07721379 0.01200133  0.00399445  183  LYS   A N    
1881  C  CA   . LYS   A  128 ? 0.70183033 0.67953658 0.47945660 -0.08114086 0.01122845  0.00619441  183  LYS   A CA   
1882  C  C    . LYS   A  128 ? 0.55673450 0.52699792 0.33215073 -0.08291018 0.00292468  0.01131810  183  LYS   A C    
1883  O  O    . LYS   A  128 ? 0.74096954 0.70420456 0.50364774 -0.08441421 -0.00094383 0.01196543  183  LYS   A O    
1884  C  CB   . LYS   A  128 ? 1.01136029 0.99510849 0.78480625 -0.08505414 0.01858426  0.00838836  183  LYS   A CB   
1885  C  CG   . LYS   A  128 ? 1.10870337 1.08717775 0.86337274 -0.08952332 0.01951404  0.01050796  183  LYS   A CG   
1886  C  CD   . LYS   A  128 ? 1.18787229 1.16238010 0.92987937 -0.08798024 0.02030322  0.00507590  183  LYS   A CD   
1887  C  CE   . LYS   A  128 ? 1.01901972 0.99032247 0.74229991 -0.09289747 0.02328192  0.00719675  183  LYS   A CE   
1888  N  NZ   . LYS   A  128 ? 1.16842353 1.13424349 0.87735641 -0.09172691 0.02285110  0.00218981  183  LYS   A NZ   
1889  H  H    . LYS   A  128 ? 0.71917033 0.70820928 0.52003467 -0.07755949 0.01513416  0.00504776  183  LYS   A H    
1890  H  HA   . LYS   A  128 ? 0.72337174 0.69833779 0.49398300 -0.07997628 0.01144477  0.00256462  183  LYS   A HA   
1891  H  HB2  . LYS   A  128 ? 0.94272292 0.93246305 0.72009933 -0.08327248 0.02367616  0.00476895  183  LYS   A HB2  
1892  H  HB3  . LYS   A  128 ? 0.93628561 0.92205065 0.71620488 -0.08651944 0.01800392  0.01203643  183  LYS   A HB3  
1893  H  HG2  . LYS   A  128 ? 1.10570848 1.08879590 0.85921788 -0.09216762 0.02467352  0.01186450  183  LYS   A HG2  
1894  H  HG3  . LYS   A  128 ? 1.10047340 1.07320666 0.85165721 -0.09121310 0.01435999  0.01447553  183  LYS   A HG3  
1895  H  HD2  . LYS   A  128 ? 1.12550116 1.09429324 0.86642301 -0.08646122 0.01450783  0.00452004  183  LYS   A HD2  
1896  H  HD3  . LYS   A  128 ? 1.12483740 1.10436273 0.87160879 -0.08530071 0.02458894  0.00058142  183  LYS   A HD3  
1897  H  HE2  . LYS   A  128 ? 1.09065223 1.06822181 0.81491739 -0.09450962 0.02964844  0.00716839  183  LYS   A HE2  
1898  H  HE3  . LYS   A  128 ? 1.09067476 1.05711043 0.80974728 -0.09552946 0.01917095  0.01207795  183  LYS   A HE3  
1899  H  HZ1  . LYS   A  128 ? 1.12358618 1.09343958 0.83597666 -0.08911601 0.02674696  -0.00251012 183  LYS   A HZ1  
1900  H  HZ2  . LYS   A  128 ? 1.12305641 1.08333290 0.83115131 -0.09054114 0.01682209  0.00219911  183  LYS   A HZ2  
1901  H  HZ3  . LYS   A  128 ? 1.13581932 1.09962475 0.83303392 -0.09483753 0.02464589  0.00369679  183  LYS   A HZ3  
1902  N  N    . VAL   A  129 ? 0.63233441 0.60421586 0.42010158 -0.08245217 -0.00006078 0.01470621  184  VAL   A N    
1903  C  CA   . VAL   A  129 ? 0.47060004 0.43629456 0.25802201 -0.08326673 -0.00783075 0.01898525  184  VAL   A CA   
1904  C  C    . VAL   A  129 ? 0.47019857 0.43345678 0.26412946 -0.07987761 -0.01351323 0.01623103  184  VAL   A C    
1905  O  O    . VAL   A  129 ? 0.46566927 0.42312557 0.25401202 -0.08021895 -0.01982333 0.01716175  184  VAL   A O    
1906  C  CB   . VAL   A  129 ? 0.56557137 0.53343213 0.36129177 -0.08489481 -0.00812287 0.02413230  184  VAL   A CB   
1907  C  CG1  . VAL   A  129 ? 0.49118188 0.45280296 0.28708386 -0.08501209 -0.01607255 0.02819893  184  VAL   A CG1  
1908  C  CG2  . VAL   A  129 ? 0.65985066 0.62957448 0.44852173 -0.08926414 -0.00256660 0.02719079  184  VAL   A CG2  
1909  H  H    . VAL   A  129 ? 0.56108880 0.53822696 0.35768440 -0.08148761 0.00280467  0.01420904  184  VAL   A H    
1910  H  HA   . VAL   A  129 ? 0.52644211 0.48767900 0.30303323 -0.08522123 -0.00940751 0.02042039  184  VAL   A HA   
1911  H  HB   . VAL   A  129 ? 0.53281999 0.50526428 0.33905628 -0.08300450 -0.00659070 0.02268136  184  VAL   A HB   
1912  H  HG11 . VAL   A  129 ? 0.52050316 0.47735208 0.30615300 -0.08651487 -0.01823608 0.02960592  184  VAL   A HG11 
1913  H  HG12 . VAL   A  129 ? 0.50407481 0.46560749 0.30570912 -0.08259413 -0.01913066 0.02634890  184  VAL   A HG12 
1914  H  HG13 . VAL   A  129 ? 0.50677413 0.46927714 0.30723241 -0.08599473 -0.01595725 0.03116937  184  VAL   A HG13 
1915  H  HG21 . VAL   A  129 ? 0.62947261 0.59911299 0.42225403 -0.09059108 -0.00356033 0.03061371  184  VAL   A HG21 
1916  H  HG22 . VAL   A  129 ? 0.63219756 0.60760581 0.42363673 -0.08892775 0.00272453  0.02461445  184  VAL   A HG22 
1917  H  HG23 . VAL   A  129 ? 0.64396477 0.60919929 0.42115605 -0.09113995 -0.00338372 0.02825203  184  VAL   A HG23 
1918  N  N    . MET   A  130 ? 0.43414617 0.40197122 0.24002761 -0.07678291 -0.01142199 0.01298696  185  MET   A N    
1919  C  CA   . MET   A  130 ? 0.40437627 0.37016416 0.21791831 -0.07422672 -0.01643780 0.01116290  185  MET   A CA   
1920  C  C    . MET   A  130 ? 0.36630493 0.33300775 0.18215232 -0.07117887 -0.01353347 0.00523527  185  MET   A C    
1921  O  O    . MET   A  130 ? 0.32796705 0.29795215 0.15504308 -0.06868565 -0.01231464 0.00397607  185  MET   A O    
1922  C  CB   . MET   A  130 ? 0.39406520 0.36298367 0.22103207 -0.07346138 -0.01811535 0.01416887  185  MET   A CB   
1923  C  CG   . MET   A  130 ? 0.46482566 0.43203300 0.29056907 -0.07584406 -0.02136719 0.01978051  185  MET   A CG   
1924  S  SD   . MET   A  130 ? 0.47159353 0.44220686 0.31279010 -0.07471461 -0.02313631 0.02270888  185  MET   A SD   
1925  C  CE   . MET   A  130 ? 0.45183164 0.42977744 0.30017087 -0.07421659 -0.01580628 0.02139979  185  MET   A CE   
1926  H  H    . MET   A  130 ? 0.43406218 0.40639666 0.24336343 -0.07635823 -0.00682436 0.01198017  185  MET   A H    
1927  H  HA   . MET   A  130 ? 0.40627837 0.36774504 0.21434866 -0.07501166 -0.02075112 0.01168268  185  MET   A HA   
1928  H  HB2  . MET   A  130 ? 0.40305153 0.37631088 0.23533799 -0.07270089 -0.01415160 0.01356479  185  MET   A HB2  
1929  H  HB3  . MET   A  130 ? 0.40136009 0.36909986 0.23300937 -0.07199877 -0.02104714 0.01285177  185  MET   A HB3  
1930  H  HG2  . MET   A  130 ? 0.45380336 0.41700971 0.27459139 -0.07628615 -0.02559798 0.02037347  185  MET   A HG2  
1931  H  HG3  . MET   A  130 ? 0.45447913 0.42230788 0.27515665 -0.07769921 -0.01844303 0.02131557  185  MET   A HG3  
1932  H  HE1  . MET   A  130 ? 0.46044427 0.43920267 0.30383316 -0.07616757 -0.01305046 0.02258723  185  MET   A HE1  
1933  H  HE2  . MET   A  130 ? 0.45414510 0.43336859 0.30372566 -0.07245985 -0.01413510 0.01809265  185  MET   A HE2  
1934  H  HE3  . MET   A  130 ? 0.44709492 0.42700267 0.30303663 -0.07376049 -0.01635327 0.02274959  185  MET   A HE3  
1935  N  N    . PRO   A  131 ? 0.43245554 0.39559382 0.23721184 -0.07108881 -0.01251541 0.00128002  186  PRO   A N    
1936  C  CA   . PRO   A  131 ? 0.38084966 0.34393382 0.18713026 -0.06777111 -0.00950683 -0.00475489 186  PRO   A CA   
1937  C  C    . PRO   A  131 ? 0.38944098 0.34961474 0.20468307 -0.06543719 -0.01370002 -0.00667465 186  PRO   A C    
1938  O  O    . PRO   A  131 ? 0.36434087 0.32617426 0.18662448 -0.06217574 -0.01092412 -0.00979385 186  PRO   A O    
1939  C  CB   . PRO   A  131 ? 0.39884615 0.35690075 0.18934448 -0.06884351 -0.00907921 -0.00810797 186  PRO   A CB   
1940  C  CG   . PRO   A  131 ? 0.40275979 0.35678387 0.18504560 -0.07245728 -0.01452113 -0.00372380 186  PRO   A CG   
1941  C  CD   . PRO   A  131 ? 0.41361356 0.37203196 0.20315574 -0.07398101 -0.01424828 0.00227910  186  PRO   A CD   
1942  H  HA   . PRO   A  131 ? 0.39109293 0.35913920 0.20138568 -0.06662169 -0.00471841 -0.00541281 186  PRO   A HA   
1943  H  HB2  . PRO   A  131 ? 0.40180016 0.35624555 0.19137307 -0.06727905 -0.01059273 -0.01176951 186  PRO   A HB2  
1944  H  HB3  . PRO   A  131 ? 0.40416881 0.36517647 0.19087736 -0.06879409 -0.00397301 -0.00930987 186  PRO   A HB3  
1945  H  HG2  . PRO   A  131 ? 0.40629965 0.35675809 0.18955006 -0.07237235 -0.01955985 -0.00411271 186  PRO   A HG2  
1946  H  HG3  . PRO   A  131 ? 0.41819072 0.37031296 0.18958680 -0.07386872 -0.01320923 -0.00441087 186  PRO   A HG3  
1947  H  HD2  . PRO   A  131 ? 0.41477010 0.37060583 0.20365424 -0.07523847 -0.01906654 0.00517414  186  PRO   A HD2  
1948  H  HD3  . PRO   A  131 ? 0.42068869 0.38126156 0.20573238 -0.07543048 -0.01039961 0.00353649  186  PRO   A HD3  
1949  N  N    . ASN   A  132 ? 0.32337335 0.27931118 0.13821273 -0.06716263 -0.02037762 -0.00477542 187  ASN   A N    
1950  C  CA   . ASN   A  132 ? 0.34091884 0.29391593 0.16317976 -0.06605641 -0.02453321 -0.00627807 187  ASN   A CA   
1951  C  C    . ASN   A  132 ? 0.32307932 0.28068632 0.15925246 -0.06463711 -0.02374228 -0.00372781 187  ASN   A C    
1952  O  O    . ASN   A  132 ? 0.36360708 0.32043523 0.20606714 -0.06222995 -0.02283417 -0.00621709 187  ASN   A O    
1953  C  CB   . ASN   A  132 ? 0.36275029 0.31191838 0.18193848 -0.06859731 -0.03156465 -0.00481968 187  ASN   A CB   
1954  C  CG   . ASN   A  132 ? 0.37621158 0.31953362 0.18211231 -0.06977031 -0.03349159 -0.00846020 187  ASN   A CG   
1955  O  OD1  . ASN   A  132 ? 0.35010338 0.28870428 0.15383360 -0.06890565 -0.03415022 -0.01325306 187  ASN   A OD1  
1956  N  ND2  . ASN   A  132 ? 0.38864869 0.33135247 0.18475041 -0.07186085 -0.03472191 -0.00626913 187  ASN   A ND2  
1957  H  H    . ASN   A  132 ? 0.34623545 0.30116707 0.15589364 -0.06919532 -0.02242323 -0.00245297 187  ASN   A H    
1958  H  HA   . ASN   A  132 ? 0.34438878 0.29470932 0.16445506 -0.06454825 -0.02329833 -0.01022304 187  ASN   A HA   
1959  H  HB2  . ASN   A  132 ? 0.35520926 0.30636382 0.17461137 -0.06987313 -0.03280727 -0.00119827 187  ASN   A HB2  
1960  H  HB3  . ASN   A  132 ? 0.35217005 0.30072290 0.17802984 -0.06827327 -0.03391630 -0.00507633 187  ASN   A HB3  
1961  H  HD21 . ASN   A  132 ? 0.38478994 0.33024898 0.18112548 -0.07226389 -0.03293579 -0.00338365 187  ASN   A HD21 
1962  H  HD22 . ASN   A  132 ? 0.39475065 0.33396110 0.18361157 -0.07298340 -0.03748206 -0.00760759 187  ASN   A HD22 
1963  N  N    . ILE   A  133 ? 0.32895029 0.29056436 0.16911653 -0.06610076 -0.02428733 0.00119923  188  ILE   A N    
1964  C  CA   . ILE   A  133 ? 0.34848493 0.31441519 0.20097488 -0.06498355 -0.02361298 0.00363038  188  ILE   A CA   
1965  C  C    . ILE   A  133 ? 0.36418462 0.33424759 0.22147349 -0.06229221 -0.01791907 0.00164785  188  ILE   A C    
1966  O  O    . ILE   A  133 ? 0.35197762 0.32343000 0.21849051 -0.06029820 -0.01782512 0.00145127  188  ILE   A O    
1967  C  CB   . ILE   A  133 ? 0.33610791 0.30480489 0.19080293 -0.06696552 -0.02504519 0.00883434  188  ILE   A CB   
1968  C  CG1  . ILE   A  133 ? 0.37805581 0.34349874 0.23079316 -0.06864270 -0.03136365 0.01067408  188  ILE   A CG1  
1969  C  CG2  . ILE   A  133 ? 0.30767530 0.28097984 0.17401859 -0.06589279 -0.02369002 0.01100752  188  ILE   A CG2  
1970  C  CD1  . ILE   A  133 ? 0.35594577 0.32210356 0.20661619 -0.07038879 -0.03305739 0.01545745  188  ILE   A CD1  
1971  H  H    . ILE   A  133 ? 0.33643842 0.29765826 0.17119296 -0.06779590 -0.02520202 0.00303770  188  ILE   A H    
1972  H  HA   . ILE   A  133 ? 0.34004951 0.30413687 0.19657204 -0.06462177 -0.02631557 0.00305859  188  ILE   A HA   
1973  H  HB   . ILE   A  133 ? 0.34610230 0.31568366 0.19540128 -0.06794384 -0.02276743 0.00963837  188  ILE   A HB   
1974  H  HG12 . ILE   A  133 ? 0.35648435 0.32225838 0.21587491 -0.06807680 -0.03328480 0.01061999  188  ILE   A HG12 
1975  H  HG13 . ILE   A  133 ? 0.36928886 0.33158636 0.21537906 -0.06914555 -0.03275929 0.00870677  188  ILE   A HG13 
1976  H  HG21 . ILE   A  133 ? 0.30858833 0.28108302 0.17979859 -0.06481095 -0.02510059 0.00991907  188  ILE   A HG21 
1977  H  HG22 . ILE   A  133 ? 0.31232685 0.28859416 0.17981589 -0.06512974 -0.01988102 0.01041733  188  ILE   A HG22 
1978  H  HG23 . ILE   A  133 ? 0.31009907 0.28410351 0.17768618 -0.06709546 -0.02530281 0.01401999  188  ILE   A HG23 
1979  H  HD11 . ILE   A  133 ? 0.35454005 0.32335484 0.21182381 -0.06999642 -0.03211618 0.01726392  188  ILE   A HD11 
1980  H  HD12 . ILE   A  133 ? 0.36834943 0.33399445 0.21218175 -0.07130435 -0.03093391 0.01583487  188  ILE   A HD12 
1981  H  HD13 . ILE   A  133 ? 0.36350113 0.32775378 0.21290462 -0.07097946 -0.03727571 0.01623770  188  ILE   A HD13 
1982  N  N    . GLU   A  134 ? 0.35281569 0.32525659 0.20380314 -0.06225799 -0.01317251 0.00022991  189  GLU   A N    
1983  C  CA   . GLU   A  134 ? 0.33360076 0.31174564 0.18993996 -0.05961302 -0.00758603 -0.00174651 189  GLU   A CA   
1984  C  C    . GLU   A  134 ? 0.38533112 0.36002737 0.24270314 -0.05579698 -0.00715610 -0.00695537 189  GLU   A C    
1985  O  O    . GLU   A  134 ? 0.31125224 0.28941494 0.17654651 -0.05252371 -0.00470024 -0.00842674 189  GLU   A O    
1986  C  CB   . GLU   A  134 ? 0.35574573 0.33834952 0.20541500 -0.06089920 -0.00210414 -0.00209441 189  GLU   A CB   
1987  C  CG   . GLU   A  134 ? 0.49856693 0.48398513 0.34673017 -0.06487060 -0.00188086 0.00319584  189  GLU   A CG   
1988  C  CD   . GLU   A  134 ? 0.65394729 0.64481860 0.51338208 -0.06530547 -0.00161806 0.00685844  189  GLU   A CD   
1989  O  OE1  . GLU   A  134 ? 0.42225334 0.41619226 0.29190078 -0.06235084 -0.00123116 0.00554524  189  GLU   A OE1  
1990  O  OE2  . GLU   A  134 ? 0.53591728 0.52730364 0.39313439 -0.06874730 -0.00205017 0.01115724  189  GLU   A OE2  
1991  H  H    . GLU   A  134 ? 0.35900787 0.32980806 0.20233822 -0.06392873 -0.01343476 0.00050419  189  GLU   A H    
1992  H  HA   . GLU   A  134 ? 0.34089130 0.32230619 0.20493597 -0.05939777 -0.00768987 0.00047393  189  GLU   A HA   
1993  H  HB2  . GLU   A  134 ? 0.38720006 0.36630028 0.22846797 -0.06119820 -0.00204907 -0.00428463 189  GLU   A HB2  
1994  H  HB3  . GLU   A  134 ? 0.37723190 0.36425704 0.23141709 -0.05877405 0.00153017  -0.00397244 189  GLU   A HB3  
1995  H  HG2  . GLU   A  134 ? 0.48444796 0.46539342 0.32807839 -0.06655190 -0.00568567 0.00494752  189  GLU   A HG2  
1996  H  HG3  . GLU   A  134 ? 0.49095970 0.47856820 0.33374363 -0.06596428 0.00177738  0.00265535  189  GLU   A HG3  
1997  N  N    . LYS   A  135 ? 0.36270988 0.33003184 0.21183275 -0.05612924 -0.00990291 -0.00986093 190  LYS   A N    
1998  C  CA   . LYS   A  135 ? 0.38644034 0.34868693 0.23623499 -0.05274750 -0.01014566 -0.01467628 190  LYS   A CA   
1999  C  C    . LYS   A  135 ? 0.34603512 0.30615908 0.20549649 -0.05201838 -0.01385381 -0.01296728 190  LYS   A C    
2000  O  O    . LYS   A  135 ? 0.38597274 0.34554607 0.25102597 -0.04839146 -0.01251230 -0.01507412 190  LYS   A O    
2001  C  CB   . LYS   A  135 ? 0.39478850 0.34891868 0.23306885 -0.05364370 -0.01240745 -0.01855966 190  LYS   A CB   
2002  C  CG   . LYS   A  135 ? 0.45752087 0.40492612 0.29650700 -0.05009791 -0.01283770 -0.02367924 190  LYS   A CG   
2003  C  CD   . LYS   A  135 ? 0.51976049 0.45878774 0.34695825 -0.05076287 -0.01458136 -0.02837217 190  LYS   A CD   
2004  C  CE   . LYS   A  135 ? 0.49792141 0.42874813 0.32654473 -0.04771698 -0.01594257 -0.03276891 190  LYS   A CE   
2005  N  NZ   . LYS   A  135 ? 0.48167855 0.40304756 0.29890531 -0.04919865 -0.01881661 -0.03721943 190  LYS   A NZ   
2006  H  H    . LYS   A  135 ? 0.37741536 0.34256333 0.22034046 -0.05844766 -0.01178055 -0.00888823 190  LYS   A H    
2007  H  HA   . LYS   A  135 ? 0.37701905 0.34246063 0.22853561 -0.05015625 -0.00621619 -0.01676540 190  LYS   A HA   
2008  H  HB2  . LYS   A  135 ? 0.41415042 0.36957353 0.24565706 -0.05398552 -0.00970536 -0.01981184 190  LYS   A HB2  
2009  H  HB3  . LYS   A  135 ? 0.40634346 0.35799342 0.24312370 -0.05626583 -0.01643821 -0.01657113 190  LYS   A HB3  
2010  H  HG2  . LYS   A  135 ? 0.44796699 0.39341629 0.29269248 -0.05032538 -0.01574520 -0.02217646 190  LYS   A HG2  
2011  H  HG3  . LYS   A  135 ? 0.45415330 0.40457839 0.29602233 -0.04699574 -0.00908162 -0.02543851 190  LYS   A HG3  
2012  H  HD2  . LYS   A  135 ? 0.50836909 0.44905338 0.32954532 -0.05007209 -0.01120564 -0.03041770 190  LYS   A HD2  
2013  H  HD3  . LYS   A  135 ? 0.50162053 0.43854740 0.32574698 -0.05397400 -0.01833397 -0.02661808 190  LYS   A HD3  
2014  H  HE2  . LYS   A  135 ? 0.48917201 0.41895437 0.32423213 -0.04836369 -0.01864470 -0.03048600 190  LYS   A HE2  
2015  H  HE3  . LYS   A  135 ? 0.49765357 0.43017781 0.32833970 -0.04407107 -0.01231682 -0.03503624 190  LYS   A HE3  
2016  H  HZ1  . LYS   A  135 ? 0.48895115 0.40872860 0.30535197 -0.05243338 -0.02265036 -0.03526022 190  LYS   A HZ1  
2017  H  HZ2  . LYS   A  135 ? 0.49717686 0.41952920 0.30763459 -0.04899043 -0.01648400 -0.03909706 190  LYS   A HZ2  
2018  H  HZ3  . LYS   A  135 ? 0.49486831 0.41087511 0.31245127 -0.04715132 -0.01918491 -0.04013040 190  LYS   A HZ3  
2019  N  N    . LEU   A  136 ? 0.35939205 0.31808227 0.22024105 -0.05532171 -0.01854118 -0.00936540 191  LEU   A N    
2020  C  CA   . LEU   A  136 ? 0.35772538 0.31545746 0.22747625 -0.05535428 -0.02159165 -0.00721529 191  LEU   A CA   
2021  C  C    . LEU   A  136 ? 0.44359428 0.40736812 0.32259870 -0.05287122 -0.01855185 -0.00548170 191  LEU   A C    
2022  O  O    . LEU   A  136 ? 0.34440160 0.30622977 0.22898367 -0.05048883 -0.01891460 -0.00627504 191  LEU   A O    
2023  C  CB   . LEU   A  136 ? 0.45346183 0.41221997 0.32485297 -0.05901894 -0.02579572 -0.00307694 191  LEU   A CB   
2024  C  CG   . LEU   A  136 ? 0.47219747 0.42583823 0.33721596 -0.06174496 -0.03031952 -0.00415463 191  LEU   A CG   
2025  C  CD1  . LEU   A  136 ? 0.48421913 0.44067281 0.35283327 -0.06445345 -0.03414638 -0.00004922 191  LEU   A CD1  
2026  C  CD2  . LEU   A  136 ? 0.55058271 0.49759650 0.41602659 -0.06143811 -0.03240608 -0.00731257 191  LEU   A CD2  
2027  H  H    . LEU   A  136 ? 0.35947227 0.31787920 0.21544215 -0.05755576 -0.01983237 -0.00827604 191  LEU   A H    
2028  H  HA   . LEU   A  136 ? 0.39238492 0.34498170 0.26132053 -0.05455326 -0.02294800 -0.00959267 191  LEU   A HA   
2029  H  HB2  . LEU   A  136 ? 0.42636144 0.38901430 0.29720643 -0.05977523 -0.02459013 -0.00095981 191  LEU   A HB2  
2030  H  HB3  . LEU   A  136 ? 0.42218852 0.38167241 0.30007017 -0.05886166 -0.02682314 -0.00151401 191  LEU   A HB3  
2031  H  HG   . LEU   A  136 ? 0.49318022 0.44587690 0.35095811 -0.06201385 -0.02948117 -0.00559846 191  LEU   A HG   
2032  H  HD11 . LEU   A  136 ? 0.48339781 0.43756509 0.34754202 -0.06611611 -0.03701895 -0.00071586 191  LEU   A HD11 
2033  H  HD12 . LEU   A  136 ? 0.47298446 0.42987806 0.34796077 -0.06448944 -0.03518382 0.00092913  191  LEU   A HD12 
2034  H  HD13 . LEU   A  136 ? 0.47521582 0.43528172 0.34417367 -0.06448173 -0.03276534 0.00221336  191  LEU   A HD13 
2035  H  HD21 . LEU   A  136 ? 0.52549779 0.46984968 0.38746765 -0.05950581 -0.03031732 -0.01035156 191  LEU   A HD21 
2036  H  HD22 . LEU   A  136 ? 0.51876426 0.46645579 0.39076829 -0.06103449 -0.03268676 -0.00594217 191  LEU   A HD22 
2037  H  HD23 . LEU   A  136 ? 0.52811921 0.47262424 0.39058658 -0.06365632 -0.03565368 -0.00772548 191  LEU   A HD23 
2038  N  N    . ARG   A  137 ? 0.36830473 0.33903784 0.24843448 -0.05369854 -0.01583016 -0.00299512 192  ARG   A N    
2039  C  CA   . ARG   A  137 ? 0.41903681 0.39636242 0.30802470 -0.05209041 -0.01337585 -0.00111443 192  ARG   A CA   
2040  C  C    . ARG   A  137 ? 0.35234153 0.33119482 0.24409641 -0.04760819 -0.00994105 -0.00489253 192  ARG   A C    
2041  O  O    . ARG   A  137 ? 0.34399235 0.32353997 0.24326222 -0.04506063 -0.01045134 -0.00464286 192  ARG   A O    
2042  C  CB   . ARG   A  137 ? 0.35693538 0.34072453 0.24548899 -0.05452441 -0.01107625 0.00198339  192  ARG   A CB   
2043  C  CG   . ARG   A  137 ? 0.40693164 0.39737755 0.30498338 -0.05398375 -0.00964895 0.00454742  192  ARG   A CG   
2044  C  CD   . ARG   A  137 ? 0.47286502 0.46859014 0.36916268 -0.05683670 -0.00708984 0.00708509  192  ARG   A CD   
2045  N  NE   . ARG   A  137 ? 0.72410339 0.72424889 0.61750966 -0.05581480 -0.00195204 0.00423530  192  ARG   A NE   
2046  C  CZ   . ARG   A  137 ? 0.68772602 0.69402170 0.58785558 -0.05274316 0.00143910  0.00201845  192  ARG   A CZ   
2047  N  NH1  . ARG   A  137 ? 0.72250307 0.73257309 0.63246125 -0.05141541 0.00052758  0.00347701  192  ARG   A NH1  
2048  N  NH2  . ARG   A  137 ? 0.75378919 0.76298231 0.65067679 -0.05087098 0.00584717  -0.00184953 192  ARG   A NH2  
2049  H  H    . ARG   A  137 ? 0.39856249 0.36972225 0.27356884 -0.05551020 -0.01567351 -0.00239387 192  ARG   A H    
2050  H  HA   . ARG   A  137 ? 0.37576783 0.35223871 0.26949883 -0.05238414 -0.01571510 0.00069629  192  ARG   A HA   
2051  H  HB2  . ARG   A  137 ? 0.38287222 0.36475778 0.26857945 -0.05696611 -0.01348448 0.00403341  192  ARG   A HB2  
2052  H  HB3  . ARG   A  137 ? 0.38960785 0.37490171 0.27382642 -0.05426737 -0.00819096 0.00023863  192  ARG   A HB3  
2053  H  HG2  . ARG   A  137 ? 0.40632793 0.39886874 0.30795774 -0.05128997 -0.00778275 0.00257951  192  ARG   A HG2  
2054  H  HG3  . ARG   A  137 ? 0.40043160 0.38944376 0.30201593 -0.05455288 -0.01238834 0.00647799  192  ARG   A HG3  
2055  H  HD2  . ARG   A  137 ? 0.49696606 0.49604413 0.39900246 -0.05723544 -0.00712308 0.00917040  192  ARG   A HD2  
2056  H  HD3  . ARG   A  137 ? 0.50192130 0.49471870 0.39310807 -0.05913381 -0.00887529 0.00860738  192  ARG   A HD3  
2057  H  HE   . ARG   A  137 ? 0.65326732 0.65224212 0.54017389 -0.05724214 -0.00102413 0.00389892  192  ARG   A HE   
2058  H  HH11 . ARG   A  137 ? 0.69988596 0.71061265 0.61195457 -0.05340187 -0.00089744 0.00631135  192  ARG   A HH11 
2059  H  HH12 . ARG   A  137 ? 0.70759904 0.71934235 0.62173784 -0.04845100 0.00124514  0.00154975  192  ARG   A HH12 
2060  H  HH21 . ARG   A  137 ? 0.73399562 0.74838674 0.63585532 -0.04887235 0.00830260  -0.00324015 192  ARG   A HH21 
2061  H  HH22 . ARG   A  137 ? 0.74077350 0.74686742 0.63057578 -0.05155111 0.00629531  -0.00312981 192  ARG   A HH22 
2062  N  N    . SER   A  138 ? 0.34706068 0.32614756 0.23246504 -0.04632074 -0.00660102 -0.00860102 193  SER   A N    
2063  C  CA   . SER   A  138 ? 0.37963492 0.36167461 0.26881239 -0.04146875 -0.00297774 -0.01236301 193  SER   A CA   
2064  C  C    . SER   A  138 ? 0.38033062 0.35374695 0.26851359 -0.03771414 -0.00496535 -0.01631331 193  SER   A C    
2065  O  O    . SER   A  138 ? 0.41814476 0.39297420 0.31207100 -0.03298118 -0.00353943 -0.01849151 193  SER   A O    
2066  C  CB   . SER   A  138 ? 0.45443836 0.44240844 0.33884501 -0.04129074 0.00251078  -0.01476467 193  SER   A CB   
2067  O  OG   . SER   A  138 ? 0.44138670 0.42313200 0.31516063 -0.04120655 0.00287799  -0.01862533 193  SER   A OG   
2068  H  H    . SER   A  138 ? 0.36250621 0.34007376 0.24133117 -0.04824134 -0.00658017 -0.00889205 193  SER   A H    
2069  H  HA   . SER   A  138 ? 0.37653461 0.36323988 0.27309644 -0.04064269 -0.00262798 -0.01050984 193  SER   A HA   
2070  H  HB2  . SER   A  138 ? 0.43116894 0.42393884 0.32066217 -0.03820255 0.00525509  -0.01649882 193  SER   A HB2  
2071  H  HB3  . SER   A  138 ? 0.42817831 0.42005646 0.31197605 -0.04440892 0.00325120  -0.01184380 193  SER   A HB3  
2073  N  N    . CYS   A  139 ? 0.37663260 0.34079957 0.25793397 -0.03977602 -0.00867036 -0.01716251 194  CYS   A N    
2074  C  CA   . CYS   A  139 ? 0.34336349 0.29786432 0.22313379 -0.03702207 -0.01096910 -0.02063103 194  CYS   A CA   
2075  C  C    . CYS   A  139 ? 0.39150310 0.34258240 0.27811232 -0.03744650 -0.01488275 -0.01742446 194  CYS   A C    
2076  O  O    . CYS   A  139 ? 0.33373815 0.27822942 0.22169632 -0.03423893 -0.01613241 -0.01944593 194  CYS   A O    
2077  C  CB   . CYS   A  139 ? 0.41154990 0.35718927 0.28075162 -0.03943279 -0.01337251 -0.02342262 194  CYS   A CB   
2078  S  SG   . CYS   A  139 ? 0.64541519 0.59286308 0.50363833 -0.03916844 -0.00909232 -0.02774534 194  CYS   A SG   
2079  H  H    . CYS   A  139 ? 0.36868060 0.33235279 0.24613066 -0.04301932 -0.00994775 -0.01557766 194  CYS   A H    
2080  H  HA   . CYS   A  139 ? 0.37539092 0.33094209 0.25634605 -0.03314724 -0.00843112 -0.02352075 194  CYS   A HA   
2081  H  HB2  . CYS   A  139 ? 0.42289251 0.36798131 0.29155058 -0.04306832 -0.01610777 -0.02065744 194  CYS   A HB2  
2082  H  HB3  . CYS   A  139 ? 0.43161726 0.37039390 0.30007392 -0.03777029 -0.01494110 -0.02565527 194  CYS   A HB3  
2083  N  N    . GLY   A  140 ? 0.35784644 0.31233698 0.24758050 -0.04155082 -0.01696130 -0.01259964 195  GLY   A N    
2084  C  CA   . GLY   A  140 ? 0.34936434 0.30074677 0.24426687 -0.04295984 -0.02054742 -0.00944462 195  GLY   A CA   
2085  C  C    . GLY   A  140 ? 0.32109517 0.27912283 0.22493887 -0.04122142 -0.01951379 -0.00637109 195  GLY   A C    
2086  O  O    . GLY   A  140 ? 0.29194233 0.25482523 0.19906953 -0.03736304 -0.01649069 -0.00786518 195  GLY   A O    
2087  H  H    . GLY   A  140 ? 0.36030573 0.31906247 0.24861784 -0.04353228 -0.01603330 -0.01127095 195  GLY   A H    
2088  H  HA2  . GLY   A  140 ? 0.35094649 0.29549414 0.24435635 -0.04181810 -0.02199062 -0.01128063 195  GLY   A HA2  
2089  H  HA3  . GLY   A  140 ? 0.34281892 0.29408917 0.23646984 -0.04644085 -0.02248958 -0.00751820 195  GLY   A HA3  
2090  N  N    . THR   A  141 ? 0.32067215 0.27913794 0.22841057 -0.04408646 -0.02209438 -0.00238486 196  THR   A N    
2091  C  CA   . THR   A  141 ? 0.28911805 0.25355735 0.20438917 -0.04340367 -0.02172652 0.00088018  196  THR   A CA   
2092  C  C    . THR   A  141 ? 0.32516742 0.29654014 0.24174970 -0.04684087 -0.02126805 0.00405510  196  THR   A C    
2093  O  O    . THR   A  141 ? 0.30305547 0.27260804 0.21689764 -0.05030380 -0.02331370 0.00535296  196  THR   A O    
2094  C  CB   . THR   A  141 ? 0.30098614 0.25969285 0.21869224 -0.04398742 -0.02486065 0.00281879  196  THR   A CB   
2095  O  OG1  . THR   A  141 ? 0.34320652 0.29440084 0.25932613 -0.04055726 -0.02548999 0.00017419  196  THR   A OG1  
2096  C  CG2  . THR   A  141 ? 0.41557235 0.37951139 0.33986261 -0.04373112 -0.02501859 0.00623882  196  THR   A CG2  
2097  H  H    . THR   A  141 ? 0.31461298 0.26958880 0.22012118 -0.04664297 -0.02420464 -0.00183822 196  THR   A H    
2098  H  HA   . THR   A  141 ? 0.30415264 0.27148944 0.22172880 -0.04035113 -0.01982074 -0.00033451 196  THR   A HA   
2099  H  HB   . THR   A  141 ? 0.32342672 0.27956101 0.23901644 -0.04704929 -0.02655208 0.00359928  196  THR   A HB   
2101  H  HG21 . THR   A  141 ? 0.37157711 0.33122540 0.29650736 -0.04372869 -0.02675282 0.00715663  196  THR   A HG21 
2102  H  HG22 . THR   A  141 ? 0.37031880 0.33816987 0.29721370 -0.04106074 -0.02340284 0.00556315  196  THR   A HG22 
2103  H  HG23 . THR   A  141 ? 0.36557409 0.33319175 0.29072484 -0.04627878 -0.02508098 0.00816017  196  THR   A HG23 
2104  N  N    . HIS   A  142 ? 0.29321459 0.27242854 0.21443093 -0.04583332 -0.01888314 0.00531955  197  HIS   A N    
2105  C  CA   . HIS   A  142 ? 0.28928718 0.27408129 0.21145028 -0.04895739 -0.01841005 0.00830868  197  HIS   A CA   
2106  C  C    . HIS   A  142 ? 0.33607900 0.32716063 0.26549953 -0.04832909 -0.01768379 0.01058076  197  HIS   A C    
2107  O  O    . HIS   A  142 ? 0.30060530 0.29411274 0.23425150 -0.04506577 -0.01660143 0.00935469  197  HIS   A O    
2108  C  CB   . HIS   A  142 ? 0.33318645 0.32081729 0.25023675 -0.04983027 -0.01563359 0.00699817  197  HIS   A CB   
2109  C  CG   . HIS   A  142 ? 0.43539065 0.43014544 0.35563982 -0.04766416 -0.01159959 0.00570284  197  HIS   A CG   
2110  N  ND1  . HIS   A  142 ? 0.45071867 0.44538754 0.37099513 -0.04369906 -0.00948695 0.00180200  197  HIS   A ND1  
2111  C  CD2  . HIS   A  142 ? 0.57251018 0.57480425 0.49623600 -0.04913946 -0.00939875 0.00769738  197  HIS   A CD2  
2112  C  CE1  . HIS   A  142 ? 0.40935767 0.41274542 0.33390182 -0.04271031 -0.00586499 0.00143408  197  HIS   A CE1  
2113  N  NE2  . HIS   A  142 ? 0.54178798 0.54991776 0.46835142 -0.04632552 -0.00569574 0.00503454  197  HIS   A NE2  
2114  H  H    . HIS   A  142 ? 0.30046666 0.28139645 0.22437391 -0.04312603 -0.01766829 0.00422952  197  HIS   A H    
2115  H  HA   . HIS   A  142 ? 0.30348366 0.28573170 0.22443283 -0.05113644 -0.02057108 0.00971989  197  HIS   A HA   
2116  H  HB2  . HIS   A  142 ? 0.34073073 0.32946196 0.25649664 -0.05239733 -0.01624748 0.00908668  197  HIS   A HB2  
2117  H  HB3  . HIS   A  142 ? 0.34834173 0.33188146 0.26070410 -0.04950494 -0.01592837 0.00486648  197  HIS   A HB3  
2119  H  HD2  . HIS   A  142 ? 0.52154213 0.52484530 0.44568142 -0.05164064 -0.01025201 0.01029052  197  HIS   A HD2  
2120  H  HE1  . HIS   A  142 ? 0.45028323 0.45621854 0.37634039 -0.03985174 -0.00369908 -0.00114804 197  HIS   A HE1  
2122  N  N    . ALA   A  143 ? 0.31867221 0.31181988 0.24939801 -0.05133041 -0.01878185 0.01374530  198  ALA   A N    
2123  C  CA   . ALA   A  143 ? 0.29523426 0.29424775 0.23154870 -0.05174641 -0.01816354 0.01591177  198  ALA   A CA   
2124  C  C    . ALA   A  143 ? 0.36805063 0.37184322 0.30282390 -0.05418195 -0.01589473 0.01692874  198  ALA   A C    
2125  O  O    . ALA   A  143 ? 0.31515855 0.31659114 0.24403319 -0.05615890 -0.01586154 0.01709115  198  ALA   A O    
2126  C  CB   . ALA   A  143 ? 0.25065595 0.24758080 0.18890445 -0.05336522 -0.02096469 0.01848262  198  ALA   A CB   
2127  H  H    . ALA   A  143 ? 0.31657341 0.30720985 0.24453239 -0.05317052 -0.02013859 0.01445504  198  ALA   A H    
2128  H  HA   . ALA   A  143 ? 0.30233932 0.30345902 0.24196592 -0.04945525 -0.01741425 0.01495780  198  ALA   A HA   
2129  H  HB1  . ALA   A  143 ? 0.25902486 0.25939083 0.20051475 -0.05371303 -0.02071177 0.01975277  198  ALA   A HB1  
2130  H  HB2  . ALA   A  143 ? 0.26241511 0.25621822 0.20125477 -0.05220714 -0.02220939 0.01805244  198  ALA   A HB2  
2131  H  HB3  . ALA   A  143 ? 0.26197505 0.25718492 0.19752178 -0.05525967 -0.02182279 0.01925297  198  ALA   A HB3  
2132  N  N    . PRO   A  144 ? 0.40049404 0.41097069 0.34013510 -0.05435985 -0.01405578 0.01768968  199  PRO   A N    
2133  C  CA   . PRO   A  144 ? 0.40620929 0.42049590 0.34407178 -0.05755002 -0.01193864 0.01913137  199  PRO   A CA   
2134  C  C    . PRO   A  144 ? 0.31722936 0.32714704 0.25144607 -0.06067983 -0.01437860 0.02198757  199  PRO   A C    
2135  O  O    . PRO   A  144 ? 0.29362875 0.30290690 0.22283641 -0.06326985 -0.01348455 0.02315556  199  PRO   A O    
2136  C  CB   . PRO   A  144 ? 0.35421422 0.37598985 0.29954100 -0.05751209 -0.01068221 0.01969606  199  PRO   A CB   
2137  C  CG   . PRO   A  144 ? 0.39027143 0.41313279 0.34055021 -0.05315533 -0.01130796 0.01756857  199  PRO   A CG   
2138  C  CD   . PRO   A  144 ? 0.32748860 0.34202045 0.27429834 -0.05180208 -0.01419863 0.01730114  199  PRO   A CD   
2139  H  HA   . PRO   A  144 ? 0.38286597 0.39790249 0.31745112 -0.05748285 -0.00983287 0.01772370  199  PRO   A HA   
2140  H  HB2  . PRO   A  144 ? 0.36900449 0.39021066 0.31568384 -0.05914026 -0.01228185 0.02167405  199  PRO   A HB2  
2141  H  HB3  . PRO   A  144 ? 0.37471634 0.40077990 0.31999400 -0.05863932 -0.00807660 0.01937468  199  PRO   A HB3  
2142  H  HG2  . PRO   A  144 ? 0.36289001 0.38869596 0.31788602 -0.05297141 -0.01215675 0.01841659  199  PRO   A HG2  
2143  H  HG3  . PRO   A  144 ? 0.37107340 0.39696053 0.32193521 -0.05146380 -0.00908141 0.01549715  199  PRO   A HG3  
2144  H  HD2  . PRO   A  144 ? 0.35240531 0.36534262 0.30090469 -0.05223601 -0.01630582 0.01881555  199  PRO   A HD2  
2145  H  HD3  . PRO   A  144 ? 0.35741097 0.37089422 0.30465746 -0.04904240 -0.01400380 0.01535072  199  PRO   A HD3  
2146  N  N    . TYR   A  145 ? 0.23468600 0.24176915 0.17148082 -0.06034701 -0.01741049 0.02317622  200  TYR   A N    
2147  C  CA   . TYR   A  145 ? 0.24487595 0.24814844 0.17922470 -0.06241123 -0.01988443 0.02535514  200  TYR   A CA   
2148  C  C    . TYR   A  145 ? 0.24646063 0.24719982 0.18383144 -0.06119711 -0.02249563 0.02548586  200  TYR   A C    
2149  O  O    . TYR   A  145 ? 0.30632398 0.30796373 0.24724957 -0.05926908 -0.02244306 0.02453630  200  TYR   A O    
2150  C  CB   . TYR   A  145 ? 0.30040464 0.30562440 0.23539639 -0.06508736 -0.01945934 0.02774002  200  TYR   A CB   
2151  C  CG   . TYR   A  145 ? 0.26896179 0.27780950 0.21026266 -0.06494134 -0.01952882 0.02824621  200  TYR   A CG   
2152  C  CD1  . TYR   A  145 ? 0.35641608 0.36301598 0.29995593 -0.06463648 -0.02205942 0.02914380  200  TYR   A CD1  
2153  C  CD2  . TYR   A  145 ? 0.32024720 0.33531874 0.26539797 -0.06503271 -0.01708888 0.02756418  200  TYR   A CD2  
2154  C  CE1  . TYR   A  145 ? 0.38500705 0.39445567 0.33330858 -0.06460367 -0.02244262 0.02949115  200  TYR   A CE1  
2155  C  CE2  . TYR   A  145 ? 0.33868426 0.35734767 0.28967503 -0.06491696 -0.01776500 0.02791715  200  TYR   A CE2  
2156  C  CZ   . TYR   A  145 ? 0.45156652 0.46689218 0.40357611 -0.06474598 -0.02059970 0.02892797  200  TYR   A CZ   
2157  O  OH   . TYR   A  145 ? 0.44522673 0.46325931 0.40184703 -0.06475439 -0.02172721 0.02925111  200  TYR   A OH   
2158  H  H    . TYR   A  145 ? 0.25302047 0.26068223 0.19319585 -0.05867977 -0.01790971 0.02257817  200  TYR   A H    
2159  H  HA   . TYR   A  145 ? 0.25628081 0.25701603 0.18618722 -0.06290178 -0.02022062 0.02509000  200  TYR   A HA   
2160  H  HB2  . TYR   A  145 ? 0.28033641 0.28235546 0.21316426 -0.06601074 -0.02122727 0.02897988  200  TYR   A HB2  
2161  H  HB3  . TYR   A  145 ? 0.28358352 0.29051825 0.21642186 -0.06620636 -0.01749053 0.02772064  200  TYR   A HB3  
2162  H  HD1  . TYR   A  145 ? 0.33870336 0.34199873 0.28038597 -0.06452486 -0.02354911 0.02944884  200  TYR   A HD1  
2163  H  HD2  . TYR   A  145 ? 0.31630582 0.33353665 0.26017055 -0.06516692 -0.01497826 0.02672800  200  TYR   A HD2  
2164  H  HE1  . TYR   A  145 ? 0.38749212 0.39521927 0.33661413 -0.06443892 -0.02399204 0.02996849  200  TYR   A HE1  
2165  H  HE2  . TYR   A  145 ? 0.35589123 0.37948972 0.31009319 -0.06499234 -0.01631073 0.02737437  200  TYR   A HE2  
2167  N  N    . MET   A  146 ? 0.21981877 0.21736783 0.15541489 -0.06231575 -0.02478242 0.02667405  201  MET   A N    
2168  C  CA   . MET   A  146 ? 0.21793662 0.21383533 0.15619980 -0.06185123 -0.02684595 0.02697291  201  MET   A CA   
2169  C  C    . MET   A  146 ? 0.23506334 0.23098609 0.17422111 -0.06309190 -0.02800692 0.02886942  201  MET   A C    
2170  O  O    . MET   A  146 ? 0.23839262 0.23290594 0.17441398 -0.06419253 -0.02869084 0.02987131  201  MET   A O    
2171  C  CB   . MET   A  146 ? 0.19942269 0.19217110 0.13544483 -0.06175046 -0.02842023 0.02588650  201  MET   A CB   
2172  C  CG   . MET   A  146 ? 0.25439182 0.24635077 0.19356556 -0.06185536 -0.03005864 0.02624542  201  MET   A CG   
2173  S  SD   . MET   A  146 ? 0.27003902 0.25936764 0.20786637 -0.06266168 -0.03205640 0.02500233  201  MET   A SD   
2174  C  CE   . MET   A  146 ? 0.25281242 0.24271375 0.18828076 -0.06348046 -0.03393396 0.02592540  201  MET   A CE   
2175  H  H    . MET   A  146 ? 0.22895208 0.22550921 0.16149861 -0.06340124 -0.02501143 0.02731103  201  MET   A H    
2176  H  HA   . MET   A  146 ? 0.21602497 0.21293120 0.15692964 -0.06089996 -0.02641992 0.02661880  201  MET   A HA   
2177  H  HB2  . MET   A  146 ? 0.21762881 0.20965719 0.15263380 -0.06094922 -0.02767204 0.02452533  201  MET   A HB2  
2178  H  HB3  . MET   A  146 ? 0.21773072 0.20965266 0.15107159 -0.06254084 -0.02915066 0.02622343  201  MET   A HB3  
2179  H  HG2  . MET   A  146 ? 0.23868980 0.23149385 0.17896914 -0.06231906 -0.03064332 0.02730860  201  MET   A HG2  
2180  H  HG3  . MET   A  146 ? 0.23913047 0.23135859 0.18018144 -0.06116055 -0.02945516 0.02611270  201  MET   A HG3  
2181  H  HE1  . MET   A  146 ? 0.26107335 0.25014487 0.19313705 -0.06351601 -0.03351222 0.02563812  201  MET   A HE1  
2182  H  HE2  . MET   A  146 ? 0.25555789 0.24654680 0.19244489 -0.06336526 -0.03388447 0.02707109  201  MET   A HE2  
2183  H  HE3  . MET   A  146 ? 0.25931162 0.24907258 0.19533421 -0.06397606 -0.03551684 0.02554389  201  MET   A HE3  
2184  N  N    . ARG   A  147 ? 0.24599150 0.24281406 0.18882500 -0.06277312 -0.02842176 0.02931549  202  ARG   A N    
2185  C  CA   . ARG   A  147 ? 0.22908649 0.22542539 0.17267938 -0.06360564 -0.02942274 0.03059220  202  ARG   A CA   
2186  C  C    . ARG   A  147 ? 0.20193693 0.19658969 0.14584288 -0.06318849 -0.03126242 0.03050118  202  ARG   A C    
2187  O  O    . ARG   A  147 ? 0.23998556 0.23495813 0.18569648 -0.06264540 -0.03146707 0.02973161  202  ARG   A O    
2188  C  CB   . ARG   A  147 ? 0.23787393 0.23608358 0.18469030 -0.06355360 -0.02904878 0.03080110  202  ARG   A CB   
2189  C  CG   . ARG   A  147 ? 0.28145766 0.27835006 0.22864898 -0.06428511 -0.03014569 0.03160151  202  ARG   A CG   
2190  C  CD   . ARG   A  147 ? 0.33326417 0.33203590 0.28258067 -0.06493597 -0.02986994 0.03176995  202  ARG   A CD   
2191  N  NE   . ARG   A  147 ? 0.55240262 0.55319297 0.50382549 -0.06372911 -0.02964444 0.03112504  202  ARG   A NE   
2192  C  CZ   . ARG   A  147 ? 0.64478600 0.64864588 0.59798545 -0.06321336 -0.02882397 0.03080024  202  ARG   A CZ   
2193  N  NH1  . ARG   A  147 ? 0.56703520 0.57372928 0.52102995 -0.06438586 -0.02772713 0.03098003  202  ARG   A NH1  
2194  N  NH2  . ARG   A  147 ? 0.56831563 0.57243097 0.52256912 -0.06147559 -0.02909955 0.03029344  202  ARG   A NH2  
2195  H  H    . ARG   A  147 ? 0.23718017 0.23450692 0.18165462 -0.06195842 -0.02816015 0.02875520  202  ARG   A H    
2196  H  HA   . ARG   A  147 ? 0.23169407 0.22757170 0.17336965 -0.06451721 -0.02923764 0.03130594  202  ARG   A HA   
2197  H  HB2  . ARG   A  147 ? 0.24462414 0.24472594 0.19192833 -0.06387815 -0.02801429 0.03081588  202  ARG   A HB2  
2198  H  HB3  . ARG   A  147 ? 0.24290542 0.24125272 0.19094725 -0.06269319 -0.02917371 0.03026601  202  ARG   A HB3  
2199  H  HG2  . ARG   A  147 ? 0.27963698 0.27568331 0.22733524 -0.06362630 -0.03087653 0.03127990  202  ARG   A HG2  
2200  H  HG3  . ARG   A  147 ? 0.28304788 0.27851486 0.22840522 -0.06502534 -0.03045607 0.03224697  202  ARG   A HG3  
2201  H  HD2  . ARG   A  147 ? 0.36211580 0.35941213 0.31130141 -0.06519726 -0.03067566 0.03191589  202  ARG   A HD2  
2202  H  HD3  . ARG   A  147 ? 0.36563408 0.36553437 0.31479433 -0.06601310 -0.02920727 0.03217554  202  ARG   A HD3  
2203  H  HE   . ARG   A  147 ? 0.50417411 0.50404227 0.45566121 -0.06320083 -0.03013645 0.03094684  202  ARG   A HE   
2204  H  HH11 . ARG   A  147 ? 0.58548206 0.59225631 0.53944778 -0.06582754 -0.02790078 0.03151623  202  ARG   A HH11 
2205  H  HH12 . ARG   A  147 ? 0.58936489 0.59784025 0.54385495 -0.06381778 -0.02673121 0.03050376  202  ARG   A HH12 
2206  H  HH21 . ARG   A  147 ? 0.59066546 0.59591252 0.54557246 -0.06054669 -0.02853545 0.02981250  202  ARG   A HH21 
2207  H  HH22 . ARG   A  147 ? 0.58823526 0.59111571 0.54226661 -0.06124046 -0.02984251 0.03044780  202  ARG   A HH22 
2208  N  N    . PRO   A  148 ? 0.23324180 0.22615516 0.17559008 -0.06345835 -0.03268462 0.03134343  203  PRO   A N    
2209  C  CA   . PRO   A  148 ? 0.25407937 0.24660107 0.19793324 -0.06257870 -0.03454128 0.03103244  203  PRO   A CA   
2210  C  C    . PRO   A  148 ? 0.24068391 0.23383161 0.18750550 -0.06203458 -0.03442158 0.03083486  203  PRO   A C    
2211  O  O    . PRO   A  148 ? 0.29721200 0.29032761 0.24417746 -0.06256721 -0.03342350 0.03117039  203  PRO   A O    
2212  C  CB   . PRO   A  148 ? 0.30273545 0.29253301 0.24326846 -0.06258886 -0.03634876 0.03215020  203  PRO   A CB   
2213  C  CG   . PRO   A  148 ? 0.31439048 0.30269811 0.25254509 -0.06402906 -0.03500323 0.03344145  203  PRO   A CG   
2214  C  CD   . PRO   A  148 ? 0.31189847 0.30303609 0.25080472 -0.06461796 -0.03263299 0.03269123  203  PRO   A CD   
2215  H  HA   . PRO   A  148 ? 0.25427127 0.24762964 0.19879363 -0.06242608 -0.03476555 0.03025517  203  PRO   A HA   
2216  H  HB2  . PRO   A  148 ? 0.29316729 0.28246862 0.23498893 -0.06167460 -0.03770036 0.03215396  203  PRO   A HB2  
2217  H  HB3  . PRO   A  148 ? 0.29524118 0.28473106 0.23377831 -0.06274039 -0.03691699 0.03203050  203  PRO   A HB3  
2218  H  HG2  . PRO   A  148 ? 0.31001484 0.29782197 0.24958092 -0.06396417 -0.03508857 0.03361585  203  PRO   A HG2  
2219  H  HG3  . PRO   A  148 ? 0.31529927 0.30143183 0.25010380 -0.06462068 -0.03564981 0.03443014  203  PRO   A HG3  
2220  H  HD2  . PRO   A  148 ? 0.29052725 0.28240281 0.23014207 -0.06534901 -0.03162307 0.03306141  203  PRO   A HD2  
2221  H  HD3  . PRO   A  148 ? 0.29398540 0.28494662 0.23039931 -0.06499151 -0.03221174 0.03264884  203  PRO   A HD3  
2222  N  N    . VAL   A  149 ? 0.23632506 0.23051009 0.18556599 -0.06102690 -0.03542202 0.03007668  204  VAL   A N    
2223  C  CA   . VAL   A  149 ? 0.24534231 0.23992774 0.19670302 -0.06020708 -0.03521829 0.02952811  204  VAL   A CA   
2224  C  C    . VAL   A  149 ? 0.23905233 0.23061979 0.18923408 -0.05911681 -0.03689819 0.02997449  204  VAL   A C    
2225  O  O    . VAL   A  149 ? 0.24069579 0.23045284 0.18905042 -0.05870848 -0.03868113 0.03074494  204  VAL   A O    
2226  C  CB   . VAL   A  149 ? 0.27557912 0.27359581 0.23055093 -0.05965184 -0.03489388 0.02820234  204  VAL   A CB   
2227  C  CG1  . VAL   A  149 ? 0.28975484 0.28917325 0.24507408 -0.06102476 -0.03323503 0.02804197  204  VAL   A CG1  
2228  C  CG2  . VAL   A  149 ? 0.34390232 0.34352535 0.30050632 -0.05891333 -0.03679131 0.02778438  204  VAL   A CG2  
2229  H  H    . VAL   A  149 ? 0.24124011 0.23617129 0.19087441 -0.06085584 -0.03620433 0.02972648  204  VAL   A H    
2230  H  HA   . VAL   A  149 ? 0.24576065 0.24018739 0.19676937 -0.06078871 -0.03418805 0.02966064  204  VAL   A HA   
2231  H  HB   . VAL   A  149 ? 0.28234240 0.28056931 0.23833121 -0.05886469 -0.03466585 0.02765541  204  VAL   A HB   
2232  H  HG11 . VAL   A  149 ? 0.28503817 0.28385961 0.23925857 -0.06159418 -0.03343477 0.02833296  204  VAL   A HG11 
2233  H  HG12 . VAL   A  149 ? 0.28440467 0.28301895 0.23880526 -0.06125385 -0.03242007 0.02831252  204  VAL   A HG12 
2234  H  HG13 . VAL   A  149 ? 0.28431079 0.28586036 0.24168636 -0.06114524 -0.03285499 0.02735369  204  VAL   A HG13 
2235  H  HG21 . VAL   A  149 ? 0.31949532 0.32194862 0.27912551 -0.05851946 -0.03655626 0.02683390  204  VAL   A HG21 
2236  H  HG22 . VAL   A  149 ? 0.32250002 0.32032266 0.27805185 -0.05793132 -0.03821222 0.02821270  204  VAL   A HG22 
2237  H  HG23 . VAL   A  149 ? 0.31983593 0.31944019 0.27541450 -0.05985418 -0.03691204 0.02798571  204  VAL   A HG23 
2238  N  N    . TYR   A  150 ? 0.19426584 0.18459353 0.14486982 -0.05860639 -0.03656430 0.02945340  205  TYR   A N    
2239  C  CA   . TYR   A  150 ? 0.23776208 0.22415160 0.18728931 -0.05717762 -0.03827707 0.02947045  205  TYR   A CA   
2240  C  C    . TYR   A  150 ? 0.21486542 0.20355400 0.16803564 -0.05441973 -0.03907874 0.02776127  205  TYR   A C    
2241  O  O    . TYR   A  150 ? 0.23016047 0.22339347 0.18649188 -0.05427231 -0.03740782 0.02633358  205  TYR   A O    
2242  C  CB   . TYR   A  150 ? 0.23328266 0.21693009 0.18140163 -0.05794512 -0.03762080 0.02917695  205  TYR   A CB   
2243  C  CG   . TYR   A  150 ? 0.22114512 0.19896981 0.16724385 -0.05672907 -0.03950907 0.02915187  205  TYR   A CG   
2244  C  CD1  . TYR   A  150 ? 0.29744646 0.26997584 0.23962119 -0.05811503 -0.04093383 0.03117453  205  TYR   A CD1  
2245  C  CD2  . TYR   A  150 ? 0.24589676 0.22295234 0.19348976 -0.05426402 -0.03977032 0.02707337  205  TYR   A CD2  
2246  C  CE1  . TYR   A  150 ? 0.23284382 0.19842246 0.17237897 -0.05712238 -0.04299751 0.03138719  205  TYR   A CE1  
2247  C  CE2  . TYR   A  150 ? 0.28060585 0.25111639 0.22598761 -0.05275442 -0.04172868 0.02679816  205  TYR   A CE2  
2248  C  CZ   . TYR   A  150 ? 0.25149509 0.21572582 0.19271208 -0.05420939 -0.04357039 0.02910161  205  TYR   A CZ   
2249  O  OH   . TYR   A  150 ? 0.26368886 0.22007722 0.20218980 -0.05260362 -0.04585579 0.02894107  205  TYR   A OH   
2250  H  HA   . TYR   A  150 ? 0.22725518 0.21115670 0.17451528 -0.05749565 -0.03943971 0.03066427  205  TYR   A HA   
2251  H  HB2  . TYR   A  150 ? 0.22959140 0.21299517 0.17632164 -0.05978751 -0.03700536 0.03011146  205  TYR   A HB2  
2252  H  HB3  . TYR   A  150 ? 0.22824217 0.21412545 0.17799009 -0.05755615 -0.03656637 0.02798854  205  TYR   A HB3  
2253  H  HD1  . TYR   A  150 ? 0.25914192 0.23252504 0.20014368 -0.05978720 -0.04044874 0.03242380  205  TYR   A HD1  
2254  H  HD2  . TYR   A  150 ? 0.24348366 0.22424209 0.19336225 -0.05362402 -0.03850229 0.02574814  205  TYR   A HD2  
2255  H  HE1  . TYR   A  150 ? 0.25542510 0.21692911 0.19176172 -0.05843925 -0.04393792 0.03303406  205  TYR   A HE1  
2256  H  HE2  . TYR   A  150 ? 0.26658732 0.23663718 0.21306215 -0.05070430 -0.04179473 0.02503284  205  TYR   A HE2  
2258  N  N    . PRO   A  151 ? 0.25168374 0.23777732 0.20471241 -0.05216129 -0.04165230 0.02788661  206  PRO   A N    
2259  C  CA   . PRO   A  151 ? 0.25586325 0.23624885 0.20422480 -0.05270136 -0.04384064 0.03007506  206  PRO   A CA   
2260  C  C    . PRO   A  151 ? 0.26471567 0.24663047 0.21135543 -0.05424250 -0.04426005 0.03142879  206  PRO   A C    
2261  O  O    . PRO   A  151 ? 0.28635246 0.27312961 0.23612484 -0.05378512 -0.04435032 0.03048910  206  PRO   A O    
2262  C  CB   . PRO   A  151 ? 0.26001370 0.23745313 0.20917217 -0.04905483 -0.04692080 0.02957750  206  PRO   A CB   
2263  C  CG   . PRO   A  151 ? 0.30067331 0.28491008 0.25630823 -0.04661237 -0.04632118 0.02701163  206  PRO   A CG   
2264  C  CD   . PRO   A  151 ? 0.27172649 0.26043311 0.22911929 -0.04879361 -0.04259966 0.02588418  206  PRO   A CD   
2265  H  HA   . PRO   A  151 ? 0.25846359 0.23556696 0.20416321 -0.05415943 -0.04325470 0.03081441  206  PRO   A HA   
2266  H  HB2  . PRO   A  151 ? 0.27300832 0.24869445 0.22023307 -0.04882370 -0.04888942 0.03086076  206  PRO   A HB2  
2267  H  HB3  . PRO   A  151 ? 0.27351823 0.24641113 0.22079480 -0.04862873 -0.04730831 0.02960393  206  PRO   A HB3  
2268  H  HG2  . PRO   A  151 ? 0.28334984 0.27066043 0.24077871 -0.04619324 -0.04740947 0.02709992  206  PRO   A HG2  
2269  H  HG3  . PRO   A  151 ? 0.28724191 0.27000731 0.24409470 -0.04408494 -0.04726069 0.02591847  206  PRO   A HG3  
2270  H  HD2  . PRO   A  151 ? 0.26857054 0.26235130 0.22922555 -0.04885250 -0.04186830 0.02509675  206  PRO   A HD2  
2271  H  HD3  . PRO   A  151 ? 0.27274311 0.26062763 0.23049966 -0.04796644 -0.04174270 0.02470514  206  PRO   A HD3  
2272  N  N    . THR   A  152 ? 0.21255276 0.19013315 0.15385593 -0.05632115 -0.04446183 0.03352668  207  THR   A N    
2273  C  CA   . THR   A  152 ? 0.19849950 0.17703348 0.13694482 -0.05799418 -0.04429344 0.03456035  207  THR   A CA   
2274  C  C    . THR   A  152 ? 0.23881242 0.21499799 0.17497538 -0.05634237 -0.04786038 0.03541958  207  THR   A C    
2275  O  O    . THR   A  152 ? 0.21563950 0.18685065 0.14566277 -0.05743054 -0.04914321 0.03754031  207  THR   A O    
2276  C  CB   . THR   A  152 ? 0.25131497 0.22752579 0.18556190 -0.06101740 -0.04232095 0.03609544  207  THR   A CB   
2277  O  OG1  . THR   A  152 ? 0.22022909 0.19019046 0.15098807 -0.06143286 -0.04366086 0.03765031  207  THR   A OG1  
2278  C  CG2  . THR   A  152 ? 0.25442186 0.23442355 0.19168210 -0.06228419 -0.03936962 0.03506169  207  THR   A CG2  
2279  H  H    . THR   A  152 ? 0.22405861 0.19790930 0.16324770 -0.05684380 -0.04459243 0.03423713  207  THR   A H    
2280  H  HA   . THR   A  152 ? 0.21205841 0.19465429 0.15311641 -0.05814795 -0.04316466 0.03346459  207  THR   A HA   
2281  H  HB   . THR   A  152 ? 0.23558965 0.21187985 0.16716811 -0.06191339 -0.04226410 0.03674630  207  THR   A HB   
2283  H  HG21 . THR   A  152 ? 0.25292811 0.23264822 0.18817118 -0.06411069 -0.03814220 0.03588147  207  THR   A HG21 
2284  H  HG22 . THR   A  152 ? 0.25106406 0.23037335 0.18988679 -0.06180258 -0.03940020 0.03457230  207  THR   A HG22 
2285  H  HG23 . THR   A  152 ? 0.24856502 0.23192525 0.18810602 -0.06176742 -0.03874990 0.03402331  207  THR   A HG23 
2286  N  N    . LYS   A  153 ? 0.26474088 0.24475108 0.20602795 -0.05372682 -0.04952346 0.03376748  208  LYS   A N    
2287  C  CA   . LYS   A  153 ? 0.27181819 0.25179085 0.21319646 -0.05151629 -0.05343860 0.03395204  208  LYS   A CA   
2288  C  C    . LYS   A  153 ? 0.27587038 0.26243410 0.22074702 -0.05222368 -0.05330132 0.03243430  208  LYS   A C    
2289  O  O    . LYS   A  153 ? 0.23311272 0.22388843 0.18121175 -0.05375638 -0.05025969 0.03108193  208  LYS   A O    
2290  C  CB   . LYS   A  153 ? 0.29880822 0.27917248 0.24495606 -0.04764060 -0.05552658 0.03273470  208  LYS   A CB   
2291  C  CG   . LYS   A  153 ? 0.31082064 0.28376496 0.25381929 -0.04652113 -0.05612244 0.03370946  208  LYS   A CG   
2292  C  CD   . LYS   A  153 ? 0.38408130 0.34908998 0.32017055 -0.04622957 -0.05953665 0.03640524  208  LYS   A CD   
2293  C  CE   . LYS   A  153 ? 0.36488950 0.32235295 0.29925337 -0.04399050 -0.06123581 0.03682470  208  LYS   A CE   
2294  N  NZ   . LYS   A  153 ? 0.51951540 0.46803665 0.44604638 -0.04401433 -0.06486999 0.03997612  208  LYS   A NZ   
2295  H  H    . LYS   A  153 ? 0.25342697 0.23678273 0.19866054 -0.05337853 -0.04809491 0.03237307  208  LYS   A H    
2296  H  HA   . LYS   A  153 ? 0.28135729 0.25692138 0.21746647 -0.05211879 -0.05487249 0.03570307  208  LYS   A HA   
2297  H  HB2  . LYS   A  153 ? 0.28907615 0.27429470 0.24018012 -0.04731674 -0.05378060 0.03095192  208  LYS   A HB2  
2298  H  HB3  . LYS   A  153 ? 0.29651991 0.27759075 0.24334513 -0.04597011 -0.05840193 0.03279192  208  LYS   A HB3  
2299  H  HG2  . LYS   A  153 ? 0.32045650 0.29237700 0.26202312 -0.04866203 -0.05359350 0.03392793  208  LYS   A HG2  
2300  H  HG3  . LYS   A  153 ? 0.32311171 0.29747108 0.27014571 -0.04391892 -0.05663664 0.03217065  208  LYS   A HG3  
2301  H  HD2  . LYS   A  153 ? 0.36317769 0.32964274 0.29991853 -0.04467312 -0.06214067 0.03646258  208  LYS   A HD2  
2302  H  HD3  . LYS   A  153 ? 0.36279637 0.32560667 0.29423425 -0.04916598 -0.05827266 0.03794317  208  LYS   A HD3  
2303  H  HE2  . LYS   A  153 ? 0.39853579 0.35441262 0.33203280 -0.04579648 -0.05887980 0.03672539  208  LYS   A HE2  
2304  H  HE3  . LYS   A  153 ? 0.39902383 0.35885531 0.33814201 -0.04072769 -0.06234295 0.03503473  208  LYS   A HE3  
2305  H  HZ1  . LYS   A  153 ? 0.46690720 0.41363394 0.38898802 -0.04720545 -0.06352635 0.04156966  208  LYS   A HZ1  
2306  H  HZ2  . LYS   A  153 ? 0.46781701 0.41773009 0.39498776 -0.04219019 -0.06740842 0.04007681  208  LYS   A HZ2  
2307  H  HZ3  . LYS   A  153 ? 0.47192371 0.41495749 0.39702460 -0.04271327 -0.06606579 0.04030070  208  LYS   A HZ3  
2308  N  N    . THR   A  154 ? 0.21003248 0.19703153 0.15414251 -0.05109744 -0.05703657 0.03267641  209  THR   A N    
2309  C  CA   . THR   A  154 ? 0.20562921 0.19775546 0.15185118 -0.05230605 -0.05768255 0.03134234  209  THR   A CA   
2310  C  C    . THR   A  154 ? 0.21089722 0.21084151 0.16598251 -0.05203663 -0.05643925 0.02886444  209  THR   A C    
2311  O  O    . THR   A  154 ? 0.25033706 0.25280330 0.20646685 -0.05456396 -0.05380236 0.02791838  209  THR   A O    
2312  C  CB   . THR   A  154 ? 0.28337312 0.27459025 0.22734976 -0.05083036 -0.06281784 0.03201804  209  THR   A CB   
2313  O  OG1  . THR   A  154 ? 0.26491320 0.24813549 0.19927077 -0.05170591 -0.06349005 0.03467941  209  THR   A OG1  
2314  C  CG2  . THR   A  154 ? 0.30477208 0.30057430 0.25004870 -0.05251592 -0.06407230 0.03055469  209  THR   A CG2  
2315  H  H    . THR   A  154 ? 0.22960392 0.21325523 0.17156982 -0.04957666 -0.05952172 0.03372132  209  THR   A H    
2316  H  HA   . THR   A  154 ? 0.21897858 0.20989910 0.16176146 -0.05450243 -0.05583224 0.03162285  209  THR   A HA   
2317  H  HB   . THR   A  154 ? 0.26670447 0.25925830 0.21449447 -0.04822161 -0.06486428 0.03167523  209  THR   A HB   
2319  H  HG21 . THR   A  154 ? 0.30309600 0.29745543 0.24549717 -0.05182196 -0.06750577 0.03122360  209  THR   A HG21 
2320  H  HG22 . THR   A  154 ? 0.29674211 0.29137474 0.23892036 -0.05479954 -0.06172418 0.03048112  209  THR   A HG22 
2321  H  HG23 . THR   A  154 ? 0.29414380 0.29540393 0.24606274 -0.05209420 -0.06388842 0.02894850  209  THR   A HG23 
2322  N  N    . PHE   A  155 ? 0.26482219 0.26847482 0.22612077 -0.04897965 -0.05829806 0.02779303  210  PHE   A N    
2323  C  CA   . PHE   A  155 ? 0.21826163 0.23058005 0.18820260 -0.04916466 -0.05709299 0.02538955  210  PHE   A CA   
2324  C  C    . PHE   A  155 ? 0.21100143 0.22433370 0.18221107 -0.05108496 -0.05205806 0.02472813  210  PHE   A C    
2325  O  O    . PHE   A  155 ? 0.23838463 0.25570506 0.21207571 -0.05378627 -0.05001600 0.02377219  210  PHE   A O    
2326  C  CB   . PHE   A  155 ? 0.27220380 0.28968978 0.24940604 -0.04519937 -0.05982232 0.02396978  210  PHE   A CB   
2327  C  CG   . PHE   A  155 ? 0.33576643 0.35736167 0.31567472 -0.04426143 -0.06479578 0.02357013  210  PHE   A CG   
2328  C  CD1  . PHE   A  155 ? 0.46571171 0.48195639 0.43801856 -0.04543748 -0.06803749 0.02537546  210  PHE   A CD1  
2329  C  CD2  . PHE   A  155 ? 0.57610554 0.60708803 0.56593388 -0.04210215 -0.06636409 0.02131942  210  PHE   A CD2  
2330  C  CE1  . PHE   A  155 ? 0.35041383 0.37016988 0.32452315 -0.04460195 -0.07323039 0.02498724  210  PHE   A CE1  
2331  C  CE2  . PHE   A  155 ? 0.77007967 0.80552912 0.76295936 -0.04123993 -0.07152089 0.02087435  210  PHE   A CE2  
2332  C  CZ   . PHE   A  155 ? 0.48220775 0.51165223 0.46686274 -0.04253876 -0.07516780 0.02276615  210  PHE   A CZ   
2333  H  H    . PHE   A  155 ? 0.24453261 0.24537805 0.20473994 -0.04681882 -0.06019004 0.02850437  210  PHE   A H    
2334  H  HA   . PHE   A  155 ? 0.23506287 0.24943934 0.20506945 -0.05097052 -0.05788516 0.02505470  210  PHE   A HA   
2335  H  HB2  . PHE   A  155 ? 0.27207676 0.28532872 0.24721850 -0.04289334 -0.06066624 0.02469548  210  PHE   A HB2  
2336  H  HB3  . PHE   A  155 ? 0.26566881 0.28823465 0.24816056 -0.04533906 -0.05752470 0.02242408  210  PHE   A HB3  
2337  H  HD1  . PHE   A  155 ? 0.40231398 0.41282219 0.36814684 -0.04690401 -0.06671687 0.02677658  210  PHE   A HD1  
2338  H  HD2  . PHE   A  155 ? 0.52210587 0.55700397 0.51682508 -0.04133842 -0.06391422 0.01995863  210  PHE   A HD2  
2339  H  HE1  . PHE   A  155 ? 0.40893322 0.42477205 0.37709227 -0.04555130 -0.07532451 0.02614989  210  PHE   A HE1  
2340  H  HE2  . PHE   A  155 ? 0.63099021 0.67386019 0.63151908 -0.03983342 -0.07251713 0.01918494  210  PHE   A HE2  
2341  H  HZ   . PHE   A  155 ? 0.49675763 0.52907300 0.48309815 -0.04196453 -0.07895662 0.02243854  210  PHE   A HZ   
2342  N  N    . PRO   A  156 ? 0.18513632 0.19436766 0.15413301 -0.05008323 -0.05009399 0.02528713  211  PRO   A N    
2343  C  CA   . PRO   A  156 ? 0.20823677 0.21797678 0.17730498 -0.05212375 -0.04583541 0.02487837  211  PRO   A CA   
2344  C  C    . PRO   A  156 ? 0.17190336 0.17991661 0.13710088 -0.05551283 -0.04424809 0.02572072  211  PRO   A C    
2345  O  O    . PRO   A  156 ? 0.22910322 0.23981240 0.19620007 -0.05747487 -0.04185160 0.02501189  211  PRO   A O    
2346  C  CB   . PRO   A  156 ? 0.21140747 0.21564151 0.17727390 -0.05057219 -0.04525217 0.02557280  211  PRO   A CB   
2347  C  CG   . PRO   A  156 ? 0.18584004 0.18914974 0.15334886 -0.04682053 -0.04875034 0.02529651  211  PRO   A CG   
2348  C  CD   . PRO   A  156 ? 0.20329367 0.20716831 0.16981496 -0.04706321 -0.05204751 0.02616521  211  PRO   A CD   
2349  H  HA   . PRO   A  156 ? 0.19400348 0.20857888 0.16775297 -0.05196780 -0.04469720 0.02348393  211  PRO   A HA   
2350  H  HB2  . PRO   A  156 ? 0.20442314 0.20446202 0.16572131 -0.05181010 -0.04510923 0.02696296  211  PRO   A HB2  
2351  H  HB3  . PRO   A  156 ? 0.20160413 0.20721680 0.16904289 -0.05068086 -0.04307857 0.02470373  211  PRO   A HB3  
2352  H  HG2  . PRO   A  156 ? 0.19844358 0.19648013 0.16251384 -0.04603262 -0.04930937 0.02619002  211  PRO   A HG2  
2353  H  HG3  . PRO   A  156 ? 0.19440055 0.20191279 0.16677728 -0.04516044 -0.04836809 0.02363037  211  PRO   A HG3  
2354  H  HD2  . PRO   A  156 ? 0.19966465 0.19847625 0.16077986 -0.04784460 -0.05292447 0.02782923  211  PRO   A HD2  
2355  H  HD3  . PRO   A  156 ? 0.19940349 0.20522273 0.16898218 -0.04462969 -0.05446265 0.02553242  211  PRO   A HD3  
2356  N  N    . ASN   A  157 ? 0.20478842 0.20795290 0.16412786 -0.05616076 -0.04551010 0.02720870  212  ASN   A N    
2357  C  CA   . ASN   A  157 ? 0.20960319 0.21105340 0.16533440 -0.05868351 -0.04379375 0.02756863  212  ASN   A CA   
2358  C  C    . ASN   A  157 ? 0.20843661 0.21251936 0.16540059 -0.06027802 -0.04476542 0.02648818  212  ASN   A C    
2359  O  O    . ASN   A  157 ? 0.22493041 0.22904122 0.18170908 -0.06218496 -0.04277997 0.02598017  212  ASN   A O    
2360  C  CB   . ASN   A  157 ? 0.19717813 0.19331065 0.14626472 -0.05907251 -0.04388716 0.02919963  212  ASN   A CB   
2361  C  CG   . ASN   A  157 ? 0.23306414 0.22710344 0.18128890 -0.05911987 -0.04161644 0.02997299  212  ASN   A CG   
2362  O  OD1  . ASN   A  157 ? 0.20056213 0.19502799 0.14870298 -0.06031112 -0.03918913 0.02978607  212  ASN   A OD1  
2363  N  ND2  . ASN   A  157 ? 0.18151852 0.17324147 0.12940019 -0.05774157 -0.04267894 0.03066651  212  ASN   A ND2  
2364  H  H    . ASN   A  157 ? 0.20106904 0.20187798 0.15849510 -0.05494497 -0.04738285 0.02795220  212  ASN   A H    
2365  H  HA   . ASN   A  157 ? 0.20281759 0.20473219 0.15950528 -0.05929017 -0.04159338 0.02736169  212  ASN   A HA   
2366  H  HB2  . ASN   A  157 ? 0.21162270 0.20624858 0.15906580 -0.05816069 -0.04605324 0.02983822  212  ASN   A HB2  
2367  H  HB3  . ASN   A  157 ? 0.20884760 0.20447314 0.15578121 -0.06031891 -0.04328914 0.02904141  212  ASN   A HB3  
2368  H  HD21 . ASN   A  157 ? 0.19911949 0.18928766 0.14572312 -0.05688709 -0.04464689 0.03119525  212  ASN   A HD21 
2369  H  HD22 . ASN   A  157 ? 0.19480368 0.18613937 0.14347348 -0.05763812 -0.04158751 0.03058676  212  ASN   A HD22 
2370  N  N    . LEU   A  158 ? 0.18712041 0.19301249 0.14519745 -0.05955860 -0.04812850 0.02610576  213  LEU   A N    
2371  C  CA   . LEU   A  158 ? 0.19751292 0.20634007 0.15736668 -0.06155787 -0.04931204 0.02477469  213  LEU   A CA   
2372  C  C    . LEU   A  158 ? 0.16300589 0.17686993 0.12912482 -0.06314079 -0.04715351 0.02351118  213  LEU   A C    
2373  O  O    . LEU   A  158 ? 0.18787642 0.20146364 0.15356576 -0.06592397 -0.04619334 0.02283360  213  LEU   A O    
2374  C  CB   . LEU   A  158 ? 0.18529409 0.19633932 0.14622000 -0.06047090 -0.05389491 0.02443737  213  LEU   A CB   
2375  C  CG   . LEU   A  158 ? 0.19940934 0.20470142 0.15213194 -0.06004110 -0.05626522 0.02575178  213  LEU   A CG   
2376  C  CD1  . LEU   A  158 ? 0.21632600 0.22352219 0.16957895 -0.05885693 -0.06143311 0.02557866  213  LEU   A CD1  
2377  C  CD2  . LEU   A  158 ? 0.22366968 0.22519991 0.17039667 -0.06255588 -0.05459911 0.02538086  213  LEU   A CD2  
2378  H  H    . LEU   A  158 ? 0.19662598 0.20171386 0.15425369 -0.05790641 -0.04990347 0.02666403  213  LEU   A H    
2379  H  HA   . LEU   A  158 ? 0.18815903 0.19390246 0.14388561 -0.06286199 -0.04860400 0.02489052  213  LEU   A HA   
2380  H  HB2  . LEU   A  158 ? 0.19014296 0.20365815 0.15476733 -0.05849796 -0.05477029 0.02441227  213  LEU   A HB2  
2381  H  HB3  . LEU   A  158 ? 0.19159947 0.20561799 0.15500790 -0.06204628 -0.05461928 0.02329861  213  LEU   A HB3  
2382  H  HG   . LEU   A  158 ? 0.20451933 0.20690531 0.15496463 -0.05878094 -0.05556842 0.02701132  213  LEU   A HG   
2383  H  HD11 . LEU   A  158 ? 0.21716088 0.22007689 0.16453642 -0.05832975 -0.06282970 0.02681072  213  LEU   A HD11 
2384  H  HD12 . LEU   A  158 ? 0.21342793 0.22282471 0.16778386 -0.06052997 -0.06237668 0.02436573  213  LEU   A HD12 
2385  H  HD13 . LEU   A  158 ? 0.21214777 0.22259867 0.17039831 -0.05695937 -0.06253239 0.02540786  213  LEU   A HD13 
2386  H  HD21 . LEU   A  158 ? 0.21436183 0.21382982 0.15957801 -0.06268749 -0.05182504 0.02590491  213  LEU   A HD21 
2387  H  HD22 . LEU   A  158 ? 0.21546112 0.21917112 0.16464154 -0.06407809 -0.05453672 0.02408086  213  LEU   A HD22 
2388  H  HD23 . LEU   A  158 ? 0.22093481 0.21981959 0.16270371 -0.06251652 -0.05640605 0.02583431  213  LEU   A HD23 
2389  N  N    . TYR   A  159 ? 0.18663368 0.20477948 0.15819840 -0.06149329 -0.04637906 0.02310434  214  TYR   A N    
2390  C  CA   . TYR   A  159 ? 0.15237087 0.17587405 0.12950499 -0.06330016 -0.04396332 0.02196675  214  TYR   A CA   
2391  C  C    . TYR   A  159 ? 0.18790020 0.20765887 0.16170171 -0.06495031 -0.04026951 0.02272899  214  TYR   A C    
2392  O  O    . TYR   A  159 ? 0.19643432 0.21758647 0.17155144 -0.06782961 -0.03844017 0.02238275  214  TYR   A O    
2393  C  CB   . TYR   A  159 ? 0.20438634 0.23426546 0.18827404 -0.06095257 -0.04394502 0.02084455  214  TYR   A CB   
2394  C  CG   . TYR   A  159 ? 0.22069259 0.25879112 0.21179152 -0.06332157 -0.04242082 0.01924952  214  TYR   A CG   
2395  C  CD1  . TYR   A  159 ? 0.22793481 0.26942599 0.22159392 -0.06628664 -0.04428367 0.01852435  214  TYR   A CD1  
2396  C  CD2  . TYR   A  159 ? 0.20674527 0.24924794 0.20175296 -0.06300583 -0.03902113 0.01837333  214  TYR   A CD2  
2397  C  CE1  . TYR   A  159 ? 0.21594676 0.26541147 0.21653306 -0.06922331 -0.04272103 0.01715987  214  TYR   A CE1  
2398  C  CE2  . TYR   A  159 ? 0.19451249 0.24498129 0.19582653 -0.06585094 -0.03696463 0.01704111  214  TYR   A CE2  
2399  C  CZ   . TYR   A  159 ? 0.22916770 0.28337353 0.23366834 -0.06906530 -0.03883785 0.01651402  214  TYR   A CZ   
2400  O  OH   . TYR   A  159 ? 0.19966659 0.26222205 0.21079361 -0.07241228 -0.03668878 0.01526475  214  TYR   A OH   
2401  H  H    . TYR   A  159 ? 0.17330572 0.19081706 0.14481734 -0.05930344 -0.04726243 0.02349495  214  TYR   A H    
2402  H  HA   . TYR   A  159 ? 0.17498037 0.20040104 0.15347061 -0.06527378 -0.04489608 0.02133006  214  TYR   A HA   
2403  H  HB2  . TYR   A  159 ? 0.19392356 0.22442213 0.17866039 -0.05891659 -0.04670712 0.02075160  214  TYR   A HB2  
2404  H  HB3  . TYR   A  159 ? 0.19163026 0.21972775 0.17436272 -0.05972346 -0.04222111 0.02116688  214  TYR   A HB3  
2405  H  HD1  . TYR   A  159 ? 0.22426315 0.26271012 0.21483980 -0.06649771 -0.04663434 0.01889447  214  TYR   A HD1  
2406  H  HD2  . TYR   A  159 ? 0.20660667 0.24653752 0.19956596 -0.06119494 -0.03787915 0.01867540  214  TYR   A HD2  
2407  H  HE1  . TYR   A  159 ? 0.22293699 0.27455029 0.22527717 -0.07156754 -0.04416284 0.01663302  214  TYR   A HE1  
2408  H  HE2  . TYR   A  159 ? 0.20440084 0.25795734 0.20788264 -0.06566311 -0.03437988 0.01638789  214  TYR   A HE2  
2410  N  N    . THR   A  160 ? 0.21081367 0.22550735 0.18001378 -0.06341414 -0.03940558 0.02390712  215  THR   A N    
2411  C  CA   . THR   A  160 ? 0.21087839 0.22217059 0.17693776 -0.06473222 -0.03665923 0.02464726  215  THR   A CA   
2412  C  C    . THR   A  160 ? 0.20622645 0.21420780 0.16906995 -0.06692449 -0.03676514 0.02474346  215  THR   A C    
2413  O  O    . THR   A  160 ? 0.21272340 0.21954633 0.17508760 -0.06885190 -0.03504304 0.02487666  215  THR   A O    
2414  C  CB   . THR   A  160 ? 0.20074876 0.20828235 0.16338280 -0.06292433 -0.03601855 0.02568674  215  THR   A CB   
2415  O  OG1  . THR   A  160 ? 0.16355753 0.17336422 0.12889439 -0.06132561 -0.03528700 0.02520908  215  THR   A OG1  
2416  C  CG2  . THR   A  160 ? 0.26884642 0.27291936 0.22807696 -0.06399188 -0.03422423 0.02645829  215  THR   A CG2  
2417  H  H    . THR   A  160 ? 0.20557632 0.21896081 0.17366152 -0.06164508 -0.04065199 0.02429088  215  THR   A H    
2418  H  HA   . THR   A  160 ? 0.20630699 0.22007427 0.17475210 -0.06547349 -0.03513559 0.02427937  215  THR   A HA   
2419  H  HB   . THR   A  160 ? 0.20600411 0.21186358 0.16681015 -0.06208975 -0.03751502 0.02606079  215  THR   A HB   
2421  H  HG21 . THR   A  160 ? 0.24455853 0.24735746 0.20259713 -0.06309526 -0.03374476 0.02696152  215  THR   A HG21 
2422  H  HG22 . THR   A  160 ? 0.24464509 0.24962428 0.20487009 -0.06513900 -0.03306489 0.02629096  215  THR   A HG22 
2423  H  HG23 . THR   A  160 ? 0.24601391 0.24812852 0.20311801 -0.06442112 -0.03477393 0.02658168  215  THR   A HG23 
2424  N  N    . LEU   A  161 ? 0.23213233 0.23775661 0.19192329 -0.06649384 -0.03881351 0.02469098  216  LEU   A N    
2425  C  CA   . LEU   A  161 ? 0.26361683 0.26567215 0.21982485 -0.06810987 -0.03918310 0.02419310  216  LEU   A CA   
2426  C  C    . LEU   A  161 ? 0.24951565 0.25343785 0.20866300 -0.07099415 -0.03927165 0.02324967  216  LEU   A C    
2427  O  O    . LEU   A  161 ? 0.24436402 0.24448252 0.20123014 -0.07267883 -0.03818038 0.02317707  216  LEU   A O    
2428  C  CB   . LEU   A  161 ? 0.28021222 0.28055373 0.23271738 -0.06749772 -0.04170858 0.02383571  216  LEU   A CB   
2429  C  CG   . LEU   A  161 ? 0.35064757 0.34790257 0.29849002 -0.06562626 -0.04115411 0.02495105  216  LEU   A CG   
2430  C  CD1  . LEU   A  161 ? 0.34402996 0.33989587 0.28772840 -0.06527521 -0.04368142 0.02495005  216  LEU   A CD1  
2431  C  CD2  . LEU   A  161 ? 0.36826280 0.36210325 0.31282958 -0.06568561 -0.03878700 0.02490707  216  LEU   A CD2  
2432  H  H    . LEU   A  161 ? 0.23219378 0.23806682 0.19168724 -0.06509114 -0.04003553 0.02492755  216  LEU   A H    
2433  H  HA   . LEU   A  161 ? 0.25766450 0.25688550 0.21154517 -0.06788524 -0.03771583 0.02463951  216  LEU   A HA   
2434  H  HB2  . LEU   A  161 ? 0.29020771 0.29340491 0.24506681 -0.06726455 -0.04352230 0.02359821  216  LEU   A HB2  
2435  H  HB3  . LEU   A  161 ? 0.29310915 0.29147422 0.24365053 -0.06875895 -0.04202954 0.02304174  216  LEU   A HB3  
2436  H  HG   . LEU   A  161 ? 0.33448863 0.33292979 0.28405958 -0.06459931 -0.04072059 0.02573138  216  LEU   A HG   
2437  H  HD11 . LEU   A  161 ? 0.34786332 0.34221154 0.28902796 -0.06440706 -0.04316809 0.02592574  216  LEU   A HD11 
2438  H  HD12 . LEU   A  161 ? 0.35026088 0.34434631 0.29126972 -0.06618536 -0.04386238 0.02404881  216  LEU   A HD12 
2439  H  HD13 . LEU   A  161 ? 0.34759066 0.34574342 0.29361716 -0.06505228 -0.04571362 0.02485005  216  LEU   A HD13 
2440  H  HD21 . LEU   A  161 ? 0.35848087 0.35272998 0.30508801 -0.06582811 -0.03747895 0.02511198  216  LEU   A HD21 
2441  H  HD22 . LEU   A  161 ? 0.36494604 0.35702166 0.30742934 -0.06643182 -0.03917213 0.02394349  216  LEU   A HD22 
2442  H  HD23 . LEU   A  161 ? 0.36161047 0.35456216 0.30402404 -0.06481637 -0.03823830 0.02557332  216  LEU   A HD23 
2443  N  N    . ALA   A  162 ? 0.28237775 0.29225993 0.24688768 -0.07146922 -0.04053764 0.02257900  217  ALA   A N    
2444  C  CA   . ALA   A  162 ? 0.27198923 0.28537214 0.24044569 -0.07478178 -0.04088787 0.02154970  217  ALA   A CA   
2445  C  C    . ALA   A  162 ? 0.30690122 0.32200402 0.27785754 -0.07688031 -0.03771438 0.02201089  217  ALA   A C    
2446  O  O    . ALA   A  162 ? 0.21867840 0.23455575 0.19114433 -0.08062320 -0.03737071 0.02157112  217  ALA   A O    
2447  C  CB   . ALA   A  162 ? 0.28873298 0.30937141 0.26304629 -0.07417632 -0.04356608 0.02049765  217  ALA   A CB   
2448  H  H    . ALA   A  162 ? 0.26863354 0.28065279 0.23461622 -0.06965441 -0.04129497 0.02272076  217  ALA   A H    
2449  H  HA   . ALA   A  162 ? 0.28633192 0.29624268 0.25188959 -0.07627748 -0.04168579 0.02113517  217  ALA   A HA   
2450  H  HB1  . ALA   A  162 ? 0.28468138 0.30845857 0.26222438 -0.07669283 -0.04379235 0.01971315  217  ALA   A HB1  
2451  H  HB2  . ALA   A  162 ? 0.28520146 0.30423468 0.25717261 -0.07313062 -0.04586129 0.02036037  217  ALA   A HB2  
2452  H  HB3  . ALA   A  162 ? 0.28103641 0.30475074 0.25813612 -0.07230207 -0.04285553 0.02069539  217  ALA   A HB3  
2453  N  N    . THR   A  163 ? 0.20830783 0.22376826 0.17921765 -0.07487097 -0.03549260 0.02289889  218  THR   A N    
2454  C  CA   . THR   A  163 ? 0.20231192 0.22025877 0.17523351 -0.07675108 -0.03248018 0.02325992  218  THR   A CA   
2455  C  C    . THR   A  163 ? 0.19908014 0.21099178 0.16663241 -0.07650224 -0.03038356 0.02480205  218  THR   A C    
2456  O  O    . THR   A  163 ? 0.20344172 0.21514863 0.17039630 -0.07891080 -0.02815454 0.02549651  218  THR   A O    
2457  C  CB   . THR   A  163 ? 0.20195577 0.22746047 0.18054667 -0.07478687 -0.03157452 0.02237064  218  THR   A CB   
2458  O  OG1  . THR   A  163 ? 0.17523161 0.19806552 0.15132606 -0.07097981 -0.03183552 0.02283909  218  THR   A OG1  
2459  C  CG2  . THR   A  163 ? 0.21110328 0.24404314 0.19640782 -0.07468255 -0.03376083 0.02075216  218  THR   A CG2  
2460  H  H    . THR   A  163 ? 0.22490217 0.23900956 0.19424309 -0.07249754 -0.03586473 0.02325621  218  THR   A H    
2461  H  HA   . THR   A  163 ? 0.20584492 0.22484319 0.18009824 -0.07968343 -0.03235949 0.02295722  218  THR   A HA   
2462  H  HB   . THR   A  163 ? 0.19842640 0.22557840 0.17776182 -0.07632563 -0.02924751 0.02251065  218  THR   A HB   
2464  H  HG21 . THR   A  163 ? 0.20657986 0.24387318 0.19537677 -0.07275590 -0.03321491 0.02005906  218  THR   A HG21 
2465  H  HG22 . THR   A  163 ? 0.20845902 0.23939785 0.19236250 -0.07349712 -0.03625408 0.02072951  218  THR   A HG22 
2466  H  HG23 . THR   A  163 ? 0.20961876 0.24501444 0.19710883 -0.07774024 -0.03332644 0.02037011  218  THR   A HG23 
2467  N  N    . GLY   A  164 ? 0.23633620 0.24353273 0.19989960 -0.07382639 -0.03123007 0.02539414  219  GLY   A N    
2468  C  CA   . GLY   A  164 ? 0.26122963 0.26382646 0.22063245 -0.07289430 -0.02989797 0.02668478  219  GLY   A CA   
2469  C  C    . GLY   A  164 ? 0.22012714 0.22527337 0.18033729 -0.07145002 -0.02834603 0.02696307  219  GLY   A C    
2470  O  O    . GLY   A  164 ? 0.22164562 0.22364673 0.17855848 -0.07112865 -0.02739723 0.02801216  219  GLY   A O    
2471  H  H    . GLY   A  164 ? 0.23022091 0.23734078 0.19371268 -0.07261015 -0.03276366 0.02497870  219  GLY   A H    
2472  H  HA2  . GLY   A  164 ? 0.24548963 0.24535471 0.20275584 -0.07140069 -0.03078744 0.02680882  219  GLY   A HA2  
2473  H  HA3  . GLY   A  164 ? 0.24784940 0.24784568 0.20554221 -0.07475109 -0.02925212 0.02722823  219  GLY   A HA3  
2474  N  N    . LEU   A  165 ? 0.22243997 0.23314382 0.18695888 -0.07048278 -0.02832721 0.02583138  220  LEU   A N    
2475  C  CA   . LEU   A  165 ? 0.19973379 0.21313810 0.16531713 -0.06916317 -0.02671466 0.02539761  220  LEU   A CA   
2476  C  C    . LEU   A  165 ? 0.25412786 0.26664281 0.21954760 -0.06586074 -0.02819397 0.02508861  220  LEU   A C    
2477  O  O    . LEU   A  165 ? 0.21169618 0.22386950 0.17786825 -0.06469236 -0.03037712 0.02496631  220  LEU   A O    
2478  C  CB   . LEU   A  165 ? 0.19657233 0.21705744 0.16757677 -0.07000919 -0.02542647 0.02392690  220  LEU   A CB   
2479  C  CG   . LEU   A  165 ? 0.19259277 0.21510011 0.16427273 -0.07404939 -0.02331682 0.02419583  220  LEU   A CG   
2480  C  CD1  . LEU   A  165 ? 0.17892708 0.21034509 0.15774691 -0.07484003 -0.02235173 0.02237304  220  LEU   A CD1  
2481  C  CD2  . LEU   A  165 ? 0.23611988 0.25597501 0.20310791 -0.07543094 -0.02058623 0.02529723  220  LEU   A CD2  
2482  H  H    . LEU   A  165 ? 0.21603227 0.22879843 0.18284604 -0.07042649 -0.02954458 0.02515091  220  LEU   A H    
2483  H  HA   . LEU   A  165 ? 0.21374436 0.22482681 0.17644101 -0.06985448 -0.02553151 0.02617860  220  LEU   A HA   
2484  H  HB2  . LEU   A  165 ? 0.19501212 0.21780503 0.16900913 -0.06919317 -0.02703902 0.02320765  220  LEU   A HB2  
2485  H  HB3  . LEU   A  165 ? 0.19572113 0.21773247 0.16722630 -0.06855191 -0.02443035 0.02330113  220  LEU   A HB3  
2486  H  HG   . LEU   A  165 ? 0.19895013 0.21859914 0.16925326 -0.07558168 -0.02438175 0.02486347  220  LEU   A HG   
2487  H  HD11 . LEU   A  165 ? 0.18504944 0.21771157 0.16433991 -0.07805168 -0.02108452 0.02267567  220  LEU   A HD11 
2488  H  HD12 . LEU   A  165 ? 0.18290141 0.21709847 0.16292953 -0.07333665 -0.02092530 0.02151456  220  LEU   A HD12 
2489  H  HD13 . LEU   A  165 ? 0.18183883 0.21507850 0.16359836 -0.07366281 -0.02447037 0.02167679  220  LEU   A HD13 
2490  H  HD21 . LEU   A  165 ? 0.22364996 0.23838986 0.18662578 -0.07464897 -0.02143542 0.02637795  220  LEU   A HD21 
2491  H  HD22 . LEU   A  165 ? 0.22248212 0.24526134 0.19059239 -0.07415709 -0.01933705 0.02437423  220  LEU   A HD22 
2492  H  HD23 . LEU   A  165 ? 0.22649248 0.24676138 0.19319555 -0.07839804 -0.01934685 0.02580377  220  LEU   A HD23 
2493  N  N    . TYR   A  166 ? 0.23508358 0.24632210 0.19851670 -0.06474026 -0.02710713 0.02512760  221  TYR   A N    
2494  C  CA   . TYR   A  166 ? 0.20504710 0.21546108 0.16854440 -0.06206020 -0.02813330 0.02454307  221  TYR   A CA   
2495  C  C    . TYR   A  166 ? 0.20571637 0.22073293 0.17416896 -0.06026634 -0.02871319 0.02286666  221  TYR   A C    
2496  O  O    . TYR   A  166 ? 0.27217147 0.29246038 0.24432576 -0.06101631 -0.02713971 0.02168502  221  TYR   A O    
2497  C  CB   . TYR   A  166 ? 0.18825328 0.19692764 0.14888883 -0.06168941 -0.02674669 0.02434859  221  TYR   A CB   
2498  C  CG   . TYR   A  166 ? 0.20379078 0.20839453 0.16010630 -0.06282905 -0.02687496 0.02594745  221  TYR   A CG   
2499  C  CD1  . TYR   A  166 ? 0.22695419 0.22873124 0.18198667 -0.06237391 -0.02852140 0.02694011  221  TYR   A CD1  
2500  C  CD2  . TYR   A  166 ? 0.22524549 0.22913748 0.17874704 -0.06428315 -0.02538696 0.02646462  221  TYR   A CD2  
2501  C  CE1  . TYR   A  166 ? 0.21399209 0.21335731 0.16632165 -0.06298680 -0.02869801 0.02809862  221  TYR   A CE1  
2502  C  CE2  . TYR   A  166 ? 0.23860267 0.23903002 0.18861458 -0.06477037 -0.02610403 0.02791197  221  TYR   A CE2  
2503  C  CZ   . TYR   A  166 ? 0.23895222 0.23763810 0.18901417 -0.06391758 -0.02776681 0.02854891  221  TYR   A CZ   
2504  O  OH   . TYR   A  166 ? 0.26499692 0.26154831 0.21277690 -0.06402911 -0.02846390 0.02966823  221  TYR   A OH   
2505  H  H    . TYR   A  166 ? 0.23208731 0.24248487 0.19366558 -0.06583370 -0.02581365 0.02555680  221  TYR   A H    
2506  H  HA   . TYR   A  166 ? 0.20678084 0.21460500 0.16880491 -0.06162225 -0.02952752 0.02528566  221  TYR   A HA   
2507  H  HB2  . TYR   A  166 ? 0.19679937 0.20794499 0.15823886 -0.06229869 -0.02510036 0.02363385  221  TYR   A HB2  
2508  H  HB3  . TYR   A  166 ? 0.19611847 0.20396458 0.15691257 -0.06002969 -0.02749576 0.02373637  221  TYR   A HB3  
2509  H  HD1  . TYR   A  166 ? 0.21753345 0.21928799 0.17360751 -0.06162033 -0.02952418 0.02682007  221  TYR   A HD1  
2510  H  HD2  . TYR   A  166 ? 0.22427289 0.23018304 0.17818856 -0.06490640 -0.02392351 0.02584814  221  TYR   A HD2  
2511  H  HE1  . TYR   A  166 ? 0.22284795 0.22117794 0.17483455 -0.06270242 -0.02949593 0.02857326  221  TYR   A HE1  
2512  H  HE2  . TYR   A  166 ? 0.23790817 0.23742987 0.18556617 -0.06563513 -0.02544714 0.02842945  221  TYR   A HE2  
2514  N  N    . PRO   A  167 ? 0.19276443 0.20606691 0.16154566 -0.05782523 -0.03105878 0.02275303  222  PRO   A N    
2515  C  CA   . PRO   A  167 ? 0.24490830 0.26194996 0.21837047 -0.05514733 -0.03217647 0.02110075  222  PRO   A CA   
2516  C  C    . PRO   A  167 ? 0.21250826 0.23380342 0.18902460 -0.05385714 -0.02979103 0.01889743  222  PRO   A C    
2517  O  O    . PRO   A  167 ? 0.18848529 0.21635765 0.17094401 -0.05272304 -0.02956422 0.01717243  222  PRO   A O    
2518  C  CB   . PRO   A  167 ? 0.25416514 0.26551861 0.22464785 -0.05298266 -0.03475547 0.02191218  222  PRO   A CB   
2519  C  CG   . PRO   A  167 ? 0.23724820 0.24456547 0.20328195 -0.05525482 -0.03538594 0.02404703  222  PRO   A CG   
2520  C  CD   . PRO   A  167 ? 0.23104942 0.23883170 0.19572796 -0.05760832 -0.03282072 0.02430853  222  PRO   A CD   
2521  H  HA   . PRO   A  167 ? 0.22816883 0.24814713 0.20429207 -0.05560986 -0.03311331 0.02099654  222  PRO   A HA   
2522  H  HB2  . PRO   A  167 ? 0.25032216 0.25938976 0.21924093 -0.05211896 -0.03413335 0.02150101  222  PRO   A HB2  
2523  H  HB3  . PRO   A  167 ? 0.24950553 0.26198521 0.22224550 -0.05119850 -0.03661616 0.02148467  222  PRO   A HB3  
2524  H  HG2  . PRO   A  167 ? 0.24111590 0.24446979 0.20432442 -0.05476301 -0.03623698 0.02483424  222  PRO   A HG2  
2525  H  HG3  . PRO   A  167 ? 0.23992279 0.24839786 0.20679158 -0.05563266 -0.03659066 0.02432713  222  PRO   A HG3  
2526  H  HD2  . PRO   A  167 ? 0.22334339 0.22865765 0.18572029 -0.05757679 -0.03222778 0.02456863  222  PRO   A HD2  
2527  H  HD3  . PRO   A  167 ? 0.22152966 0.22862519 0.18501678 -0.05900404 -0.03296685 0.02513401  222  PRO   A HD3  
2528  N  N    . GLU   A  168 ? 0.25134000 0.26956552 0.22394298 -0.05412424 -0.02789692 0.01872347  223  GLU   A N    
2529  C  CA   . GLU   A  168 ? 0.21455429 0.23620921 0.18873887 -0.05286694 -0.02532451 0.01634047  223  GLU   A CA   
2530  C  C    . GLU   A  168 ? 0.21708277 0.24578403 0.19442923 -0.05545607 -0.02226189 0.01574814  223  GLU   A C    
2531  O  O    . GLU   A  168 ? 0.23407246 0.26848441 0.21496063 -0.05435708 -0.01989404 0.01337674  223  GLU   A O    
2532  C  CB   . GLU   A  168 ? 0.24561153 0.26181704 0.21371499 -0.05307286 -0.02428954 0.01629198  223  GLU   A CB   
2533  C  CG   . GLU   A  168 ? 0.22263810 0.23763776 0.18644705 -0.05663635 -0.02257525 0.01796551  223  GLU   A CG   
2534  C  CD   . GLU   A  168 ? 0.40008810 0.41027135 0.35801455 -0.05690902 -0.02220062 0.01791261  223  GLU   A CD   
2535  O  OE1  . GLU   A  168 ? 0.25900841 0.26657400 0.21594581 -0.05460478 -0.02289677 0.01623399  223  GLU   A OE1  
2536  O  OE2  . GLU   A  168 ? 0.26914126 0.27769023 0.22326326 -0.05941046 -0.02161174 0.01957212  223  GLU   A OE2  
2537  H  H    . GLU   A  168 ? 0.23209326 0.24625736 0.20097160 -0.05507530 -0.02823032 0.01996822  223  GLU   A H    
2538  H  HA   . GLU   A  168 ? 0.22811741 0.25109124 0.20523578 -0.05014143 -0.02632423 0.01496417  223  GLU   A HA   
2539  H  HB2  . GLU   A  168 ? 0.23592395 0.25369710 0.20479169 -0.05153268 -0.02298821 0.01431919  223  GLU   A HB2  
2540  H  HB3  . GLU   A  168 ? 0.23405251 0.24571198 0.20011984 -0.05224956 -0.02626753 0.01701226  223  GLU   A HB3  
2541  H  HG2  . GLU   A  168 ? 0.25661844 0.27007240 0.21988928 -0.05782765 -0.02381911 0.01966674  223  GLU   A HG2  
2542  H  HG3  . GLU   A  168 ? 0.25871238 0.27767625 0.22396988 -0.05782003 -0.02053887 0.01746934  223  GLU   A HG3  
2543  N  N    . SER   A  169 ? 0.19987652 0.22772628 0.17547512 -0.05903710 -0.02210128 0.01784635  224  SER   A N    
2544  C  CA   . SER   A  169 ? 0.24650106 0.27965987 0.22439229 -0.06239332 -0.01956313 0.01783335  224  SER   A CA   
2545  C  C    . SER   A  169 ? 0.24779034 0.28692529 0.23248059 -0.06292731 -0.02096370 0.01728013  224  SER   A C    
2546  O  O    . SER   A  169 ? 0.24609032 0.29275978 0.23581648 -0.06438296 -0.01876620 0.01592308  224  SER   A O    
2547  C  CB   . SER   A  169 ? 0.25892746 0.28692323 0.23093569 -0.06602047 -0.01897561 0.02035994  224  SER   A CB   
2548  O  OG   . SER   A  169 ? 0.23243518 0.25617570 0.19851017 -0.06593903 -0.01771751 0.02081532  224  SER   A OG   
2549  H  H    . SER   A  169 ? 0.21272703 0.23627794 0.18544196 -0.05948216 -0.02357689 0.01930975  224  SER   A H    
2550  H  HA   . SER   A  169 ? 0.24025801 0.27664331 0.21898255 -0.06216914 -0.01718584 0.01644036  224  SER   A HA   
2551  H  HB2  . SER   A  169 ? 0.24766895 0.27236974 0.21862584 -0.06592146 -0.02110780 0.02147277  224  SER   A HB2  
2552  H  HB3  . SER   A  169 ? 0.25000927 0.28081554 0.22329468 -0.06857289 -0.01750453 0.02054540  224  SER   A HB3  
2554  N  N    . HIS   A  170 ? 0.21075955 0.24699174 0.19550321 -0.06211505 -0.02455217 0.01826920  225  HIS   A N    
2555  C  CA   . HIS   A  170 ? 0.22107629 0.26295057 0.21185976 -0.06266718 -0.02644366 0.01758696  225  HIS   A CA   
2556  C  C    . HIS   A  170 ? 0.26900014 0.31674448 0.26637799 -0.05849348 -0.02796984 0.01537338  225  HIS   A C    
2557  O  O    . HIS   A  170 ? 0.21401218 0.26988703 0.21857011 -0.05888619 -0.02845517 0.01398228  225  HIS   A O    
2558  C  CB   . HIS   A  170 ? 0.23534538 0.27205780 0.22287986 -0.06401850 -0.02948867 0.01932169  225  HIS   A CB   
2559  C  CG   . HIS   A  170 ? 0.23345912 0.26420271 0.21726975 -0.06106132 -0.03243846 0.02021030  225  HIS   A CG   
2560  N  ND1  . HIS   A  170 ? 0.26571301 0.29753432 0.25197679 -0.05720843 -0.03460034 0.01932726  225  HIS   A ND1  
2561  C  CD2  . HIS   A  170 ? 0.27489299 0.29877761 0.25278884 -0.06173360 -0.03348132 0.02191987  225  HIS   A CD2  
2562  C  CE1  . HIS   A  170 ? 0.22712487 0.25216496 0.20817864 -0.05625462 -0.03684958 0.02087760  225  HIS   A CE1  
2563  N  NE2  . HIS   A  170 ? 0.23001808 0.25085023 0.20631251 -0.05891080 -0.03597099 0.02230118  225  HIS   A NE2  
2564  H  H    . HIS   A  170 ? 0.22076489 0.25176057 0.20172794 -0.06136528 -0.02582947 0.01931129  225  HIS   A H    
2565  H  HA   . HIS   A  170 ? 0.23012269 0.27588338 0.22293043 -0.06534024 -0.02448045 0.01729741  225  HIS   A HA   
2566  H  HB2  . HIS   A  170 ? 0.23141831 0.27210259 0.22273611 -0.06495218 -0.03062776 0.01873932  225  HIS   A HB2  
2567  H  HB3  . HIS   A  170 ? 0.23116313 0.26459116 0.21510744 -0.06636070 -0.02830526 0.02042019  225  HIS   A HB3  
2569  H  HD2  . HIS   A  170 ? 0.25320294 0.27474272 0.22849366 -0.06375314 -0.03262781 0.02269884  225  HIS   A HD2  
2570  H  HE1  . HIS   A  170 ? 0.23719981 0.26047060 0.21784022 -0.05392981 -0.03868863 0.02094876  225  HIS   A HE1  
2572  N  N    . GLY   A  171 ? 0.19360167 0.23767041 0.18897760 -0.05454521 -0.02852702 0.01479862  226  GLY   A N    
2573  C  CA   . GLY   A  171 ? 0.17624846 0.22501180 0.17745282 -0.04996034 -0.02956587 0.01238914  226  GLY   A CA   
2574  C  C    . GLY   A  171 ? 0.19264790 0.23776963 0.19393620 -0.04645700 -0.03459193 0.01302051  226  GLY   A C    
2575  O  O    . GLY   A  171 ? 0.21333574 0.26016802 0.21843201 -0.04183282 -0.03634644 0.01131782  226  GLY   A O    
2576  H  H    . GLY   A  171 ? 0.20429397 0.24257433 0.19456990 -0.05466055 -0.02840377 0.01587764  226  GLY   A H    
2577  H  HA2  . GLY   A  171 ? 0.18538554 0.23244017 0.18482386 -0.04844166 -0.02792750 0.01149599  226  GLY   A HA2  
2578  H  HA3  . GLY   A  171 ? 0.18395150 0.24029368 0.19095486 -0.05051832 -0.02849399 0.01100646  226  GLY   A HA3  
2579  N  N    . ILE   A  172 ? 0.25406057 0.29362947 0.25058967 -0.04847537 -0.03699221 0.01547075  227  ILE   A N    
2580  C  CA   . ILE   A  172 ? 0.20964082 0.24487688 0.20457405 -0.04568864 -0.04162290 0.01647797  227  ILE   A CA   
2581  C  C    . ILE   A  172 ? 0.17308098 0.19840553 0.16031179 -0.04486973 -0.04168037 0.01801369  227  ILE   A C    
2582  O  O    . ILE   A  172 ? 0.16167927 0.18139204 0.14295003 -0.04735298 -0.04192707 0.02016591  227  ILE   A O    
2583  C  CB   . ILE   A  172 ? 0.24235815 0.27784225 0.23641708 -0.04826062 -0.04421390 0.01785652  227  ILE   A CB   
2584  C  CG1  . ILE   A  172 ? 0.23476624 0.28054038 0.23676752 -0.05033255 -0.04371893 0.01617437  227  ILE   A CG1  
2585  C  CG2  . ILE   A  172 ? 0.25144434 0.28216293 0.24271211 -0.04550341 -0.04904899 0.01908288  227  ILE   A CG2  
2586  C  CD1  . ILE   A  172 ? 0.20707479 0.26185185 0.21836984 -0.04668622 -0.04490774 0.01367812  227  ILE   A CD1  
2587  H  H    . ILE   A  172 ? 0.22428566 0.26253942 0.21825191 -0.05150751 -0.03576681 0.01650302  227  ILE   A H    
2588  H  HA   . ILE   A  172 ? 0.21609280 0.25470144 0.21544421 -0.04265582 -0.04296424 0.01509245  227  ILE   A HA   
2589  H  HB   . ILE   A  172 ? 0.23379052 0.26539701 0.22325715 -0.05083208 -0.04290967 0.01910495  227  ILE   A HB   
2590  H  HG12 . ILE   A  172 ? 0.22708727 0.27426207 0.22907484 -0.05287303 -0.04052414 0.01597972  227  ILE   A HG12 
2591  H  HG13 . ILE   A  172 ? 0.22908585 0.27424243 0.22997436 -0.05191658 -0.04576458 0.01691515  227  ILE   A HG13 
2592  H  HG21 . ILE   A  172 ? 0.25152531 0.28459916 0.24656741 -0.04229692 -0.05055917 0.01800577  227  ILE   A HG21 
2593  H  HG22 . ILE   A  172 ? 0.24996921 0.27403423 0.23556210 -0.04552103 -0.04897226 0.02047937  227  ILE   A HG22 
2594  H  HG23 . ILE   A  172 ? 0.24996904 0.28176948 0.24110940 -0.04696251 -0.05082301 0.01954605  227  ILE   A HG23 
2595  H  HD11 . ILE   A  172 ? 0.21472645 0.27080446 0.22737947 -0.04534382 -0.04239781 0.01255399  227  ILE   A HD11 
2596  H  HD12 . ILE   A  172 ? 0.21748501 0.27018470 0.22846390 -0.04374609 -0.04832156 0.01397538  227  ILE   A HD12 
2597  H  HD13 . ILE   A  172 ? 0.21394691 0.27532396 0.23015666 -0.04860085 -0.04482831 0.01282024  227  ILE   A HD13 
2598  N  N    . VAL   A  173 ? 0.21513957 0.23879191 0.20291775 -0.04143509 -0.04132883 0.01659113  228  VAL   A N    
2599  C  CA   . VAL   A  173 ? 0.29233354 0.30723554 0.27337769 -0.04132704 -0.04083989 0.01756492  228  VAL   A CA   
2600  C  C    . VAL   A  173 ? 0.31884044 0.32583845 0.29569325 -0.03930598 -0.04492409 0.01932703  228  VAL   A C    
2601  O  O    . VAL   A  173 ? 0.30945119 0.30867738 0.28040758 -0.03995872 -0.04495585 0.02055716  228  VAL   A O    
2602  C  CB   . VAL   A  173 ? 0.21728507 0.23311381 0.19970059 -0.03918137 -0.03827327 0.01494410  228  VAL   A CB   
2603  C  CG1  . VAL   A  173 ? 0.26568785 0.28883499 0.25087556 -0.04180508 -0.03397007 0.01362905  228  VAL   A CG1  
2604  C  CG2  . VAL   A  173 ? 0.29539627 0.31315842 0.28281051 -0.03375735 -0.04026482 0.01254626  228  VAL   A CG2  
2605  H  H    . VAL   A  173 ? 0.21950823 0.24767613 0.21211100 -0.03912754 -0.04143779 0.01481517  228  VAL   A H    
2606  H  HA   . VAL   A  173 ? 0.25908032 0.27236617 0.23692593 -0.04427876 -0.03944158 0.01879154  228  VAL   A HA   
2607  H  HB   . VAL   A  173 ? 0.25304380 0.26288188 0.23066783 -0.03969171 -0.03807953 0.01562933  228  VAL   A HB   
2608  H  HG11 . VAL   A  173 ? 0.24696586 0.27641636 0.23725806 -0.04159984 -0.03395588 0.01280854  228  VAL   A HG11 
2609  H  HG12 . VAL   A  173 ? 0.24625240 0.26762122 0.22818817 -0.04488294 -0.03309034 0.01521404  228  VAL   A HG12 
2610  H  HG13 . VAL   A  173 ? 0.25009200 0.27324894 0.23497939 -0.04068604 -0.03215801 0.01201221  228  VAL   A HG13 
2611  H  HG21 . VAL   A  173 ? 0.27203339 0.28925037 0.25928831 -0.03234384 -0.03854739 0.01075259  228  VAL   A HG21 
2612  H  HG22 . VAL   A  173 ? 0.27364275 0.28607997 0.25877118 -0.03220246 -0.04331167 0.01370655  228  VAL   A HG22 
2613  H  HG23 . VAL   A  173 ? 0.26836148 0.29316175 0.26133347 -0.03321770 -0.04027180 0.01156891  228  VAL   A HG23 
2614  N  N    . GLY   A  174 ? 0.24536632 0.25431058 0.22509994 -0.03706011 -0.04854014 0.01951631  229  GLY   A N    
2615  C  CA   . GLY   A  174 ? 0.31768945 0.31866997 0.29224202 -0.03568784 -0.05273964 0.02179721  229  GLY   A CA   
2616  C  C    . GLY   A  174 ? 0.39806467 0.40298122 0.37567437 -0.03431328 -0.05668914 0.02217677  229  GLY   A C    
2617  O  O    . GLY   A  174 ? 0.28932053 0.30371642 0.27455702 -0.03372825 -0.05634571 0.02014545  229  GLY   A O    
2618  H  H    . GLY   A  174 ? 0.27259666 0.28800467 0.25751701 -0.03646997 -0.04850041 0.01825044  229  GLY   A H    
2619  H  HA2  . GLY   A  174 ? 0.31388235 0.31050432 0.28321174 -0.03842939 -0.05212568 0.02363122  229  GLY   A HA2  
2620  H  HA3  . GLY   A  174 ? 0.31831872 0.31534350 0.29218274 -0.03299426 -0.05373734 0.02127759  229  GLY   A HA3  
2621  N  N    . ASN   A  175 ? 0.34691072 0.34468436 0.31846768 -0.03395749 -0.06054154 0.02474954  230  ASN   A N    
2622  C  CA   . ASN   A  175 ? 0.38075885 0.38116986 0.35436934 -0.03192558 -0.06530447 0.02512406  230  ASN   A CA   
2623  C  C    . ASN   A  175 ? 0.35509253 0.35851461 0.33560795 -0.02594382 -0.06806674 0.02297371  230  ASN   A C    
2624  O  O    . ASN   A  175 ? 0.46137559 0.47155508 0.44787824 -0.02364135 -0.07140650 0.02197056  230  ASN   A O    
2625  C  CB   . ASN   A  175 ? 0.34241754 0.33339861 0.30637661 -0.03292586 -0.06880662 0.02861192  230  ASN   A CB   
2626  C  CG   . ASN   A  175 ? 0.33464539 0.32480046 0.29305175 -0.03803047 -0.06682180 0.03017525  230  ASN   A CG   
2627  O  OD1  . ASN   A  175 ? 0.34965971 0.34656996 0.31174240 -0.04062515 -0.06411497 0.02876484  230  ASN   A OD1  
2628  N  ND2  . ASN   A  175 ? 0.32195914 0.30330724 0.27092278 -0.03961724 -0.06807114 0.03313819  230  ASN   A ND2  
2629  H  H    . ASN   A  175 ? 0.36799720 0.35928732 0.33387646 -0.03520615 -0.06025250 0.02634783  230  ASN   A H    
2630  H  HA   . ASN   A  175 ? 0.35597837 0.36263677 0.33282930 -0.03378889 -0.06452584 0.02437488  230  ASN   A HA   
2631  H  HB2  . ASN   A  175 ? 0.35513946 0.33926320 0.31502718 -0.03223451 -0.06884360 0.02963877  230  ASN   A HB2  
2632  H  HB3  . ASN   A  175 ? 0.35826728 0.35006419 0.32339603 -0.03063100 -0.07261654 0.02879284  230  ASN   A HB3  
2633  H  HD21 . ASN   A  175 ? 0.33443767 0.31071162 0.28056610 -0.03779656 -0.07056970 0.03432551  230  ASN   A HD21 
2634  H  HD22 . ASN   A  175 ? 0.32865465 0.30916566 0.27406749 -0.04252281 -0.06634090 0.03392127  230  ASN   A HD22 
2635  N  N    . SER   A  176 ? 0.35105547 0.34925514 0.33063710 -0.02332138 -0.06689414 0.02210759  231  SER   A N    
2636  C  CA   . SER   A  176 ? 0.32072639 0.32196569 0.30727041 -0.01725611 -0.06836322 0.01922567  231  SER   A CA   
2637  C  C    . SER   A  176 ? 0.32442468 0.32957757 0.31477317 -0.01719671 -0.06297316 0.01609701  231  SER   A C    
2638  O  O    . SER   A  176 ? 0.32200471 0.32084048 0.30620635 -0.02017380 -0.05997708 0.01692523  231  SER   A O    
2639  C  CB   . SER   A  176 ? 0.41320798 0.40234572 0.39390540 -0.01309347 -0.07296627 0.02081764  231  SER   A CB   
2640  O  OG   . SER   A  176 ? 0.63798916 0.62520361 0.61657548 -0.01186137 -0.07863966 0.02319434  231  SER   A OG   
2641  H  H    . SER   A  176 ? 0.34584320 0.33826631 0.32019043 -0.02533248 -0.06519569 0.02322747  231  SER   A H    
2642  H  HA   . SER   A  176 ? 0.34124225 0.34998235 0.33389509 -0.01574752 -0.07002714 0.01812657  231  SER   A HA   
2643  H  HB2  . SER   A  176 ? 0.43415502 0.41547149 0.40803111 -0.01550749 -0.07175092 0.02246210  231  SER   A HB2  
2644  H  HB3  . SER   A  176 ? 0.43448323 0.42469770 0.41940826 -0.00890210 -0.07328959 0.01852192  231  SER   A HB3  
2646  N  N    . MET   A  177 ? 0.34199032 0.35743529 0.34228116 -0.01353674 -0.06203988 0.01242899  232  MET   A N    
2647  C  CA   . MET   A  177 ? 0.37006617 0.39144680 0.37435991 -0.01390887 -0.05643779 0.00918629  232  MET   A CA   
2648  C  C    . MET   A  177 ? 0.38651401 0.41560054 0.40035295 -0.00750057 -0.05684033 0.00506212  232  MET   A C    
2649  O  O    . MET   A  177 ? 0.33740532 0.37351161 0.35840389 -0.00451859 -0.06042898 0.00446362  232  MET   A O    
2650  C  CB   . MET   A  177 ? 0.36802402 0.39999884 0.37639284 -0.01920093 -0.05222221 0.00878330  232  MET   A CB   
2651  C  CG   . MET   A  177 ? 0.29619277 0.32334605 0.29727635 -0.02514072 -0.05119031 0.01200082  232  MET   A CG   
2652  S  SD   . MET   A  177 ? 0.31837317 0.35566059 0.32331550 -0.03084912 -0.04618512 0.01132036  232  MET   A SD   
2653  C  CE   . MET   A  177 ? 0.36756796 0.41470015 0.38041255 -0.03116796 -0.04965789 0.01112443  232  MET   A CE   
2654  H  H    . MET   A  177 ? 0.34596992 0.36513546 0.35066739 -0.01071915 -0.06501504 0.01190291  232  MET   A H    
2655  H  HA   . MET   A  177 ? 0.36643386 0.38075769 0.36514187 -0.01476163 -0.05495967 0.00958441  232  MET   A HA   
2656  H  HB2  . MET   A  177 ? 0.34721279 0.38640097 0.36156249 -0.01839190 -0.05374563 0.00811264  232  MET   A HB2  
2657  H  HB3  . MET   A  177 ? 0.34695113 0.38247120 0.35745960 -0.01922864 -0.04860419 0.00669851  232  MET   A HB3  
2658  H  HG2  . MET   A  177 ? 0.31868207 0.33874363 0.31403762 -0.02587201 -0.05016701 0.01280516  232  MET   A HG2  
2659  H  HG3  . MET   A  177 ? 0.31861782 0.34335592 0.31779277 -0.02540594 -0.05442991 0.01385930  232  MET   A HG3  
2660  H  HE1  . MET   A  177 ? 0.35535386 0.39770693 0.36437050 -0.03139950 -0.05279899 0.01304471  232  MET   A HE1  
2661  H  HE2  . MET   A  177 ? 0.35526541 0.40756333 0.37418956 -0.02768296 -0.05076592 0.00920335  232  MET   A HE2  
2662  H  HE3  . MET   A  177 ? 0.35027766 0.40219527 0.36493731 -0.03466580 -0.04735433 0.01095377  232  MET   A HE3  
2663  N  N    . TYR   A  178 ? 0.27383503 0.30253130 0.28794563 -0.00570141 -0.05292792 0.00201566  233  TYR   A N    
2664  C  CA   . TYR   A  178 ? 0.27018604 0.30870953 0.29402614 -0.00036292 -0.05127681 -0.00273619 233  TYR   A CA   
2665  C  C    . TYR   A  178 ? 0.28727704 0.33481106 0.31367615 -0.00411596 -0.04417597 -0.00511603 233  TYR   A C    
2666  O  O    . TYR   A  178 ? 0.26419348 0.30527887 0.28264430 -0.00808510 -0.04099092 -0.00412280 233  TYR   A O    
2667  C  CB   . TYR   A  178 ? 0.32988554 0.35925624 0.35151178 0.00645658  -0.05330831 -0.00497882 233  TYR   A CB   
2668  C  CG   . TYR   A  178 ? 0.30954233 0.34947786 0.34127513 0.01244265  -0.05086002 -0.01058364 233  TYR   A CG   
2669  C  CD1  . TYR   A  178 ? 0.27620345 0.32652679 0.31914672 0.01778748  -0.05398222 -0.01253494 233  TYR   A CD1  
2670  C  CD2  . TYR   A  178 ? 0.35249034 0.39274579 0.38268706 0.01273592  -0.04532273 -0.01415247 233  TYR   A CD2  
2671  C  CE1  . TYR   A  178 ? 0.34734923 0.40898558 0.40061235 0.02337768  -0.05121060 -0.01805499 233  TYR   A CE1  
2672  C  CE2  . TYR   A  178 ? 0.30610391 0.35666460 0.34531659 0.01815861  -0.04238424 -0.01964081 233  TYR   A CE2  
2673  C  CZ   . TYR   A  178 ? 0.38109642 0.44269317 0.43223420 0.02355446  -0.04511465 -0.02167234 233  TYR   A CZ   
2674  O  OH   . TYR   A  178 ? 0.36888909 0.44168091 0.42934746 0.02887143  -0.04142960 -0.02751393 233  TYR   A OH   
2675  H  H    . TYR   A  178 ? 0.29619372 0.31847754 0.30417234 -0.00788435 -0.05120829 0.00280254  233  TYR   A H    
2676  H  HA   . TYR   A  178 ? 0.28318429 0.32893908 0.31367439 0.00130355  -0.05351274 -0.00309810 233  TYR   A HA   
2677  H  HB2  . TYR   A  178 ? 0.31685641 0.34055990 0.33694437 0.00890344  -0.05806936 -0.00328023 233  TYR   A HB2  
2678  H  HB3  . TYR   A  178 ? 0.31396353 0.33545166 0.32853836 0.00448168  -0.05163117 -0.00443296 233  TYR   A HB3  
2679  H  HD1  . TYR   A  178 ? 0.29888880 0.34913775 0.34264022 0.01759508  -0.05797972 -0.01020971 233  TYR   A HD1  
2680  H  HD2  . TYR   A  178 ? 0.32950294 0.36307925 0.35231289 0.00917078  -0.04350710 -0.01291715 233  TYR   A HD2  
2681  H  HE1  . TYR   A  178 ? 0.33578461 0.40525526 0.39739841 0.02712167  -0.05348169 -0.01946533 233  TYR   A HE1  
2682  H  HE2  . TYR   A  178 ? 0.33399701 0.38442296 0.37129849 0.01818036  -0.03849752 -0.02210812 233  TYR   A HE2  
2684  N  N    . ASP   A  179 ? 0.24487714 0.30752575 0.28238505 -0.00298535 -0.04194058 -0.00813455 234  ASP   A N    
2685  C  CA   . ASP   A  179 ? 0.25785434 0.33017528 0.29815573 -0.00689061 -0.03505327 -0.01025070 234  ASP   A CA   
2686  C  C    . ASP   A  179 ? 0.23027307 0.31055146 0.27822888 -0.00077939 -0.03231012 -0.01571813 234  ASP   A C    
2687  O  O    . ASP   A  179 ? 0.25322261 0.34357077 0.31203702 0.00382168  -0.03433920 -0.01806510 234  ASP   A O    
2688  C  CB   . ASP   A  179 ? 0.29351211 0.37748682 0.33991343 -0.01251587 -0.03379842 -0.00892963 234  ASP   A CB   
2689  C  CG   . ASP   A  179 ? 0.25001839 0.34166467 0.29699263 -0.01782612 -0.02668803 -0.01010627 234  ASP   A CG   
2690  O  OD1  . ASP   A  179 ? 0.34124929 0.43905962 0.39196500 -0.01519471 -0.02251385 -0.01398588 234  ASP   A OD1  
2691  O  OD2  . ASP   A  179 ? 0.25379100 0.34466982 0.29685789 -0.02464308 -0.02539006 -0.00705976 234  ASP   A OD2  
2692  H  H    . ASP   A  179 ? 0.25884280 0.32603085 0.30234367 0.00020007  -0.04485500 -0.00883366 234  ASP   A H    
2693  H  HA   . ASP   A  179 ? 0.25437272 0.31999651 0.28714699 -0.00985280 -0.03296156 -0.00910148 234  ASP   A HA   
2694  H  HB2  . ASP   A  179 ? 0.27111876 0.34952593 0.31273770 -0.01557153 -0.03607236 -0.00573889 234  ASP   A HB2  
2695  H  HB3  . ASP   A  179 ? 0.27361983 0.36554113 0.32825348 -0.00978119 -0.03563561 -0.01041363 234  ASP   A HB3  
2696  N  N    . PRO   A  180 ? 0.23644227 0.31244323 0.27900231 -0.00014382 -0.02792341 -0.01815725 235  PRO   A N    
2697  C  CA   . PRO   A  180 ? 0.37519854 0.45769650 0.42409390 0.00630388  -0.02517661 -0.02387640 235  PRO   A CA   
2698  C  C    . PRO   A  180 ? 0.33352879 0.43501389 0.39351106 0.00472210  -0.01973371 -0.02690527 235  PRO   A C    
2699  O  O    . PRO   A  180 ? 0.29936540 0.41057134 0.36904216 0.01078499  -0.01870814 -0.03155622 235  PRO   A O    
2700  C  CB   . PRO   A  180 ? 0.35848802 0.42938781 0.39623678 0.00606355  -0.02229671 -0.02508809 235  PRO   A CB   
2701  C  CG   . PRO   A  180 ? 0.29548422 0.36023229 0.32380593 -0.00213369 -0.02104077 -0.02058605 235  PRO   A CG   
2702  C  CD   . PRO   A  180 ? 0.27385974 0.33908352 0.30418408 -0.00535971 -0.02555156 -0.01585181 235  PRO   A CD   
2703  H  HA   . PRO   A  180 ? 0.33352345 0.41424105 0.38580489 0.01177411  -0.02918247 -0.02479183 235  PRO   A HA   
2704  H  HB2  . PRO   A  180 ? 0.34994268 0.42696714 0.39012051 0.00734445  -0.01800378 -0.02864970 235  PRO   A HB2  
2705  H  HB3  . PRO   A  180 ? 0.35321444 0.41468602 0.38759351 0.00994321  -0.02572045 -0.02527814 235  PRO   A HB3  
2706  H  HG2  . PRO   A  180 ? 0.30184984 0.37289292 0.33048949 -0.00543505 -0.01649710 -0.02137655 235  PRO   A HG2  
2707  H  HG3  . PRO   A  180 ? 0.30734494 0.36138928 0.32776845 -0.00218464 -0.02203771 -0.01987244 235  PRO   A HG3  
2708  H  HD2  . PRO   A  180 ? 0.26216739 0.33110505 0.29177195 -0.01053539 -0.02329971 -0.01412498 235  PRO   A HD2  
2709  H  HD3  . PRO   A  180 ? 0.26852185 0.32363039 0.29307097 -0.00529807 -0.02905959 -0.01346184 235  PRO   A HD3  
2710  N  N    . VAL   A  181 ? 0.34388983 0.45065662 0.40272141 -0.00340414 -0.01640509 -0.02425173 236  VAL   A N    
2711  C  CA   . VAL   A  181 ? 0.28856629 0.41287488 0.35730326 -0.00628244 -0.01115500 -0.02651851 236  VAL   A CA   
2712  C  C    . VAL   A  181 ? 0.26590285 0.40247095 0.34811947 -0.00421490 -0.01503258 -0.02695935 236  VAL   A C    
2713  O  O    . VAL   A  181 ? 0.28323469 0.43538883 0.37748027 -0.00174043 -0.01219411 -0.03103647 236  VAL   A O    
2714  C  CB   . VAL   A  181 ? 0.30825225 0.43187505 0.36997825 -0.01578737 -0.00688097 -0.02316396 236  VAL   A CB   
2715  C  CG1  . VAL   A  181 ? 0.34841996 0.48882675 0.42012185 -0.02083764 -0.00307747 -0.02370275 236  VAL   A CG1  
2716  C  CG2  . VAL   A  181 ? 0.29518342 0.41187519 0.34644884 -0.01712049 -0.00180919 -0.02427415 236  VAL   A CG2  
2717  H  H    . VAL   A  181 ? 0.32297790 0.42209685 0.37462664 -0.00733503 -0.01739284 -0.02095459 236  VAL   A H    
2718  H  HA   . VAL   A  181 ? 0.30184004 0.43039483 0.37279582 -0.00326134 -0.00768766 -0.03022755 236  VAL   A HA   
2719  H  HB   . VAL   A  181 ? 0.30534992 0.42107004 0.36204436 -0.01815458 -0.01034704 -0.01956964 236  VAL   A HB   
2720  H  HG11 . VAL   A  181 ? 0.33653224 0.48653698 0.41533557 -0.01790614 -0.00025820 -0.02741910 236  VAL   A HG11 
2721  H  HG12 . VAL   A  181 ? 0.33113468 0.47387418 0.40731671 -0.02148817 -0.00679676 -0.02211263 236  VAL   A HG12 
2722  H  HG13 . VAL   A  181 ? 0.33355260 0.47253162 0.39982125 -0.02642661 0.00018346  -0.02194908 236  VAL   A HG13 
2723  H  HG21 . VAL   A  181 ? 0.29790536 0.41319111 0.34424204 -0.02289224 0.00024189  -0.02179162 236  VAL   A HG21 
2724  H  HG22 . VAL   A  181 ? 0.30270323 0.40876567 0.34784198 -0.01445995 -0.00446951 -0.02384264 236  VAL   A HG22 
2725  H  HG23 . VAL   A  181 ? 0.30324498 0.42745203 0.35868445 -0.01490489 0.00195831  -0.02795180 236  VAL   A HG23 
2726  N  N    . PHE   A  182 ? 0.30411452 0.43416423 0.38442868 -0.00521744 -0.02156537 -0.02293743 237  PHE   A N    
2727  C  CA   . PHE   A  182 ? 0.33738217 0.47711161 0.42927665 -0.00235289 -0.02667708 -0.02334374 237  PHE   A CA   
2728  C  C    . PHE   A  182 ? 0.41544718 0.55358917 0.51240164 0.00791506  -0.03159977 -0.02617832 237  PHE   A C    
2729  O  O    . PHE   A  182 ? 0.33578843 0.48598811 0.44535333 0.01215588  -0.03461577 -0.02837440 237  PHE   A O    
2730  C  CB   . PHE   A  182 ? 0.30723828 0.43946183 0.39394420 -0.00671340 -0.03229072 -0.01817347 237  PHE   A CB   
2731  C  CG   . PHE   A  182 ? 0.32250547 0.45390117 0.40363002 -0.01628941 -0.02918066 -0.01485486 237  PHE   A CG   
2732  C  CD1  . PHE   A  182 ? 0.24427974 0.38462189 0.32762527 -0.02142877 -0.02205060 -0.01625780 237  PHE   A CD1  
2733  C  CD2  . PHE   A  182 ? 0.28079963 0.40172440 0.35374057 -0.02007215 -0.03334223 -0.01031758 237  PHE   A CD2  
2734  C  CE1  . PHE   A  182 ? 0.22829095 0.36637622 0.30586129 -0.03004053 -0.01971044 -0.01295819 237  PHE   A CE1  
2735  C  CE2  . PHE   A  182 ? 0.23521474 0.35489222 0.30323401 -0.02825644 -0.03076826 -0.00755562 237  PHE   A CE2  
2736  C  CZ   . PHE   A  182 ? 0.18962991 0.31739876 0.25992852 -0.03307836 -0.02419914 -0.00879997 237  PHE   A CZ   
2737  H  H    . PHE   A  182 ? 0.29997575 0.41958088 0.37155497 -0.00775683 -0.02291246 -0.01994776 237  PHE   A H    
2738  H  HA   . PHE   A  182 ? 0.33272225 0.48546591 0.43298176 -0.00426019 -0.02362703 -0.02519007 237  PHE   A HA   
2739  H  HB2  . PHE   A  182 ? 0.32072163 0.44094792 0.39987624 -0.00460022 -0.03529425 -0.01648185 237  PHE   A HB2  
2740  H  HB3  . PHE   A  182 ? 0.31743246 0.45655197 0.41184485 -0.00478284 -0.03579936 -0.01867301 237  PHE   A HB3  
2741  H  HD1  . PHE   A  182 ? 0.25892475 0.40676183 0.34752071 -0.01910030 -0.01875870 -0.01945332 237  PHE   A HD1  
2742  H  HD2  . PHE   A  182 ? 0.27905092 0.39381701 0.34987155 -0.01698161 -0.03801314 -0.00917516 237  PHE   A HD2  
2743  H  HE1  . PHE   A  182 ? 0.22176407 0.36534482 0.30032104 -0.03368158 -0.01499328 -0.01366760 237  PHE   A HE1  
2744  H  HE2  . PHE   A  182 ? 0.23074785 0.34353393 0.29340929 -0.03042324 -0.03348899 -0.00482155 237  PHE   A HE2  
2745  H  HZ   . PHE   A  182 ? 0.20671010 0.33255637 0.27311707 -0.03846012 -0.02268969 -0.00679135 237  PHE   A HZ   
2746  N  N    . ASP   A  183 ? 0.44649959 0.56939185 0.53353280 0.01187367  -0.03269335 -0.02612659 238  ASP   A N    
2747  C  CA   . ASP   A  183 ? 0.40192538 0.51759458 0.48995063 0.02101848  -0.03866079 -0.02747037 238  ASP   A CA   
2748  C  C    . ASP   A  183 ? 0.37857208 0.49257237 0.46889132 0.02212090  -0.04684873 -0.02403341 238  ASP   A C    
2749  O  O    . ASP   A  183 ? 0.39896905 0.52085507 0.49974000 0.02854354  -0.05120865 -0.02612928 238  ASP   A O    
2750  C  CB   . ASP   A  183 ? 0.43252143 0.56020379 0.53234905 0.02897122  -0.03625103 -0.03394596 238  ASP   A CB   
2751  C  CG   . ASP   A  183 ? 0.44868770 0.56484807 0.54637003 0.03875740  -0.04135669 -0.03579635 238  ASP   A CG   
2752  O  OD1  . ASP   A  183 ? 0.39827257 0.49582905 0.48349485 0.03840785  -0.04551794 -0.03209343 238  ASP   A OD1  
2753  O  OD2  . ASP   A  183 ? 0.40250441 0.52783954 0.51071346 0.04650624  -0.04127477 -0.04078650 238  ASP   A OD2  
2754  H  H    . ASP   A  183 ? 0.42393571 0.54020959 0.50299251 0.00861323  -0.02978816 -0.02513424 238  ASP   A H    
2755  H  HA   . ASP   A  183 ? 0.41449800 0.51732445 0.49297690 0.02137378  -0.03902930 -0.02639055 238  ASP   A HA   
2756  H  HB2  . ASP   A  183 ? 0.42722422 0.55805671 0.52593780 0.02713975  -0.03038931 -0.03610773 238  ASP   A HB2  
2757  H  HB3  . ASP   A  183 ? 0.42450255 0.56479263 0.53473568 0.02962526  -0.03705489 -0.03503174 238  ASP   A HB3  
2758  N  N    . ALA   A  184 ? 0.31663623 0.41993111 0.39651561 0.01592212  -0.04900490 -0.01877187 239  ALA   A N    
2759  C  CA   . ALA   A  184 ? 0.26226217 0.36364883 0.34202224 0.01497887  -0.05584618 -0.01508959 239  ALA   A CA   
2760  C  C    . ALA   A  184 ? 0.26422513 0.34785861 0.32871163 0.01065341  -0.05779626 -0.01000638 239  ALA   A C    
2761  O  O    . ALA   A  184 ? 0.33633971 0.41335043 0.39253962 0.00619289  -0.05314047 -0.00908190 239  ALA   A O    
2762  C  CB   . ALA   A  184 ? 0.35886180 0.47554404 0.44712633 0.00901370  -0.05430767 -0.01490848 239  ALA   A CB   
2763  H  H    . ALA   A  184 ? 0.31397361 0.41096455 0.38629270 0.01214626  -0.04600448 -0.01754624 239  ALA   A H    
2764  H  HA   . ALA   A  184 ? 0.29384783 0.39531392 0.37765133 0.02095702  -0.06026863 -0.01608291 239  ALA   A HA   
2765  H  HB1  . ALA   A  184 ? 0.32232532 0.43747431 0.41006023 0.00839865  -0.05905491 -0.01264705 239  ALA   A HB1  
2766  H  HB2  . ALA   A  184 ? 0.32194176 0.45070660 0.42041790 0.01148379  -0.05279278 -0.01821747 239  ALA   A HB2  
2767  H  HB3  . ALA   A  184 ? 0.31800193 0.43372798 0.40184307 0.00328105  -0.05016679 -0.01379318 239  ALA   A HB3  
2768  N  N    . SER   A  185 ? 0.25850242 0.33522663 0.31952655 0.01189500  -0.06476610 -0.00674327 240  SER   A N    
2769  C  CA   . SER   A  185 ? 0.30165100 0.36281517 0.34892198 0.00784120  -0.06684373 -0.00190882 240  SER   A CA   
2770  C  C    . SER   A  185 ? 0.32232395 0.38701794 0.36877877 0.00195736  -0.06882523 0.00114016  240  SER   A C    
2771  O  O    . SER   A  185 ? 0.40215468 0.47798479 0.45769766 0.00289248  -0.07168817 0.00012250  240  SER   A O    
2772  C  CB   . SER   A  185 ? 0.31922215 0.36671180 0.36033094 0.01369656  -0.07322715 -0.00020960 240  SER   A CB   
2773  O  OG   . SER   A  185 ? 0.40373373 0.44602388 0.44433841 0.01885908  -0.07144389 -0.00314009 240  SER   A OG   
2774  H  H    . SER   A  185 ? 0.27164105 0.35387057 0.33913869 0.01539071  -0.06837217 -0.00758933 240  SER   A H    
2775  H  HA   . SER   A  185 ? 0.29687923 0.35374233 0.33887452 0.00484407  -0.06271658 -0.00172161 240  SER   A HA   
2776  H  HB2  . SER   A  185 ? 0.33683309 0.38843063 0.38306648 0.01707785  -0.07762741 -0.00040028 240  SER   A HB2  
2777  H  HB3  . SER   A  185 ? 0.33507687 0.37291199 0.36709672 0.01042756  -0.07438032 0.00314971  240  SER   A HB3  
2779  N  N    . PHE   A  186 ? 0.33421111 0.38919145 0.36966759 -0.00397348 -0.06722011 0.00458426  241  PHE   A N    
2780  C  CA   . PHE   A  186 ? 0.38407141 0.43835527 0.41532844 -0.00968392 -0.06880298 0.00770155  241  PHE   A CA   
2781  C  C    . PHE   A  186 ? 0.34587094 0.38509500 0.36537898 -0.00928253 -0.07340606 0.01167334  241  PHE   A C    
2782  O  O    . PHE   A  186 ? 0.31572911 0.34388918 0.32731128 -0.00905047 -0.07204898 0.01284570  241  PHE   A O    
2783  C  CB   . PHE   A  186 ? 0.30841756 0.36416632 0.33683074 -0.01648147 -0.06233503 0.00797301  241  PHE   A CB   
2784  C  CG   . PHE   A  186 ? 0.29839444 0.35252124 0.32171470 -0.02271153 -0.06277069 0.01074212  241  PHE   A CG   
2785  C  CD1  . PHE   A  186 ? 0.30543315 0.34738851 0.31764051 -0.02449503 -0.06481874 0.01421924  241  PHE   A CD1  
2786  C  CD2  . PHE   A  186 ? 0.24501216 0.30953902 0.27439156 -0.02698452 -0.06083733 0.00970331  241  PHE   A CD2  
2787  C  CE1  . PHE   A  186 ? 0.26759592 0.30819839 0.27511877 -0.02973365 -0.06484182 0.01620173  241  PHE   A CE1  
2788  C  CE2  . PHE   A  186 ? 0.23860376 0.30050457 0.26276749 -0.03241659 -0.06118087 0.01184915  241  PHE   A CE2  
2789  C  CZ   . PHE   A  186 ? 0.32378942 0.37385428 0.33707502 -0.03352159 -0.06304365 0.01491099  241  PHE   A CZ   
2790  H  H    . PHE   A  186 ? 0.34168839 0.38993841 0.37185806 -0.00434738 -0.06494273 0.00481969  241  PHE   A H    
2791  H  HA   . PHE   A  186 ? 0.35097176 0.41348022 0.38877380 -0.00923783 -0.07105218 0.00689563  241  PHE   A HA   
2792  H  HB2  . PHE   A  186 ? 0.31597394 0.38097441 0.35151055 -0.01667103 -0.05944990 0.00554888  241  PHE   A HB2  
2793  H  HB3  . PHE   A  186 ? 0.32181919 0.37030590 0.34458217 -0.01654002 -0.06035395 0.00848628  241  PHE   A HB3  
2794  H  HD1  . PHE   A  186 ? 0.29956856 0.33403650 0.30730501 -0.02213502 -0.06609137 0.01512636  241  PHE   A HD1  
2795  H  HD2  . PHE   A  186 ? 0.25340948 0.32676190 0.29044995 -0.02628057 -0.05907640 0.00739145  241  PHE   A HD2  
2796  H  HE1  . PHE   A  186 ? 0.29051495 0.32337603 0.29059708 -0.03088073 -0.06586751 0.01837698  241  PHE   A HE1  
2797  H  HE2  . PHE   A  186 ? 0.25411695 0.32244152 0.28220108 -0.03548480 -0.05999744 0.01109328  241  PHE   A HE2  
2798  H  HZ   . PHE   A  186 ? 0.28784817 0.33634543 0.29766685 -0.03690997 -0.06325264 0.01606789  241  PHE   A HZ   
2799  N  N    . HIS   A  187 ? 0.37639791 0.41552216 0.39460355 -0.00967290 -0.07875326 0.01369384  242  HIS   A N    
2800  C  CA   . HIS   A  187 ? 0.39222279 0.41821808 0.39932230 -0.00938919 -0.08361100 0.01759608  242  HIS   A CA   
2801  C  C    . HIS   A  187 ? 0.42530131 0.45311654 0.42904580 -0.01426308 -0.08562860 0.01959898  242  HIS   A C    
2802  O  O    . HIS   A  187 ? 0.42300710 0.46256188 0.43519375 -0.01531749 -0.08625195 0.01769673  242  HIS   A O    
2803  C  CB   . HIS   A  187 ? 0.36833781 0.39116254 0.37740535 -0.00188982 -0.09018596 0.01751876  242  HIS   A CB   
2804  C  CG   . HIS   A  187 ? 0.42526945 0.44206381 0.43450791 0.00316194  -0.08900727 0.01595517  242  HIS   A CG   
2805  N  ND1  . HIS   A  187 ? 0.66064155 0.66528523 0.66006500 0.00066653  -0.08568290 0.01758913  242  HIS   A ND1  
2806  C  CD2  . HIS   A  187 ? 0.45565259 0.47739387 0.47391999 0.01031184  -0.09048556 0.01254577  242  HIS   A CD2  
2807  C  CE1  . HIS   A  187 ? 0.49456388 0.49593532 0.49642855 0.00621335  -0.08557715 0.01521108  242  HIS   A CE1  
2808  N  NE2  . HIS   A  187 ? 0.63480294 0.64598119 0.64780897 0.01244227  -0.08829795 0.01204371  242  HIS   A NE2  
2809  H  H    . HIS   A  187 ? 0.36888286 0.41681662 0.39333296 -0.01038953 -0.07940478 0.01255160  242  HIS   A H    
2810  H  HA   . HIS   A  187 ? 0.39144906 0.40929121 0.39165300 -0.01102929 -0.08130669 0.01892642  242  HIS   A HA   
2811  H  HB2  . HIS   A  187 ? 0.38610202 0.41853714 0.40364152 0.00017958  -0.09208368 0.01563983  242  HIS   A HB2  
2812  H  HB3  . HIS   A  187 ? 0.39310282 0.40812889 0.39472747 -0.00230602 -0.09381439 0.02037807  242  HIS   A HB3  
2814  H  HD2  . HIS   A  187 ? 0.48136196 0.51194280 0.50791907 0.01336339  -0.09276828 0.01075363  242  HIS   A HD2  
2815  H  HE1  . HIS   A  187 ? 0.56008029 0.55348998 0.55671430 0.00583531  -0.08387107 0.01553732  242  HIS   A HE1  
2817  N  N    . LEU   A  188 ? 0.44695014 0.46341574 0.43837246 -0.01754885 -0.08636115 0.02319547  243  LEU   A N    
2818  C  CA   . LEU   A  188 ? 0.65252787 0.66946626 0.63924134 -0.02210734 -0.08790314 0.02481354  243  LEU   A CA   
2819  C  C    . LEU   A  188 ? 0.88113058 0.90316772 0.87175465 -0.01926564 -0.09494387 0.02459567  243  LEU   A C    
2820  O  O    . LEU   A  188 ? 0.70733386 0.73505849 0.69905061 -0.02273126 -0.09603710 0.02417349  243  LEU   A O    
2821  C  CB   . LEU   A  188 ? 0.59102339 0.59477013 0.56355113 -0.02521340 -0.08774351 0.02860115  243  LEU   A CB   
2822  C  CG   . LEU   A  188 ? 0.76913399 0.76914907 0.73716569 -0.02962528 -0.08115412 0.02905810  243  LEU   A CG   
2823  C  CD1  . LEU   A  188 ? 0.81158233 0.80335808 0.76788163 -0.03372634 -0.08101965 0.03209405  243  LEU   A CD1  
2824  C  CD2  . LEU   A  188 ? 0.71702862 0.72726679 0.69287419 -0.03266907 -0.07610750 0.02626308  243  LEU   A CD2  
2825  H  H    . LEU   A  188 ? 0.48415729 0.49246863 0.46992779 -0.01701179 -0.08578292 0.02452657  243  LEU   A H    
2826  H  HA   . LEU   A  188 ? 0.61906630 0.64193738 0.60922581 -0.02530793 -0.08443087 0.02345548  243  LEU   A HA   
2827  H  HB2  . LEU   A  188 ? 0.64987564 0.64693034 0.61877567 -0.02232009 -0.09042262 0.03002009  243  LEU   A HB2  
2828  H  HB3  . LEU   A  188 ? 0.64805073 0.65186721 0.61728865 -0.02712783 -0.08986612 0.02951481  243  LEU   A HB3  
2829  H  HG   . LEU   A  188 ? 0.72468460 0.72057915 0.69207144 -0.02780468 -0.08014072 0.02918300  243  LEU   A HG   
2830  H  HD11 . LEU   A  188 ? 0.79280400 0.78143167 0.74624068 -0.03577128 -0.07732132 0.03257093  243  LEU   A HD11 
2831  H  HD12 . LEU   A  188 ? 0.79638284 0.79200047 0.75298882 -0.03595449 -0.08112816 0.03160373  243  LEU   A HD12 
2832  H  HD13 . LEU   A  188 ? 0.80479974 0.79052770 0.75591308 -0.03214993 -0.08453117 0.03400955  243  LEU   A HD13 
2833  H  HD21 . LEU   A  188 ? 0.72328371 0.73797679 0.70563728 -0.03041015 -0.07501953 0.02440993  243  LEU   A HD21 
2834  H  HD22 . LEU   A  188 ? 0.72460306 0.73966259 0.70261383 -0.03398052 -0.07754480 0.02568914  243  LEU   A HD22 
2835  H  HD23 . LEU   A  188 ? 0.71909851 0.72629428 0.69094360 -0.03560475 -0.07264201 0.02693012  243  LEU   A HD23 
2836  N  N    . ARG   A  189 ? 0.68156219 0.70112962 0.67413795 -0.01285126 -0.09998327 0.02477768  244  ARG   A N    
2837  C  CA   . ARG   A  189 ? 0.91583377 0.94013196 0.91257429 -0.00911171 -0.10753928 0.02461588  244  ARG   A CA   
2838  C  C    . ARG   A  189 ? 0.94425011 0.98242331 0.95712215 -0.00416522 -0.10793769 0.02045458  244  ARG   A C    
2839  O  O    . ARG   A  189 ? 0.80576777 0.84461689 0.82328337 -0.00116510 -0.10419510 0.01852807  244  ARG   A O    
2840  C  CB   . ARG   A  189 ? 1.02031100 1.03056026 1.00617623 -0.00536902 -0.11373744 0.02835320  244  ARG   A CB   
2841  C  CG   . ARG   A  189 ? 1.11215520 1.10898304 1.08180261 -0.01078882 -0.11210393 0.03243361  244  ARG   A CG   
2842  C  CD   . ARG   A  189 ? 1.24329102 1.24349391 1.20880198 -0.01639543 -0.11248390 0.03294398  244  ARG   A CD   
2843  N  NE   . ARG   A  189 ? 1.25587761 1.24910676 1.21117389 -0.02250895 -0.10690591 0.03470462  244  ARG   A NE   
2844  C  CZ   . ARG   A  189 ? 1.23600054 1.23148453 1.18749356 -0.02776470 -0.10525274 0.03452740  244  ARG   A CZ   
2845  N  NH1  . ARG   A  189 ? 1.14999044 1.15370512 1.10606849 -0.02839627 -0.10889309 0.03284335  244  ARG   A NH1  
2846  N  NH2  . ARG   A  189 ? 0.81351119 0.80302042 0.75672394 -0.03243620 -0.09989890 0.03581269  244  ARG   A NH2  
2847  H  H    . ARG   A  189 ? 0.76864642 0.78300005 0.75966740 -0.01063278 -0.09893159 0.02501880  244  ARG   A H    
2848  H  HA   . ARG   A  189 ? 0.88430196 0.91191095 0.88007438 -0.01259170 -0.10829694 0.02478608  244  ARG   A HA   
2849  H  HB2  . ARG   A  189 ? 1.01983356 1.02680063 1.00725770 -0.00152218 -0.11357656 0.02794737  244  ARG   A HB2  
2850  H  HB3  . ARG   A  189 ? 1.02205133 1.03514099 1.00982428 -0.00311925 -0.11918428 0.02849174  244  ARG   A HB3  
2851  H  HG2  . ARG   A  189 ? 1.11306477 1.10747886 1.08129561 -0.01290873 -0.10696160 0.03226250  244  ARG   A HG2  
2852  H  HG3  . ARG   A  189 ? 1.12881052 1.11666369 1.09159994 -0.00853459 -0.11590748 0.03489825  244  ARG   A HG3  
2853  H  HD2  . ARG   A  189 ? 1.22032988 1.21746993 1.18143761 -0.01509412 -0.11784620 0.03454930  244  ARG   A HD2  
2854  H  HD3  . ARG   A  189 ? 1.20242596 1.21289432 1.17667818 -0.01712586 -0.11146485 0.03032145  244  ARG   A HD3  
2855  H  HE   . ARG   A  189 ? 1.23973525 1.22695887 1.19129884 -0.02262112 -0.10455358 0.03580760  244  ARG   A HE   
2856  H  HH11 . ARG   A  189 ? 1.18075871 1.18540585 1.13793421 -0.02568257 -0.11392657 0.03312457  244  ARG   A HH11 
2857  H  HH12 . ARG   A  189 ? 1.16833818 1.17639780 1.12628174 -0.03158048 -0.10644024 0.03144010  244  ARG   A HH12 
2858  H  HH21 . ARG   A  189 ? 0.92595130 0.91645569 0.86635917 -0.03554656 -0.09887942 0.03555869  244  ARG   A HH21 
2859  H  HH22 . ARG   A  189 ? 0.92797214 0.91269469 0.86871725 -0.03234030 -0.09745960 0.03678923  244  ARG   A HH22 
2860  N  N    . GLY   A  190 ? 0.80641836 0.85615230 0.82777458 -0.00368357 -0.11230244 0.01885830  245  GLY   A N    
2861  C  CA   . GLY   A  190 ? 0.72390878 0.79017824 0.76216334 -0.00049055 -0.11194918 0.01454390  245  GLY   A CA   
2862  C  C    . GLY   A  190 ? 0.57108408 0.64906228 0.61593932 -0.00740345 -0.10634541 0.01231640  245  GLY   A C    
2863  O  O    . GLY   A  190 ? 0.59102613 0.66285169 0.62715274 -0.01371841 -0.10217653 0.01395465  245  GLY   A O    
2864  H  H    . GLY   A  190 ? 0.82206690 0.86952889 0.83846140 -0.00556960 -0.11562487 0.02045157  245  GLY   A H    
2865  H  HA2  . GLY   A  190 ? 0.71017456 0.78041595 0.75241947 0.00271746  -0.11776643 0.01429497  245  GLY   A HA2  
2866  H  HA3  . GLY   A  190 ? 0.70649689 0.77238607 0.74794590 0.00305184  -0.10968072 0.01324940  245  GLY   A HA3  
2867  N  N    . ARG   A  191 ? 0.54749501 0.64220774 0.60776418 -0.00615094 -0.10645237 0.00862260  246  ARG   A N    
2868  C  CA   . ARG   A  191 ? 0.60360605 0.70987082 0.67054075 -0.01309832 -0.10251980 0.00672461  246  ARG   A CA   
2869  C  C    . ARG   A  191 ? 0.54893053 0.65983456 0.62029940 -0.01562775 -0.09340703 0.00466693  246  ARG   A C    
2870  O  O    . ARG   A  191 ? 0.41723740 0.53455985 0.49139208 -0.02223134 -0.08915187 0.00377682  246  ARG   A O    
2871  C  CB   . ARG   A  191 ? 0.76570916 0.88866371 0.84714532 -0.01168670 -0.10757447 0.00394518  246  ARG   A CB   
2872  C  CG   . ARG   A  191 ? 0.95508021 1.08431458 1.03759980 -0.02006406 -0.10729890 0.00360985  246  ARG   A CG   
2873  C  CD   . ARG   A  191 ? 0.86691028 1.00953364 0.96029598 -0.01956698 -0.11437068 0.00174034  246  ARG   A CD   
2874  N  NE   . ARG   A  191 ? 0.83972108 0.97997022 0.93302554 -0.01170621 -0.12316024 0.00263507  246  ARG   A NE   
2875  C  CZ   . ARG   A  191 ? 1.13994014 1.28717637 1.23801970 -0.01067071 -0.13153248 0.00216738  246  ARG   A CZ   
2876  N  NH1  . ARG   A  191 ? 1.25225198 1.38814521 1.33883953 -0.00842067 -0.13918880 0.00523834  246  ARG   A NH1  
2877  N  NH2  . ARG   A  191 ? 0.80047393 0.96711248 0.91599363 -0.01093281 -0.13261144 -0.00155068 246  ARG   A NH2  
2878  H  H    . ARG   A  191 ? 0.57027888 0.66930282 0.63716078 -0.00087156 -0.10904997 0.00723032  246  ARG   A H    
2879  H  HA   . ARG   A  191 ? 0.61129057 0.71132654 0.66991538 -0.01754943 -0.10269905 0.00865084  246  ARG   A HA   
2880  H  HB2  . ARG   A  191 ? 0.76753950 0.88779050 0.84760356 -0.00753535 -0.11373123 0.00488548  246  ARG   A HB2  
2881  H  HB3  . ARG   A  191 ? 0.75762653 0.89002115 0.84920216 -0.00936719 -0.10504096 0.00131409  246  ARG   A HB3  
2882  H  HG2  . ARG   A  191 ? 0.88018304 1.01451743 0.96670032 -0.02361273 -0.10157865 0.00224435  246  ARG   A HG2  
2883  H  HG3  . ARG   A  191 ? 0.88579315 1.00463629 0.95713317 -0.02293193 -0.10786640 0.00599747  246  ARG   A HG3  
2884  H  HD2  . ARG   A  191 ? 0.87383848 1.02908099 0.97910279 -0.01980155 -0.11197317 -0.00097970 246  ARG   A HD2  
2885  H  HD3  . ARG   A  191 ? 0.87812948 1.01918721 0.96720040 -0.02472052 -0.11551768 0.00246889  246  ARG   A HD3  
2886  H  HE   . ARG   A  191 ? 0.91011190 1.04357600 0.99972755 -0.00740242 -0.12318933 0.00359993  246  ARG   A HE   
2887  H  HH11 . ARG   A  191 ? 1.21737623 1.34105062 1.29326797 -0.00756289 -0.13856836 0.00765682  246  ARG   A HH11 
2888  H  HH12 . ARG   A  191 ? 1.21557903 1.35624480 1.30510068 -0.00794843 -0.14487331 0.00488080  246  ARG   A HH12 
2889  H  HH21 . ARG   A  191 ? 0.89781904 1.06957746 1.01634777 -0.01172815 -0.13774191 -0.00195442 246  ARG   A HH21 
2890  H  HH22 . ARG   A  191 ? 0.88657755 1.06111717 1.01058722 -0.01045524 -0.12814400 -0.00364556 246  ARG   A HH22 
2891  N  N    . GLU   A  192 ? 0.46787253 0.57442772 0.53883374 -0.01051790 -0.09067868 0.00401787  247  GLU   A N    
2892  C  CA   . GLU   A  192 ? 0.52609974 0.63595533 0.59983385 -0.01234695 -0.08231785 0.00206245  247  GLU   A CA   
2893  C  C    . GLU   A  192 ? 0.37317678 0.47765523 0.43841583 -0.02069920 -0.07707905 0.00395972  247  GLU   A C    
2894  O  O    . GLU   A  192 ? 0.56766748 0.68080801 0.63838881 -0.02529335 -0.07165086 0.00227554  247  GLU   A O    
2895  C  CB   . GLU   A  192 ? 0.42816895 0.52845752 0.49744889 -0.00624330 -0.08094838 0.00192370  247  GLU   A CB   
2896  C  CG   . GLU   A  192 ? 0.51199061 0.61710894 0.58532423 -0.00662475 -0.07301785 -0.00090923 247  GLU   A CG   
2897  C  CD   . GLU   A  192 ? 0.56948376 0.69377500 0.65861839 -0.00606784 -0.07011048 -0.00523958 247  GLU   A CD   
2898  O  OE1  . GLU   A  192 ? 0.72418857 0.85745800 0.82375044 -0.00007415 -0.07459876 -0.00751197 247  GLU   A OE1  
2899  O  OE2  . GLU   A  192 ? 0.40019998 0.53079414 0.49135959 -0.01173399 -0.06343238 -0.00628296 247  GLU   A OE2  
2900  H  H    . GLU   A  192 ? 0.50622594 0.60717428 0.57467377 -0.00577928 -0.09428196 0.00480434  247  GLU   A H    
2901  H  HA   . GLU   A  192 ? 0.46136695 0.58361417 0.54580551 -0.01198750 -0.08100222 -0.00065368 247  GLU   A HA   
2902  H  HB2  . GLU   A  192 ? 0.47347361 0.57539129 0.54699093 -0.00063316 -0.08512092 0.00104318  247  GLU   A HB2  
2903  H  HB3  . GLU   A  192 ? 0.47210276 0.56055164 0.53089327 -0.00747971 -0.08151808 0.00463549  247  GLU   A HB3  
2904  H  HG2  . GLU   A  192 ? 0.50373667 0.60264742 0.57441044 -0.00230702 -0.07307856 -0.00124700 247  GLU   A HG2  
2905  H  HG3  . GLU   A  192 ? 0.49119669 0.59231585 0.55860704 -0.01170007 -0.06931565 0.00042388  247  GLU   A HG3  
2906  N  N    . LYS   A  193 ? 0.41939473 0.50957799 0.47120440 -0.02254456 -0.07892557 0.00750619  248  LYS   A N    
2907  C  CA   . LYS   A  193 ? 0.42828688 0.51124227 0.47085059 -0.02912662 -0.07446240 0.00943949  248  LYS   A CA   
2908  C  C    . LYS   A  193 ? 0.43818831 0.52921504 0.48470375 -0.03583398 -0.07272062 0.00862964  248  LYS   A C    
2909  O  O    . LYS   A  193 ? 0.48601082 0.57333481 0.52745581 -0.04100322 -0.06793441 0.00944531  248  LYS   A O    
2910  C  CB   . LYS   A  193 ? 0.40488830 0.47306255 0.43378371 -0.02924694 -0.07794539 0.01307768  248  LYS   A CB   
2911  C  CG   . LYS   A  193 ? 0.61150366 0.67941803 0.63828462 -0.02961840 -0.08469569 0.01424162  248  LYS   A CG   
2912  C  CD   . LYS   A  193 ? 0.46593994 0.51940680 0.47800651 -0.03083168 -0.08679459 0.01782809  248  LYS   A CD   
2913  C  CE   . LYS   A  193 ? 0.46761578 0.52029419 0.47640121 -0.03080759 -0.09380117 0.01892194  248  LYS   A CE   
2914  N  NZ   . LYS   A  193 ? 0.42209613 0.47665602 0.43536156 -0.02407999 -0.10029313 0.01883076  248  LYS   A NZ   
2915  H  H    . LYS   A  193 ? 0.41932362 0.50403351 0.46759683 -0.01936165 -0.08320416 0.00875898  248  LYS   A H    
2916  H  HA   . LYS   A  193 ? 0.41948730 0.50084174 0.46123272 -0.02906459 -0.07012777 0.00898263  248  LYS   A HA   
2917  H  HB2  . LYS   A  193 ? 0.44784167 0.51123619 0.47090715 -0.03301160 -0.07466399 0.01416051  248  LYS   A HB2  
2918  H  HB3  . LYS   A  193 ? 0.45332518 0.51602888 0.47967815 -0.02540170 -0.07882439 0.01366005  248  LYS   A HB3  
2919  H  HG2  . LYS   A  193 ? 0.52243698 0.59418458 0.55436981 -0.02541037 -0.08852102 0.01344643  248  LYS   A HG2  
2920  H  HG3  . LYS   A  193 ? 0.51785702 0.59167135 0.54789943 -0.03333392 -0.08412246 0.01331338  248  LYS   A HG3  
2921  H  HD2  . LYS   A  193 ? 0.49224830 0.54272854 0.49988133 -0.03483868 -0.08317862 0.01838518  248  LYS   A HD2  
2922  H  HD3  . LYS   A  193 ? 0.49795666 0.54511756 0.50648373 -0.02775714 -0.08702237 0.01889540  248  LYS   A HD3  
2923  H  HE2  . LYS   A  193 ? 0.45348158 0.51293886 0.46659315 -0.03369582 -0.09397705 0.01754803  248  LYS   A HE2  
2924  H  HE3  . LYS   A  193 ? 0.45892885 0.50287324 0.45791936 -0.03242907 -0.09412930 0.02105249  248  LYS   A HE3  
2925  H  HZ1  . LYS   A  193 ? 0.43637145 0.50046271 0.45933980 -0.02278581 -0.10063639 0.01661821  248  LYS   A HZ1  
2926  H  HZ2  . LYS   A  193 ? 0.44027245 0.48924232 0.45092890 -0.02124234 -0.09970891 0.01968644  248  LYS   A HZ2  
2927  H  HZ3  . LYS   A  193 ? 0.44300050 0.49466109 0.45181233 -0.02404053 -0.10463800 0.02009748  248  LYS   A HZ3  
2928  N  N    . PHE   A  194 ? 0.33504969 0.43662786 0.39041117 -0.03583146 -0.07700284 0.00706855  249  PHE   A N    
2929  C  CA   . PHE   A  194 ? 0.51455456 0.62352633 0.57386649 -0.04262683 -0.07579862 0.00615949  249  PHE   A CA   
2930  C  C    . PHE   A  194 ? 0.45468572 0.57558310 0.52430713 -0.04512557 -0.06958555 0.00359153  249  PHE   A C    
2931  O  O    . PHE   A  194 ? 0.52531523 0.65003294 0.59637606 -0.05179216 -0.06691215 0.00327431  249  PHE   A O    
2932  C  CB   . PHE   A  194 ? 0.60463852 0.72083455 0.66957390 -0.04238218 -0.08314073 0.00534507  249  PHE   A CB   
2933  C  CG   . PHE   A  194 ? 0.81207746 0.91647589 0.86510903 -0.04196185 -0.08898004 0.00799609  249  PHE   A CG   
2934  C  CD1  . PHE   A  194 ? 0.55641812 0.65322131 0.59985220 -0.04795935 -0.08833078 0.00936541  249  PHE   A CD1  
2935  C  CD2  . PHE   A  194 ? 0.93438399 1.03464603 0.98510927 -0.03547750 -0.09497008 0.00910973  249  PHE   A CD2  
2936  C  CE1  . PHE   A  194 ? 0.83350456 0.91984785 0.86545849 -0.04762563 -0.09309495 0.01153303  249  PHE   A CE1  
2937  C  CE2  . PHE   A  194 ? 0.98022199 1.06939888 1.01887429 -0.03556537 -0.09999107 0.01176856  249  PHE   A CE2  
2938  C  CZ   . PHE   A  194 ? 1.02240992 1.10509050 1.05174196 -0.04170413 -0.09875647 0.01285400  249  PHE   A CZ   
2939  H  H    . PHE   A  194 ? 0.39837423 0.50226140 0.45719111 -0.03163452 -0.08099207 0.00659723  249  PHE   A H    
2940  H  HA   . PHE   A  194 ? 0.47236273 0.57346189 0.52333683 -0.04622452 -0.07435906 0.00779080  249  PHE   A HA   
2941  H  HB2  . PHE   A  194 ? 0.62483549 0.74796546 0.69753289 -0.03796278 -0.08522761 0.00391987  249  PHE   A HB2  
2942  H  HB3  . PHE   A  194 ? 0.62063938 0.74315429 0.68983400 -0.04700677 -0.08202643 0.00428071  249  PHE   A HB3  
2943  H  HD1  . PHE   A  194 ? 0.66574025 0.76428789 0.71017289 -0.05224473 -0.08454344 0.00876477  249  PHE   A HD1  
2944  H  HD2  . PHE   A  194 ? 0.89952546 1.00432158 0.95662796 -0.03096573 -0.09565081 0.00804677  249  PHE   A HD2  
2945  H  HE1  . PHE   A  194 ? 0.79016358 0.87160230 0.81573707 -0.05146214 -0.09240621 0.01210536  249  PHE   A HE1  
2946  H  HE2  . PHE   A  194 ? 0.97942948 1.06524551 1.01594234 -0.03133006 -0.10415772 0.01279088  249  PHE   A HE2  
2947  H  HZ   . PHE   A  194 ? 0.96544397 1.04091406 0.98634350 -0.04178298 -0.10183891 0.01446768  249  PHE   A HZ   
2948  N  N    . ASN   A  195 ? 0.34299168 0.46974975 0.41965842 -0.03981243 -0.06746227 0.00163186  250  ASN   A N    
2949  C  CA   . ASN   A  195 ? 0.34287494 0.48233461 0.42975986 -0.04168079 -0.06147430 -0.00114728 250  ASN   A CA   
2950  C  C    . ASN   A  195 ? 0.31265879 0.44521177 0.39142433 -0.04713722 -0.05445282 0.00022615  250  ASN   A C    
2951  O  O    . ASN   A  195 ? 0.21047235 0.33069509 0.27901459 -0.04542305 -0.05289222 0.00203050  250  ASN   A O    
2952  C  CB   . ASN   A  195 ? 0.31476918 0.46070981 0.40967834 -0.03396859 -0.06082136 -0.00385171 250  ASN   A CB   
2953  C  CG   . ASN   A  195 ? 0.70881253 0.86942226 0.81474864 -0.03573449 -0.05425723 -0.00715367 250  ASN   A CG   
2954  O  OD1  . ASN   A  195 ? 0.47000772 0.63358021 0.57540917 -0.04316290 -0.04910879 -0.00683322 250  ASN   A OD1  
2955  N  ND2  . ASN   A  195 ? 0.85757643 1.02728236 0.97325748 -0.02891280 -0.05396697 -0.01044173 250  ASN   A ND2  
2956  H  H    . ASN   A  195 ? 0.36980563 0.49234328 0.44458139 -0.03491981 -0.06974603 0.00197242  250  ASN   A H    
2957  H  HA   . ASN   A  195 ? 0.33165354 0.48025578 0.42560178 -0.04453783 -0.06253909 -0.00227278 250  ASN   A HA   
2958  H  HB2  . ASN   A  195 ? 0.38901144 0.53868991 0.48879260 -0.03016721 -0.06579728 -0.00454640 250  ASN   A HB2  
2959  H  HB3  . ASN   A  195 ? 0.38803813 0.52454132 0.47579768 -0.03135010 -0.05987860 -0.00283025 250  ASN   A HB3  
2960  H  HD21 . ASN   A  195 ? 0.80368358 0.97023159 0.91917014 -0.02354577 -0.05778394 -0.01053094 250  ASN   A HD21 
2961  H  HD22 . ASN   A  195 ? 0.80242503 0.98120642 0.92465341 -0.02967192 -0.04991755 -0.01258729 250  ASN   A HD22 
2962  N  N    . HIS   A  196 ? 0.23171139 0.37227240 0.31512517 -0.05383612 -0.05047476 -0.00056237 251  HIS   A N    
2963  C  CA   . HIS   A  196 ? 0.25562030 0.38861942 0.33041424 -0.05973240 -0.04492545 0.00126108  251  HIS   A CA   
2964  C  C    . HIS   A  196 ? 0.18717077 0.31765443 0.25912347 -0.05711426 -0.03928249 0.00080169  251  HIS   A C    
2965  O  O    . HIS   A  196 ? 0.20979521 0.33037674 0.27192771 -0.05984973 -0.03592293 0.00281860  251  HIS   A O    
2966  C  CB   . HIS   A  196 ? 0.31910878 0.46072471 0.39930779 -0.06779525 -0.04214676 0.00067781  251  HIS   A CB   
2967  C  CG   . HIS   A  196 ? 0.32607055 0.48409188 0.41904533 -0.06832490 -0.03791008 -0.00235504 251  HIS   A CG   
2968  N  ND1  . HIS   A  196 ? 0.27178526 0.43086791 0.36342692 -0.06902485 -0.03092726 -0.00284045 251  HIS   A ND1  
2969  C  CD2  . HIS   A  196 ? 0.35495514 0.52910984 0.46197715 -0.06850412 -0.03968792 -0.00508849 251  HIS   A CD2  
2970  C  CE1  . HIS   A  196 ? 0.31294882 0.48873168 0.41761148 -0.06939489 -0.02817908 -0.00594993 251  HIS   A CE1  
2971  N  NE2  . HIS   A  196 ? 0.36799270 0.55380964 0.48285797 -0.06924621 -0.03326157 -0.00740268 251  HIS   A NE2  
2972  H  H    . HIS   A  196 ? 0.25672495 0.40766308 0.34891164 -0.05476481 -0.05131002 -0.00222946 251  HIS   A H    
2973  H  HA   . HIS   A  196 ? 0.24604532 0.36887869 0.31234202 -0.06044735 -0.04691837 0.00333057  251  HIS   A HA   
2974  H  HB2  . HIS   A  196 ? 0.30517292 0.43972635 0.37824559 -0.07146598 -0.03928576 0.00230009  251  HIS   A HB2  
2975  H  HB3  . HIS   A  196 ? 0.30762836 0.45051450 0.38943166 -0.06943171 -0.04609094 0.00076713  251  HIS   A HB3  
2977  H  HD2  . HIS   A  196 ? 0.35223466 0.52930778 0.46288359 -0.06825334 -0.04443453 -0.00540708 251  HIS   A HD2  
2978  H  HE1  . HIS   A  196 ? 0.31461069 0.49488714 0.42101485 -0.07003297 -0.02321840 -0.00701802 251  HIS   A HE1  
2980  N  N    . ARG   A  197 ? 0.23509678 0.37421417 0.31538510 -0.05141537 -0.03852038 -0.00204210 252  ARG   A N    
2981  C  CA   . ARG   A  197 ? 0.26014405 0.39776391 0.33797699 -0.04916152 -0.03291196 -0.00313925 252  ARG   A CA   
2982  C  C    . ARG   A  197 ? 0.23388733 0.35486352 0.29826856 -0.04725398 -0.03319844 -0.00063452 252  ARG   A C    
2983  O  O    . ARG   A  197 ? 0.30805874 0.42520300 0.36713672 -0.04822477 -0.02828802 -0.00058463 252  ARG   A O    
2984  C  CB   . ARG   A  197 ? 0.23888731 0.38752842 0.32766590 -0.04218633 -0.03283235 -0.00705454 252  ARG   A CB   
2985  C  CG   . ARG   A  197 ? 0.24869475 0.39157629 0.33697307 -0.03421536 -0.03926574 -0.00713808 252  ARG   A CG   
2986  C  CD   . ARG   A  197 ? 0.29073483 0.44430625 0.38984564 -0.02725391 -0.03855245 -0.01133144 252  ARG   A CD   
2987  N  NE   . ARG   A  197 ? 0.34213194 0.49060649 0.44167364 -0.01942809 -0.04544979 -0.01138997 252  ARG   A NE   
2988  C  CZ   . ARG   A  197 ? 0.21319205 0.36680853 0.32018948 -0.01140074 -0.04650002 -0.01475408 252  ARG   A CZ   
2989  N  NH1  . ARG   A  197 ? 0.21225730 0.37668705 0.32698226 -0.00964056 -0.04060538 -0.01880233 252  ARG   A NH1  
2990  N  NH2  . ARG   A  197 ? 0.26289243 0.41059083 0.36940390 -0.00484937 -0.05369629 -0.01411874 252  ARG   A NH2  
2991  H  H    . ARG   A  197 ? 0.22842732 0.37449870 0.31598210 -0.04880304 -0.04155172 -0.00348148 252  ARG   A H    
2992  H  HA   . ARG   A  197 ? 0.24481374 0.38576901 0.32288134 -0.05379327 -0.02859942 -0.00318022 252  ARG   A HA   
2993  H  HB2  . ARG   A  197 ? 0.24628823 0.39499933 0.33366251 -0.04147873 -0.02844822 -0.00815978 252  ARG   A HB2  
2994  H  HB3  . ARG   A  197 ? 0.24523282 0.40539411 0.34323442 -0.04366386 -0.03266835 -0.00867246 252  ARG   A HB3  
2995  H  HG2  . ARG   A  197 ? 0.25716946 0.40052307 0.34689218 -0.03471242 -0.04377153 -0.00615535 252  ARG   A HG2  
2996  H  HG3  . ARG   A  197 ? 0.25647557 0.38796520 0.33568436 -0.03311364 -0.03945789 -0.00547154 252  ARG   A HG3  
2997  H  HD2  . ARG   A  197 ? 0.29008386 0.44191164 0.38658002 -0.02642901 -0.03425479 -0.01239176 252  ARG   A HD2  
2998  H  HD3  . ARG   A  197 ? 0.28891936 0.45497847 0.39760038 -0.02875931 -0.03760146 -0.01316182 252  ARG   A HD3  
2999  H  HE   . ARG   A  197 ? 0.29059213 0.43172711 0.38480052 -0.01998288 -0.04922754 -0.00902136 252  ARG   A HE   
3000  H  HH11 . ARG   A  197 ? 0.21109423 0.38303292 0.32902810 -0.01403203 -0.03652370 -0.01949265 252  ARG   A HH11 
3001  H  HH12 . ARG   A  197 ? 0.21632528 0.38022897 0.33272207 -0.00409891 -0.04072608 -0.02084061 252  ARG   A HH12 
3002  H  HH21 . ARG   A  197 ? 0.25012058 0.40470436 0.36460382 -0.00003580 -0.05566353 -0.01639412 252  ARG   A HH21 
3003  H  HH22 . ARG   A  197 ? 0.25107253 0.38791680 0.34918553 -0.00529220 -0.05647043 -0.01140101 252  ARG   A HH22 
3004  N  N    . TRP   A  198 ? 0.18994379 0.30103320 0.24823323 -0.04526725 -0.03879832 0.00159348  253  TRP   A N    
3005  C  CA   . TRP   A  198 ? 0.18154454 0.27817971 0.22834784 -0.04330351 -0.03912466 0.00373401  253  TRP   A CA   
3006  C  C    . TRP   A  198 ? 0.23751786 0.32543281 0.27465707 -0.04917527 -0.03694219 0.00658450  253  TRP   A C    
3007  O  O    . TRP   A  198 ? 0.20970413 0.28781664 0.23836678 -0.04851818 -0.03561414 0.00797581  253  TRP   A O    
3008  C  CB   . TRP   A  198 ? 0.21736392 0.30639467 0.26070058 -0.03886335 -0.04572859 0.00518121  253  TRP   A CB   
3009  C  CG   . TRP   A  198 ? 0.20801052 0.30252111 0.25909123 -0.03190736 -0.04878153 0.00278288  253  TRP   A CG   
3010  C  CD1  . TRP   A  198 ? 0.21114397 0.31533349 0.27179778 -0.02954776 -0.05307143 0.00130911  253  TRP   A CD1  
3011  C  CD2  . TRP   A  198 ? 0.24511176 0.33469546 0.29456413 -0.02600340 -0.04843426 0.00157712  253  TRP   A CD2  
3012  N  NE1  . TRP   A  198 ? 0.22048138 0.32683244 0.28633010 -0.02206859 -0.05514531 -0.00087137 253  TRP   A NE1  
3013  C  CE2  . TRP   A  198 ? 0.24031007 0.33716980 0.29904771 -0.01978073 -0.05224567 -0.00081013 253  TRP   A CE2  
3014  C  CE3  . TRP   A  198 ? 0.20493484 0.28483254 0.24622998 -0.02537820 -0.04537039 0.00202981  253  TRP   A CE3  
3015  C  CZ2  . TRP   A  198 ? 0.23859355 0.33199102 0.29797509 -0.01271038 -0.05306928 -0.00269857 253  TRP   A CZ2  
3016  C  CZ3  . TRP   A  198 ? 0.25515980 0.33189696 0.29706529 -0.01892016 -0.04615770 0.00006588  253  TRP   A CZ3  
3017  C  CH2  . TRP   A  198 ? 0.21434917 0.29718816 0.26489496 -0.01257689 -0.04996366 -0.00223173 253  TRP   A CH2  
3018  H  H    . TRP   A  198 ? 0.19767350 0.31127113 0.25896040 -0.04525775 -0.04243108 0.00174276  253  TRP   A H    
3019  H  HA   . TRP   A  198 ? 0.19968258 0.29645464 0.24669474 -0.04079379 -0.03663692 0.00240278  253  TRP   A HA   
3020  H  HB2  . TRP   A  198 ? 0.20616014 0.29543346 0.24920759 -0.04120981 -0.04825552 0.00625410  253  TRP   A HB2  
3021  H  HB3  . TRP   A  198 ? 0.20732307 0.28698266 0.24292174 -0.03850776 -0.04550743 0.00675324  253  TRP   A HB3  
3022  H  HD1  . TRP   A  198 ? 0.21111767 0.32036224 0.27491683 -0.03260677 -0.05431754 0.00148362  253  TRP   A HD1  
3023  H  HE1  . TRP   A  198 ? 0.22834027 0.34084311 0.30085438 -0.01914070 -0.05807804 -0.00214349 253  TRP   A HE1  
3024  H  HE3  . TRP   A  198 ? 0.22102889 0.29648080 0.25652361 -0.02922298 -0.04300960 0.00354388  253  TRP   A HE3  
3025  H  HZ2  . TRP   A  198 ? 0.23627847 0.33422107 0.30193508 -0.00811363 -0.05597266 -0.00429170 253  TRP   A HZ2  
3026  H  HZ3  . TRP   A  198 ? 0.23396608 0.30394650 0.27021804 -0.01869770 -0.04431657 0.00023642  253  TRP   A HZ3  
3027  H  HH2  . TRP   A  198 ? 0.23428717 0.31408778 0.28482020 -0.00799690 -0.05048928 -0.00366588 253  TRP   A HH2  
3028  N  N    . TRP   A  199 ? 0.25784463 0.34932864 0.29659301 -0.05470902 -0.03692916 0.00727848  254  TRP   A N    
3029  C  CA   . TRP   A  199 ? 0.20497495 0.28716919 0.23468545 -0.05947096 -0.03663830 0.00998950  254  TRP   A CA   
3030  C  C    . TRP   A  199 ? 0.22213751 0.30568004 0.25048539 -0.06462398 -0.03108370 0.01025136  254  TRP   A C    
3031  O  O    . TRP   A  199 ? 0.20746520 0.29982728 0.24220191 -0.06850444 -0.02932628 0.00918877  254  TRP   A O    
3032  C  CB   . TRP   A  199 ? 0.21790713 0.30049199 0.24838102 -0.06203145 -0.04112459 0.01063359  254  TRP   A CB   
3033  C  CG   . TRP   A  199 ? 0.21305962 0.29437572 0.24418342 -0.05714826 -0.04693415 0.01060515  254  TRP   A CG   
3034  C  CD1  . TRP   A  199 ? 0.21906212 0.30947840 0.25933444 -0.05338071 -0.05002736 0.00862411  254  TRP   A CD1  
3035  C  CD2  . TRP   A  199 ? 0.18713099 0.25726530 0.20906073 -0.05523279 -0.05015244 0.01275352  254  TRP   A CD2  
3036  N  NE1  . TRP   A  199 ? 0.22900540 0.31356877 0.26558757 -0.04922629 -0.05538578 0.00968322  254  TRP   A NE1  
3037  C  CE2  . TRP   A  199 ? 0.21729691 0.28940430 0.24236847 -0.05059514 -0.05533075 0.01227846  254  TRP   A CE2  
3038  C  CE3  . TRP   A  199 ? 0.18985124 0.24890190 0.20139629 -0.05690724 -0.04909015 0.01500568  254  TRP   A CE3  
3039  C  CZ2  . TRP   A  199 ? 0.28704268 0.34968466 0.30412820 -0.04831064 -0.05933953 0.01430086  254  TRP   A CZ2  
3040  C  CZ3  . TRP   A  199 ? 0.23399274 0.28499007 0.23866463 -0.05472460 -0.05265906 0.01665550  254  TRP   A CZ3  
3041  C  CH2  . TRP   A  199 ? 0.23620260 0.28858241 0.24310333 -0.05067044 -0.05760236 0.01645288  254  TRP   A CH2  
3042  H  H    . TRP   A  199 ? 0.23826553 0.33830053 0.28417325 -0.05548911 -0.03716634 0.00587257  254  TRP   A H    
3043  H  HA   . TRP   A  199 ? 0.21999310 0.29416022 0.24337873 -0.05759390 -0.03730569 0.01123468  254  TRP   A HA   
3044  H  HB2  . TRP   A  199 ? 0.21350566 0.30388021 0.25014290 -0.06453840 -0.04046891 0.00946611  254  TRP   A HB2  
3045  H  HB3  . TRP   A  199 ? 0.21383211 0.28955519 0.23787570 -0.06464377 -0.04083229 0.01220925  254  TRP   A HB3  
3046  H  HD1  . TRP   A  199 ? 0.21854046 0.31814858 0.26661974 -0.05356670 -0.04867737 0.00679469  254  TRP   A HD1  
3047  H  HE1  . TRP   A  199 ? 0.22614430 0.31453252 0.26709169 -0.04624270 -0.05845699 0.00885699  254  TRP   A HE1  
3048  H  HE3  . TRP   A  199 ? 0.19791326 0.25525379 0.20721152 -0.05965003 -0.04605037 0.01541118  254  TRP   A HE3  
3049  H  HZ2  . TRP   A  199 ? 0.25893217 0.32237139 0.27758837 -0.04525675 -0.06306251 0.01420477  254  TRP   A HZ2  
3050  H  HZ3  . TRP   A  199 ? 0.22304370 0.26743028 0.22127321 -0.05587150 -0.05172187 0.01800429  254  TRP   A HZ3  
3051  H  HH2  . TRP   A  199 ? 0.25009084 0.29636157 0.25141016 -0.04952354 -0.05983814 0.01784102  254  TRP   A HH2  
3052  N  N    . GLY   A  200 ? 0.24155062 0.31629103 0.26140267 -0.06480306 -0.02851876 0.01177685  255  GLY   A N    
3053  C  CA   . GLY   A  200 ? 0.19220921 0.26615274 0.20868066 -0.06921970 -0.02363183 0.01251784  255  GLY   A CA   
3054  C  C    . GLY   A  200 ? 0.19937699 0.26425454 0.20813629 -0.07345024 -0.02424026 0.01517283  255  GLY   A C    
3055  O  O    . GLY   A  200 ? 0.29465291 0.35555622 0.30173588 -0.07366633 -0.02797436 0.01597603  255  GLY   A O    
3056  H  H    . GLY   A  200 ? 0.22387999 0.29275751 0.23968643 -0.06214472 -0.03003772 0.01247354  255  GLY   A H    
3057  H  HA2  . GLY   A  200 ? 0.20521793 0.28695655 0.22722268 -0.07131331 -0.02172108 0.01133588  255  GLY   A HA2  
3058  H  HA3  . GLY   A  200 ? 0.20645297 0.27796781 0.22000745 -0.06732237 -0.02179417 0.01237885  255  GLY   A HA3  
3059  N  N    . GLY   A  201 ? 0.17580548 0.23716241 0.17944032 -0.07666934 -0.02056812 0.01643129  256  GLY   A N    
3060  C  CA   . GLY   A  201 ? 0.18486837 0.23813045 0.18182583 -0.08075855 -0.02073894 0.01874698  256  GLY   A CA   
3061  C  C    . GLY   A  201 ? 0.21014929 0.26650906 0.21092980 -0.08510137 -0.02224535 0.01853313  256  GLY   A C    
3062  O  O    . GLY   A  201 ? 0.22621140 0.29269618 0.23513046 -0.08684910 -0.02152944 0.01684972  256  GLY   A O    
3063  H  H    . GLY   A  201 ? 0.18375847 0.24756688 0.18779279 -0.07613629 -0.01794623 0.01578080  256  GLY   A H    
3064  H  HA2  . GLY   A  201 ? 0.19016415 0.24176127 0.18391183 -0.08266586 -0.01797072 0.01955649  256  GLY   A HA2  
3065  H  HA3  . GLY   A  201 ? 0.18763901 0.23451245 0.18028325 -0.07881241 -0.02270614 0.01964574  256  GLY   A HA3  
3066  N  N    . GLN   A  202 ? 0.24123050 0.28882328 0.23613425 -0.08678104 -0.02439831 0.02003306  257  GLN   A N    
3067  C  CA   . GLN   A  202 ? 0.26001140 0.30800557 0.25662267 -0.09128689 -0.02612088 0.01983360  257  GLN   A CA   
3068  C  C    . GLN   A  202 ? 0.21279998 0.25231531 0.20405778 -0.08952581 -0.03001256 0.02028359  257  GLN   A C    
3069  O  O    . GLN   A  202 ? 0.25931624 0.28918970 0.24307802 -0.08998471 -0.02985184 0.02176975  257  GLN   A O    
3070  C  CB   . GLN   A  202 ? 0.28413510 0.32894430 0.27752149 -0.09732946 -0.02314614 0.02128468  257  GLN   A CB   
3071  C  CG   . GLN   A  202 ? 0.27043712 0.31570578 0.26601022 -0.10263421 -0.02500664 0.02081388  257  GLN   A CG   
3072  C  CD   . GLN   A  202 ? 0.29725718 0.33750075 0.28854364 -0.10880045 -0.02234587 0.02259267  257  GLN   A CD   
3073  O  OE1  . GLN   A  202 ? 0.36196664 0.40922964 0.35714218 -0.11256263 -0.01891235 0.02259929  257  GLN   A OE1  
3074  N  NE2  . GLN   A  202 ? 0.24684393 0.27492630 0.22998381 -0.10996518 -0.02372698 0.02410930  257  GLN   A NE2  
3075  H  H    . GLN   A  202 ? 0.23567565 0.27684134 0.22537330 -0.08507890 -0.02481553 0.02105609  257  GLN   A H    
3076  H  HA   . GLN   A  202 ? 0.24812636 0.30395260 0.25136614 -0.09148236 -0.02686293 0.01835614  257  GLN   A HA   
3077  H  HB2  . GLN   A  202 ? 0.27561808 0.32580823 0.27168828 -0.09832110 -0.02026668 0.02105728  257  GLN   A HB2  
3078  H  HB3  . GLN   A  202 ? 0.27707386 0.31382781 0.26388901 -0.09685281 -0.02287427 0.02277298  257  GLN   A HB3  
3079  H  HG2  . GLN   A  202 ? 0.27788705 0.31789535 0.27056593 -0.10145148 -0.02785985 0.02074695  257  GLN   A HG2  
3080  H  HG3  . GLN   A  202 ? 0.27626276 0.33035550 0.27894741 -0.10324995 -0.02536079 0.01929861  257  GLN   A HG3  
3081  H  HE21 . GLN   A  202 ? 0.26221541 0.28511548 0.24163580 -0.10657227 -0.02508506 0.02438392  257  GLN   A HE21 
3082  H  HE22 . GLN   A  202 ? 0.27274555 0.29766530 0.25410444 -0.11413076 -0.02331779 0.02480836  257  GLN   A HE22 
3083  N  N    . PRO   A  203 ? 0.21186994 0.25503141 0.20681396 -0.08747394 -0.03369673 0.01888868  258  PRO   A N    
3084  C  CA   . PRO   A  203 ? 0.21010897 0.24585778 0.19949371 -0.08597465 -0.03712463 0.01909241  258  PRO   A CA   
3085  C  C    . PRO   A  203 ? 0.19587240 0.22573739 0.18150419 -0.09064889 -0.03808483 0.01909762  258  PRO   A C    
3086  O  O    . PRO   A  203 ? 0.17153382 0.20448861 0.16039523 -0.09549046 -0.03708612 0.01877696  258  PRO   A O    
3087  C  CB   . PRO   A  203 ? 0.21301000 0.25544196 0.20773721 -0.08304873 -0.04076584 0.01765612  258  PRO   A CB   
3088  C  CG   . PRO   A  203 ? 0.20201500 0.25580829 0.20633703 -0.08471088 -0.03991226 0.01625201  258  PRO   A CG   
3089  C  CD   . PRO   A  203 ? 0.22348890 0.27825785 0.22797307 -0.08638613 -0.03486289 0.01697620  258  PRO   A CD   
3090  H  HA   . PRO   A  203 ? 0.20693627 0.23766279 0.19183105 -0.08352287 -0.03648540 0.02003515  258  PRO   A HA   
3091  H  HB2  . PRO   A  203 ? 0.21181668 0.25196153 0.20468736 -0.08382963 -0.04341581 0.01726297  258  PRO   A HB2  
3092  H  HB3  . PRO   A  203 ? 0.20741212 0.24880804 0.20091210 -0.07937901 -0.04100041 0.01803730  258  PRO   A HB3  
3093  H  HG2  . PRO   A  203 ? 0.21168104 0.26763517 0.21819726 -0.08797802 -0.04121804 0.01554757  258  PRO   A HG2  
3094  H  HG3  . PRO   A  203 ? 0.20726046 0.26574579 0.21545564 -0.08149648 -0.04133998 0.01550811  258  PRO   A HG3  
3095  H  HD2  . PRO   A  203 ? 0.21667159 0.27659538 0.22536224 -0.08987327 -0.03364527 0.01639980  258  PRO   A HD2  
3096  H  HD3  . PRO   A  203 ? 0.21245714 0.26990974 0.21867014 -0.08326613 -0.03375447 0.01674107  258  PRO   A HD3  
3097  N  N    . LEU   A  204 ? 0.22518429 0.24626777 0.20371147 -0.08918744 -0.03987716 0.01934971  259  LEU   A N    
3098  C  CA   . LEU   A  204 ? 0.25177473 0.26515576 0.22525471 -0.09254503 -0.04098201 0.01901192  259  LEU   A CA   
3099  C  C    . LEU   A  204 ? 0.21049374 0.22787060 0.18799065 -0.09700751 -0.04357579 0.01730692  259  LEU   A C    
3100  O  O    . LEU   A  204 ? 0.22651412 0.23947871 0.20214242 -0.10173489 -0.04323715 0.01723229  259  LEU   A O    
3101  C  CB   . LEU   A  204 ? 0.28351963 0.28920007 0.24985731 -0.08915114 -0.04273950 0.01876721  259  LEU   A CB   
3102  C  CG   . LEU   A  204 ? 0.30452654 0.30069014 0.26448336 -0.09141348 -0.04354122 0.01807224  259  LEU   A CG   
3103  C  CD1  . LEU   A  204 ? 0.37517920 0.36449027 0.33153355 -0.09230825 -0.04076344 0.01961417  259  LEU   A CD1  
3104  C  CD2  . LEU   A  204 ? 0.35633582 0.34740958 0.31030592 -0.08796456 -0.04520841 0.01715135  259  LEU   A CD2  
3105  H  H    . LEU   A  204 ? 0.22070746 0.24045491 0.19735160 -0.08587313 -0.04035661 0.01963108  259  LEU   A H    
3106  H  HA   . LEU   A  204 ? 0.24557197 0.25538272 0.21699746 -0.09420314 -0.03887793 0.02001001  259  LEU   A HA   
3107  H  HB2  . LEU   A  204 ? 0.27620307 0.28021741 0.24069986 -0.08647583 -0.04120697 0.01978980  259  LEU   A HB2  
3108  H  HB3  . LEU   A  204 ? 0.27884093 0.28753081 0.24643727 -0.08785330 -0.04491825 0.01795615  259  LEU   A HB3  
3109  H  HG   . LEU   A  204 ? 0.32372993 0.32123259 0.28549090 -0.09467667 -0.04499706 0.01706601  259  LEU   A HG   
3110  H  HD11 . LEU   A  204 ? 0.35799909 0.34105644 0.31064928 -0.09387270 -0.04155172 0.01899934  259  LEU   A HD11 
3111  H  HD12 . LEU   A  204 ? 0.34981054 0.33747306 0.30413750 -0.08910903 -0.03969880 0.02041069  259  LEU   A HD12 
3112  H  HD13 . LEU   A  204 ? 0.35047647 0.34311411 0.31003928 -0.09452951 -0.03935146 0.02040485  259  LEU   A HD13 
3113  H  HD21 . LEU   A  204 ? 0.33966583 0.33440608 0.29508179 -0.08757102 -0.04728173 0.01634590  259  LEU   A HD21 
3114  H  HD22 . LEU   A  204 ? 0.33718801 0.32742625 0.28978026 -0.08504910 -0.04376271 0.01811744  259  LEU   A HD22 
3115  H  HD23 . LEU   A  204 ? 0.34543383 0.33037126 0.29532284 -0.08911419 -0.04565892 0.01634884  259  LEU   A HD23 
3116  N  N    . TRP   A  205 ? 0.20802082 0.23369497 0.19120073 -0.09571930 -0.04635398 0.01601074  260  TRP   A N    
3117  C  CA   . TRP   A  205 ? 0.26018402 0.29103091 0.24816824 -0.10006738 -0.04927429 0.01423698  260  TRP   A CA   
3118  C  C    . TRP   A  205 ? 0.24642432 0.28469577 0.24173486 -0.10507058 -0.04654332 0.01430784  260  TRP   A C    
3119  O  O    . TRP   A  205 ? 0.22195771 0.26045033 0.21872780 -0.11077686 -0.04763276 0.01340637  260  TRP   A O    
3120  C  CB   . TRP   A  205 ? 0.29051015 0.32888442 0.28305900 -0.09722622 -0.05363690 0.01286782  260  TRP   A CB   
3121  C  CG   . TRP   A  205 ? 0.24636267 0.29333299 0.24537660 -0.09267949 -0.05279561 0.01329485  260  TRP   A CG   
3122  C  CD1  . TRP   A  205 ? 0.21025379 0.26938847 0.21981755 -0.09324854 -0.05234107 0.01237057  260  TRP   A CD1  
3123  C  CD2  . TRP   A  205 ? 0.19772632 0.24156186 0.19301066 -0.08676288 -0.05266462 0.01444040  260  TRP   A CD2  
3124  N  NE1  . TRP   A  205 ? 0.27050436 0.33347988 0.28279704 -0.08763751 -0.05188601 0.01272587  260  TRP   A NE1  
3125  C  CE2  . TRP   A  205 ? 0.23305558 0.28629994 0.23643750 -0.08386473 -0.05212959 0.01415198  260  TRP   A CE2  
3126  C  CE3  . TRP   A  205 ? 0.17561665 0.20969740 0.16162497 -0.08388904 -0.05268746 0.01557793  260  TRP   A CE3  
3127  C  CZ2  . TRP   A  205 ? 0.19387886 0.24581072 0.19575651 -0.07833707 -0.05200499 0.01505331  260  TRP   A CZ2  
3128  C  CZ3  . TRP   A  205 ? 0.19365175 0.22722189 0.17851204 -0.07898097 -0.05215111 0.01671634  260  TRP   A CZ3  
3129  C  CH2  . TRP   A  205 ? 0.19760126 0.23930451 0.18990552 -0.07626632 -0.05210108 0.01650118  260  TRP   A CH2  
3130  H  H    . TRP   A  205 ? 0.21414992 0.24213856 0.19820273 -0.09216194 -0.04667566 0.01623441  260  TRP   A H    
3131  H  HA   . TRP   A  205 ? 0.25631133 0.28036755 0.23927931 -0.10200127 -0.05044413 0.01378568  260  TRP   A HA   
3132  H  HB2  . TRP   A  205 ? 0.27601087 0.31872374 0.27256629 -0.10045972 -0.05554709 0.01164628  260  TRP   A HB2  
3133  H  HB3  . TRP   A  205 ? 0.27544814 0.30818576 0.26223022 -0.09527146 -0.05549860 0.01278383  260  TRP   A HB3  
3134  H  HD1  . TRP   A  205 ? 0.23170985 0.29593769 0.24611863 -0.09704993 -0.05220868 0.01151975  260  TRP   A HD1  
3135  H  HE1  . TRP   A  205 ? 0.24035852 0.31084678 0.25914577 -0.08665312 -0.05138706 0.01205523  260  TRP   A HE1  
3136  H  HE3  . TRP   A  205 ? 0.19105577 0.21898285 0.17179102 -0.08542691 -0.05275062 0.01552399  260  TRP   A HE3  
3137  H  HZ2  . TRP   A  205 ? 0.20023362 0.25796378 0.20741177 -0.07616693 -0.05177663 0.01461072  260  TRP   A HZ2  
3138  H  HZ3  . TRP   A  205 ? 0.19108693 0.21876907 0.17011103 -0.07741170 -0.05202497 0.01748984  260  TRP   A HZ3  
3139  H  HH2  . TRP   A  205 ? 0.19402233 0.23437980 0.18499511 -0.07302329 -0.05202692 0.01721791  260  TRP   A HH2  
3140  N  N    . ILE   A  206 ? 0.22379872 0.26781300 0.22318444 -0.10330619 -0.04284023 0.01528607  261  ILE   A N    
3141  C  CA   . ILE   A  206 ? 0.21571855 0.26652956 0.22089343 -0.10816561 -0.03925967 0.01550460  261  ILE   A CA   
3142  C  C    . ILE   A  206 ? 0.23027402 0.27074933 0.22795728 -0.11244358 -0.03633218 0.01742335  261  ILE   A C    
3143  O  O    . ILE   A  206 ? 0.23254643 0.27439666 0.23219508 -0.11893416 -0.03505773 0.01754994  261  ILE   A O    
3144  C  CB   . ILE   A  206 ? 0.20886675 0.26933140 0.22036842 -0.10471942 -0.03618570 0.01545474  261  ILE   A CB   
3145  C  CG1  . ILE   A  206 ? 0.23599815 0.30711970 0.25597051 -0.10038254 -0.03952882 0.01343227  261  ILE   A CG1  
3146  C  CG2  . ILE   A  206 ? 0.21424341 0.28132689 0.23029298 -0.10961973 -0.03145326 0.01577642  261  ILE   A CG2  
3147  C  CD1  . ILE   A  206 ? 0.36530739 0.44585049 0.39354974 -0.10365975 -0.04187781 0.01162204  261  ILE   A CD1  
3148  H  H    . ILE   A  206 ? 0.22208524 0.26573420 0.22036970 -0.09915271 -0.04244286 0.01576145  261  ILE   A H    
3149  H  HA   . ILE   A  206 ? 0.22187397 0.27811158 0.23198046 -0.11126289 -0.04092210 0.01426029  261  ILE   A HA   
3150  H  HB   . ILE   A  206 ? 0.21294467 0.26786947 0.21940471 -0.10143389 -0.03506771 0.01655532  261  ILE   A HB   
3151  H  HG12 . ILE   A  206 ? 0.25068104 0.31667209 0.26649424 -0.09720553 -0.04219660 0.01360271  261  ILE   A HG12 
3152  H  HG13 . ILE   A  206 ? 0.24823281 0.32410967 0.27137581 -0.09769239 -0.03743352 0.01330526  261  ILE   A HG13 
3153  H  HG21 . ILE   A  206 ? 0.21670139 0.28778335 0.23668930 -0.11396398 -0.03222194 0.01499532  261  ILE   A HG21 
3154  H  HG22 . ILE   A  206 ? 0.21616755 0.27605045 0.22609378 -0.11101931 -0.02921235 0.01741223  261  ILE   A HG22 
3155  H  HG23 . ILE   A  206 ? 0.21019469 0.28472155 0.23119614 -0.10711759 -0.02987850 0.01509224  261  ILE   A HG23 
3156  H  HD11 . ILE   A  206 ? 0.31802344 0.39376080 0.34297812 -0.10590653 -0.04451704 0.01148233  261  ILE   A HD11 
3157  H  HD12 . ILE   A  206 ? 0.31559217 0.40135905 0.34795383 -0.10739373 -0.03906573 0.01146708  261  ILE   A HD12 
3158  H  HD13 . ILE   A  206 ? 0.31333235 0.40042758 0.34679070 -0.10012458 -0.04387269 0.01052194  261  ILE   A HD13 
3159  N  N    . THR   A  207 ? 0.25613359 0.28637323 0.24537891 -0.10889103 -0.03538609 0.01901145  262  THR   A N    
3160  C  CA   . THR   A  207 ? 0.27721357 0.29639620 0.25865966 -0.11191586 -0.03344507 0.02094227  262  THR   A CA   
3161  C  C    . THR   A  207 ? 0.28220171 0.29413959 0.26036999 -0.11685625 -0.03605412 0.02020130  262  THR   A C    
3162  O  O    . THR   A  207 ? 0.27838817 0.28622514 0.25458115 -0.12255654 -0.03445150 0.02134695  262  THR   A O    
3163  C  CB   . THR   A  207 ? 0.25678420 0.26700887 0.23066843 -0.10649394 -0.03315166 0.02222987  262  THR   A CB   
3164  O  OG1  . THR   A  207 ? 0.22412391 0.24098349 0.20114212 -0.10218912 -0.03126584 0.02255460  262  THR   A OG1  
3165  C  CG2  . THR   A  207 ? 0.25733900 0.25620255 0.22331885 -0.10854100 -0.03151239 0.02437878  262  THR   A CG2  
3166  H  H    . THR   A  207 ? 0.24828804 0.27840519 0.23667558 -0.10448185 -0.03608397 0.01893540  262  THR   A H    
3167  H  HA   . THR   A  207 ? 0.27070090 0.29293424 0.25387496 -0.11442535 -0.03063307 0.02185607  262  THR   A HA   
3168  H  HB   . THR   A  207 ? 0.25347123 0.26075560 0.22542608 -0.10435367 -0.03562180 0.02128395  262  THR   A HB   
3170  H  HG21 . THR   A  207 ? 0.25776151 0.25241607 0.22000933 -0.10474942 -0.03140437 0.02505276  262  THR   A HG21 
3171  H  HG22 . THR   A  207 ? 0.26171184 0.26294470 0.22880410 -0.11119106 -0.02911391 0.02546073  262  THR   A HG22 
3172  H  HG23 . THR   A  207 ? 0.26505819 0.25828785 0.22839102 -0.11098239 -0.03306381 0.02398394  262  THR   A HG23 
3173  N  N    . ALA   A  208 ? 0.24742773 0.25671214 0.22392507 -0.11471914 -0.04001945 0.01836484  263  ALA   A N    
3174  C  CA   . ALA   A  208 ? 0.27975947 0.28173637 0.25257525 -0.11895657 -0.04294255 0.01702558  263  ALA   A CA   
3175  C  C    . ALA   A  208 ? 0.25879097 0.26816344 0.23854846 -0.12634452 -0.04320044 0.01624329  263  ALA   A C    
3176  O  O    . ALA   A  208 ? 0.26092723 0.26332164 0.23741804 -0.13234986 -0.04254382 0.01693065  263  ALA   A O    
3177  C  CB   . ALA   A  208 ? 0.35964680 0.36026663 0.33031517 -0.11531113 -0.04699483 0.01486622  263  ALA   A CB   
3178  H  H    . ALA   A  208 ? 0.25650156 0.26823869 0.23370537 -0.11055670 -0.04094034 0.01789866  263  ALA   A H    
3179  H  HA   . ALA   A  208 ? 0.28746009 0.28000152 0.25414389 -0.11956270 -0.04209515 0.01802606  263  ALA   A HA   
3180  H  HB1  . ALA   A  208 ? 0.33742994 0.33211774 0.30464041 -0.11790153 -0.04885086 0.01379517  263  ALA   A HB1  
3181  H  HB2  . ALA   A  208 ? 0.32897806 0.32581884 0.29573777 -0.11089518 -0.04646500 0.01540369  263  ALA   A HB2  
3182  H  HB3  . ALA   A  208 ? 0.32669890 0.33602852 0.30309606 -0.11481966 -0.04833533 0.01396976  263  ALA   A HB3  
3183  N  N    . THR   A  209 ? 0.24028111 0.26376817 0.22974658 -0.12580676 -0.04418877 0.01486825  264  THR   A N    
3184  C  CA   . THR   A  209 ? 0.28858882 0.32255670 0.28706852 -0.13239445 -0.04460011 0.01368715  264  THR   A CA   
3185  C  C    . THR   A  209 ? 0.30604836 0.34165972 0.30623811 -0.13825902 -0.03971930 0.01561316  264  THR   A C    
3186  O  O    . THR   A  209 ? 0.24763760 0.28269720 0.24908543 -0.14600815 -0.03977367 0.01545947  264  THR   A O    
3187  C  CB   . THR   A  209 ? 0.29148114 0.34146452 0.30093798 -0.12899205 -0.04631444 0.01194028  264  THR   A CB   
3188  O  OG1  . THR   A  209 ? 0.30814856 0.35516208 0.31454936 -0.12481255 -0.05145337 0.01038375  264  THR   A OG1  
3189  C  CG2  . THR   A  209 ? 0.38707060 0.45027685 0.40759623 -0.13511616 -0.04648441 0.01051891  264  THR   A CG2  
3190  H  H    . THR   A  209 ? 0.24834096 0.27531487 0.23916015 -0.12112758 -0.04470199 0.01462494  264  THR   A H    
3191  H  HA   . THR   A  209 ? 0.28820956 0.31781408 0.28451931 -0.13544889 -0.04735425 0.01256719  264  THR   A HA   
3192  H  HB   . THR   A  209 ? 0.30252385 0.35560530 0.31326622 -0.12524059 -0.04385646 0.01282571  264  THR   A HB   
3194  H  HG21 . THR   A  209 ? 0.34983987 0.42208529 0.37679982 -0.13241398 -0.04863900 0.00913029  264  THR   A HG21 
3195  H  HG22 . THR   A  209 ? 0.36013904 0.41934007 0.37885135 -0.13982096 -0.04839650 0.00988831  264  THR   A HG22 
3196  H  HG23 . THR   A  209 ? 0.35304821 0.42002758 0.37624523 -0.13720867 -0.04258256 0.01153514  264  THR   A HG23 
3197  N  N    . LYS   A  210 ? 0.31259111 0.34916389 0.31172597 -0.13496432 -0.03547587 0.01754943  265  LYS   A N    
3198  C  CA   . LYS   A  210 ? 0.28035247 0.31753540 0.27927870 -0.14032981 -0.03058152 0.01965288  265  LYS   A CA   
3199  C  C    . LYS   A  210 ? 0.29550883 0.31649858 0.28397036 -0.14535387 -0.03045959 0.02170848  265  LYS   A C    
3200  O  O    . LYS   A  210 ? 0.28082961 0.30140448 0.26898843 -0.15234518 -0.02755213 0.02329795  265  LYS   A O    
3201  C  CB   . LYS   A  210 ? 0.26658371 0.30688667 0.26493901 -0.13517271 -0.02644340 0.02112113  265  LYS   A CB   
3202  C  CG   . LYS   A  210 ? 0.31013876 0.36813635 0.32027927 -0.13291799 -0.02476793 0.01924965  265  LYS   A CG   
3203  C  CD   . LYS   A  210 ? 0.41408965 0.47363070 0.42246196 -0.12806045 -0.02077299 0.02035235  265  LYS   A CD   
3204  C  CE   . LYS   A  210 ? 0.40471745 0.48064572 0.42405665 -0.12523839 -0.01872182 0.01821262  265  LYS   A CE   
3205  N  NZ   . LYS   A  210 ? 0.34881663 0.43740308 0.37719357 -0.13205367 -0.01566456 0.01722327  265  LYS   A NZ   
3206  H  H    . LYS   A  210 ? 0.29498866 0.33168069 0.29316100 -0.12952426 -0.03564544 0.01757876  265  LYS   A H    
3207  H  HA   . LYS   A  210 ? 0.28635821 0.33311290 0.29265088 -0.14434385 -0.02998486 0.01869004  265  LYS   A HA   
3208  H  HB2  . LYS   A  210 ? 0.27619299 0.31048962 0.26986766 -0.13009195 -0.02774952 0.02139032  265  LYS   A HB2  
3209  H  HB3  . LYS   A  210 ? 0.28325927 0.31944013 0.27770054 -0.13829567 -0.02357548 0.02300465  265  LYS   A HB3  
3210  H  HG2  . LYS   A  210 ? 0.31970623 0.38472667 0.33520019 -0.13799901 -0.02327422 0.01881322  265  LYS   A HG2  
3211  H  HG3  . LYS   A  210 ? 0.31300396 0.37454501 0.32665545 -0.12960348 -0.02794195 0.01758798  265  LYS   A HG3  
3212  H  HD2  . LYS   A  210 ? 0.38151938 0.43452549 0.38504308 -0.12330442 -0.02237926 0.02074667  265  LYS   A HD2  
3213  H  HD3  . LYS   A  210 ? 0.38861585 0.44390321 0.39254755 -0.13133764 -0.01786772 0.02215066  265  LYS   A HD3  
3214  H  HE2  . LYS   A  210 ? 0.38634193 0.46573645 0.40954846 -0.12153624 -0.02187108 0.01665783  265  LYS   A HE2  
3215  H  HE3  . LYS   A  210 ? 0.38841766 0.46349567 0.40519813 -0.12223523 -0.01629609 0.01887132  265  LYS   A HE3  
3216  H  HZ1  . LYS   A  210 ? 0.36595774 0.45719516 0.39821181 -0.13440447 -0.01825485 0.01619950  265  LYS   A HZ1  
3217  H  HZ2  . LYS   A  210 ? 0.37041655 0.45489562 0.39450008 -0.13624872 -0.01297133 0.01888196  265  LYS   A HZ2  
3218  H  HZ3  . LYS   A  210 ? 0.36183807 0.45972258 0.39614803 -0.12974961 -0.01390097 0.01593099  265  LYS   A HZ3  
3219  N  N    . GLN   A  211 ? 0.29348028 0.30086619 0.27312696 -0.14179753 -0.03351038 0.02167905  266  GLN   A N    
3220  C  CA   . GLN   A  211 ? 0.33219862 0.32300231 0.30154091 -0.14513841 -0.03382239 0.02340530  266  GLN   A CA   
3221  C  C    . GLN   A  211 ? 0.36277020 0.34681296 0.33009470 -0.14902198 -0.03817584 0.02120342  266  GLN   A C    
3222  O  O    . GLN   A  211 ? 0.34460345 0.31312507 0.30262405 -0.15002298 -0.03951137 0.02182060  266  GLN   A O    
3223  C  CB   . GLN   A  211 ? 0.29085979 0.27043480 0.25126332 -0.13799125 -0.03364996 0.02490380  266  GLN   A CB   
3224  C  CG   . GLN   A  211 ? 0.29784465 0.28083217 0.25800765 -0.13606597 -0.02953277 0.02741890  266  GLN   A CG   
3225  C  CD   . GLN   A  211 ? 0.34158617 0.31673443 0.29501963 -0.12853914 -0.02963156 0.02858981  266  GLN   A CD   
3226  O  OE1  . GLN   A  211 ? 0.36927682 0.33074269 0.31443381 -0.12735051 -0.03118515 0.02945078  266  GLN   A OE1  
3227  N  NE2  . GLN   A  211 ? 0.34042215 0.32436568 0.29771709 -0.12312298 -0.02817211 0.02839802  266  GLN   A NE2  
3228  H  H    . GLN   A  211 ? 0.29571474 0.30406272 0.27566612 -0.13695408 -0.03540838 0.02051966  266  GLN   A H    
3229  H  HA   . GLN   A  211 ? 0.32618606 0.31714034 0.29538122 -0.14980851 -0.03121354 0.02510592  266  GLN   A HA   
3230  H  HB2  . GLN   A  211 ? 0.29722297 0.27849990 0.25848097 -0.13321450 -0.03550830 0.02336740  266  GLN   A HB2  
3231  H  HB3  . GLN   A  211 ? 0.31020588 0.27838129 0.26397723 -0.13947710 -0.03463154 0.02558394  266  GLN   A HB3  
3232  H  HG2  . GLN   A  211 ? 0.31114039 0.29078871 0.26887870 -0.14078459 -0.02771061 0.02920300  266  GLN   A HG2  
3233  H  HG3  . GLN   A  211 ? 0.29835156 0.29269490 0.26537463 -0.13531387 -0.02835291 0.02657538  266  GLN   A HG3  
3234  H  HE21 . GLN   A  211 ? 0.33227748 0.32561916 0.29546085 -0.12372392 -0.02711354 0.02765389  266  GLN   A HE21 
3235  H  HE22 . GLN   A  211 ? 0.33543324 0.31565523 0.28943732 -0.11897947 -0.02834059 0.02893747  266  GLN   A HE22 
3236  N  N    . GLY   A  212 ? 0.37273133 0.36838531 0.34880295 -0.15138820 -0.04050720 0.01854927  267  GLY   A N    
3237  C  CA   . GLY   A  212 ? 0.33505270 0.32600525 0.31010163 -0.15650219 -0.04473736 0.01621620  267  GLY   A CA   
3238  C  C    . GLY   A  212 ? 0.37557554 0.35822088 0.34441185 -0.15091456 -0.04909999 0.01383405  267  GLY   A C    
3239  O  O    . GLY   A  212 ? 0.39135456 0.36484718 0.35539779 -0.15447803 -0.05238254 0.01203694  267  GLY   A O    
3240  H  H    . GLY   A  212 ? 0.35007578 0.35690069 0.33296314 -0.14967416 -0.03965848 0.01806310  267  GLY   A H    
3241  H  HA2  . GLY   A  212 ? 0.35158449 0.35356766 0.33467579 -0.15952781 -0.04545920 0.01492859  267  GLY   A HA2  
3242  H  HA3  . GLY   A  212 ? 0.36264211 0.34495920 0.33308703 -0.16132738 -0.04406004 0.01737834  267  GLY   A HA3  
3243  N  N    . VAL   A  213 ? 0.31098402 0.29671288 0.27957219 -0.14247122 -0.04895284 0.01374274  268  VAL   A N    
3244  C  CA   . VAL   A  213 ? 0.30445847 0.28357923 0.26699284 -0.13675591 -0.05222731 0.01171900  268  VAL   A CA   
3245  C  C    . VAL   A  213 ? 0.35588199 0.34853816 0.32587728 -0.13366382 -0.05472704 0.00993197  268  VAL   A C    
3246  O  O    . VAL   A  213 ? 0.26327285 0.26657814 0.23964421 -0.13013530 -0.05274951 0.01104193  268  VAL   A O    
3247  C  CB   . VAL   A  213 ? 0.39639693 0.36709535 0.35179162 -0.12981392 -0.04984559 0.01347240  268  VAL   A CB   
3248  C  CG1  . VAL   A  213 ? 0.38658220 0.35307115 0.33677864 -0.12362789 -0.05237535 0.01139806  268  VAL   A CG1  
3249  C  CG2  . VAL   A  213 ? 0.34960347 0.30610821 0.29728311 -0.13237362 -0.04808509 0.01537433  268  VAL   A CG2  
3250  H  H    . VAL   A  213 ? 0.31490290 0.30722812 0.28712842 -0.14036353 -0.04655213 0.01498224  268  VAL   A H    
3251  H  HA   . VAL   A  213 ? 0.33936381 0.31098053 0.29770786 -0.13955645 -0.05441484 0.01034887  268  VAL   A HA   
3252  H  HB   . VAL   A  213 ? 0.35503405 0.33297160 0.31452745 -0.12762870 -0.04765480 0.01484800  268  VAL   A HB   
3253  H  HG11 . VAL   A  213 ? 0.39522919 0.35613918 0.34200948 -0.12574518 -0.05478448 0.00954779  268  VAL   A HG11 
3254  H  HG12 . VAL   A  213 ? 0.38220525 0.35722935 0.33670956 -0.12136636 -0.05311506 0.01091593  268  VAL   A HG12 
3255  H  HG13 . VAL   A  213 ? 0.38797808 0.34873796 0.33376235 -0.11988641 -0.05085536 0.01236317  268  VAL   A HG13 
3256  H  HG21 . VAL   A  213 ? 0.36355409 0.31493789 0.30695784 -0.12765944 -0.04717248 0.01613089  268  VAL   A HG21 
3257  H  HG22 . VAL   A  213 ? 0.36462530 0.32430354 0.31512412 -0.13577563 -0.04590818 0.01716483  268  VAL   A HG22 
3258  H  HG23 . VAL   A  213 ? 0.37392652 0.32325497 0.31801450 -0.13530876 -0.05016319 0.01400821  268  VAL   A HG23 
3259  N  N    . ARG   A  214 ? 0.36942267 0.36119467 0.33825260 -0.13507803 -0.05941904 0.00707407  269  ARG   A N    
3260  C  CA   . ARG   A  214 ? 0.38626057 0.39046085 0.36196035 -0.13298167 -0.06277752 0.00544285  269  ARG   A CA   
3261  C  C    . ARG   A  214 ? 0.28682983 0.28969723 0.25810534 -0.12461118 -0.06324659 0.00562164  269  ARG   A C    
3262  O  O    . ARG   A  214 ? 0.28089786 0.27207065 0.24253517 -0.12156764 -0.06281175 0.00547371  269  ARG   A O    
3263  C  CB   . ARG   A  214 ? 0.47753870 0.48157942 0.45344144 -0.13833131 -0.06800761 0.00240855  269  ARG   A CB   
3264  C  CG   . ARG   A  214 ? 0.90714097 0.92610610 0.89220190 -0.13723987 -0.07189022 0.00098952  269  ARG   A CG   
3265  C  CD   . ARG   A  214 ? 0.85766578 0.88090587 0.84695709 -0.14429846 -0.07663143 -0.00166105 269  ARG   A CD   
3266  N  NE   . ARG   A  214 ? 0.89993793 0.93940157 0.89992005 -0.14282766 -0.08018468 -0.00266359 269  ARG   A NE   
3267  C  CZ   . ARG   A  214 ? 0.76835930 0.81401277 0.77268916 -0.14695705 -0.08582810 -0.00525587 269  ARG   A CZ   
3268  N  NH1  . ARG   A  214 ? 0.69243813 0.72816736 0.68967253 -0.15230787 -0.08900665 -0.00743179 269  ARG   A NH1  
3269  N  NH2  . ARG   A  214 ? 0.73812926 0.80006599 0.75405014 -0.14536515 -0.08870242 -0.00587003 269  ARG   A NH2  
3270  H  H    . ARG   A  214 ? 0.37940553 0.36228094 0.34270301 -0.13727841 -0.06075173 0.00609206  269  ARG   A H    
3271  H  HA   . ARG   A  214 ? 0.36781794 0.38201696 0.35138336 -0.13385417 -0.06130453 0.00626105  269  ARG   A HA   
3272  H  HB2  . ARG   A  214 ? 0.53301162 0.53621566 0.51072907 -0.14403552 -0.06735235 0.00248368  269  ARG   A HB2  
3273  H  HB3  . ARG   A  214 ? 0.52904600 0.52370882 0.49700123 -0.13693048 -0.06965026 0.00123063  269  ARG   A HB3  
3274  H  HG2  . ARG   A  214 ? 0.75433099 0.77152669 0.73544133 -0.13247100 -0.07360983 0.00056394  269  ARG   A HG2  
3275  H  HG3  . ARG   A  214 ? 0.74324363 0.77139091 0.73562831 -0.13630782 -0.06972510 0.00222686  269  ARG   A HG3  
3276  H  HD2  . ARG   A  214 ? 0.87904853 0.90268183 0.87125903 -0.14964083 -0.07482041 -0.00121943 269  ARG   A HD2  
3277  H  HD3  . ARG   A  214 ? 0.87631416 0.89080358 0.85809404 -0.14470261 -0.07925990 -0.00323050 269  ARG   A HD3  
3278  H  HE   . ARG   A  214 ? 0.84484595 0.89026129 0.84864140 -0.13884754 -0.07871799 -0.00153876 269  ARG   A HE   
3279  H  HH11 . ARG   A  214 ? 0.71425593 0.74083567 0.70623749 -0.15473656 -0.08684710 -0.00707518 269  ARG   A HH11 
3280  H  HH12 . ARG   A  214 ? 0.72026539 0.75832552 0.71788585 -0.15339579 -0.09344286 -0.00929368 269  ARG   A HH12 
3281  H  HH21 . ARG   A  214 ? 0.74861932 0.81507981 0.76764864 -0.14792123 -0.09280451 -0.00760718 269  ARG   A HH21 
3282  H  HH22 . ARG   A  214 ? 0.74033338 0.80841845 0.76082230 -0.14164162 -0.08664808 -0.00462830 269  ARG   A HH22 
3283  N  N    . ALA   A  215 ? 0.25839400 0.27325863 0.23693699 -0.12081393 -0.06368642 0.00609482  270  ALA   A N    
3284  C  CA   . ALA   A  215 ? 0.25482473 0.26884255 0.22940025 -0.11366457 -0.06457452 0.00642946  270  ALA   A CA   
3285  C  C    . ALA   A  215 ? 0.25178722 0.27214730 0.22853364 -0.11273303 -0.07014501 0.00458525  270  ALA   A C    
3286  O  O    . ALA   A  215 ? 0.26619554 0.29682338 0.25180387 -0.11601456 -0.07269358 0.00352735  270  ALA   A O    
3287  C  CB   . ALA   A  215 ? 0.29770368 0.31787986 0.27690589 -0.10923565 -0.06097585 0.00868807  270  ALA   A CB   
3288  H  H    . ALA   A  215 ? 0.26160657 0.28529227 0.24774460 -0.12279085 -0.06339781 0.00620050  270  ALA   A H    
3289  H  HA   . ALA   A  215 ? 0.26570034 0.27036256 0.23245877 -0.11228035 -0.06406856 0.00632291  270  ALA   A HA   
3290  H  HB1  . ALA   A  215 ? 0.27747470 0.29628876 0.25358737 -0.10491534 -0.06161678 0.00900290  270  ALA   A HB1  
3291  H  HB2  . ALA   A  215 ? 0.27930439 0.29534608 0.25664276 -0.10979590 -0.05771264 0.00990356  270  ALA   A HB2  
3292  H  HB3  . ALA   A  215 ? 0.27682036 0.30637360 0.26381490 -0.11015294 -0.06132293 0.00855565  270  ALA   A HB3  
3293  N  N    . GLY   A  216 ? 0.25000730 0.26401287 0.21822394 -0.10862318 -0.07216485 0.00411954  271  GLY   A N    
3294  C  CA   . GLY   A  216 ? 0.27790868 0.29747635 0.24686182 -0.10623337 -0.07726375 0.00324368  271  GLY   A CA   
3295  C  C    . GLY   A  216 ? 0.28497085 0.31329313 0.26050356 -0.10113312 -0.07628752 0.00529673  271  GLY   A C    
3296  O  O    . GLY   A  216 ? 0.36916837 0.39654648 0.34544837 -0.09878256 -0.07156800 0.00719012  271  GLY   A O    
3297  H  H    . GLY   A  216 ? 0.25841042 0.26443127 0.21999618 -0.10725445 -0.07035972 0.00438946  271  GLY   A H    
3298  H  HA2  . GLY   A  216 ? 0.27863640 0.30284849 0.25175223 -0.10963597 -0.08031501 0.00181758  271  GLY   A HA2  
3299  H  HA3  . GLY   A  216 ? 0.27854937 0.29128492 0.23931342 -0.10452901 -0.07837583 0.00270624  271  GLY   A HA3  
3300  N  N    . THR   A  217 ? 0.39293367 0.42913264 0.37278137 -0.09925040 -0.08109996 0.00483515  272  THR   A N    
3301  C  CA   . THR   A  217 ? 0.33906847 0.38211083 0.32428405 -0.09386804 -0.08087237 0.00655694  272  THR   A CA   
3302  C  C    . THR   A  217 ? 0.34942412 0.38311571 0.32440966 -0.08909836 -0.07902988 0.00841133  272  THR   A C    
3303  O  O    . THR   A  217 ? 0.36708140 0.39367086 0.33238974 -0.08840611 -0.08156163 0.00803693  272  THR   A O    
3304  C  CB   . THR   A  217 ? 0.36113876 0.41391164 0.35295030 -0.09278587 -0.08724064 0.00554266  272  THR   A CB   
3305  O  OG1  . THR   A  217 ? 0.38181803 0.44329584 0.38298309 -0.09829051 -0.08880315 0.00347827  272  THR   A OG1  
3306  C  CG2  . THR   A  217 ? 0.36936072 0.42945015 0.36801058 -0.08699199 -0.08721562 0.00703835  272  THR   A CG2  
3307  H  H    . THR   A  217 ? 0.35512370 0.39208969 0.33436865 -0.10126306 -0.08482812 0.00337370  272  THR   A H    
3308  H  HA   . THR   A  217 ? 0.34848416 0.39581901 0.33976793 -0.09427989 -0.07763433 0.00709631  272  THR   A HA   
3309  H  HB   . THR   A  217 ? 0.36840716 0.41645232 0.35327488 -0.09216402 -0.09054921 0.00522089  272  THR   A HB   
3311  H  HG21 . THR   A  217 ? 0.36770409 0.43490240 0.37195072 -0.08638275 -0.09129865 0.00621792  272  THR   A HG21 
3312  H  HG22 . THR   A  217 ? 0.36042273 0.42393434 0.36438838 -0.08723928 -0.08333778 0.00736880  272  THR   A HG22 
3313  H  HG23 . THR   A  217 ? 0.36604604 0.42012903 0.35800290 -0.08365326 -0.08707352 0.00841412  272  THR   A HG23 
3314  N  N    . PHE   A  218 ? 0.34434983 0.37803301 0.32120410 -0.08632903 -0.07431285 0.01026372  273  PHE   A N    
3315  C  CA   . PHE   A  218 ? 0.37628269 0.40239865 0.34505096 -0.08226694 -0.07201562 0.01213928  273  PHE   A CA   
3316  C  C    . PHE   A  218 ? 0.39618820 0.42370325 0.36365032 -0.07761959 -0.07534265 0.01344499  273  PHE   A C    
3317  O  O    . PHE   A  218 ? 0.29466128 0.31526718 0.25397211 -0.07504418 -0.07425596 0.01496100  273  PHE   A O    
3318  C  CB   . PHE   A  218 ? 0.33867508 0.36499125 0.31055877 -0.08108665 -0.06636989 0.01360686  273  PHE   A CB   
3319  C  CG   . PHE   A  218 ? 0.36101085 0.38090968 0.32926226 -0.08391134 -0.06216874 0.01353386  273  PHE   A CG   
3320  C  CD1  . PHE   A  218 ? 0.37312564 0.39131850 0.34118220 -0.08871031 -0.06282521 0.01190226  273  PHE   A CD1  
3321  C  CD2  . PHE   A  218 ? 0.39295235 0.40844631 0.35826367 -0.08175332 -0.05787292 0.01514606  273  PHE   A CD2  
3322  C  CE1  . PHE   A  218 ? 0.40642983 0.41753763 0.37066814 -0.09089870 -0.05941467 0.01202199  273  PHE   A CE1  
3323  C  CE2  . PHE   A  218 ? 0.41043925 0.41998848 0.37256122 -0.08381073 -0.05464417 0.01520172  273  PHE   A CE2  
3324  C  CZ   . PHE   A  218 ? 0.38512105 0.39203131 0.34643909 -0.08817209 -0.05547448 0.01371312  273  PHE   A CZ   
3325  H  H    . PHE   A  218 ? 0.34713903 0.38598877 0.33063084 -0.08722388 -0.07240967 0.01029745  273  PHE   A H    
3326  H  HA   . PHE   A  218 ? 0.37046552 0.38974419 0.33194101 -0.08325627 -0.07171798 0.01170247  273  PHE   A HA   
3327  H  HB2  . PHE   A  218 ? 0.34720081 0.38051823 0.32668513 -0.08126701 -0.06620485 0.01342159  273  PHE   A HB2  
3328  H  HB3  . PHE   A  218 ? 0.34918100 0.37319079 0.31814110 -0.07794134 -0.06572564 0.01488356  273  PHE   A HB3  
3329  H  HD1  . PHE   A  218 ? 0.38103157 0.40242690 0.35125643 -0.09049418 -0.06589461 0.01069699  273  PHE   A HD1  
3330  H  HD2  . PHE   A  218 ? 0.38444710 0.40075830 0.34979892 -0.07883643 -0.05744024 0.01621051  273  PHE   A HD2  
3331  H  HE1  . PHE   A  218 ? 0.39868373 0.40764809 0.36227140 -0.09426312 -0.06005757 0.01093706  273  PHE   A HE1  
3332  H  HE2  . PHE   A  218 ? 0.39618194 0.40309304 0.35646960 -0.08220919 -0.05211865 0.01626425  273  PHE   A HE2  
3333  H  HZ   . PHE   A  218 ? 0.39686134 0.39893577 0.35568002 -0.08937525 -0.05350507 0.01386195  273  PHE   A HZ   
3334  N  N    . PHE   A  219 ? 0.41294742 0.44957989 0.38884091 -0.07653381 -0.07927433 0.01293624  274  PHE   A N    
3335  C  CA   . PHE   A  219 ? 0.38168138 0.41964936 0.35756621 -0.07155123 -0.08253994 0.01440671  274  PHE   A CA   
3336  C  C    . PHE   A  219 ? 0.35363746 0.39122427 0.32531381 -0.07162761 -0.08937849 0.01380865  274  PHE   A C    
3337  O  O    . PHE   A  219 ? 0.29069552 0.33193463 0.26493877 -0.07531637 -0.09216668 0.01169714  274  PHE   A O    
3338  C  CB   . PHE   A  219 ? 0.40998864 0.45826453 0.39838225 -0.06903310 -0.08218212 0.01418467  274  PHE   A CB   
3339  C  CG   . PHE   A  219 ? 0.41031289 0.46212843 0.40488303 -0.07156391 -0.07623597 0.01354097  274  PHE   A CG   
3340  C  CD1  . PHE   A  219 ? 0.42422438 0.47023004 0.41481996 -0.07052615 -0.07096206 0.01498499  274  PHE   A CD1  
3341  C  CD2  . PHE   A  219 ? 0.33971149 0.40047014 0.34348887 -0.07543866 -0.07605099 0.01159175  274  PHE   A CD2  
3342  C  CE1  . PHE   A  219 ? 0.37195858 0.42037225 0.36682212 -0.07301129 -0.06588976 0.01461230  274  PHE   A CE1  
3343  C  CE2  . PHE   A  219 ? 0.40475115 0.46786022 0.41274229 -0.07828332 -0.07049289 0.01135110  274  PHE   A CE2  
3344  C  CZ   . PHE   A  219 ? 0.32038444 0.37699941 0.32349521 -0.07685843 -0.06557485 0.01293069  274  PHE   A CZ   
3345  H  H    . PHE   A  219 ? 0.39932126 0.44138837 0.38115981 -0.07893421 -0.08004063 0.01163633  274  PHE   A H    
3346  H  HA   . PHE   A  219 ? 0.38377494 0.41567978 0.35363978 -0.06973186 -0.08054001 0.01591413  274  PHE   A HA   
3347  H  HB2  . PHE   A  219 ? 0.40434325 0.45891696 0.39805931 -0.06926601 -0.08590367 0.01305964  274  PHE   A HB2  
3348  H  HB3  . PHE   A  219 ? 0.40290660 0.44924426 0.38984182 -0.06538985 -0.08233470 0.01554189  274  PHE   A HB3  
3349  H  HD1  . PHE   A  219 ? 0.40904903 0.44934013 0.39370701 -0.06832943 -0.07092144 0.01629009  274  PHE   A HD1  
3350  H  HD2  . PHE   A  219 ? 0.37313622 0.43843532 0.38014522 -0.07640710 -0.07982070 0.01047935  274  PHE   A HD2  
3351  H  HE1  . PHE   A  219 ? 0.36690059 0.41141972 0.35892248 -0.07217910 -0.06268904 0.01560011  274  PHE   A HE1  
3352  H  HE2  . PHE   A  219 ? 0.36714169 0.43640324 0.38124239 -0.08134664 -0.07020895 0.01015697  274  PHE   A HE2  
3353  H  HZ   . PHE   A  219 ? 0.34535033 0.40325820 0.35072055 -0.07874250 -0.06203584 0.01290079  274  PHE   A HZ   
3354  N  N    . TRP   A  220 ? 0.32911950 0.36186451 0.29385030 -0.06780732 -0.09221756 0.01578580  275  TRP   A N    
3355  C  CA   . TRP   A  220 ? 0.27704713 0.30757841 0.23511545 -0.06753591 -0.09880680 0.01578090  275  TRP   A CA   
3356  C  C    . TRP   A  220 ? 0.29444599 0.32564110 0.25296223 -0.06219636 -0.10310593 0.01798957  275  TRP   A C    
3357  O  O    . TRP   A  220 ? 0.30558810 0.33123171 0.26004964 -0.05937097 -0.10032444 0.02031993  275  TRP   A O    
3358  C  CB   . TRP   A  220 ? 0.27081865 0.29006881 0.21395159 -0.06920894 -0.09735420 0.01630807  275  TRP   A CB   
3359  C  CG   . TRP   A  220 ? 0.27922535 0.29560691 0.22036162 -0.07358748 -0.09312866 0.01417430  275  TRP   A CG   
3360  C  CD1  . TRP   A  220 ? 0.27510297 0.28838828 0.21634378 -0.07423245 -0.08649401 0.01443348  275  TRP   A CD1  
3361  C  CD2  . TRP   A  220 ? 0.24190411 0.25780678 0.18075457 -0.07779569 -0.09568772 0.01138406  275  TRP   A CD2  
3362  N  NE1  . TRP   A  220 ? 0.27873650 0.28909647 0.21767850 -0.07820746 -0.08480621 0.01213493  275  TRP   A NE1  
3363  C  CE2  . TRP   A  220 ? 0.31458050 0.32627344 0.25205624 -0.08064080 -0.09024174 0.01012097  275  TRP   A CE2  
3364  C  CE3  . TRP   A  220 ? 0.31935504 0.33799607 0.25750801 -0.07950739 -0.10243063 0.00971208  275  TRP   A CE3  
3365  C  CZ2  . TRP   A  220 ? 0.29823679 0.30713347 0.23286600 -0.08504789 -0.09115484 0.00725126  275  TRP   A CZ2  
3366  C  CZ3  . TRP   A  220 ? 0.30499429 0.32137853 0.24029376 -0.08427059 -0.10332014 0.00672364  275  TRP   A CZ3  
3367  C  CH2  . TRP   A  220 ? 0.31188506 0.32312709 0.24550807 -0.08701974 -0.09758884 0.00548607  275  TRP   A CH2  
3368  H  H    . TRP   A  220 ? 0.31756541 0.34794357 0.28123033 -0.06542955 -0.09004685 0.01728569  275  TRP   A H    
3369  H  HA   . TRP   A  220 ? 0.28931016 0.32496756 0.25186285 -0.06970799 -0.10153172 0.01396433  275  TRP   A HA   
3370  H  HB2  . TRP   A  220 ? 0.27524939 0.29012099 0.21431807 -0.06717400 -0.09496555 0.01819219  275  TRP   A HB2  
3371  H  HB3  . TRP   A  220 ? 0.28290838 0.30070490 0.22110415 -0.06921285 -0.10181630 0.01622929  275  TRP   A HB3  
3372  H  HD1  . TRP   A  220 ? 0.27080286 0.28347790 0.21305083 -0.07219443 -0.08369038 0.01595840  275  TRP   A HD1  
3373  H  HE1  . TRP   A  220 ? 0.28171816 0.28952020 0.22012872 -0.07901516 -0.08108360 0.01195585  275  TRP   A HE1  
3374  H  HE3  . TRP   A  220 ? 0.29812834 0.31952661 0.23718578 -0.07739084 -0.10654092 0.01059618  275  TRP   A HE3  
3375  H  HZ2  . TRP   A  220 ? 0.30284232 0.30810252 0.23620337 -0.08659489 -0.08769371 0.00651605  275  TRP   A HZ2  
3376  H  HZ3  . TRP   A  220 ? 0.31660593 0.33472431 0.25115657 -0.08566169 -0.10806979 0.00545996  275  TRP   A HZ3  
3377  H  HH2  . TRP   A  220 ? 0.31258190 0.32146955 0.24390849 -0.09018872 -0.09844431 0.00338952  275  TRP   A HH2  
3378  N  N    . SER   A  221 ? 0.29725111 0.33512107 0.26096714 -0.06085123 -0.11008054 0.01721260  276  SER   A N    
3379  C  CA   . SER   A  221 ? 0.30250034 0.33928239 0.26477155 -0.05553513 -0.11551341 0.01940708  276  SER   A CA   
3380  C  C    . SER   A  221 ? 0.33123749 0.35502720 0.27667412 -0.05500736 -0.11647274 0.02224932  276  SER   A C    
3381  O  O    . SER   A  221 ? 0.32512647 0.34351304 0.26071900 -0.05873807 -0.11613000 0.02159892  276  SER   A O    
3382  C  CB   . SER   A  221 ? 0.34209618 0.38811457 0.31189886 -0.05449898 -0.12358642 0.01788498  276  SER   A CB   
3383  O  OG   . SER   A  221 ? 0.51669872 0.57584488 0.50291121 -0.05497546 -0.12208121 0.01532375  276  SER   A OG   
3384  H  H    . SER   A  221 ? 0.29758605 0.34069765 0.26590174 -0.06331514 -0.11168157 0.01528538  276  SER   A H    
3385  H  HA   . SER   A  221 ? 0.30936772 0.34792849 0.27694610 -0.05278027 -0.11326980 0.02007158  276  SER   A HA   
3386  H  HB2  . SER   A  221 ? 0.37216210 0.41657543 0.33681935 -0.05748044 -0.12598526 0.01700463  276  SER   A HB2  
3387  H  HB3  . SER   A  221 ? 0.37384713 0.41831583 0.34208602 -0.05057947 -0.12755118 0.01951512  276  SER   A HB3  
3389  N  N    . VAL   A  222 ? 0.38708940 0.40568101 0.32903498 -0.05052264 -0.11750023 0.02528120  277  VAL   A N    
3390  C  CA   . VAL   A  222 ? 0.49490985 0.50098825 0.42095113 -0.05049862 -0.11716618 0.02844403  277  VAL   A CA   
3391  C  C    . VAL   A  222 ? 0.43900311 0.44098833 0.35394970 -0.05194010 -0.12340878 0.02880880  277  VAL   A C    
3392  O  O    . VAL   A  222 ? 0.51133710 0.50500894 0.41296309 -0.05474290 -0.12124826 0.02962635  277  VAL   A O    
3393  C  CB   . VAL   A  222 ? 0.58376974 0.58445477 0.50813663 -0.04564155 -0.11816055 0.03181745  277  VAL   A CB   
3394  C  CG1  . VAL   A  222 ? 0.68541098 0.67328173 0.59279561 -0.04653702 -0.11799897 0.03534093  277  VAL   A CG1  
3395  C  CG2  . VAL   A  222 ? 0.75429571 0.75723767 0.68707132 -0.04454766 -0.11168769 0.03142023  277  VAL   A CG2  
3396  H  H    . VAL   A  222 ? 0.39140701 0.41428727 0.34099334 -0.04751426 -0.11840697 0.02533314  277  VAL   A H    
3397  H  HA   . VAL   A  222 ? 0.46753019 0.47051424 0.39011538 -0.05296390 -0.11191772 0.02820029  277  VAL   A HA   
3398  H  HB   . VAL   A  222 ? 0.61433154 0.61834431 0.54304290 -0.04261258 -0.12348484 0.03191917  277  VAL   A HB   
3399  H  HG11 . VAL   A  222 ? 0.65424931 0.63982350 0.55708027 -0.04974514 -0.11348700 0.03479288  277  VAL   A HG11 
3400  H  HG12 . VAL   A  222 ? 0.66362464 0.64948863 0.56534076 -0.04623410 -0.12313688 0.03609008  277  VAL   A HG12 
3401  H  HG13 . VAL   A  222 ? 0.65787953 0.64175278 0.56439078 -0.04428696 -0.11727662 0.03737979  277  VAL   A HG13 
3402  H  HG21 . VAL   A  222 ? 0.69388324 0.69331455 0.62585014 -0.04143400 -0.11280406 0.03325948  277  VAL   A HG21 
3403  H  HG22 . VAL   A  222 ? 0.68158519 0.69277656 0.62469649 -0.04431282 -0.11132666 0.02919144  277  VAL   A HG22 
3404  H  HG23 . VAL   A  222 ? 0.68875951 0.68829030 0.61721909 -0.04723121 -0.10679692 0.03150817  277  VAL   A HG23 
3405  N  N    . SER   A  223 ? 0.37904501 0.38774782 0.29991534 -0.05021285 -0.13102983 0.02779081  278  SER   A N    
3406  C  CA   . SER   A  223 ? 0.41621596 0.42137688 0.32662457 -0.05131584 -0.13801990 0.02810772  278  SER   A CA   
3407  C  C    . SER   A  223 ? 0.44629544 0.45135790 0.35162032 -0.05703685 -0.13659371 0.02501672  278  SER   A C    
3408  O  O    . SER   A  223 ? 0.45502669 0.45616794 0.34989977 -0.05842786 -0.14190000 0.02497381  278  SER   A O    
3409  C  CB   . SER   A  223 ? 0.40139383 0.41503006 0.32104445 -0.04770236 -0.14710641 0.02757977  278  SER   A CB   
3410  O  OG   . SER   A  223 ? 0.41967672 0.44684082 0.35551527 -0.04919741 -0.14711146 0.02369484  278  SER   A OG   
3411  H  H    . SER   A  223 ? 0.39671493 0.41270536 0.32847577 -0.04829114 -0.13197422 0.02677319  278  SER   A H    
3412  H  HA   . SER   A  223 ? 0.42049837 0.41703165 0.31995425 -0.05048097 -0.13835253 0.03084338  278  SER   A HA   
3413  H  HB2  . SER   A  223 ? 0.42182639 0.43222204 0.33331323 -0.04826397 -0.15219823 0.02812347  278  SER   A HB2  
3414  H  HB3  . SER   A  223 ? 0.41221869 0.42497355 0.33437565 -0.04359677 -0.14832017 0.02950333  278  SER   A HB3  
3416  N  N    . ILE   A  224 ? 0.38917100 0.39786571 0.30120486 -0.06028650 -0.12982984 0.02237759  279  ILE   A N    
3417  C  CA   . ILE   A  224 ? 0.31442785 0.32144094 0.22113535 -0.06548335 -0.12832198 0.01931605  279  ILE   A CA   
3418  C  C    . ILE   A  224 ? 0.35191435 0.34735957 0.24315289 -0.06680731 -0.12301122 0.02062083  279  ILE   A C    
3419  O  O    . ILE   A  224 ? 0.35905924 0.35235751 0.25167185 -0.06640069 -0.11600777 0.02155843  279  ILE   A O    
3420  C  CB   . ILE   A  224 ? 0.31222183 0.32684639 0.23156703 -0.06864037 -0.12390292 0.01606005  279  ILE   A CB   
3421  C  CG1  . ILE   A  224 ? 0.34390867 0.37151426 0.27955791 -0.06773429 -0.12832321 0.01463251  279  ILE   A CG1  
3422  C  CG2  . ILE   A  224 ? 0.30140662 0.31193689 0.21351713 -0.07390774 -0.12271535 0.01288930  279  ILE   A CG2  
3423  C  CD1  . ILE   A  224 ? 0.36135888 0.39654243 0.30986649 -0.07031566 -0.12314075 0.01245948  279  ILE   A CD1  
3424  H  H    . ILE   A  224 ? 0.36971435 0.38160133 0.28947541 -0.05919106 -0.12630223 0.02244419  279  ILE   A H    
3425  H  HA   . ILE   A  224 ? 0.34287831 0.35084394 0.24694836 -0.06617442 -0.13390428 0.01850597  279  ILE   A HA   
3426  H  HB   . ILE   A  224 ? 0.30706158 0.32047045 0.22849947 -0.06790790 -0.11844970 0.01692264  279  ILE   A HB   
3427  H  HG12 . ILE   A  224 ? 0.34777206 0.37738144 0.28233212 -0.06916614 -0.13352793 0.01331721  279  ILE   A HG12 
3428  H  HG13 . ILE   A  224 ? 0.34049848 0.36980498 0.27925199 -0.06384707 -0.13006693 0.01648732  279  ILE   A HG13 
3429  H  HG21 . ILE   A  224 ? 0.31349379 0.32435045 0.22218516 -0.07482355 -0.12810019 0.01198351  279  ILE   A HG21 
3430  H  HG22 . ILE   A  224 ? 0.30818078 0.31136984 0.21118514 -0.07420614 -0.11904301 0.01351308  279  ILE   A HG22 
3431  H  HG23 . ILE   A  224 ? 0.30053228 0.31530243 0.22039488 -0.07604815 -0.12031866 0.01107887  279  ILE   A HG23 
3432  H  HD11 . ILE   A  224 ? 0.35243243 0.38486981 0.29748338 -0.07405439 -0.12122724 0.01079556  279  ILE   A HD11 
3433  H  HD12 . ILE   A  224 ? 0.34603760 0.38006735 0.29639846 -0.06858372 -0.11854560 0.01375101  279  ILE   A HD12 
3434  H  HD13 . ILE   A  224 ? 0.35018259 0.39420617 0.30866635 -0.07007544 -0.12624933 0.01137574  279  ILE   A HD13 
3435  N  N    . PRO   A  225 ? 0.35444111 0.34267202 0.23073959 -0.06850057 -0.12593326 0.02053064  280  PRO   A N    
3436  C  CA   . PRO   A  225 ? 0.37856627 0.35683385 0.24043927 -0.06956402 -0.12040105 0.02173073  280  PRO   A CA   
3437  C  C    . PRO   A  225 ? 0.41764668 0.39617705 0.28337958 -0.07194804 -0.11231425 0.01911597  280  PRO   A C    
3438  O  O    . PRO   A  225 ? 0.36270803 0.34625077 0.23668912 -0.07418349 -0.11235592 0.01581926  280  PRO   A O    
3439  C  CB   . PRO   A  225 ? 0.41142994 0.38401255 0.25833979 -0.07169673 -0.12528102 0.02066448  280  PRO   A CB   
3440  C  CG   . PRO   A  225 ? 0.37760317 0.35649163 0.23046035 -0.07111074 -0.13450517 0.01982467  280  PRO   A CG   
3441  C  CD   . PRO   A  225 ? 0.37482440 0.36465293 0.24742226 -0.06980363 -0.13432908 0.01889360  280  PRO   A CD   
3442  H  HA   . PRO   A  225 ? 0.38576865 0.36118665 0.24529009 -0.06739109 -0.11942938 0.02474293  280  PRO   A HA   
3443  H  HB2  . PRO   A  225 ? 0.39909786 0.36992922 0.24269775 -0.07426941 -0.12246976 0.01797802  280  PRO   A HB2  
3444  H  HB3  . PRO   A  225 ? 0.40516606 0.37182474 0.24198708 -0.07087564 -0.12522000 0.02315281  280  PRO   A HB3  
3445  H  HG2  . PRO   A  225 ? 0.39369249 0.37205133 0.24252465 -0.07371403 -0.13660939 0.01720944  280  PRO   A HG2  
3446  H  HG3  . PRO   A  225 ? 0.39515561 0.37166268 0.24292827 -0.06901976 -0.13874888 0.02242102  280  PRO   A HG3  
3447  H  HD2  . PRO   A  225 ? 0.36753190 0.36130837 0.24518102 -0.07239380 -0.13443255 0.01590957  280  PRO   A HD2  
3448  H  HD3  . PRO   A  225 ? 0.37144190 0.36500898 0.24862406 -0.06728707 -0.13939439 0.02022706  280  PRO   A HD3  
3449  N  N    . HIS   A  226 ? 0.35711634 0.32997158 0.21641916 -0.07163491 -0.10568778 0.02067221  281  HIS   A N    
3450  C  CA   . HIS   A  226 ? 0.36505717 0.33726829 0.22661901 -0.07328467 -0.09826512 0.01843802  281  HIS   A CA   
3451  C  C    . HIS   A  226 ? 0.36084598 0.33087370 0.21719474 -0.07653003 -0.09876216 0.01410464  281  HIS   A C    
3452  O  O    . HIS   A  226 ? 0.32826474 0.30039424 0.19169000 -0.07812542 -0.09591325 0.01138409  281  HIS   A O    
3453  C  CB   . HIS   A  226 ? 0.34819639 0.31481111 0.20199889 -0.07243882 -0.09201978 0.02084674  281  HIS   A CB   
3454  C  CG   . HIS   A  226 ? 0.40752679 0.37546453 0.26670584 -0.06970002 -0.09158578 0.02478256  281  HIS   A CG   
3455  N  ND1  . HIS   A  226 ? 0.51893038 0.48107120 0.36865130 -0.06901387 -0.08993521 0.02829088  281  HIS   A ND1  
3456  C  CD2  . HIS   A  226 ? 0.45111859 0.42504656 0.32354206 -0.06772673 -0.09243076 0.02550336  281  HIS   A CD2  
3457  C  CE1  . HIS   A  226 ? 0.58882844 0.55285633 0.44626594 -0.06659792 -0.09017080 0.03096099  281  HIS   A CE1  
3458  N  NE2  . HIS   A  226 ? 0.43007407 0.40127867 0.30119303 -0.06548320 -0.09148408 0.02926343  281  HIS   A NE2  
3459  H  H    . HIS   A  226 ? 0.37752351 0.34678483 0.23082033 -0.07038244 -0.10596391 0.02324007  281  HIS   A H    
3460  H  HA   . HIS   A  226 ? 0.34825435 0.32531226 0.22042516 -0.07276514 -0.09707066 0.01821874  281  HIS   A HA   
3461  H  HB2  . HIS   A  226 ? 0.37486136 0.33689028 0.21792078 -0.07308073 -0.09292316 0.02123684  281  HIS   A HB2  
3462  H  HB3  . HIS   A  226 ? 0.36099711 0.32747239 0.21653642 -0.07322047 -0.08730961 0.01925788  281  HIS   A HB3  
3464  H  HD2  . HIS   A  226 ? 0.42815378 0.40701303 0.30892837 -0.06800986 -0.09325068 0.02372868  281  HIS   A HD2  
3465  H  HE1  . HIS   A  226 ? 0.53085160 0.49141669 0.38436568 -0.06592005 -0.08937621 0.03364053  281  HIS   A HE1  
3467  N  N    . GLU   A  227 ? 0.36492154 0.32994086 0.20811565 -0.07762077 -0.10258065 0.01343432  282  GLU   A N    
3468  C  CA   . GLU   A  227 ? 0.36764032 0.32900387 0.20370802 -0.08061438 -0.10289440 0.00900464  282  GLU   A CA   
3469  C  C    . GLU   A  227 ? 0.33325660 0.30026782 0.17971280 -0.08280598 -0.10749768 0.00609711  282  GLU   A C    
3470  O  O    . GLU   A  227 ? 0.41181082 0.37674057 0.25814930 -0.08536806 -0.10561577 0.00234236  282  GLU   A O    
3471  C  CB   . GLU   A  227 ? 0.41972184 0.37464595 0.23878251 -0.08138348 -0.10647772 0.00889178  282  GLU   A CB   
3472  C  CG   . GLU   A  227 ? 0.51413941 0.46354455 0.32209939 -0.08012960 -0.10145339 0.01165976  282  GLU   A CG   
3473  C  CD   . GLU   A  227 ? 0.54437035 0.49374422 0.35100693 -0.07784821 -0.10409825 0.01709704  282  GLU   A CD   
3474  O  OE1  . GLU   A  227 ? 0.42732561 0.38187528 0.24428515 -0.07605821 -0.10913090 0.01910590  282  GLU   A OE1  
3475  O  OE2  . GLU   A  227 ? 0.53637648 0.47995698 0.33048066 -0.07795838 -0.10104603 0.01921300  282  GLU   A OE2  
3476  H  H    . GLU   A  227 ? 0.37285644 0.33628243 0.21099725 -0.07649079 -0.10518705 0.01574752  282  GLU   A H    
3477  H  HA   . GLU   A  227 ? 0.36575785 0.32486188 0.20099959 -0.08088121 -0.09744387 0.00778154  282  GLU   A HA   
3478  H  HB2  . GLU   A  227 ? 0.43215096 0.38911563 0.25184733 -0.08095542 -0.11231118 0.01019464  282  GLU   A HB2  
3479  H  HB3  . GLU   A  227 ? 0.43372124 0.38606572 0.24817592 -0.08333655 -0.10660896 0.00554932  282  GLU   A HB3  
3480  H  HG2  . GLU   A  227 ? 0.50553775 0.45028526 0.30216354 -0.08136507 -0.10157956 0.01012272  282  GLU   A HG2  
3481  H  HG3  . GLU   A  227 ? 0.48673362 0.43647319 0.29846048 -0.07973417 -0.09569349 0.01129394  282  GLU   A HG3  
3482  N  N    . ARG   A  228 ? 0.36223102 0.33639276 0.21794346 -0.08173160 -0.11333188 0.00786234  283  ARG   A N    
3483  C  CA   . ARG   A  228 ? 0.34023336 0.32195222 0.20768830 -0.08396506 -0.11785293 0.00547192  283  ARG   A CA   
3484  C  C    . ARG   A  228 ? 0.38060206 0.36681432 0.26132816 -0.08468332 -0.11216021 0.00481719  283  ARG   A C    
3485  O  O    . ARG   A  228 ? 0.31316113 0.30111465 0.19901901 -0.08826344 -0.11233830 0.00168858  283  ARG   A O    
3486  C  CB   . ARG   A  228 ? 0.34405684 0.33286762 0.21750346 -0.08182779 -0.12571567 0.00760109  283  ARG   A CB   
3487  C  CG   . ARG   A  228 ? 0.38820037 0.38762063 0.27643573 -0.08372193 -0.13039133 0.00551481  283  ARG   A CG   
3488  C  CD   . ARG   A  228 ? 0.45775971 0.45599926 0.34269071 -0.08886050 -0.13371316 0.00112235  283  ARG   A CD   
3489  N  NE   . ARG   A  228 ? 0.46665779 0.45974290 0.33777317 -0.08927983 -0.14027977 0.00053873  283  ARG   A NE   
3490  C  CZ   . ARG   A  228 ? 0.63368273 0.62228251 0.49660909 -0.09344910 -0.14298281 -0.00332966 283  ARG   A CZ   
3491  N  NH1  . ARG   A  228 ? 0.50682950 0.49388140 0.37287477 -0.09745448 -0.13927862 -0.00684443 283  ARG   A NH1  
3492  N  NH2  . ARG   A  228 ? 0.49873966 0.48370618 0.34957930 -0.09367009 -0.14987735 -0.00369663 283  ARG   A NH2  
3493  H  H    . ARG   A  228 ? 0.35021165 0.32466593 0.20494202 -0.07949924 -0.11457594 0.01065993  283  ARG   A H    
3494  H  HA   . ARG   A  228 ? 0.36106455 0.33993194 0.22307190 -0.08656283 -0.11968354 0.00271939  283  ARG   A HA   
3495  H  HB2  . ARG   A  228 ? 0.36343175 0.34851679 0.22724906 -0.08180379 -0.12965308 0.00781553  283  ARG   A HB2  
3496  H  HB3  . ARG   A  228 ? 0.34845424 0.33839315 0.22499293 -0.07892001 -0.12402920 0.01036733  283  ARG   A HB3  
3497  H  HG2  . ARG   A  228 ? 0.38871735 0.39244688 0.28011432 -0.08165225 -0.13535871 0.00694377  283  ARG   A HG2  
3498  H  HG3  . ARG   A  228 ? 0.37771654 0.38107914 0.27538645 -0.08368517 -0.12647434 0.00559119  283  ARG   A HG3  
3499  H  HD2  . ARG   A  228 ? 0.43729389 0.44311631 0.33289793 -0.09039427 -0.13617390 -0.00002811 283  ARG   A HD2  
3500  H  HD3  . ARG   A  228 ? 0.44029343 0.43362367 0.32189512 -0.09061933 -0.12890774 -0.00037765 283  ARG   A HD3  
3501  H  HE   . ARG   A  228 ? 0.50112915 0.49361891 0.36866441 -0.08668787 -0.14266704 0.00284974  283  ARG   A HE   
3502  H  HH11 . ARG   A  228 ? 0.53339326 0.52627683 0.41024825 -0.09879646 -0.13892324 -0.00736740 283  ARG   A HH11 
3503  H  HH12 . ARG   A  228 ? 0.54607016 0.52604467 0.40315884 -0.09875505 -0.13719006 -0.00865254 283  ARG   A HH12 
3504  H  HH21 . ARG   A  228 ? 0.54530913 0.52600706 0.38891590 -0.09628454 -0.15110768 -0.00634407 283  ARG   A HH21 
3505  H  HH22 . ARG   A  228 ? 0.53925335 0.52575445 0.38902107 -0.09117860 -0.15329543 -0.00130267 283  ARG   A HH22 
3506  N  N    . ARG   A  229 ? 0.35417402 0.34113464 0.23909232 -0.08164205 -0.10696706 0.00777376  284  ARG   A N    
3507  C  CA   . ARG   A  229 ? 0.30449885 0.29474646 0.20017636 -0.08214408 -0.10131544 0.00745674  284  ARG   A CA   
3508  C  C    . ARG   A  229 ? 0.29963604 0.28335762 0.19007105 -0.08497842 -0.09697814 0.00441896  284  ARG   A C    
3509  O  O    . ARG   A  229 ? 0.32641804 0.31229571 0.22431794 -0.08772714 -0.09581556 0.00249451  284  ARG   A O    
3510  C  CB   . ARG   A  229 ? 0.30398944 0.29430100 0.20204476 -0.07843447 -0.09652529 0.01095346  284  ARG   A CB   
3511  C  CG   . ARG   A  229 ? 0.33870363 0.33426276 0.24185860 -0.07522011 -0.10092703 0.01373848  284  ARG   A CG   
3512  C  CD   . ARG   A  229 ? 0.31756914 0.31211346 0.22228476 -0.07175390 -0.09674706 0.01706329  284  ARG   A CD   
3513  N  NE   . ARG   A  229 ? 0.28606123 0.28187174 0.19088392 -0.06832080 -0.10165162 0.01983653  284  ARG   A NE   
3514  C  CZ   . ARG   A  229 ? 0.31647217 0.31282473 0.22528912 -0.06501859 -0.10003717 0.02252568  284  ARG   A CZ   
3515  N  NH1  . ARG   A  229 ? 0.39757460 0.39389652 0.31062168 -0.06481843 -0.09356581 0.02290451  284  ARG   A NH1  
3516  N  NH2  . ARG   A  229 ? 0.31043604 0.30662256 0.21834481 -0.06175224 -0.10535365 0.02487128  284  ARG   A NH2  
3517  H  H    . ARG   A  229 ? 0.34967971 0.33468449 0.23016670 -0.07939555 -0.10706031 0.01005248  284  ARG   A H    
3518  H  HA   . ARG   A  229 ? 0.30767059 0.30433834 0.21257722 -0.08310533 -0.10363488 0.00686847  284  ARG   A HA   
3519  H  HB2  . ARG   A  229 ? 0.31357509 0.29816389 0.20297873 -0.07777728 -0.09410566 0.01156027  284  ARG   A HB2  
3520  H  HB3  . ARG   A  229 ? 0.30252692 0.29490244 0.20724688 -0.07883456 -0.09293858 0.01068466  284  ARG   A HB3  
3521  H  HG2  . ARG   A  229 ? 0.32271338 0.32483804 0.23517336 -0.07571199 -0.10305508 0.01290168  284  ARG   A HG2  
3522  H  HG3  . ARG   A  229 ? 0.33424187 0.32744658 0.23048662 -0.07485994 -0.10492254 0.01415852  284  ARG   A HG3  
3523  H  HD2  . ARG   A  229 ? 0.31367147 0.30256027 0.21077298 -0.07190331 -0.09339132 0.01756976  284  ARG   A HD2  
3524  H  HD3  . ARG   A  229 ? 0.30424109 0.30263203 0.21735176 -0.07172661 -0.09395825 0.01678354  284  ARG   A HD3  
3525  H  HE   . ARG   A  229 ? 0.30828500 0.30406249 0.21004072 -0.06837534 -0.10620285 0.01967542  284  ARG   A HE   
3526  H  HH11 . ARG   A  229 ? 0.36292887 0.35664725 0.27291563 -0.06647716 -0.08995582 0.02213638  284  ARG   A HH11 
3527  H  HH12 . ARG   A  229 ? 0.35988855 0.35873374 0.27869317 -0.06290267 -0.09303036 0.02385359  284  ARG   A HH12 
3528  H  HH21 . ARG   A  229 ? 0.31459063 0.30836475 0.22158402 -0.05978825 -0.10419630 0.02689551  284  ARG   A HH21 
3529  H  HH22 . ARG   A  229 ? 0.31832767 0.31658763 0.22648977 -0.06153833 -0.11018382 0.02438981  284  ARG   A HH22 
3530  N  N    . ILE   A  230 ? 0.29271114 0.26820734 0.17002489 -0.08428276 -0.09453388 0.00395901  285  ILE   A N    
3531  C  CA   . ILE   A  230 ? 0.32845753 0.29707342 0.19997962 -0.08596646 -0.09038375 0.00079054  285  ILE   A CA   
3532  C  C    . ILE   A  230 ? 0.29383236 0.26047722 0.16336226 -0.08997805 -0.09475330 -0.00323470 285  ILE   A C    
3533  O  O    . ILE   A  230 ? 0.29465696 0.25848761 0.16670272 -0.09220236 -0.09249052 -0.00569918 285  ILE   A O    
3534  C  CB   . ILE   A  230 ? 0.33259135 0.29406953 0.19057626 -0.08396511 -0.08658078 0.00097984  285  ILE   A CB   
3535  C  CG1  . ILE   A  230 ? 0.34371883 0.30692667 0.20546597 -0.08090366 -0.08105209 0.00445126  285  ILE   A CG1  
3536  C  CG2  . ILE   A  230 ? 0.31719470 0.27112734 0.16690844 -0.08529446 -0.08380655 -0.00323618 285  ILE   A CG2  
3537  C  CD1  . ILE   A  230 ? 0.32908988 0.29410708 0.20119055 -0.08080881 -0.07632106 0.00410873  285  ILE   A CD1  
3538  H  H    . ILE   A  230 ? 0.30652553 0.28059459 0.17827976 -0.08262946 -0.09539089 0.00563104  285  ILE   A H    
3539  H  HA   . ILE   A  230 ? 0.30542061 0.27523351 0.18330207 -0.08577144 -0.08685582 0.00111908  285  ILE   A HA   
3540  H  HB   . ILE   A  230 ? 0.33800304 0.29890722 0.18991035 -0.08378366 -0.08998068 0.00169039  285  ILE   A HB   
3541  H  HG12 . ILE   A  230 ? 0.33491933 0.30175146 0.20002216 -0.07986055 -0.08324724 0.00698275  285  ILE   A HG12 
3542  H  HG13 . ILE   A  230 ? 0.34196734 0.30137640 0.19579433 -0.08002222 -0.07838754 0.00446042  285  ILE   A HG13 
3543  H  HG21 . ILE   A  230 ? 0.31925279 0.27324086 0.17489241 -0.08594923 -0.08181571 -0.00423821 285  ILE   A HG21 
3544  H  HG22 . ILE   A  230 ? 0.33190006 0.28374958 0.17646572 -0.08709281 -0.08758301 -0.00531084 285  ILE   A HG22 
3545  H  HG23 . ILE   A  230 ? 0.32624447 0.27717105 0.16965517 -0.08368386 -0.08027194 -0.00297492 285  ILE   A HG23 
3546  H  HD11 . ILE   A  230 ? 0.32415378 0.29391962 0.20459658 -0.08129944 -0.07815465 0.00500677  285  ILE   A HD11 
3547  H  HD12 . ILE   A  230 ? 0.33302957 0.29456335 0.20304763 -0.08210487 -0.07542807 0.00145256  285  ILE   A HD12 
3548  H  HD13 . ILE   A  230 ? 0.32603309 0.29078719 0.19812933 -0.07899033 -0.07248835 0.00564669  285  ILE   A HD13 
3549  N  N    . LEU   A  231 ? 0.38234049 0.34963703 0.24647388 -0.09098148 -0.10128687 -0.00385919 286  LEU   A N    
3550  C  CA   . LEU   A  231 ? 0.33809161 0.30329227 0.19924486 -0.09515075 -0.10621382 -0.00790127 286  LEU   A CA   
3551  C  C    . LEU   A  231 ? 0.31081665 0.28322786 0.18677014 -0.09831597 -0.10780662 -0.00855329 286  LEU   A C    
3552  O  O    . LEU   A  231 ? 0.31228873 0.28111544 0.18812212 -0.10224760 -0.10813487 -0.01189720 286  LEU   A O    
3553  C  CB   . LEU   A  231 ? 0.35599944 0.32155448 0.20921320 -0.09549250 -0.11358566 -0.00807942 286  LEU   A CB   
3554  C  CG   . LEU   A  231 ? 0.50317311 0.45898256 0.33807695 -0.09509242 -0.11307922 -0.00986438 286  LEU   A CG   
3555  C  CD1  . LEU   A  231 ? 0.58038568 0.53678167 0.40732062 -0.09541051 -0.12097844 -0.00939975 286  LEU   A CD1  
3556  C  CD2  . LEU   A  231 ? 0.45906401 0.40696192 0.28749993 -0.09810428 -0.11138061 -0.01504261 286  LEU   A CD2  
3557  H  H    . LEU   A  231 ? 0.34715396 0.31589282 0.20907089 -0.08911915 -0.10296514 -0.00171700 286  LEU   A H    
3558  H  HA   . LEU   A  231 ? 0.34995249 0.30850112 0.20451565 -0.09586398 -0.10348405 -0.01023078 286  LEU   A HA   
3559  H  HB2  . LEU   A  231 ? 0.37425897 0.34433421 0.23085804 -0.09323853 -0.11503491 -0.00510356 286  LEU   A HB2  
3560  H  HB3  . LEU   A  231 ? 0.38002980 0.34818342 0.23690166 -0.09832396 -0.11786409 -0.00996356 286  LEU   A HB3  
3561  H  HG   . LEU   A  231 ? 0.46821132 0.42202440 0.29986069 -0.09253286 -0.10858365 -0.00796788 286  LEU   A HG   
3562  H  HD11 . LEU   A  231 ? 0.56648755 0.51688933 0.38130987 -0.09477270 -0.11987962 -0.00984999 286  LEU   A HD11 
3563  H  HD12 . LEU   A  231 ? 0.56193841 0.51949018 0.39042932 -0.09821079 -0.12541251 -0.01184013 286  LEU   A HD12 
3564  H  HD13 . LEU   A  231 ? 0.55078381 0.51229280 0.38293487 -0.09347264 -0.12286324 -0.00623483 286  LEU   A HD13 
3565  H  HD21 . LEU   A  231 ? 0.46640742 0.41239083 0.29745609 -0.09722328 -0.10602167 -0.01518476 286  LEU   A HD21 
3566  H  HD22 . LEU   A  231 ? 0.47438157 0.42439061 0.30765074 -0.10104020 -0.11516916 -0.01679964 286  LEU   A HD22 
3567  H  HD23 . LEU   A  231 ? 0.48361000 0.42603606 0.30025220 -0.09799504 -0.11193858 -0.01654353 286  LEU   A HD23 
3568  N  N    . THR   A  232 ? 0.29334170 0.27532524 0.18158978 -0.09654768 -0.10811809 -0.00535730 287  THR   A N    
3569  C  CA   . THR   A  232 ? 0.32212842 0.31269664 0.22510135 -0.09937997 -0.10900639 -0.00565116 287  THR   A CA   
3570  C  C    . THR   A  232 ? 0.35074073 0.33742949 0.25700855 -0.10108972 -0.10248134 -0.00631175 287  THR   A C    
3571  O  O    . THR   A  232 ? 0.31181860 0.29936346 0.22338186 -0.10583221 -0.10326590 -0.00842125 287  THR   A O    
3572  C  CB   . THR   A  232 ? 0.31087804 0.31216490 0.22497813 -0.09621508 -0.11044648 -0.00239598 287  THR   A CB   
3573  O  OG1  . THR   A  232 ? 0.26727509 0.27109319 0.17755705 -0.09464937 -0.11755822 -0.00190058 287  THR   A OG1  
3574  C  CG2  . THR   A  232 ? 0.29565042 0.30723768 0.22566611 -0.09905873 -0.11046495 -0.00280684 287  THR   A CG2  
3575  H  H    . THR   A  232 ? 0.30060181 0.28373373 0.18776423 -0.09350702 -0.10768503 -0.00297467 287  THR   A H    
3576  H  HA   . THR   A  232 ? 0.32472754 0.31641164 0.22778393 -0.10249399 -0.11337113 -0.00780261 287  THR   A HA   
3577  H  HB   . THR   A  232 ? 0.29290748 0.29247206 0.20601887 -0.09318844 -0.10645001 -0.00030318 287  THR   A HB   
3579  H  HG21 . THR   A  232 ? 0.29394326 0.31271982 0.23077226 -0.09674396 -0.11203550 -0.00120311 287  THR   A HG21 
3580  H  HG22 . THR   A  232 ? 0.30303031 0.31587800 0.23410067 -0.10272031 -0.11382692 -0.00503198 287  THR   A HG22 
3581  H  HG23 . THR   A  232 ? 0.29323682 0.30298230 0.22546041 -0.09959860 -0.10555685 -0.00249034 287  THR   A HG23 
3582  N  N    . ILE   A  233 ? 0.30061930 0.28251481 0.20311019 -0.09748384 -0.09633524 -0.00449794 288  ILE   A N    
3583  C  CA   . ILE   A  233 ? 0.30280411 0.28064874 0.20787027 -0.09835569 -0.09051332 -0.00476479 288  ILE   A CA   
3584  C  C    . ILE   A  233 ? 0.36885366 0.33693552 0.26577044 -0.10173997 -0.09090285 -0.00869296 288  ILE   A C    
3585  O  O    . ILE   A  233 ? 0.32722008 0.29367381 0.22877032 -0.10553191 -0.09009176 -0.00993915 288  ILE   A O    
3586  C  CB   . ILE   A  233 ? 0.30281180 0.27805299 0.20530054 -0.09368888 -0.08467776 -0.00226858 288  ILE   A CB   
3587  C  CG1  . ILE   A  233 ? 0.30934501 0.29404268 0.22214715 -0.09119136 -0.08405312 0.00133947  288  ILE   A CG1  
3588  C  CG2  . ILE   A  233 ? 0.32062849 0.28897786 0.22196285 -0.09401330 -0.07929889 -0.00317167 288  ILE   A CG2  
3589  C  CD1  . ILE   A  233 ? 0.32455912 0.30728093 0.23391807 -0.08659350 -0.07962228 0.00405017  288  ILE   A CD1  
3590  H  H    . ILE   A  233 ? 0.31141499 0.29259577 0.20970595 -0.09454066 -0.09595638 -0.00300001 288  ILE   A H    
3591  H  HA   . ILE   A  233 ? 0.30623102 0.28960890 0.22036037 -0.09997226 -0.09042707 -0.00407864 288  ILE   A HA   
3592  H  HB   . ILE   A  233 ? 0.31263161 0.28449515 0.20708328 -0.09190708 -0.08507360 -0.00243122 288  ILE   A HB   
3593  H  HG12 . ILE   A  233 ? 0.30443025 0.29218864 0.22459537 -0.09269331 -0.08261537 0.00156662  288  ILE   A HG12 
3594  H  HG13 . ILE   A  233 ? 0.31035310 0.29955494 0.22491209 -0.09118648 -0.08812683 0.00160814  288  ILE   A HG13 
3595  H  HG21 . ILE   A  233 ? 0.31277168 0.28309578 0.22041924 -0.09649606 -0.07927018 -0.00326734 288  ILE   A HG21 
3596  H  HG22 . ILE   A  233 ? 0.32285625 0.28460455 0.21666476 -0.09456696 -0.07942956 -0.00548367 288  ILE   A HG22 
3597  H  HG23 . ILE   A  233 ? 0.30997750 0.27840805 0.21164688 -0.09116948 -0.07583698 -0.00137412 288  ILE   A HG23 
3598  H  HD11 . ILE   A  233 ? 0.31633937 0.29564548 0.22513761 -0.08639093 -0.07575774 0.00385996  288  ILE   A HD11 
3599  H  HD12 . ILE   A  233 ? 0.32376295 0.30323708 0.22539264 -0.08545327 -0.08062781 0.00391088  288  ILE   A HD12 
3600  H  HD13 . ILE   A  233 ? 0.31240469 0.30050641 0.22778872 -0.08512272 -0.07974991 0.00604500  288  ILE   A HD13 
3601  N  N    . LEU   A  234 ? 0.35623056 0.31739616 0.24040693 -0.10031902 -0.09200417 -0.01056395 289  LEU   A N    
3602  C  CA   . LEU   A  234 ? 0.37988281 0.33070359 0.25422046 -0.10266546 -0.09249850 -0.01485402 289  LEU   A CA   
3603  C  C    . LEU   A  234 ? 0.32482374 0.27699748 0.20279025 -0.10857259 -0.09816077 -0.01742297 289  LEU   A C    
3604  O  O    . LEU   A  234 ? 0.30122554 0.24621087 0.17758289 -0.11188134 -0.09753469 -0.02013764 289  LEU   A O    
3605  C  CB   . LEU   A  234 ? 0.37463200 0.31983152 0.23476702 -0.10032785 -0.09335909 -0.01645917 289  LEU   A CB   
3606  C  CG   . LEU   A  234 ? 0.38426614 0.32636684 0.23872176 -0.09538443 -0.08720078 -0.01497757 289  LEU   A CG   
3607  C  CD1  . LEU   A  234 ? 0.37402579 0.31243712 0.21457803 -0.09389059 -0.08860371 -0.01611901 289  LEU   A CD1  
3608  C  CD2  . LEU   A  234 ? 0.39599714 0.33044302 0.24929094 -0.09450000 -0.08168856 -0.01702234 289  LEU   A CD2  
3609  H  H    . LEU   A  234 ? 0.36243266 0.32511598 0.24358138 -0.09777404 -0.09235616 -0.00914819 289  LEU   A H    
3610  H  HA   . LEU   A  234 ? 0.35981441 0.30616710 0.23422661 -0.10208754 -0.08853326 -0.01516961 289  LEU   A HA   
3611  H  HB2  . LEU   A  234 ? 0.38104099 0.33080223 0.24116795 -0.10040485 -0.09718066 -0.01545059 289  LEU   A HB2  
3612  H  HB3  . LEU   A  234 ? 0.38967156 0.32859775 0.24359480 -0.10230491 -0.09463234 -0.01975565 289  LEU   A HB3  
3613  H  HG   . LEU   A  234 ? 0.37011209 0.31794780 0.23093799 -0.09365606 -0.08589069 -0.01174654 289  LEU   A HG   
3614  H  HD11 . LEU   A  234 ? 0.37770736 0.31530392 0.21542940 -0.09102762 -0.08452436 -0.01488847 289  LEU   A HD11 
3615  H  HD12 . LEU   A  234 ? 0.38941836 0.32186544 0.22303793 -0.09535567 -0.08961181 -0.01956152 289  LEU   A HD12 
3616  H  HD13 . LEU   A  234 ? 0.38017201 0.32292962 0.22143701 -0.09440604 -0.09260282 -0.01465871 289  LEU   A HD13 
3617  H  HD21 . LEU   A  234 ? 0.38510364 0.32219660 0.24679011 -0.09504657 -0.08040112 -0.01547564 289  LEU   A HD21 
3618  H  HD22 . LEU   A  234 ? 0.40154782 0.33009985 0.24981728 -0.09646533 -0.08322599 -0.02030213 289  LEU   A HD22 
3619  H  HD23 . LEU   A  234 ? 0.39224273 0.32499427 0.24129835 -0.09140595 -0.07806125 -0.01661915 289  LEU   A HD23 
3620  N  N    . GLN   A  235 ? 0.37635255 0.33791274 0.25981730 -0.10987444 -0.10378495 -0.01645432 290  GLN   A N    
3621  C  CA   . GLN   A  235 ? 0.45463240 0.41960174 0.34291118 -0.11578290 -0.10968269 -0.01888203 290  GLN   A CA   
3622  C  C    . GLN   A  235 ? 0.40623590 0.37622362 0.30775294 -0.11965166 -0.10763458 -0.01802690 290  GLN   A C    
3623  O  O    . GLN   A  235 ? 0.38277370 0.34935427 0.28505224 -0.12539074 -0.10954986 -0.02072573 290  GLN   A O    
3624  C  CB   . GLN   A  235 ? 0.42404491 0.39843342 0.31497121 -0.11543999 -0.11652578 -0.01807905 290  GLN   A CB   
3625  C  CG   . GLN   A  235 ? 0.41826487 0.38504902 0.29322881 -0.11425002 -0.12017018 -0.02024771 290  GLN   A CG   
3626  C  CD   . GLN   A  235 ? 0.52734017 0.50173867 0.40237468 -0.11232433 -0.12660328 -0.01849148 290  GLN   A CD   
3627  O  OE1  . GLN   A  235 ? 0.51581609 0.50159454 0.40325260 -0.11134948 -0.12883560 -0.01589174 290  GLN   A OE1  
3628  N  NE2  . GLN   A  235 ? 0.65675032 0.62471837 0.51738256 -0.11156820 -0.12994641 -0.01999356 290  GLN   A NE2  
3629  H  H    . GLN   A  235 ? 0.37101510 0.33700916 0.25538442 -0.10702974 -0.10413047 -0.01427008 290  GLN   A H    
3630  H  HA   . GLN   A  235 ? 0.43275338 0.38983944 0.31294996 -0.11772883 -0.11076370 -0.02190758 290  GLN   A HA   
3631  H  HB2  . GLN   A  235 ? 0.41812211 0.39836335 0.31409574 -0.11217465 -0.11524756 -0.01513670 290  GLN   A HB2  
3632  H  HB3  . GLN   A  235 ? 0.42712709 0.40660739 0.32483020 -0.11926551 -0.11998569 -0.01913776 290  GLN   A HB3  
3633  H  HG2  . GLN   A  235 ? 0.45232323 0.41434801 0.32312351 -0.11782068 -0.12243388 -0.02344996 290  GLN   A HG2  
3634  H  HG3  . GLN   A  235 ? 0.44302449 0.40380937 0.31082070 -0.11124269 -0.11599608 -0.01979688 290  GLN   A HG3  
3635  H  HE21 . GLN   A  235 ? 0.61766183 0.57764661 0.46941841 -0.11215037 -0.12814596 -0.02217360 290  GLN   A HE21 
3636  H  HE22 . GLN   A  235 ? 0.61649990 0.58795816 0.47598463 -0.11039487 -0.13402157 -0.01885656 290  GLN   A HE22 
3637  N  N    . TRP   A  236 ? 0.35311517 0.33008552 0.26389697 -0.11670770 -0.10339052 -0.01432037 291  TRP   A N    
3638  C  CA   . TRP   A  236 ? 0.40832564 0.38918915 0.33004084 -0.12001204 -0.10026500 -0.01318936 291  TRP   A CA   
3639  C  C    . TRP   A  236 ? 0.36743248 0.33547384 0.28292865 -0.12202232 -0.09620505 -0.01462780 291  TRP   A C    
3640  O  O    . TRP   A  236 ? 0.40156227 0.36913300 0.32248223 -0.12723151 -0.09558633 -0.01498972 291  TRP   A O    
3641  C  CB   . TRP   A  236 ? 0.36536020 0.35445416 0.29586479 -0.11573783 -0.09596626 -0.00917789 291  TRP   A CB   
3642  C  CG   . TRP   A  236 ? 0.35965410 0.36278617 0.30060610 -0.11445141 -0.09932589 -0.00759608 291  TRP   A CG   
3643  C  CD1  . TRP   A  236 ? 0.35095915 0.36281973 0.29832363 -0.11781807 -0.10546768 -0.00913892 291  TRP   A CD1  
3644  C  CD2  . TRP   A  236 ? 0.31993696 0.32996702 0.26644230 -0.10911437 -0.09695382 -0.00436142 291  TRP   A CD2  
3645  N  NE1  . TRP   A  236 ? 0.32429904 0.34821230 0.28114802 -0.11436347 -0.10699718 -0.00708474 291  TRP   A NE1  
3646  C  CE2  . TRP   A  236 ? 0.31569999 0.33819830 0.27192241 -0.10904714 -0.10178453 -0.00417168 291  TRP   A CE2  
3647  C  CE3  . TRP   A  236 ? 0.27976450 0.28655320 0.22399820 -0.10433550 -0.09147592 -0.00177480 291  TRP   A CE3  
3648  C  CZ2  . TRP   A  236 ? 0.31067461 0.34136456 0.27370757 -0.10396215 -0.10125229 -0.00158113 291  TRP   A CZ2  
3649  C  CZ3  . TRP   A  236 ? 0.26060748 0.27545470 0.21135092 -0.09997790 -0.09101017 0.00082293  291  TRP   A CZ3  
3650  C  CH2  . TRP   A  236 ? 0.24019802 0.26629856 0.19989440 -0.09965068 -0.09582639 0.00085270  291  TRP   A CH2  
3651  H  H    . TRP   A  236 ? 0.37088895 0.35001507 0.28074703 -0.11272032 -0.10244365 -0.01245798 291  TRP   A H    
3652  H  HA   . TRP   A  236 ? 0.38206708 0.36869013 0.30978188 -0.12393551 -0.10369149 -0.01412247 291  TRP   A HA   
3653  H  HB2  . TRP   A  236 ? 0.36999452 0.35468012 0.29458663 -0.11169969 -0.09355862 -0.00825097 291  TRP   A HB2  
3654  H  HB3  . TRP   A  236 ? 0.36836261 0.35709488 0.30314773 -0.11763575 -0.09285357 -0.00853187 291  TRP   A HB3  
3655  H  HD1  . TRP   A  236 ? 0.35718459 0.36717099 0.30306113 -0.12195311 -0.10833638 -0.01140082 291  TRP   A HD1  
3656  H  HE1  . TRP   A  236 ? 0.32839864 0.35987502 0.29112089 -0.11538199 -0.11082956 -0.00765785 291  TRP   A HE1  
3657  H  HE3  . TRP   A  236 ? 0.28649938 0.28567249 0.22490385 -0.10402460 -0.08834399 -0.00192220 291  TRP   A HE3  
3658  H  HZ2  . TRP   A  236 ? 0.29113382 0.33012795 0.26085734 -0.10348877 -0.10471658 -0.00164649 291  TRP   A HZ2  
3659  H  HZ3  . TRP   A  236 ? 0.25503910 0.26768696 0.20432958 -0.09708667 -0.08747127 0.00248584  291  TRP   A HZ3  
3660  H  HH2  . TRP   A  236 ? 0.25371701 0.28456503 0.21768120 -0.09637054 -0.09539910 0.00247908  291  TRP   A HH2  
3661  N  N    . LEU   A  237 ? 0.36552081 0.32330826 0.26975000 -0.11773518 -0.09334502 -0.01533164 292  LEU   A N    
3662  C  CA   . LEU   A  237 ? 0.43266910 0.37769997 0.33048171 -0.11829785 -0.08976545 -0.01691228 292  LEU   A CA   
3663  C  C    . LEU   A  237 ? 0.39635402 0.33233833 0.28804079 -0.12387010 -0.09362571 -0.02121634 292  LEU   A C    
3664  O  O    . LEU   A  237 ? 0.39917129 0.32458931 0.28738511 -0.12551990 -0.09143151 -0.02246929 292  LEU   A O    
3665  C  CB   . LEU   A  237 ? 0.39562565 0.33352172 0.28359205 -0.11183794 -0.08586149 -0.01707388 292  LEU   A CB   
3666  C  CG   . LEU   A  237 ? 0.39007872 0.33035064 0.28281721 -0.10743186 -0.07999711 -0.01341703 292  LEU   A CG   
3667  C  CD1  . LEU   A  237 ? 0.43824005 0.37563694 0.32271838 -0.10125265 -0.07703742 -0.01337482 292  LEU   A CD1  
3668  C  CD2  . LEU   A  237 ? 0.34478557 0.27739698 0.23898673 -0.10913736 -0.07677485 -0.01331959 292  LEU   A CD2  
3669  H  H    . LEU   A  237 ? 0.37793612 0.33681226 0.27851462 -0.11425871 -0.09359116 -0.01478796 292  LEU   A H    
3670  H  HA   . LEU   A  237 ? 0.39679390 0.34342906 0.30071521 -0.11920033 -0.08711924 -0.01504497 292  LEU   A HA   
3671  H  HB2  . LEU   A  237 ? 0.40455854 0.34513247 0.28912956 -0.11001882 -0.08767685 -0.01726678 292  LEU   A HB2  
3672  H  HB3  . LEU   A  237 ? 0.41305494 0.34172028 0.29417741 -0.11236418 -0.08551438 -0.01964623 292  LEU   A HB3  
3673  H  HG   . LEU   A  237 ? 0.37884188 0.32785577 0.27917254 -0.10754800 -0.08032548 -0.01103237 292  LEU   A HG   
3674  H  HD11 . LEU   A  237 ? 0.41493234 0.35553777 0.30336693 -0.09868111 -0.07392826 -0.01085210 292  LEU   A HD11 
3675  H  HD12 . LEU   A  237 ? 0.43025029 0.35947382 0.30805749 -0.10055929 -0.07589890 -0.01570775 292  LEU   A HD12 
3676  H  HD13 . LEU   A  237 ? 0.42422795 0.36480105 0.30617747 -0.10074979 -0.07945060 -0.01357731 292  LEU   A HD13 
3677  H  HD21 . LEU   A  237 ? 0.35733202 0.29243875 0.25688937 -0.11337443 -0.07829925 -0.01297759 292  LEU   A HD21 
3678  H  HD22 . LEU   A  237 ? 0.36581078 0.28941941 0.25280160 -0.10893562 -0.07673912 -0.01586363 292  LEU   A HD22 
3679  H  HD23 . LEU   A  237 ? 0.35020864 0.28433922 0.24696608 -0.10619607 -0.07335056 -0.01106585 292  LEU   A HD23 
3680  N  N    . SER   A  238 ? 0.39783233 0.33717096 0.28757629 -0.12658006 -0.09964813 -0.02350870 293  SER   A N    
3681  C  CA   . SER   A  238 ? 0.44684654 0.37801677 0.33083570 -0.13241157 -0.10397814 -0.02785450 293  SER   A CA   
3682  C  C    . SER   A  238 ? 0.40330866 0.34226531 0.29874349 -0.14002538 -0.10740283 -0.02763812 293  SER   A C    
3683  O  O    . SER   A  238 ? 0.47596955 0.40953574 0.36815614 -0.14598340 -0.11164047 -0.03111578 293  SER   A O    
3684  C  CB   . SER   A  238 ? 0.52900934 0.45796996 0.40238076 -0.13134138 -0.10886534 -0.03103224 293  SER   A CB   
3685  O  OG   . SER   A  238 ? 0.60796595 0.53026718 0.47088975 -0.12474934 -0.10487545 -0.03121538 293  SER   A OG   
3686  H  H    . SER   A  238 ? 0.40236762 0.34884900 0.29403502 -0.12472309 -0.10133353 -0.02238191 293  SER   A H    
3687  H  HA   . SER   A  238 ? 0.44711742 0.36809850 0.32580650 -0.13224263 -0.10141890 -0.02911600 293  SER   A HA   
3688  H  HB2  . SER   A  238 ? 0.52252614 0.46100160 0.40073469 -0.13142413 -0.11194018 -0.02977262 293  SER   A HB2  
3689  H  HB3  . SER   A  238 ? 0.53713846 0.45976651 0.40590876 -0.13522579 -0.11174841 -0.03425545 293  SER   A HB3  
3691  N  N    . LEU   A  239 ? 0.38685966 0.33867592 0.29564285 -0.14001283 -0.10545903 -0.02379060 294  LEU   A N    
3692  C  CA   . LEU   A  239 ? 0.47063947 0.43105447 0.39148045 -0.14727439 -0.10729845 -0.02336121 294  LEU   A CA   
3693  C  C    . LEU   A  239 ? 0.50139457 0.45002848 0.41974968 -0.15305349 -0.10510417 -0.02434663 294  LEU   A C    
3694  O  O    . LEU   A  239 ? 0.39841336 0.33471537 0.30894625 -0.14976476 -0.10073401 -0.02397241 294  LEU   A O    
3695  C  CB   . LEU   A  239 ? 0.40739357 0.38233626 0.34190863 -0.14532232 -0.10401161 -0.01917365 294  LEU   A CB   
3696  C  CG   . LEU   A  239 ? 0.38500553 0.37466210 0.32651487 -0.14174873 -0.10752251 -0.01812028 294  LEU   A CG   
3697  C  CD1  . LEU   A  239 ? 0.39476770 0.39643401 0.34861103 -0.13914156 -0.10323812 -0.01433054 294  LEU   A CD1  
3698  C  CD2  . LEU   A  239 ? 0.39026740 0.38833332 0.33723539 -0.14734489 -0.11486503 -0.02072793 294  LEU   A CD2  
3699  H  H    . LEU   A  239 ? 0.39615917 0.35170883 0.30660284 -0.13546966 -0.10281844 -0.02149087 294  LEU   A H    
3700  H  HA   . LEU   A  239 ? 0.45004955 0.41451061 0.37178600 -0.15001130 -0.11225727 -0.02525715 294  LEU   A HA   
3701  H  HB2  . LEU   A  239 ? 0.40897197 0.38004506 0.34122974 -0.14145531 -0.09957608 -0.01733888 294  LEU   A HB2  
3702  H  HB3  . LEU   A  239 ? 0.41405910 0.39246139 0.35543293 -0.15032856 -0.10363267 -0.01884558 294  LEU   A HB3  
3703  H  HG   . LEU   A  239 ? 0.39261270 0.37830412 0.32660624 -0.13710395 -0.10789144 -0.01823277 294  LEU   A HG   
3704  H  HD11 . LEU   A  239 ? 0.38271001 0.39179638 0.33950132 -0.13560969 -0.10514876 -0.01356760 294  LEU   A HD11 
3705  H  HD12 . LEU   A  239 ? 0.38647017 0.39397493 0.34839556 -0.14377786 -0.10316168 -0.01428939 294  LEU   A HD12 
3706  H  HD13 . LEU   A  239 ? 0.38406515 0.38007194 0.33460435 -0.13638924 -0.09870843 -0.01278734 294  LEU   A HD13 
3707  H  HD21 . LEU   A  239 ? 0.40068573 0.39149594 0.33881938 -0.14797376 -0.11803003 -0.02315510 294  LEU   A HD21 
3708  H  HD22 . LEU   A  239 ? 0.39406902 0.39437348 0.34701318 -0.15278745 -0.11452308 -0.02108497 294  LEU   A HD22 
3709  H  HD23 . LEU   A  239 ? 0.38547152 0.39394933 0.33872569 -0.14489210 -0.11683850 -0.01966620 294  LEU   A HD23 
3710  N  N    . PRO   A  240 ? 0.48830378 0.44039536 0.41342992 -0.16179526 -0.10808513 -0.02546689 295  PRO   A N    
3711  C  CA   . PRO   A  240 ? 0.43586344 0.37599653 0.35838938 -0.16807099 -0.10617805 -0.02593682 295  PRO   A CA   
3712  C  C    . PRO   A  240 ? 0.45793477 0.39781979 0.38492179 -0.16647217 -0.09931846 -0.02161537 295  PRO   A C    
3713  O  O    . PRO   A  240 ? 0.42684776 0.37942266 0.36233205 -0.16246291 -0.09653681 -0.01845812 295  PRO   A O    
3714  C  CB   . PRO   A  240 ? 0.46867380 0.41719297 0.40025097 -0.17798316 -0.11077268 -0.02737665 295  PRO   A CB   
3715  C  CG   . PRO   A  240 ? 0.53614962 0.49906874 0.47283494 -0.17612252 -0.11629876 -0.02869794 295  PRO   A CG   
3716  C  CD   . PRO   A  240 ? 0.48305494 0.45104796 0.41911322 -0.16614223 -0.11345972 -0.02616987 295  PRO   A CD   
3717  H  HA   . PRO   A  240 ? 0.46705276 0.39439064 0.37918788 -0.16729832 -0.10690127 -0.02832160 295  PRO   A HA   
3718  H  HB2  . PRO   A  240 ? 0.47218794 0.42718193 0.41222355 -0.18089062 -0.10815109 -0.02498423 295  PRO   A HB2  
3719  H  HB3  . PRO   A  240 ? 0.48861232 0.42681324 0.41400698 -0.18237682 -0.11287820 -0.02986506 295  PRO   A HB3  
3720  H  HG2  . PRO   A  240 ? 0.50506896 0.47973138 0.45241171 -0.18024281 -0.11766652 -0.02809507 295  PRO   A HG2  
3721  H  HG3  . PRO   A  240 ? 0.51820183 0.47516316 0.44774580 -0.17738019 -0.12045732 -0.03182265 295  PRO   A HG3  
3722  H  HD2  . PRO   A  240 ? 0.48241055 0.46145117 0.42823464 -0.16531634 -0.11150530 -0.02364844 295  PRO   A HD2  
3723  H  HD3  . PRO   A  240 ? 0.49385703 0.46362764 0.42641276 -0.16359760 -0.11709253 -0.02763279 295  PRO   A HD3  
3724  N  N    . ASP   A  241 ? 0.50465274 0.42936119 0.42527062 -0.16970170 -0.09705468 -0.02162429 296  ASP   A N    
3725  C  CA   . ASP   A  241 ? 0.54159033 0.46208829 0.46289289 -0.16754688 -0.09094608 -0.01771453 296  ASP   A CA   
3726  C  C    . ASP   A  241 ? 0.53131592 0.46872491 0.46665674 -0.16995476 -0.08816351 -0.01392265 296  ASP   A C    
3727  O  O    . ASP   A  241 ? 0.53703558 0.47830063 0.47491008 -0.16463527 -0.08356313 -0.01065606 296  ASP   A O    
3728  C  CB   . ASP   A  241 ? 0.57766628 0.48013678 0.49136332 -0.17275378 -0.09023369 -0.01814380 296  ASP   A CB   
3729  C  CG   . ASP   A  241 ? 0.77280319 0.65653193 0.67202806 -0.16835263 -0.09126757 -0.02150607 296  ASP   A CG   
3730  O  OD1  . ASP   A  241 ? 0.93262863 0.81686586 0.82742631 -0.15983169 -0.09035184 -0.02236964 296  ASP   A OD1  
3731  O  OD2  . ASP   A  241 ? 0.82708347 0.69551528 0.71925008 -0.17356533 -0.09301358 -0.02350078 296  ASP   A OD2  
3732  H  H    . ASP   A  241 ? 0.51541126 0.43163592 0.43068653 -0.17338307 -0.09969783 -0.02419310 296  ASP   A H    
3733  H  HA   . ASP   A  241 ? 0.53390974 0.45195001 0.45107979 -0.16075504 -0.08896725 -0.01720632 296  ASP   A HA   
3734  H  HB2  . ASP   A  241 ? 0.61439955 0.51789105 0.53077650 -0.17983897 -0.09278193 -0.01923577 296  ASP   A HB2  
3735  H  HB3  . ASP   A  241 ? 0.60418248 0.50591195 0.51983714 -0.17237912 -0.08652654 -0.01507231 296  ASP   A HB3  
3736  N  N    . ASN   A  242 ? 0.49219668 0.44055501 0.43694568 -0.17776525 -0.09101699 -0.01467038 297  ASN   A N    
3737  C  CA   . ASN   A  242 ? 0.48618320 0.45013234 0.44432068 -0.18090455 -0.08776809 -0.01148034 297  ASN   A CA   
3738  C  C    . ASN   A  242 ? 0.48147866 0.46320558 0.44874251 -0.17435583 -0.08784194 -0.01067035 297  ASN   A C    
3739  O  O    . ASN   A  242 ? 0.68102181 0.67631066 0.65925407 -0.17494936 -0.08463550 -0.00824660 297  ASN   A O    
3740  C  CB   . ASN   A  242 ? 0.63459480 0.60433406 0.60035968 -0.19234569 -0.09024897 -0.01261360 297  ASN   A CB   
3741  C  CG   . ASN   A  242 ? 0.73138410 0.71237963 0.70286465 -0.19444723 -0.09692074 -0.01620150 297  ASN   A CG   
3742  O  OD1  . ASN   A  242 ? 0.77477741 0.74817938 0.73749340 -0.19142075 -0.10146017 -0.01931608 297  ASN   A OD1  
3743  N  ND2  . ASN   A  242 ? 0.91203684 0.91186517 0.89826560 -0.19930978 -0.09771553 -0.01594223 297  ASN   A ND2  
3744  H  H    . ASN   A  242 ? 0.51120287 0.45757997 0.45414358 -0.18126839 -0.09495290 -0.01733152 297  ASN   A H    
3745  H  HA   . ASN   A  242 ? 0.50824201 0.46704382 0.46443009 -0.18006310 -0.08363423 -0.00899877 297  ASN   A HA   
3746  H  HB2  . ASN   A  242 ? 0.61247718 0.59123421 0.58624649 -0.19458354 -0.08711952 -0.01034442 297  ASN   A HB2  
3747  H  HB3  . ASN   A  242 ? 0.62769479 0.58456790 0.58656347 -0.19646060 -0.09057795 -0.01322337 297  ASN   A HB3  
3748  H  HD21 . ASN   A  242 ? 0.84059089 0.84513623 0.83245289 -0.20230332 -0.09428690 -0.01397323 297  ASN   A HD21 
3749  H  HD22 . ASN   A  242 ? 0.84543222 0.85337508 0.83594388 -0.19951360 -0.10168789 -0.01779516 297  ASN   A HD22 
3750  N  N    . GLU   A  243 ? 0.46189606 0.44319683 0.42420653 -0.16817144 -0.09146228 -0.01272522 298  GLU   A N    
3751  C  CA   . GLU   A  243 ? 0.44744897 0.44323599 0.41678557 -0.16157283 -0.09195472 -0.01173913 298  GLU   A CA   
3752  C  C    . GLU   A  243 ? 0.36383253 0.35377061 0.32545704 -0.15191041 -0.08915210 -0.01024821 298  GLU   A C    
3753  O  O    . GLU   A  243 ? 0.34483552 0.34535682 0.31197923 -0.14632061 -0.08851070 -0.00867960 298  GLU   A O    
3754  C  CB   . GLU   A  243 ? 0.50359231 0.50659567 0.47488189 -0.16254421 -0.09914681 -0.01486800 298  GLU   A CB   
3755  C  CG   . GLU   A  243 ? 0.60430694 0.61770499 0.58619517 -0.17169167 -0.10266922 -0.01648960 298  GLU   A CG   
3756  C  CD   . GLU   A  243 ? 0.75101995 0.77299738 0.73563099 -0.17207012 -0.11046410 -0.01948083 298  GLU   A CD   
3757  O  OE1  . GLU   A  243 ? 0.96009117 0.98005390 0.93800890 -0.16495723 -0.11294299 -0.01991506 298  GLU   A OE1  
3758  O  OE2  . GLU   A  243 ? 0.85371828 0.88442993 0.84692037 -0.17972705 -0.11424214 -0.02131737 298  GLU   A OE2  
3759  H  H    . GLU   A  243 ? 0.47251922 0.44408894 0.42664596 -0.16821876 -0.09375892 -0.01481489 298  GLU   A H    
3760  H  HA   . GLU   A  243 ? 0.43604952 0.44193313 0.41460910 -0.16287443 -0.08972766 -0.01002771 298  GLU   A HA   
3761  H  HB2  . GLU   A  243 ? 0.51714146 0.50978786 0.47871822 -0.16180815 -0.10128526 -0.01678226 298  GLU   A HB2  
3762  H  HB3  . GLU   A  243 ? 0.50161004 0.51274371 0.47643065 -0.15757363 -0.09967232 -0.01404462 298  GLU   A HB3  
3763  H  HG2  . GLU   A  243 ? 0.60001528 0.62382531 0.59160870 -0.17258458 -0.10002714 -0.01471666 298  GLU   A HG2  
3764  H  HG3  . GLU   A  243 ? 0.61509514 0.61946541 0.59273720 -0.17700937 -0.10250292 -0.01737331 298  GLU   A HG3  
3765  N  N    . ARG   A  244 ? 0.32925072 0.30243778 0.27812606 -0.14993514 -0.08792979 -0.01108416 299  ARG   A N    
3766  C  CA   . ARG   A  244 ? 0.34838629 0.31607568 0.28906846 -0.14142457 -0.08638456 -0.01070437 299  ARG   A CA   
3767  C  C    . ARG   A  244 ? 0.32270443 0.29313850 0.26690525 -0.13679643 -0.08043770 -0.00686104 299  ARG   A C    
3768  O  O    . ARG   A  244 ? 0.33380431 0.29760841 0.27697355 -0.13862777 -0.07672512 -0.00526085 299  ARG   A O    
3769  C  CB   . ARG   A  244 ? 0.39898014 0.34882575 0.32589149 -0.14076345 -0.08666931 -0.01328717 299  ARG   A CB   
3770  C  CG   . ARG   A  244 ? 0.42770541 0.37210065 0.34577852 -0.13251771 -0.08497132 -0.01350063 299  ARG   A CG   
3771  C  CD   . ARG   A  244 ? 0.46364710 0.39075166 0.37003028 -0.13124248 -0.08336379 -0.01559263 299  ARG   A CD   
3772  N  NE   . ARG   A  244 ? 0.60844433 0.52691060 0.50906146 -0.13693231 -0.08771946 -0.01958458 299  ARG   A NE   
3773  C  CZ   . ARG   A  244 ? 0.55491680 0.46378073 0.45416421 -0.14269018 -0.08786647 -0.02032919 299  ARG   A CZ   
3774  N  NH1  . ARG   A  244 ? 0.47719318 0.38221174 0.37892139 -0.14312734 -0.08374190 -0.01729316 299  ARG   A NH1  
3775  N  NH2  . ARG   A  244 ? 0.60001504 0.50196481 0.49432164 -0.14824659 -0.09248716 -0.02420907 299  ARG   A NH2  
3776  H  H    . ARG   A  244 ? 0.35354900 0.31859916 0.29889292 -0.15401107 -0.08797799 -0.01195181 299  ARG   A H    
3777  H  HA   . ARG   A  244 ? 0.34506953 0.31890100 0.28675699 -0.13910483 -0.08909031 -0.01137488 299  ARG   A HA   
3778  H  HB2  . ARG   A  244 ? 0.40426391 0.35205638 0.32881141 -0.14424679 -0.09051825 -0.01589901 299  ARG   A HB2  
3779  H  HB3  . ARG   A  244 ? 0.39881533 0.34207320 0.32464039 -0.14273566 -0.08422148 -0.01245023 299  ARG   A HB3  
3780  H  HG2  . ARG   A  244 ? 0.41564518 0.36477846 0.33735034 -0.12899092 -0.08191185 -0.01091989 299  ARG   A HG2  
3781  H  HG3  . ARG   A  244 ? 0.42645544 0.37399328 0.34266630 -0.13133544 -0.08799264 -0.01491537 299  ARG   A HG3  
3782  H  HD2  . ARG   A  244 ? 0.48205835 0.40583205 0.38983628 -0.13142462 -0.08032525 -0.01378754 299  ARG   A HD2  
3783  H  HD3  . ARG   A  244 ? 0.48273087 0.40757915 0.38381895 -0.12619300 -0.08238336 -0.01610680 299  ARG   A HD3  
3784  H  HE   . ARG   A  244 ? 0.56199813 0.48118973 0.45941147 -0.13669486 -0.09057735 -0.02163842 299  ARG   A HE   
3785  H  HH11 . ARG   A  244 ? 0.49354601 0.39765567 0.39434528 -0.13847576 -0.08073980 -0.01572683 299  ARG   A HH11 
3786  H  HH12 . ARG   A  244 ? 0.50366628 0.40676731 0.40762907 -0.14822383 -0.08410096 -0.01683392 299  ARG   A HH12 
3787  H  HH21 . ARG   A  244 ? 0.59601963 0.49037021 0.48859322 -0.15207466 -0.09264493 -0.02476708 299  ARG   A HH21 
3788  H  HH22 . ARG   A  244 ? 0.59193462 0.49659413 0.48441979 -0.14819159 -0.09550584 -0.02619434 299  ARG   A HH22 
3789  N  N    . PRO   A  245 ? 0.33109850 0.31042042 0.27874655 -0.13065031 -0.07955428 -0.00519579 300  PRO   A N    
3790  C  CA   . PRO   A  245 ? 0.35164112 0.33183861 0.30093956 -0.12601605 -0.07414089 -0.00194220 300  PRO   A CA   
3791  C  C    . PRO   A  245 ? 0.38098267 0.34705436 0.31973371 -0.12228592 -0.07112212 -0.00177334 300  PRO   A C    
3792  O  O    . PRO   A  245 ? 0.35025442 0.30693793 0.27977380 -0.12108027 -0.07298936 -0.00431747 300  PRO   A O    
3793  C  CB   . PRO   A  245 ? 0.36631936 0.35759544 0.32025903 -0.12052302 -0.07503282 -0.00086142 300  PRO   A CB   
3794  C  CG   . PRO   A  245 ? 0.37286386 0.37170282 0.33047435 -0.12325346 -0.08108073 -0.00313457 300  PRO   A CG   
3795  C  CD   . PRO   A  245 ? 0.33581489 0.32410473 0.28563541 -0.12811109 -0.08398893 -0.00621634 300  PRO   A CD   
3796  H  HA   . PRO   A  245 ? 0.35323203 0.33711749 0.30825198 -0.12907532 -0.07224070 -0.00062815 300  PRO   A HA   
3797  H  HB2  . PRO   A  245 ? 0.36065310 0.34730473 0.30856434 -0.11620196 -0.07435152 -0.00070133 300  PRO   A HB2  
3798  H  HB3  . PRO   A  245 ? 0.35376865 0.35165545 0.31415918 -0.11983877 -0.07267690 0.00099702  300  PRO   A HB3  
3799  H  HG2  . PRO   A  245 ? 0.35787824 0.35884446 0.31368876 -0.11939479 -0.08281344 -0.00311099 300  PRO   A HG2  
3800  H  HG3  . PRO   A  245 ? 0.35699341 0.36490768 0.32342947 -0.12576716 -0.08138764 -0.00270266 300  PRO   A HG3  
3801  H  HD2  . PRO   A  245 ? 0.34777647 0.32994658 0.28967333 -0.12542900 -0.08523002 -0.00740150 300  PRO   A HD2  
3802  H  HD3  . PRO   A  245 ? 0.34669518 0.34017181 0.30094105 -0.13214777 -0.08727470 -0.00753026 300  PRO   A HD3  
3803  N  N    . SER   A  246 ? 0.40870672 0.37368643 0.34905481 -0.12042537 -0.06645838 0.00107068  301  SER   A N    
3804  C  CA   . SER   A  246 ? 0.31784439 0.27204126 0.25028390 -0.11579415 -0.06345969 0.00166821  301  SER   A CA   
3805  C  C    . SER   A  246 ? 0.30739564 0.26656219 0.24015346 -0.10884257 -0.06136073 0.00324887  301  SER   A C    
3806  O  O    . SER   A  246 ? 0.38366884 0.33543664 0.30981195 -0.10447326 -0.05960195 0.00300362  301  SER   A O    
3807  C  CB   . SER   A  246 ? 0.31659424 0.26504040 0.24935821 -0.11816086 -0.06020916 0.00389654  301  SER   A CB   
3808  O  OG   . SER   A  246 ? 0.35682392 0.29712090 0.28689533 -0.12450784 -0.06198277 0.00250843  301  SER   A OG   
3809  H  H    . SER   A  246 ? 0.37077248 0.34232402 0.31752968 -0.12210367 -0.06516686 0.00260937  301  SER   A H    
3810  H  HA   . SER   A  246 ? 0.33986926 0.28639305 0.26579130 -0.11566234 -0.06504969 -0.00055500 301  SER   A HA   
3811  H  HB2  . SER   A  246 ? 0.31816167 0.27429116 0.25715318 -0.11899652 -0.05866334 0.00583460  301  SER   A HB2  
3812  H  HB3  . SER   A  246 ? 0.32387072 0.26645172 0.25229546 -0.11436883 -0.05837217 0.00446399  301  SER   A HB3  
3814  N  N    . VAL   A  247 ? 0.33260310 0.30412272 0.27322823 -0.10788240 -0.06152710 0.00474673  302  VAL   A N    
3815  C  CA   . VAL   A  247 ? 0.28966600 0.26548433 0.23085213 -0.10191923 -0.05960194 0.00650290  302  VAL   A CA   
3816  C  C    . VAL   A  247 ? 0.27582681 0.26003444 0.21963412 -0.10032012 -0.06295577 0.00598014  302  VAL   A C    
3817  O  O    . VAL   A  247 ? 0.32668814 0.31943077 0.27772668 -0.10320840 -0.06547975 0.00563226  302  VAL   A O    
3818  C  CB   . VAL   A  247 ? 0.25967994 0.24000999 0.20666781 -0.10094252 -0.05562124 0.00948054  302  VAL   A CB   
3819  C  CG1  . VAL   A  247 ? 0.23541060 0.22694504 0.19232248 -0.10422021 -0.05598086 0.01015792  302  VAL   A CG1  
3820  C  CG2  . VAL   A  247 ? 0.24176334 0.22369212 0.18757683 -0.09494631 -0.05355188 0.01105650  302  VAL   A CG2  
3821  H  H    . VAL   A  247 ? 0.31598186 0.29330844 0.26185355 -0.11104237 -0.06292070 0.00458767  302  VAL   A H    
3822  H  HA   . VAL   A  247 ? 0.29182893 0.26127923 0.22698975 -0.09932852 -0.05874290 0.00603042  302  VAL   A HA   
3823  H  HB   . VAL   A  247 ? 0.26049590 0.23471536 0.20505667 -0.10222675 -0.05400988 0.00986862  302  VAL   A HB   
3824  H  HG11 . VAL   A  247 ? 0.23821369 0.23592091 0.19800228 -0.10230432 -0.05753374 0.00997637  302  VAL   A HG11 
3825  H  HG12 . VAL   A  247 ? 0.24638169 0.23745257 0.20430349 -0.10842882 -0.05744101 0.00907979  302  VAL   A HG12 
3826  H  HG13 . VAL   A  247 ? 0.23766240 0.23073807 0.19703043 -0.10405305 -0.05321329 0.01178196  302  VAL   A HG13 
3827  H  HG21 . VAL   A  247 ? 0.24068171 0.22453725 0.18937562 -0.09450269 -0.05118714 0.01269202  302  VAL   A HG21 
3828  H  HG22 . VAL   A  247 ? 0.24773344 0.22337201 0.18779176 -0.09297992 -0.05305770 0.01050045  302  VAL   A HG22 
3829  H  HG23 . VAL   A  247 ? 0.24223185 0.22945544 0.19004697 -0.09361878 -0.05514663 0.01094193  302  VAL   A HG23 
3830  N  N    . TYR   A  248 ? 0.27309972 0.25467944 0.21078093 -0.09574369 -0.06303691 0.00594183  303  TYR   A N    
3831  C  CA   . TYR   A  248 ? 0.26880848 0.25571558 0.20625573 -0.09357239 -0.06628467 0.00588731  303  TYR   A CA   
3832  C  C    . TYR   A  248 ? 0.33674067 0.32483071 0.27288303 -0.08839486 -0.06384782 0.00816534  303  TYR   A C    
3833  O  O    . TYR   A  248 ? 0.33406901 0.31732959 0.26720709 -0.08639690 -0.05998174 0.00897630  303  TYR   A O    
3834  C  CB   . TYR   A  248 ? 0.34289822 0.32328832 0.27092713 -0.09416400 -0.06948104 0.00319522  303  TYR   A CB   
3835  C  CG   . TYR   A  248 ? 0.31141841 0.28809956 0.23851915 -0.09943243 -0.07210234 0.00043855  303  TYR   A CG   
3836  C  CD1  . TYR   A  248 ? 0.30140972 0.26864362 0.22426344 -0.10112264 -0.06981490 -0.00079476 303  TYR   A CD1  
3837  C  CD2  . TYR   A  248 ? 0.32180932 0.30423814 0.25241497 -0.10277155 -0.07722323 -0.00095613 303  TYR   A CD2  
3838  C  CE1  . TYR   A  248 ? 0.36118472 0.32360604 0.28251153 -0.10637248 -0.07239370 -0.00335384 303  TYR   A CE1  
3839  C  CE2  . TYR   A  248 ? 0.32080573 0.29966033 0.25053182 -0.10828335 -0.07985638 -0.00362649 303  TYR   A CE2  
3840  C  CZ   . TYR   A  248 ? 0.32106912 0.28939590 0.24583033 -0.11024295 -0.07732551 -0.00479749 303  TYR   A CZ   
3841  O  OH   . TYR   A  248 ? 0.31254351 0.27574068 0.23573391 -0.11596648 -0.07986365 -0.00738373 303  TYR   A OH   
3842  H  H    . TYR   A  248 ? 0.27443108 0.25043511 0.20765625 -0.09391592 -0.06092070 0.00604207  303  TYR   A H    
3843  H  HA   . TYR   A  248 ? 0.28970635 0.28350353 0.23348492 -0.09510124 -0.06822442 0.00603847  303  TYR   A HA   
3844  H  HB2  . TYR   A  248 ? 0.31882155 0.29350066 0.24095789 -0.09201419 -0.06730527 0.00302331  303  TYR   A HB2  
3845  H  HB3  . TYR   A  248 ? 0.31710857 0.30114239 0.24488086 -0.09305078 -0.07206862 0.00337802  303  TYR   A HB3  
3846  H  HD1  . TYR   A  248 ? 0.31382263 0.27746516 0.23465368 -0.09866837 -0.06665184 0.00007647  303  TYR   A HD1  
3847  H  HD2  . TYR   A  248 ? 0.31462681 0.30330384 0.24819535 -0.10129743 -0.07917172 -0.00012936 303  TYR   A HD2  
3848  H  HE1  . TYR   A  248 ? 0.34178060 0.29677740 0.25976008 -0.10729949 -0.07096137 -0.00412459 303  TYR   A HE1  
3849  H  HE2  . TYR   A  248 ? 0.32436711 0.30777648 0.25691947 -0.11067456 -0.08353824 -0.00463407 303  TYR   A HE2  
3851  N  N    . ALA   A  249 ? 0.30061772 0.29490143 0.23907426 -0.08636922 -0.06647547 0.00915789  304  ALA   A N    
3852  C  CA   . ALA   A  249 ? 0.32089496 0.31486589 0.25624195 -0.08202667 -0.06516855 0.01116401  304  ALA   A CA   
3853  C  C    . ALA   A  249 ? 0.31646633 0.31128064 0.24738342 -0.08071686 -0.06962934 0.01117316  304  ALA   A C    
3854  O  O    . ALA   A  249 ? 0.29552352 0.29640108 0.23153666 -0.08151770 -0.07387226 0.01087655  304  ALA   A O    
3855  C  CB   . ALA   A  249 ? 0.31535548 0.31556633 0.25881004 -0.08009148 -0.06313172 0.01340236  304  ALA   A CB   
3856  H  H    . ALA   A  249 ? 0.31354937 0.31228575 0.25570923 -0.08784781 -0.06935229 0.00858161  304  ALA   A H    
3857  H  HA   . ALA   A  249 ? 0.31552559 0.30426672 0.24582788 -0.08112023 -0.06267388 0.01108865  304  ALA   A HA   
3858  H  HB1  . ALA   A  249 ? 0.31302714 0.31211519 0.25393409 -0.07751076 -0.06224989 0.01470263  304  ALA   A HB1  
3859  H  HB2  . ALA   A  249 ? 0.31183004 0.31144544 0.25757441 -0.08100638 -0.06041018 0.01354923  304  ALA   A HB2  
3860  H  HB3  . ALA   A  249 ? 0.31380472 0.31963652 0.26255223 -0.08053237 -0.06547099 0.01331562  304  ALA   A HB3  
3861  N  N    . PHE   A  250 ? 0.28750867 0.27635744 0.20887420 -0.07879014 -0.06855620 0.01150974  305  PHE   A N    
3862  C  CA   . PHE   A  250 ? 0.25863215 0.24713708 0.17437914 -0.07674674 -0.07141954 0.01283508  305  PHE   A CA   
3863  C  C    . PHE   A  250 ? 0.28444684 0.27461284 0.20251718 -0.07357390 -0.06910928 0.01592459  305  PHE   A C    
3864  O  O    . PHE   A  250 ? 0.25683820 0.24558085 0.17592093 -0.07275805 -0.06439736 0.01665790  305  PHE   A O    
3865  C  CB   . PHE   A  250 ? 0.28625846 0.26724505 0.18970637 -0.07695126 -0.07064030 0.01147848  305  PHE   A CB   
3866  C  CG   . PHE   A  250 ? 0.33916432 0.31833461 0.23465490 -0.07518347 -0.07255720 0.01332861  305  PHE   A CG   
3867  C  CD1  . PHE   A  250 ? 0.30965248 0.28897491 0.20078285 -0.07590161 -0.07845387 0.01291453  305  PHE   A CD1  
3868  C  CD2  . PHE   A  250 ? 0.31414843 0.29134148 0.20629483 -0.07309205 -0.06874596 0.01567533  305  PHE   A CD2  
3869  C  CE1  . PHE   A  250 ? 0.39242762 0.36910063 0.27513468 -0.07439185 -0.08049474 0.01510091  305  PHE   A CE1  
3870  C  CE2  . PHE   A  250 ? 0.32593620 0.30055022 0.20976622 -0.07206862 -0.07042215 0.01779084  305  PHE   A CE2  
3871  C  CZ   . PHE   A  250 ? 0.39229858 0.36627656 0.27110538 -0.07262383 -0.07629009 0.01766461  305  PHE   A CZ   
3872  H  H    . PHE   A  250 ? 0.28743935 0.27211326 0.20545098 -0.07881350 -0.06579846 0.01090699  305  PHE   A H    
3873  H  HA   . PHE   A  250 ? 0.27596056 0.26778150 0.19400629 -0.07737963 -0.07543568 0.01251102  305  PHE   A HA   
3874  H  HB2  . PHE   A  250 ? 0.29624569 0.27581385 0.19776839 -0.07894620 -0.07267873 0.00933369  305  PHE   A HB2  
3875  H  HB3  . PHE   A  250 ? 0.28955638 0.26796055 0.19183497 -0.07641581 -0.06671142 0.01134295  305  PHE   A HB3  
3876  H  HD1  . PHE   A  250 ? 0.33520213 0.31639692 0.22906674 -0.07757214 -0.08126975 0.01125009  305  PHE   A HD1  
3877  H  HD2  . PHE   A  250 ? 0.31560189 0.29297611 0.21076678 -0.07258451 -0.06507348 0.01590525  305  PHE   A HD2  
3878  H  HE1  . PHE   A  250 ? 0.37660274 0.35313082 0.25596294 -0.07479307 -0.08484458 0.01491020  305  PHE   A HE1  
3879  H  HE2  . PHE   A  250 ? 0.33622760 0.30950016 0.21788295 -0.07113338 -0.06770882 0.01943509  305  PHE   A HE2  
3880  H  HZ   . PHE   A  250 ? 0.38330090 0.35490265 0.25578317 -0.07200661 -0.07756991 0.01933974  305  PHE   A HZ   
3881  N  N    . TYR   A  251 ? 0.27430132 0.26707393 0.19304165 -0.07177475 -0.07287203 0.01764711  306  TYR   A N    
3882  C  CA   . TYR   A  251 ? 0.28984964 0.28253734 0.20907500 -0.06884749 -0.07160097 0.02055249  306  TYR   A CA   
3883  C  C    . TYR   A  251 ? 0.28020826 0.26853633 0.18972218 -0.06772541 -0.07484931 0.02225484  306  TYR   A C    
3884  O  O    . TYR   A  251 ? 0.27881533 0.26745737 0.18539426 -0.06821137 -0.08006205 0.02160025  306  TYR   A O    
3885  C  CB   . TYR   A  251 ? 0.23005757 0.22969189 0.16033939 -0.06711074 -0.07310858 0.02129293  306  TYR   A CB   
3886  C  CG   . TYR   A  251 ? 0.27044439 0.26871324 0.20020770 -0.06385258 -0.07301848 0.02408391  306  TYR   A CG   
3887  C  CD1  . TYR   A  251 ? 0.33088639 0.32672673 0.26035327 -0.06317071 -0.06810903 0.02535816  306  TYR   A CD1  
3888  C  CD2  . TYR   A  251 ? 0.26606447 0.26503396 0.19556397 -0.06147898 -0.07819885 0.02540173  306  TYR   A CD2  
3889  C  CE1  . TYR   A  251 ? 0.31210953 0.30570474 0.24048612 -0.06071326 -0.06823751 0.02777910  306  TYR   A CE1  
3890  C  CE2  . TYR   A  251 ? 0.24814558 0.24418129 0.17618677 -0.05859525 -0.07845674 0.02797252  306  TYR   A CE2  
3891  C  CZ   . TYR   A  251 ? 0.33213180 0.32526869 0.25949243 -0.05845248 -0.07335608 0.02911384  306  TYR   A CZ   
3892  O  OH   . TYR   A  251 ? 0.23642534 0.22607121 0.16225868 -0.05599526 -0.07397973 0.03150265  306  TYR   A OH   
3893  H  H    . TYR   A  251 ? 0.28439206 0.27877635 0.20319237 -0.07238619 -0.07667606 0.01695246  306  TYR   A H    
3894  H  HA   . TYR   A  251 ? 0.26931763 0.25988358 0.18744449 -0.06870993 -0.06761103 0.02095081  306  TYR   A HA   
3895  H  HB2  . TYR   A  251 ? 0.24416381 0.24610591 0.17969215 -0.06793699 -0.07041027 0.02053997  306  TYR   A HB2  
3896  H  HB3  . TYR   A  251 ? 0.25193414 0.25476539 0.18467185 -0.06738050 -0.07693105 0.02050924  306  TYR   A HB3  
3897  H  HD1  . TYR   A  251 ? 0.30494636 0.30027762 0.23463483 -0.06445476 -0.06487977 0.02455696  306  TYR   A HD1  
3898  H  HD2  . TYR   A  251 ? 0.26745176 0.26841995 0.19730538 -0.06185862 -0.08190121 0.02454367  306  TYR   A HD2  
3899  H  HE1  . TYR   A  251 ? 0.31443295 0.30648822 0.24262404 -0.06056871 -0.06509232 0.02851797  306  TYR   A HE1  
3900  H  HE2  . TYR   A  251 ? 0.27511674 0.27096143 0.20269106 -0.05674003 -0.08231132 0.02892100  306  TYR   A HE2  
3902  N  N    . SER   A  252 ? 0.28711492 0.27127582 0.19135402 -0.06652233 -0.07188375 0.02457758  307  SER   A N    
3903  C  CA   . SER   A  252 ? 0.32418597 0.30357122 0.21896920 -0.06566264 -0.07449833 0.02700957  307  SER   A CA   
3904  C  C    . SER   A  252 ? 0.28232461 0.26070857 0.17925070 -0.06343640 -0.07363278 0.03011788  307  SER   A C    
3905  O  O    . SER   A  252 ? 0.25475222 0.23366612 0.15542254 -0.06335833 -0.06890365 0.03042592  307  SER   A O    
3906  C  CB   . SER   A  252 ? 0.39372334 0.36742696 0.27663481 -0.06748541 -0.07157474 0.02663116  307  SER   A CB   
3907  O  OG   . SER   A  252 ? 0.31876385 0.28738463 0.19209506 -0.06711591 -0.07263594 0.02969801  307  SER   A OG   
3908  H  H    . SER   A  252 ? 0.28652412 0.27071604 0.19295958 -0.06644407 -0.06817769 0.02474216  307  SER   A H    
3909  H  HA   . SER   A  252 ? 0.32293856 0.30334789 0.21742421 -0.06535982 -0.07909479 0.02682497  307  SER   A HA   
3910  H  HB2  . SER   A  252 ? 0.36015826 0.33354238 0.24028301 -0.06865681 -0.07325596 0.02468795  307  SER   A HB2  
3911  H  HB3  . SER   A  252 ? 0.35191274 0.32572252 0.23635870 -0.06786780 -0.06716990 0.02605356  307  SER   A HB3  
3913  N  N    . GLU   A  253 ? 0.26999032 0.24597961 0.16339660 -0.06169309 -0.07853919 0.03242861  308  GLU   A N    
3914  C  CA   . GLU   A  253 ? 0.27985513 0.25291741 0.17356554 -0.05948367 -0.07882133 0.03549524  308  GLU   A CA   
3915  C  C    . GLU   A  253 ? 0.33013088 0.29611874 0.21308202 -0.06124701 -0.07525199 0.03794534  308  GLU   A C    
3916  O  O    . GLU   A  253 ? 0.29863811 0.26113224 0.18092817 -0.06042225 -0.07428308 0.04049997  308  GLU   A O    
3917  C  CB   . GLU   A  253 ? 0.32834747 0.30055764 0.22178048 -0.05662023 -0.08603381 0.03709394  308  GLU   A CB   
3918  C  CG   . GLU   A  253 ? 0.46380258 0.44444972 0.36779678 -0.05530437 -0.09000111 0.03437058  308  GLU   A CG   
3919  C  CD   . GLU   A  253 ? 0.69786566 0.67990124 0.59773445 -0.05754019 -0.09325484 0.03239192  308  GLU   A CD   
3920  O  OE1  . GLU   A  253 ? 0.44467506 0.42045093 0.33221650 -0.05974383 -0.09256007 0.03308119  308  GLU   A OE1  
3921  O  OE2  . GLU   A  253 ? 0.42823803 0.41774648 0.33706734 -0.05724212 -0.09647986 0.03004104  308  GLU   A OE2  
3922  H  H    . GLU   A  253 ? 0.28545415 0.26100552 0.17549925 -0.06191152 -0.08210960 0.03208618  308  GLU   A H    
3923  H  HA   . GLU   A  253 ? 0.28445268 0.26066008 0.18568948 -0.05868945 -0.07664720 0.03489846  308  GLU   A HA   
3924  H  HB2  . GLU   A  253 ? 0.35201600 0.31989413 0.23660237 -0.05740197 -0.08816302 0.03828744  308  GLU   A HB2  
3925  H  HB3  . GLU   A  253 ? 0.34198344 0.31228888 0.23693255 -0.05482899 -0.08612800 0.03877018  308  GLU   A HB3  
3926  H  HG2  . GLU   A  253 ? 0.46201646 0.44327247 0.36884502 -0.05259627 -0.09372537 0.03533902  308  GLU   A HG2  
3927  H  HG3  . GLU   A  253 ? 0.44768035 0.43269733 0.35911310 -0.05563471 -0.08687315 0.03278668  308  GLU   A HG3  
3928  N  N    . GLN   A  254 ? 0.28609234 0.25010341 0.16068703 -0.06385300 -0.07313497 0.03694298  309  GLN   A N    
3929  C  CA   . GLN   A  254 ? 0.33730519 0.29648972 0.20246430 -0.06604443 -0.06866030 0.03859420  309  GLN   A CA   
3930  C  C    . GLN   A  254 ? 0.34725463 0.30977464 0.21694252 -0.06728125 -0.06186895 0.03655659  309  GLN   A C    
3931  O  O    . GLN   A  254 ? 0.33294535 0.29970235 0.20867582 -0.06718276 -0.06078843 0.03341293  309  GLN   A O    
3932  C  CB   . GLN   A  254 ? 0.31569380 0.27078745 0.16794914 -0.06785155 -0.07039797 0.03850362  309  GLN   A CB   
3933  C  CG   . GLN   A  254 ? 0.39628935 0.34632379 0.24137270 -0.06675962 -0.07720596 0.04157079  309  GLN   A CG   
3934  C  CD   . GLN   A  254 ? 0.43327814 0.37645119 0.27125961 -0.06729643 -0.07639243 0.04612393  309  GLN   A CD   
3935  O  OE1  . GLN   A  254 ? 0.40473258 0.34818304 0.24762908 -0.06746817 -0.07236857 0.04717489  309  GLN   A OE1  
3936  N  NE2  . GLN   A  254 ? 0.41079485 0.34726891 0.23664142 -0.06790139 -0.08033291 0.04892845  309  GLN   A NE2  
3937  H  HA   . GLN   A  254 ? 0.32666802 0.28282276 0.19031309 -0.06557178 -0.06914640 0.04116387  309  GLN   A HA   
3938  H  HB2  . GLN   A  254 ? 0.33537492 0.29303694 0.18928134 -0.06809266 -0.07094186 0.03582948  309  GLN   A HB2  
3939  H  HB3  . GLN   A  254 ? 0.34035417 0.29340822 0.18693802 -0.06954550 -0.06654626 0.03900225  309  GLN   A HB3  
3940  H  HG2  . GLN   A  254 ? 0.37996584 0.33268273 0.23205787 -0.06466851 -0.08082689 0.04121679  309  GLN   A HG2  
3941  H  HG3  . GLN   A  254 ? 0.39193818 0.34024864 0.22972253 -0.06780118 -0.07889127 0.04092337  309  GLN   A HG3  
3942  H  HE21 . GLN   A  254 ? 0.42570898 0.36211574 0.24853942 -0.06754024 -0.08385955 0.04817804  309  GLN   A HE21 
3943  H  HE22 . GLN   A  254 ? 0.42688259 0.35863179 0.24717918 -0.06881446 -0.07961702 0.05166964  309  GLN   A HE22 
3944  N  N    . PRO   A  255 ? 0.33556801 0.29612163 0.20188077 -0.06873134 -0.05718135 0.03822272  310  PRO   A N    
3945  C  CA   . PRO   A  255 ? 0.34495133 0.29943630 0.20232105 -0.06991825 -0.05783155 0.04211070  310  PRO   A CA   
3946  C  C    . PRO   A  255 ? 0.30327597 0.25527263 0.16474178 -0.06853535 -0.05981012 0.04500040  310  PRO   A C    
3947  O  O    . PRO   A  255 ? 0.35514349 0.30116552 0.20919335 -0.06995277 -0.05993614 0.04838482  310  PRO   A O    
3948  C  CB   . PRO   A  255 ? 0.32808560 0.28311723 0.18143728 -0.07264041 -0.05120173 0.04192357  310  PRO   A CB   
3949  C  CG   . PRO   A  255 ? 0.36836120 0.32980779 0.23257691 -0.07169870 -0.04749617 0.03881484  310  PRO   A CG   
3950  C  CD   . PRO   A  255 ? 0.33944702 0.30355942 0.20974737 -0.06964836 -0.05102186 0.03630349  310  PRO   A CD   
3951  H  HA   . PRO   A  255 ? 0.34184274 0.29334944 0.19219439 -0.07017162 -0.06080909 0.04275882  310  PRO   A HA   
3952  H  HB2  . PRO   A  255 ? 0.34593171 0.29843879 0.19702685 -0.07376631 -0.05013670 0.04438506  310  PRO   A HB2  
3953  H  HB3  . PRO   A  255 ? 0.34924823 0.30315971 0.19552812 -0.07381056 -0.05051812 0.04121882  310  PRO   A HB3  
3954  H  HG2  . PRO   A  255 ? 0.34485343 0.30709326 0.21396826 -0.07146570 -0.04646700 0.03985199  310  PRO   A HG2  
3955  H  HG3  . PRO   A  255 ? 0.35021782 0.31313053 0.21231931 -0.07275924 -0.04390573 0.03742679  310  PRO   A HG3  
3956  H  HD2  . PRO   A  255 ? 0.33441812 0.30135339 0.21262723 -0.06859095 -0.05051152 0.03572665  310  PRO   A HD2  
3957  H  HD3  . PRO   A  255 ? 0.34385660 0.30898181 0.21244982 -0.07003894 -0.04998043 0.03406946  310  PRO   A HD3  
3958  N  N    . ASP   A  256 ? 0.25329730 0.20924735 0.12577395 -0.06585978 -0.06154578 0.04365131  311  ASP   A N    
3959  C  CA   . ASP   A  256 ? 0.29708093 0.25062022 0.17367038 -0.06399409 -0.06344610 0.04565772  311  ASP   A CA   
3960  C  C    . ASP   A  256 ? 0.32846490 0.27460185 0.19757186 -0.06281713 -0.06898969 0.04896094  311  ASP   A C    
3961  O  O    . ASP   A  256 ? 0.29069746 0.23068091 0.15630680 -0.06320141 -0.06910752 0.05187224  311  ASP   A O    
3962  C  CB   . ASP   A  256 ? 0.33770958 0.29750964 0.22662821 -0.06101015 -0.06489798 0.04309123  311  ASP   A CB   
3963  C  CG   . ASP   A  256 ? 0.37967715 0.33777824 0.27387848 -0.05851377 -0.06639572 0.04422128  311  ASP   A CG   
3964  O  OD1  . ASP   A  256 ? 0.29832131 0.25627440 0.19520684 -0.05940833 -0.06264751 0.04436633  311  ASP   A OD1  
3965  O  OD2  . ASP   A  256 ? 0.33380747 0.29061893 0.22928521 -0.05552614 -0.07149518 0.04480195  311  ASP   A OD2  
3966  H  H    . ASP   A  256 ? 0.26792571 0.22802263 0.14526233 -0.06524212 -0.06143674 0.04131822  311  ASP   A H    
3967  H  HA   . ASP   A  256 ? 0.29603583 0.24875756 0.17275055 -0.06535355 -0.06011308 0.04640808  311  ASP   A HA   
3968  H  HB2  . ASP   A  256 ? 0.32600683 0.28974128 0.21907793 -0.06181886 -0.06156673 0.04127248  311  ASP   A HB2  
3969  H  HB3  . ASP   A  256 ? 0.33459014 0.29594362 0.22409508 -0.05991434 -0.06815076 0.04223968  311  ASP   A HB3  
3970  N  N    . PHE   A  257 ? 0.27381784 0.22028673 0.14078037 -0.06126506 -0.07409109 0.04847960  312  PHE   A N    
3971  C  CA   . PHE   A  257 ? 0.31758976 0.25711501 0.17772123 -0.05947787 -0.08031690 0.05158795  312  PHE   A CA   
3972  C  C    . PHE   A  257 ? 0.38212898 0.31221119 0.22843248 -0.06268497 -0.07902371 0.05564921  312  PHE   A C    
3973  O  O    . PHE   A  257 ? 0.40621072 0.32881835 0.24906199 -0.06186233 -0.08134209 0.05894032  312  PHE   A O    
3974  C  CB   . PHE   A  257 ? 0.36170727 0.30397829 0.22061852 -0.05822450 -0.08554405 0.05011954  312  PHE   A CB   
3975  C  CG   . PHE   A  257 ? 0.50078470 0.43629891 0.35199380 -0.05608019 -0.09298810 0.05320846  312  PHE   A CG   
3976  C  CD1  . PHE   A  257 ? 0.53253907 0.46857685 0.39113218 -0.05134770 -0.09847715 0.05357721  312  PHE   A CD1  
3977  C  CD2  . PHE   A  257 ? 0.73457575 0.66341001 0.57096958 -0.05854652 -0.09467598 0.05555699  312  PHE   A CD2  
3978  C  CE1  . PHE   A  257 ? 0.70424938 0.63402796 0.55597562 -0.04876496 -0.10605977 0.05638172  312  PHE   A CE1  
3979  C  CE2  . PHE   A  257 ? 0.85655677 0.77875352 0.68516511 -0.05642723 -0.10223269 0.05858089  312  PHE   A CE2  
3980  C  CZ   . PHE   A  257 ? 0.76459813 0.68718219 0.60113305 -0.05138142 -0.10811844 0.05905368  312  PHE   A CZ   
3981  H  H    . PHE   A  257 ? 0.28981981 0.24073264 0.15956107 -0.06131962 -0.07394258 0.04618567  312  PHE   A H    
3982  H  HA   . PHE   A  257 ? 0.32314372 0.26239577 0.18882905 -0.05691910 -0.08218274 0.05192593  312  PHE   A HA   
3983  H  HB2  . PHE   A  257 ? 0.36634421 0.31473184 0.23462470 -0.05647491 -0.08623846 0.04772872  312  PHE   A HB2  
3984  H  HB3  . PHE   A  257 ? 0.37722883 0.32012662 0.23131655 -0.06065162 -0.08338846 0.04919446  312  PHE   A HB3  
3985  H  HD1  . PHE   A  257 ? 0.54889572 0.48965833 0.41720450 -0.04968189 -0.09715447 0.05182728  312  PHE   A HD1  
3986  H  HD2  . PHE   A  257 ? 0.68486363 0.61376661 0.51629710 -0.06155692 -0.09076514 0.05499292  312  PHE   A HD2  
3987  H  HE1  . PHE   A  257 ? 0.67055213 0.60096335 0.52787209 -0.04509055 -0.10982508 0.05642670  312  PHE   A HE1  
3988  H  HE2  . PHE   A  257 ? 0.81099194 0.72830290 0.62868255 -0.05831707 -0.10330589 0.06030735  312  PHE   A HE2  
3989  H  HZ   . PHE   A  257 ? 0.77812034 0.69589704 0.60940725 -0.04959681 -0.11353701 0.06120589  312  PHE   A HZ   
3990  N  N    . SER   A  258 ? 0.36064231 0.29094523 0.19907936 -0.06653608 -0.07484698 0.05530364  313  SER   A N    
3991  C  CA   . SER   A  258 ? 0.41006550 0.33272263 0.23544432 -0.07034433 -0.07258583 0.05895166  313  SER   A CA   
3992  C  C    . SER   A  258 ? 0.38193649 0.30344224 0.21051003 -0.07239719 -0.06760529 0.06031297  313  SER   A C    
3993  O  O    . SER   A  258 ? 0.37221831 0.28523046 0.19311889 -0.07420933 -0.06834146 0.06435567  313  SER   A O    
3994  C  CB   . SER   A  258 ? 0.45591727 0.38036060 0.27270222 -0.07363755 -0.06894334 0.05753907  313  SER   A CB   
3995  O  OG   . SER   A  258 ? 0.42274144 0.34710854 0.23541972 -0.07201856 -0.07434809 0.05640088  313  SER   A OG   
3996  H  H    . SER   A  258 ? 0.36861947 0.30394262 0.20983368 -0.06684561 -0.07326142 0.05265855  313  SER   A H    
3997  H  HA   . SER   A  258 ? 0.41384062 0.33029085 0.23311329 -0.06947419 -0.07710159 0.06160717  313  SER   A HA   
3998  H  HB2  . SER   A  258 ? 0.42770147 0.35798091 0.25046223 -0.07413246 -0.06475936 0.05482947  313  SER   A HB2  
3999  H  HB3  . SER   A  258 ? 0.44498819 0.36474872 0.25295317 -0.07642774 -0.06706601 0.06002481  313  SER   A HB3  
4001  N  N    . GLY   A  259 ? 0.33148694 0.26108205 0.17114866 -0.07221439 -0.06299781 0.05701124  314  GLY   A N    
4002  C  CA   . GLY   A  259 ? 0.34109646 0.27097309 0.18477580 -0.07425014 -0.05839304 0.05772273  314  GLY   A CA   
4003  C  C    . GLY   A  259 ? 0.29725567 0.21960172 0.14113978 -0.07295500 -0.06194412 0.06066731  314  GLY   A C    
4004  O  O    . GLY   A  259 ? 0.35303366 0.27062351 0.19325089 -0.07615733 -0.05952439 0.06316923  314  GLY   A O    
4005  H  H    . GLY   A  259 ? 0.33671305 0.27157608 0.18130800 -0.07092018 -0.06290179 0.05429651  314  GLY   A H    
4006  H  HA2  . GLY   A  259 ? 0.33013377 0.25904197 0.16790096 -0.07756189 -0.05499165 0.05877854  314  GLY   A HA2  
4007  H  HA3  . GLY   A  259 ? 0.31578070 0.25182790 0.16793467 -0.07331216 -0.05617547 0.05506520  314  GLY   A HA3  
4008  N  N    . HIS   A  260 ? 0.33001161 0.25177255 0.17901644 -0.06820657 -0.06755298 0.05999392  315  HIS   A N    
4009  C  CA   . HIS   A  260 ? 0.36067086 0.27500373 0.21032530 -0.06583306 -0.07146115 0.06216615  315  HIS   A CA   
4010  C  C    . HIS   A  260 ? 0.34691364 0.24929631 0.18251508 -0.06775898 -0.07461915 0.06705174  315  HIS   A C    
4011  O  O    . HIS   A  260 ? 0.34699267 0.24090728 0.17942531 -0.06859545 -0.07537337 0.06978370  315  HIS   A O    
4012  C  CB   . HIS   A  260 ? 0.34415072 0.26133269 0.20236534 -0.05977260 -0.07698916 0.06012001  315  HIS   A CB   
4013  C  CG   . HIS   A  260 ? 0.43046767 0.35718387 0.30250850 -0.05769867 -0.07430171 0.05599308  315  HIS   A CG   
4014  N  ND1  . HIS   A  260 ? 0.36726132 0.29293635 0.24461347 -0.05738638 -0.07211415 0.05552531  315  HIS   A ND1  
4015  C  CD2  . HIS   A  260 ? 0.36270633 0.29926014 0.24317989 -0.05612673 -0.07376401 0.05238500  315  HIS   A CD2  
4016  C  CE1  . HIS   A  260 ? 0.41555458 0.35046613 0.30384567 -0.05555711 -0.07017691 0.05180816  315  HIS   A CE1  
4017  N  NE2  . HIS   A  260 ? 0.39182532 0.33338308 0.28245127 -0.05484349 -0.07107449 0.04995071  315  HIS   A NE2  
4018  H  H    . HIS   A  260 ? 0.32258457 0.24882743 0.17500846 -0.06634376 -0.06895064 0.05796036  315  HIS   A H    
4019  H  HA   . HIS   A  260 ? 0.34261149 0.25745356 0.19609442 -0.06690994 -0.06857155 0.06181782  315  HIS   A HA   
4020  H  HB2  . HIS   A  260 ? 0.36842471 0.28736860 0.22461763 -0.05895181 -0.07938405 0.05973824  315  HIS   A HB2  
4021  H  HB3  . HIS   A  260 ? 0.37316668 0.28383780 0.22935788 -0.05797486 -0.08030078 0.06197469  315  HIS   A HB3  
4023  H  HD2  . HIS   A  260 ? 0.38270921 0.32179379 0.26187408 -0.05608281 -0.07514389 0.05170672  315  HIS   A HD2  
4024  H  HE1  . HIS   A  260 ? 0.38899332 0.32528910 0.28234872 -0.05502168 -0.06846343 0.05064536  315  HIS   A HE1  
4026  N  N    . LYS   A  261 ? 0.36108911 0.26204702 0.18755543 -0.06856500 -0.07675532 0.06818249  316  LYS   A N    
4027  C  CA   . LYS   A  261 ? 0.43849796 0.32735670 0.25016049 -0.07032470 -0.08036599 0.07318462  316  LYS   A CA   
4028  C  C    . LYS   A  261 ? 0.43979824 0.32418612 0.24169150 -0.07710757 -0.07456439 0.07610390  316  LYS   A C    
4029  O  O    . LYS   A  261 ? 0.40559793 0.27893901 0.19921318 -0.07933992 -0.07586606 0.08043592  316  LYS   A O    
4030  C  CB   . LYS   A  261 ? 0.46318924 0.35170507 0.26747185 -0.06891812 -0.08513833 0.07344864  316  LYS   A CB   
4031  C  CG   . LYS   A  261 ? 0.72137427 0.59656167 0.50929159 -0.07013218 -0.09010033 0.07892210  316  LYS   A CG   
4032  C  CD   . LYS   A  261 ? 1.13897061 1.00452745 0.92771053 -0.06568068 -0.09690367 0.08165935  316  LYS   A CD   
4033  C  CE   . LYS   A  261 ? 1.11591578 0.96585858 0.88752955 -0.06777548 -0.10093461 0.08788233  316  LYS   A CE   
4034  N  NZ   . LYS   A  261 ? 1.02688110 0.87478709 0.78714740 -0.06769317 -0.10547090 0.08935117  316  LYS   A NZ   
4035  H  H    . LYS   A  261 ? 0.36640915 0.27347073 0.19535607 -0.06808116 -0.07614921 0.06587433  316  LYS   A H    
4036  H  HA   . LYS   A  261 ? 0.43450195 0.31766912 0.24702947 -0.06790814 -0.08396817 0.07463948  316  LYS   A HA   
4037  H  HB2  . LYS   A  261 ? 0.49439579 0.38669422 0.30593619 -0.06483240 -0.08873102 0.07145151  316  LYS   A HB2  
4038  H  HB3  . LYS   A  261 ? 0.49629354 0.38993111 0.29928389 -0.07123099 -0.08156842 0.07178123  316  LYS   A HB3  
4039  H  HG2  . LYS   A  261 ? 0.71295297 0.58900559 0.49639165 -0.06943519 -0.09285466 0.07864938  316  LYS   A HG2  
4040  H  HG3  . LYS   A  261 ? 0.71300054 0.58453453 0.49349290 -0.07461612 -0.08624496 0.08101935  316  LYS   A HG3  
4041  H  HD2  . LYS   A  261 ? 0.98796058 0.85418224 0.78336239 -0.06558008 -0.09444299 0.08087281  316  LYS   A HD2  
4042  H  HD3  . LYS   A  261 ? 1.00493133 0.87387735 0.79936224 -0.06120743 -0.10134736 0.07992342  316  LYS   A HD3  
4043  H  HE2  . LYS   A  261 ? 1.10438633 0.95111543 0.87041545 -0.07260744 -0.09637687 0.08970423  316  LYS   A HE2  
4044  H  HE3  . LYS   A  261 ? 1.10529983 0.94914490 0.87837607 -0.06448257 -0.10522841 0.08922959  316  LYS   A HE3  
4045  H  HZ1  . LYS   A  261 ? 1.05348217 0.90495408 0.80994964 -0.07129980 -0.10127498 0.08864018  316  LYS   A HZ1  
4046  H  HZ2  . LYS   A  261 ? 1.05170155 0.90456730 0.81827414 -0.06369913 -0.10908644 0.08709399  316  LYS   A HZ2  
4047  H  HZ3  . LYS   A  261 ? 1.06981742 0.90782964 0.82032996 -0.06807198 -0.10895397 0.09318680  316  LYS   A HZ3  
4048  N  N    . TYR   A  262 ? 0.43173689 0.32490504 0.23525803 -0.08040068 -0.06801462 0.07357223  317  TYR   A N    
4049  C  CA   . TYR   A  262 ? 0.45346865 0.34467864 0.24778861 -0.08689022 -0.06212668 0.07584528  317  TYR   A CA   
4050  C  C    . TYR   A  262 ? 0.39829597 0.29551762 0.20128530 -0.08985486 -0.05552352 0.07434215  317  TYR   A C    
4051  O  O    . TYR   A  262 ? 0.38463050 0.28169355 0.18186043 -0.09540216 -0.05031244 0.07599296  317  TYR   A O    
4052  C  CB   . TYR   A  262 ? 0.45164299 0.34832075 0.23976123 -0.08857020 -0.05928807 0.07398641  317  TYR   A CB   
4053  C  CG   . TYR   A  262 ? 0.48747709 0.37840396 0.26558203 -0.08639096 -0.06583241 0.07543250  317  TYR   A CG   
4054  C  CD1  . TYR   A  262 ? 0.55705553 0.43534607 0.32171655 -0.08767895 -0.07038932 0.08079587  317  TYR   A CD1  
4055  C  CD2  . TYR   A  262 ? 0.49087405 0.38854486 0.27251631 -0.08324365 -0.06781475 0.07151910  317  TYR   A CD2  
4056  C  CE1  . TYR   A  262 ? 0.63832957 0.51129800 0.39325875 -0.08560138 -0.07694069 0.08227049  317  TYR   A CE1  
4057  C  CE2  . TYR   A  262 ? 0.57326406 0.46610960 0.34588945 -0.08144508 -0.07431450 0.07270523  317  TYR   A CE2  
4058  C  CZ   . TYR   A  262 ? 0.67219484 0.55295807 0.43154210 -0.08244228 -0.07898480 0.07807897  317  TYR   A CZ   
4059  O  OH   . TYR   A  262 ? 0.76128167 0.63737947 0.51134229 -0.08052155 -0.08593811 0.07930640  317  TYR   A OH   
4060  H  H    . TYR   A  262 ? 0.42466599 0.32530928 0.23525530 -0.07855369 -0.06713958 0.07029972  317  TYR   A H    
4061  H  HA   . TYR   A  262 ? 0.45375913 0.33585143 0.23908685 -0.08858017 -0.06429262 0.07966934  317  TYR   A HA   
4062  H  HB2  . TYR   A  262 ? 0.44662249 0.35154003 0.24332719 -0.08694927 -0.05722455 0.07027392  317  TYR   A HB2  
4063  H  HB3  . TYR   A  262 ? 0.46286303 0.35886145 0.24496187 -0.09285187 -0.05501321 0.07534555  317  TYR   A HB3  
4064  H  HD1  . TYR   A  262 ? 0.56312734 0.43605885 0.32478803 -0.09018990 -0.06913549 0.08357263  317  TYR   A HD1  
4065  H  HD2  . TYR   A  262 ? 0.49346113 0.39883375 0.28367823 -0.08239795 -0.06496635 0.06804921  317  TYR   A HD2  
4066  H  HE1  . TYR   A  262 ? 0.64086080 0.50468898 0.38623491 -0.08636340 -0.08028950 0.08613703  317  TYR   A HE1  
4067  H  HE2  . TYR   A  262 ? 0.56713879 0.46463281 0.34233320 -0.07967015 -0.07573152 0.06992016  317  TYR   A HE2  
4069  N  N    . GLY   A  263 ? 0.41892597 0.32255119 0.23591861 -0.08628717 -0.05553725 0.07094160  318  GLY   A N    
4070  C  CA   . GLY   A  263 ? 0.34635359 0.25751746 0.17230025 -0.08855445 -0.04959418 0.06878009  318  GLY   A CA   
4071  C  C    . GLY   A  263 ? 0.36699504 0.28945392 0.19715095 -0.08886647 -0.04464193 0.06491375  318  GLY   A C    
4072  O  O    . GLY   A  263 ? 0.41700777 0.33995286 0.23980157 -0.08932140 -0.04441750 0.06465562  318  GLY   A O    
4073  H  H    . GLY   A  263 ? 0.39200208 0.29543880 0.21297023 -0.08238430 -0.05939971 0.06996446  318  GLY   A H    
4074  H  HA2  . GLY   A  263 ? 0.35854730 0.27082956 0.19238630 -0.08591739 -0.05105809 0.06743344  318  GLY   A HA2  
4075  H  HA3  . GLY   A  263 ? 0.37208426 0.27966899 0.19351605 -0.09252894 -0.04743071 0.07114327  318  GLY   A HA3  
4076  N  N    . PRO   A  264 ? 0.33153129 0.26278916 0.17291918 -0.08865853 -0.04060103 0.06177700  319  PRO   A N    
4077  C  CA   . PRO   A  264 ? 0.33307838 0.27429563 0.17943060 -0.08775064 -0.03675314 0.05776529  319  PRO   A CA   
4078  C  C    . PRO   A  264 ? 0.39486149 0.33851111 0.23343799 -0.09188668 -0.03153449 0.05805030  319  PRO   A C    
4079  O  O    . PRO   A  264 ? 0.46756187 0.41625732 0.30573124 -0.09065797 -0.02971371 0.05510611  319  PRO   A O    
4080  C  CB   . PRO   A  264 ? 0.37597021 0.32426879 0.23512295 -0.08679791 -0.03422001 0.05524042  319  PRO   A CB   
4081  C  CG   . PRO   A  264 ? 0.35194865 0.29433221 0.21075700 -0.08926964 -0.03501729 0.05827159  319  PRO   A CG   
4082  C  CD   . PRO   A  264 ? 0.30356267 0.23479566 0.15306455 -0.08874392 -0.04031859 0.06177971  319  PRO   A CD   
4083  H  HA   . PRO   A  264 ? 0.34751976 0.28917778 0.19447482 -0.08483186 -0.03946289 0.05636262  319  PRO   A HA   
4084  H  HB2  . PRO   A  264 ? 0.35255861 0.30660877 0.21374750 -0.08811246 -0.03020521 0.05371247  319  PRO   A HB2  
4085  H  HB3  . PRO   A  264 ? 0.34846777 0.29862985 0.21325840 -0.08347473 -0.03633820 0.05338681  319  PRO   A HB3  
4086  H  HG2  . PRO   A  264 ? 0.34383768 0.28754315 0.20081817 -0.09292970 -0.03158612 0.05918872  319  PRO   A HG2  
4087  H  HG3  . PRO   A  264 ? 0.33333549 0.27757043 0.19943802 -0.08749138 -0.03572476 0.05697086  319  PRO   A HG3  
4088  H  HD2  . PRO   A  264 ? 0.32910001 0.25516719 0.17397778 -0.09183507 -0.03994513 0.06443673  319  PRO   A HD2  
4089  H  HD3  . PRO   A  264 ? 0.31751132 0.24703556 0.17086403 -0.08538198 -0.04381569 0.06117485  319  PRO   A HD3  
4090  N  N    . PHE   A  265 ? 0.38225222 0.32220596 0.21467890 -0.09688883 -0.02903672 0.06142670  320  PHE   A N    
4091  C  CA   . PHE   A  265 ? 0.47770330 0.42051607 0.30268982 -0.10151559 -0.02334279 0.06194302  320  PHE   A CA   
4092  C  C    . PHE   A  265 ? 0.44217163 0.37519845 0.25118920 -0.10432696 -0.02532751 0.06600150  320  PHE   A C    
4093  O  O    . PHE   A  265 ? 0.38507336 0.31890225 0.18612039 -0.10910714 -0.02056045 0.06733462  320  PHE   A O    
4094  C  CB   . PHE   A  265 ? 0.55413240 0.50058490 0.38275310 -0.10654871 -0.01830891 0.06317015  320  PHE   A CB   
4095  C  CG   . PHE   A  265 ? 0.85312170 0.80703270 0.69656461 -0.10445789 -0.01746385 0.06033568  320  PHE   A CG   
4096  C  CD1  . PHE   A  265 ? 0.87020731 0.83419150 0.72270858 -0.10101432 -0.01505321 0.05572501  320  PHE   A CD1  
4097  C  CD2  . PHE   A  265 ? 1.06011724 1.01004696 0.90763575 -0.10587610 -0.01941233 0.06228153  320  PHE   A CD2  
4098  C  CE1  . PHE   A  265 ? 0.67815888 0.64827633 0.54321063 -0.09909368 -0.01470972 0.05346170  320  PHE   A CE1  
4099  C  CE2  . PHE   A  265 ? 0.89647049 0.85296941 0.75653464 -0.10405684 -0.01888168 0.05964520  320  PHE   A CE2  
4100  C  CZ   . PHE   A  265 ? 0.90270823 0.86931264 0.77133006 -0.10065597 -0.01663470 0.05541259  320  PHE   A CZ   
4101  H  H    . PHE   A  265 ? 0.40520453 0.34070158 0.23812045 -0.09759202 -0.03081766 0.06342180  320  PHE   A H    
4102  H  HA   . PHE   A  265 ? 0.45456165 0.40347695 0.28189296 -0.09997709 -0.02113514 0.05886715  320  PHE   A HA   
4103  H  HB2  . PHE   A  265 ? 0.59750688 0.53671408 0.42081419 -0.10910483 -0.01999707 0.06658834  320  PHE   A HB2  
4104  H  HB3  . PHE   A  265 ? 0.59061486 0.54153609 0.41643450 -0.10900633 -0.01387821 0.06254217  320  PHE   A HB3  
4105  H  HD1  . PHE   A  265 ? 0.81776071 0.78391230 0.66738784 -0.09994836 -0.01381487 0.05413638  320  PHE   A HD1  
4106  H  HD2  . PHE   A  265 ? 0.96853590 0.91076589 0.80973750 -0.10812093 -0.02123527 0.06540957  320  PHE   A HD2  
4107  H  HE1  . PHE   A  265 ? 0.75910521 0.73530602 0.62972951 -0.09669872 -0.01331466 0.05056359  320  PHE   A HE1  
4108  H  HE2  . PHE   A  265 ? 0.92664087 0.88011557 0.78891116 -0.10509682 -0.02027319 0.06076979  320  PHE   A HE2  
4109  H  HZ   . PHE   A  265 ? 0.82817852 0.79884827 0.70469820 -0.09946235 -0.01648490 0.05384418  320  PHE   A HZ   
4110  N  N    . GLY   A  266 ? 0.40463889 0.32863003 0.20875806 -0.10146879 -0.03229605 0.06805435  321  GLY   A N    
4111  C  CA   . GLY   A  266 ? 0.44121450 0.35558742 0.22923787 -0.10383771 -0.03472173 0.07199140  321  GLY   A CA   
4112  C  C    . GLY   A  266 ? 0.42513892 0.34419096 0.20622963 -0.10434640 -0.03160013 0.06953799  321  GLY   A C    
4113  O  O    . GLY   A  266 ? 0.41077739 0.33680260 0.19894747 -0.10046312 -0.03161786 0.06500734  321  GLY   A O    
4114  H  H    . GLY   A  266 ? 0.41151619 0.33541018 0.22207375 -0.09803916 -0.03557475 0.06703904  321  GLY   A H    
4115  H  HA2  . GLY   A  266 ? 0.43975329 0.35013831 0.22265413 -0.10800303 -0.03288174 0.07504653  321  GLY   A HA2  
4116  H  HA3  . GLY   A  266 ? 0.43444052 0.34300429 0.22094746 -0.10095614 -0.04035908 0.07315487  321  GLY   A HA3  
4117  N  N    . PRO   A  267 ? 0.50685930 0.42192131 0.27350634 -0.10924905 -0.02870361 0.07226229  322  PRO   A N    
4118  C  CA   . PRO   A  267 ? 0.53515601 0.45439821 0.29438791 -0.10955421 -0.02554725 0.06942951  322  PRO   A CA   
4119  C  C    . PRO   A  267 ? 0.45665675 0.37278527 0.21249065 -0.10477482 -0.03215459 0.06771662  322  PRO   A C    
4120  O  O    . PRO   A  267 ? 0.44065672 0.36175323 0.19457491 -0.10359250 -0.03012330 0.06370514  322  PRO   A O    
4121  C  CB   . PRO   A  267 ? 0.54482096 0.45778120 0.28713173 -0.11608622 -0.02232292 0.07386785  322  PRO   A CB   
4122  C  CG   . PRO   A  267 ? 0.52473378 0.42781919 0.26432955 -0.11872269 -0.02560181 0.07958112  322  PRO   A CG   
4123  C  CD   . PRO   A  267 ? 0.44600672 0.35183433 0.20208102 -0.11493482 -0.02823113 0.07810628  322  PRO   A CD   
4124  H  HA   . PRO   A  267 ? 0.50367463 0.43157011 0.27031630 -0.10922823 -0.02089362 0.06596759  322  PRO   A HA   
4125  H  HB2  . PRO   A  267 ? 0.54896307 0.45772883 0.28122437 -0.11573108 -0.02458973 0.07432660  322  PRO   A HB2  
4126  H  HB3  . PRO   A  267 ? 0.53945184 0.45890659 0.28285480 -0.11885983 -0.01597972 0.07243519  322  PRO   A HB3  
4127  H  HG2  . PRO   A  267 ? 0.52395296 0.41823354 0.25443926 -0.11810992 -0.03065380 0.08238578  322  PRO   A HG2  
4128  H  HG3  . PRO   A  267 ? 0.52025723 0.42341843 0.25582069 -0.12369389 -0.02106510 0.08156279  322  PRO   A HG3  
4129  H  HD2  . PRO   A  267 ? 0.47893244 0.37681594 0.23309243 -0.11347871 -0.03363217 0.08070700  322  PRO   A HD2  
4130  H  HD3  . PRO   A  267 ? 0.47120506 0.38075888 0.23251352 -0.11767757 -0.02419463 0.07819007  322  PRO   A HD3  
4131  N  N    . GLU   A  268 ? 0.49125397 0.39947078 0.24689886 -0.10193668 -0.04011489 0.07045460  323  GLU   A N    
4132  C  CA   . GLU   A  268 ? 0.52971435 0.43569386 0.28354186 -0.09745556 -0.04717217 0.06900899  323  GLU   A CA   
4133  C  C    . GLU   A  268 ? 0.54213125 0.45794636 0.31089798 -0.09297451 -0.04703694 0.06316990  323  GLU   A C    
4134  O  O    . GLU   A  268 ? 0.49654484 0.41303083 0.26506180 -0.08994100 -0.05146481 0.06076150  323  GLU   A O    
4135  C  CB   . GLU   A  268 ? 0.51607484 0.41241610 0.26828992 -0.09494920 -0.05567114 0.07315670  323  GLU   A CB   
4136  C  CG   . GLU   A  268 ? 0.76181114 0.64614820 0.50018221 -0.09898958 -0.05694626 0.07963583  323  GLU   A CG   
4137  C  CD   . GLU   A  268 ? 0.79558879 0.67770708 0.53713810 -0.10278066 -0.05276514 0.08249551  323  GLU   A CD   
4138  O  OE1  . GLU   A  268 ? 0.56649798 0.45729470 0.32179135 -0.10259946 -0.04813214 0.07947768  323  GLU   A OE1  
4139  O  OE2  . GLU   A  268 ? 0.99046671 0.86121482 0.71972984 -0.10620742 -0.05458224 0.08804704  323  GLU   A OE2  
4140  H  H    . GLU   A  268 ? 0.49423090 0.39851928 0.25120291 -0.10277102 -0.04126006 0.07316791  323  GLU   A H    
4141  H  HA   . GLU   A  268 ? 0.53228086 0.43634033 0.27565742 -0.09897143 -0.04678525 0.06909617  323  GLU   A HA   
4142  H  HB2  . GLU   A  268 ? 0.55068737 0.44966710 0.31388468 -0.09275936 -0.05628202 0.07222424  323  GLU   A HB2  
4143  H  HB3  . GLU   A  268 ? 0.56378078 0.45905459 0.31376931 -0.09238458 -0.06032337 0.07231002  323  GLU   A HB3  
4144  H  HG2  . GLU   A  268 ? 0.70473075 0.58285892 0.44061783 -0.09642240 -0.06333902 0.08161329  323  GLU   A HG2  
4145  H  HG3  . GLU   A  268 ? 0.70981264 0.59245896 0.43724698 -0.10197177 -0.05484964 0.08047917  323  GLU   A HG3  
4146  N  N    . MET   A  269 ? 0.46037552 0.38375399 0.24199051 -0.09286650 -0.04202484 0.06092739  324  MET   A N    
4147  C  CA   . MET   A  269 ? 0.36836794 0.30004048 0.16383648 -0.08895189 -0.04180419 0.05598762  324  MET   A CA   
4148  C  C    . MET   A  269 ? 0.38664821 0.32379401 0.18002254 -0.08876895 -0.03822384 0.05138933  324  MET   A C    
4149  O  O    . MET   A  269 ? 0.37554616 0.31759214 0.17764927 -0.08560423 -0.03915415 0.04737459  324  MET   A O    
4150  C  CB   . MET   A  269 ? 0.40287936 0.34014767 0.21100470 -0.08914440 -0.03766372 0.05533360  324  MET   A CB   
4151  C  CG   . MET   A  269 ? 0.38500321 0.31722263 0.19748446 -0.08819366 -0.04180503 0.05857446  324  MET   A CG   
4152  S  SD   . MET   A  269 ? 0.39289564 0.32317266 0.21143025 -0.08244063 -0.05037122 0.05770475  324  MET   A SD   
4153  C  CE   . MET   A  269 ? 0.43644142 0.37775534 0.27068174 -0.07950908 -0.04763508 0.05213801  324  MET   A CE   
4154  H  H    . MET   A  269 ? 0.45386320 0.37698153 0.23545216 -0.09542929 -0.03886896 0.06265339  324  MET   A H    
4155  H  HA   . MET   A  269 ? 0.39181575 0.32168281 0.18996653 -0.08619582 -0.04696935 0.05599286  324  MET   A HA   
4156  H  HB2  . MET   A  269 ? 0.39046538 0.32933918 0.19588584 -0.09213806 -0.03295840 0.05583700  324  MET   A HB2  
4157  H  HB3  . MET   A  269 ? 0.37806797 0.32085395 0.19426015 -0.08692627 -0.03683306 0.05205212  324  MET   A HB3  
4158  H  HG2  . MET   A  269 ? 0.40144062 0.32754874 0.20573767 -0.09060548 -0.04245547 0.06197859  324  MET   A HG2  
4159  H  HG3  . MET   A  269 ? 0.38378519 0.31977010 0.20404686 -0.08843633 -0.03913471 0.05783625  324  MET   A HG3  
4160  H  HE1  . MET   A  269 ? 0.41323036 0.35676402 0.25307733 -0.08007216 -0.04495759 0.05213091  324  MET   A HE1  
4161  H  HE2  . MET   A  269 ? 0.41866398 0.36296421 0.25092795 -0.08015542 -0.04517003 0.05005465  324  MET   A HE2  
4162  H  HE3  . MET   A  269 ? 0.41466549 0.35641164 0.25335357 -0.07680267 -0.05140810 0.05128302  324  MET   A HE3  
4163  N  N    . THR   A  270 ? 0.35752302 0.29352421 0.13897103 -0.09231083 -0.03388149 0.05187394  325  THR   A N    
4164  C  CA   . THR   A  270 ? 0.39195296 0.33246550 0.17032599 -0.09196585 -0.03013722 0.04716420  325  THR   A CA   
4165  C  C    . THR   A  270 ? 0.42396605 0.36121976 0.19783507 -0.08939113 -0.03638740 0.04511026  325  THR   A C    
4166  O  O    . THR   A  270 ? 0.40379754 0.34520879 0.18148975 -0.08736439 -0.03534023 0.04018655  325  THR   A O    
4167  C  CB   . THR   A  270 ? 0.41790348 0.35777122 0.18363155 -0.09649574 -0.02404551 0.04834011  325  THR   A CB   
4168  O  OG1  . THR   A  270 ? 0.51846111 0.46418568 0.29220176 -0.09851263 -0.01794036 0.04890584  325  THR   A OG1  
4169  C  CG2  . THR   A  270 ? 0.43697390 0.37989748 0.19633879 -0.09613121 -0.02040994 0.04350897  325  THR   A CG2  
4170  H  H    . THR   A  270 ? 0.38284856 0.31507891 0.15783590 -0.09504075 -0.03306287 0.05509454  325  THR   A H    
4171  H  HA   . THR   A  270 ? 0.38210997 0.32856971 0.17013073 -0.09051374 -0.02730470 0.04436890  325  THR   A HA   
4172  H  HB   . THR   A  270 ? 0.44507688 0.37843814 0.20135219 -0.09842931 -0.02666664 0.05198281  325  THR   A HB   
4174  H  HG21 . THR   A  270 ? 0.43988866 0.38392133 0.19298942 -0.09899960 -0.01550306 0.04400006  325  THR   A HG21 
4175  H  HG22 . THR   A  270 ? 0.42320535 0.37143368 0.19172446 -0.09371362 -0.01879878 0.03990893  325  THR   A HG22 
4176  H  HG23 . THR   A  270 ? 0.43943349 0.37781173 0.19158059 -0.09545866 -0.02459643 0.04338270  325  THR   A HG23 
4177  N  N    . ASN   A  271 ? 0.39341521 0.32298154 0.15899970 -0.08956166 -0.04306721 0.04887163  326  ASN   A N    
4178  C  CA   . ASN   A  271 ? 0.46562758 0.39237231 0.22656247 -0.08750193 -0.04972817 0.04723608  326  ASN   A CA   
4179  C  C    . ASN   A  271 ? 0.43287712 0.36462051 0.20897020 -0.08357178 -0.05332551 0.04403403  326  ASN   A C    
4180  O  O    . ASN   A  271 ? 0.45837849 0.39269847 0.23553441 -0.08244500 -0.05393194 0.03964535  326  ASN   A O    
4181  C  CB   . ASN   A  271 ? 0.53536606 0.45314348 0.28520027 -0.08798209 -0.05690191 0.05217202  326  ASN   A CB   
4182  C  CG   . ASN   A  271 ? 0.74780023 0.65930790 0.48060805 -0.09240694 -0.05384251 0.05583642  326  ASN   A CG   
4183  O  OD1  . ASN   A  271 ? 1.00180435 0.90802312 0.73112136 -0.09437243 -0.05399079 0.06095394  326  ASN   A OD1  
4184  N  ND2  . ASN   A  271 ? 0.85784096 0.76949841 0.57933319 -0.09434085 -0.05065728 0.05323258  326  ASN   A ND2  
4185  H  H    . ASN   A  271 ? 0.42097354 0.34687087 0.18376084 -0.09098763 -0.04371747 0.05252628  326  ASN   A H    
4186  H  HA   . ASN   A  271 ? 0.46357507 0.39092243 0.21802433 -0.08842687 -0.04738086 0.04474298  326  ASN   A HA   
4187  H  HB2  . ASN   A  271 ? 0.55388421 0.47062981 0.30993241 -0.08672228 -0.05943841 0.05445044  326  ASN   A HB2  
4188  H  HB3  . ASN   A  271 ? 0.55916762 0.47604752 0.30669081 -0.08657154 -0.06142171 0.05070945  326  ASN   A HB3  
4189  H  HD21 . ASN   A  271 ? 0.81164700 0.72835833 0.53683978 -0.09424271 -0.04623125 0.04975696  326  ASN   A HD21 
4190  H  HD22 . ASN   A  271 ? 0.83499336 0.74149162 0.54495507 -0.09562637 -0.05300354 0.05490611  326  ASN   A HD22 
4191  N  N    . PRO   A  272 ? 0.47260177 0.40552872 0.26025572 -0.08160519 -0.05574774 0.04597488  327  PRO   A N    
4192  C  CA   . PRO   A  272 ? 0.46583608 0.40429747 0.26784891 -0.07837438 -0.05813226 0.04285164  327  PRO   A CA   
4193  C  C    . PRO   A  272 ? 0.42071062 0.36552814 0.22976138 -0.07820642 -0.05221139 0.03818851  327  PRO   A C    
4194  O  O    . PRO   A  272 ? 0.43982193 0.38752419 0.25454196 -0.07660396 -0.05408463 0.03459824  327  PRO   A O    
4195  C  CB   . PRO   A  272 ? 0.54559940 0.48408020 0.35710910 -0.07686904 -0.05966062 0.04585879  327  PRO   A CB   
4196  C  CG   . PRO   A  272 ? 0.61032724 0.54103565 0.41075203 -0.07890435 -0.06074293 0.05100965  327  PRO   A CG   
4197  C  CD   . PRO   A  272 ? 0.54798561 0.47641575 0.33481592 -0.08250394 -0.05646794 0.05109243  327  PRO   A CD   
4198  H  HA   . PRO   A  272 ? 0.47437221 0.41178516 0.27469820 -0.07732740 -0.06294622 0.04211465  327  PRO   A HA   
4199  H  HB2  . PRO   A  272 ? 0.52494919 0.46712953 0.34345362 -0.07694272 -0.05558117 0.04487436  327  PRO   A HB2  
4200  H  HB3  . PRO   A  272 ? 0.53037232 0.46981019 0.34740329 -0.07465231 -0.06406575 0.04543201  327  PRO   A HB3  
4201  H  HG2  . PRO   A  272 ? 0.57570630 0.50638926 0.38038099 -0.07925895 -0.05874181 0.05259034  327  PRO   A HG2  
4202  H  HG3  . PRO   A  272 ? 0.58401942 0.51110470 0.38174579 -0.07756242 -0.06626864 0.05264584  327  PRO   A HG3  
4203  H  HD2  . PRO   A  272 ? 0.53787673 0.46779937 0.32542011 -0.08437321 -0.05136068 0.05154495  327  PRO   A HD2  
4204  H  HD3  . PRO   A  272 ? 0.55369294 0.47628039 0.33068371 -0.08348246 -0.05942440 0.05383284  327  PRO   A HD3  
4205  N  N    . LEU   A  273 ? 0.38404608 0.33104587 0.19305007 -0.07988250 -0.04524698 0.03824816  328  LEU   A N    
4206  C  CA   . LEU   A  273 ? 0.43078223 0.38366243 0.24682097 -0.07903636 -0.03999667 0.03386857  328  LEU   A CA   
4207  C  C    . LEU   A  273 ? 0.40894300 0.36073059 0.21666813 -0.07914385 -0.03961875 0.02985949  328  LEU   A C    
4208  O  O    . LEU   A  273 ? 0.37816060 0.33245987 0.19182052 -0.07739445 -0.03937924 0.02577655  328  LEU   A O    
4209  C  CB   . LEU   A  273 ? 0.34641457 0.30276865 0.16438714 -0.08065005 -0.03301387 0.03461635  328  LEU   A CB   
4210  C  CG   . LEU   A  273 ? 0.34777942 0.30598462 0.17579564 -0.08050777 -0.03275945 0.03748167  328  LEU   A CG   
4211  C  CD1  . LEU   A  273 ? 0.36821666 0.33099636 0.19824554 -0.08263717 -0.02563996 0.03771858  328  LEU   A CD1  
4212  C  CD2  . LEU   A  273 ? 0.33657396 0.29829305 0.17769758 -0.07743083 -0.03489012 0.03548073  328  LEU   A CD2  
4213  H  H    . LEU   A  273 ? 0.40794569 0.35281432 0.21275549 -0.08153007 -0.04388814 0.04100384  328  LEU   A H    
4214  H  HA   . LEU   A  273 ? 0.38758245 0.34282246 0.21277602 -0.07722916 -0.04161613 0.03284337  328  LEU   A HA   
4215  H  HB2  . LEU   A  273 ? 0.37442935 0.32840866 0.18338487 -0.08283223 -0.03148814 0.03616505  328  LEU   A HB2  
4216  H  HB3  . LEU   A  273 ? 0.36205542 0.32198393 0.18318807 -0.07982560 -0.02974305 0.03146615  328  LEU   A HB3  
4217  H  HG   . LEU   A  273 ? 0.35419351 0.30822349 0.17852840 -0.08125795 -0.03582529 0.04061226  328  LEU   A HG   
4218  H  HD11 . LEU   A  273 ? 0.35812509 0.32074624 0.19217768 -0.08324265 -0.02597827 0.04003947  328  LEU   A HD11 
4219  H  HD12 . LEU   A  273 ? 0.35573435 0.32298532 0.19148470 -0.08123831 -0.02308950 0.03476317  328  LEU   A HD12 
4220  H  HD13 . LEU   A  273 ? 0.37044829 0.33181781 0.19196039 -0.08480712 -0.02348152 0.03844104  328  LEU   A HD13 
4221  H  HD21 . LEU   A  273 ? 0.33705643 0.29652649 0.17813700 -0.07640529 -0.03943339 0.03592432  328  LEU   A HD21 
4222  H  HD22 . LEU   A  273 ? 0.33324772 0.29777926 0.17686404 -0.07650506 -0.03285103 0.03241233  328  LEU   A HD22 
4223  H  HD23 . LEU   A  273 ? 0.33049285 0.29385132 0.17748916 -0.07745703 -0.03379294 0.03678067  328  LEU   A HD23 
4224  N  N    . ARG   A  274 ? 0.41560364 0.36283958 0.20872976 -0.08135656 -0.03971514 0.03102503  329  ARG   A N    
4225  C  CA   . ARG   A  274 ? 0.41076148 0.35595915 0.19436121 -0.08154666 -0.04000452 0.02713225  329  ARG   A CA   
4226  C  C    . ARG   A  274 ? 0.37858278 0.32213771 0.16466723 -0.07993711 -0.04731710 0.02522901  329  ARG   A C    
4227  O  O    . ARG   A  274 ? 0.41075233 0.35464036 0.19655646 -0.07921812 -0.04715436 0.02052217  329  ARG   A O    
4228  C  CB   . ARG   A  274 ? 0.48019439 0.42017037 0.24630284 -0.08451276 -0.03938575 0.02929059  329  ARG   A CB   
4229  C  CG   . ARG   A  274 ? 0.77676260 0.71959770 0.53871989 -0.08668700 -0.03064995 0.02925542  329  ARG   A CG   
4230  C  CD   . ARG   A  274 ? 0.96074408 0.89847070 0.70382011 -0.08983374 -0.02948782 0.03031730  329  ARG   A CD   
4231  N  NE   . ARG   A  274 ? 1.11018384 1.05092072 0.84881711 -0.09277841 -0.02121705 0.03134298  329  ARG   A NE   
4232  C  CZ   . ARG   A  274 ? 1.65201187 1.58949590 1.37431169 -0.09614892 -0.01819833 0.03229733  329  ARG   A CZ   
4233  N  NH1  . ARG   A  274 ? 1.45927787 1.39102423 1.16778004 -0.09641054 -0.02175167 0.03077121  329  ARG   A NH1  
4234  N  NH2  . ARG   A  274 ? 1.45025015 1.39048183 1.16973913 -0.09966877 -0.01139368 0.03477747  329  ARG   A NH2  
4235  H  H    . ARG   A  274 ? 0.41952235 0.36450204 0.20807113 -0.08289664 -0.03959288 0.03428657  329  ARG   A H    
4236  H  HA   . ARG   A  274 ? 0.41391927 0.36221558 0.20036241 -0.08092637 -0.03560782 0.02400792  329  ARG   A HA   
4237  H  HB2  . ARG   A  274 ? 0.51615644 0.45293280 0.27980855 -0.08517816 -0.04301958 0.03310751  329  ARG   A HB2  
4238  H  HB3  . ARG   A  274 ? 0.52024454 0.45798218 0.27966800 -0.08446814 -0.04128807 0.02691355  329  ARG   A HB3  
4239  H  HG2  . ARG   A  274 ? 0.70235193 0.64912629 0.46908751 -0.08538821 -0.02699399 0.02551240  329  ARG   A HG2  
4240  H  HG3  . ARG   A  274 ? 0.70333296 0.64751232 0.47001076 -0.08743285 -0.02931504 0.03221240  329  ARG   A HG3  
4241  H  HD2  . ARG   A  274 ? 0.95585191 0.88873839 0.69358253 -0.09072192 -0.03423395 0.03383289  329  ARG   A HD2  
4242  H  HD3  . ARG   A  274 ? 0.95898044 0.89585859 0.69739246 -0.08909928 -0.02992783 0.02674970  329  ARG   A HD3  
4243  H  HE   . ARG   A  274 ? 1.16616726 1.11139023 0.91336578 -0.09247220 -0.01797421 0.03130744  329  ARG   A HE   
4244  H  HH11 . ARG   A  274 ? 1.50516570 1.43631768 1.21593916 -0.09425578 -0.02511175 0.02805762  329  ARG   A HH11 
4245  H  HH12 . ARG   A  274 ? 1.52790213 1.45633602 1.22468841 -0.09892846 -0.02078144 0.03248642  329  ARG   A HH12 
4246  H  HH21 . ARG   A  274 ? 1.51937270 1.45782018 1.22795832 -0.10211828 -0.00889368 0.03530966  329  ARG   A HH21 
4247  H  HH22 . ARG   A  274 ? 1.49496222 1.43889987 1.22342527 -0.09972864 -0.00939106 0.03585856  329  ARG   A HH22 
4248  N  N    . GLU   A  275 ? 0.39962113 0.34145376 0.18832891 -0.07939550 -0.05378431 0.02872025  330  GLU   A N    
4249  C  CA   . GLU   A  275 ? 0.43201095 0.37347341 0.22360821 -0.07818662 -0.06111296 0.02725449  330  GLU   A CA   
4250  C  C    . GLU   A  275 ? 0.40871191 0.35547972 0.21534635 -0.07644098 -0.06072495 0.02406994  330  GLU   A C    
4251  O  O    . GLU   A  275 ? 0.30763933 0.25480667 0.11580968 -0.07633721 -0.06356654 0.02045890  330  GLU   A O    
4252  C  CB   . GLU   A  275 ? 0.42262036 0.36160171 0.21382022 -0.07749721 -0.06809010 0.03183291  330  GLU   A CB   
4253  C  CG   . GLU   A  275 ? 0.52448952 0.45649761 0.29857466 -0.07931469 -0.07064991 0.03486918  330  GLU   A CG   
4254  C  CD   . GLU   A  275 ? 0.78073937 0.70997673 0.54312205 -0.08054083 -0.07312853 0.03150957  330  GLU   A CD   
4255  O  OE1  . GLU   A  275 ? 0.66572165 0.59695458 0.43327236 -0.07949354 -0.07849767 0.02874474  330  GLU   A OE1  
4256  O  OE2  . GLU   A  275 ? 0.77335292 0.69864762 0.52142781 -0.08278909 -0.06957104 0.03143947  330  GLU   A OE2  
4257  H  H    . GLU   A  275 ? 0.40107280 0.34206736 0.18996516 -0.07978135 -0.05368841 0.03204159  330  GLU   A H    
4258  H  HA   . GLU   A  275 ? 0.43069020 0.36980867 0.21402434 -0.07904008 -0.06206089 0.02518850  330  GLU   A HA   
4259  H  HB2  . GLU   A  275 ? 0.43543082 0.37569225 0.23278412 -0.07684618 -0.06666885 0.03405239  330  GLU   A HB2  
4260  H  HB3  . GLU   A  275 ? 0.43938082 0.37997335 0.23560493 -0.07642483 -0.07257251 0.03060253  330  GLU   A HB3  
4261  H  HG2  . GLU   A  275 ? 0.54641271 0.47707057 0.31577998 -0.08072677 -0.06600922 0.03635862  330  GLU   A HG2  
4262  H  HG3  . GLU   A  275 ? 0.54490817 0.47510058 0.31949118 -0.07839938 -0.07546175 0.03777113  330  GLU   A HG3  
4263  N  N    . ILE   A  276 ? 0.36389527 0.31433439 0.18109365 -0.07543453 -0.05715758 0.02547970  331  ILE   A N    
4264  C  CA   . ILE   A  276 ? 0.32108921 0.27605948 0.15133691 -0.07404814 -0.05584094 0.02286155  331  ILE   A CA   
4265  C  C    . ILE   A  276 ? 0.37519079 0.32994175 0.20317455 -0.07421128 -0.05190189 0.01812555  331  ILE   A C    
4266  O  O    . ILE   A  276 ? 0.38149515 0.33708271 0.21516143 -0.07377551 -0.05352857 0.01508577  331  ILE   A O    
4267  C  CB   . ILE   A  276 ? 0.35719535 0.31548661 0.19688798 -0.07313958 -0.05227296 0.02523636  331  ILE   A CB   
4268  C  CG1  . ILE   A  276 ? 0.39510238 0.35311818 0.23841344 -0.07237823 -0.05672973 0.02915582  331  ILE   A CG1  
4269  C  CG2  . ILE   A  276 ? 0.38168749 0.34407845 0.23298703 -0.07190169 -0.04981951 0.02251038  331  ILE   A CG2  
4270  C  CD1  . ILE   A  276 ? 0.47671515 0.43620732 0.32579976 -0.07205839 -0.05314061 0.03188676  331  ILE   A CD1  
4271  H  H    . ILE   A  276 ? 0.36516351 0.31496558 0.18102501 -0.07579266 -0.05559110 0.02818702  331  ILE   A H    
4272  H  HA   . ILE   A  276 ? 0.34376246 0.29954451 0.17802452 -0.07360205 -0.06014191 0.02258548  331  ILE   A HA   
4273  H  HB   . ILE   A  276 ? 0.36236328 0.32005304 0.19773108 -0.07390442 -0.04844825 0.02599505  331  ILE   A HB   
4274  H  HG12 . ILE   A  276 ? 0.39916167 0.35920733 0.24881633 -0.07143422 -0.05977863 0.02826491  331  ILE   A HG12 
4275  H  HG13 . ILE   A  276 ? 0.40923268 0.36389601 0.24470177 -0.07300980 -0.05928656 0.03078157  331  ILE   A HG13 
4276  H  HG21 . ILE   A  276 ? 0.36868334 0.33173841 0.22375284 -0.07161680 -0.05315973 0.02151747  331  ILE   A HG21 
4277  H  HG22 . ILE   A  276 ? 0.37233913 0.33446926 0.22131047 -0.07200102 -0.04670402 0.02016613  331  ILE   A HG22 
4278  H  HG23 . ILE   A  276 ? 0.36481965 0.32926923 0.22187924 -0.07134011 -0.04810973 0.02409813  331  ILE   A HG23 
4279  H  HD11 . ILE   A  276 ? 0.43676808 0.39956117 0.29391196 -0.07123540 -0.05143095 0.03051540  331  ILE   A HD11 
4280  H  HD12 . ILE   A  276 ? 0.45028004 0.40865275 0.29412818 -0.07329812 -0.04965775 0.03249856  331  ILE   A HD12 
4281  H  HD13 . ILE   A  276 ? 0.44552872 0.40367904 0.29529884 -0.07150357 -0.05613898 0.03431789  331  ILE   A HD13 
4282  N  N    . ASP   A  277 ? 0.37890333 0.33254749 0.19889510 -0.07484621 -0.04649710 0.01748188  332  ASP   A N    
4283  C  CA   . ASP   A  277 ? 0.35820282 0.31165254 0.17619796 -0.07424349 -0.04224968 0.01270002  332  ASP   A CA   
4284  C  C    . ASP   A  277 ? 0.42145744 0.37048346 0.23124993 -0.07498837 -0.04628636 0.00919093  332  ASP   A C    
4285  O  O    . ASP   A  277 ? 0.35439256 0.30236071 0.16641854 -0.07423580 -0.04583763 0.00492810  332  ASP   A O    
4286  C  CB   . ASP   A  277 ? 0.35149521 0.30564344 0.16223110 -0.07478173 -0.03563606 0.01258156  332  ASP   A CB   
4287  C  CG   . ASP   A  277 ? 0.41065124 0.36585093 0.22225212 -0.07305681 -0.03059554 0.00743743  332  ASP   A CG   
4288  O  OD1  . ASP   A  277 ? 0.33350039 0.29226732 0.15634072 -0.07109880 -0.02819743 0.00661047  332  ASP   A OD1  
4289  O  OD2  . ASP   A  277 ? 0.38805497 0.34014413 0.18867323 -0.07342959 -0.02918683 0.00410242  332  ASP   A OD2  
4290  H  H    . ASP   A  277 ? 0.37638819 0.32940313 0.19221190 -0.07563527 -0.04537701 0.01999869  332  ASP   A H    
4291  H  HA   . ASP   A  277 ? 0.36086255 0.31658548 0.18755201 -0.07301589 -0.04105442 0.01161133  332  ASP   A HA   
4292  H  HB2  . ASP   A  277 ? 0.36098027 0.31774879 0.17612578 -0.07488137 -0.03364679 0.01520851  332  ASP   A HB2  
4293  H  HB3  . ASP   A  277 ? 0.37615895 0.32747746 0.17699286 -0.07619331 -0.03655883 0.01322755  332  ASP   A HB3  
4294  N  N    . LYS   A  278 ? 0.38609752 0.33186069 0.18561241 -0.07658494 -0.05050347 0.01108641  333  LYS   A N    
4295  C  CA   . LYS   A  278 ? 0.40634918 0.34793353 0.19736373 -0.07763942 -0.05527038 0.00803656  333  LYS   A CA   
4296  C  C    . LYS   A  278 ? 0.38645250 0.32957339 0.18807575 -0.07739816 -0.06053260 0.00653284  333  LYS   A C    
4297  O  O    . LYS   A  278 ? 0.40716904 0.34771112 0.20659694 -0.07803073 -0.06213285 0.00219626  333  LYS   A O    
4298  C  CB   . LYS   A  278 ? 0.42298150 0.36103994 0.20176290 -0.07923273 -0.05966301 0.01110139  333  LYS   A CB   
4299  C  CG   . LYS   A  278 ? 0.86632454 0.80122155 0.63019842 -0.08052819 -0.05476123 0.01108850  333  LYS   A CG   
4300  C  CD   . LYS   A  278 ? 1.01613271 0.94654065 0.76661277 -0.08239494 -0.05907399 0.01546379  333  LYS   A CD   
4301  C  CE   . LYS   A  278 ? 1.38145137 1.30883265 1.12779129 -0.08279764 -0.06832127 0.01507824  333  LYS   A CE   
4302  N  NZ   . LYS   A  278 ? 1.89272213 1.81774747 1.63319218 -0.08340902 -0.06922139 0.00902906  333  LYS   A NZ   
4303  H  H    . LYS   A  278 ? 0.39948243 0.34529501 0.19689283 -0.07709157 -0.05059071 0.01436783  333  LYS   A H    
4304  H  HA   . LYS   A  278 ? 0.40964893 0.34956801 0.19570734 -0.07755784 -0.05209072 0.00471881  333  LYS   A HA   
4305  H  HB2  . LYS   A  278 ? 0.48021561 0.41971701 0.26327109 -0.07894159 -0.06144639 0.01477888  333  LYS   A HB2  
4306  H  HB3  . LYS   A  278 ? 0.49582529 0.43206257 0.27187833 -0.07980795 -0.06442433 0.00956804  333  LYS   A HB3  
4307  H  HG2  . LYS   A  278 ? 0.72883791 0.66189778 0.48750108 -0.08066086 -0.05354224 0.00717372  333  LYS   A HG2  
4308  H  HG3  . LYS   A  278 ? 0.71776974 0.65520090 0.48522002 -0.08010601 -0.04962470 0.01200771  333  LYS   A HG3  
4309  H  HD2  . LYS   A  278 ? 1.06144130 0.98969114 0.80155414 -0.08356335 -0.05561251 0.01481175  333  LYS   A HD2  
4310  H  HD3  . LYS   A  278 ? 1.04734921 0.97890651 0.80187547 -0.08223035 -0.05913285 0.01933889  333  LYS   A HD3  
4311  H  HE2  . LYS   A  278 ? 1.38642943 1.31055927 1.12353182 -0.08377119 -0.07078504 0.01789079  333  LYS   A HE2  
4312  H  HE3  . LYS   A  278 ? 1.35647154 1.28657901 1.11314368 -0.08173764 -0.07171020 0.01609496  333  LYS   A HE3  
4313  H  HZ1  . LYS   A  278 ? 1.71550274 1.63853228 1.44746792 -0.08403756 -0.06522211 0.00752262  333  LYS   A HZ1  
4314  H  HZ2  . LYS   A  278 ? 1.67453265 1.60191321 1.42388141 -0.08254170 -0.06826603 0.00668507  333  LYS   A HZ2  
4315  H  HZ3  . LYS   A  278 ? 1.71433449 1.63737547 1.45061910 -0.08406858 -0.07481401 0.00908063  333  LYS   A HZ3  
4316  N  N    . THR   A  279 ? 0.40973306 0.35694414 0.22252716 -0.07669787 -0.06298732 0.00999126  334  THR   A N    
4317  C  CA   . THR   A  279 ? 0.38851169 0.33865732 0.21257688 -0.07674274 -0.06719762 0.00896973  334  THR   A CA   
4318  C  C    . THR   A  279 ? 0.37858576 0.32894537 0.20910770 -0.07630069 -0.06293816 0.00546691  334  THR   A C    
4319  O  O    . THR   A  279 ? 0.33257186 0.28220320 0.16636273 -0.07743099 -0.06575353 0.00260611  334  THR   A O    
4320  C  CB   . THR   A  279 ? 0.35345325 0.30827081 0.18768406 -0.07564499 -0.06964067 0.01324249  334  THR   A CB   
4321  O  OG1  . THR   A  279 ? 0.35533738 0.30829608 0.18186909 -0.07570294 -0.07389063 0.01638685  334  THR   A OG1  
4322  C  CG2  . THR   A  279 ? 0.38096786 0.34002987 0.22679739 -0.07593037 -0.07381900 0.01226149  334  THR   A CG2  
4323  H  H    . THR   A  279 ? 0.39540541 0.34361821 0.20867053 -0.07629582 -0.06189416 0.01303503  334  THR   A H    
4324  H  HA   . THR   A  279 ? 0.39154464 0.34006870 0.21146654 -0.07786842 -0.07147087 0.00758122  334  THR   A HA   
4325  H  HB   . THR   A  279 ? 0.35646701 0.31267375 0.19456309 -0.07470824 -0.06559309 0.01455287  334  THR   A HB   
4327  H  HG21 . THR   A  279 ? 0.36476985 0.32681650 0.21626002 -0.07494770 -0.07535623 0.01478718  334  THR   A HG21 
4328  H  HG22 . THR   A  279 ? 0.37602359 0.33409002 0.21849690 -0.07710067 -0.07783800 0.01073371  334  THR   A HG22 
4329  H  HG23 . THR   A  279 ? 0.36459827 0.32444575 0.21558367 -0.07600418 -0.07100506 0.01058209  334  THR   A HG23 
4330  N  N    . VAL   A  280 ? 0.33068416 0.28188047 0.16291508 -0.07477438 -0.05641998 0.00581249  335  VAL   A N    
4331  C  CA   . VAL   A  280 ? 0.34927607 0.30026519 0.18751532 -0.07370877 -0.05257812 0.00285759  335  VAL   A CA   
4332  C  C    . VAL   A  280 ? 0.31416348 0.25951454 0.14323029 -0.07410526 -0.05207254 -0.00218580 335  VAL   A C    
4333  O  O    . VAL   A  280 ? 0.32559761 0.26858038 0.15846056 -0.07409132 -0.05229064 -0.00523470 335  VAL   A O    
4334  C  CB   . VAL   A  280 ? 0.34580618 0.29975799 0.18859574 -0.07165106 -0.04609930 0.00423460  335  VAL   A CB   
4335  C  CG1  . VAL   A  280 ? 0.34458953 0.29708266 0.19127220 -0.07001074 -0.04257163 0.00064234  335  VAL   A CG1  
4336  C  CG2  . VAL   A  280 ? 0.32224411 0.28099263 0.17476463 -0.07128660 -0.04664675 0.00859318  335  VAL   A CG2  
4337  H  H    . VAL   A  280 ? 0.34631878 0.29821503 0.17608966 -0.07441586 -0.05454119 0.00801900  335  VAL   A H    
4338  H  HA   . VAL   A  280 ? 0.32963848 0.28205270 0.17516907 -0.07408837 -0.05477116 0.00301864  335  VAL   A HA   
4339  H  HB   . VAL   A  280 ? 0.34809452 0.30151308 0.18408613 -0.07162898 -0.04386292 0.00449558  335  VAL   A HB   
4340  H  HG11 . VAL   A  280 ? 0.34161985 0.29331833 0.19290894 -0.07056409 -0.04501476 -0.00001711 335  VAL   A HG11 
4341  H  HG12 . VAL   A  280 ? 0.35161808 0.30109566 0.19145435 -0.06972979 -0.04123330 -0.00218237 335  VAL   A HG12 
4342  H  HG13 . VAL   A  280 ? 0.33836514 0.29359344 0.18963687 -0.06868429 -0.03931601 0.00181571  335  VAL   A HG13 
4343  H  HG21 . VAL   A  280 ? 0.32199937 0.28254110 0.17682582 -0.07027146 -0.04284932 0.00934696  335  VAL   A HG21 
4344  H  HG22 . VAL   A  280 ? 0.32806894 0.28702900 0.17775063 -0.07198888 -0.04900790 0.01079115  335  VAL   A HG22 
4345  H  HG23 . VAL   A  280 ? 0.32066181 0.28037643 0.17981738 -0.07138200 -0.04848479 0.00836289  335  VAL   A HG23 
4346  N  N    . GLY   A  281 ? 0.35719326 0.29991302 0.17375824 -0.07443330 -0.05093757 -0.00304262 336  GLY   A N    
4347  C  CA   . GLY   A  281 ? 0.35950336 0.29644138 0.16548765 -0.07473485 -0.05048541 -0.00816900 336  GLY   A CA   
4348  C  C    . GLY   A  281 ? 0.38549525 0.31874153 0.18935968 -0.07708052 -0.05731543 -0.01051991 336  GLY   A C    
4349  O  O    . GLY   A  281 ? 0.41868889 0.34668398 0.21856828 -0.07739267 -0.05755268 -0.01530252 336  GLY   A O    
4350  H  H    . GLY   A  281 ? 0.34687936 0.29116210 0.16098543 -0.07454631 -0.05032076 -0.00037058 336  GLY   A H    
4351  H  HA2  . GLY   A  281 ? 0.36480987 0.30095106 0.17329162 -0.07318076 -0.04695078 -0.01051245 336  GLY   A HA2  
4352  H  HA3  . GLY   A  281 ? 0.37349358 0.30953825 0.17066725 -0.07495124 -0.04901912 -0.00801128 336  GLY   A HA3  
4353  N  N    . GLN   A  282 ? 0.37313348 0.30909941 0.17943409 -0.07873356 -0.06311929 -0.00727045 337  GLN   A N    
4354  C  CA   . GLN   A  282 ? 0.42133528 0.35566521 0.22733068 -0.08124413 -0.07005455 -0.00915614 337  GLN   A CA   
4355  C  C    . GLN   A  282 ? 0.40476024 0.33996949 0.22283387 -0.08188049 -0.07042022 -0.01068429 337  GLN   A C    
4356  O  O    . GLN   A  282 ? 0.34406409 0.27504152 0.16021518 -0.08397821 -0.07330389 -0.01456297 337  GLN   A O    
4357  C  CB   . GLN   A  282 ? 0.41271466 0.35102031 0.21981528 -0.08216207 -0.07615606 -0.00507154 337  GLN   A CB   
4358  C  CG   . GLN   A  282 ? 0.48277551 0.41774434 0.27468050 -0.08246570 -0.07754576 -0.00409868 337  GLN   A CG   
4359  C  CD   . GLN   A  282 ? 0.51806402 0.45608848 0.31096137 -0.08273970 -0.08404794 0.00019087  337  GLN   A CD   
4360  O  OE1  . GLN   A  282 ? 0.49161375 0.43511397 0.29723814 -0.08247263 -0.08750807 0.00211023  337  GLN   A OE1  
4361  N  NE2  . GLN   A  282 ? 0.61789656 0.55233014 0.39711863 -0.08313186 -0.08586132 0.00170146  337  GLN   A NE2  
4362  H  H    . GLN   A  282 ? 0.38028592 0.31932020 0.18865964 -0.07825578 -0.06287395 -0.00385640 337  GLN   A H    
4363  H  HA   . GLN   A  282 ? 0.41954803 0.34932303 0.21625680 -0.08198582 -0.07059264 -0.01225100 337  GLN   A HA   
4364  H  HB2  . GLN   A  282 ? 0.41658378 0.35887888 0.23113863 -0.08099510 -0.07484916 -0.00195776 337  GLN   A HB2  
4365  H  HB3  . GLN   A  282 ? 0.42679626 0.36585328 0.23723745 -0.08373910 -0.08070233 -0.00613677 337  GLN   A HB3  
4366  H  HG2  . GLN   A  282 ? 0.48424730 0.41518706 0.26831251 -0.08365913 -0.07898779 -0.00738006 337  GLN   A HG2  
4367  H  HG3  . GLN   A  282 ? 0.47505713 0.40953428 0.26363477 -0.08129388 -0.07269526 -0.00312239 337  GLN   A HG3  
4368  H  HE21 . GLN   A  282 ? 0.59585655 0.52698100 0.36645049 -0.08328789 -0.08257940 0.00047878  337  GLN   A HE21 
4369  H  HE22 . GLN   A  282 ? 0.58985341 0.52516180 0.36837938 -0.08320067 -0.09037839 0.00398337  337  GLN   A HE22 
4370  N  N    . LEU   A  283 ? 0.33910990 0.27917582 0.16888225 -0.08036519 -0.06741206 -0.00766428 338  LEU   A N    
4371  C  CA   . LEU   A  283 ? 0.32925916 0.26956910 0.16935301 -0.08106811 -0.06703952 -0.00874291 338  LEU   A CA   
4372  C  C    . LEU   A  283 ? 0.33460063 0.26762813 0.17008407 -0.08034603 -0.06360576 -0.01326948 338  LEU   A C    
4373  O  O    . LEU   A  283 ? 0.35394576 0.28270027 0.19043252 -0.08253773 -0.06603628 -0.01618459 338  LEU   A O    
4374  C  CB   . LEU   A  283 ? 0.32365397 0.26983696 0.17550820 -0.07934913 -0.06396199 -0.00485729 338  LEU   A CB   
4375  C  CG   . LEU   A  283 ? 0.34488046 0.29055440 0.20606828 -0.08018808 -0.06305878 -0.00571374 338  LEU   A CG   
4376  C  CD1  . LEU   A  283 ? 0.38088015 0.32873714 0.24737123 -0.08380032 -0.06856373 -0.00603630 338  LEU   A CD1  
4377  C  CD2  . LEU   A  283 ? 0.40500262 0.35524905 0.27512977 -0.07813612 -0.05933671 -0.00241404 338  LEU   A CD2  
4378  H  H    . LEU   A  283 ? 0.34532592 0.28822610 0.17622602 -0.07908531 -0.06568068 -0.00487916 338  LEU   A H    
4379  H  HA   . LEU   A  283 ? 0.33320534 0.27431422 0.17557667 -0.08331502 -0.07138465 -0.00921094 338  LEU   A HA   
4380  H  HB2  . LEU   A  283 ? 0.32348245 0.27390730 0.17871381 -0.07971498 -0.06645654 -0.00232861 338  LEU   A HB2  
4381  H  HB3  . LEU   A  283 ? 0.32634592 0.27243441 0.17614090 -0.07732488 -0.06005893 -0.00417984 338  LEU   A HB3  
4382  H  HG   . LEU   A  283 ? 0.36243731 0.30291426 0.21970403 -0.07984314 -0.06135431 -0.00847258 338  LEU   A HG   
4383  H  HD11 . LEU   A  283 ? 0.36654788 0.31343606 0.23797444 -0.08477396 -0.06776940 -0.00656440 338  LEU   A HD11 
4384  H  HD12 . LEU   A  283 ? 0.36379465 0.31711936 0.23485884 -0.08374171 -0.07021395 -0.00350814 338  LEU   A HD12 
4385  H  HD13 . LEU   A  283 ? 0.37680280 0.32163703 0.23723756 -0.08530334 -0.07133822 -0.00829959 338  LEU   A HD13 
4386  H  HD21 . LEU   A  283 ? 0.38000587 0.32928777 0.24720813 -0.07602011 -0.05585386 -0.00238146 338  LEU   A HD21 
4387  H  HD22 . LEU   A  283 ? 0.37505329 0.32999438 0.24887626 -0.07824628 -0.06087791 0.00010959  338  LEU   A HD22 
4388  H  HD23 . LEU   A  283 ? 0.37709382 0.32655716 0.25221476 -0.07882410 -0.05888404 -0.00283799 338  LEU   A HD23 
4389  N  N    . MET   A  284 ? 0.33632302 0.26787645 0.16680154 -0.07727492 -0.05797841 -0.01398076 339  MET   A N    
4390  C  CA   . MET   A  284 ? 0.36118418 0.28655124 0.18895750 -0.07538721 -0.05422994 -0.01819620 339  MET   A CA   
4391  C  C    . MET   A  284 ? 0.40848953 0.32603964 0.22441508 -0.07690159 -0.05676779 -0.02339249 339  MET   A C    
4392  O  O    . MET   A  284 ? 0.37709534 0.28786692 0.19260915 -0.07747233 -0.05759901 -0.02709719 339  MET   A O    
4393  C  CB   . MET   A  284 ? 0.35667419 0.28432766 0.18348546 -0.07154506 -0.04757643 -0.01775661 339  MET   A CB   
4394  C  CG   . MET   A  284 ? 0.30998015 0.24489084 0.14833696 -0.07018737 -0.04517429 -0.01290817 339  MET   A CG   
4395  S  SD   . MET   A  284 ? 0.33545518 0.27045184 0.18650141 -0.07110021 -0.04719046 -0.01151339 339  MET   A SD   
4396  C  CE   . MET   A  284 ? 0.29644039 0.22349420 0.14491424 -0.06858711 -0.04434346 -0.01628056 339  MET   A CE   
4397  H  H    . MET   A  284 ? 0.33858958 0.27309421 0.16749457 -0.07630209 -0.05647808 -0.01185879 339  MET   A H    
4398  H  HA   . MET   A  284 ? 0.35729969 0.28196299 0.19183394 -0.07574886 -0.05463604 -0.01806952 339  MET   A HA   
4399  H  HB2  . MET   A  284 ? 0.35438648 0.28270009 0.17416200 -0.07157100 -0.04691894 -0.01775885 339  MET   A HB2  
4400  H  HB3  . MET   A  284 ? 0.35370436 0.27735692 0.17896003 -0.06987986 -0.04535592 -0.02083638 339  MET   A HB3  
4401  H  HG2  . MET   A  284 ? 0.32015663 0.25878558 0.15865546 -0.07119907 -0.04654032 -0.01005668 339  MET   A HG2  
4402  H  HG3  . MET   A  284 ? 0.32223302 0.25819731 0.16051969 -0.06781589 -0.04098441 -0.01331373 339  MET   A HG3  
4403  H  HE1  . MET   A  284 ? 0.30682749 0.23526695 0.15440232 -0.06587499 -0.04062690 -0.01667155 339  MET   A HE1  
4404  H  HE2  . MET   A  284 ? 0.31644687 0.23860398 0.15847199 -0.06958947 -0.04600612 -0.01929871 339  MET   A HE2  
4405  H  HE3  . MET   A  284 ? 0.30325308 0.22919832 0.15750423 -0.06884862 -0.04489292 -0.01560181 339  MET   A HE3  
4406  N  N    . ASP   A  285 ? 0.37146890 0.28918803 0.17700163 -0.07774334 -0.05826187 -0.02362114 340  ASP   A N    
4407  C  CA   . ASP   A  285 ? 0.42959934 0.34013528 0.22304404 -0.07963607 -0.06149748 -0.02842858 340  ASP   A CA   
4408  C  C    . ASP   A  285 ? 0.44755703 0.35588384 0.24541628 -0.08357661 -0.06811345 -0.02948659 340  ASP   A C    
4409  O  O    . ASP   A  285 ? 0.46127611 0.36170167 0.25338465 -0.08502835 -0.06992105 -0.03437064 340  ASP   A O    
4410  C  CB   . ASP   A  285 ? 0.41218442 0.32406175 0.19425972 -0.08059658 -0.06331817 -0.02728067 340  ASP   A CB   
4411  C  CG   . ASP   A  285 ? 0.47288430 0.38492647 0.24627683 -0.07780246 -0.05670385 -0.02781396 340  ASP   A CG   
4412  O  OD1  . ASP   A  285 ? 0.49869063 0.41053340 0.27552342 -0.07465750 -0.05060009 -0.02955886 340  ASP   A OD1  
4413  O  OD2  . ASP   A  285 ? 0.49804103 0.41078815 0.26156816 -0.07878968 -0.05761667 -0.02631231 340  ASP   A OD2  
4414  H  H    . ASP   A  285 ? 0.38647956 0.30842614 0.19195795 -0.07722474 -0.05734124 -0.02072439 340  ASP   A H    
4415  H  HA   . ASP   A  285 ? 0.42459732 0.33053666 0.21390423 -0.07786791 -0.05832324 -0.03190034 340  ASP   A HA   
4416  H  HB2  . ASP   A  285 ? 0.42326945 0.34008014 0.21008284 -0.08142577 -0.06564917 -0.02337580 340  ASP   A HB2  
4417  H  HB3  . ASP   A  285 ? 0.43950856 0.34716201 0.21469799 -0.08249986 -0.06690868 -0.03004038 340  ASP   A HB3  
4418  N  N    . GLY   A  286 ? 0.43021765 0.34580520 0.23847428 -0.08536337 -0.07157729 -0.02500285 341  GLY   A N    
4419  C  CA   . GLY   A  286 ? 0.40061733 0.31659344 0.21463464 -0.08952618 -0.07774328 -0.02554923 341  GLY   A CA   
4420  C  C    . GLY   A  286 ? 0.40563709 0.31636566 0.22532293 -0.09036972 -0.07617748 -0.02786672 341  GLY   A C    
4421  O  O    . GLY   A  286 ? 0.33303860 0.23746249 0.14966255 -0.09369393 -0.07973076 -0.03161779 341  GLY   A O    
4422  H  H    . GLY   A  286 ? 0.41622770 0.33683938 0.22811759 -0.08400736 -0.07001069 -0.02165569 341  GLY   A H    
4423  H  HA2  . GLY   A  286 ? 0.41827181 0.33137187 0.22491440 -0.09139667 -0.08136898 -0.02783852 341  GLY   A HA2  
4424  H  HA3  . GLY   A  286 ? 0.40002829 0.32253420 0.22145441 -0.09004558 -0.07946951 -0.02211000 341  GLY   A HA3  
4425  N  N    . LEU   A  287 ? 0.34494025 0.25774872 0.17237347 -0.08744501 -0.07100587 -0.02549556 342  LEU   A N    
4426  C  CA   . LEU   A  287 ? 0.35430300 0.26151735 0.18663445 -0.08768144 -0.06924882 -0.02696132 342  LEU   A CA   
4427  C  C    . LEU   A  287 ? 0.38965234 0.28536069 0.21129470 -0.08653743 -0.06800827 -0.03273242 342  LEU   A C    
4428  O  O    . LEU   A  287 ? 0.39923304 0.28737861 0.22027770 -0.08935281 -0.07047457 -0.03554226 342  LEU   A O    
4429  C  CB   . LEU   A  287 ? 0.35849956 0.27002126 0.19942725 -0.08403968 -0.06395296 -0.02336207 342  LEU   A CB   
4430  C  CG   . LEU   A  287 ? 0.36593759 0.28742397 0.21823503 -0.08514529 -0.06487750 -0.01814463 342  LEU   A CG   
4431  C  CD1  . LEU   A  287 ? 0.33596978 0.26089895 0.19463503 -0.08123905 -0.05948386 -0.01509801 342  LEU   A CD1  
4432  C  CD2  . LEU   A  287 ? 0.32781500 0.24982578 0.18757969 -0.08983427 -0.06866430 -0.01773177 342  LEU   A CD2  
4433  H  H    . LEU   A  287 ? 0.35187012 0.26936924 0.18130374 -0.08535724 -0.06874171 -0.02282268 342  LEU   A H    
4434  H  HA   . LEU   A  287 ? 0.35809481 0.26607066 0.19512472 -0.09109534 -0.07256551 -0.02656114 342  LEU   A HA   
4435  H  HB2  . LEU   A  287 ? 0.35937402 0.27160060 0.19641772 -0.08100715 -0.06086855 -0.02348720 342  LEU   A HB2  
4436  H  HB3  . LEU   A  287 ? 0.36059439 0.26715708 0.20306213 -0.08371834 -0.06272153 -0.02458192 342  LEU   A HB3  
4437  H  HG   . LEU   A  287 ? 0.34988785 0.27570349 0.20053059 -0.08533417 -0.06652820 -0.01693362 342  LEU   A HG   
4438  H  HD11 . LEU   A  287 ? 0.33293965 0.26427892 0.19748655 -0.08157986 -0.05993271 -0.01195491 342  LEU   A HD11 
4439  H  HD12 . LEU   A  287 ? 0.34117472 0.26246929 0.20253086 -0.08122430 -0.05844688 -0.01565243 342  LEU   A HD12 
4440  H  HD13 . LEU   A  287 ? 0.34317738 0.26744837 0.19715121 -0.07851020 -0.05677945 -0.01582653 342  LEU   A HD13 
4441  H  HD21 . LEU   A  287 ? 0.34317943 0.26495773 0.20015568 -0.09246500 -0.07247101 -0.01918837 342  LEU   A HD21 
4442  H  HD22 . LEU   A  287 ? 0.34087723 0.25705540 0.20057505 -0.09016975 -0.06757833 -0.01918352 342  LEU   A HD22 
4443  H  HD23 . LEU   A  287 ? 0.32839066 0.25681573 0.19573948 -0.08997373 -0.06839897 -0.01459252 342  LEU   A HD23 
4444  N  N    . LYS   A  288 ? 0.40606347 0.30038154 0.21894330 -0.08258579 -0.06415702 -0.03464842 343  LYS   A N    
4445  C  CA   . LYS   A  288 ? 0.46175277 0.34564739 0.26383090 -0.08079293 -0.06257831 -0.04070086 343  LYS   A CA   
4446  C  C    . LYS   A  288 ? 0.48572218 0.36264363 0.27912259 -0.08527380 -0.06846784 -0.04484159 343  LYS   A C    
4447  O  O    . LYS   A  288 ? 0.44605964 0.31241134 0.23520289 -0.08607306 -0.06949455 -0.04942382 343  LYS   A O    
4448  C  CB   . LYS   A  288 ? 0.47809044 0.36395264 0.27195656 -0.07628693 -0.05724835 -0.04198289 343  LYS   A CB   
4449  C  CG   . LYS   A  288 ? 0.51490021 0.39082327 0.29850560 -0.07343599 -0.05461389 -0.04862512 343  LYS   A CG   
4450  C  CD   . LYS   A  288 ? 0.51247954 0.39140636 0.28902346 -0.06916407 -0.04863213 -0.05013698 343  LYS   A CD   
4451  C  CE   . LYS   A  288 ? 0.53879786 0.40735370 0.30377686 -0.06672993 -0.04684640 -0.05769482 343  LYS   A CE   
4452  N  NZ   . LYS   A  288 ? 0.55069959 0.42299432 0.30796224 -0.06281412 -0.04043870 -0.05975270 343  LYS   A NZ   
4453  H  H    . LYS   A  288 ? 0.40562207 0.30561686 0.21925500 -0.08100614 -0.06233881 -0.03221596 343  LYS   A H    
4454  H  HA   . LYS   A  288 ? 0.45606560 0.33580476 0.26156643 -0.07947837 -0.06093990 -0.04153621 343  LYS   A HA   
4455  H  HB2  . LYS   A  288 ? 0.47067600 0.36155272 0.27061552 -0.07382438 -0.05377180 -0.03926096 343  LYS   A HB2  
4456  H  HB3  . LYS   A  288 ? 0.48168892 0.37069440 0.27100632 -0.07776820 -0.05899592 -0.04106749 343  LYS   A HB3  
4457  H  HG2  . LYS   A  288 ? 0.51822829 0.38888305 0.29512304 -0.07604637 -0.05818785 -0.05146977 343  LYS   A HG2  
4458  H  HG3  . LYS   A  288 ? 0.50745070 0.37948111 0.29547742 -0.07189617 -0.05344465 -0.04949552 343  LYS   A HG3  
4459  H  HD2  . LYS   A  288 ? 0.50723290 0.39060742 0.29047465 -0.06636836 -0.04490862 -0.04805261 343  LYS   A HD2  
4460  H  HD3  . LYS   A  288 ? 0.51587373 0.39897692 0.28838032 -0.07075522 -0.04956779 -0.04843426 343  LYS   A HD3  
4461  H  HE2  . LYS   A  288 ? 0.54715317 0.41077659 0.30545899 -0.06974270 -0.05084832 -0.05989993 343  LYS   A HE2  
4462  H  HE3  . LYS   A  288 ? 0.53873050 0.40269265 0.30764925 -0.06474989 -0.04594404 -0.05928521 343  LYS   A HE3  
4463  H  HZ1  . LYS   A  288 ? 0.55005741 0.42543608 0.30229089 -0.06485022 -0.04141305 -0.05839539 343  LYS   A HZ1  
4464  H  HZ2  . LYS   A  288 ? 0.54041815 0.41799361 0.30426869 -0.06030464 -0.03687499 -0.05762335 343  LYS   A HZ2  
4465  H  HZ3  . LYS   A  288 ? 0.55927861 0.42552119 0.31014666 -0.06096106 -0.03909386 -0.06454088 343  LYS   A HZ3  
4466  N  N    . GLN   A  289 ? 0.41718614 0.29979575 0.20792031 -0.08817296 -0.07270408 -0.04313439 344  GLN   A N    
4467  C  CA   . GLN   A  289 ? 0.44306827 0.32117054 0.22722518 -0.09303794 -0.07939438 -0.04634029 344  GLN   A CA   
4468  C  C    . GLN   A  289 ? 0.40585953 0.28084749 0.19822845 -0.09770317 -0.08340638 -0.04676805 344  GLN   A C    
4469  O  O    . GLN   A  289 ? 0.44223541 0.30835527 0.22811982 -0.10109186 -0.08716381 -0.05143313 344  GLN   A O    
4470  C  CB   . GLN   A  289 ? 0.43890071 0.32553628 0.22163811 -0.09493300 -0.08374614 -0.04314257 344  GLN   A CB   
4471  C  CG   . GLN   A  289 ? 0.52123153 0.40520763 0.29922321 -0.10043890 -0.09192587 -0.04594817 344  GLN   A CG   
4472  C  CD   . GLN   A  289 ? 0.54359412 0.43330938 0.31506303 -0.10076620 -0.09572446 -0.04388387 344  GLN   A CD   
4473  O  OE1  . GLN   A  289 ? 0.57096487 0.45605665 0.32803184 -0.09936491 -0.09483331 -0.04646246 344  GLN   A OE1  
4474  N  NE2  . GLN   A  289 ? 0.56684327 0.46661341 0.34863824 -0.10231726 -0.09979105 -0.03910164 344  GLN   A NE2  
4475  H  H    . GLN   A  289 ? 0.42761344 0.31691349 0.22057199 -0.08706380 -0.07161527 -0.03989606 344  GLN   A H    
4476  H  HA   . GLN   A  289 ? 0.44420439 0.31531227 0.21849842 -0.09209981 -0.07860359 -0.05057149 344  GLN   A HA   
4477  H  HB2  . GLN   A  289 ? 0.45648366 0.34331906 0.23181230 -0.09256030 -0.08138578 -0.04334509 344  GLN   A HB2  
4478  H  HB3  . GLN   A  289 ? 0.44035125 0.33417648 0.23257849 -0.09490433 -0.08371346 -0.03898145 344  GLN   A HB3  
4479  H  HG2  . GLN   A  289 ? 0.50076789 0.38757306 0.28781474 -0.10322907 -0.09460104 -0.04457974 344  GLN   A HG2  
4480  H  HG3  . GLN   A  289 ? 0.51767236 0.39331990 0.28765118 -0.10096782 -0.09210213 -0.05045195 344  GLN   A HG3  
4481  H  HE21 . GLN   A  289 ? 0.54693604 0.44993991 0.33866525 -0.10357208 -0.10032848 -0.03769708 344  GLN   A HE21 
4482  H  HE22 . GLN   A  289 ? 0.55514884 0.45824051 0.33370322 -0.10198815 -0.10192082 -0.03738058 344  GLN   A HE22 
4483  N  N    . LEU   A  290 ? 0.36911756 0.25103232 0.17522725 -0.09811766 -0.08237009 -0.04200178 345  LEU   A N    
4484  C  CA   . LEU   A  290 ? 0.39198616 0.27179804 0.20664911 -0.10266277 -0.08497437 -0.04165317 345  LEU   A CA   
4485  C  C    . LEU   A  290 ? 0.46987268 0.33927488 0.28432578 -0.10061952 -0.08099010 -0.04355117 345  LEU   A C    
4486  O  O    . LEU   A  290 ? 0.38110006 0.24628121 0.20087978 -0.10445324 -0.08263049 -0.04336752 345  LEU   A O    
4487  C  CB   . LEU   A  290 ? 0.36160633 0.25397593 0.19063911 -0.10396929 -0.08537439 -0.03570234 345  LEU   A CB   
4488  C  CG   . LEU   A  290 ? 0.38611668 0.28883672 0.21750066 -0.10618307 -0.09040727 -0.03365912 345  LEU   A CG   
4489  C  CD1  . LEU   A  290 ? 0.36905479 0.28394204 0.21487021 -0.10649741 -0.09013030 -0.02823810 345  LEU   A CD1  
4490  C  CD2  . LEU   A  290 ? 0.40440783 0.30419439 0.23250940 -0.11218353 -0.09735495 -0.03720682 345  LEU   A CD2  
4491  H  H    . LEU   A  290 ? 0.37106213 0.25927028 0.18113521 -0.09569006 -0.07988230 -0.03879902 345  LEU   A H    
4492  H  HA   . LEU   A  290 ? 0.40350473 0.28037983 0.21462822 -0.10644820 -0.08934216 -0.04412146 345  LEU   A HA   
4493  H  HB2  . LEU   A  290 ? 0.36269686 0.25792181 0.19449721 -0.10026263 -0.08128579 -0.03336622 345  LEU   A HB2  
4494  H  HB3  . LEU   A  290 ? 0.36986127 0.26077279 0.20444694 -0.10694274 -0.08626951 -0.03539937 345  LEU   A HB3  
4495  H  HG   . LEU   A  290 ? 0.38251612 0.28597549 0.20757765 -0.10338008 -0.08953146 -0.03368942 345  LEU   A HG   
4496  H  HD11 . LEU   A  290 ? 0.36725682 0.28840226 0.21370095 -0.10648761 -0.09281159 -0.02688704 345  LEU   A HD11 
4497  H  HD12 . LEU   A  290 ? 0.36842334 0.28383896 0.22030970 -0.11003289 -0.09166902 -0.02821859 345  LEU   A HD12 
4498  H  HD13 . LEU   A  290 ? 0.36224627 0.27805117 0.21044196 -0.10318018 -0.08576778 -0.02622422 345  LEU   A HD13 
4499  H  HD21 . LEU   A  290 ? 0.41303682 0.30607429 0.23081388 -0.11165849 -0.09799649 -0.04060659 345  LEU   A HD21 
4500  H  HD22 . LEU   A  290 ? 0.40335780 0.30024481 0.23575553 -0.11519969 -0.09778787 -0.03785536 345  LEU   A HD22 
4501  H  HD23 . LEU   A  290 ? 0.39885855 0.30639669 0.23080102 -0.11360399 -0.10081806 -0.03548073 345  LEU   A HD23 
4502  N  N    . ARG   A  291 ? 0.43529016 0.30053991 0.24346268 -0.09458344 -0.07581539 -0.04537382 346  ARG   A N    
4503  C  CA   . ARG   A  291 ? 0.45757371 0.31322822 0.26562846 -0.09141544 -0.07218765 -0.04719942 346  ARG   A CA   
4504  C  C    . ARG   A  291 ? 0.40101612 0.26119620 0.22188470 -0.09163421 -0.07048550 -0.04198468 346  ARG   A C    
4505  O  O    . ARG   A  291 ? 0.40978634 0.26099700 0.23204628 -0.09201868 -0.07013194 -0.04269271 346  ARG   A O    
4506  C  CB   . ARG   A  291 ? 0.50908840 0.34999567 0.30916065 -0.09439011 -0.07542905 -0.05279892 346  ARG   A CB   
4507  C  CG   . ARG   A  291 ? 0.62032306 0.45406112 0.40577906 -0.09213877 -0.07536808 -0.05907417 346  ARG   A CG   
4508  C  CD   . ARG   A  291 ? 0.67972374 0.51994008 0.46027777 -0.09573369 -0.07960233 -0.05926797 346  ARG   A CD   
4509  N  NE   . ARG   A  291 ? 0.70256710 0.53416246 0.46786016 -0.09485477 -0.08039261 -0.06569473 346  ARG   A NE   
4510  C  CZ   . ARG   A  291 ? 0.68874824 0.52313107 0.44533432 -0.09075408 -0.07710069 -0.06717194 346  ARG   A CZ   
4511  N  NH1  . ARG   A  291 ? 0.64294058 0.48859888 0.40447885 -0.08738194 -0.07301785 -0.06250705 346  ARG   A NH1  
4512  N  NH2  . ARG   A  291 ? 0.83972120 0.66479182 0.58174402 -0.09018478 -0.07766622 -0.07366186 346  ARG   A NH2  
4513  H  H    . ARG   A  291 ? 0.44691196 0.31556898 0.25096250 -0.09233277 -0.07453376 -0.04541855 346  ARG   A H    
4514  H  HA   . ARG   A  291 ? 0.45155278 0.30707246 0.25585097 -0.08678206 -0.06849156 -0.04830173 346  ARG   A HA   
4515  H  HB2  . ARG   A  291 ? 0.51875019 0.36042073 0.32127336 -0.09960300 -0.07950722 -0.05220876 346  ARG   A HB2  
4516  H  HB3  . ARG   A  291 ? 0.51886195 0.35359395 0.32066008 -0.09275210 -0.07361217 -0.05305258 346  ARG   A HB3  
4517  H  HG2  . ARG   A  291 ? 0.61806655 0.44125071 0.39863658 -0.09326828 -0.07685520 -0.06280120 346  ARG   A HG2  
4518  H  HG3  . ARG   A  291 ? 0.60390496 0.43883848 0.38750193 -0.08705351 -0.07103074 -0.05948583 346  ARG   A HG3  
4519  H  HD2  . ARG   A  291 ? 0.64835399 0.49774498 0.43210858 -0.09391428 -0.07782515 -0.05596505 346  ARG   A HD2  
4520  H  HD3  . ARG   A  291 ? 0.66336632 0.50480604 0.44792277 -0.10066983 -0.08384369 -0.05820694 346  ARG   A HD3  
4521  H  HE   . ARG   A  291 ? 0.70871687 0.53261477 0.46992531 -0.09745065 -0.08321498 -0.06887279 346  ARG   A HE   
4522  H  HH11 . ARG   A  291 ? 0.64433670 0.49254155 0.41272908 -0.08493100 -0.06984234 -0.06024270 346  ARG   A HH11 
4523  H  HH12 . ARG   A  291 ? 0.65266430 0.50292188 0.41033250 -0.08769893 -0.07361296 -0.06166362 346  ARG   A HH12 
4524  H  HH21 . ARG   A  291 ? 0.79599404 0.62299943 0.53175193 -0.08776235 -0.07531863 -0.07466774 346  ARG   A HH21 
4525  H  HH22 . ARG   A  291 ? 0.80219674 0.61902857 0.54061228 -0.09234973 -0.08032657 -0.07699091 346  ARG   A HH22 
4526  N  N    . LEU   A  292 ? 0.35617772 0.22944927 0.18522245 -0.09103489 -0.06932428 -0.03688368 347  LEU   A N    
4527  C  CA   . LEU   A  292 ? 0.34798479 0.22714378 0.18852152 -0.09056920 -0.06711727 -0.03183320 347  LEU   A CA   
4528  C  C    . LEU   A  292 ? 0.37245369 0.25723550 0.21542147 -0.08427179 -0.06166065 -0.02950642 347  LEU   A C    
4529  O  O    . LEU   A  292 ? 0.37613428 0.26691970 0.22813511 -0.08344553 -0.05972281 -0.02519481 347  LEU   A O    
4530  C  CB   . LEU   A  292 ? 0.36181480 0.25171548 0.21056828 -0.09506450 -0.07034121 -0.02810079 347  LEU   A CB   
4531  C  CG   . LEU   A  292 ? 0.36207563 0.24949592 0.21232128 -0.10206778 -0.07558729 -0.02937935 347  LEU   A CG   
4532  C  CD1  . LEU   A  292 ? 0.34972441 0.25069791 0.20892173 -0.10529005 -0.07855877 -0.02587245 347  LEU   A CD1  
4533  C  CD2  . LEU   A  292 ? 0.37613779 0.25605595 0.23040618 -0.10474431 -0.07493290 -0.02876744 347  LEU   A CD2  
4534  H  H    . LEU   A  292 ? 0.36403841 0.24239941 0.19081409 -0.09084800 -0.07000227 -0.03661769 347  LEU   A H    
4535  H  HA   . LEU   A  292 ? 0.36071858 0.23313701 0.20219943 -0.09156948 -0.06719615 -0.03240465 347  LEU   A HA   
4536  H  HB2  . LEU   A  292 ? 0.35263079 0.24780160 0.19933969 -0.09412826 -0.07088505 -0.02780615 347  LEU   A HB2  
4537  H  HB3  . LEU   A  292 ? 0.34557778 0.24015185 0.20145799 -0.09423437 -0.06838948 -0.02478058 347  LEU   A HB3  
4538  H  HG   . LEU   A  292 ? 0.37506759 0.25701287 0.21777096 -0.10305388 -0.07776865 -0.03294801 347  LEU   A HG   
4539  H  HD11 . LEU   A  292 ? 0.35527202 0.25561959 0.21505558 -0.10980540 -0.08223121 -0.02716693 347  LEU   A HD11 
4540  H  HD12 . LEU   A  292 ? 0.34115064 0.24681209 0.20779341 -0.10494536 -0.07661173 -0.02271709 347  LEU   A HD12 
4541  H  HD13 . LEU   A  292 ? 0.34834835 0.25377667 0.20510207 -0.10313052 -0.07878131 -0.02558869 347  LEU   A HD13 
4542  H  HD21 . LEU   A  292 ? 0.38084662 0.25136375 0.22919992 -0.10267860 -0.07371109 -0.03127825 347  LEU   A HD21 
4543  H  HD22 . LEU   A  292 ? 0.36314851 0.24790998 0.22390924 -0.10349371 -0.07257435 -0.02538788 347  LEU   A HD22 
4544  H  HD23 . LEU   A  292 ? 0.37621254 0.25577748 0.23223001 -0.10982233 -0.07816773 -0.02925362 347  LEU   A HD23 
4545  N  N    . HIS   A  293 ? 0.40191209 0.28466758 0.23658207 -0.08004767 -0.05905323 -0.03261831 348  HIS   A N    
4546  C  CA   . HIS   A  293 ? 0.40452629 0.29375571 0.24118851 -0.07468304 -0.05389349 -0.03075303 348  HIS   A CA   
4547  C  C    . HIS   A  293 ? 0.36821532 0.25352937 0.20897466 -0.07032611 -0.05022130 -0.03068869 348  HIS   A C    
4548  O  O    . HIS   A  293 ? 0.38266146 0.27419865 0.22718599 -0.06623238 -0.04618730 -0.02876880 348  HIS   A O    
4549  C  CB   . HIS   A  293 ? 0.39445132 0.28364414 0.22059241 -0.07230273 -0.05210022 -0.03415154 348  HIS   A CB   
4550  C  CG   . HIS   A  293 ? 0.46958175 0.34719130 0.28590912 -0.07062989 -0.05174721 -0.04051243 348  HIS   A CG   
4551  N  ND1  . HIS   A  293 ? 0.48647642 0.36250639 0.29797411 -0.06504004 -0.04669684 -0.04374231 348  HIS   A ND1  
4552  C  CD2  . HIS   A  293 ? 0.39764041 0.26499498 0.20861387 -0.07385351 -0.05579321 -0.04427227 348  HIS   A CD2  
4553  C  CE1  . HIS   A  293 ? 0.46229491 0.32670081 0.26548421 -0.06453282 -0.04780117 -0.04952070 348  HIS   A CE1  
4554  N  NE2  . HIS   A  293 ? 0.44724941 0.30557603 0.24971247 -0.06989510 -0.05333818 -0.04991060 348  HIS   A NE2  
4555  H  H    . HIS   A  293 ? 0.40647620 0.28397644 0.23401412 -0.08078427 -0.06050040 -0.03606531 348  HIS   A H    
4556  H  HA   . HIS   A  293 ? 0.38211370 0.27915189 0.22440034 -0.07565498 -0.05410627 -0.02704485 348  HIS   A HA   
4557  H  HB2  . HIS   A  293 ? 0.40528432 0.29941371 0.23317924 -0.06919420 -0.04851475 -0.03276272 348  HIS   A HB2  
4558  H  HB3  . HIS   A  293 ? 0.41108209 0.30328876 0.23493686 -0.07499825 -0.05472194 -0.03347985 348  HIS   A HB3  
4560  H  HD2  . HIS   A  293 ? 0.42222667 0.28881103 0.23536527 -0.07803582 -0.05952500 -0.04329943 348  HIS   A HD2  
4561  H  HE1  . HIS   A  293 ? 0.47246355 0.33346695 0.27103493 -0.06084444 -0.04496434 -0.05304088 348  HIS   A HE1  
4563  N  N    . ARG   A  294 ? 0.36676618 0.24139926 0.20657562 -0.07129342 -0.05191967 -0.03275481 349  ARG   A N    
4564  C  CA   . ARG   A  294 ? 0.39294690 0.26285708 0.23695822 -0.06756359 -0.04962338 -0.03200842 349  ARG   A CA   
4565  C  C    . ARG   A  294 ? 0.39171404 0.25913084 0.24219070 -0.07211961 -0.05235218 -0.02841946 349  ARG   A C    
4566  O  O    . ARG   A  294 ? 0.41921270 0.27851179 0.27085227 -0.07074141 -0.05212662 -0.02814308 349  ARG   A O    
4567  C  CB   . ARG   A  294 ? 0.47918117 0.33661753 0.31466794 -0.06364505 -0.04878889 -0.03801575 349  ARG   A CB   
4568  C  CG   . ARG   A  294 ? 0.49362421 0.35448673 0.32257557 -0.05905445 -0.04520128 -0.04184315 349  ARG   A CG   
4569  C  CD   . ARG   A  294 ? 0.57302463 0.42148936 0.39250046 -0.05561200 -0.04469140 -0.04867844 349  ARG   A CD   
4570  N  NE   . ARG   A  294 ? 0.62127078 0.46348420 0.44411346 -0.05008480 -0.04282347 -0.04945303 349  ARG   A NE   
4571  C  CZ   . ARG   A  294 ? 0.81791908 0.66713560 0.64602828 -0.04388220 -0.03836697 -0.04866184 349  ARG   A CZ   
4572  N  NH1  . ARG   A  294 ? 0.81707907 0.67877096 0.64639765 -0.04230927 -0.03460189 -0.04786340 349  ARG   A NH1  
4573  N  NH2  . ARG   A  294 ? 0.81511599 0.65842283 0.64715385 -0.03925880 -0.03787960 -0.04868257 349  ARG   A NH2  
4574  H  H    . ARG   A  294 ? 0.38258702 0.25217980 0.21861151 -0.07442500 -0.05482651 -0.03472515 349  ARG   A H    
4575  H  HA   . ARG   A  294 ? 0.39093441 0.26755145 0.23884204 -0.06446774 -0.04675390 -0.03003138 349  ARG   A HA   
4576  H  HB2  . ARG   A  294 ? 0.47117501 0.32136458 0.30237663 -0.06694771 -0.05178563 -0.04010317 349  ARG   A HB2  
4577  H  HB3  . ARG   A  294 ? 0.46268451 0.31657076 0.30095387 -0.06082302 -0.04764435 -0.03748298 349  ARG   A HB3  
4578  H  HG2  . ARG   A  294 ? 0.49848548 0.36573076 0.33181900 -0.05561952 -0.04203340 -0.04011720 349  ARG   A HG2  
4579  H  HG3  . ARG   A  294 ? 0.50164187 0.36698037 0.32808858 -0.06177486 -0.04625449 -0.04154830 349  ARG   A HG3  
4580  H  HD2  . ARG   A  294 ? 0.57255566 0.42409295 0.38744128 -0.05349055 -0.04239085 -0.05107982 349  ARG   A HD2  
4581  H  HD3  . ARG   A  294 ? 0.57582641 0.41708785 0.39098164 -0.05925675 -0.04807725 -0.05041521 349  ARG   A HD3  
4582  H  HE   . ARG   A  294 ? 0.65830135 0.49150902 0.47964305 -0.05091693 -0.04495968 -0.05048768 349  ARG   A HE   
4583  H  HH11 . ARG   A  294 ? 0.81346941 0.67622447 0.63721734 -0.04321989 -0.03410345 -0.04997456 349  ARG   A HH11 
4584  H  HH12 . ARG   A  294 ? 0.80469084 0.67333239 0.64009488 -0.04050390 -0.03264805 -0.04518605 349  ARG   A HH12 
4585  H  HH21 . ARG   A  294 ? 0.81209326 0.66029412 0.64781195 -0.03501754 -0.03515124 -0.04844810 349  ARG   A HH21 
4586  H  HH22 . ARG   A  294 ? 0.81879562 0.65326506 0.64969206 -0.04050938 -0.04041703 -0.04886368 349  ARG   A HH22 
4587  N  N    . CYS   A  295 ? 0.35492533 0.22957757 0.20948154 -0.07762677 -0.05498373 -0.02560871 350  CYS   A N    
4588  C  CA   . CYS   A  295 ? 0.37231445 0.24655622 0.23298262 -0.08295502 -0.05735457 -0.02245371 350  CYS   A CA   
4589  C  C    . CYS   A  295 ? 0.35600054 0.24325302 0.22632363 -0.08339489 -0.05598410 -0.01709894 350  CYS   A C    
4590  O  O    . CYS   A  295 ? 0.43653607 0.32392240 0.31262022 -0.08497202 -0.05556998 -0.01385059 350  CYS   A O    
4591  C  CB   . CYS   A  295 ? 0.38460934 0.25578398 0.24210392 -0.08950638 -0.06202444 -0.02467593 350  CYS   A CB   
4592  S  SG   . CYS   A  295 ? 0.53175521 0.40594575 0.39790463 -0.09721615 -0.06468512 -0.02084924 350  CYS   A SG   
4593  H  H    . CYS   A  295 ? 0.36384541 0.24410397 0.21725056 -0.07805108 -0.05528083 -0.02573061 350  CYS   A H    
4594  H  HA   . CYS   A  295 ? 0.37376750 0.24068791 0.23405156 -0.08203758 -0.05685884 -0.02255003 350  CYS   A HA   
4595  H  HB2  . CYS   A  295 ? 0.41730905 0.27886021 0.26859277 -0.08939596 -0.06292676 -0.02806710 350  CYS   A HB2  
4596  H  HB3  . CYS   A  295 ? 0.40361303 0.28069931 0.26000446 -0.08976585 -0.06282680 -0.02516551 350  CYS   A HB3  
4597  N  N    . VAL   A  296 ? 0.35708743 0.25440335 0.22826393 -0.08218293 -0.05543231 -0.01629783 351  VAL   A N    
4598  C  CA   . VAL   A  296 ? 0.34080827 0.25014925 0.22021556 -0.08310166 -0.05503782 -0.01186859 351  VAL   A CA   
4599  C  C    . VAL   A  296 ? 0.36546984 0.27976757 0.24808928 -0.07783697 -0.05081230 -0.00946581 351  VAL   A C    
4600  O  O    . VAL   A  296 ? 0.33994144 0.25335541 0.21798633 -0.07363725 -0.04845661 -0.01135828 351  VAL   A O    
4601  C  CB   . VAL   A  296 ? 0.35090214 0.26714882 0.22899002 -0.08515437 -0.05778344 -0.01221615 351  VAL   A CB   
4602  C  CG1  . VAL   A  296 ? 0.41760010 0.34537455 0.30340087 -0.08493122 -0.05729929 -0.00804148 351  VAL   A CG1  
4603  C  CG2  . VAL   A  296 ? 0.41549528 0.32883373 0.29246062 -0.09099217 -0.06253908 -0.01419770 351  VAL   A CG2  
4604  H  H    . VAL   A  296 ? 0.35893202 0.25505656 0.22480640 -0.08066992 -0.05532619 -0.01871332 351  VAL   A H    
4605  H  HA   . VAL   A  296 ? 0.34707803 0.25671878 0.23089869 -0.08602095 -0.05597400 -0.01019512 351  VAL   A HA   
4606  H  HB   . VAL   A  296 ? 0.37518865 0.28994191 0.24749580 -0.08275871 -0.05695791 -0.01412847 351  VAL   A HB   
4607  H  HG11 . VAL   A  296 ? 0.38543969 0.31491792 0.27695295 -0.08659043 -0.05722238 -0.00615628 351  VAL   A HG11 
4608  H  HG12 . VAL   A  296 ? 0.38572276 0.31557029 0.27122945 -0.08152983 -0.05467010 -0.00709770 351  VAL   A HG12 
4609  H  HG13 . VAL   A  296 ? 0.39012623 0.32155174 0.27541697 -0.08653688 -0.05975607 -0.00820002 351  VAL   A HG13 
4610  H  HG21 . VAL   A  296 ? 0.39620498 0.31412083 0.27235281 -0.09192007 -0.06460161 -0.01436705 351  VAL   A HG21 
4611  H  HG22 . VAL   A  296 ? 0.40527487 0.31037205 0.27650690 -0.09120171 -0.06305201 -0.01716245 351  VAL   A HG22 
4612  H  HG23 . VAL   A  296 ? 0.39288956 0.30802074 0.27561432 -0.09366544 -0.06308078 -0.01238583 351  VAL   A HG23 
4613  N  N    . ASN   A  297 ? 0.29892313 0.21852434 0.18938319 -0.07834163 -0.04979248 -0.00549801 352  ASN   A N    
4614  C  CA   . ASN   A  297 ? 0.37016124 0.29629904 0.26454145 -0.07429712 -0.04649829 -0.00287809 352  ASN   A CA   
4615  C  C    . ASN   A  297 ? 0.31642511 0.25244099 0.21323933 -0.07482766 -0.04693277 -0.00099979 352  ASN   A C    
4616  O  O    . ASN   A  297 ? 0.34212977 0.28242832 0.24256368 -0.07837962 -0.04947102 0.00026570  352  ASN   A O    
4617  C  CB   . ASN   A  297 ? 0.31993318 0.24657214 0.22042045 -0.07442628 -0.04535656 0.00032869  352  ASN   A CB   
4618  C  CG   . ASN   A  297 ? 0.32271898 0.23939048 0.22037929 -0.07234646 -0.04462941 -0.00090023 352  ASN   A CG   
4619  O  OD1  . ASN   A  297 ? 0.32398349 0.23796555 0.21851784 -0.06764169 -0.04279573 -0.00290099 352  ASN   A OD1  
4620  N  ND2  . ASN   A  297 ? 0.31500390 0.22595170 0.21362078 -0.07574061 -0.04603806 0.00024392  352  ASN   A ND2  
4621  H  H    . ASN   A  297 ? 0.32678455 0.24595454 0.22008169 -0.08147387 -0.05115009 -0.00448204 352  ASN   A H    
4622  H  HA   . ASN   A  297 ? 0.33715278 0.26075527 0.22820011 -0.07102503 -0.04477063 -0.00451068 352  ASN   A HA   
4623  H  HB2  . ASN   A  297 ? 0.32613394 0.25426352 0.22942919 -0.07795007 -0.04687469 0.00149190  352  ASN   A HB2  
4624  H  HB3  . ASN   A  297 ? 0.32066509 0.25286916 0.22420342 -0.07241879 -0.04367170 0.00218103  352  ASN   A HB3  
4625  H  HD21 . ASN   A  297 ? 0.31510854 0.22956479 0.21700296 -0.07886408 -0.04673612 0.00198607  352  ASN   A HD21 
4626  H  HD22 . ASN   A  297 ? 0.32521257 0.22874814 0.22109297 -0.07490566 -0.04622550 -0.00072420 352  ASN   A HD22 
4627  N  N    . VAL   A  298 ? 0.28824025 0.22772667 0.18309534 -0.07126190 -0.04447191 -0.00087397 353  VAL   A N    
4628  C  CA   . VAL   A  298 ? 0.29576352 0.24269745 0.19113705 -0.07145137 -0.04490773 0.00093363  353  VAL   A CA   
4629  C  C    . VAL   A  298 ? 0.30305511 0.25558540 0.20337816 -0.06879673 -0.04179763 0.00391912  353  VAL   A C    
4630  O  O    . VAL   A  298 ? 0.33251315 0.28371692 0.23206466 -0.06569652 -0.03877803 0.00322363  353  VAL   A O    
4631  C  CB   . VAL   A  298 ? 0.29637775 0.24172288 0.18307130 -0.07062387 -0.04498153 -0.00156769 353  VAL   A CB   
4632  C  CG1  . VAL   A  298 ? 0.36477631 0.31657842 0.25117332 -0.07098431 -0.04583327 0.00088249  353  VAL   A CG1  
4633  C  CG2  . VAL   A  298 ? 0.40146023 0.34037381 0.28229707 -0.07326756 -0.04831208 -0.00507260 353  VAL   A CG2  
4634  H  H    . VAL   A  298 ? 0.29979461 0.23679128 0.19291058 -0.06864449 -0.04246004 -0.00192037 353  VAL   A H    
4635  H  HA   . VAL   A  298 ? 0.29378438 0.24311659 0.19188055 -0.07391320 -0.04723142 0.00192533  353  VAL   A HA   
4636  H  HB   . VAL   A  298 ? 0.32635623 0.27021486 0.21089143 -0.06804363 -0.04222658 -0.00264981 353  VAL   A HB   
4637  H  HG11 . VAL   A  298 ? 0.33691406 0.29120332 0.22693773 -0.07289772 -0.04834236 0.00220512  353  VAL   A HG11 
4638  H  HG12 . VAL   A  298 ? 0.33471364 0.28962326 0.22342555 -0.06925937 -0.04344143 0.00263081  353  VAL   A HG12 
4639  H  HG13 . VAL   A  298 ? 0.34635592 0.29653752 0.22642341 -0.07105173 -0.04635827 -0.00063498 353  VAL   A HG13 
4640  H  HG21 . VAL   A  298 ? 0.37322319 0.31129879 0.24801344 -0.07282258 -0.04843761 -0.00659110 353  VAL   A HG21 
4641  H  HG22 . VAL   A  298 ? 0.37166676 0.30529279 0.25168461 -0.07277772 -0.04764157 -0.00679772 353  VAL   A HG22 
4642  H  HG23 . VAL   A  298 ? 0.36632681 0.30716032 0.25014102 -0.07595774 -0.05106640 -0.00413067 353  VAL   A HG23 
4643  N  N    . ILE   A  299 ? 0.36241370 0.32114524 0.26824129 -0.07002360 -0.04277774 0.00696757  354  ILE   A N    
4644  C  CA   . ILE   A  299 ? 0.33285612 0.29688570 0.24284776 -0.06806224 -0.04042313 0.00977783  354  ILE   A CA   
4645  C  C    . ILE   A  299 ? 0.31561908 0.28345934 0.22310103 -0.06812906 -0.04124541 0.01095349  354  ILE   A C    
4646  O  O    . ILE   A  299 ? 0.31848934 0.28809273 0.22647296 -0.07000560 -0.04448083 0.01147707  354  ILE   A O    
4647  C  CB   . ILE   A  299 ? 0.29450065 0.26162988 0.21198483 -0.06924563 -0.04085129 0.01217503  354  ILE   A CB   
4648  C  CG1  . ILE   A  299 ? 0.37047100 0.33277965 0.28912267 -0.06894635 -0.03969726 0.01161263  354  ILE   A CG1  
4649  C  CG2  . ILE   A  299 ? 0.31909901 0.29214203 0.24061170 -0.06785981 -0.03945535 0.01505393  354  ILE   A CG2  
4650  C  CD1  . ILE   A  299 ? 0.37456501 0.33901405 0.29918629 -0.07065306 -0.03984213 0.01386337  354  ILE   A CD1  
4651  H  H    . ILE   A  299 ? 0.33837426 0.29811132 0.24552980 -0.07217031 -0.04509329 0.00715367  354  ILE   A H    
4652  H  HA   . ILE   A  299 ? 0.32713217 0.29000908 0.23627847 -0.06605253 -0.03816089 0.00926577  354  ILE   A HA   
4653  H  HB   . ILE   A  299 ? 0.31889892 0.28697243 0.23753133 -0.07135087 -0.04307101 0.01210770  354  ILE   A HB   
4654  H  HG12 . ILE   A  299 ? 0.35296506 0.31466365 0.27088934 -0.06656930 -0.03776914 0.01151069  354  ILE   A HG12 
4655  H  HG13 . ILE   A  299 ? 0.35918140 0.31709069 0.27486813 -0.06996711 -0.04078450 0.00973869  354  ILE   A HG13 
4656  H  HG21 . ILE   A  299 ? 0.30895418 0.28179300 0.22941925 -0.06607462 -0.03742441 0.01509198  354  ILE   A HG21 
4657  H  HG22 . ILE   A  299 ? 0.30915639 0.28434318 0.22982585 -0.06826046 -0.04070085 0.01557112  354  ILE   A HG22 
4658  H  HG23 . ILE   A  299 ? 0.30594188 0.28056449 0.23168558 -0.06843518 -0.03944659 0.01622808  354  ILE   A HG23 
4659  H  HD11 . ILE   A  299 ? 0.36587083 0.33375311 0.29296848 -0.06935393 -0.03861053 0.01545468  354  ILE   A HD11 
4660  H  HD12 . ILE   A  299 ? 0.37112391 0.33766073 0.29740965 -0.07288499 -0.04148376 0.01400393  354  ILE   A HD12 
4661  H  HD13 . ILE   A  299 ? 0.37448138 0.33472562 0.29861069 -0.07086971 -0.03954160 0.01352340  354  ILE   A HD13 
4662  N  N    . PHE   A  300 ? 0.30139631 0.27045333 0.20618203 -0.06615316 -0.03842508 0.01138583  355  PHE   A N    
4663  C  CA   . PHE   A  300 ? 0.28316686 0.25517309 0.18538885 -0.06635261 -0.03874458 0.01333998  355  PHE   A CA   
4664  C  C    . PHE   A  300 ? 0.29514489 0.27139404 0.20341817 -0.06553262 -0.03717327 0.01633007  355  PHE   A C    
4665  O  O    . PHE   A  300 ? 0.28644711 0.26379618 0.19710840 -0.06405596 -0.03409484 0.01643967  355  PHE   A O    
4666  C  CB   . PHE   A  300 ? 0.31196189 0.28214586 0.20587745 -0.06557216 -0.03640810 0.01166400  355  PHE   A CB   
4667  C  CG   . PHE   A  300 ? 0.28676099 0.25834805 0.17556719 -0.06636497 -0.03671256 0.01373446  355  PHE   A CG   
4668  C  CD1  . PHE   A  300 ? 0.27533412 0.24475946 0.15784806 -0.06785718 -0.04029841 0.01358075  355  PHE   A CD1  
4669  C  CD2  . PHE   A  300 ? 0.28643957 0.26113474 0.17649946 -0.06588578 -0.03379554 0.01605592  355  PHE   A CD2  
4670  C  CE1  . PHE   A  300 ? 0.27619889 0.24581754 0.15327463 -0.06856529 -0.04097969 0.01596577  355  PHE   A CE1  
4671  C  CE2  . PHE   A  300 ? 0.25108171 0.22581393 0.13575155 -0.06706934 -0.03422794 0.01835466  355  PHE   A CE2  
4672  C  CZ   . PHE   A  300 ? 0.24458680 0.21646741 0.12266653 -0.06826743 -0.03789781 0.01850660  355  PHE   A CZ   
4673  H  H    . PHE   A  300 ? 0.30149212 0.26944155 0.20601022 -0.06470328 -0.03625043 0.01047141  355  PHE   A H    
4674  H  HA   . PHE   A  300 ? 0.29536313 0.26753494 0.19702534 -0.06764036 -0.04162200 0.01368116  355  PHE   A HA   
4675  H  HB2  . PHE   A  300 ? 0.30588067 0.27287081 0.19600746 -0.06598081 -0.03743099 0.00940168  355  PHE   A HB2  
4676  H  HB3  . PHE   A  300 ? 0.29869640 0.26962176 0.19404238 -0.06413213 -0.03353205 0.01122300  355  PHE   A HB3  
4677  H  HD1  . PHE   A  300 ? 0.28103238 0.24862707 0.16289932 -0.06850714 -0.04252862 0.01194658  355  PHE   A HD1  
4678  H  HD2  . PHE   A  300 ? 0.27066898 0.24720320 0.16515729 -0.06490607 -0.03167800 0.01614578  355  PHE   A HD2  
4679  H  HE1  . PHE   A  300 ? 0.27493015 0.24286632 0.14743763 -0.06942683 -0.04380835 0.01597039  355  PHE   A HE1  
4680  H  HE2  . PHE   A  300 ? 0.25433010 0.23085356 0.13984413 -0.06716057 -0.03224669 0.01996993  355  PHE   A HE2  
4681  H  HZ   . PHE   A  300 ? 0.25819194 0.22937536 0.13181567 -0.06903857 -0.03834586 0.02027559  355  PHE   A HZ   
4682  N  N    . VAL   A  301 ? 0.29977149 0.27838233 0.21063143 -0.06632912 -0.03958729 0.01853593  356  VAL   A N    
4683  C  CA   . VAL   A  301 ? 0.24603081 0.22785297 0.16298558 -0.06571265 -0.03870761 0.02086929  356  VAL   A CA   
4684  C  C    . VAL   A  301 ? 0.21348652 0.19659214 0.12991221 -0.06592155 -0.04094599 0.02312016  356  VAL   A C    
4685  O  O    . VAL   A  301 ? 0.24368492 0.22633772 0.15825263 -0.06653996 -0.04433843 0.02295437  356  VAL   A O    
4686  C  CB   . VAL   A  301 ? 0.29089335 0.27376705 0.21449727 -0.06606425 -0.03926317 0.02058589  356  VAL   A CB   
4687  C  CG1  . VAL   A  301 ? 0.23960558 0.22338410 0.16507806 -0.06761899 -0.04274306 0.02007089  356  VAL   A CG1  
4688  C  CG2  . VAL   A  301 ? 0.35580608 0.34155130 0.28469914 -0.06530492 -0.03796349 0.02254078  356  VAL   A CG2  
4689  H  H    . VAL   A  301 ? 0.28855982 0.26668546 0.19726957 -0.06712272 -0.04196260 0.01845055  356  VAL   A H    
4690  H  HA   . VAL   A  301 ? 0.25429779 0.23653093 0.17114246 -0.06495343 -0.03626107 0.02111206  356  VAL   A HA   
4691  H  HB   . VAL   A  301 ? 0.28236562 0.26330924 0.20539296 -0.06586552 -0.03809146 0.01928733  356  VAL   A HB   
4692  H  HG11 . VAL   A  301 ? 0.25178000 0.23763502 0.17849718 -0.06738282 -0.04408794 0.02127852  356  VAL   A HG11 
4693  H  HG12 . VAL   A  301 ? 0.25836495 0.24009834 0.18006146 -0.06828502 -0.04388549 0.01871840  356  VAL   A HG12 
4694  H  HG13 . VAL   A  301 ? 0.25107911 0.23545636 0.18026453 -0.06823596 -0.04255446 0.01982368  356  VAL   A HG13 
4695  H  HG21 . VAL   A  301 ? 0.32901433 0.31516823 0.26121596 -0.06564133 -0.03793614 0.02233727  356  VAL   A HG21 
4696  H  HG22 . VAL   A  301 ? 0.32963315 0.31530473 0.25775203 -0.06451180 -0.03597850 0.02281570  356  VAL   A HG22 
4697  H  HG23 . VAL   A  301 ? 0.32954276 0.31670928 0.25915709 -0.06530792 -0.03919378 0.02366876  356  VAL   A HG23 
4698  N  N    . GLY   A  302 ? 0.25904918 0.24340811 0.17704315 -0.06534676 -0.03932772 0.02515538  357  GLY   A N    
4699  C  CA   . GLY   A  302 ? 0.21339479 0.19775268 0.13109553 -0.06521066 -0.04145443 0.02742710  357  GLY   A CA   
4700  C  C    . GLY   A  302 ? 0.27895510 0.26576218 0.20395057 -0.06436835 -0.04166210 0.02828446  357  GLY   A C    
4701  O  O    . GLY   A  302 ? 0.29485929 0.28334519 0.22429304 -0.06419704 -0.03967149 0.02756972  357  GLY   A O    
4702  H  H    . GLY   A  302 ? 0.23292872 0.21790913 0.15218879 -0.06499589 -0.03700031 0.02506995  357  GLY   A H    
4703  H  HA2  . GLY   A  302 ? 0.24096277 0.22461225 0.15679678 -0.06537159 -0.04410525 0.02727331  357  GLY   A HA2  
4704  H  HA3  . GLY   A  302 ? 0.23975448 0.22299397 0.15398526 -0.06551117 -0.04022587 0.02851466  357  GLY   A HA3  
4705  N  N    . ASP   A  303 ? 0.26100188 0.24761191 0.18670560 -0.06364120 -0.04431534 0.02970580  358  ASP   A N    
4706  C  CA   . ASP   A  303 ? 0.24328586 0.23206618 0.17533302 -0.06248452 -0.04465372 0.03011235  358  ASP   A CA   
4707  C  C    . ASP   A  303 ? 0.26653320 0.25367180 0.19809246 -0.06230745 -0.04290600 0.03173357  358  ASP   A C    
4708  O  O    . ASP   A  303 ? 0.22691724 0.21573535 0.16315752 -0.06173862 -0.04176907 0.03150694  358  ASP   A O    
4709  C  CB   . ASP   A  303 ? 0.27167326 0.26144466 0.20576613 -0.06113727 -0.04861929 0.03029400  358  ASP   A CB   
4710  C  CG   . ASP   A  303 ? 0.23925832 0.22512971 0.16758713 -0.06049353 -0.05153884 0.03211531  358  ASP   A CG   
4711  O  OD1  . ASP   A  303 ? 0.22873038 0.21086052 0.14954206 -0.06190912 -0.05046682 0.03318589  358  ASP   A OD1  
4712  O  OD2  . ASP   A  303 ? 0.28349802 0.26991951 0.21439970 -0.05854258 -0.05484162 0.03251127  358  ASP   A OD2  
4713  H  H    . ASP   A  303 ? 0.26573440 0.25057614 0.18755779 -0.06371307 -0.04602684 0.03036878  358  ASP   A H    
4714  H  HA   . ASP   A  303 ? 0.25147304 0.24233377 0.18710874 -0.06268337 -0.04351473 0.02902682  358  ASP   A HA   
4715  H  HB2  . ASP   A  303 ? 0.25258720 0.24399252 0.19095677 -0.06015785 -0.04845191 0.03027014  358  ASP   A HB2  
4716  H  HB3  . ASP   A  303 ? 0.25547376 0.24713194 0.19094852 -0.06155986 -0.04970293 0.02907859  358  ASP   A HB3  
4717  N  N    . HIS   A  304 ? 0.21799850 0.20169109 0.14344272 -0.06315008 -0.04278187 0.03335580  359  HIS   A N    
4718  C  CA   . HIS   A  304 ? 0.24709392 0.22892061 0.17148526 -0.06389728 -0.04108078 0.03496536  359  HIS   A CA   
4719  C  C    . HIS   A  304 ? 0.28426439 0.26277900 0.20094721 -0.06575567 -0.04042430 0.03662768  359  HIS   A C    
4720  O  O    . HIS   A  304 ? 0.28072506 0.25798762 0.19247597 -0.06602197 -0.04166842 0.03651466  359  HIS   A O    
4721  C  CB   . HIS   A  304 ? 0.24507412 0.22490437 0.17175080 -0.06240188 -0.04340306 0.03591717  359  HIS   A CB   
4722  C  CG   . HIS   A  304 ? 0.24501526 0.22200453 0.16879795 -0.06106577 -0.04742669 0.03683082  359  HIS   A CG   
4723  N  ND1  . HIS   A  304 ? 0.26855585 0.24025483 0.18459186 -0.06213999 -0.04873244 0.03911185  359  HIS   A ND1  
4724  C  CD2  . HIS   A  304 ? 0.23816070 0.21741556 0.16579866 -0.05888247 -0.05045063 0.03573292  359  HIS   A CD2  
4725  C  CE1  . HIS   A  304 ? 0.27312878 0.24341872 0.18810138 -0.06022398 -0.05299275 0.03943392  359  HIS   A CE1  
4726  N  NE2  . HIS   A  304 ? 0.24829842 0.22351933 0.17076218 -0.05811315 -0.05419912 0.03733010  359  HIS   A NE2  
4727  H  H    . HIS   A  304 ? 0.24035273 0.22273144 0.16189723 -0.06353711 -0.04381802 0.03348504  359  HIS   A H    
4728  H  HA   . HIS   A  304 ? 0.24152726 0.22543702 0.16856091 -0.06423514 -0.03886985 0.03427088  359  HIS   A HA   
4729  H  HB2  . HIS   A  304 ? 0.24548857 0.22325842 0.17075589 -0.06324802 -0.04250724 0.03701184  359  HIS   A HB2  
4730  H  HB3  . HIS   A  304 ? 0.23981808 0.22221756 0.17128249 -0.06141592 -0.04319559 0.03474422  359  HIS   A HB3  
4732  H  HD2  . HIS   A  304 ? 0.23572105 0.21867853 0.16851559 -0.05813462 -0.05009410 0.03425045  359  HIS   A HD2  
4733  H  HE1  . HIS   A  304 ? 0.27454445 0.24085626 0.18420801 -0.06036500 -0.05498088 0.04105577  359  HIS   A HE1  
4735  N  N    . GLY   A  305 ? 0.23293695 0.20977291 0.14818761 -0.06731751 -0.03873006 0.03824905  360  GLY   A N    
4736  C  CA   . GLY   A  305 ? 0.29448736 0.26816380 0.20228641 -0.06978641 -0.03768560 0.04023135  360  GLY   A CA   
4737  C  C    . GLY   A  305 ? 0.27236727 0.23926279 0.17491961 -0.07000871 -0.04098558 0.04299719  360  GLY   A C    
4738  O  O    . GLY   A  305 ? 0.23489624 0.19981515 0.13874830 -0.06749672 -0.04481887 0.04300757  360  GLY   A O    
4739  H  H    . GLY   A  305 ? 0.25217727 0.22989371 0.17105861 -0.06709356 -0.03815605 0.03810575  360  GLY   A H    
4740  H  HA2  . GLY   A  305 ? 0.27593723 0.25026321 0.18064414 -0.07003873 -0.03721442 0.03958145  360  GLY   A HA2  
4741  H  HA3  . GLY   A  305 ? 0.27223259 0.24748382 0.18107729 -0.07124081 -0.03514029 0.04039197  360  GLY   A HA3  
4742  N  N    . MET   A  306 ? 0.29136032 0.25482389 0.18803300 -0.07311831 -0.03939289 0.04534864  361  MET   A N    
4743  C  CA   . MET   A  306 ? 0.26774246 0.22311148 0.15732682 -0.07404681 -0.04227057 0.04854123  361  MET   A CA   
4744  C  C    . MET   A  306 ? 0.30085307 0.25348577 0.18716246 -0.07820167 -0.03957763 0.05080812  361  MET   A C    
4745  O  O    . MET   A  306 ? 0.24478355 0.20146057 0.12972875 -0.08120773 -0.03535662 0.05062474  361  MET   A O    
4746  C  CB   . MET   A  306 ? 0.28418595 0.23661327 0.16502692 -0.07433385 -0.04404958 0.04962594  361  MET   A CB   
4747  C  CG   . MET   A  306 ? 0.29116195 0.23386464 0.16328272 -0.07486681 -0.04802502 0.05338319  361  MET   A CG   
4748  S  SD   . MET   A  306 ? 0.32940483 0.26842049 0.20580240 -0.06968264 -0.05455381 0.05330532  361  MET   A SD   
4749  C  CE   . MET   A  306 ? 0.38221356 0.32696152 0.26041427 -0.06695430 -0.05697004 0.05068214  361  MET   A CE   
4750  H  H    . MET   A  306 ? 0.27908188 0.24536815 0.17618595 -0.07481557 -0.03635767 0.04497490  361  MET   A H    
4751  H  HA   . MET   A  306 ? 0.27957594 0.23289552 0.17179906 -0.07186160 -0.04500172 0.04851528  361  MET   A HA   
4752  H  HB2  . MET   A  306 ? 0.27875268 0.23349619 0.16213754 -0.07205360 -0.04572999 0.04797256  361  MET   A HB2  
4753  H  HB3  . MET   A  306 ? 0.28294566 0.23740697 0.16091368 -0.07646862 -0.04102260 0.04945148  361  MET   A HB3  
4754  H  HG2  . MET   A  306 ? 0.30532986 0.24635202 0.17081374 -0.07581723 -0.04846030 0.05424779  361  MET   A HG2  
4755  H  HG3  . MET   A  306 ? 0.30241460 0.24225685 0.17263040 -0.07723606 -0.04658019 0.05505779  361  MET   A HG3  
4756  H  HE1  . MET   A  306 ? 0.35790944 0.30841774 0.24145442 -0.06691169 -0.05449037 0.04837143  361  MET   A HE1  
4757  H  HE2  . MET   A  306 ? 0.37205946 0.31480074 0.24328858 -0.06842719 -0.05718650 0.05170789  361  MET   A HE2  
4758  H  HE3  . MET   A  306 ? 0.36672580 0.31065780 0.24738875 -0.06417824 -0.06060609 0.05051556  361  MET   A HE3  
4759  N  N    . GLU   A  307 ? 0.31433633 0.25993097 0.19928771 -0.07833050 -0.04218614 0.05282692  362  GLU   A N    
4760  C  CA   . GLU   A  307 ? 0.29281241 0.23472536 0.17523023 -0.08257893 -0.04034043 0.05497736  362  GLU   A CA   
4761  C  C    . GLU   A  307 ? 0.30646956 0.23747322 0.17829859 -0.08433940 -0.04323504 0.05893821  362  GLU   A C    
4762  O  O    . GLU   A  307 ? 0.33593592 0.26189786 0.20463055 -0.08095842 -0.04772099 0.05965706  362  GLU   A O    
4763  C  CB   . GLU   A  307 ? 0.26477960 0.20675480 0.15450802 -0.08124577 -0.04109363 0.05356377  362  GLU   A CB   
4764  C  CG   . GLU   A  307 ? 0.33508149 0.27279431 0.22325769 -0.08551316 -0.03999149 0.05529980  362  GLU   A CG   
4765  C  CD   . GLU   A  307 ? 0.32754666 0.27169126 0.21623422 -0.09050645 -0.03503477 0.05552960  362  GLU   A CD   
4766  O  OE1  . GLU   A  307 ? 0.35351297 0.29602581 0.23496926 -0.09380972 -0.03338756 0.05779956  362  GLU   A OE1  
4767  O  OE2  . GLU   A  307 ? 0.35788167 0.30931783 0.25423014 -0.09091479 -0.03277246 0.05331048  362  GLU   A OE2  
4768  H  H    . GLU   A  307 ? 0.30601990 0.24892843 0.19174722 -0.07565299 -0.04533419 0.05274693  362  GLU   A H    
4769  H  HA   . GLU   A  307 ? 0.29194024 0.23838708 0.17455605 -0.08515447 -0.03682975 0.05467502  362  GLU   A HA   
4770  H  HB2  . GLU   A  307 ? 0.27497941 0.22366272 0.17064440 -0.08020327 -0.03935274 0.05128004  362  GLU   A HB2  
4771  H  HB3  . GLU   A  307 ? 0.28415886 0.22252424 0.17422159 -0.07823896 -0.04428938 0.05342381  362  GLU   A HB3  
4772  H  HG2  . GLU   A  307 ? 0.31184810 0.24985024 0.20472637 -0.08417473 -0.04071411 0.05390655  362  GLU   A HG2  
4773  H  HG3  . GLU   A  307 ? 0.32488030 0.25480962 0.20692250 -0.08647871 -0.04201938 0.05768220  362  GLU   A HG3  
4774  N  N    . ASP   A  308 ? 0.34012133 0.26760933 0.20660566 -0.08976045 -0.04080407 0.06157434  363  ASP   A N    
4775  C  CA   . ASP   A  308 ? 0.38455263 0.29990429 0.24040359 -0.09225120 -0.04350966 0.06586622  363  ASP   A CA   
4776  C  C    . ASP   A  308 ? 0.41527581 0.32188842 0.27264673 -0.09017634 -0.04769697 0.06646276  363  ASP   A C    
4777  O  O    . ASP   A  308 ? 0.37406099 0.28137311 0.23628865 -0.09208848 -0.04617748 0.06558486  363  ASP   A O    
4778  C  CB   . ASP   A  308 ? 0.53419697 0.44894415 0.38420895 -0.09962939 -0.03899522 0.06849538  363  ASP   A CB   
4779  C  CG   . ASP   A  308 ? 0.60232401 0.52273995 0.44720641 -0.10184393 -0.03520839 0.06862808  363  ASP   A CG   
4780  O  OD1  . ASP   A  308 ? 0.66080433 0.57608420 0.49707800 -0.10035846 -0.03791697 0.07021642  363  ASP   A OD1  
4781  O  OD2  . ASP   A  308 ? 0.68222201 0.61236638 0.53159928 -0.10486329 -0.02965841 0.06694737  363  ASP   A OD2  
4782  H  H    . ASP   A  308 ? 0.33700001 0.26984027 0.20655008 -0.09210932 -0.03737042 0.06073026  363  ASP   A H    
4783  H  HA   . ASP   A  308 ? 0.40764701 0.32041472 0.25846279 -0.09066396 -0.04562288 0.06676504  363  ASP   A HA   
4784  H  HB2  . ASP   A  308 ? 0.50097942 0.42057511 0.35706571 -0.10120723 -0.03654876 0.06711402  363  ASP   A HB2  
4785  H  HB3  . ASP   A  308 ? 0.51726413 0.42288420 0.36061987 -0.10160992 -0.04095928 0.07147897  363  ASP   A HB3  
4786  N  N    . VAL   A  309 ? 0.36722851 0.26541334 0.22010082 -0.08618932 -0.05316674 0.06785050  364  VAL   A N    
4787  C  CA   . VAL   A  309 ? 0.36680487 0.25645041 0.22113413 -0.08282885 -0.05758506 0.06788828  364  VAL   A CA   
4788  C  C    . VAL   A  309 ? 0.49680281 0.37343603 0.34011716 -0.08176381 -0.06285609 0.07189542  364  VAL   A C    
4789  O  O    . VAL   A  309 ? 0.45022058 0.32812366 0.29109436 -0.07862522 -0.06548491 0.07212364  364  VAL   A O    
4790  C  CB   . VAL   A  309 ? 0.40986228 0.30680352 0.27504611 -0.07621140 -0.05919189 0.06354411  364  VAL   A CB   
4791  C  CG1  . VAL   A  309 ? 0.52319050 0.41239989 0.39070770 -0.07263511 -0.06284446 0.06279296  364  VAL   A CG1  
4792  C  CG2  . VAL   A  309 ? 0.36889470 0.27900773 0.24359618 -0.07699803 -0.05426632 0.05992377  364  VAL   A CG2  
4793  H  H    . VAL   A  309 ? 0.38186359 0.27969295 0.23059140 -0.08532776 -0.05430395 0.06866115  364  VAL   A H    
4794  H  HA   . VAL   A  309 ? 0.39699864 0.28434420 0.25191540 -0.08562374 -0.05618901 0.06818195  364  VAL   A HA   
4795  H  HB   . VAL   A  309 ? 0.41066292 0.30860969 0.27478811 -0.07349771 -0.06133367 0.06354279  364  VAL   A HB   
4796  H  HG11 . VAL   A  309 ? 0.48786837 0.37665570 0.35705808 -0.07510767 -0.06085994 0.06229085  364  VAL   A HG11 
4797  H  HG12 . VAL   A  309 ? 0.50046229 0.38051635 0.36155516 -0.07217223 -0.06607874 0.06526202  364  VAL   A HG12 
4798  H  HG13 . VAL   A  309 ? 0.48048592 0.37427676 0.35414669 -0.06832214 -0.06396416 0.06023883  364  VAL   A HG13 
4799  H  HG21 . VAL   A  309 ? 0.36926907 0.28269094 0.25015780 -0.07331753 -0.05526752 0.05748516  364  VAL   A HG21 
4800  H  HG22 . VAL   A  309 ? 0.37297726 0.28808987 0.24682815 -0.07790527 -0.05253035 0.05982458  364  VAL   A HG22 
4801  H  HG23 . VAL   A  309 ? 0.37526679 0.28528404 0.25051966 -0.08025561 -0.05198431 0.06013234  364  VAL   A HG23 
4802  N  N    . THR   A  310 ? 0.53009558 0.39388424 0.36682904 -0.08422101 -0.06483014 0.07493868  365  THR   A N    
4803  C  CA   . THR   A  310 ? 0.62548029 0.47463104 0.45083112 -0.08326626 -0.07033429 0.07921838  365  THR   A CA   
4804  C  C    . THR   A  310 ? 0.58576858 0.42446065 0.41283536 -0.07873609 -0.07524163 0.07870282  365  THR   A C    
4805  O  O    . THR   A  310 ? 0.50252503 0.34306782 0.33663511 -0.07894161 -0.07339922 0.07597917  365  THR   A O    
4806  C  CB   . THR   A  310 ? 0.60707897 0.44738287 0.41970098 -0.09146190 -0.06823182 0.08434611  365  THR   A CB   
4807  O  OG1  . THR   A  310 ? 0.59338307 0.43099001 0.40843648 -0.09592511 -0.06564394 0.08416027  365  THR   A OG1  
4808  C  CG2  . THR   A  310 ? 0.66947871 0.51948148 0.47936502 -0.09607592 -0.06295456 0.08478128  365  THR   A CG2  
4809  H  H    . THR   A  310 ? 0.53660703 0.40036854 0.37586221 -0.08665897 -0.06284177 0.07434899  365  THR   A H    
4810  H  HA   . THR   A  310 ? 0.59306705 0.44425365 0.41729265 -0.08022126 -0.07247073 0.07920142  365  THR   A HA   
4811  H  HB   . THR   A  310 ? 0.63426781 0.46390107 0.43870959 -0.09057383 -0.07232860 0.08740012  365  THR   A HB   
4813  H  HG21 . THR   A  310 ? 0.65869194 0.50303763 0.46036416 -0.10130797 -0.06154195 0.08806677  365  THR   A HG21 
4814  H  HG22 . THR   A  310 ? 0.63615036 0.49614322 0.45397502 -0.09686881 -0.05906971 0.08188750  365  THR   A HG22 
4815  H  HG23 . THR   A  310 ? 0.64793086 0.49983805 0.45616895 -0.09305478 -0.06485096 0.08458885  365  THR   A HG23 
4816  N  N    . CYS   A  311 ? 0.59731787 0.42435572 0.41719747 -0.07466429 -0.08166791 0.08135337  366  CYS   A N    
4817  C  CA   . CYS   A  311 ? 0.60219359 0.42006212 0.42456985 -0.06848200 -0.08692501 0.08016573  366  CYS   A CA   
4818  C  C    . CYS   A  311 ? 0.58566052 0.39082256 0.40321791 -0.07290758 -0.08648321 0.08182383  366  CYS   A C    
4819  O  O    . CYS   A  311 ? 0.56693423 0.36765555 0.38945866 -0.06882761 -0.08853348 0.07908896  366  CYS   A O    
4820  C  CB   . CYS   A  311 ? 0.68993080 0.49900937 0.50625831 -0.06245028 -0.09439933 0.08254585  366  CYS   A CB   
4821  S  SG   . CYS   A  311 ? 0.94236088 0.73481196 0.73910403 -0.06813736 -0.09720824 0.09029942  366  CYS   A SG   
4822  H  H    . CYS   A  311 ? 0.60477114 0.42946458 0.41787985 -0.07558230 -0.08289437 0.08388271  366  CYS   A H    
4823  H  HA   . CYS   A  311 ? 0.59724903 0.42383891 0.42941010 -0.06494153 -0.08591975 0.07618280  366  CYS   A HA   
4824  H  HB2  . CYS   A  311 ? 0.70957696 0.51300001 0.52831089 -0.05794214 -0.09771147 0.08138426  366  CYS   A HB2  
4825  H  HB3  . CYS   A  311 ? 0.69779390 0.51603448 0.51868784 -0.05951579 -0.09472957 0.08083393  366  CYS   A HB3  
4826  N  N    . ASP   A  312 ? 0.52519399 0.32532290 0.33358443 -0.08162870 -0.08334348 0.08587140  367  ASP   A N    
4827  C  CA   . ASP   A  312 ? 0.53318030 0.32228768 0.33759013 -0.08703177 -0.08253855 0.08729940  367  ASP   A CA   
4828  C  C    . ASP   A  312 ? 0.50166023 0.30135527 0.31768879 -0.08852985 -0.07792441 0.08246456  367  ASP   A C    
4829  O  O    . ASP   A  312 ? 0.48724461 0.27812466 0.30275699 -0.09027683 -0.07871030 0.08190371  367  ASP   A O    
4830  C  CB   . ASP   A  312 ? 0.79987824 0.58085692 0.59129566 -0.09660241 -0.08034931 0.09315000  367  ASP   A CB   
4831  C  CG   . ASP   A  312 ? 0.83130556 0.62646222 0.62590218 -0.10412458 -0.07267626 0.09269828  367  ASP   A CG   
4832  O  OD1  . ASP   A  312 ? 1.10817981 0.91699505 0.90724754 -0.10227350 -0.07014039 0.09092035  367  ASP   A OD1  
4833  O  OD2  . ASP   A  312 ? 1.05764079 0.85001963 0.85019839 -0.11200120 -0.06931691 0.09408733  367  ASP   A OD2  
4834  H  H    . ASP   A  312 ? 0.54248947 0.34600109 0.34695897 -0.08438996 -0.08168416 0.08769038  367  ASP   A H    
4835  H  HA   . ASP   A  312 ? 0.57517111 0.35340986 0.37694037 -0.08328879 -0.08709873 0.08774487  367  ASP   A HA   
4836  H  HB2  . ASP   A  312 ? 0.74313557 0.51302826 0.53018862 -0.09918292 -0.08167786 0.09470510  367  ASP   A HB2  
4837  H  HB3  . ASP   A  312 ? 0.73947525 0.51558864 0.52363235 -0.09543952 -0.08298874 0.09601693  367  ASP   A HB3  
4838  N  N    . ARG   A  313 ? 0.42586774 0.24357349 0.25191015 -0.08762836 -0.07357980 0.07890026  368  ARG   A N    
4839  C  CA   . ARG   A  313 ? 0.44126442 0.26905587 0.27821475 -0.08809301 -0.06992803 0.07428889  368  ARG   A CA   
4840  C  C    . ARG   A  313 ? 0.46262705 0.29399911 0.30851975 -0.07920744 -0.07260930 0.06958367  368  ARG   A C    
4841  O  O    . ARG   A  313 ? 0.37515926 0.22080700 0.23040599 -0.07625304 -0.07016531 0.06602498  368  ARG   A O    
4842  C  CB   . ARG   A  313 ? 0.39465618 0.23914129 0.23719919 -0.09239491 -0.06362594 0.07313477  368  ARG   A CB   
4843  C  CG   . ARG   A  313 ? 0.40724319 0.24924511 0.24224344 -0.10194803 -0.06003620 0.07716019  368  ARG   A CG   
4844  C  CD   . ARG   A  313 ? 0.39193100 0.25064656 0.23390001 -0.10580761 -0.05370262 0.07529806  368  ARG   A CD   
4845  N  NE   . ARG   A  313 ? 0.39087796 0.25995833 0.23557919 -0.10171849 -0.05263163 0.07395169  368  ARG   A NE   
4846  C  CZ   . ARG   A  313 ? 0.37885469 0.25054267 0.21738026 -0.10461452 -0.05039394 0.07635984  368  ARG   A CZ   
4847  N  NH1  . ARG   A  313 ? 0.37110835 0.23482683 0.19929403 -0.11115091 -0.04938603 0.08078399  368  ARG   A NH1  
4848  N  NH2  . ARG   A  313 ? 0.40968007 0.29163900 0.25182483 -0.10105431 -0.04914303 0.07425436  368  ARG   A NH2  
4849  H  H    . ARG   A  313 ? 0.44273001 0.26607394 0.26836097 -0.08679530 -0.07302514 0.07939781  368  ARG   A H    
4850  H  HA   . ARG   A  313 ? 0.44093665 0.26173136 0.27536607 -0.09168947 -0.06985738 0.07501572  368  ARG   A HA   
4851  H  HB2  . ARG   A  313 ? 0.40054974 0.25061002 0.24402353 -0.08963282 -0.06370484 0.07286729  368  ARG   A HB2  
4852  H  HB3  . ARG   A  313 ? 0.39307779 0.24447167 0.24315389 -0.09173012 -0.06181305 0.06996055  368  ARG   A HB3  
4853  H  HG2  . ARG   A  313 ? 0.41308171 0.24776393 0.24605253 -0.10495587 -0.06062854 0.07788158  368  ARG   A HG2  
4854  H  HG3  . ARG   A  313 ? 0.41512263 0.25141972 0.24230444 -0.10271772 -0.06138187 0.08033074  368  ARG   A HG3  
4855  H  HD2  . ARG   A  313 ? 0.38616800 0.25000858 0.23535019 -0.10531384 -0.05262081 0.07243288  368  ARG   A HD2  
4856  H  HD3  . ARG   A  313 ? 0.40010539 0.25754899 0.23756167 -0.11179216 -0.05135325 0.07775251  368  ARG   A HD3  
4857  H  HE   . ARG   A  313 ? 0.37690920 0.25058481 0.22741798 -0.09721460 -0.05348916 0.07130563  368  ARG   A HE   
4858  H  HH11 . ARG   A  313 ? 0.38913852 0.24208465 0.21134160 -0.11169777 -0.05231190 0.08313084  368  ARG   A HH11 
4859  H  HH12 . ARG   A  313 ? 0.37980229 0.24886420 0.20691215 -0.11500034 -0.04573005 0.08140382  368  ARG   A HH12 
4860  H  HH21 . ARG   A  313 ? 0.40033668 0.28077072 0.23688853 -0.10110215 -0.04962087 0.07586557  368  ARG   A HH21 
4861  H  HH22 . ARG   A  313 ? 0.38519478 0.27506536 0.23497440 -0.09878976 -0.04793025 0.07127222  368  ARG   A HH22 
4862  N  N    . THR   A  314 ? 0.43839306 0.25625932 0.28106615 -0.07502902 -0.07758600 0.06957457  369  THR   A N    
4863  C  CA   . THR   A  314 ? 0.45936400 0.27971834 0.31017640 -0.06659159 -0.07997271 0.06490087  369  THR   A CA   
4864  C  C    . THR   A  314 ? 0.41259542 0.22379234 0.26364622 -0.06664921 -0.08078667 0.06256586  369  THR   A C    
4865  O  O    . THR   A  314 ? 0.45016211 0.24507588 0.29227409 -0.06877646 -0.08385277 0.06537385  369  THR   A O    
4866  C  CB   . THR   A  314 ? 0.45343408 0.26699987 0.30147052 -0.05914295 -0.08596479 0.06600771  369  THR   A CB   
4867  O  OG1  . THR   A  314 ? 0.42443573 0.24426174 0.27020055 -0.05975311 -0.08592585 0.06855769  369  THR   A OG1  
4868  C  CG2  . THR   A  314 ? 0.43761551 0.25771236 0.29593033 -0.05038748 -0.08751786 0.06076622  369  THR   A CG2  
4869  H  H    . THR   A  314 ? 0.46516299 0.27179262 0.30023149 -0.07753043 -0.07945455 0.07251316  369  THR   A H    
4870  H  HA   . THR   A  314 ? 0.42646390 0.25916153 0.28468329 -0.06543949 -0.07725751 0.06225210  369  THR   A HA   
4871  H  HB   . THR   A  314 ? 0.46293402 0.26316807 0.30367208 -0.05963768 -0.08905478 0.06841141  369  THR   A HB   
4873  H  HG21 . THR   A  314 ? 0.44427091 0.26214465 0.30180776 -0.04576708 -0.09119485 0.06145164  369  THR   A HG21 
4874  H  HG22 . THR   A  314 ? 0.42647487 0.25897688 0.29169923 -0.05050747 -0.08423413 0.05840701  369  THR   A HG22 
4875  H  HG23 . THR   A  314 ? 0.44381326 0.25800037 0.30258137 -0.04924041 -0.08814657 0.05897478  369  THR   A HG23 
4876  N  N    . GLU   A  315 ? 0.40122664 0.22230615 0.26165172 -0.06469639 -0.07806920 0.05753826  370  GLU   A N    
4877  C  CA   . GLU   A  315 ? 0.46148390 0.27508515 0.32304791 -0.06264643 -0.07929116 0.05404808  370  GLU   A CA   
4878  C  C    . GLU   A  315 ? 0.48018986 0.29028073 0.34481514 -0.05265797 -0.08336315 0.05103122  370  GLU   A C    
4879  O  O    . GLU   A  315 ? 0.47577286 0.29735273 0.34737700 -0.04736284 -0.08309291 0.04924769  370  GLU   A O    
4880  C  CB   . GLU   A  315 ? 0.45444280 0.28129405 0.32431746 -0.06488526 -0.07447079 0.04993077  370  GLU   A CB   
4881  C  CG   . GLU   A  315 ? 0.41418973 0.24357906 0.28203493 -0.07436552 -0.07094404 0.05203798  370  GLU   A CG   
4882  C  CD   . GLU   A  315 ? 0.44240317 0.26051378 0.30583805 -0.07926512 -0.07172027 0.05162095  370  GLU   A CD   
4883  O  OE1  . GLU   A  315 ? 0.48337418 0.28809360 0.34306052 -0.07552080 -0.07548740 0.05022862  370  GLU   A OE1  
4884  O  OE2  . GLU   A  315 ? 0.48348749 0.30631799 0.34743223 -0.08688152 -0.06865765 0.05251756  370  GLU   A OE2  
4885  H  H    . GLU   A  315 ? 0.40111601 0.23383421 0.26703513 -0.06468391 -0.07534733 0.05619204  370  GLU   A H    
4886  H  HA   . GLU   A  315 ? 0.46448311 0.26691353 0.31940913 -0.06640100 -0.08056611 0.05617858  370  GLU   A HA   
4887  H  HB2  . GLU   A  315 ? 0.43164709 0.26955491 0.30727047 -0.06229973 -0.07287498 0.04856319  370  GLU   A HB2  
4888  H  HB3  . GLU   A  315 ? 0.44571865 0.26881453 0.31688547 -0.06230919 -0.07537721 0.04696297  370  GLU   A HB3  
4889  H  HG2  . GLU   A  315 ? 0.42981324 0.25764042 0.29340917 -0.07734934 -0.07088502 0.05561301  370  GLU   A HG2  
4890  H  HG3  . GLU   A  315 ? 0.41414279 0.25527760 0.28797597 -0.07489085 -0.06792169 0.05022321  370  GLU   A HG3  
4891  N  N    . PHE   A  316 ? 0.44169545 0.23624605 0.30152476 -0.05024340 -0.08699407 0.05014937  371  PHE   A N    
4892  C  CA   . PHE   A  316 ? 0.40681946 0.19645843 0.26928288 -0.04044582 -0.09102859 0.04692797  371  PHE   A CA   
4893  C  C    . PHE   A  316 ? 0.43302366 0.22179154 0.29948840 -0.03788470 -0.08973999 0.04108606  371  PHE   A C    
4894  O  O    . PHE   A  316 ? 0.43436950 0.21189871 0.29504433 -0.04248609 -0.08989374 0.04101851  371  PHE   A O    
4895  C  CB   . PHE   A  316 ? 0.42901850 0.19878009 0.28120536 -0.03845812 -0.09725869 0.05081193  371  PHE   A CB   
4896  C  CG   . PHE   A  316 ? 0.47838140 0.24879165 0.32605812 -0.03960222 -0.09921182 0.05627011  371  PHE   A CG   
4897  C  CD1  . PHE   A  316 ? 0.54604900 0.32586616 0.39970255 -0.03245779 -0.10123222 0.05543182  371  PHE   A CD1  
4898  C  CD2  . PHE   A  316 ? 0.62526959 0.38822982 0.46291012 -0.04839033 -0.09863225 0.06207470  371  PHE   A CD2  
4899  C  CE1  . PHE   A  316 ? 0.52719820 0.30769557 0.37596130 -0.03384152 -0.10320828 0.06029486  371  PHE   A CE1  
4900  C  CE2  . PHE   A  316 ? 0.56592798 0.32963839 0.39841336 -0.04964568 -0.10011950 0.06692202  371  PHE   A CE2  
4901  C  CZ   . PHE   A  316 ? 0.53726816 0.30957019 0.37508720 -0.04235597 -0.10251643 0.06594860  371  PHE   A CZ   
4902  H  H    . PHE   A  316 ? 0.45000854 0.23655704 0.30474335 -0.05497861 -0.08694627 0.05150698  371  PHE   A H    
4903  H  HA   . PHE   A  316 ? 0.41088903 0.21064323 0.27910554 -0.03648601 -0.09073061 0.04593334  371  PHE   A HA   
4904  H  HB2  . PHE   A  316 ? 0.44945103 0.20892784 0.29539338 -0.04326065 -0.09744208 0.05225875  371  PHE   A HB2  
4905  H  HB3  . PHE   A  316 ? 0.44393450 0.21012716 0.29832053 -0.03158119 -0.09998250 0.04818067  371  PHE   A HB3  
4906  H  HD1  . PHE   A  316 ? 0.51597178 0.30187261 0.37691009 -0.02678506 -0.10129055 0.05148346  371  PHE   A HD1  
4907  H  HD2  . PHE   A  316 ? 0.57302523 0.33032042 0.40709192 -0.05369148 -0.09721114 0.06267001  371  PHE   A HD2  
4908  H  HE1  . PHE   A  316 ? 0.52802682 0.31490931 0.38093618 -0.02909981 -0.10492210 0.05959763  371  PHE   A HE1  
4909  H  HE2  . PHE   A  316 ? 0.57808483 0.33677369 0.40338391 -0.05576024 -0.09938622 0.07078522  371  PHE   A HE2  
4910  H  HZ   . PHE   A  316 ? 0.54456168 0.31697345 0.37833852 -0.04325923 -0.10379882 0.06913735  371  PHE   A HZ   
4911  N  N    . LEU   A  317 ? 0.41354501 0.21398258 0.28951889 -0.03074477 -0.08852065 0.03613374  372  LEU   A N    
4912  C  CA   . LEU   A  317 ? 0.43416110 0.23475367 0.31390241 -0.02716051 -0.08713489 0.03004683  372  LEU   A CA   
4913  C  C    . LEU   A  317 ? 0.48351133 0.26442429 0.35656190 -0.02313012 -0.09180778 0.02872281  372  LEU   A C    
4914  O  O    . LEU   A  317 ? 0.48867097 0.26389998 0.36026460 -0.02351495 -0.09094030 0.02483465  372  LEU   A O    
4915  C  CB   . LEU   A  317 ? 0.39466915 0.21102525 0.28547025 -0.01950015 -0.08533890 0.02549791  372  LEU   A CB   
4916  C  CG   . LEU   A  317 ? 0.41931182 0.25438657 0.31694984 -0.02297915 -0.08061001 0.02583392  372  LEU   A CG   
4917  C  CD1  . LEU   A  317 ? 0.42421311 0.27305856 0.33202326 -0.01600757 -0.07892919 0.02129780  372  LEU   A CD1  
4918  C  CD2  . LEU   A  317 ? 0.51830333 0.35688290 0.41472471 -0.03067562 -0.07636556 0.02538738  372  LEU   A CD2  
4919  H  H    . LEU   A  317 ? 0.41351911 0.22222099 0.29360944 -0.02812760 -0.08848865 0.03650751  372  LEU   A H    
4920  H  HA   . LEU   A  317 ? 0.42572349 0.22927937 0.30522519 -0.03237787 -0.08420746 0.02949817  372  LEU   A HA   
4921  H  HB2  . LEU   A  317 ? 0.41436040 0.22881898 0.30599350 -0.01455832 -0.08838841 0.02619193  372  LEU   A HB2  
4922  H  HB3  . LEU   A  317 ? 0.41195178 0.22749519 0.30449781 -0.01674419 -0.08449528 0.02137948  372  LEU   A HB3  
4923  H  HG   . LEU   A  317 ? 0.42607760 0.26221603 0.32219070 -0.02494462 -0.08155318 0.02954030  372  LEU   A HG   
4924  H  HD11 . LEU   A  317 ? 0.40918726 0.26919883 0.32092610 -0.01837566 -0.07618864 0.02183458  372  LEU   A HD11 
4925  H  HD12 . LEU   A  317 ? 0.42124721 0.26968020 0.33035922 -0.01415140 -0.07759812 0.01752889  372  LEU   A HD12 
4926  H  HD13 . LEU   A  317 ? 0.42532814 0.27240089 0.33444729 -0.01103089 -0.08192691 0.02152773  372  LEU   A HD13 
4927  H  HD21 . LEU   A  317 ? 0.48328346 0.31661254 0.37461224 -0.03590643 -0.07687653 0.02888335  372  LEU   A HD21 
4928  H  HD22 . LEU   A  317 ? 0.48442441 0.31832302 0.37983504 -0.02966937 -0.07622748 0.02236698  372  LEU   A HD22 
4929  H  HD23 . LEU   A  317 ? 0.46809870 0.31886554 0.36977232 -0.03139836 -0.07336515 0.02457552  372  LEU   A HD23 
4930  N  N    . SER   A  318 ? 0.48321444 0.25314191 0.35166624 -0.01914823 -0.09708281 0.03197215  373  SER   A N    
4931  C  CA   . SER   A  318 ? 0.47214025 0.22117546 0.33300877 -0.01534253 -0.10224874 0.03154507  373  SER   A CA   
4932  C  C    . SER   A  318 ? 0.47079736 0.20405237 0.32129812 -0.02405830 -0.10249790 0.03374860  373  SER   A C    
4933  O  O    . SER   A  318 ? 0.62568974 0.34166464 0.47024924 -0.02144921 -0.10599993 0.03204917  373  SER   A O    
4934  C  CB   . SER   A  318 ? 0.50530469 0.24513495 0.36208194 -0.01030703 -0.10831739 0.03576233  373  SER   A CB   
4935  O  OG   . SER   A  318 ? 0.57020545 0.31036896 0.42134425 -0.01760163 -0.10833982 0.04255173  373  SER   A OG   
4936  H  H    . SER   A  318 ? 0.47335151 0.24864893 0.34321922 -0.01861688 -0.09768617 0.03448604  373  SER   A H    
4937  H  HA   . SER   A  318 ? 0.47928381 0.22976351 0.34444857 -0.00964066 -0.10200597 0.02663046  373  SER   A HA   
4938  H  HB2  . SER   A  318 ? 0.52981257 0.25416103 0.38060093 -0.00817490 -0.11197395 0.03583914  373  SER   A HB2  
4939  H  HB3  . SER   A  318 ? 0.50805980 0.25685522 0.37195453 -0.00373406 -0.10881138 0.03351941  373  SER   A HB3  
4941  N  N    . ASN   A  319 ? 0.47436252 0.21320017 0.32278329 -0.03425369 -0.09901360 0.03742520  374  ASN   A N    
4942  C  CA   . ASN   A  319 ? 0.51192945 0.23834637 0.35208976 -0.04328915 -0.09877286 0.03910764  374  ASN   A CA   
4943  C  C    . ASN   A  319 ? 0.49400437 0.22549526 0.33798563 -0.04537739 -0.09533994 0.03345245  374  ASN   A C    
4944  O  O    . ASN   A  319 ? 0.51387352 0.23555325 0.35173488 -0.05282243 -0.09540540 0.03411204  374  ASN   A O    
4945  C  CB   . ASN   A  319 ? 0.52734435 0.25882354 0.36433268 -0.05378537 -0.09610780 0.04509470  374  ASN   A CB   
4946  C  CG   . ASN   A  319 ? 0.54936677 0.27386209 0.37973088 -0.05398083 -0.09930602 0.05144851  374  ASN   A CG   
4947  O  OD1  . ASN   A  319 ? 0.61774528 0.32529697 0.44099873 -0.04989673 -0.10465747 0.05314396  374  ASN   A OD1  
4948  N  ND2  . ASN   A  319 ? 0.56504846 0.30245775 0.39744109 -0.05832300 -0.09619536 0.05481889  374  ASN   A ND2  
4949  H  H    . ASN   A  319 ? 0.46633625 0.21692313 0.31864423 -0.03566701 -0.09682200 0.03887344  374  ASN   A H    
4950  H  HA   . ASN   A  319 ? 0.52451468 0.23499879 0.35783735 -0.04199161 -0.10268733 0.04024274  374  ASN   A HA   
4951  H  HB2  . ASN   A  319 ? 0.51003659 0.25681865 0.35372311 -0.05467568 -0.09245825 0.04396608  374  ASN   A HB2  
4952  H  HB3  . ASN   A  319 ? 0.53161985 0.25611201 0.36414784 -0.05996763 -0.09571852 0.04579838  374  ASN   A HB3  
4953  H  HD21 . ASN   A  319 ? 0.54444420 0.29247710 0.38111919 -0.06196111 -0.09245837 0.05383550  374  ASN   A HD21 
4954  H  HD22 . ASN   A  319 ? 0.55980796 0.29516542 0.38908219 -0.05753353 -0.09791341 0.05803242  374  ASN   A HD22 
4955  N  N    . TYR   A  320 ? 0.53302383 0.28051713 0.38684976 -0.03963443 -0.09225582 0.02829868  375  TYR   A N    
4956  C  CA   . TYR   A  320 ? 0.47743881 0.23222837 0.33500457 -0.04142571 -0.08864403 0.02303569  375  TYR   A CA   
4957  C  C    . TYR   A  320 ? 0.47060519 0.22255291 0.33079404 -0.03192466 -0.08953302 0.01622348  375  TYR   A C    
4958  O  O    . TYR   A  320 ? 0.51926661 0.26572442 0.37705913 -0.03278694 -0.08899161 0.01175534  375  TYR   A O    
4959  C  CB   . TYR   A  320 ? 0.45411873 0.23136456 0.32050735 -0.04378460 -0.08341237 0.02288054  375  TYR   A CB   
4960  C  CG   . TYR   A  320 ? 0.45290983 0.23531339 0.31783795 -0.05291097 -0.08165888 0.02860470  375  TYR   A CG   
4961  C  CD1  . TYR   A  320 ? 0.43462607 0.21842277 0.29859108 -0.05300113 -0.08268957 0.03371501  375  TYR   A CD1  
4962  C  CD2  . TYR   A  320 ? 0.52066201 0.30713373 0.38528973 -0.06128079 -0.07898749 0.02867724  375  TYR   A CD2  
4963  C  CE1  . TYR   A  320 ? 0.44139615 0.22988117 0.30356276 -0.06125293 -0.08065706 0.03861286  375  TYR   A CE1  
4964  C  CE2  . TYR   A  320 ? 0.52761829 0.32002068 0.39180472 -0.06929316 -0.07701962 0.03350081  375  TYR   A CE2  
4965  C  CZ   . TYR   A  320 ? 0.49295256 0.28607926 0.35563612 -0.06934381 -0.07761239 0.03839790  375  TYR   A CZ   
4966  O  OH   . TYR   A  320 ? 0.44337529 0.24258165 0.30531293 -0.07739159 -0.07513395 0.04271861  375  TYR   A OH   
4967  H  H    . TYR   A  320 ? 0.50035191 0.25478828 0.35855246 -0.03472736 -0.09239221 0.02823728  375  TYR   A H    
4968  H  HA   . TYR   A  320 ? 0.49018198 0.23719351 0.34265125 -0.04742814 -0.08897915 0.02382448  375  TYR   A HA   
4969  H  HB2  . TYR   A  320 ? 0.44926965 0.23390201 0.32055706 -0.03832198 -0.08315022 0.02219781  375  TYR   A HB2  
4970  H  HB3  . TYR   A  320 ? 0.45197743 0.23348695 0.32040724 -0.04440989 -0.08136103 0.01933628  375  TYR   A HB3  
4971  H  HD1  . TYR   A  320 ? 0.44561100 0.22675341 0.30982524 -0.04736765 -0.08492741 0.03378170  375  TYR   A HD1  
4972  H  HD2  . TYR   A  320 ? 0.50324517 0.28885546 0.36812806 -0.06142426 -0.07850517 0.02523669  375  TYR   A HD2  
4973  H  HE1  . TYR   A  320 ? 0.45087171 0.23985429 0.31164390 -0.06127224 -0.08133055 0.04190697  375  TYR   A HE1  
4974  H  HE2  . TYR   A  320 ? 0.51116621 0.30678496 0.37578949 -0.07472388 -0.07539108 0.03336038  375  TYR   A HE2  
4976  N  N    . LEU   A  321 ? 0.47574246 0.23227823 0.34108454 -0.02291863 -0.09084930 0.01534983  376  LEU   A N    
4977  C  CA   . LEU   A  321 ? 0.48638171 0.24580756 0.35707420 -0.01307697 -0.09060016 0.00871031  376  LEU   A CA   
4978  C  C    . LEU   A  321 ? 0.55538309 0.29784572 0.42182645 -0.00533944 -0.09648608 0.00862471  376  LEU   A C    
4979  O  O    . LEU   A  321 ? 0.57327759 0.31075311 0.43727773 -0.00486156 -0.10007250 0.01389263  376  LEU   A O    
4980  C  CB   . LEU   A  321 ? 0.52480400 0.30588904 0.40679675 -0.00867057 -0.08724420 0.00759189  376  LEU   A CB   
4981  C  CG   . LEU   A  321 ? 0.51646852 0.31507531 0.40338370 -0.01498064 -0.08171499 0.00786575  376  LEU   A CG   
4982  C  CD1  . LEU   A  321 ? 0.48352197 0.30017197 0.38031793 -0.01067573 -0.07941684 0.00745459  376  LEU   A CD1  
4983  C  CD2  . LEU   A  321 ? 0.62274778 0.42261034 0.50903344 -0.01654400 -0.07858524 0.00255268  376  LEU   A CD2  
4984  H  H    . LEU   A  321 ? 0.47469014 0.23317418 0.34041458 -0.02295428 -0.09190760 0.01899954  376  LEU   A H    
4985  H  HA   . LEU   A  321 ? 0.50486171 0.26300919 0.37447518 -0.01422815 -0.08896474 0.00505894  376  LEU   A HA   
4986  H  HB2  . LEU   A  321 ? 0.51267087 0.29401049 0.39524564 -0.00737313 -0.08934259 0.01100893  376  LEU   A HB2  
4987  H  HB3  . LEU   A  321 ? 0.51408088 0.29728562 0.39982468 -0.00211817 -0.08695512 0.00313436  376  LEU   A HB3  
4988  H  HG   . LEU   A  321 ? 0.52601159 0.32291755 0.40953803 -0.02136841 -0.08184510 0.01203528  376  LEU   A HG   
4989  H  HD11 . LEU   A  321 ? 0.47751033 0.30407062 0.37664604 -0.01515220 -0.07628737 0.00841098  376  LEU   A HD11 
4990  H  HD12 . LEU   A  321 ? 0.48941115 0.30963865 0.39023650 -0.00503417 -0.07855196 0.00314328  376  LEU   A HD12 
4991  H  HD13 . LEU   A  321 ? 0.49072754 0.30574033 0.38756293 -0.00908574 -0.08195231 0.01048759  376  LEU   A HD13 
4992  H  HD21 . LEU   A  321 ? 0.59269583 0.38146943 0.47256786 -0.02051737 -0.08009216 0.00317106  376  LEU   A HD21 
4993  H  HD22 . LEU   A  321 ? 0.58897102 0.38898152 0.47756511 -0.01033478 -0.07844817 -0.00172773 376  LEU   A HD22 
4994  H  HD23 . LEU   A  321 ? 0.57302523 0.38456273 0.46280646 -0.01983552 -0.07526167 0.00272215  376  LEU   A HD23 
4995  N  N    . THR   A  322 ? 0.55714524 0.29064381 0.42232862 0.00084870  -0.09753118 0.00251958  377  THR   A N    
4996  C  CA   . THR   A  322 ? 0.63063061 0.35172850 0.49474776 0.01101027  -0.10262741 0.00073230  377  THR   A CA   
4997  C  C    . THR   A  322 ? 0.77668500 0.51651645 0.65338838 0.02045044  -0.10037436 -0.00348777 377  THR   A C    
4998  O  O    . THR   A  322 ? 0.64776826 0.40594211 0.53181452 0.01899353  -0.09466772 -0.00642503 377  THR   A O    
4999  C  CB   . THR   A  322 ? 0.74544555 0.44748509 0.60175776 0.01262456  -0.10467048 -0.00391464 377  THR   A CB   
5000  O  OG1  . THR   A  322 ? 0.66755891 0.38056704 0.52893257 0.01467852  -0.09969715 -0.01117068 377  THR   A OG1  
5001  C  CG2  . THR   A  322 ? 0.83776325 0.52327752 0.68230420 0.00139632  -0.10633857 0.00039530  377  THR   A CG2  
5002  H  H    . THR   A  322 ? 0.57166332 0.30675420 0.43654537 -0.00112206 -0.09508064 -0.00077276 377  THR   A H    
5003  H  HA   . THR   A  322 ? 0.66288692 0.37660077 0.52319342 0.01003321  -0.10609525 0.00558221  377  THR   A HA   
5004  H  HB   . THR   A  322 ? 0.73557991 0.42816687 0.59083050 0.01970976  -0.10843956 -0.00496183 377  THR   A HB   
5006  H  HG21 . THR   A  322 ? 0.82560033 0.49744910 0.66477484 0.00288120  -0.10827781 -0.00260335 377  THR   A HG21 
5007  H  HG22 . THR   A  322 ? 0.79760385 0.49248788 0.64360321 -0.00508252 -0.10271168 0.00074151  377  THR   A HG22 
5008  H  HG23 . THR   A  322 ? 0.81603837 0.49537957 0.65696537 -0.00079625 -0.10912737 0.00572252  377  THR   A HG23 
5009  N  N    . ASN   A  323 ? 0.67412138 0.40908369 0.55318546 0.02993006  -0.10509219 -0.00361194 378  ASN   A N    
5010  C  CA   . ASN   A  323 ? 0.76212680 0.51454449 0.65385973 0.03931135  -0.10373832 -0.00749196 378  ASN   A CA   
5011  C  C    . ASN   A  323 ? 0.60618854 0.38085961 0.50595051 0.03447865  -0.09953128 -0.00453307 378  ASN   A C    
5012  O  O    . ASN   A  323 ? 0.66034073 0.45336208 0.56982470 0.03683504  -0.09462483 -0.00882029 378  ASN   A O    
5013  C  CB   . ASN   A  323 ? 0.65862179 0.41626191 0.55557680 0.04599284  -0.10000108 -0.01655135 378  ASN   A CB   
5014  C  CG   . ASN   A  323 ? 0.70868748 0.44492108 0.59891844 0.05292329  -0.10444154 -0.02050367 378  ASN   A CG   
5015  O  OD1  . ASN   A  323 ? 0.78832459 0.51420218 0.67181063 0.05058645  -0.10297746 -0.02438852 378  ASN   A OD1  
5016  N  ND2  . ASN   A  323 ? 0.77391934 0.50267094 0.66564280 0.06181932  -0.11027683 -0.01978523 378  ASN   A ND2  
5017  H  H    . ASN   A  323 ? 0.73144138 0.45165950 0.60404307 0.03050681  -0.10945678 -0.00113945 378  ASN   A H    
5018  H  HA   . ASN   A  323 ? 0.70416057 0.45038164 0.59595537 0.04498425  -0.10828370 -0.00625786 378  ASN   A HA   
5019  H  HB2  . ASN   A  323 ? 0.67916530 0.44135684 0.57492620 0.04041392  -0.09592421 -0.01777236 378  ASN   A HB2  
5020  H  HB3  . ASN   A  323 ? 0.67831492 0.44947097 0.58437127 0.05132066  -0.09855196 -0.01880113 378  ASN   A HB3  
5021  H  HD21 . ASN   A  323 ? 0.74909472 0.48723891 0.64678001 0.06421172  -0.11105735 -0.01793634 378  ASN   A HD21 
5022  H  HD22 . ASN   A  323 ? 0.77199161 0.48606953 0.65867412 0.06551633  -0.11365132 -0.02116718 378  ASN   A HD22 
5023  N  N    . VAL   A  324 ? 0.68074977 0.45290080 0.57597947 0.02804668  -0.10169918 0.00282043  379  VAL   A N    
5024  C  CA   . VAL   A  324 ? 0.57980478 0.37047476 0.48121351 0.02340000  -0.09852970 0.00611628  379  VAL   A CA   
5025  C  C    . VAL   A  324 ? 0.55045104 0.35587394 0.46337438 0.03192907  -0.09947193 0.00426218  379  VAL   A C    
5026  O  O    . VAL   A  324 ? 0.61216140 0.43452996 0.53177983 0.02923134  -0.09662825 0.00574248  379  VAL   A O    
5027  C  CB   . VAL   A  324 ? 0.57965994 0.36094713 0.47183529 0.01535590  -0.10128079 0.01412373  379  VAL   A CB   
5028  C  CG1  . VAL   A  324 ? 0.67683756 0.45013592 0.56684941 0.02076870  -0.10803109 0.01808931  379  VAL   A CG1  
5029  C  CG2  . VAL   A  324 ? 0.63797295 0.43472230 0.53312248 0.00734799  -0.09660228 0.01702372  379  VAL   A CG2  
5030  H  H    . VAL   A  324 ? 0.65339649 0.41127795 0.54102063 0.02650919  -0.10530935 0.00585534  379  VAL   A H    
5031  H  HA   . VAL   A  324 ? 0.57955819 0.37875548 0.48314303 0.01951690  -0.09395643 0.00430592  379  VAL   A HA   
5032  H  HB   . VAL   A  324 ? 0.61858171 0.38723621 0.50316811 0.01160794  -0.10195662 0.01484179  379  VAL   A HB   
5033  H  HG11 . VAL   A  324 ? 0.63892210 0.42484066 0.53583276 0.02311756  -0.10757818 0.01816150  379  VAL   A HG11 
5034  H  HG12 . VAL   A  324 ? 0.66023302 0.42462212 0.54953861 0.02710859  -0.11112654 0.01567696  379  VAL   A HG12 
5035  H  HG13 . VAL   A  324 ? 0.65450990 0.41885865 0.53673393 0.01548977  -0.10980377 0.02294499  379  VAL   A HG13 
5036  H  HG21 . VAL   A  324 ? 0.61390191 0.40486908 0.50319922 0.00260297  -0.09818163 0.02182860  379  VAL   A HG21 
5037  H  HG22 . VAL   A  324 ? 0.60615718 0.40628946 0.50157207 0.00361762  -0.09289877 0.01499638  379  VAL   A HG22 
5038  H  HG23 . VAL   A  324 ? 0.60152817 0.41077980 0.50409377 0.01052465  -0.09569557 0.01610284  379  VAL   A HG23 
5039  N  N    . ASP   A  325 ? 0.63633078 0.43508491 0.55168945 0.04227398  -0.10382023 0.00104119  380  ASP   A N    
5040  C  CA   . ASP   A  325 ? 0.65009737 0.46287805 0.57719564 0.05088674  -0.10545011 -0.00090764 380  ASP   A CA   
5041  C  C    . ASP   A  325 ? 0.66227591 0.49542528 0.60178769 0.05426833  -0.09910347 -0.00775274 380  ASP   A C    
5042  O  O    . ASP   A  325 ? 0.67317396 0.52213967 0.62408841 0.05963856  -0.09906705 -0.00950450 380  ASP   A O    
5043  C  CB   . ASP   A  325 ? 0.62851214 0.42722309 0.55436844 0.06133389  -0.11274617 -0.00196463 380  ASP   A CB   
5044  C  CG   . ASP   A  325 ? 0.76652980 0.54828250 0.68178928 0.05921178  -0.11982462 0.00555010  380  ASP   A CG   
5045  O  OD1  . ASP   A  325 ? 0.77725577 0.56739497 0.69408417 0.05623532  -0.12117682 0.01041624  380  ASP   A OD1  
5046  O  OD2  . ASP   A  325 ? 1.17386055 0.93344009 1.07847595 0.06004244  -0.12391742 0.00663502  380  ASP   A OD2  
5047  H  H    . ASP   A  325 ? 0.63407242 0.41909710 0.54376042 0.04406390  -0.10605317 0.00003469  380  ASP   A H    
5048  H  HA   . ASP   A  325 ? 0.63738823 0.45584321 0.56524837 0.04776336  -0.10626561 0.00315610  380  ASP   A HA   
5049  H  HB2  . ASP   A  325 ? 0.67470026 0.46412185 0.59741247 0.06365748  -0.11248841 -0.00535895 380  ASP   A HB2  
5050  H  HB3  . ASP   A  325 ? 0.66051984 0.47030219 0.59571987 0.06769102  -0.11326659 -0.00448650 380  ASP   A HB3  
5051  N  N    . ASP   A  326 ? 0.62201220 0.45466807 0.55889690 0.05070442  -0.09379952 -0.01153597 381  ASP   A N    
5052  C  CA   . ASP   A  326 ? 0.65543878 0.50617778 0.60172248 0.05225068  -0.08707210 -0.01754496 381  ASP   A CA   
5053  C  C    . ASP   A  326 ? 0.58136141 0.45031959 0.53265661 0.04468476  -0.08228821 -0.01480621 381  ASP   A C    
5054  O  O    . ASP   A  326 ? 0.69201875 0.57746649 0.65163350 0.04549625  -0.07685433 -0.01889123 381  ASP   A O    
5055  C  CB   . ASP   A  326 ? 0.59792006 0.44008067 0.53739530 0.05010855  -0.08346976 -0.02201446 381  ASP   A CB   
5056  C  CG   . ASP   A  326 ? 0.83760822 0.66253781 0.77259248 0.05804364  -0.08727482 -0.02621705 381  ASP   A CG   
5057  O  OD1  . ASP   A  326 ? 0.69974566 0.52368677 0.64021653 0.06754275  -0.09164704 -0.02747149 381  ASP   A OD1  
5058  O  OD2  . ASP   A  326 ? 0.77465045 0.58649743 0.70045418 0.05491133  -0.08622781 -0.02842679 381  ASP   A OD2  
5059  H  H    . ASP   A  326 ? 0.64753890 0.46786642 0.57610387 0.04701447  -0.09448146 -0.01029891 381  ASP   A H    
5060  H  HA   . ASP   A  326 ? 0.62677258 0.48331627 0.58038664 0.05972677  -0.08789305 -0.02085908 381  ASP   A HA   
5061  H  HB2  . ASP   A  326 ? 0.65374810 0.48966041 0.58614820 0.04288768  -0.08321724 -0.01869074 381  ASP   A HB2  
5062  H  HB3  . ASP   A  326 ? 0.64674383 0.50109023 0.59151351 0.05028416  -0.07869460 -0.02557568 381  ASP   A HB3  
5063  N  N    . ILE   A  327 ? 0.53535795 0.40067458 0.48083028 0.03696673  -0.08396112 -0.00803369 382  ILE   A N    
5064  C  CA   . ILE   A  327 ? 0.56084484 0.44041958 0.50895828 0.02905542  -0.07913418 -0.00573762 382  ILE   A CA   
5065  C  C    . ILE   A  327 ? 0.54607421 0.43470207 0.49913359 0.02871848  -0.08160488 -0.00148117 382  ILE   A C    
5066  O  O    . ILE   A  327 ? 0.47092074 0.35030445 0.42085099 0.03148609  -0.08761944 0.00186983  382  ILE   A O    
5067  C  CB   . ILE   A  327 ? 0.61235344 0.48370975 0.55044132 0.01914951  -0.07723707 -0.00236797 382  ILE   A CB   
5068  C  CG1  . ILE   A  327 ? 0.56772399 0.42536843 0.49696434 0.01500460  -0.08206569 0.00411951  382  ILE   A CG1  
5069  C  CG2  . ILE   A  327 ? 0.53891337 0.40135798 0.47171757 0.01894224  -0.07517290 -0.00674140 382  ILE   A CG2  
5070  C  CD1  . ILE   A  327 ? 0.74790794 0.60287988 0.67023134 0.00483734  -0.07947253 0.00758244  382  ILE   A CD1  
5071  H  H    . ILE   A  327 ? 0.56386828 0.41758922 0.50348103 0.03664325  -0.08804719 -0.00487835 382  ILE   A H    
5072  H  HA   . ILE   A  327 ? 0.55279160 0.44276914 0.50657338 0.03036483  -0.07518856 -0.00952041 382  ILE   A HA   
5073  H  HB   . ILE   A  327 ? 0.56378543 0.44597518 0.50485790 0.01501468  -0.07380333 -0.00161383 382  ILE   A HB   
5074  H  HG12 . ILE   A  327 ? 0.62870884 0.47380662 0.55355173 0.01815017  -0.08541767 0.00369998  382  ILE   A HG12 
5075  H  HG13 . ILE   A  327 ? 0.61154830 0.47423095 0.54379106 0.01597190  -0.08381117 0.00652295  382  ILE   A HG13 
5076  H  HG21 . ILE   A  327 ? 0.57437754 0.42422727 0.50287968 0.02206887  -0.07867882 -0.00711319 382  ILE   A HG21 
5077  H  HG22 . ILE   A  327 ? 0.55954695 0.43044680 0.49761450 0.02212539  -0.07214532 -0.01103055 382  ILE   A HG22 
5078  H  HG23 . ILE   A  327 ? 0.55963445 0.42038536 0.48790267 0.01246567  -0.07344396 -0.00497500 382  ILE   A HG23 
5079  H  HD11 . ILE   A  327 ? 0.68519998 0.53317130 0.60352361 0.00366114  -0.07870063 0.00564850  382  ILE   A HD11 
5080  H  HD12 . ILE   A  327 ? 0.66852158 0.53540844 0.59510320 0.00213039  -0.07599914 0.00745725  382  ILE   A HD12 
5081  H  HD13 . ILE   A  327 ? 0.68141139 0.52973723 0.59890723 0.00205624  -0.08209383 0.01185748  382  ILE   A HD13 
5082  N  N    . THR   A  328 ? 0.44114292 0.34743333 0.40147671 0.02536771  -0.07701348 -0.00185943 383  THR   A N    
5083  C  CA   . THR   A  328 ? 0.46142066 0.37627503 0.42464012 0.02224159  -0.07829926 0.00246189  383  THR   A CA   
5084  C  C    . THR   A  328 ? 0.34880465 0.26224986 0.30505705 0.01234259  -0.07548112 0.00661546  383  THR   A C    
5085  O  O    . THR   A  328 ? 0.43153208 0.34987956 0.38784814 0.00834139  -0.07031646 0.00471379  383  THR   A O    
5086  C  CB   . THR   A  328 ? 0.43054691 0.36534032 0.40663731 0.02511885  -0.07531980 -0.00093551 383  THR   A CB   
5087  O  OG1  . THR   A  328 ? 0.50643128 0.44226533 0.48933572 0.03477298  -0.07871109 -0.00452096 383  THR   A OG1  
5088  C  CG2  . THR   A  328 ? 0.38514584 0.32993674 0.36422780 0.02070723  -0.07588083 0.00302424  383  THR   A CG2  
5089  H  H    . THR   A  328 ? 0.46274102 0.37550688 0.42589641 0.02492939  -0.07296023 -0.00498599 383  THR   A H    
5090  H  HA   . THR   A  328 ? 0.43815026 0.34635234 0.39926130 0.02475192  -0.08305305 0.00474943  383  THR   A HA   
5091  H  HB   . THR   A  328 ? 0.43388921 0.37413326 0.41155887 0.02330642  -0.07067063 -0.00353038 383  THR   A HB   
5093  H  HG21 . THR   A  328 ? 0.38951218 0.34613431 0.37712955 0.02316150  -0.07484931 0.00078492  383  THR   A HG21 
5094  H  HG22 . THR   A  328 ? 0.40021357 0.33828995 0.37577268 0.02141829  -0.08033864 0.00608092  383  THR   A HG22 
5095  H  HG23 . THR   A  328 ? 0.38789123 0.33378947 0.36369359 0.01471946  -0.07287669 0.00463494  383  THR   A HG23 
5096  N  N    . LEU   A  329 ? 0.44120467 0.34810987 0.39136666 0.00866940  -0.07893527 0.01216777  384  LEU   A N    
5097  C  CA   . LEU   A  329 ? 0.43056485 0.33789396 0.37531343 -0.00021730 -0.07620714 0.01595769  384  LEU   A CA   
5098  C  C    . LEU   A  329 ? 0.35183579 0.26945832 0.30005306 -0.00232372 -0.07665458 0.01879709  384  LEU   A C    
5099  O  O    . LEU   A  329 ? 0.36181277 0.27612868 0.30899158 0.00041705  -0.08153489 0.02119844  384  LEU   A O    
5100  C  CB   . LEU   A  329 ? 0.45768386 0.34753767 0.39067408 -0.00412936 -0.07900716 0.02002469  384  LEU   A CB   
5101  C  CG   . LEU   A  329 ? 0.42129326 0.31150952 0.34884068 -0.01301694 -0.07657114 0.02415104  384  LEU   A CG   
5102  C  CD1  . LEU   A  329 ? 0.43714118 0.33296752 0.36595356 -0.01745855 -0.07111775 0.02177612  384  LEU   A CD1  
5103  C  CD2  . LEU   A  329 ? 0.42537999 0.29950178 0.34202021 -0.01659484 -0.07987964 0.02870680  384  LEU   A CD2  
5104  H  H    . LEU   A  329 ? 0.42373568 0.32589838 0.37301165 0.01189402  -0.08306389 0.01355255  384  LEU   A H    
5105  H  HA   . LEU   A  329 ? 0.41088021 0.32313046 0.35719821 -0.00247897 -0.07220842 0.01392447  384  LEU   A HA   
5106  H  HB2  . LEU   A  329 ? 0.45241827 0.33579716 0.38314790 -0.00332660 -0.07855871 0.01798403  384  LEU   A HB2  
5107  H  HB3  . LEU   A  329 ? 0.45448214 0.33834574 0.38535571 -0.00136045 -0.08316974 0.02188288  384  LEU   A HB3  
5108  H  HG   . LEU   A  329 ? 0.42201057 0.31990358 0.35233885 -0.01376882 -0.07637542 0.02550343  384  LEU   A HG   
5109  H  HD11 . LEU   A  329 ? 0.42405015 0.32227749 0.35093707 -0.02251584 -0.06952413 0.02417398  384  LEU   A HD11 
5110  H  HD12 . LEU   A  329 ? 0.43575957 0.32341149 0.36084259 -0.01765890 -0.07141846 0.02075668  384  LEU   A HD12 
5111  H  HD13 . LEU   A  329 ? 0.42185313 0.32694918 0.35694572 -0.01509041 -0.06900813 0.01885015  384  LEU   A HD13 
5112  H  HD21 . LEU   A  329 ? 0.43327749 0.30412057 0.34844249 -0.01420590 -0.08340971 0.03071588  384  LEU   A HD21 
5113  H  HD22 . LEU   A  329 ? 0.43533066 0.30087590 0.34900266 -0.01569100 -0.08060485 0.02741065  384  LEU   A HD22 
5114  H  HD23 . LEU   A  329 ? 0.42355216 0.29903668 0.33741558 -0.02229471 -0.07779619 0.03092013  384  LEU   A HD23 
5115  N  N    . VAL   A  330 ? 0.35003677 0.27933547 0.30176732 -0.00712728 -0.07186548 0.01847508  385  VAL   A N    
5116  C  CA   . VAL   A  330 ? 0.33265591 0.26807889 0.28423864 -0.01131154 -0.07192463 0.02185471  385  VAL   A CA   
5117  C  C    . VAL   A  330 ? 0.32131818 0.24621966 0.26254928 -0.01748325 -0.07214886 0.02623489  385  VAL   A C    
5118  O  O    . VAL   A  330 ? 0.32629484 0.25087461 0.26529741 -0.02203378 -0.06832992 0.02593031  385  VAL   A O    
5119  C  CB   . VAL   A  330 ? 0.32483071 0.27479488 0.28288755 -0.01454091 -0.06686480 0.02017001  385  VAL   A CB   
5120  C  CG1  . VAL   A  330 ? 0.29618126 0.24988474 0.25239211 -0.01911056 -0.06710781 0.02361587  385  VAL   A CG1  
5121  C  CG2  . VAL   A  330 ? 0.31883198 0.28049728 0.28748131 -0.00942316 -0.06579719 0.01579324  385  VAL   A CG2  
5122  H  H    . VAL   A  330 ? 0.34162030 0.27472788 0.29551464 -0.00773549 -0.06857517 0.01603785  385  VAL   A H    
5123  H  HA   . VAL   A  330 ? 0.33575523 0.27198476 0.28907886 -0.00830917 -0.07524785 0.02254535  385  VAL   A HA   
5124  H  HB   . VAL   A  330 ? 0.31647867 0.26516652 0.27242273 -0.01730825 -0.06389150 0.01957995  385  VAL   A HB   
5125  H  HG11 . VAL   A  330 ? 0.30700654 0.25901422 0.26274419 -0.01705344 -0.07069925 0.02494265  385  VAL   A HG11 
5126  H  HG12 . VAL   A  330 ? 0.30318236 0.25177091 0.25365210 -0.02304743 -0.06615555 0.02570465  385  VAL   A HG12 
5127  H  HG13 . VAL   A  330 ? 0.29493293 0.25778258 0.25601649 -0.02018815 -0.06466564 0.02233158  385  VAL   A HG13 
5128  H  HG21 . VAL   A  330 ? 0.31137258 0.28139016 0.28336143 -0.01199978 -0.06264792 0.01509675  385  VAL   A HG21 
5129  H  HG22 . VAL   A  330 ? 0.32311034 0.28232163 0.29235429 -0.00675347 -0.06504029 0.01332755  385  VAL   A HG22 
5130  H  HG23 . VAL   A  330 ? 0.32198638 0.28527778 0.29340601 -0.00630711 -0.06903292 0.01609979  385  VAL   A HG23 
5131  N  N    . PRO   A  331 ? 0.34761626 0.26400375 0.28227368 -0.01788219 -0.07654240 0.03031722  386  PRO   A N    
5132  C  CA   . PRO   A  331 ? 0.34240553 0.24742037 0.26662719 -0.02356462 -0.07680339 0.03444143  386  PRO   A CA   
5133  C  C    . PRO   A  331 ? 0.34945214 0.25989437 0.27110916 -0.02986661 -0.07430878 0.03733992  386  PRO   A C    
5134  O  O    . PRO   A  331 ? 0.39952797 0.32191223 0.32720137 -0.03005478 -0.07232942 0.03605271  386  PRO   A O    
5135  C  CB   . PRO   A  331 ? 0.32762244 0.22088006 0.24604023 -0.01998017 -0.08298054 0.03715384  386  PRO   A CB   
5136  C  CG   . PRO   A  331 ? 0.32495281 0.22780997 0.24974005 -0.01564995 -0.08554812 0.03650781  386  PRO   A CG   
5137  C  CD   . PRO   A  331 ? 0.36490670 0.28200006 0.30141091 -0.01301101 -0.08171207 0.03129504  386  PRO   A CD   
5138  H  HA   . PRO   A  331 ? 0.34273711 0.24352202 0.26523286 -0.02499491 -0.07515325 0.03347689  386  PRO   A HA   
5139  H  HB2  . PRO   A  331 ? 0.33946854 0.22602326 0.25061834 -0.02382794 -0.08368085 0.04060385  386  PRO   A HB2  
5140  H  HB3  . PRO   A  331 ? 0.34104726 0.22784661 0.25915024 -0.01665054 -0.08456693 0.03570960  386  PRO   A HB3  
5141  H  HG2  . PRO   A  331 ? 0.33186087 0.23765408 0.25450265 -0.01890464 -0.08520444 0.03868066  386  PRO   A HG2  
5142  H  HG3  . PRO   A  331 ? 0.34360540 0.24090689 0.26731050 -0.01136364 -0.08985771 0.03701840  386  PRO   A HG3  
5143  H  HD2  . PRO   A  331 ? 0.34188110 0.26810825 0.28244504 -0.01373528 -0.08092678 0.03110361  386  PRO   A HD2  
5144  H  HD3  . PRO   A  331 ? 0.35292560 0.26967493 0.29326710 -0.00779787 -0.08349411 0.02898918  386  PRO   A HD3  
5145  N  N    . GLY   A  332 ? 0.33105057 0.23245537 0.24370211 -0.03513431 -0.07423616 0.04106247  387  GLY   A N    
5146  C  CA   . GLY   A  332 ? 0.32114661 0.22576322 0.22983779 -0.04065146 -0.07236411 0.04408147  387  GLY   A CA   
5147  C  C    . GLY   A  332 ? 0.29799744 0.20495217 0.20579010 -0.04681744 -0.06740797 0.04415691  387  GLY   A C    
5148  O  O    . GLY   A  332 ? 0.39848047 0.29756242 0.30248496 -0.04928958 -0.06697307 0.04467308  387  GLY   A O    
5149  H  H    . GLY   A  332 ? 0.34240931 0.23524231 0.25118691 -0.03536813 -0.07527042 0.04160903  387  GLY   A H    
5150  H  HA2  . GLY   A  332 ? 0.32761371 0.22473703 0.22977847 -0.04149657 -0.07489180 0.04704442  387  GLY   A HA2  
5151  H  HA3  . GLY   A  332 ? 0.31321943 0.22598657 0.22609466 -0.03946377 -0.07203624 0.04317384  387  GLY   A HA3  
5152  N  N    . THR   A  333 ? 0.30896640 0.22665438 0.22030973 -0.04922328 -0.06402591 0.04359809  388  THR   A N    
5153  C  CA   . THR   A  333 ? 0.29725981 0.21931079 0.20891726 -0.05448046 -0.05950311 0.04356012  388  THR   A CA   
5154  C  C    . THR   A  333 ? 0.27901357 0.20706217 0.19756719 -0.05328846 -0.05697435 0.03984702  388  THR   A C    
5155  O  O    . THR   A  333 ? 0.29193059 0.22468972 0.21195471 -0.05682000 -0.05360315 0.03934117  388  THR   A O    
5156  C  CB   . THR   A  333 ? 0.27374554 0.20366590 0.18562265 -0.05677512 -0.05747325 0.04447494  388  THR   A CB   
5157  O  OG1  . THR   A  333 ? 0.27282590 0.21059653 0.19124734 -0.05280660 -0.05804566 0.04202496  388  THR   A OG1  
5158  C  CG2  . THR   A  333 ? 0.30974221 0.23355791 0.21324109 -0.05880911 -0.05940157 0.04819768  388  THR   A CG2  
5159  H  H    . THR   A  333 ? 0.29900885 0.22157693 0.21287191 -0.04733415 -0.06477270 0.04313494  388  THR   A H    
5160  H  HA   . THR   A  333 ? 0.29957584 0.21520662 0.20634425 -0.05741625 -0.05953618 0.04538992  388  THR   A HA   
5161  H  HB   . THR   A  333 ? 0.27775067 0.21138598 0.19079998 -0.05964636 -0.05447682 0.04409687  388  THR   A HB   
5163  H  HG21 . THR   A  333 ? 0.29753765 0.22628590 0.20084813 -0.06057411 -0.05762578 0.04844687  388  THR   A HG21 
5164  H  HG22 . THR   A  333 ? 0.30595094 0.22693232 0.20857227 -0.05570100 -0.06265126 0.04855383  388  THR   A HG22 
5165  H  HG23 . THR   A  333 ? 0.30793709 0.22561057 0.20686160 -0.06152033 -0.05921943 0.04996407  388  THR   A HG23 
5166  N  N    . LEU   A  334 ? 0.28183359 0.21024087 0.20460635 -0.04807996 -0.05867527 0.03721174  389  LEU   A N    
5167  C  CA   . LEU   A  334 ? 0.29772776 0.22896338 0.22501270 -0.04660302 -0.05675943 0.03370734  389  LEU   A CA   
5168  C  C    . LEU   A  334 ? 0.31234467 0.23771411 0.24043538 -0.04100768 -0.05979851 0.03173332  389  LEU   A C    
5169  O  O    . LEU   A  334 ? 0.33775431 0.25932544 0.26478338 -0.03760416 -0.06345591 0.03285918  389  LEU   A O    
5170  C  CB   . LEU   A  334 ? 0.27509108 0.21860754 0.20940350 -0.04591202 -0.05375553 0.03132278  389  LEU   A CB   
5171  C  CG   . LEU   A  334 ? 0.35767570 0.30735633 0.29719672 -0.04164563 -0.05521342 0.03013336  389  LEU   A CG   
5172  C  CD1  . LEU   A  334 ? 0.39330021 0.35313582 0.33974689 -0.04065147 -0.05212713 0.02700381  389  LEU   A CD1  
5173  C  CD2  . LEU   A  334 ? 0.58427507 0.53636932 0.52211243 -0.04342234 -0.05620050 0.03273758  389  LEU   A CD2  
5174  H  H    . LEU   A  334 ? 0.29012251 0.21735272 0.21300197 -0.04523042 -0.06110910 0.03750283  389  LEU   A H    
5175  H  HA   . LEU   A  334 ? 0.29433134 0.22267534 0.21919113 -0.04965519 -0.05557429 0.03407789  389  LEU   A HA   
5176  H  HB2  . LEU   A  334 ? 0.29406267 0.23866180 0.23015638 -0.04546813 -0.05234408 0.02926238  389  LEU   A HB2  
5177  H  HB3  . LEU   A  334 ? 0.29225993 0.23890711 0.22593492 -0.04905113 -0.05208369 0.03251959  389  LEU   A HB3  
5178  H  HG   . LEU   A  334 ? 0.38125104 0.32682890 0.32066372 -0.03835581 -0.05766413 0.02962883  389  LEU   A HG   
5179  H  HD11 . LEU   A  334 ? 0.37770486 0.34193221 0.32786924 -0.03833717 -0.05303283 0.02625107  389  LEU   A HD11 
5180  H  HD12 . LEU   A  334 ? 0.37353724 0.33673126 0.31984678 -0.04364802 -0.04999977 0.02757474  389  LEU   A HD12 
5181  H  HD13 . LEU   A  334 ? 0.37764820 0.33615333 0.32477450 -0.03940400 -0.05140464 0.02515433  389  LEU   A HD13 
5182  H  HD21 . LEU   A  334 ? 0.49992245 0.44552034 0.43293178 -0.04389710 -0.05828727 0.03484505  389  LEU   A HD21 
5183  H  HD22 . LEU   A  334 ? 0.49080524 0.44617343 0.42839560 -0.04647869 -0.05383837 0.03317982  389  LEU   A HD22 
5184  H  HD23 . LEU   A  334 ? 0.49419299 0.45095849 0.43585220 -0.04104640 -0.05715380 0.03175733  389  LEU   A HD23 
5185  N  N    . GLY   A  335 ? 0.33186126 0.25667465 0.26176813 -0.03981024 -0.05835582 0.02855931  390  GLY   A N    
5186  C  CA   . GLY   A  335 ? 0.31041512 0.23066163 0.24180113 -0.03400397 -0.06048515 0.02568084  390  GLY   A CA   
5187  C  C    . GLY   A  335 ? 0.26979145 0.19990915 0.20823896 -0.03109405 -0.05745257 0.02126916  390  GLY   A C    
5188  O  O    . GLY   A  335 ? 0.28327295 0.21758834 0.22212322 -0.03426214 -0.05406654 0.02011533  390  GLY   A O    
5189  H  H    . GLY   A  335 ? 0.31579500 0.24316216 0.24590512 -0.04255927 -0.05600765 0.02803624  390  GLY   A H    
5190  H  HA2  . GLY   A  335 ? 0.31224626 0.23091242 0.24393770 -0.03109160 -0.06315903 0.02653450  390  GLY   A HA2  
5191  H  HA3  . GLY   A  335 ? 0.31558958 0.22743024 0.24274321 -0.03483323 -0.06136110 0.02570744  390  GLY   A HA3  
5192  N  N    . ARG   A  336 ? 0.30740023 0.24105227 0.25118905 -0.02504895 -0.05880665 0.01884718  391  ARG   A N    
5193  C  CA   . ARG   A  336 ? 0.27193052 0.21300197 0.22162648 -0.02162957 -0.05599903 0.01416630  391  ARG   A CA   
5194  C  C    . ARG   A  336 ? 0.28647035 0.22104633 0.23694456 -0.01481956 -0.05887196 0.01136215  391  ARG   A C    
5195  O  O    . ARG   A  336 ? 0.29031652 0.22251610 0.24213971 -0.01081698 -0.06284909 0.01243248  391  ARG   A O    
5196  C  CB   . ARG   A  336 ? 0.34768707 0.30307168 0.30510771 -0.02140428 -0.05376751 0.01350027  391  ARG   A CB   
5197  C  CG   . ARG   A  336 ? 0.39251232 0.35218123 0.34833962 -0.02758455 -0.05181488 0.01658379  391  ARG   A CG   
5198  C  CD   . ARG   A  336 ? 0.38323653 0.35588029 0.34552413 -0.02857451 -0.04854724 0.01535643  391  ARG   A CD   
5199  N  NE   . ARG   A  336 ? 0.38849434 0.36801237 0.35784042 -0.02424342 -0.05014924 0.01394283  391  ARG   A NE   
5200  C  CZ   . ARG   A  336 ? 0.30538246 0.28861430 0.27687261 -0.02463809 -0.05237314 0.01595645  391  ARG   A CZ   
5201  N  NH1  . ARG   A  336 ? 0.34535900 0.32417634 0.31139693 -0.02841466 -0.05368440 0.01958455  391  ARG   A NH1  
5202  N  NH2  . ARG   A  336 ? 0.25695524 0.24875474 0.23627469 -0.02110311 -0.05338090 0.01406100  391  ARG   A NH2  
5203  H  H    . ARG   A  336 ? 0.29396981 0.22569862 0.23778278 -0.02298469 -0.06154114 0.02011598  391  ARG   A H    
5204  H  HA   . ARG   A  336 ? 0.29046413 0.23077007 0.23802713 -0.02415843 -0.05375025 0.01328965  391  ARG   A HA   
5205  H  HB2  . ARG   A  336 ? 0.33511603 0.29193163 0.29535741 -0.01844285 -0.05615107 0.01379136  391  ARG   A HB2  
5206  H  HB3  . ARG   A  336 ? 0.33141908 0.29191330 0.29215154 -0.02005153 -0.05127865 0.01058640  391  ARG   A HB3  
5207  H  HG2  . ARG   A  336 ? 0.37582523 0.33192438 0.32781067 -0.03051125 -0.05053917 0.01700347  391  ARG   A HG2  
5208  H  HG3  . ARG   A  336 ? 0.37950173 0.33641291 0.33330846 -0.02837048 -0.05407600 0.01915569  391  ARG   A HG3  
5209  H  HD2  . ARG   A  336 ? 0.38274688 0.35774574 0.34574127 -0.02887277 -0.04590673 0.01334159  391  ARG   A HD2  
5210  H  HD3  . ARG   A  336 ? 0.37942785 0.35349500 0.34030652 -0.03202561 -0.04799095 0.01749262  391  ARG   A HD3  
5211  H  HE   . ARG   A  336 ? 0.36473975 0.34633601 0.33723643 -0.02115244 -0.04967999 0.01145023  391  ARG   A HE   
5212  H  HH11 . ARG   A  336 ? 0.33633202 0.30794168 0.29735738 -0.02933295 -0.05465220 0.02103182  391  ARG   A HH11 
5213  H  HH12 . ARG   A  336 ? 0.32845438 0.31158492 0.29583070 -0.03007848 -0.05349728 0.02044985  391  ARG   A HH12 
5214  H  HH21 . ARG   A  336 ? 0.27013987 0.26422241 0.25073141 -0.02137910 -0.05520374 0.01528950  391  ARG   A HH21 
5215  H  HH22 . ARG   A  336 ? 0.27213001 0.26757693 0.25543383 -0.01855503 -0.05221231 0.01148449  391  ARG   A HH22 
5216  N  N    . ILE   A  337 ? 0.28872311 0.21939424 0.23757605 -0.01340341 -0.05719146 0.00772617  392  ILE   A N    
5217  C  CA   . ILE   A  337 ? 0.29946408 0.22280791 0.24841091 -0.00669334 -0.05959985 0.00439566  392  ILE   A CA   
5218  C  C    . ILE   A  337 ? 0.31955433 0.25364017 0.27595755 -0.00201211 -0.05603594 -0.00112955 392  ILE   A C    
5219  O  O    . ILE   A  337 ? 0.29766357 0.23863870 0.25464377 -0.00509372 -0.05145888 -0.00290606 392  ILE   A O    
5220  C  CB   . ILE   A  337 ? 0.32388997 0.23208103 0.26384750 -0.00860136 -0.06082805 0.00413863  392  ILE   A CB   
5221  C  CG1  . ILE   A  337 ? 0.33689535 0.23353063 0.26940945 -0.01290586 -0.06456017 0.00958249  392  ILE   A CG1  
5222  C  CG2  . ILE   A  337 ? 0.38091230 0.28145409 0.32073271 -0.00138628 -0.06249036 -0.00054397 392  ILE   A CG2  
5223  C  CD1  . ILE   A  337 ? 0.38430858 0.26598161 0.30757523 -0.01681967 -0.06559306 0.00986779  392  ILE   A CD1  
5224  H  H    . ILE   A  337 ? 0.28572011 0.21817097 0.23316324 -0.01659864 -0.05455783 0.00718801  392  ILE   A H    
5225  H  HA   . ILE   A  337 ? 0.31066382 0.23162663 0.26049590 -0.00391242 -0.06286585 0.00579406  392  ILE   A HA   
5226  H  HB   . ILE   A  337 ? 0.32571113 0.23653331 0.26436767 -0.01220012 -0.05788841 0.00334274  392  ILE   A HB   
5227  H  HG12 . ILE   A  337 ? 0.34783560 0.24078876 0.28067279 -0.00935980 -0.06778565 0.01056156  392  ILE   A HG12 
5228  H  HG13 . ILE   A  337 ? 0.33446008 0.23673557 0.26751530 -0.01700481 -0.06326902 0.01217234  392  ILE   A HG13 
5229  H  HG21 . ILE   A  337 ? 0.37141830 0.27043435 0.31342405 0.00287166  -0.06542692 -0.00008273 392  ILE   A HG21 
5230  H  HG22 . ILE   A  337 ? 0.36350384 0.27121156 0.30716729 0.00060779  -0.05948678 -0.00417237 392  ILE   A HG22 
5231  H  HG23 . ILE   A  337 ? 0.37453049 0.26441392 0.30810347 -0.00298841 -0.06367753 -0.00046665 392  ILE   A HG23 
5232  H  HD11 . ILE   A  337 ? 0.38272661 0.25667250 0.30442953 -0.01275434 -0.06758705 0.00776993  392  ILE   A HD11 
5233  H  HD12 . ILE   A  337 ? 0.36871946 0.25403023 0.29191110 -0.01961185 -0.06273960 0.00834157  392  ILE   A HD12 
5234  H  HD13 . ILE   A  337 ? 0.37515485 0.25169802 0.29428992 -0.02059074 -0.06716110 0.01362018  392  ILE   A HD13 
5235  N  N    . ARG   A  338 ? 0.34131265 0.27661374 0.30318350 0.00556700  -0.05822203 -0.00386249 393  ARG   A N    
5236  C  CA   . ARG   A  338 ? 0.44779187 0.39128262 0.41605741 0.01088931  -0.05489708 -0.00985898 393  ARG   A CA   
5237  C  C    . ARG   A  338 ? 0.38654560 0.32131776 0.35552943 0.01932534  -0.05898342 -0.01270158 393  ARG   A C    
5238  O  O    . ARG   A  338 ? 0.37868708 0.30243546 0.34373379 0.02060655  -0.06446481 -0.00940754 393  ARG   A O    
5239  C  CB   . ARG   A  338 ? 0.39881480 0.36091766 0.37772799 0.01140466  -0.05180714 -0.01087843 393  ARG   A CB   
5240  C  CG   . ARG   A  338 ? 0.35352734 0.31968185 0.33851904 0.01457770  -0.05627996 -0.00857145 393  ARG   A CG   
5241  C  CD   . ARG   A  338 ? 0.33601266 0.32005626 0.33080417 0.01337872  -0.05325272 -0.00920986 393  ARG   A CD   
5242  N  NE   . ARG   A  338 ? 0.40073931 0.38964552 0.40265349 0.01783238  -0.05791261 -0.00833059 393  ARG   A NE   
5243  C  CZ   . ARG   A  338 ? 0.55230790 0.54215753 0.55372059 0.01462524  -0.06108485 -0.00383715 393  ARG   A CZ   
5244  N  NH1  . ARG   A  338 ? 0.48573351 0.47264475 0.48048317 0.00705043  -0.05975415 0.00014610  393  ARG   A NH1  
5245  N  NH2  . ARG   A  338 ? 0.56273329 0.55634451 0.57026225 0.01942648  -0.06596825 -0.00349037 393  ARG   A NH2  
5246  H  H    . ARG   A  338 ? 0.36007154 0.29124719 0.32174039 0.00758851  -0.06188019 -0.00198912 393  ARG   A H    
5247  H  HA   . ARG   A  338 ? 0.40158010 0.34352922 0.36632079 0.00863154  -0.05206221 -0.01154436 393  ARG   A HA   
5248  H  HB2  . ARG   A  338 ? 0.39725095 0.36476812 0.38018340 0.01477915  -0.04926480 -0.01498100 393  ARG   A HB2  
5249  H  HB3  . ARG   A  338 ? 0.38791925 0.35428497 0.36563033 0.00606514  -0.04928759 -0.00910248 393  ARG   A HB3  
5250  H  HG2  . ARG   A  338 ? 0.36136815 0.32108393 0.34149373 0.01153485  -0.05892454 -0.00461231 393  ARG   A HG2  
5251  H  HG3  . ARG   A  338 ? 0.36873534 0.33186749 0.35587782 0.02046142  -0.05879207 -0.01059547 393  ARG   A HG3  
5252  H  HD2  . ARG   A  338 ? 0.35077441 0.34157020 0.34956127 0.01508906  -0.04970432 -0.01290988 393  ARG   A HD2  
5253  H  HD3  . ARG   A  338 ? 0.34665698 0.33251953 0.33899623 0.00773990  -0.05166449 -0.00661148 393  ARG   A HD3  
5254  H  HE   . ARG   A  338 ? 0.41888398 0.41035187 0.42569631 0.02311502  -0.05879333 -0.01108794 393  ARG   A HE   
5255  H  HH11 . ARG   A  338 ? 0.50201845 0.48122993 0.49030945 0.00466704  -0.05897903 0.00106788  393  ARG   A HH11 
5256  H  HH12 . ARG   A  338 ? 0.49898255 0.49172890 0.49593666 0.00450929  -0.05973436 0.00174394  393  ARG   A HH12 
5257  H  HH21 . ARG   A  338 ? 0.55811703 0.55202365 0.56474847 0.01730473  -0.06820728 -0.00062792 393  ARG   A HH21 
5258  H  HH22 . ARG   A  338 ? 0.56148332 0.55734456 0.57390600 0.02480929  -0.06704552 -0.00620685 393  ARG   A HH22 
5259  N  N    . ALA   A  339 ? 0.49879250 0.43767282 0.47181734 0.02482897  -0.05613250 -0.01883082 394  ALA   A N    
5260  C  CA   . ALA   A  339 ? 0.48981109 0.42149383 0.46451995 0.03395989  -0.05944367 -0.02268877 394  ALA   A CA   
5261  C  C    . ALA   A  339 ? 0.56369698 0.50495315 0.54884237 0.03979508  -0.06267910 -0.02222579 394  ALA   A C    
5262  O  O    . ALA   A  339 ? 0.57972795 0.53529125 0.57152569 0.03663264  -0.06089253 -0.02032516 394  ALA   A O    
5263  C  CB   . ALA   A  339 ? 0.44552359 0.38141304 0.42217278 0.03785548  -0.05445851 -0.02984197 394  ALA   A CB   
5264  H  H    . ALA   A  339 ? 0.45775083 0.40419513 0.43238342 0.02289949  -0.05187635 -0.02075900 394  ALA   A H    
5265  H  HA   . ALA   A  339 ? 0.50402367 0.42186916 0.47163022 0.03369049  -0.06292917 -0.02093283 394  ALA   A HA   
5266  H  HB1  . ALA   A  339 ? 0.47001028 0.39760831 0.44534779 0.04334997  -0.05679865 -0.03241701 394  ALA   A HB1  
5267  H  HB2  . ALA   A  339 ? 0.45866287 0.39204556 0.42964983 0.03304633  -0.05179534 -0.02985147 394  ALA   A HB2  
5268  H  HB3  . ALA   A  339 ? 0.45348886 0.40283126 0.43817306 0.03962688  -0.05161376 -0.03189874 394  ALA   A HB3  
5269  N  N    . LYS   A  340 ? 0.70235795 0.63549709 0.68887061 0.04833315  -0.06772242 -0.02406291 395  LYS   A N    
5270  C  CA   . LYS   A  340 ? 1.01870358 0.96197796 1.01637602 0.05534318  -0.07108261 -0.02475869 395  LYS   A CA   
5271  C  C    . LYS   A  340 ? 1.06762910 1.02765000 1.07796812 0.06201799  -0.06677042 -0.03179905 395  LYS   A C    
5272  O  O    . LYS   A  340 ? 1.02820790 1.00181568 1.05004632 0.06616257  -0.06827138 -0.03248174 395  LYS   A O    
5273  C  CB   . LYS   A  340 ? 0.74532086 0.67257512 0.73917538 0.06209191  -0.07928132 -0.02311538 395  LYS   A CB   
5274  C  CG   . LYS   A  340 ? 0.71712267 0.63160777 0.70095956 0.05605794  -0.08428826 -0.01537835 395  LYS   A CG   
5275  C  CD   . LYS   A  340 ? 0.70977104 0.61708879 0.69423175 0.06254623  -0.09247364 -0.01279479 395  LYS   A CD   
5276  C  CE   . LYS   A  340 ? 1.18733978 1.11272740 1.18342948 0.06430126  -0.09383144 -0.01197327 395  LYS   A CE   
5277  N  NZ   . LYS   A  340 ? 1.26456547 1.18225527 1.25995946 0.07008798  -0.10267007 -0.00870491 395  LYS   A NZ   
5278  H  H    . LYS   A  340 ? 0.73200834 0.65283346 0.71236670 0.04988414  -0.06934257 -0.02492892 395  LYS   A H    
5279  H  HA   . LYS   A  340 ? 0.87907624 0.82930553 0.87888253 0.05126573  -0.07126478 -0.02136244 395  LYS   A HA   
5280  H  HB2  . LYS   A  340 ? 0.80314779 0.72042787 0.79264444 0.06500859  -0.07941289 -0.02580545 395  LYS   A HB2  
5281  H  HB3  . LYS   A  340 ? 0.79820180 0.73311305 0.80044359 0.06792281  -0.08132756 -0.02468329 395  LYS   A HB3  
5282  H  HG2  . LYS   A  340 ? 0.71337783 0.63637865 0.69861495 0.05047558  -0.08218051 -0.01289619 395  LYS   A HG2  
5283  H  HG3  . LYS   A  340 ? 0.72596359 0.62809461 0.70084590 0.05294094  -0.08415642 -0.01440551 395  LYS   A HG3  
5284  H  HD2  . LYS   A  340 ? 0.80481017 0.70007223 0.78029728 0.05883346  -0.09545565 -0.00826876 395  LYS   A HD2  
5285  H  HD3  . LYS   A  340 ? 0.80981696 0.71190071 0.79561257 0.06947238  -0.09434816 -0.01613613 395  LYS   A HD3  
5286  H  HE2  . LYS   A  340 ? 1.04622757 0.98362148 1.05167162 0.06822044  -0.09108289 -0.01649828 395  LYS   A HE2  
5287  H  HE3  . LYS   A  340 ? 1.03949857 0.97032690 1.03442776 0.05754980  -0.09160940 -0.00915288 395  LYS   A HE3  
5288  H  HZ1  . LYS   A  340 ? 1.25325727 1.16593611 1.25009680 0.07679901  -0.10498454 -0.01136911 395  LYS   A HZ1  
5289  H  HZ2  . LYS   A  340 ? 1.24779439 1.15432537 1.23410463 0.06622528  -0.10505086 -0.00438379 395  LYS   A HZ2  
5290  H  HZ3  . LYS   A  340 ? 1.23758030 1.16657066 1.23999500 0.07079358  -0.10352473 -0.00835870 395  LYS   A HZ3  
5291  N  N    . SER   A  341 ? 1.03224432 0.99170315 1.04051495 0.06296529  -0.06145816 -0.03715259 396  SER   A N    
5292  C  CA   . SER   A  341 ? 1.03505826 1.01071846 1.05444789 0.06866691  -0.05627468 -0.04412307 396  SER   A CA   
5293  C  C    . SER   A  341 ? 0.82526982 0.81493980 0.84585238 0.06117747  -0.04788754 -0.04523056 396  SER   A C    
5294  O  O    . SER   A  341 ? 0.86566347 0.85296333 0.88107526 0.06029302  -0.04294234 -0.04917267 396  SER   A O    
5295  C  CB   . SER   A  341 ? 1.10257471 1.06746030 1.11913157 0.07704392  -0.05659858 -0.05035456 396  SER   A CB   
5296  O  OG   . SER   A  341 ? 1.15606856 1.11150813 1.17456734 0.08549856  -0.06429818 -0.04992816 396  SER   A OG   
5297  H  H    . SER   A  341 ? 1.04254031 0.99134433 1.04208171 0.05985990  -0.06100155 -0.03652837 396  SER   A H    
5298  H  HA   . SER   A  341 ? 1.00093722 0.98602945 1.02950323 0.07238219  -0.05822572 -0.04422526 396  SER   A HA   
5299  H  HB2  . SER   A  341 ? 1.10403872 1.05721128 1.11065483 0.07352110  -0.05598109 -0.04984539 396  SER   A HB2  
5300  H  HB3  . SER   A  341 ? 1.09660780 1.07258892 1.11966729 0.08010794  -0.05211490 -0.05529843 396  SER   A HB3  
5302  N  N    . LYS   A  346 ? 0.94714218 0.74749631 0.86293286 0.05790740  -0.07767007 -0.04551259 401  LYS   A N    
5303  C  CA   . LYS   A  346 ? 0.85499716 0.67949444 0.78341383 0.05936372  -0.07350609 -0.04540028 401  LYS   A CA   
5304  C  C    . LYS   A  346 ? 0.85625827 0.69261062 0.78367996 0.04856794  -0.06839306 -0.04236102 401  LYS   A C    
5305  O  O    . LYS   A  346 ? 0.85105604 0.67935222 0.76943493 0.04173221  -0.06718965 -0.04236602 401  LYS   A O    
5306  C  CB   . LYS   A  346 ? 0.91913998 0.75427055 0.85603362 0.06933751  -0.06972057 -0.05392270 401  LYS   A CB   
5307  C  CG   . LYS   A  346 ? 1.05297077 0.90117860 1.00310862 0.07780535  -0.07134353 -0.05411650 401  LYS   A CG   
5308  C  CD   . LYS   A  346 ? 1.08089352 0.95235014 1.04113734 0.07314480  -0.06755861 -0.05060174 401  LYS   A CD   
5309  C  CE   . LYS   A  346 ? 1.03738594 0.92466444 0.99983025 0.06824155  -0.05910421 -0.05392808 401  LYS   A CE   
5310  N  NZ   . LYS   A  346 ? 0.90104884 0.79835796 0.87048495 0.07640452  -0.05435526 -0.06249750 401  LYS   A NZ   
5311  H  H    . LYS   A  346 ? 0.93047118 0.72776031 0.84429860 0.06066608  -0.07592416 -0.05069715 401  LYS   A H    
5312  H  HA   . LYS   A  346 ? 0.88234913 0.70802546 0.81419706 0.06082269  -0.07676145 -0.04162117 401  LYS   A HA   
5313  H  HB2  . LYS   A  346 ? 0.94715482 0.76995075 0.87920058 0.07343528  -0.07130204 -0.05767114 401  LYS   A HB2  
5314  H  HB3  . LYS   A  346 ? 0.92573726 0.77153587 0.86414009 0.06624156  -0.06449094 -0.05599715 401  LYS   A HB3  
5315  H  HG2  . LYS   A  346 ? 1.03494084 0.87280488 0.98298907 0.07985249  -0.07689257 -0.05094566 401  LYS   A HG2  
5316  H  HG3  . LYS   A  346 ? 1.03424227 0.88573754 0.98871553 0.08496127  -0.06972429 -0.05996463 401  LYS   A HG3  
5317  H  HD2  . LYS   A  346 ? 1.05561829 0.92359674 1.01229405 0.06729269  -0.06982731 -0.04481731 401  LYS   A HD2  
5318  H  HD3  . LYS   A  346 ? 1.06088424 0.94049746 1.02987111 0.07920870  -0.06870113 -0.05168477 401  LYS   A HD3  
5319  H  HE2  . LYS   A  346 ? 1.00634003 0.88556802 0.96023667 0.06281170  -0.05820877 -0.05331222 401  LYS   A HE2  
5320  H  HE3  . LYS   A  346 ? 0.99466562 0.89388621 0.96203911 0.06442089  -0.05750370 -0.05079234 401  LYS   A HE3  
5321  H  HZ1  . LYS   A  346 ? 0.95404720 0.84016120 0.91901374 0.08044757  -0.05587742 -0.06575151 401  LYS   A HZ1  
5322  H  HZ2  . LYS   A  346 ? 0.93863559 0.84535217 0.91701061 0.08110356  -0.05479627 -0.06317554 401  LYS   A HZ2  
5323  H  HZ3  . LYS   A  346 ? 0.93517387 0.84054631 0.90440267 0.07272156  -0.04942691 -0.06397189 401  LYS   A HZ3  
5324  N  N    . TYR   A  347 ? 0.86365217 0.71893311 0.80050480 0.04714319  -0.06581441 -0.03973064 402  TYR   A N    
5325  C  CA   . TYR   A  347 ? 0.82269800 0.68869799 0.75912213 0.03735412  -0.06193615 -0.03580805 402  TYR   A CA   
5326  C  C    . TYR   A  347 ? 0.88148010 0.74970806 0.81298172 0.03295437  -0.05661573 -0.03970623 402  TYR   A C    
5327  O  O    . TYR   A  347 ? 0.93397695 0.80758917 0.86794090 0.03806929  -0.05283436 -0.04631548 402  TYR   A O    
5328  C  CB   . TYR   A  347 ? 0.73950636 0.62641990 0.68796527 0.03860240  -0.05926801 -0.03464750 402  TYR   A CB   
5329  C  CG   . TYR   A  347 ? 0.62397742 0.52081662 0.57269382 0.02928690  -0.05671885 -0.02938058 402  TYR   A CG   
5330  C  CD1  . TYR   A  347 ? 0.71623069 0.60909933 0.66280949 0.02460993  -0.06054671 -0.02247925 402  TYR   A CD1  
5331  C  CD2  . TYR   A  347 ? 0.58818150 0.49832758 0.53904760 0.02539763  -0.05045618 -0.03133724 402  TYR   A CD2  
5332  C  CE1  . TYR   A  347 ? 0.69173372 0.59378254 0.63884133 0.01668515  -0.05814465 -0.01807458 402  TYR   A CE1  
5333  C  CE2  . TYR   A  347 ? 0.57808888 0.49675721 0.52927768 0.01742325  -0.04842276 -0.02657164 402  TYR   A CE2  
5334  C  CZ   . TYR   A  347 ? 0.57093567 0.48557639 0.52053022 0.01332558  -0.05226830 -0.02016717 402  TYR   A CZ   
5335  O  OH   . TYR   A  347 ? 0.45004207 0.37275976 0.40008473 0.00612874  -0.05029775 -0.01590532 402  TYR   A OH   
5336  H  H    . TYR   A  347 ? 0.85431027 0.71574003 0.79812819 0.05252053  -0.06677241 -0.04037580 402  TYR   A H    
5337  H  HA   . TYR   A  347 ? 0.82470572 0.68312365 0.75619316 0.03243545  -0.06475230 -0.03098435 402  TYR   A HA   
5338  H  HB2  . TYR   A  347 ? 0.73179662 0.61743653 0.68369585 0.04256225  -0.06288356 -0.03308303 402  TYR   A HB2  
5339  H  HB3  . TYR   A  347 ? 0.72671497 0.62227714 0.67990136 0.04224117  -0.05571816 -0.03928881 402  TYR   A HB3  
5340  H  HD1  . TYR   A  347 ? 0.69370055 0.57722753 0.63811892 0.02693747  -0.06482126 -0.02081446 402  TYR   A HD1  
5341  H  HD2  . TYR   A  347 ? 0.59983230 0.51300979 0.55166245 0.02829902  -0.04755004 -0.03598007 402  TYR   A HD2  
5342  H  HE1  . TYR   A  347 ? 0.66051376 0.55989236 0.60597122 0.01371386  -0.06053145 -0.01370192 402  TYR   A HE1  
5343  H  HE2  . TYR   A  347 ? 0.57159269 0.49839941 0.52373278 0.01491780  -0.04443969 -0.02775607 402  TYR   A HE2  
5345  N  N    . ASP   A  348 ? 0.82401454 0.68849874 0.74850279 0.02343320  -0.05639551 -0.03557219 403  ASP   A N    
5346  C  CA   . ASP   A  348 ? 0.67367548 0.54234749 0.59382915 0.01814880  -0.05178059 -0.03801300 403  ASP   A CA   
5347  C  C    . ASP   A  348 ? 0.68161023 0.55244190 0.59857315 0.00802974  -0.05175217 -0.03178980 403  ASP   A C    
5348  O  O    . ASP   A  348 ? 0.56337053 0.42133415 0.47365069 0.00338020  -0.05562561 -0.02823034 403  ASP   A O    
5349  C  CB   . ASP   A  348 ? 0.79624897 0.64923489 0.70691597 0.01942219  -0.05282201 -0.04312216 403  ASP   A CB   
5350  C  CG   . ASP   A  348 ? 0.84968960 0.70691317 0.75503856 0.01370384  -0.04855356 -0.04551548 403  ASP   A CG   
5351  O  OD1  . ASP   A  348 ? 0.73339665 0.60577887 0.64352357 0.01499490  -0.04315109 -0.04827281 403  ASP   A OD1  
5352  O  OD2  . ASP   A  348 ? 0.71586049 0.56170160 0.61228633 0.00746736  -0.05073260 -0.04427803 403  ASP   A OD2  
5353  H  H    . ASP   A  348 ? 0.79683822 0.65609860 0.71914566 0.02018697  -0.05932209 -0.03107395 403  ASP   A H    
5354  H  HA   . ASP   A  348 ? 0.71694386 0.59757268 0.64233589 0.02033561  -0.04792330 -0.04060891 403  ASP   A HA   
5355  H  HB2  . ASP   A  348 ? 0.78973186 0.64167321 0.70256561 0.02629191  -0.05255841 -0.04751250 403  ASP   A HB2  
5356  H  HB3  . ASP   A  348 ? 0.78724861 0.62787354 0.69270754 0.01713783  -0.05672316 -0.04061159 403  ASP   A HB3  
5357  N  N    . PRO   A  349 ? 0.67008221 0.55690348 0.59151638 0.00430263  -0.04729113 -0.03054117 404  PRO   A N    
5358  C  CA   . PRO   A  349 ? 0.55023038 0.44062001 0.47007406 -0.00434107 -0.04725812 -0.02468506 404  PRO   A CA   
5359  C  C    . PRO   A  349 ? 0.58969098 0.46862760 0.50016415 -0.01114043 -0.04917782 -0.02333913 404  PRO   A C    
5360  O  O    . PRO   A  349 ? 0.53036988 0.40584260 0.43913019 -0.01663447 -0.05163692 -0.01804966 404  PRO   A O    
5361  C  CB   . PRO   A  349 ? 0.62774038 0.53470558 0.55203736 -0.00600178 -0.04175407 -0.02567396 404  PRO   A CB   
5362  C  CG   . PRO   A  349 ? 0.66412002 0.57952017 0.59579366 0.00204034  -0.03918157 -0.03043349 404  PRO   A CG   
5363  C  CD   . PRO   A  349 ? 0.68004727 0.58195138 0.60808706 0.00824298  -0.04195853 -0.03485391 404  PRO   A CD   
5364  H  HA   . PRO   A  349 ? 0.58499515 0.47615629 0.50779343 -0.00452104 -0.04926527 -0.02101871 404  PRO   A HA   
5365  H  HB2  . PRO   A  349 ? 0.61344677 0.51932585 0.53306925 -0.00872079 -0.04016861 -0.02731120 404  PRO   A HB2  
5366  H  HB3  . PRO   A  349 ? 0.60323215 0.51629978 0.53035820 -0.00922996 -0.04157507 -0.02179316 404  PRO   A HB3  
5367  H  HG2  . PRO   A  349 ? 0.65325546 0.57628441 0.58554828 0.00159636  -0.03528997 -0.03279277 404  PRO   A HG2  
5368  H  HG3  . PRO   A  349 ? 0.65048480 0.57177866 0.58823889 0.00350415  -0.03982591 -0.02829743 404  PRO   A HG3  
5369  H  HD2  . PRO   A  349 ? 0.68202782 0.58211714 0.60623288 0.00880255  -0.03990226 -0.03881847 404  PRO   A HD2  
5370  H  HD3  . PRO   A  349 ? 0.67786580 0.58267659 0.61150724 0.01385241  -0.04242722 -0.03629937 404  PRO   A HD3  
5371  N  N    . LYS   A  350 ? 0.50465643 0.37834877 0.40913567 -0.01102005 -0.04795906 -0.02827695 405  LYS   A N    
5372  C  CA   . LYS   A  350 ? 0.59222877 0.45675722 0.48834395 -0.01787244 -0.04973128 -0.02751398 405  LYS   A CA   
5373  C  C    . LYS   A  350 ? 0.58525598 0.43274677 0.47639191 -0.01893694 -0.05504224 -0.02554815 405  LYS   A C    
5374  O  O    . LYS   A  350 ? 0.52804303 0.37092942 0.41566628 -0.02610637 -0.05718314 -0.02151678 405  LYS   A O    
5375  C  CB   . LYS   A  350 ? 0.85541254 0.71755749 0.74544984 -0.01708198 -0.04752221 -0.03383347 405  LYS   A CB   
5376  C  CG   . LYS   A  350 ? 0.91954052 0.79684556 0.81177866 -0.01800716 -0.04231341 -0.03524150 405  LYS   A CG   
5377  C  CD   . LYS   A  350 ? 0.91541743 0.78872508 0.79930800 -0.01849118 -0.04063237 -0.04102269 405  LYS   A CD   
5378  C  CE   . LYS   A  350 ? 0.90804470 0.77400833 0.78989321 -0.01076359 -0.04004801 -0.04786697 405  LYS   A CE   
5379  N  NZ   . LYS   A  350 ? 1.05239201 0.91682082 0.92619801 -0.01093593 -0.03742759 -0.05382388 405  LYS   A NZ   
5380  H  H    . LYS   A  350 ? 0.54800034 0.42417318 0.45366549 -0.00662438 -0.04597780 -0.03236253 405  LYS   A H    
5381  H  HA   . LYS   A  350 ? 0.59695244 0.46781540 0.49423462 -0.02271863 -0.04900162 -0.02409808 405  LYS   A HA   
5382  H  HB2  . LYS   A  350 ? 0.80776405 0.66490299 0.69733304 -0.01163785 -0.04772982 -0.03760991 405  LYS   A HB2  
5383  H  HB3  . LYS   A  350 ? 0.80221170 0.65672302 0.68654293 -0.02140706 -0.04952838 -0.03348017 405  LYS   A HB3  
5384  H  HG2  . LYS   A  350 ? 0.88979870 0.77242362 0.78325355 -0.02274699 -0.04223054 -0.03131721 405  LYS   A HG2  
5385  H  HG3  . LYS   A  350 ? 0.89496869 0.77961773 0.79269803 -0.01365281 -0.04008483 -0.03628074 405  LYS   A HG3  
5386  H  HD2  . LYS   A  350 ? 0.91759920 0.78368777 0.79627436 -0.02294571 -0.04317746 -0.04007856 405  LYS   A HD2  
5387  H  HD3  . LYS   A  350 ? 0.90772092 0.79050165 0.79240203 -0.01966049 -0.03742143 -0.04125595 405  LYS   A HD3  
5388  H  HE2  . LYS   A  350 ? 0.93845439 0.81159037 0.82648468 -0.00613284 -0.03795639 -0.04861186 405  LYS   A HE2  
5389  H  HE3  . LYS   A  350 ? 0.94928300 0.80401528 0.82884204 -0.00998068 -0.04357943 -0.04782834 405  LYS   A HE3  
5390  H  HZ1  . LYS   A  350 ? 1.00064611 0.87494057 0.87581897 -0.01208646 -0.03422756 -0.05355559 405  LYS   A HZ1  
5391  H  HZ2  . LYS   A  350 ? 1.01241505 0.86963320 0.88043678 -0.01500512 -0.03976755 -0.05347534 405  LYS   A HZ2  
5392  H  HZ3  . LYS   A  350 ? 1.01618278 0.87691313 0.88919997 -0.00585990 -0.03671052 -0.05819069 405  LYS   A HZ3  
5393  N  N    . THR   A  351 ? 0.53538382 0.37356710 0.42624536 -0.01176304 -0.05712480 -0.02847762 406  THR   A N    
5394  C  CA   . THR   A  351 ? 0.55615044 0.37730908 0.44221756 -0.01203434 -0.06242254 -0.02611263 406  THR   A CA   
5395  C  C    . THR   A  351 ? 0.47353998 0.29754508 0.36281669 -0.01571876 -0.06429424 -0.01870064 406  THR   A C    
5396  O  O    . THR   A  351 ? 0.59654248 0.41045767 0.48050839 -0.02176270 -0.06732191 -0.01470452 406  THR   A O    
5397  C  CB   . THR   A  351 ? 0.55483156 0.36708272 0.44102645 -0.00234658 -0.06419376 -0.03079812 406  THR   A CB   
5398  O  OG1  . THR   A  351 ? 0.65162492 0.46252751 0.53449738 0.00048228  -0.06172777 -0.03788267 406  THR   A OG1  
5399  C  CG2  . THR   A  351 ? 0.54862297 0.34055546 0.42834342 -0.00198661 -0.07007296 -0.02880095 406  THR   A CG2  
5400  H  H    . THR   A  351 ? 0.55174202 0.39417949 0.44538885 -0.00651048 -0.05520059 -0.03206081 406  THR   A H    
5401  H  HA   . THR   A  351 ? 0.54340649 0.35647342 0.42337435 -0.01644140 -0.06365977 -0.02651233 406  THR   A HA   
5402  H  HB   . THR   A  351 ? 0.56232655 0.38341171 0.45520651 0.00204718  -0.06310364 -0.03049552 406  THR   A HB   
5404  H  HG21 . THR   A  351 ? 0.56450188 0.35063946 0.44417781 0.00470147  -0.07116723 -0.03238206 406  THR   A HG21 
5405  H  HG22 . THR   A  351 ? 0.56117380 0.34470505 0.43456191 -0.00709456 -0.07120652 -0.02872878 406  THR   A HG22 
5406  H  HG23 . THR   A  351 ? 0.55080163 0.34361517 0.43250421 -0.00339235 -0.07170948 -0.02402191 406  THR   A HG23 
5407  N  N    . ILE   A  352 ? 0.46069977 0.29873827 0.35844114 -0.01248439 -0.06230877 -0.01700945 407  ILE   A N    
5408  C  CA   . ILE   A  352 ? 0.44593996 0.28741238 0.34648913 -0.01548160 -0.06387382 -0.01044804 407  ILE   A CA   
5409  C  C    . ILE   A  352 ? 0.43146923 0.27780849 0.33031490 -0.02495865 -0.06252138 -0.00627017 407  ILE   A C    
5410  O  O    . ILE   A  352 ? 0.47878140 0.31881794 0.37440324 -0.02996743 -0.06495678 -0.00139485 407  ILE   A O    
5411  C  CB   . ILE   A  352 ? 0.45205575 0.30790862 0.36212948 -0.01000874 -0.06215544 -0.01019832 407  ILE   A CB   
5412  C  CG1  . ILE   A  352 ? 0.43844754 0.28901064 0.35107732 -0.00024856 -0.06457984 -0.01364865 407  ILE   A CG1  
5413  C  CG2  . ILE   A  352 ? 0.41247302 0.27362368 0.32493153 -0.01408085 -0.06317277 -0.00364586 407  ILE   A CG2  
5414  C  CD1  . ILE   A  352 ? 0.49716336 0.36475223 0.42028713 0.00569909  -0.06140563 -0.01632621 407  ILE   A CD1  
5415  H  H    . ILE   A  352 ? 0.45678806 0.30244896 0.35848159 -0.00844642 -0.05987694 -0.02013062 407  ILE   A H    
5416  H  HA   . ILE   A  352 ? 0.45943481 0.28985202 0.35650259 -0.01481951 -0.06730939 -0.00884697 407  ILE   A HA   
5417  H  HB   . ILE   A  352 ? 0.43128231 0.29723620 0.34453538 -0.01005933 -0.05862214 -0.01240553 407  ILE   A HB   
5418  H  HG12 . ILE   A  352 ? 0.46272424 0.30614582 0.37375772 0.00028042  -0.06809458 -0.01055600 407  ILE   A HG12 
5419  H  HG13 . ILE   A  352 ? 0.46731973 0.31008336 0.37619576 0.00169748  -0.06489626 -0.01730355 407  ILE   A HG13 
5420  H  HG21 . ILE   A  352 ? 0.42816615 0.27914757 0.33608872 -0.01580166 -0.06625047 -0.00095098 407  ILE   A HG21 
5421  H  HG22 . ILE   A  352 ? 0.41224080 0.28010520 0.32516748 -0.01892824 -0.06088989 -0.00225831 407  ILE   A HG22 
5422  H  HG23 . ILE   A  352 ? 0.41686994 0.28476447 0.33473396 -0.01011502 -0.06306534 -0.00363868 407  ILE   A HG23 
5423  H  HD11 . ILE   A  352 ? 0.46703118 0.34165901 0.39366534 0.00384789  -0.06140963 -0.01283460 407  ILE   A HD11 
5424  H  HD12 . ILE   A  352 ? 0.47144330 0.34590399 0.39562917 0.00489132  -0.05775156 -0.01916741 407  ILE   A HD12 
5425  H  HD13 . ILE   A  352 ? 0.48311013 0.34761119 0.40825889 0.01205220  -0.06307893 -0.01872681 407  ILE   A HD13 
5426  N  N    . ILE   A  353 ? 0.41132498 0.26865566 0.31202999 -0.02744980 -0.05866559 -0.00821147 408  ILE   A N    
5427  C  CA   . ILE   A  353 ? 0.40713444 0.26990384 0.30713779 -0.03555126 -0.05763441 -0.00452538 408  ILE   A CA   
5428  C  C    . ILE   A  353 ? 0.42467189 0.27381232 0.31702447 -0.04135279 -0.06063113 -0.00365515 408  ILE   A C    
5429  O  O    . ILE   A  353 ? 0.43251723 0.28033885 0.32387567 -0.04732925 -0.06187241 0.00113873  408  ILE   A O    
5430  C  CB   . ILE   A  353 ? 0.47873214 0.35463905 0.38147587 -0.03639663 -0.05344680 -0.00692795 408  ILE   A CB   
5431  C  CG1  . ILE   A  353 ? 0.56658471 0.45652407 0.47724742 -0.03249240 -0.05049421 -0.00648308 408  ILE   A CG1  
5432  C  CG2  . ILE   A  353 ? 0.49500793 0.37419945 0.39586234 -0.04441397 -0.05314681 -0.00414468 408  ILE   A CG2  
5433  C  CD1  . ILE   A  353 ? 0.65481204 0.55199087 0.56938028 -0.03599555 -0.05045405 -0.00101404 408  ILE   A CD1  
5434  H  H    . ILE   A  353 ? 0.41661626 0.27814102 0.31899160 -0.02400535 -0.05668791 -0.01183181 408  ILE   A H    
5435  H  HA   . ILE   A  353 ? 0.41661775 0.28330761 0.31937969 -0.03663096 -0.05785897 -0.00090413 408  ILE   A HA   
5436  H  HB   . ILE   A  353 ? 0.48608562 0.35872692 0.38627759 -0.03414649 -0.05294865 -0.01098926 408  ILE   A HB   
5437  H  HG12 . ILE   A  353 ? 0.56186473 0.44977370 0.47430909 -0.02746853 -0.05116822 -0.00801417 408  ILE   A HG12 
5438  H  HG13 . ILE   A  353 ? 0.55671811 0.45315626 0.46814078 -0.03236539 -0.04784864 -0.00866803 408  ILE   A HG13 
5439  H  HG21 . ILE   A  353 ? 0.48622370 0.36569574 0.38824308 -0.04702465 -0.05412856 -0.00035941 408  ILE   A HG21 
5440  H  HG22 . ILE   A  353 ? 0.49572387 0.36768451 0.39186668 -0.04660067 -0.05449394 -0.00567384 408  ILE   A HG22 
5441  H  HG23 . ILE   A  353 ? 0.48089802 0.36918759 0.38406467 -0.04473328 -0.05069584 -0.00468360 408  ILE   A HG23 
5442  H  HD11 . ILE   A  353 ? 0.61802030 0.50873607 0.53115082 -0.03654363 -0.05293674 0.00131591  408  ILE   A HD11 
5443  H  HD12 . ILE   A  353 ? 0.61492717 0.51532233 0.52856457 -0.04042229 -0.04955881 0.00026939  408  ILE   A HD12 
5444  H  HD13 . ILE   A  353 ? 0.61396080 0.51907331 0.53330946 -0.03332164 -0.04887445 -0.00112343 408  ILE   A HD13 
5445  N  N    . ALA   A  354 ? 0.42979804 0.26881242 0.31672215 -0.03967841 -0.06169923 -0.00847304 409  ALA   A N    
5446  C  CA   . ALA   A  354 ? 0.42517433 0.25101110 0.30460191 -0.04554420 -0.06460918 -0.00843036 409  ALA   A CA   
5447  C  C    . ALA   A  354 ? 0.48855889 0.30145755 0.36464104 -0.04737480 -0.06843475 -0.00417383 409  ALA   A C    
5448  O  O    . ALA   A  354 ? 0.44243103 0.25124529 0.31552607 -0.05513695 -0.06986883 -0.00052970 409  ALA   A O    
5449  C  CB   . ALA   A  354 ? 0.48450059 0.30086982 0.35824889 -0.04239325 -0.06519216 -0.01502448 409  ALA   A CB   
5450  H  H    . ALA   A  354 ? 0.42943466 0.26992473 0.31735879 -0.03482761 -0.06051153 -0.01206606 409  ALA   A H    
5451  H  HA   . ALA   A  354 ? 0.43925244 0.27078637 0.31913829 -0.05086830 -0.06373063 -0.00685423 409  ALA   A HA   
5452  H  HB1  . ALA   A  354 ? 0.47814554 0.28547221 0.34683266 -0.04669830 -0.06736541 -0.01496527 409  ALA   A HB1  
5453  H  HB2  . ALA   A  354 ? 0.46432829 0.28881043 0.33936515 -0.04183530 -0.06266998 -0.01749545 409  ALA   A HB2  
5454  H  HB3  . ALA   A  354 ? 0.47614637 0.28729531 0.34985429 -0.03665420 -0.06595652 -0.01690726 409  ALA   A HB3  
5455  N  N    . ALA   A  355 ? 0.46931648 0.27684581 0.34631234 -0.04024083 -0.07000080 -0.00436122 410  ALA   A N    
5456  C  CA   . ALA   A  355 ? 0.43620443 0.22972451 0.30875719 -0.04112250 -0.07407238 -0.00030505 410  ALA   A CA   
5457  C  C    . ALA   A  355 ? 0.45918670 0.25976408 0.33419520 -0.04641354 -0.07364744 0.00652713  410  ALA   A C    
5458  O  O    . ALA   A  355 ? 0.43942046 0.22909105 0.30944449 -0.05002191 -0.07652952 0.01093809  410  ALA   A O    
5459  C  CB   . ALA   A  355 ? 0.47113323 0.25778392 0.34435117 -0.03118443 -0.07620332 -0.00274356 410  ALA   A CB   
5460  H  H    . ALA   A  355 ? 0.46019030 0.27290991 0.34056765 -0.03474256 -0.06858893 -0.00702472 410  ALA   A H    
5461  H  HA   . ALA   A  355 ? 0.46588469 0.24884926 0.33275318 -0.04487743 -0.07589833 -0.00068446 410  ALA   A HA   
5462  H  HB1  . ALA   A  355 ? 0.47160161 0.24835800 0.34136829 -0.03154333 -0.07922973 0.00022095  410  ALA   A HB1  
5463  H  HB2  . ALA   A  355 ? 0.47087151 0.25203437 0.34187931 -0.02817995 -0.07644050 -0.00722368 410  ALA   A HB2  
5464  N  N    . LEU   A  356 ? 0.39492977 0.21335939 0.27701014 -0.04711951 -0.06992204 0.00738488  411  LEU   A N    
5465  C  CA   . LEU   A  356 ? 0.44570035 0.27221450 0.33051285 -0.05138300 -0.06899494 0.01306393  411  LEU   A CA   
5466  C  C    . LEU   A  356 ? 0.38861570 0.22229032 0.27387989 -0.06003916 -0.06692510 0.01501965  411  LEU   A C    
5467  O  O    . LEU   A  356 ? 0.38713813 0.22788687 0.27457154 -0.06398652 -0.06574406 0.01932987  411  LEU   A O    
5468  C  CB   . LEU   A  356 ? 0.41942427 0.26094875 0.31220233 -0.04602430 -0.06651264 0.01284783  411  LEU   A CB   
5469  C  CG   . LEU   A  356 ? 0.42099285 0.25896013 0.31544650 -0.03756554 -0.06862435 0.01171466  411  LEU   A CG   
5470  C  CD1  . LEU   A  356 ? 0.38408470 0.23834774 0.28703231 -0.03351701 -0.06584936 0.01099985  411  LEU   A CD1  
5471  C  CD2  . LEU   A  356 ? 0.42274833 0.24889785 0.31219411 -0.03824871 -0.07264090 0.01646743  411  LEU   A CD2  
5472  H  H    . LEU   A  356 ? 0.41279709 0.23830788 0.29780722 -0.04475766 -0.06785468 0.00425583  411  LEU   A H    
5473  H  HA   . LEU   A  356 ? 0.42838085 0.24618945 0.30966288 -0.05204205 -0.07140124 0.01588185  411  LEU   A HA   
5474  H  HB2  . LEU   A  356 ? 0.41425586 0.26330113 0.30989137 -0.04525141 -0.06418080 0.01001143  411  LEU   A HB2  
5475  H  HB3  . LEU   A  356 ? 0.41408852 0.26125985 0.30841261 -0.04917148 -0.06568824 0.01625517  411  LEU   A HB3  
5476  H  HG   . LEU   A  356 ? 0.42307854 0.25531039 0.31606889 -0.03411763 -0.06933782 0.00805138  411  LEU   A HG   
5477  H  HD11 . LEU   A  356 ? 0.39403698 0.24704477 0.29889435 -0.02775919 -0.06711968 0.00948368  411  LEU   A HD11 
5478  H  HD12 . LEU   A  356 ? 0.38456535 0.24339953 0.28862888 -0.03623587 -0.06553204 0.01448172  411  LEU   A HD12 
5479  H  HD13 . LEU   A  356 ? 0.38451189 0.24598259 0.28984103 -0.03399887 -0.06315053 0.00852731  411  LEU   A HD13 
5480  H  HD21 . LEU   A  356 ? 0.43664199 0.25091481 0.32045782 -0.03996308 -0.07467221 0.01637911  411  LEU   A HD21 
5481  H  HD22 . LEU   A  356 ? 0.41978326 0.25023368 0.30935597 -0.04262318 -0.07182589 0.02003767  411  LEU   A HD22 
5482  H  HD23 . LEU   A  356 ? 0.42725253 0.25323415 0.31875017 -0.03264244 -0.07407761 0.01603296  411  LEU   A HD23 
5483  N  N    . THR   A  357 ? 0.40098184 0.23325318 0.28433913 -0.06258206 -0.06656414 0.01148818  412  THR   A N    
5484  C  CA   . THR   A  357 ? 0.36651313 0.20789781 0.25173122 -0.06953505 -0.06473152 0.01234155  412  THR   A CA   
5485  C  C    . THR   A  357 ? 0.36623305 0.19826536 0.24646994 -0.07776103 -0.06690106 0.01474871  412  THR   A C    
5486  O  O    . THR   A  357 ? 0.37581009 0.19486129 0.25021011 -0.07872216 -0.06943132 0.01222613  412  THR   A O    
5487  C  CB   . THR   A  357 ? 0.38959020 0.23538746 0.27524567 -0.06786747 -0.06343076 0.00715955  412  THR   A CB   
5488  O  OG1  . THR   A  357 ? 0.39442271 0.25191021 0.28558776 -0.06196426 -0.06056380 0.00575288  412  THR   A OG1  
5489  C  CG2  . THR   A  357 ? 0.40442196 0.25643280 0.29057434 -0.07499962 -0.06289619 0.00749427  412  THR   A CG2  
5490  H  H    . THR   A  357 ? 0.40080088 0.22607425 0.28151006 -0.05976715 -0.06768461 0.00833182  412  THR   A H    
5491  H  HA   . THR   A  357 ? 0.36449939 0.21565360 0.25393906 -0.07003635 -0.06291392 0.01462539  412  THR   A HA   
5492  H  HB   . THR   A  357 ? 0.40125424 0.23736095 0.28279892 -0.06590518 -0.06505382 0.00434802  412  THR   A HB   
5494  H  HG21 . THR   A  357 ? 0.39755940 0.25383773 0.28413588 -0.07341798 -0.06188209 0.00450447  412  THR   A HG21 
5495  H  HG22 . THR   A  357 ? 0.38981444 0.24993707 0.27967876 -0.07727174 -0.06162157 0.01050956  412  THR   A HG22 
5496  H  HG23 . THR   A  357 ? 0.40712816 0.25083941 0.28941035 -0.07895926 -0.06492586 0.00761785  412  THR   A HG23 
5497  N  N    . CYS   A  358 ? 0.39551139 0.23434873 0.27812836 -0.08369373 -0.06573933 0.01936676  413  CYS   A N    
5498  C  CA   . CYS   A  358 ? 0.51215261 0.34680423 0.39205569 -0.09277537 -0.06679198 0.02165909  413  CYS   A CA   
5499  C  C    . CYS   A  358 ? 0.57050180 0.38555443 0.44206771 -0.09459401 -0.07038257 0.02228702  413  CYS   A C    
5500  O  O    . CYS   A  358 ? 0.48807162 0.29507181 0.35571474 -0.09940900 -0.07229917 0.02047006  413  CYS   A O    
5501  C  CB   . CYS   A  358 ? 0.40559393 0.24703109 0.28755957 -0.09685738 -0.06640968 0.01863610  413  CYS   A CB   
5502  S  SG   . CYS   A  358 ? 0.46388555 0.32692450 0.35476613 -0.09510829 -0.06272691 0.01830689  413  CYS   A SG   
5503  H  H    . CYS   A  358 ? 0.39645800 0.24318543 0.28269491 -0.08207777 -0.06411196 0.02104196  413  CYS   A H    
5504  H  HA   . CYS   A  358 ? 0.46584564 0.30634713 0.34801659 -0.09545446 -0.06544758 0.02504130  413  CYS   A HA   
5505  H  HB2  . CYS   A  358 ? 0.44641694 0.28178641 0.32547009 -0.09446016 -0.06768703 0.01514530  413  CYS   A HB2  
5506  H  HB3  . CYS   A  358 ? 0.44473219 0.28411996 0.32560199 -0.10309330 -0.06717730 0.02022726  413  CYS   A HB3  
5507  N  N    . LYS   A  359 ? 0.51574194 0.32288057 0.38438860 -0.09071606 -0.07159746 0.02486216  414  LYS   A N    
5508  C  CA   . LYS   A  359 ? 0.48513639 0.27204803 0.34527290 -0.09064320 -0.07547884 0.02537722  414  LYS   A CA   
5509  C  C    . LYS   A  359 ? 0.49523491 0.27440411 0.35038388 -0.09790142 -0.07644530 0.03145104  414  LYS   A C    
5510  O  O    . LYS   A  359 ? 0.51939082 0.28101772 0.36660051 -0.10089940 -0.07968161 0.03236621  414  LYS   A O    
5511  C  CB   . LYS   A  359 ? 0.52014172 0.30082962 0.37938607 -0.08016682 -0.07716671 0.02369091  414  LYS   A CB   
5512  C  CG   . LYS   A  359 ? 0.49744636 0.28046498 0.35917866 -0.07285357 -0.07673567 0.01696625  414  LYS   A CG   
5513  C  CD   . LYS   A  359 ? 0.50834036 0.27553672 0.36320543 -0.07361568 -0.07958485 0.01297253  414  LYS   A CD   
5514  C  CE   . LYS   A  359 ? 0.62809497 0.39794350 0.48471808 -0.06638598 -0.07865600 0.00610171  414  LYS   A CE   
5515  N  NZ   . LYS   A  359 ? 0.66231197 0.44635502 0.52300066 -0.06978910 -0.07560913 0.00370994  414  LYS   A NZ   
5516  H  H    . LYS   A  359 ? 0.50743765 0.32162702 0.37927237 -0.08795250 -0.07020114 0.02634351  414  LYS   A H    
5517  H  HA   . LYS   A  359 ? 0.50720739 0.28826565 0.36483169 -0.09245007 -0.07669173 0.02259527  414  LYS   A HA   
5518  H  HB2  . LYS   A  359 ? 0.49946436 0.28813183 0.36219245 -0.07799482 -0.07582670 0.02579046  414  LYS   A HB2  
5519  H  HB3  . LYS   A  359 ? 0.52139384 0.28837687 0.37478393 -0.08026248 -0.07996422 0.02500211  414  LYS   A HB3  
5520  H  HG2  . LYS   A  359 ? 0.48887184 0.28405899 0.35526612 -0.07388336 -0.07417283 0.01575583  414  LYS   A HG2  
5521  H  HG3  . LYS   A  359 ? 0.49899101 0.28244317 0.36233562 -0.06634903 -0.07701243 0.01631077  414  LYS   A HG3  
5522  H  HD2  . LYS   A  359 ? 0.54567558 0.29991859 0.39561749 -0.07245854 -0.08231772 0.01425015  414  LYS   A HD2  
5523  H  HD3  . LYS   A  359 ? 0.53506303 0.30216417 0.38856912 -0.08038972 -0.07950920 0.01357968  414  LYS   A HD3  
5524  H  HE2  . LYS   A  359 ? 0.59774971 0.37216187 0.45778227 -0.06009679 -0.07786175 0.00554614  414  LYS   A HE2  
5525  H  HE3  . LYS   A  359 ? 0.61736226 0.37455285 0.46872497 -0.06541142 -0.08097141 0.00358141  414  LYS   A HE3  
5526  H  HZ1  . LYS   A  359 ? 0.63297427 0.42839599 0.49852413 -0.07023232 -0.07350593 0.00582587  414  LYS   A HZ1  
5527  H  HZ2  . LYS   A  359 ? 0.64996415 0.43056336 0.50802368 -0.07562733 -0.07651974 0.00414856  414  LYS   A HZ2  
5528  H  HZ3  . LYS   A  359 ? 0.64702308 0.43188938 0.50785887 -0.06563716 -0.07499166 -0.00036269 414  LYS   A HZ3  
5529  N  N    . LYS   A  360 ? 0.53429031 0.32562789 0.39335024 -0.10073720 -0.07361234 0.03558387  415  LYS   A N    
5530  C  CA   . LYS   A  360 ? 0.58547986 0.37038028 0.43930030 -0.10797974 -0.07387524 0.04140218  415  LYS   A CA   
5531  C  C    . LYS   A  360 ? 0.53284228 0.33377919 0.39247563 -0.11562274 -0.06993086 0.04331926  415  LYS   A C    
5532  O  O    . LYS   A  360 ? 0.52960420 0.34705549 0.39725548 -0.11279340 -0.06710457 0.04146218  415  LYS   A O    
5533  C  CB   . LYS   A  360 ? 0.59493411 0.37557226 0.44549206 -0.10312892 -0.07485558 0.04519479  415  LYS   A CB   
5534  C  CG   . LYS   A  360 ? 0.88395971 0.64841527 0.72918195 -0.09503789 -0.07930492 0.04342087  415  LYS   A CG   
5535  C  CD   . LYS   A  360 ? 1.03205931 0.78329378 0.86909163 -0.09437348 -0.08225120 0.04884505  415  LYS   A CD   
5536  C  CE   . LYS   A  360 ? 0.96387154 0.70421231 0.79856038 -0.08395434 -0.08645563 0.04692169  415  LYS   A CE   
5537  N  NZ   . LYS   A  360 ? 1.03596377 0.76180041 0.86700040 -0.08175040 -0.08947071 0.04259188  415  LYS   A NZ   
5538  H  H    . LYS   A  360 ? 0.51690984 0.32037565 0.38157356 -0.09823191 -0.07140954 0.03476368  415  LYS   A H    
5539  H  HA   . LYS   A  360 ? 0.58600581 0.35844851 0.43427020 -0.11134142 -0.07613438 0.04155142  415  LYS   A HA   
5540  H  HB2  . LYS   A  360 ? 0.63015509 0.42288452 0.48614252 -0.09992597 -0.07273968 0.04488132  415  LYS   A HB2  
5541  H  HB3  . LYS   A  360 ? 0.65041208 0.42705044 0.49688190 -0.10850682 -0.07474578 0.04918632  415  LYS   A HB3  
5542  H  HG2  . LYS   A  360 ? 0.82911420 0.58438021 0.67122716 -0.09648968 -0.08101249 0.04136693  415  LYS   A HG2  
5543  H  HG3  . LYS   A  360 ? 0.81636393 0.58780688 0.66641921 -0.08848224 -0.07876010 0.04056928  415  LYS   A HG3  
5544  H  HD2  . LYS   A  360 ? 0.97401297 0.73420388 0.81313491 -0.09515532 -0.08028853 0.05141937  415  LYS   A HD2  
5545  H  HD3  . LYS   A  360 ? 0.99401158 0.73487878 0.82491088 -0.10036141 -0.08340486 0.05124050  415  LYS   A HD3  
5546  H  HE2  . LYS   A  360 ? 0.98246729 0.73361850 0.82346439 -0.07837065 -0.08518564 0.04473070  415  LYS   A HE2  
5547  H  HE3  . LYS   A  360 ? 1.00315702 0.73522466 0.83238590 -0.08385788 -0.08858943 0.05066828  415  LYS   A HE3  
5548  H  HZ1  . LYS   A  360 ? 1.00860834 0.74222064 0.84465361 -0.08026800 -0.08776084 0.03871455  415  LYS   A HZ1  
5549  H  HZ2  . LYS   A  360 ? 1.02724040 0.74422216 0.85307634 -0.08776096 -0.09031387 0.04424056  415  LYS   A HZ2  
5550  H  HZ3  . LYS   A  360 ? 1.02472138 0.74245733 0.85350186 -0.07584742 -0.09227023 0.04204345  415  LYS   A HZ3  
5551  N  N    . PRO   A  361 ? 0.79612774 0.59287900 0.65210485 -0.12539533 -0.06956829 0.04701579  416  PRO   A N    
5552  C  CA   . PRO   A  361 ? 0.73723805 0.55015433 0.59983373 -0.13271250 -0.06578784 0.04816326  416  PRO   A CA   
5553  C  C    . PRO   A  361 ? 0.65051627 0.48005050 0.51933807 -0.12951379 -0.06198948 0.04968167  416  PRO   A C    
5554  O  O    . PRO   A  361 ? 0.82804739 0.67404693 0.70520675 -0.13041416 -0.05916688 0.04806149  416  PRO   A O    
5555  C  CB   . PRO   A  361 ? 0.72705269 0.53026062 0.58305365 -0.14293005 -0.06600953 0.05278086  416  PRO   A CB   
5556  C  CG   . PRO   A  361 ? 0.84561491 0.62545556 0.69120395 -0.14166391 -0.07076188 0.05300425  416  PRO   A CG   
5557  C  CD   . PRO   A  361 ? 0.88430512 0.66081697 0.72968268 -0.12980852 -0.07267279 0.05046090  416  PRO   A CD   
5558  H  HA   . PRO   A  361 ? 0.72353506 0.54130846 0.58997488 -0.13359216 -0.06584749 0.04503220  416  PRO   A HA   
5559  H  HB2  . PRO   A  361 ? 0.75179660 0.55832660 0.60696983 -0.14419432 -0.06408810 0.05615424  416  PRO   A HB2  
5560  H  HB3  . PRO   A  361 ? 0.75272942 0.56114316 0.61185056 -0.14883627 -0.06513000 0.05208112  416  PRO   A HB3  
5561  H  HG2  . PRO   A  361 ? 0.84065473 0.61243862 0.68032479 -0.14558861 -0.07107975 0.05698619  416  PRO   A HG2  
5562  H  HG3  . PRO   A  361 ? 0.83616102 0.61122823 0.68108815 -0.14458875 -0.07231204 0.05073374  416  PRO   A HG3  
5563  H  HD2  . PRO   A  361 ? 0.86040008 0.63318229 0.70239627 -0.12763330 -0.07298799 0.05340206  416  PRO   A HD2  
5564  H  HD3  . PRO   A  361 ? 0.86241972 0.62799615 0.70436740 -0.12750340 -0.07552402 0.04806017  416  PRO   A HD3  
5565  N  N    . ASP   A  362 ? 0.54180944 0.36619058 0.40611783 -0.12565181 -0.06233566 0.05272739  417  ASP   A N    
5566  C  CA   . ASP   A  362 ? 0.75604236 0.59359783 0.62410587 -0.12416269 -0.05893131 0.05486682  417  ASP   A CA   
5567  C  C    . ASP   A  362 ? 0.59866643 0.44022813 0.46968973 -0.11387239 -0.05957475 0.05269175  417  ASP   A C    
5568  O  O    . ASP   A  362 ? 0.63613796 0.48504478 0.50838470 -0.11167073 -0.05774688 0.05456025  417  ASP   A O    
5569  C  CB   . ASP   A  362 ? 0.82256168 0.65204698 0.68237329 -0.12971890 -0.05852103 0.06063409  417  ASP   A CB   
5570  C  CG   . ASP   A  362 ? 1.37598002 1.18363953 1.22463644 -0.12843770 -0.06313317 0.06306024  417  ASP   A CG   
5571  O  OD1  . ASP   A  362 ? 0.95781016 0.75590903 0.80538034 -0.12316529 -0.06672719 0.05987936  417  ASP   A OD1  
5572  O  OD2  . ASP   A  362 ? 1.30960679 1.10956001 1.15026760 -0.13256265 -0.06314294 0.06810813  417  ASP   A OD2  
5573  H  H    . ASP   A  362 ? 0.62345386 0.43545756 0.48197842 -0.12373261 -0.06498243 0.05338141  417  ASP   A H    
5574  H  HA   . ASP   A  362 ? 0.67199486 0.52136594 0.54592609 -0.12689856 -0.05636403 0.05400487  417  ASP   A HA   
5575  H  HB2  . ASP   A  362 ? 0.89537525 0.73178023 0.75642163 -0.12766665 -0.05673584 0.06187637  417  ASP   A HB2  
5576  H  HB3  . ASP   A  362 ? 0.90573990 0.73764175 0.76595646 -0.13669252 -0.05686773 0.06180621  417  ASP   A HB3  
5577  N  N    . GLN   A  363 ? 0.45230678 0.28982413 0.32472432 -0.10806776 -0.06192422 0.04845006  418  GLN   A N    
5578  C  CA   . GLN   A  363 ? 0.41266179 0.25213665 0.28760839 -0.09848773 -0.06291664 0.04599745  418  GLN   A CA   
5579  C  C    . GLN   A  363 ? 0.47913271 0.33508742 0.36078653 -0.09589576 -0.05963486 0.04623709  418  GLN   A C    
5580  O  O    . GLN   A  363 ? 0.47671008 0.34555325 0.36474520 -0.09785060 -0.05677753 0.04469053  418  GLN   A O    
5581  C  CB   . GLN   A  363 ? 0.42579943 0.26488611 0.30374205 -0.09449415 -0.06395198 0.04057151  418  GLN   A CB   
5582  C  CG   . GLN   A  363 ? 0.40877897 0.24712083 0.28838161 -0.08505102 -0.06526580 0.03773794  418  GLN   A CG   
5583  C  CD   . GLN   A  363 ? 0.41052771 0.24559750 0.29092813 -0.08147607 -0.06630965 0.03243315  418  GLN   A CD   
5584  O  OE1  . GLN   A  363 ? 0.45928666 0.28186285 0.33439016 -0.08404948 -0.06862850 0.03121297  418  GLN   A OE1  
5585  N  NE2  . GLN   A  363 ? 0.44145837 0.28667510 0.32772684 -0.07545429 -0.06469171 0.02911200  418  GLN   A NE2  
5586  H  H    . GLN   A  363 ? 0.47795445 0.31162149 0.34980011 -0.11044952 -0.06284188 0.04685084  418  GLN   A H    
5587  H  HA   . GLN   A  363 ? 0.44353434 0.27337649 0.31357560 -0.09614410 -0.06520739 0.04754234  418  GLN   A HA   
5588  H  HB2  . GLN   A  363 ? 0.43019480 0.25935125 0.30394870 -0.09711420 -0.06581054 0.04021027  418  GLN   A HB2  
5589  H  HB3  . GLN   A  363 ? 0.41036487 0.25970268 0.29322433 -0.09606370 -0.06184690 0.03914633  418  GLN   A HB3  
5590  H  HG2  . GLN   A  363 ? 0.40092653 0.24989256 0.28525114 -0.08283291 -0.06331620 0.03762446  418  GLN   A HG2  
5591  H  HG3  . GLN   A  363 ? 0.42026234 0.24979964 0.29564399 -0.08306902 -0.06741992 0.03947117  418  GLN   A HG3  
5592  H  HE21 . GLN   A  363 ? 0.41988558 0.27190965 0.30918896 -0.07321686 -0.06357979 0.03005315  418  GLN   A HE21 
5593  H  HE22 . GLN   A  363 ? 0.42767918 0.27280587 0.31462696 -0.07381018 -0.06467598 0.02591543  418  GLN   A HE22 
5594  N  N    . HIS   A  364 ? 0.39204246 0.24723676 0.27219296 -0.09116466 -0.06043646 0.04798827  419  HIS   A N    
5595  C  CA   . HIS   A  364 ? 0.34106350 0.21027152 0.22628716 -0.08967490 -0.05752342 0.04856004  419  HIS   A CA   
5596  C  C    . HIS   A  364 ? 0.35571963 0.23250145 0.24719191 -0.08186083 -0.05753051 0.04493837  419  HIS   A C    
5597  O  O    . HIS   A  364 ? 0.35336012 0.23726887 0.24719489 -0.07884578 -0.05668868 0.04560265  419  HIS   A O    
5598  C  CB   . HIS   A  364 ? 0.35527933 0.22026926 0.23441544 -0.09098752 -0.05803020 0.05314341  419  HIS   A CB   
5599  C  CG   . HIS   A  364 ? 0.37581742 0.23458841 0.24863796 -0.09945162 -0.05720820 0.05699233  419  HIS   A CG   
5600  N  ND1  . HIS   A  364 ? 0.37951258 0.24928120 0.25552240 -0.10566172 -0.05299037 0.05790977  419  HIS   A ND1  
5601  C  CD2  . HIS   A  364 ? 0.39766765 0.24063182 0.26143649 -0.10264829 -0.05998880 0.06004534  419  HIS   A CD2  
5602  C  CE1  . HIS   A  364 ? 0.35988271 0.22121997 0.22917804 -0.11284313 -0.05297073 0.06137859  419  HIS   A CE1  
5603  N  NE2  . HIS   A  364 ? 0.41286230 0.25727415 0.27419180 -0.11153033 -0.05722186 0.06291101  419  HIS   A NE2  
5604  H  H    . HIS   A  364 ? 0.40857214 0.25424516 0.28442973 -0.08879701 -0.06302246 0.04874676  419  HIS   A H    
5605  H  HA   . HIS   A  364 ? 0.35081649 0.22763672 0.23915726 -0.09347977 -0.05505503 0.04839821  419  HIS   A HA   
5606  H  HB2  . HIS   A  364 ? 0.36209702 0.21936330 0.23808876 -0.08710187 -0.06088684 0.05346997  419  HIS   A HB2  
5607  H  HB3  . HIS   A  364 ? 0.34725678 0.22138146 0.22954553 -0.08998638 -0.05611306 0.05322910  419  HIS   A HB3  
5609  H  HD2  . HIS   A  364 ? 0.40722588 0.24007925 0.26728353 -0.09939363 -0.06322033 0.06005499  419  HIS   A HD2  
5610  H  HE1  . HIS   A  364 ? 0.37464571 0.24117216 0.24471363 -0.11814928 -0.05031544 0.06258994  419  HIS   A HE1  
5612  N  N    . PHE   A  365 ? 0.32207960 0.19707954 0.21581873 -0.07881179 -0.05844603 0.04101267  420  PHE   A N    
5613  C  CA   . PHE   A  365 ? 0.32972306 0.21386278 0.22992283 -0.07269435 -0.05743665 0.03736871  420  PHE   A CA   
5614  C  C    . PHE   A  365 ? 0.31987393 0.20467407 0.22198662 -0.07294129 -0.05692840 0.03343586  420  PHE   A C    
5615  O  O    . PHE   A  365 ? 0.31160355 0.18690655 0.20938247 -0.07620461 -0.05850511 0.03314488  420  PHE   A O    
5616  C  CB   . PHE   A  365 ? 0.31797189 0.19695237 0.21759763 -0.06535831 -0.06018862 0.03656921  420  PHE   A CB   
5617  C  CG   . PHE   A  365 ? 0.33699250 0.20240252 0.23242477 -0.06262229 -0.06340913 0.03467358  420  PHE   A CG   
5618  C  CD1  . PHE   A  365 ? 0.44115657 0.30747721 0.33936504 -0.05920033 -0.06298405 0.02986534  420  PHE   A CD1  
5619  C  CD2  . PHE   A  365 ? 0.36552933 0.21639544 0.25337502 -0.06379788 -0.06680823 0.03765703  420  PHE   A CD2  
5620  C  CE1  . PHE   A  365 ? 0.46112680 0.31430751 0.35502785 -0.05657118 -0.06583676 0.02761617  420  PHE   A CE1  
5621  C  CE2  . PHE   A  365 ? 0.38029379 0.21715632 0.26376635 -0.06116887 -0.07002603 0.03572096  420  PHE   A CE2  
5622  C  CZ   . PHE   A  365 ? 0.42290616 0.26106754 0.30959791 -0.05744823 -0.06947853 0.03048199  420  PHE   A CZ   
5623  H  H    . PHE   A  365 ? 0.34192282 0.20975223 0.23283878 -0.08074357 -0.05963683 0.04054777  420  PHE   A H    
5624  H  HA   . PHE   A  365 ? 0.31272259 0.20619559 0.21638079 -0.07327315 -0.05531979 0.03790651  420  PHE   A HA   
5625  H  HB2  . PHE   A  365 ? 0.31467605 0.20148247 0.21915010 -0.06198367 -0.05900056 0.03450106  420  PHE   A HB2  
5626  H  HB3  . PHE   A  365 ? 0.32523331 0.20241374 0.22253829 -0.06564267 -0.06106605 0.03932285  420  PHE   A HB3  
5627  H  HD1  . PHE   A  365 ? 0.40095043 0.27651587 0.30357277 -0.05868084 -0.06071453 0.02806030  420  PHE   A HD1  
5628  H  HD2  . PHE   A  365 ? 0.36532521 0.21522163 0.25048280 -0.06640445 -0.06697873 0.04101802  420  PHE   A HD2  
5629  H  HE1  . PHE   A  365 ? 0.44274464 0.29683161 0.33823776 -0.05416264 -0.06530122 0.02410866  420  PHE   A HE1  
5630  H  HE2  . PHE   A  365 ? 0.40144452 0.22759795 0.27932289 -0.06197252 -0.07254904 0.03797292  420  PHE   A HE2  
5631  H  HZ   . PHE   A  365 ? 0.43136320 0.25989833 0.31497842 -0.05533618 -0.07159942 0.02884591  420  PHE   A HZ   
5632  N  N    . LYS   A  366 ? 0.29688329 0.19243738 0.20479761 -0.06991705 -0.05482196 0.03055740  421  LYS   A N    
5633  C  CA   . LYS   A  366 ? 0.34153244 0.23818772 0.25056133 -0.06950071 -0.05432589 0.02665650  421  LYS   A CA   
5634  C  C    . LYS   A  366 ? 0.31126517 0.21157187 0.22350337 -0.06250826 -0.05377322 0.02325820  421  LYS   A C    
5635  O  O    . LYS   A  366 ? 0.23716664 0.14621314 0.15372625 -0.05997803 -0.05226188 0.02379028  421  LYS   A O    
5636  C  CB   . LYS   A  366 ? 0.28632632 0.19343968 0.19886713 -0.07374702 -0.05196412 0.02656415  421  LYS   A CB   
5637  C  CG   . LYS   A  366 ? 0.29195642 0.19897589 0.20410424 -0.07412749 -0.05207509 0.02285674  421  LYS   A CG   
5638  C  CD   . LYS   A  366 ? 0.28340012 0.19991255 0.19864114 -0.07866374 -0.05067649 0.02317822  421  LYS   A CD   
5639  C  CE   . LYS   A  366 ? 0.32046479 0.23620489 0.23518769 -0.08520456 -0.05112050 0.02607719  421  LYS   A CE   
5640  N  NZ   . LYS   A  366 ? 0.34579101 0.24904270 0.25502098 -0.08824201 -0.05369117 0.02567047  421  LYS   A NZ   
5641  H  H    . LYS   A  366 ? 0.30221936 0.20436472 0.21304998 -0.06821757 -0.05369457 0.03109221  421  LYS   A H    
5642  H  HA   . LYS   A  366 ? 0.32640892 0.21433079 0.23160690 -0.07082552 -0.05603551 0.02610314  421  LYS   A HA   
5643  H  HB2  . LYS   A  366 ? 0.29865861 0.20505008 0.21014930 -0.07808777 -0.05200136 0.02878744  421  LYS   A HB2  
5644  H  HB3  . LYS   A  366 ? 0.28850329 0.20353493 0.20458472 -0.07206481 -0.05035510 0.02682208  421  LYS   A HB3  
5645  H  HG2  . LYS   A  366 ? 0.28864497 0.19770128 0.20200911 -0.07002122 -0.05146578 0.02066540  421  LYS   A HG2  
5646  H  HG3  . LYS   A  366 ? 0.30065614 0.19901612 0.20902273 -0.07536075 -0.05385423 0.02220411  421  LYS   A HG3  
5647  H  HD2  . LYS   A  366 ? 0.28352907 0.20783918 0.20219098 -0.07715813 -0.04902620 0.02369928  421  LYS   A HD2  
5648  H  HD3  . LYS   A  366 ? 0.29312950 0.20898640 0.20743556 -0.07863276 -0.05111213 0.02075877  421  LYS   A HD3  
5649  H  HE2  . LYS   A  366 ? 0.31227511 0.22939427 0.22765738 -0.08541275 -0.05036421 0.02847184  421  LYS   A HE2  
5650  H  HE3  . LYS   A  366 ? 0.30977082 0.23211583 0.22712792 -0.08748467 -0.05044144 0.02588039  421  LYS   A HE3  
5651  H  HZ1  . LYS   A  366 ? 0.34605634 0.24317564 0.25282922 -0.08711347 -0.05440449 0.02685879  421  LYS   A HZ1  
5652  H  HZ2  . LYS   A  366 ? 0.34424347 0.24454246 0.25201750 -0.08676439 -0.05454637 0.02305636  421  LYS   A HZ2  
5653  H  HZ3  . LYS   A  366 ? 0.34305149 0.24731201 0.25255844 -0.09284735 -0.05381671 0.02680735  421  LYS   A HZ3  
5654  N  N    . PRO   A  367 ? 0.32906461 0.22238278 0.23908773 -0.05933284 -0.05497748 0.01959034  422  PRO   A N    
5655  C  CA   . PRO   A  367 ? 0.30471611 0.20253381 0.21810994 -0.05291495 -0.05382427 0.01581732  422  PRO   A CA   
5656  C  C    . PRO   A  367 ? 0.37074250 0.27781314 0.28646272 -0.05386688 -0.05094618 0.01328861  422  PRO   A C    
5657  O  O    . PRO   A  367 ? 0.31126136 0.21683043 0.22435328 -0.05818806 -0.05104262 0.01283848  422  PRO   A O    
5658  C  CB   . PRO   A  367 ? 0.33240080 0.21741241 0.24134083 -0.04952928 -0.05634037 0.01282528  422  PRO   A CB   
5659  C  CG   . PRO   A  367 ? 0.38096517 0.25719714 0.28424934 -0.05566884 -0.05785577 0.01360436  422  PRO   A CG   
5660  C  CD   . PRO   A  367 ? 0.29996258 0.18002802 0.20382708 -0.06174227 -0.05751541 0.01877565  422  PRO   A CD   
5661  H  HA   . PRO   A  367 ? 0.31851870 0.22028384 0.23481707 -0.05030077 -0.05361562 0.01682651  422  PRO   A HA   
5662  H  HB2  . PRO   A  367 ? 0.33890018 0.22622135 0.24905051 -0.04639164 -0.05520241 0.00941041  422  PRO   A HB2  
5663  H  HB3  . PRO   A  367 ? 0.34241050 0.22274271 0.25086108 -0.04685586 -0.05813107 0.01387833  422  PRO   A HB3  
5664  H  HG2  . PRO   A  367 ? 0.35010540 0.22893956 0.25321865 -0.05697313 -0.05676954 0.01139329  422  PRO   A HG2  
5665  H  HG3  . PRO   A  367 ? 0.36237067 0.22812867 0.26179120 -0.05463441 -0.06013288 0.01307600  422  PRO   A HG3  
5666  H  HD2  . PRO   A  367 ? 0.32285178 0.20409232 0.22596049 -0.06619845 -0.05707930 0.01897340  422  PRO   A HD2  
5667  H  HD3  . PRO   A  367 ? 0.32989728 0.20283890 0.23094568 -0.06235524 -0.05933350 0.02101347  422  PRO   A HD3  
5668  N  N    . TYR   A  368 ? 0.32585096 0.24176010 0.24610701 -0.04976195 -0.04869512 0.01151919  423  TYR   A N    
5669  C  CA   . TYR   A  368 ? 0.28324771 0.20780176 0.20511670 -0.05037927 -0.04584100 0.00951907  423  TYR   A CA   
5670  C  C    . TYR   A  368 ? 0.31341803 0.24193396 0.23810101 -0.04458981 -0.04402201 0.00595267  423  TYR   A C    
5671  O  O    . TYR   A  368 ? 0.33899504 0.26909250 0.26735988 -0.04076177 -0.04443383 0.00631154  423  TYR   A O    
5672  C  CB   . TYR   A  368 ? 0.26325032 0.19820593 0.18900999 -0.05316171 -0.04403080 0.01262918  423  TYR   A CB   
5673  C  CG   . TYR   A  368 ? 0.25944772 0.19469239 0.18401521 -0.05884803 -0.04469206 0.01558379  423  TYR   A CG   
5674  C  CD1  . TYR   A  368 ? 0.26038677 0.19259918 0.18460482 -0.06114793 -0.04607226 0.01894828  423  TYR   A CD1  
5675  C  CD2  . TYR   A  368 ? 0.28947216 0.22896653 0.21349032 -0.06186466 -0.04383503 0.01503769  423  TYR   A CD2  
5676  C  CE1  . TYR   A  368 ? 0.30638409 0.24049002 0.23040482 -0.06642395 -0.04611462 0.02140485  423  TYR   A CE1  
5677  C  CE2  . TYR   A  368 ? 0.25566497 0.19734533 0.18009834 -0.06666066 -0.04439760 0.01753445  423  TYR   A CE2  
5678  C  CZ   . TYR   A  368 ? 0.32023787 0.25954920 0.24500588 -0.06897900 -0.04530975 0.02054959  423  TYR   A CZ   
5679  O  OH   . TYR   A  368 ? 0.32886958 0.27149040 0.25473553 -0.07370529 -0.04539865 0.02267738  423  TYR   A OH   
5680  H  H    . TYR   A  368 ? 0.32415584 0.24066937 0.24647230 -0.04656241 -0.04904172 0.01167111  423  TYR   A H    
5681  H  HA   . TYR   A  368 ? 0.29752466 0.21884064 0.21616371 -0.05253368 -0.04621467 0.00829781  423  TYR   A HA   
5682  H  HB2  . TYR   A  368 ? 0.26220226 0.19908974 0.19048406 -0.05149541 -0.04411566 0.01395179  423  TYR   A HB2  
5683  H  HB3  . TYR   A  368 ? 0.26163366 0.20201784 0.18859459 -0.05248290 -0.04216617 0.01120589  423  TYR   A HB3  
5684  H  HD1  . TYR   A  368 ? 0.27355012 0.20242250 0.19755834 -0.05914296 -0.04700964 0.01955502  423  TYR   A HD1  
5685  H  HD2  . TYR   A  368 ? 0.27364272 0.21512648 0.19718440 -0.06051691 -0.04282187 0.01295198  423  TYR   A HD2  
5686  H  HE1  . TYR   A  368 ? 0.29816097 0.23037913 0.22163963 -0.06816546 -0.04669884 0.02364806  423  TYR   A HE1  
5687  H  HE2  . TYR   A  368 ? 0.27471611 0.21940739 0.19903055 -0.06834992 -0.04420325 0.01708748  423  TYR   A HE2  
5689  N  N    . MET   A  369 ? 0.28671631 0.21763337 0.20980898 -0.04407966 -0.04194831 0.00252026  424  MET   A N    
5690  C  CA   . MET   A  369 ? 0.32730782 0.26709163 0.25429016 -0.04048235 -0.03870284 0.00012074  424  MET   A CA   
5691  C  C    . MET   A  369 ? 0.32641819 0.27620250 0.25725320 -0.04330086 -0.03695409 0.00345165  424  MET   A C    
5692  O  O    . MET   A  369 ? 0.29784107 0.24823722 0.22694281 -0.04779422 -0.03742469 0.00599917  424  MET   A O    
5693  C  CB   . MET   A  369 ? 0.38329318 0.32224935 0.30609813 -0.03984832 -0.03680919 -0.00415883 424  MET   A CB   
5694  C  CG   . MET   A  369 ? 0.46955389 0.39753100 0.38832724 -0.03643278 -0.03865252 -0.00803725 424  MET   A CG   
5695  S  SD   . MET   A  369 ? 0.48915678 0.41716775 0.41336200 -0.02818356 -0.03858037 -0.01095260 424  MET   A SD   
5696  C  CE   . MET   A  369 ? 0.60388076 0.54357761 0.53102487 -0.02556298 -0.03331596 -0.01491503 424  MET   A CE   
5697  H  H    . MET   A  369 ? 0.30829316 0.23542261 0.22766230 -0.04622966 -0.04251802 0.00167097  424  MET   A H    
5698  H  HA   . MET   A  369 ? 0.32924348 0.26864666 0.25889531 -0.03680925 -0.03911468 -0.00069530 424  MET   A HA   
5699  H  HB2  . MET   A  369 ? 0.38312650 0.32191879 0.30299830 -0.04346901 -0.03695635 -0.00326195 424  MET   A HB2  
5700  H  HB3  . MET   A  369 ? 0.38354987 0.32915133 0.30883229 -0.03806745 -0.03421897 -0.00549175 424  MET   A HB3  
5701  H  HG2  . MET   A  369 ? 0.45366096 0.37464437 0.36994550 -0.03854831 -0.04130381 -0.00643152 424  MET   A HG2  
5702  H  HG3  . MET   A  369 ? 0.45634168 0.38344479 0.37151897 -0.03665670 -0.03749239 -0.01077812 424  MET   A HG3  
5703  H  HE1  . MET   A  369 ? 0.57372230 0.51069653 0.49617800 -0.02621565 -0.03238058 -0.01740716 424  MET   A HE1  
5704  H  HE2  . MET   A  369 ? 0.56074047 0.50775439 0.49024487 -0.02800684 -0.03179238 -0.01267486 424  MET   A HE2  
5705  H  HE3  . MET   A  369 ? 0.57056695 0.51222259 0.50152451 -0.02108813 -0.03280430 -0.01692638 424  MET   A HE3  
5706  N  N    . LYS   A  370 ? 0.27158403 0.22935940 0.20800163 -0.04062752 -0.03506954 0.00331855  425  LYS   A N    
5707  C  CA   . LYS   A  370 ? 0.23627271 0.20173040 0.17615570 -0.04314755 -0.03402700 0.00657022  425  LYS   A CA   
5708  C  C    . LYS   A  370 ? 0.23515753 0.20437640 0.17248696 -0.04688759 -0.03209879 0.00720604  425  LYS   A C    
5709  O  O    . LYS   A  370 ? 0.29653496 0.26787713 0.23430385 -0.05005929 -0.03255754 0.01037992  425  LYS   A O    
5710  C  CB   . LYS   A  370 ? 0.28385276 0.25723940 0.23036617 -0.03990154 -0.03255449 0.00593950  425  LYS   A CB   
5711  C  CG   . LYS   A  370 ? 0.30235261 0.28109685 0.25069144 -0.03707493 -0.02929241 0.00195324  425  LYS   A CG   
5712  C  CD   . LYS   A  370 ? 0.24396597 0.23205385 0.19992848 -0.03488421 -0.02790016 0.00168218  425  LYS   A CD   
5713  C  CE   . LYS   A  370 ? 0.23538548 0.23084438 0.19426508 -0.03253672 -0.02396157 -0.00223043 425  LYS   A CE   
5714  N  NZ   . LYS   A  370 ? 0.25011578 0.25578061 0.21689922 -0.03197460 -0.02268938 -0.00180667 425  LYS   A NZ   
5715  H  H    . LYS   A  370 ? 0.27916729 0.23756231 0.21735725 -0.03720762 -0.03451024 0.00105293  425  LYS   A H    
5716  H  HA   . LYS   A  370 ? 0.24950655 0.21219298 0.18908794 -0.04463444 -0.03592708 0.00900293  425  LYS   A HA   
5717  H  HB2  . LYS   A  370 ? 0.26818931 0.24602848 0.21643585 -0.04193157 -0.03191890 0.00800350  425  LYS   A HB2  
5718  H  HB3  . LYS   A  370 ? 0.27602476 0.24676311 0.22407143 -0.03775771 -0.03451874 0.00621839  425  LYS   A HB3  
5719  H  HG2  . LYS   A  370 ? 0.29067969 0.26503021 0.23757687 -0.03450373 -0.02991172 -0.00043297 425  LYS   A HG2  
5720  H  HG3  . LYS   A  370 ? 0.28367090 0.26422930 0.22948857 -0.03932571 -0.02743217 0.00177296  425  LYS   A HG3  
5721  H  HD2  . LYS   A  370 ? 0.24639758 0.23790766 0.20336074 -0.03757725 -0.02752756 0.00405065  425  LYS   A HD2  
5722  H  HD3  . LYS   A  370 ? 0.25336975 0.23954633 0.21165591 -0.03242382 -0.03011964 0.00184973  425  LYS   A HD3  
5723  H  HE2  . LYS   A  370 ? 0.24873167 0.24147412 0.20761050 -0.02912006 -0.02435124 -0.00489120 425  LYS   A HE2  
5724  H  HE3  . LYS   A  370 ? 0.24258012 0.23882633 0.19800025 -0.03488810 -0.02184911 -0.00249305 425  LYS   A HE3  
5725  H  HZ1  . LYS   A  370 ? 0.24395379 0.24894924 0.21378756 -0.02976460 -0.02495744 -0.00149413 425  LYS   A HZ1  
5726  H  HZ2  . LYS   A  370 ? 0.23916847 0.24683851 0.20560373 -0.03515921 -0.02227961 0.00049387  425  LYS   A HZ2  
5727  H  HZ3  . LYS   A  370 ? 0.24486908 0.25557646 0.21383160 -0.03071959 -0.02009940 -0.00420787 425  LYS   A HZ3  
5728  N  N    . GLN   A  371 ? 0.32435820 0.29348347 0.25825390 -0.04640781 -0.03025715 0.00411592  426  GLN   A N    
5729  C  CA   . GLN   A  371 ? 0.31547239 0.28725874 0.24573779 -0.04971092 -0.02887091 0.00471095  426  GLN   A CA   
5730  C  C    . GLN   A  371 ? 0.30054584 0.26736569 0.22690786 -0.05331977 -0.03163222 0.00647698  426  GLN   A C    
5731  O  O    . GLN   A  371 ? 0.40652308 0.37588337 0.33093202 -0.05611245 -0.03148028 0.00796566  426  GLN   A O    
5732  C  CB   . GLN   A  371 ? 0.43426937 0.40677619 0.36057886 -0.04840829 -0.02619215 0.00084010  426  GLN   A CB   
5733  C  CG   . GLN   A  371 ? 0.59516346 0.55938226 0.51649135 -0.04695642 -0.02764449 -0.00266787 426  GLN   A CG   
5734  C  CD   . GLN   A  371 ? 0.71430004 0.67650199 0.63871610 -0.04188435 -0.02739894 -0.00574515 426  GLN   A CD   
5735  O  OE1  . GLN   A  371 ? 0.65208501 0.61887276 0.58314210 -0.03946313 -0.02700813 -0.00479483 426  GLN   A OE1  
5736  N  NE2  . GLN   A  371 ? 0.76544285 0.72042274 0.68492687 -0.04002868 -0.02798256 -0.00966921 426  GLN   A NE2  
5737  H  H    . GLN   A  371 ? 0.30541611 0.27267635 0.23898602 -0.04380046 -0.02991354 0.00153388  426  GLN   A H    
5738  H  HA   . GLN   A  371 ? 0.32465315 0.30148327 0.25745812 -0.05061429 -0.02779501 0.00652141  426  GLN   A HA   
5739  H  HB2  . GLN   A  371 ? 0.43017069 0.40452591 0.35380298 -0.05071667 -0.02544093 0.00172296  426  GLN   A HB2  
5740  H  HB3  . GLN   A  371 ? 0.43174675 0.40857059 0.36122262 -0.04629801 -0.02410334 -0.00032904 426  GLN   A HB3  
5741  H  HG2  . GLN   A  371 ? 0.57289475 0.53251410 0.49270076 -0.04880842 -0.03023440 -0.00129295 426  GLN   A HG2  
5742  H  HG3  . GLN   A  371 ? 0.58078355 0.54510868 0.49792662 -0.04757079 -0.02633312 -0.00442444 426  GLN   A HG3  
5743  H  HE21 . GLN   A  371 ? 0.75313818 0.70489132 0.66786516 -0.04208465 -0.02859310 -0.01019903 426  GLN   A HE21 
5744  H  HE22 . GLN   A  371 ? 0.75555110 0.70883560 0.67648399 -0.03665466 -0.02789700 -0.01184100 426  GLN   A HE22 
5745  N  N    . HIS   A  372 ? 0.33391440 0.29364991 0.25924072 -0.05337783 -0.03433412 0.00638757  427  HIS   A N    
5746  C  CA   . HIS   A  372 ? 0.25947976 0.21564728 0.18220392 -0.05736914 -0.03684743 0.00810338  427  HIS   A CA   
5747  C  C    . HIS   A  372 ? 0.26147711 0.21963581 0.18797193 -0.05941181 -0.03795396 0.01202801  427  HIS   A C    
5748  O  O    . HIS   A  372 ? 0.32594630 0.28275570 0.25163147 -0.06287563 -0.03970122 0.01365983  427  HIS   A O    
5749  C  CB   . HIS   A  372 ? 0.37838423 0.32502082 0.29684874 -0.05736924 -0.03907883 0.00573210  427  HIS   A CB   
5750  C  CG   . HIS   A  372 ? 0.34664333 0.29077217 0.26028457 -0.05564472 -0.03803968 0.00141373  427  HIS   A CG   
5751  N  ND1  . HIS   A  372 ? 0.44180131 0.37738693 0.35220927 -0.05335983 -0.03913704 -0.00192919 427  HIS   A ND1  
5752  C  CD2  . HIS   A  372 ? 0.40397543 0.35274199 0.31503806 -0.05579836 -0.03590168 -0.00003187 427  HIS   A CD2  
5753  C  CE1  . HIS   A  372 ? 0.47584862 0.41174358 0.38207683 -0.05199498 -0.03734393 -0.00569074 427  HIS   A CE1  
5754  N  NE2  . HIS   A  372 ? 0.44268268 0.38648826 0.34889045 -0.05365825 -0.03533101 -0.00448721 427  HIS   A NE2  
5755  H  H    . HIS   A  372 ? 0.31017485 0.26725200 0.23642510 -0.05102002 -0.03468634 0.00524819  427  HIS   A H    
5756  H  HA   . HIS   A  372 ? 0.29155952 0.25010684 0.21240242 -0.05889745 -0.03639615 0.00802722  427  HIS   A HA   
5757  H  HB2  . HIS   A  372 ? 0.34068933 0.28426072 0.26053908 -0.05552427 -0.03966565 0.00579072  427  HIS   A HB2  
5758  H  HB3  . HIS   A  372 ? 0.34000862 0.28472382 0.25727868 -0.06046190 -0.04079096 0.00697292  427  HIS   A HB3  
5760  H  HD2  . HIS   A  372 ? 0.38922727 0.34324461 0.30130035 -0.05707274 -0.03498426 0.00170824  427  HIS   A HD2  
5761  H  HE1  . HIS   A  372 ? 0.46888840 0.39957076 0.37201875 -0.05018393 -0.03754308 -0.00881218 427  HIS   A HE1  
5763  N  N    . LEU   A  373 ? 0.24327193 0.20486183 0.17395803 -0.05735426 -0.03696061 0.01335234  428  LEU   A N    
5764  C  CA   . LEU   A  373 ? 0.26651090 0.23016757 0.19999889 -0.05916936 -0.03766511 0.01679361  428  LEU   A CA   
5765  C  C    . LEU   A  373 ? 0.25373778 0.22314680 0.18800817 -0.06173611 -0.03692378 0.01844013  428  LEU   A C    
5766  O  O    . LEU   A  373 ? 0.24236754 0.21524757 0.17592029 -0.06131743 -0.03549533 0.01751747  428  LEU   A O    
5767  C  CB   . LEU   A  373 ? 0.25742674 0.22458322 0.19491704 -0.05651567 -0.03679256 0.01762962  428  LEU   A CB   
5768  C  CG   . LEU   A  373 ? 0.25603861 0.21798354 0.19375284 -0.05362237 -0.03832531 0.01697601  428  LEU   A CG   
5769  C  CD1  . LEU   A  373 ? 0.28971493 0.25712812 0.23207448 -0.05063142 -0.03748904 0.01705699  428  LEU   A CD1  
5770  C  CD2  . LEU   A  373 ? 0.22875585 0.18475878 0.16443825 -0.05593642 -0.04065770 0.01959392  428  LEU   A CD2  
5771  H  H    . LEU   A  373 ? 0.25334519 0.21621145 0.18515989 -0.05482794 -0.03583372 0.01197142  428  LEU   A H    
5772  H  HA   . LEU   A  373 ? 0.26128575 0.22056097 0.19350639 -0.06051149 -0.03923456 0.01750591  428  LEU   A HA   
5773  H  HB2  . LEU   A  373 ? 0.25543761 0.22648758 0.19410679 -0.05529866 -0.03518506 0.01656172  428  LEU   A HB2  
5774  H  HB3  . LEU   A  373 ? 0.25318748 0.22259383 0.19203359 -0.05795370 -0.03686456 0.01972537  428  LEU   A HB3  
5775  H  HG   . LEU   A  373 ? 0.26199812 0.22072703 0.19802591 -0.05215548 -0.03846122 0.01472074  428  LEU   A HG   
5776  H  HD11 . LEU   A  373 ? 0.28167018 0.24609885 0.22438687 -0.04814673 -0.03863019 0.01622085  428  LEU   A HD11 
5777  H  HD12 . LEU   A  373 ? 0.27423668 0.24354681 0.21764575 -0.05195474 -0.03773087 0.01917156  428  LEU   A HD12 
5778  H  HD13 . LEU   A  373 ? 0.27538800 0.24729770 0.21917224 -0.04998408 -0.03566958 0.01577219  428  LEU   A HD13 
5779  H  HD21 . LEU   A  373 ? 0.24002567 0.19294557 0.17325267 -0.05810407 -0.04123995 0.01943510  428  LEU   A HD21 
5780  H  HD22 . LEU   A  373 ? 0.23256084 0.19188364 0.16965801 -0.05730899 -0.04029944 0.02158198  428  LEU   A HD22 
5781  H  HD23 . LEU   A  373 ? 0.24106956 0.19301873 0.17633301 -0.05394335 -0.04192421 0.01939264  428  LEU   A HD23 
5782  N  N    . PRO   A  374 ? 0.22460450 0.19533926 0.16041772 -0.06419902 -0.03774500 0.02100434  429  PRO   A N    
5783  C  CA   . PRO   A  374 ? 0.20902368 0.18551630 0.14647804 -0.06568117 -0.03716768 0.02250463  429  PRO   A CA   
5784  C  C    . PRO   A  374 ? 0.27696514 0.25788963 0.21588087 -0.06376581 -0.03522811 0.02255529  429  PRO   A C    
5785  O  O    . PRO   A  374 ? 0.28961053 0.27141470 0.23057891 -0.06206245 -0.03437075 0.02274732  429  PRO   A O    
5786  C  CB   . PRO   A  374 ? 0.25146800 0.22894065 0.19114162 -0.06755638 -0.03768091 0.02484526  429  PRO   A CB   
5787  C  CG   . PRO   A  374 ? 0.26714095 0.23788658 0.20468719 -0.06860413 -0.03913057 0.02468165  429  PRO   A CG   
5788  C  CD   . PRO   A  374 ? 0.24172837 0.20838419 0.17755167 -0.06546295 -0.03910588 0.02255043  429  PRO   A CD   
5789  H  HA   . PRO   A  374 ? 0.23194522 0.20827146 0.16780724 -0.06691221 -0.03787611 0.02191728  429  PRO   A HA   
5790  H  HB2  . PRO   A  374 ? 0.23893768 0.21833181 0.18023925 -0.06651873 -0.03683588 0.02569690  429  PRO   A HB2  
5791  H  HB3  . PRO   A  374 ? 0.24060911 0.22060665 0.18106106 -0.06916282 -0.03801558 0.02547379  429  PRO   A HB3  
5792  H  HG2  . PRO   A  374 ? 0.25868219 0.22917473 0.19699231 -0.06916262 -0.03910074 0.02617437  429  PRO   A HG2  
5793  H  HG3  . PRO   A  374 ? 0.26146698 0.23087466 0.19792274 -0.07068839 -0.04010604 0.02438822  429  PRO   A HG3  
5794  H  HD2  . PRO   A  374 ? 0.24324685 0.20982489 0.18018378 -0.06384858 -0.03883751 0.02308691  429  PRO   A HD2  
5795  H  HD3  . PRO   A  374 ? 0.24972780 0.21141145 0.18325309 -0.06596985 -0.04024841 0.02162668  429  PRO   A HD3  
5796  N  N    . LYS   A  375 ? 0.26298118 0.24632913 0.20045649 -0.06429774 -0.03481055 0.02243006  430  LYS   A N    
5797  C  CA   . LYS   A  375 ? 0.26199418 0.24872454 0.19993354 -0.06335221 -0.03299994 0.02280527  430  LYS   A CA   
5798  C  C    . LYS   A  375 ? 0.22441441 0.21396613 0.16585976 -0.06323075 -0.03253238 0.02475476  430  LYS   A C    
5799  O  O    . LYS   A  375 ? 0.24026404 0.23173399 0.18290399 -0.06237349 -0.03103320 0.02477505  430  LYS   A O    
5800  C  CB   . LYS   A  375 ? 0.37117928 0.35870007 0.30583882 -0.06441855 -0.03336545 0.02305830  430  LYS   A CB   
5801  C  CG   . LYS   A  375 ? 0.36266726 0.34742275 0.29259562 -0.06462642 -0.03365679 0.02085323  430  LYS   A CG   
5802  C  CD   . LYS   A  375 ? 0.33002317 0.31388018 0.25859812 -0.06283217 -0.03135702 0.01834326  430  LYS   A CD   
5803  C  CE   . LYS   A  375 ? 0.33692768 0.32347172 0.26371953 -0.06269011 -0.02889079 0.01832777  430  LYS   A CE   
5804  N  NZ   . LYS   A  375 ? 0.34775108 0.33458337 0.27393734 -0.06092388 -0.02644390 0.01541445  430  LYS   A NZ   
5805  H  H    . LYS   A  375 ? 0.26915830 0.25175053 0.20505987 -0.06549184 -0.03586156 0.02221241  430  LYS   A H    
5806  H  HA   . LYS   A  375 ? 0.27263963 0.25909534 0.21031579 -0.06212923 -0.03187899 0.02151246  430  LYS   A HA   
5807  H  HB2  . LYS   A  375 ? 0.33778980 0.32600063 0.27328497 -0.06533736 -0.03471217 0.02415180  430  LYS   A HB2  
5808  H  HB3  . LYS   A  375 ? 0.33711743 0.32626933 0.27171007 -0.06410924 -0.03218005 0.02364683  430  LYS   A HB3  
5809  H  HG2  . LYS   A  375 ? 0.35813174 0.34092647 0.28787112 -0.06536100 -0.03518889 0.02040784  430  LYS   A HG2  
5810  H  HG3  . LYS   A  375 ? 0.35763857 0.34297997 0.28511205 -0.06530127 -0.03400170 0.02132053  430  LYS   A HG3  
5811  H  HD2  . LYS   A  375 ? 0.33589995 0.31994635 0.26752228 -0.06175464 -0.03098346 0.01825649  430  LYS   A HD2  
5812  H  HD3  . LYS   A  375 ? 0.34257275 0.32368618 0.26840070 -0.06284455 -0.03196849 0.01664006  430  LYS   A HD3  
5813  H  HE2  . LYS   A  375 ? 0.33970517 0.32565159 0.26288611 -0.06376339 -0.02943221 0.01869979  430  LYS   A HE2  
5814  H  HE3  . LYS   A  375 ? 0.33333993 0.32213420 0.26281208 -0.06275258 -0.02829563 0.01984052  430  LYS   A HE3  
5815  H  HZ1  . LYS   A  375 ? 0.34950018 0.33384642 0.27262542 -0.06079448 -0.02690363 0.01380299  430  LYS   A HZ1  
5816  H  HZ2  . LYS   A  375 ? 0.34330785 0.33058333 0.27293411 -0.05967144 -0.02633831 0.01504480  430  LYS   A HZ2  
5817  H  HZ3  . LYS   A  375 ? 0.34560817 0.33468899 0.27100009 -0.06118431 -0.02458666 0.01549918  430  LYS   A HZ3  
5818  N  N    . ARG   A  376 ? 0.20889698 0.19890255 0.15193127 -0.06429888 -0.03369829 0.02615435  431  ARG   A N    
5819  C  CA   . ARG   A  376 ? 0.23456809 0.22678322 0.18021892 -0.06413478 -0.03324651 0.02761495  431  ARG   A CA   
5820  C  C    . ARG   A  376 ? 0.30856091 0.30026451 0.25555170 -0.06302401 -0.03263845 0.02747132  431  ARG   A C    
5821  O  O    . ARG   A  376 ? 0.28965980 0.28307411 0.23812616 -0.06271583 -0.03209693 0.02822397  431  ARG   A O    
5822  C  CB   . ARG   A  376 ? 0.21040112 0.20363563 0.15749368 -0.06552198 -0.03416949 0.02866685  431  ARG   A CB   
5823  C  CG   . ARG   A  376 ? 0.21321389 0.20368135 0.15979207 -0.06672394 -0.03491062 0.02857507  431  ARG   A CG   
5824  C  CD   . ARG   A  376 ? 0.24186660 0.23455641 0.19021299 -0.06873778 -0.03516582 0.02972194  431  ARG   A CD   
5825  N  NE   . ARG   A  376 ? 0.24293850 0.23220915 0.19003426 -0.07084437 -0.03593472 0.02994031  431  ARG   A NE   
5826  C  CZ   . ARG   A  376 ? 0.28292155 0.26860794 0.22854000 -0.07094355 -0.03583322 0.03065445  431  ARG   A CZ   
5827  N  NH1  . ARG   A  376 ? 0.31667635 0.30310637 0.26255149 -0.06938328 -0.03497503 0.03128677  431  ARG   A NH1  
5828  N  NH2  . ARG   A  376 ? 0.23064107 0.21132794 0.17401625 -0.07281821 -0.03694003 0.03082089  431  ARG   A NH2  
5829  H  H    . ARG   A  376 ? 0.22063825 0.20968866 0.16301167 -0.06527214 -0.03472954 0.02603927  431  ARG   A H    
5830  H  HA   . ARG   A  376 ? 0.23422915 0.22782114 0.17980765 -0.06390422 -0.03278331 0.02800734  431  ARG   A HA   
5831  H  HB2  . ARG   A  376 ? 0.21340933 0.20814380 0.16186625 -0.06520695 -0.03363441 0.02937745  431  ARG   A HB2  
5832  H  HB3  . ARG   A  376 ? 0.21629429 0.21064550 0.16323234 -0.06604676 -0.03481985 0.02872294  431  ARG   A HB3  
5833  H  HG2  . ARG   A  376 ? 0.22240618 0.21089579 0.16744676 -0.06706432 -0.03557589 0.02768041  431  ARG   A HG2  
5834  H  HG3  . ARG   A  376 ? 0.21994242 0.20894302 0.16639030 -0.06595798 -0.03460240 0.02861689  431  ARG   A HG3  
5835  H  HD2  . ARG   A  376 ? 0.23304662 0.22730932 0.18245856 -0.06827412 -0.03434263 0.03038735  431  ARG   A HD2  
5836  H  HD3  . ARG   A  376 ? 0.23435774 0.22936876 0.18360341 -0.06917309 -0.03562593 0.02964357  431  ARG   A HD3  
5837  H  HE   . ARG   A  376 ? 0.25323397 0.24244986 0.20027106 -0.07225726 -0.03670147 0.02966629  431  ARG   A HE   
5838  H  HH11 . ARG   A  376 ? 0.30116376 0.29070905 0.24836971 -0.06923942 -0.03418012 0.03164154  431  ARG   A HH11 
5839  H  HH12 . ARG   A  376 ? 0.30538526 0.28912735 0.25008160 -0.06843199 -0.03534713 0.03125747  431  ARG   A HH12 
5840  H  HH21 . ARG   A  376 ? 0.25000048 0.22742209 0.19183801 -0.07254963 -0.03719455 0.03133332  431  ARG   A HH21 
5841  H  HH22 . ARG   A  376 ? 0.24862050 0.22897041 0.19187890 -0.07436727 -0.03758351 0.03044118  431  ARG   A HH22 
5842  N  N    . LEU   A  377 ? 0.23052964 0.21947633 0.17683578 -0.06229733 -0.03311774 0.02640971  432  LEU   A N    
5843  C  CA   . LEU   A  377 ? 0.22278306 0.21125349 0.17051207 -0.06074725 -0.03322182 0.02622123  432  LEU   A CA   
5844  C  C    . LEU   A  377 ? 0.24192402 0.23339066 0.19140452 -0.05928360 -0.03189209 0.02499073  432  LEU   A C    
5845  O  O    . LEU   A  377 ? 0.29201445 0.28487355 0.24375959 -0.05812365 -0.03208360 0.02490023  432  LEU   A O    
5846  C  CB   . LEU   A  377 ? 0.22042948 0.20424521 0.16674387 -0.06007722 -0.03457200 0.02556516  432  LEU   A CB   
5847  C  CG   . LEU   A  377 ? 0.29093629 0.27141967 0.23550111 -0.06220867 -0.03582413 0.02710949  432  LEU   A CG   
5848  C  CD1  . LEU   A  377 ? 0.28678757 0.26100525 0.22918747 -0.06155101 -0.03741708 0.02658478  432  LEU   A CD1  
5849  C  CD2  . LEU   A  377 ? 0.29329720 0.27536431 0.23856407 -0.06295435 -0.03571443 0.02898498  432  LEU   A CD2  
5850  H  H    . LEU   A  377 ? 0.24669936 0.23381114 0.19156948 -0.06265828 -0.03363192 0.02574268  432  LEU   A H    
5851  H  HA   . LEU   A  377 ? 0.22616385 0.21535441 0.17456777 -0.06117857 -0.03338988 0.02733962  432  LEU   A HA   
5852  H  HB2  . LEU   A  377 ? 0.23774087 0.22053686 0.18301262 -0.05972150 -0.03439506 0.02424570  432  LEU   A HB2  
5853  H  HB3  . LEU   A  377 ? 0.23601265 0.21961379 0.18337834 -0.05854807 -0.03489168 0.02529401  432  LEU   A HB3  
5854  H  HG   . LEU   A  377 ? 0.27497888 0.25616771 0.21906553 -0.06368230 -0.03569628 0.02714622  432  LEU   A HG   
5855  H  HD11 . LEU   A  377 ? 0.29190099 0.26380438 0.23282698 -0.06355061 -0.03804971 0.02753622  432  LEU   A HD11 
5856  H  HD12 . LEU   A  377 ? 0.29050708 0.26387185 0.23333997 -0.06009464 -0.03795329 0.02688219  432  LEU   A HD12 
5857  H  HD13 . LEU   A  377 ? 0.29127017 0.26439196 0.23313160 -0.06059337 -0.03736671 0.02495165  432  LEU   A HD13 
5858  H  HD21 . LEU   A  377 ? 0.28788027 0.27311969 0.23415406 -0.06361681 -0.03485458 0.02930808  432  LEU   A HD21 
5859  H  HD22 . LEU   A  377 ? 0.29138803 0.27368575 0.23734531 -0.06148626 -0.03591113 0.02887905  432  LEU   A HD22 
5860  H  HD23 . LEU   A  377 ? 0.29422075 0.27382946 0.23805207 -0.06427976 -0.03634745 0.02992465  432  LEU   A HD23 
5861  N  N    . HIS   A  378 ? 0.20551074 0.19816539 0.15375814 -0.05960375 -0.03060784 0.02406289  433  HIS   A N    
5862  C  CA   . HIS   A  378 ? 0.21255144 0.20847771 0.16210747 -0.05887869 -0.02873104 0.02281523  433  HIS   A CA   
5863  C  C    . HIS   A  378 ? 0.26910853 0.26612389 0.22183537 -0.05653948 -0.02891656 0.02132642  433  HIS   A C    
5864  O  O    . HIS   A  378 ? 0.24188262 0.24289969 0.19797336 -0.05626789 -0.02822539 0.02122850  433  HIS   A O    
5865  C  CB   . HIS   A  378 ? 0.26555392 0.26435220 0.21625619 -0.06026793 -0.02779951 0.02419853  433  HIS   A CB   
5866  C  CG   . HIS   A  378 ? 0.24089806 0.23835464 0.18882561 -0.06183799 -0.02805697 0.02573545  433  HIS   A CG   
5867  N  ND1  . HIS   A  378 ? 0.28756088 0.28466061 0.23223132 -0.06269184 -0.02715852 0.02565588  433  HIS   A ND1  
5868  C  CD2  . HIS   A  378 ? 0.26946503 0.26600564 0.21743840 -0.06235555 -0.02923939 0.02723363  433  HIS   A CD2  
5869  C  CE1  . HIS   A  378 ? 0.26348823 0.25924370 0.20656157 -0.06345955 -0.02832285 0.02725204  433  HIS   A CE1  
5870  N  NE2  . HIS   A  378 ? 0.29736701 0.29316577 0.24282834 -0.06315010 -0.02941230 0.02805688  433  HIS   A NE2  
5871  H  H    . HIS   A  378 ? 0.21679074 0.20831634 0.16316384 -0.06048165 -0.03089556 0.02423137  433  HIS   A H    
5872  H  HA   . HIS   A  378 ? 0.23373157 0.22925222 0.18120977 -0.05906770 -0.02797411 0.02195184  433  HIS   A HA   
5873  H  HB2  . HIS   A  378 ? 0.24399623 0.24320428 0.19651841 -0.06004325 -0.02853486 0.02475694  433  HIS   A HB2  
5874  H  HB3  . HIS   A  378 ? 0.24622142 0.24730781 0.19770133 -0.06031132 -0.02637542 0.02343862  433  HIS   A HB3  
5876  H  HD2  . HIS   A  378 ? 0.26623112 0.26269549 0.21551964 -0.06211411 -0.02985870 0.02759724  433  HIS   A HD2  
5877  H  HE1  . HIS   A  378 ? 0.27891430 0.27388307 0.21941097 -0.06403355 -0.02838518 0.02771864  433  HIS   A HE1  
5879  N  N    . TYR   A  379 ? 0.24045244 0.23380719 0.19212352 -0.05484810 -0.03003181 0.02003463  434  TYR   A N    
5880  C  CA   . TYR   A  379 ? 0.20087156 0.19432436 0.15547916 -0.05187201 -0.03091894 0.01866567  434  TYR   A CA   
5881  C  C    . TYR   A  379 ? 0.21118833 0.20365578 0.16528770 -0.04944931 -0.03002829 0.01561095  434  TYR   A C    
5882  O  O    . TYR   A  379 ? 0.26657832 0.25330603 0.21873008 -0.04787584 -0.03177665 0.01478447  434  TYR   A O    
5883  C  CB   . TYR   A  379 ? 0.21855873 0.20692378 0.17206523 -0.05159958 -0.03380501 0.02034506  434  TYR   A CB   
5884  C  CG   . TYR   A  379 ? 0.21100199 0.19934976 0.16747020 -0.04848767 -0.03564456 0.01984490  434  TYR   A CG   
5885  C  CD1  . TYR   A  379 ? 0.22053030 0.21415928 0.18093136 -0.04810906 -0.03582714 0.02030262  434  TYR   A CD1  
5886  C  CD2  . TYR   A  379 ? 0.18220150 0.16494316 0.13743262 -0.04581799 -0.03754734 0.01878898  434  TYR   A CD2  
5887  C  CE1  . TYR   A  379 ? 0.28270903 0.27689201 0.24608873 -0.04508695 -0.03809153 0.01983519  434  TYR   A CE1  
5888  C  CE2  . TYR   A  379 ? 0.25931972 0.24176979 0.21723861 -0.04242120 -0.03980245 0.01843834  434  TYR   A CE2  
5889  C  CZ   . TYR   A  379 ? 0.24514782 0.23395056 0.20745735 -0.04196721 -0.04012849 0.01893557  434  TYR   A CZ   
5890  O  OH   . TYR   A  379 ? 0.22960609 0.21905191 0.19499189 -0.03859560 -0.04289272 0.01867370  434  TYR   A OH   
5891  H  H    . TYR   A  379 ? 0.23821387 0.22873065 0.18725675 -0.05550680 -0.03045413 0.01997674  434  TYR   A H    
5892  H  HA   . TYR   A  379 ? 0.21028158 0.20790441 0.16797772 -0.05157634 -0.03029667 0.01863334  434  TYR   A HA   
5893  H  HB2  . TYR   A  379 ? 0.20988992 0.19885038 0.16299227 -0.05337911 -0.03395646 0.02206754  434  TYR   A HB2  
5894  H  HB3  . TYR   A  379 ? 0.21552223 0.19965596 0.16632105 -0.05188915 -0.03445959 0.02015609  434  TYR   A HB3  
5895  H  HD1  . TYR   A  379 ? 0.22566411 0.22234938 0.18663506 -0.04994333 -0.03465327 0.02094287  434  TYR   A HD1  
5896  H  HD2  . TYR   A  379 ? 0.20814919 0.18684438 0.16051792 -0.04626926 -0.03758160 0.01831556  434  TYR   A HD2  
5897  H  HE1  . TYR   A  379 ? 0.25301898 0.25108421 0.21913028 -0.04508470 -0.03844572 0.02007528  434  TYR   A HE1  
5898  H  HE2  . TYR   A  379 ? 0.24048483 0.21832229 0.19724609 -0.04036479 -0.04131592 0.01777457  434  TYR   A HE2  
5900  N  N    . ALA   A  380 ? 0.20793106 0.20569003 0.16348302 -0.04918578 -0.02717226 0.01379423  435  ALA   A N    
5901  C  CA   . ALA   A  380 ? 0.24152419 0.23901606 0.19655617 -0.04655968 -0.02580410 0.01035842  435  ALA   A CA   
5902  C  C    . ALA   A  380 ? 0.18238345 0.18803975 0.14138804 -0.04570309 -0.02239461 0.00824328  435  ALA   A C    
5903  O  O    . ALA   A  380 ? 0.21233803 0.21988483 0.17392448 -0.04221971 -0.02148079 0.00507742  435  ALA   A O    
5904  C  CB   . ALA   A  380 ? 0.26458719 0.25707519 0.21305904 -0.04812049 -0.02547808 0.00967969  435  ALA   A CB   
5905  H  H    . ALA   A  380 ? 0.21110983 0.21244161 0.16771826 -0.05071439 -0.02597762 0.01463447  435  ALA   A H    
5906  H  HA   . ALA   A  380 ? 0.22810298 0.22299534 0.18428931 -0.04414076 -0.02747696 0.00959046  435  ALA   A HA   
5907  H  HB1  . ALA   A  380 ? 0.26267034 0.25448516 0.21032581 -0.04624206 -0.02457776 0.00711811  435  ALA   A HB1  
5908  H  HB2  . ALA   A  380 ? 0.25942057 0.24721035 0.20593514 -0.04883689 -0.02759980 0.01084930  435  ALA   A HB2  
5909  H  HB3  . ALA   A  380 ? 0.25803062 0.25264019 0.20495233 -0.05032298 -0.02414784 0.01057925  435  ALA   A HB3  
5910  N  N    . ASN   A  381 ? 0.20649792 0.21671996 0.16571018 -0.04894273 -0.02037055 0.00983942  436  ASN   A N    
5911  C  CA   . ASN   A  381 ? 0.21480931 0.23243523 0.17646302 -0.04933852 -0.01650131 0.00801419  436  ASN   A CA   
5912  C  C    . ASN   A  381 ? 0.27743593 0.30270410 0.24753015 -0.04804540 -0.01632810 0.00741412  436  ASN   A C    
5913  O  O    . ASN   A  381 ? 0.21488386 0.24529040 0.18736051 -0.05103399 -0.01484329 0.00875389  436  ASN   A O    
5914  C  CB   . ASN   A  381 ? 0.22419792 0.24248613 0.18153121 -0.05377196 -0.01442419 0.01014229  436  ASN   A CB   
5915  C  CG   . ASN   A  381 ? 0.23898631 0.26383820 0.19699077 -0.05502008 -0.01000199 0.00850655  436  ASN   A CG   
5916  O  OD1  . ASN   A  381 ? 0.30154726 0.32950556 0.26086187 -0.05252601 -0.00777742 0.00508931  436  ASN   A OD1  
5917  N  ND2  . ASN   A  381 ? 0.33026677 0.35709429 0.28706619 -0.05888402 -0.00846310 0.01074988  436  ASN   A ND2  
5918  H  H    . ASN   A  381 ? 0.19952177 0.20812993 0.15721442 -0.05101797 -0.02131105 0.01206949  436  ASN   A H    
5919  H  HA   . ASN   A  381 ? 0.22919279 0.24651000 0.18957765 -0.04759244 -0.01524725 0.00558178  436  ASN   A HA   
5920  H  HB2  . ASN   A  381 ? 0.22739825 0.24099706 0.17965636 -0.05444530 -0.01511130 0.01063726  436  ASN   A HB2  
5921  H  HB3  . ASN   A  381 ? 0.22212827 0.24070458 0.18084604 -0.05532055 -0.01551917 0.01227343  436  ASN   A HB3  
5922  H  HD21 . ASN   A  381 ? 0.29373294 0.31727785 0.24843442 -0.06044539 -0.01004639 0.01301278  436  ASN   A HD21 
5923  H  HD22 . ASN   A  381 ? 0.29789573 0.32925123 0.25589681 -0.06003332 -0.00577921 0.01002310  436  ASN   A HD22 
5924  N  N    . ASN   A  382 ? 0.24921192 0.27510640 0.22370073 -0.04354789 -0.01794932 0.00518079  437  ASN   A N    
5925  C  CA   . ASN   A  382 ? 0.21213141 0.24616835 0.19543386 -0.04144423 -0.01823235 0.00396137  437  ASN   A CA   
5926  C  C    . ASN   A  382 ? 0.22107826 0.25502014 0.20756927 -0.03557020 -0.01911845 0.00042979  437  ASN   A C    
5927  O  O    . ASN   A  382 ? 0.23882990 0.26383826 0.22122699 -0.03325869 -0.02202812 0.00055832  437  ASN   A O    
5928  C  CB   . ASN   A  382 ? 0.22412482 0.25680017 0.20945100 -0.04229170 -0.02213474 0.00691318  437  ASN   A CB   
5929  C  CG   . ASN   A  382 ? 0.26229429 0.30465207 0.25663930 -0.04152774 -0.02246362 0.00600820  437  ASN   A CG   
5930  O  OD1  . ASN   A  382 ? 0.22324377 0.26981983 0.22351354 -0.03717995 -0.02337845 0.00348832  437  ASN   A OD1  
5931  N  ND2  . ASN   A  382 ? 0.20963562 0.25564092 0.20524135 -0.04569440 -0.02183943 0.00784934  437  ASN   A ND2  
5932  H  H    . ASN   A  382 ? 0.24872002 0.26963568 0.22062172 -0.04166980 -0.01914413 0.00436392  437  ASN   A H    
5933  H  HA   . ASN   A  382 ? 0.22188580 0.26226452 0.20759673 -0.04321079 -0.01541018 0.00336599  437  ASN   A HA   
5934  H  HB2  . ASN   A  382 ? 0.22631758 0.25685993 0.20830925 -0.04556397 -0.02193932 0.00908589  437  ASN   A HB2  
5935  H  HB3  . ASN   A  382 ? 0.22986247 0.25717571 0.21360269 -0.04016858 -0.02481469 0.00724900  437  ASN   A HB3  
5936  H  HD21 . ASN   A  382 ? 0.22201082 0.26410365 0.21327448 -0.04831253 -0.02178838 0.00976763  437  ASN   A HD21 
5937  H  HD22 . ASN   A  382 ? 0.22213131 0.27449837 0.22303700 -0.04591817 -0.02155428 0.00711337  437  ASN   A HD22 
5938  N  N    . ARG   A  383 ? 0.20702747 0.25084314 0.20092165 -0.03319479 -0.01658558 -0.00280784 438  ARG   A N    
5939  C  CA   . ARG   A  383 ? 0.18825445 0.23296639 0.18640149 -0.02676270 -0.01744688 -0.00662295 438  ARG   A CA   
5940  C  C    . ARG   A  383 ? 0.20398732 0.24425182 0.20485526 -0.02298000 -0.02327831 -0.00541061 438  ARG   A C    
5941  O  O    . ARG   A  383 ? 0.20157290 0.23842381 0.20370314 -0.01732747 -0.02525909 -0.00787918 438  ARG   A O    
5942  C  CB   . ARG   A  383 ? 0.21222599 0.27061260 0.21926531 -0.02516899 -0.01332146 -0.01033687 438  ARG   A CB   
5943  C  CG   . ARG   A  383 ? 0.25760949 0.32592517 0.27367282 -0.02666079 -0.01441917 -0.00907347 438  ARG   A CG   
5944  C  CD   . ARG   A  383 ? 0.27262369 0.35586083 0.29766214 -0.02689469 -0.00963499 -0.01230268 438  ARG   A CD   
5945  N  NE   . ARG   A  383 ? 0.29688674 0.38933545 0.33139765 -0.02787562 -0.01184486 -0.01135766 438  ARG   A NE   
5946  C  CZ   . ARG   A  383 ? 0.34671193 0.44771907 0.38484412 -0.03364495 -0.00924240 -0.01015294 438  ARG   A CZ   
5947  N  NH1  . ARG   A  383 ? 0.33940896 0.44294405 0.37374377 -0.03854011 -0.00355900 -0.01013283 438  ARG   A NH1  
5948  N  NH2  . ARG   A  383 ? 0.23091438 0.33803105 0.27650663 -0.03457672 -0.01254709 -0.00906530 438  ARG   A NH2  
5949  H  H    . ARG   A  383 ? 0.20304579 0.25324503 0.19949098 -0.03564430 -0.01421791 -0.00269655 438  ARG   A H    
5950  H  HA   . ARG   A  383 ? 0.20370865 0.24265893 0.19668458 -0.02578364 -0.01682089 -0.00781821 438  ARG   A HA   
5951  H  HB2  . ARG   A  383 ? 0.22026572 0.27897805 0.22982770 -0.02042830 -0.01365382 -0.01327022 438  ARG   A HB2  
5952  H  HB3  . ARG   A  383 ? 0.21667895 0.27716455 0.22090712 -0.02791614 -0.00950475 -0.01085472 438  ARG   A HB3  
5953  H  HG2  . ARG   A  383 ? 0.24365020 0.30989426 0.25663275 -0.03098042 -0.01482528 -0.00606506 438  ARG   A HG2  
5954  H  HG3  . ARG   A  383 ? 0.24735062 0.31439611 0.26655954 -0.02334690 -0.01818760 -0.00901363 438  ARG   A HG3  
5955  H  HD2  . ARG   A  383 ? 0.27988645 0.36546019 0.30776405 -0.02246222 -0.00868017 -0.01564350 438  ARG   A HD2  
5956  H  HD3  . ARG   A  383 ? 0.27774256 0.36216965 0.29925483 -0.03090706 -0.00597701 -0.01180255 438  ARG   A HD3  
5957  H  HE   . ARG   A  383 ? 0.30006576 0.39209878 0.33793262 -0.02451416 -0.01532808 -0.01160670 438  ARG   A HE   
5958  H  HH11 . ARG   A  383 ? 0.34369135 0.45053083 0.37851685 -0.03720516 -0.00028733 -0.01259783 438  ARG   A HH11 
5959  H  HH12 . ARG   A  383 ? 0.33982247 0.44143838 0.37082592 -0.04306840 -0.00310833 -0.00765066 438  ARG   A HH12 
5960  H  HH21 . ARG   A  383 ? 0.25836876 0.37179053 0.30714086 -0.03829953 -0.01077672 -0.00869595 438  ARG   A HH21 
5961  H  HH22 . ARG   A  383 ? 0.25991899 0.36450326 0.30692065 -0.03163017 -0.01658263 -0.00869146 438  ARG   A HH22 
5962  N  N    . ARG   A  384 ? 0.18460414 0.22398576 0.18546885 -0.02602617 -0.02612445 -0.00162562 439  ARG   A N    
5963  C  CA   . ARG   A  384 ? 0.24033943 0.27460170 0.24184948 -0.02329316 -0.03167580 0.00013628  439  ARG   A CA   
5964  C  C    . ARG   A  384 ? 0.26332080 0.28391790 0.25542536 -0.02404996 -0.03426114 0.00258363  439  ARG   A C    
5965  O  O    . ARG   A  384 ? 0.25595456 0.27042425 0.24676576 -0.02202258 -0.03876081 0.00430572  439  ARG   A O    
5966  C  CB   . ARG   A  384 ? 0.21448033 0.25361907 0.21921796 -0.02652922 -0.03350791 0.00290954  439  ARG   A CB   
5967  C  CG   . ARG   A  384 ? 0.21452424 0.26747912 0.22923642 -0.02647106 -0.03155632 0.00073035  439  ARG   A CG   
5968  C  CD   . ARG   A  384 ? 0.22581878 0.28307831 0.24224493 -0.03142874 -0.03238602 0.00333291  439  ARG   A CD   
5969  N  NE   . ARG   A  384 ? 0.17405394 0.24499339 0.20057049 -0.03193555 -0.03054265 0.00110397  439  ARG   A NE   
5970  C  CZ   . ARG   A  384 ? 0.17938378 0.25606954 0.20901021 -0.03645734 -0.03066795 0.00243013  439  ARG   A CZ   
5971  N  NH1  . ARG   A  384 ? 0.17855851 0.24838048 0.20192268 -0.04028468 -0.03258508 0.00574963  439  ARG   A NH1  
5972  N  NH2  . ARG   A  384 ? 0.19518454 0.28497502 0.23460019 -0.03720634 -0.02874774 0.00013237  439  ARG   A NH2  
5973  H  H    . ARG   A  384 ? 0.19562590 0.23751988 0.19575980 -0.02992328 -0.02455472 -0.00013233 439  ARG   A H    
5974  H  HA   . ARG   A  384 ? 0.23011371 0.26655185 0.23604120 -0.01883319 -0.03281426 -0.00208381 439  ARG   A HA   
5975  H  HB2  . ARG   A  384 ? 0.21675615 0.25348407 0.21716706 -0.03059742 -0.03238052 0.00492878  439  ARG   A HB2  
5976  H  HB3  . ARG   A  384 ? 0.22145450 0.25667071 0.22567210 -0.02476948 -0.03728884 0.00417402  439  ARG   A HB3  
5977  H  HG2  . ARG   A  384 ? 0.21978888 0.27557355 0.23956263 -0.02226090 -0.03359139 -0.00091506 439  ARG   A HG2  
5978  H  HG3  . ARG   A  384 ? 0.21699494 0.27380174 0.23236106 -0.02738193 -0.02766232 -0.00099462 439  ARG   A HG3  
5979  H  HD2  . ARG   A  384 ? 0.20651516 0.26073527 0.21802029 -0.03527633 -0.03047218 0.00490365  439  ARG   A HD2  
5980  H  HD3  . ARG   A  384 ? 0.20927590 0.26281232 0.22461455 -0.03056410 -0.03618126 0.00493442  439  ARG   A HD3  
5981  H  HE   . ARG   A  384 ? 0.18847072 0.26426005 0.21938986 -0.02920125 -0.02922768 -0.00138390 439  ARG   A HE   
5982  H  HH11 . ARG   A  384 ? 0.17955405 0.24295664 0.19912335 -0.03893931 -0.03541601 0.00709754  439  ARG   A HH11 
5983  H  HH12 . ARG   A  384 ? 0.17644000 0.24803065 0.19933474 -0.04417509 -0.03096881 0.00655920  439  ARG   A HH12 
5984  H  HH21 . ARG   A  384 ? 0.18772912 0.28097671 0.22863895 -0.04094680 -0.02825237 0.00095406  439  ARG   A HH21 
5985  H  HH22 . ARG   A  384 ? 0.19151032 0.28658840 0.23597601 -0.03405051 -0.02788431 -0.00229177 439  ARG   A HH22 
5986  N  N    . ILE   A  385 ? 0.27167904 0.28768536 0.25708622 -0.02734366 -0.03159785 0.00295728  440  ILE   A N    
5987  C  CA   . ILE   A  385 ? 0.24117509 0.24520068 0.21851587 -0.02830746 -0.03388960 0.00486442  440  ILE   A CA   
5988  C  C    . ILE   A  385 ? 0.34648260 0.34421062 0.32114476 -0.02441997 -0.03393768 0.00163578  440  ILE   A C    
5989  O  O    . ILE   A  385 ? 0.22942124 0.22910550 0.20277181 -0.02449987 -0.03041909 -0.00115805 440  ILE   A O    
5990  C  CB   . ILE   A  385 ? 0.24480699 0.24677700 0.21652815 -0.03402238 -0.03217172 0.00742244  440  ILE   A CB   
5991  C  CG1  . ILE   A  385 ? 0.20740773 0.21421801 0.18124309 -0.03743306 -0.03235590 0.01031880  440  ILE   A CG1  
5992  C  CG2  . ILE   A  385 ? 0.22637931 0.21701282 0.19079608 -0.03517072 -0.03458794 0.00913105  440  ILE   A CG2  
5993  C  CD1  . ILE   A  385 ? 0.22639023 0.23256093 0.19599970 -0.04213996 -0.03040058 0.01223702  440  ILE   A CD1  
5994  H  H    . ILE   A  385 ? 0.25797397 0.27838290 0.24378109 -0.02919009 -0.02846886 0.00211571  440  ILE   A H    
5995  H  HA   . ILE   A  385 ? 0.26444623 0.26540336 0.24169391 -0.02765026 -0.03693942 0.00663480  440  ILE   A HA   
5996  H  HB   . ILE   A  385 ? 0.23288019 0.23754273 0.20404321 -0.03482372 -0.02931700 0.00588934  440  ILE   A HB   
5997  H  HG12 . ILE   A  385 ? 0.21956553 0.22312146 0.19278747 -0.03703911 -0.03509184 0.01196595  440  ILE   A HG12 
5998  H  HG13 . ILE   A  385 ? 0.21753860 0.23120549 0.19635341 -0.03671815 -0.03129145 0.00919480  440  ILE   A HG13 
5999  H  HG21 . ILE   A  385 ? 0.23388189 0.22134477 0.19824895 -0.03436394 -0.03725965 0.01062415  440  ILE   A HG21 
6000  H  HG22 . ILE   A  385 ? 0.23777907 0.22497791 0.20037544 -0.03343112 -0.03435095 0.00710828  440  ILE   A HG22 
6001  H  HG23 . ILE   A  385 ? 0.22990398 0.21998569 0.19150388 -0.03854467 -0.03372003 0.01069960  440  ILE   A HG23 
6002  H  HD11 . ILE   A  385 ? 0.22013849 0.22048977 0.18566014 -0.04308474 -0.03170823 0.01357417  440  ILE   A HD11 
6003  H  HD12 . ILE   A  385 ? 0.21958667 0.22773129 0.18857056 -0.04260701 -0.02795138 0.01082282  440  ILE   A HD12 
6004  H  HD13 . ILE   A  385 ? 0.21541548 0.22492981 0.18680257 -0.04387197 -0.03032130 0.01355605  440  ILE   A HD13 
6005  N  N    . GLU   A  386 ? 0.25362569 0.24269888 0.22648689 -0.02113727 -0.03809249 0.00206084  441  GLU   A N    
6006  C  CA   . GLU   A  386 ? 0.26711044 0.24827580 0.23672214 -0.01738464 -0.03868429 -0.00102733 441  GLU   A CA   
6007  C  C    . GLU   A  386 ? 0.28663325 0.26095003 0.24819309 -0.02144201 -0.03711955 -0.00092609 441  GLU   A C    
6008  O  O    . GLU   A  386 ? 0.25265148 0.22455712 0.21025839 -0.02656346 -0.03753018 0.00257538  441  GLU   A O    
6009  C  CB   . GLU   A  386 ? 0.33476114 0.30599639 0.30272678 -0.01367574 -0.04393122 0.00009361  441  GLU   A CB   
6010  C  CG   . GLU   A  386 ? 0.32705891 0.30389076 0.30292308 -0.00805354 -0.04653979 -0.00074691 441  GLU   A CG   
6011  C  CD   . GLU   A  386 ? 0.29994223 0.28358966 0.27964044 -0.01028866 -0.04807841 0.00265567  441  GLU   A CD   
6012  O  OE1  . GLU   A  386 ? 0.34589022 0.32905951 0.32172102 -0.01614499 -0.04724855 0.00601238  441  GLU   A OE1  
6013  O  OE2  . GLU   A  386 ? 0.30035692 0.28975627 0.28699088 -0.00592535 -0.05038861 0.00175418  441  GLU   A OE2  
6014  H  H    . GLU   A  386 ? 0.27370983 0.26122296 0.24683127 -0.02134369 -0.04063194 0.00430872  441  GLU   A H    
6015  H  HA   . GLU   A  386 ? 0.28002867 0.26675066 0.25370061 -0.01443149 -0.03671735 -0.00420319 441  GLU   A HA   
6016  H  HB2  . GLU   A  386 ? 0.31635836 0.28307030 0.28059334 -0.01687874 -0.04560213 0.00339322  441  GLU   A HB2  
6017  H  HB3  . GLU   A  386 ? 0.32358897 0.28812486 0.28830463 -0.01182328 -0.04432489 -0.00181681 441  GLU   A HB3  
6018  H  HG2  . GLU   A  386 ? 0.33148664 0.30040598 0.30524081 -0.00498244 -0.04975340 -0.00071300 441  GLU   A HG2  
6019  H  HG3  . GLU   A  386 ? 0.32369155 0.30743274 0.30446038 -0.00538863 -0.04425170 -0.00401331 441  GLU   A HG3  
6020  N  N    . ASP   A  387 ? 0.27330086 0.24535808 0.23282112 -0.01896053 -0.03525688 -0.00512765 442  ASP   A N    
6021  C  CA   . ASP   A  387 ? 0.29307890 0.25876987 0.24486807 -0.02241313 -0.03414190 -0.00572813 442  ASP   A CA   
6022  C  C    . ASP   A  387 ? 0.30576479 0.25954404 0.25145853 -0.02511206 -0.03807406 -0.00269704 442  ASP   A C    
6023  O  O    . ASP   A  387 ? 0.31266081 0.26432392 0.25378978 -0.03025182 -0.03777804 -0.00074036 442  ASP   A O    
6024  C  CB   . ASP   A  387 ? 0.36048904 0.32376671 0.31040475 -0.01846565 -0.03235904 -0.01111507 442  ASP   A CB   
6025  C  CG   . ASP   A  387 ? 0.41794580 0.39345247 0.37224677 -0.01734840 -0.02725799 -0.01422132 442  ASP   A CG   
6026  O  OD1  . ASP   A  387 ? 0.47067368 0.45476902 0.42734188 -0.02118050 -0.02503374 -0.01179763 442  ASP   A OD1  
6027  O  OD2  . ASP   A  387 ? 0.51271838 0.48922247 0.46831205 -0.01258004 -0.02549111 -0.01902830 442  ASP   A OD2  
6028  H  H    . ASP   A  387 ? 0.28558713 0.26031455 0.24867648 -0.01490120 -0.03475365 -0.00786166 442  ASP   A H    
6029  H  HA   . ASP   A  387 ? 0.29647589 0.26725218 0.24796520 -0.02581381 -0.03196153 -0.00464380 442  ASP   A HA   
6030  H  HB2  . ASP   A  387 ? 0.36209968 0.32138252 0.31339246 -0.01432530 -0.03436338 -0.01250584 442  ASP   A HB2  
6031  H  HB3  . ASP   A  387 ? 0.36021954 0.31752050 0.30428356 -0.02070358 -0.03253533 -0.01144356 442  ASP   A HB3  
6032  N  N    . ILE   A  388 ? 0.33635837 0.28273743 0.28221241 -0.02170569 -0.04184288 -0.00216783 443  ILE   A N    
6033  C  CA   . ILE   A  388 ? 0.29941729 0.23397154 0.23905320 -0.02472170 -0.04540776 0.00091580  443  ILE   A CA   
6034  C  C    . ILE   A  388 ? 0.32716870 0.26392159 0.26809311 -0.02781555 -0.04700849 0.00599223  443  ILE   A C    
6035  O  O    . ILE   A  388 ? 0.32874596 0.26808959 0.27373621 -0.02467800 -0.04869289 0.00698448  443  ILE   A O    
6036  C  CB   . ILE   A  388 ? 0.32740471 0.24997365 0.26418024 -0.01996852 -0.04876136 -0.00114614 443  ILE   A CB   
6037  C  CG1  . ILE   A  388 ? 0.31434733 0.23384058 0.24855947 -0.01745626 -0.04694095 -0.00652791 443  ILE   A CG1  
6038  C  CG2  . ILE   A  388 ? 0.34934378 0.25875601 0.27914679 -0.02386487 -0.05257995 0.00265212  443  ILE   A CG2  
6039  C  CD1  . ILE   A  388 ? 0.34749836 0.25648117 0.28001848 -0.01155101 -0.04980867 -0.00943722 443  ILE   A CD1  
6040  H  H    . ILE   A  388 ? 0.32129258 0.26993245 0.27105829 -0.01757121 -0.04225029 -0.00367566 443  ILE   A H    
6041  H  HA   . ILE   A  388 ? 0.31567827 0.24830666 0.25158307 -0.02812411 -0.04448031 0.00085892  443  ILE   A HA   
6042  H  HB   . ILE   A  388 ? 0.32346308 0.24842541 0.26438928 -0.01589351 -0.04981789 -0.00146865 443  ILE   A HB   
6043  H  HG12 . ILE   A  388 ? 0.32441247 0.24029681 0.25395671 -0.02146171 -0.04660935 -0.00616587 443  ILE   A HG12 
6044  H  HG13 . ILE   A  388 ? 0.31893468 0.24737164 0.25700915 -0.01599661 -0.04396250 -0.00863399 443  ILE   A HG13 
6045  H  HG21 . ILE   A  388 ? 0.34408760 0.25208011 0.27055568 -0.02807414 -0.05165032 0.00301387  443  ILE   A HG21 
6046  H  HG22 . ILE   A  388 ? 0.34125233 0.25238484 0.27223429 -0.02515860 -0.05366229 0.00591856  443  ILE   A HG22 
6047  H  HG23 . ILE   A  388 ? 0.35414422 0.25493380 0.28157616 -0.02091454 -0.05484815 0.00138411  443  ILE   A HG23 
6048  H  HD11 . ILE   A  388 ? 0.34803224 0.24675068 0.27514130 -0.01369043 -0.05230163 -0.00800950 443  ILE   A HD11 
6049  H  HD12 . ILE   A  388 ? 0.34158939 0.25262311 0.27827823 -0.00798016 -0.05123557 -0.00882586 443  ILE   A HD12 
6050  H  HD13 . ILE   A  388 ? 0.34566528 0.25559816 0.27813497 -0.00897782 -0.04790490 -0.01350532 443  ILE   A HD13 
6051  N  N    . HIS   A  389 ? 0.28147846 0.21699107 0.21872488 -0.03384059 -0.04668311 0.00898925  444  HIS   A N    
6052  C  CA   . HIS   A  389 ? 0.27000803 0.20673811 0.20733128 -0.03708522 -0.04786486 0.01351254  444  HIS   A CA   
6053  C  C    . HIS   A  389 ? 0.34289458 0.26906377 0.27382484 -0.04107713 -0.05021530 0.01625942  444  HIS   A C    
6054  O  O    . HIS   A  389 ? 0.32034731 0.24167551 0.24747284 -0.04367309 -0.04995157 0.01512078  444  HIS   A O    
6055  C  CB   . HIS   A  389 ? 0.26319993 0.20995295 0.20294344 -0.04082542 -0.04480133 0.01468016  444  HIS   A CB   
6056  C  CG   . HIS   A  389 ? 0.28060618 0.23144452 0.22211680 -0.04265891 -0.04530516 0.01822611  444  HIS   A CG   
6057  N  ND1  . HIS   A  389 ? 0.24077579 0.19780426 0.18719865 -0.03971596 -0.04552634 0.01815766  444  HIS   A ND1  
6058  C  CD2  . HIS   A  389 ? 0.31567648 0.26549634 0.25460830 -0.04714816 -0.04551025 0.02151037  444  HIS   A CD2  
6059  C  CE1  . HIS   A  389 ? 0.24927169 0.20790781 0.19511569 -0.04249697 -0.04605066 0.02137797  444  HIS   A CE1  
6060  N  NE2  . HIS   A  389 ? 0.25630948 0.21063113 0.19760959 -0.04682057 -0.04588955 0.02343518  444  HIS   A NE2  
6061  H  H    . HIS   A  389 ? 0.28993553 0.22404410 0.22456233 -0.03592555 -0.04567856 0.00803217  444  HIS   A H    
6062  H  HA   . HIS   A  389 ? 0.28303006 0.22099587 0.22287601 -0.03434702 -0.04913942 0.01402013  444  HIS   A HA   
6063  H  HB2  . HIS   A  389 ? 0.26437598 0.21691510 0.20716426 -0.03903815 -0.04290847 0.01258745  444  HIS   A HB2  
6064  H  HB3  . HIS   A  389 ? 0.26778218 0.21266687 0.20468417 -0.04392324 -0.04425773 0.01497565  444  HIS   A HB3  
6066  H  HD2  . HIS   A  389 ? 0.29391867 0.24048834 0.22996527 -0.04997045 -0.04550180 0.02221073  444  HIS   A HD2  
6067  H  HE1  . HIS   A  389 ? 0.24644339 0.20885865 0.19477312 -0.04156569 -0.04652049 0.02199185  444  HIS   A HE1  
6069  N  N    . LEU   A  390 ? 0.26901990 0.19207014 0.19860244 -0.04197688 -0.05243712 0.01989555  445  LEU   A N    
6070  C  CA   . LEU   A  390 ? 0.31361252 0.22889288 0.23746864 -0.04707708 -0.05383231 0.02328047  445  LEU   A CA   
6071  C  C    . LEU   A  390 ? 0.32631430 0.24906401 0.25135192 -0.05134166 -0.05212682 0.02649833  445  LEU   A C    
6072  O  O    . LEU   A  390 ? 0.36703682 0.29426011 0.29426801 -0.04976496 -0.05244879 0.02795265  445  LEU   A O    
6073  C  CB   . LEU   A  390 ? 0.33949918 0.24312012 0.25891954 -0.04498862 -0.05786205 0.02517770  445  LEU   A CB   
6074  C  CG   . LEU   A  390 ? 0.36580068 0.26216877 0.28492960 -0.03896935 -0.06010949 0.02191371  445  LEU   A CG   
6075  C  CD1  . LEU   A  390 ? 0.35332856 0.23743770 0.26732028 -0.03737493 -0.06449408 0.02455939  445  LEU   A CD1  
6076  C  CD2  . LEU   A  390 ? 0.33130205 0.22265688 0.24794780 -0.03988670 -0.05919582 0.01846529  445  LEU   A CD2  
6077  H  H    . LEU   A  390 ? 0.29097712 0.21707681 0.22319630 -0.03950139 -0.05305099 0.02026840  445  LEU   A H    
6078  H  HA   . LEU   A  390 ? 0.31257030 0.22494732 0.23434296 -0.04918821 -0.05336139 0.02222132  445  LEU   A HA   
6079  H  HB2  . LEU   A  390 ? 0.33775038 0.24427241 0.25842744 -0.04403696 -0.05849703 0.02691455  445  LEU   A HB2  
6080  H  HB3  . LEU   A  390 ? 0.34477919 0.24230318 0.25979966 -0.04881445 -0.05855349 0.02713626  445  LEU   A HB3  
6081  H  HG   . LEU   A  390 ? 0.34509254 0.24828845 0.26911795 -0.03512448 -0.05937340 0.02006174  445  LEU   A HG   
6082  H  HD11 . LEU   A  390 ? 0.36602750 0.24646473 0.28078291 -0.03252884 -0.06611037 0.02232865  445  LEU   A HD11 
6083  H  HD12 . LEU   A  390 ? 0.36645174 0.24292997 0.27533221 -0.04118122 -0.06520820 0.02615461  445  LEU   A HD12 
6084  H  HD13 . LEU   A  390 ? 0.35774651 0.24494720 0.27250454 -0.03740023 -0.06512645 0.02691600  445  LEU   A HD13 
6085  H  HD21 . LEU   A  390 ? 0.33479354 0.23404793 0.25457215 -0.04020189 -0.05658422 0.01662985  445  LEU   A HD21 
6086  H  HD22 . LEU   A  390 ? 0.34565043 0.23150185 0.25812221 -0.04426016 -0.05973529 0.02018755  445  LEU   A HD22 
6087  H  HD23 . LEU   A  390 ? 0.34919643 0.23485091 0.26510906 -0.03582028 -0.06077921 0.01633194  445  LEU   A HD23 
6088  N  N    . LEU   A  391 ? 0.26833296 0.19256586 0.19203891 -0.05659555 -0.05047837 0.02734972  446  LEU   A N    
6089  C  CA   . LEU   A  391 ? 0.31509081 0.24475875 0.23918295 -0.06072510 -0.04902277 0.03035964  446  LEU   A CA   
6090  C  C    . LEU   A  391 ? 0.30778337 0.22875370 0.22621471 -0.06422726 -0.05078200 0.03368482  446  LEU   A C    
6091  O  O    . LEU   A  391 ? 0.30482531 0.21809353 0.21959010 -0.06695329 -0.05182840 0.03370326  446  LEU   A O    
6092  C  CB   . LEU   A  391 ? 0.35072607 0.28712973 0.27683404 -0.06448361 -0.04656737 0.02982037  446  LEU   A CB   
6093  C  CG   . LEU   A  391 ? 0.41528869 0.36104888 0.34613431 -0.06228367 -0.04442197 0.02764824  446  LEU   A CG   
6094  C  CD1  . LEU   A  391 ? 0.43575418 0.38631111 0.36758658 -0.06578500 -0.04291764 0.02733296  446  LEU   A CD1  
6095  C  CD2  . LEU   A  391 ? 0.43040684 0.38284072 0.36435163 -0.06065206 -0.04347774 0.02883965  446  LEU   A CD2  
6096  H  H    . LEU   A  391 ? 0.29343188 0.21547630 0.21610293 -0.05748434 -0.05030532 0.02584417  446  LEU   A H    
6097  H  HA   . LEU   A  391 ? 0.30400178 0.23829791 0.23038931 -0.05887892 -0.04864329 0.03072466  446  LEU   A HA   
6098  H  HB2  . LEU   A  391 ? 0.35959235 0.29186267 0.28381702 -0.06596773 -0.04715916 0.02896889  446  LEU   A HB2  
6099  H  HB3  . LEU   A  391 ? 0.35288382 0.29127243 0.27866873 -0.06729688 -0.04590359 0.03186680  446  LEU   A HB3  
6100  H  HG   . LEU   A  391 ? 0.40949684 0.35378495 0.34064075 -0.05954819 -0.04474081 0.02551434  446  LEU   A HG   
6101  H  HD11 . LEU   A  391 ? 0.42390922 0.37855500 0.35760659 -0.06426836 -0.04189735 0.02580386  446  LEU   A HD11 
6102  H  HD12 . LEU   A  391 ? 0.42461580 0.37846348 0.35731095 -0.06778763 -0.04218702 0.02905814  446  LEU   A HD12 
6103  H  HD13 . LEU   A  391 ? 0.43083149 0.37703538 0.36047152 -0.06753267 -0.04381347 0.02689336  446  LEU   A HD13 
6104  H  HD21 . LEU   A  391 ? 0.42267063 0.37297231 0.35662100 -0.05800393 -0.04467022 0.02865183  446  LEU   A HD21 
6105  H  HD22 . LEU   A  391 ? 0.42234230 0.37542370 0.35541075 -0.06298466 -0.04322701 0.03080550  446  LEU   A HD22 
6106  H  HD23 . LEU   A  391 ? 0.41765535 0.37563267 0.35424867 -0.06001184 -0.04202386 0.02773642  446  LEU   A HD23 
6107  N  N    . VAL   A  392 ? 0.31600094 0.23803616 0.23326875 -0.06441174 -0.05109745 0.03643807  447  VAL   A N    
6108  C  CA   . VAL   A  392 ? 0.29332632 0.20670876 0.20412102 -0.06747816 -0.05276163 0.04000612  447  VAL   A CA   
6109  C  C    . VAL   A  392 ? 0.29327339 0.21200067 0.20350498 -0.07324509 -0.05000070 0.04228674  447  VAL   A C    
6110  O  O    . VAL   A  392 ? 0.28519666 0.21396264 0.19953912 -0.07302754 -0.04764169 0.04180265  447  VAL   A O    
6111  C  CB   . VAL   A  392 ? 0.33314115 0.24254481 0.24160409 -0.06349935 -0.05557628 0.04151829  447  VAL   A CB   
6112  C  CG1  . VAL   A  392 ? 0.33801904 0.23682289 0.23820448 -0.06673480 -0.05760597 0.04555570  447  VAL   A CG1  
6113  C  CG2  . VAL   A  392 ? 0.37750381 0.28314120 0.28802624 -0.05724150 -0.05813905 0.03872087  447  VAL   A CG2  
6114  H  H    . VAL   A  392 ? 0.30021298 0.22836110 0.22040226 -0.06276052 -0.05024667 0.03610235  447  VAL   A H    
6115  H  HA   . VAL   A  392 ? 0.31225502 0.21845019 0.22029671 -0.06845757 -0.05400017 0.03984348  447  VAL   A HA   
6116  H  HB   . VAL   A  392 ? 0.32485622 0.24125786 0.23583357 -0.06279793 -0.05447694 0.04161441  447  VAL   A HB   
6117  H  HG11 . VAL   A  392 ? 0.34690964 0.23862241 0.24442032 -0.06820147 -0.05850540 0.04559606  447  VAL   A HG11 
6118  H  HG12 . VAL   A  392 ? 0.33793914 0.24011371 0.23698440 -0.07043803 -0.05570169 0.04726590  447  VAL   A HG12 
6119  H  HG13 . VAL   A  392 ? 0.34462130 0.24014334 0.24304463 -0.06372944 -0.05997455 0.04640647  447  VAL   A HG13 
6120  H  HG21 . VAL   A  392 ? 0.36747727 0.27082437 0.27686739 -0.05459845 -0.06030081 0.03972028  447  VAL   A HG21 
6121  H  HG22 . VAL   A  392 ? 0.35627547 0.26901698 0.27180511 -0.05534938 -0.05660016 0.03626814  447  VAL   A HG22 
6122  H  HG23 . VAL   A  392 ? 0.37095648 0.26934913 0.27885371 -0.05774060 -0.05919745 0.03829179  447  VAL   A HG23 
6123  N  N    . ASP   A  393 ? 0.25530308 0.16725205 0.16056125 -0.07847334 -0.05021565 0.04460263  448  ASP   A N    
6124  C  CA   . ASP   A  393 ? 0.28356576 0.20083085 0.18822312 -0.08405565 -0.04736704 0.04687667  448  ASP   A CA   
6125  C  C    . ASP   A  393 ? 0.31650531 0.23611364 0.21865711 -0.08336364 -0.04678765 0.04913342  448  ASP   A C    
6126  O  O    . ASP   A  393 ? 0.30720544 0.21915427 0.20426610 -0.08110896 -0.04955115 0.05085232  448  ASP   A O    
6127  C  CB   . ASP   A  393 ? 0.33404291 0.24329899 0.23332755 -0.09014915 -0.04769815 0.04931660  448  ASP   A CB   
6128  C  CG   . ASP   A  393 ? 0.52625734 0.43318903 0.42719206 -0.09270886 -0.04815758 0.04738048  448  ASP   A CG   
6129  O  OD1  . ASP   A  393 ? 0.61937004 0.53061789 0.52524412 -0.08923016 -0.04829720 0.04390730  448  ASP   A OD1  
6130  O  OD2  . ASP   A  393 ? 0.63289106 0.53367221 0.52982354 -0.09853017 -0.04836977 0.04932445  448  ASP   A OD2  
6131  H  H    . ASP   A  393 ? 0.28058213 0.18461709 0.18286014 -0.07863461 -0.05205142 0.04468097  448  ASP   A H    
6132  H  HA   . ASP   A  393 ? 0.28404939 0.20910336 0.19340092 -0.08458966 -0.04543844 0.04530952  448  ASP   A HA   
6133  H  HB2  . ASP   A  393 ? 0.36402571 0.26447812 0.25813809 -0.08947454 -0.04989491 0.05095669  448  ASP   A HB2  
6134  H  HB3  . ASP   A  393 ? 0.35439163 0.26806128 0.25348359 -0.09365637 -0.04550649 0.05082902  448  ASP   A HB3  
6135  N  N    . ARG   A  394 ? 0.32266146 0.25258526 0.22810131 -0.08521301 -0.04341757 0.04900341  449  ARG   A N    
6136  C  CA   . ARG   A  394 ? 0.35873437 0.29090416 0.26088485 -0.08560684 -0.04234176 0.05094614  449  ARG   A CA   
6137  C  C    . ARG   A  394 ? 0.42827457 0.34972161 0.32115412 -0.08917286 -0.04377081 0.05480514  449  ARG   A C    
6138  O  O    . ARG   A  394 ? 0.40064758 0.31661433 0.29098445 -0.09364951 -0.04370157 0.05612157  449  ARG   A O    
6139  C  CB   . ARG   A  394 ? 0.36369836 0.30740982 0.27026021 -0.08796512 -0.03813210 0.05008392  449  ARG   A CB   
6140  C  CG   . ARG   A  394 ? 0.42066807 0.36604702 0.32701364 -0.09413844 -0.03563376 0.05128486  449  ARG   A CG   
6141  C  CD   . ARG   A  394 ? 0.50886941 0.46677250 0.42124736 -0.09542406 -0.03169960 0.04978993  449  ARG   A CD   
6142  N  NE   . ARG   A  394 ? 1.29588282 1.25612700 1.20606279 -0.10146150 -0.02863276 0.05178041  449  ARG   A NE   
6143  C  CZ   . ARG   A  394 ? 0.88382059 0.84028333 0.79228586 -0.10697228 -0.02853407 0.05339853  449  ARG   A CZ   
6144  N  NH1  . ARG   A  394 ? 1.19553244 1.14763021 1.10592186 -0.10734880 -0.03102805 0.05250034  449  ARG   A NH1  
6145  N  NH2  . ARG   A  394 ? 0.96245986 0.91968918 0.86698067 -0.11258214 -0.02567356 0.05583425  449  ARG   A NH2  
6146  H  H    . ARG   A  394 ? 0.32213157 0.25763819 0.23174058 -0.08613164 -0.04184904 0.04756626  449  ARG   A H    
6147  H  HA   . ARG   A  394 ? 0.35925740 0.29196841 0.26220998 -0.08171096 -0.04370331 0.05014520  449  ARG   A HA   
6148  H  HB2  . ARG   A  394 ? 0.37195659 0.31736970 0.27646339 -0.08747727 -0.03743942 0.05078581  449  ARG   A HB2  
6149  H  HB3  . ARG   A  394 ? 0.36396056 0.31285304 0.27581987 -0.08567574 -0.03775577 0.04783665  449  ARG   A HB3  
6150  H  HG2  . ARG   A  394 ? 0.42652273 0.36918658 0.33415249 -0.09493355 -0.03673269 0.05069222  449  ARG   A HG2  
6151  H  HG3  . ARG   A  394 ? 0.43805414 0.37867665 0.33878583 -0.09683721 -0.03557207 0.05369068  449  ARG   A HG3  
6152  H  HD2  . ARG   A  394 ? 0.59670955 0.55789691 0.50964910 -0.09273136 -0.03115225 0.04908802  449  ARG   A HD2  
6153  H  HD3  . ARG   A  394 ? 0.59701622 0.55847716 0.51440132 -0.09474748 -0.03176970 0.04800845  449  ARG   A HD3  
6154  H  HE   . ARG   A  394 ? 0.92953587 0.89420784 0.83951730 -0.10166526 -0.02655202 0.05184000  449  ARG   A HE   
6155  H  HH11 . ARG   A  394 ? 1.07506478 1.02940214 0.98936021 -0.10430840 -0.03199742 0.05048575  449  ARG   A HH11 
6156  H  HH12 . ARG   A  394 ? 1.09069169 1.03738523 0.99810582 -0.11075911 -0.03169856 0.05388830  449  ARG   A HH12 
6157  H  HH21 . ARG   A  394 ? 0.94788194 0.90351838 0.85189039 -0.11668928 -0.02534612 0.05682369  449  ARG   A HH21 
6158  H  HH22 . ARG   A  394 ? 0.94340432 0.90274465 0.84567302 -0.11234564 -0.02403528 0.05640779  449  ARG   A HH22 
6159  N  N    . ARG   A  395 ? 0.34676951 0.26449776 0.23424229 -0.08708874 -0.04556247 0.05661735  450  ARG   A N    
6160  C  CA   . ARG   A  395 ? 0.32734668 0.23471159 0.20453671 -0.08997380 -0.04720199 0.06073282  450  ARG   A CA   
6161  C  C    . ARG   A  395 ? 0.32706410 0.22131351 0.20011732 -0.08720806 -0.05223490 0.06177009  450  ARG   A C    
6162  O  O    . ARG   A  395 ? 0.33828244 0.22205830 0.20202661 -0.08876350 -0.05459534 0.06543649  450  ARG   A O    
6163  C  CB   . ARG   A  395 ? 0.32457739 0.23130795 0.19735244 -0.09789013 -0.04370708 0.06339791  450  ARG   A CB   
6164  C  CG   . ARG   A  395 ? 0.37091619 0.29021859 0.24663733 -0.10015256 -0.03871369 0.06255732  450  ARG   A CG   
6165  C  CD   . ARG   A  395 ? 0.38936353 0.31304294 0.26549861 -0.10732061 -0.03435280 0.06359642  450  ARG   A CD   
6166  N  NE   . ARG   A  395 ? 0.67544609 0.58766425 0.54306841 -0.11287123 -0.03537437 0.06747103  450  ARG   A NE   
6167  C  CZ   . ARG   A  395 ? 0.84373528 0.74819529 0.70056552 -0.11563429 -0.03568053 0.07137097  450  ARG   A CZ   
6168  N  NH1  . ARG   A  395 ? 0.75643140 0.66451859 0.60957372 -0.11390826 -0.03454168 0.07175074  450  ARG   A NH1  
6169  N  NH2  . ARG   A  395 ? 0.97640419 0.86869651 0.82527423 -0.12062630 -0.03717855 0.07502298  450  ARG   A NH2  
6170  H  H    . ARG   A  395 ? 0.34983063 0.27177376 0.24002135 -0.08372068 -0.04590449 0.05522393  450  ARG   A H    
6171  H  HA   . ARG   A  395 ? 0.32988542 0.23886715 0.20490801 -0.08848891 -0.04747929 0.06128140  450  ARG   A HA   
6172  H  HB2  . ARG   A  395 ? 0.33822760 0.24425600 0.21365541 -0.09979715 -0.04335944 0.06269695  450  ARG   A HB2  
6173  H  HB3  . ARG   A  395 ? 0.34846765 0.24699497 0.21360424 -0.09968584 -0.04514524 0.06634022  450  ARG   A HB3  
6174  H  HG2  . ARG   A  395 ? 0.36556107 0.28373736 0.23643990 -0.09963925 -0.03890822 0.06385565  450  ARG   A HG2  
6175  H  HG3  . ARG   A  395 ? 0.35050860 0.27696964 0.23295788 -0.09708750 -0.03809548 0.05977018  450  ARG   A HG3  
6176  H  HD2  . ARG   A  395 ? 0.43351981 0.36334902 0.30928203 -0.10842162 -0.03148146 0.06359877  450  ARG   A HD2  
6177  H  HD3  . ARG   A  395 ? 0.42652684 0.35531265 0.30939475 -0.10726957 -0.03353240 0.06147633  450  ARG   A HD3  
6178  H  HE   . ARG   A  395 ? 0.61958826 0.52942795 0.48889607 -0.11468845 -0.03591263 0.06728972  450  ARG   A HE   
6179  H  HH11 . ARG   A  395 ? 0.75583553 0.66803551 0.61250591 -0.10954350 -0.03529101 0.06969810  450  ARG   A HH11 
6180  H  HH12 . ARG   A  395 ? 0.78686982 0.69306171 0.63370949 -0.11731470 -0.03302708 0.07404286  450  ARG   A HH12 
6181  H  HH21 . ARG   A  395 ? 0.92886198 0.81531310 0.76989770 -0.12251464 -0.03755761 0.07785562  450  ARG   A HH21 
6182  H  HH22 . ARG   A  395 ? 0.92920792 0.81892806 0.78029746 -0.12214231 -0.03787476 0.07463217  450  ARG   A HH22 
6183  N  N    . TRP   A  396 ? 0.35212791 0.24695984 0.23164473 -0.08259903 -0.05395630 0.05848388  451  TRP   A N    
6184  C  CA   . TRP   A  396 ? 0.35375082 0.23654532 0.23034978 -0.07925270 -0.05850439 0.05861533  451  TRP   A CA   
6185  C  C    . TRP   A  396 ? 0.33433580 0.21959287 0.21583393 -0.07135032 -0.06141800 0.05597638  451  TRP   A C    
6186  O  O    . TRP   A  396 ? 0.31529850 0.21217804 0.20384726 -0.06899378 -0.05948478 0.05340547  451  TRP   A O    
6187  C  CB   . TRP   A  396 ? 0.36166823 0.24042508 0.24023445 -0.08148488 -0.05810516 0.05689687  451  TRP   A CB   
6188  C  CG   . TRP   A  396 ? 0.33536148 0.20684709 0.20710631 -0.08917404 -0.05708306 0.06026438  451  TRP   A CG   
6189  C  CD1  . TRP   A  396 ? 0.35463950 0.23375855 0.22728898 -0.09565151 -0.05277188 0.06132297  451  TRP   A CD1  
6190  C  CD2  . TRP   A  396 ? 0.39503449 0.25019532 0.25789008 -0.09140558 -0.06039714 0.06316821  451  TRP   A CD2  
6191  N  NE1  . TRP   A  396 ? 0.34326166 0.21297649 0.20865773 -0.10223290 -0.05283362 0.06466292  451  TRP   A NE1  
6192  C  CE2  . TRP   A  396 ? 0.36798337 0.22203317 0.22662029 -0.10005021 -0.05758263 0.06608161  451  TRP   A CE2  
6193  C  CE3  . TRP   A  396 ? 0.37854159 0.21972853 0.23663595 -0.08682100 -0.06554338 0.06355479  451  TRP   A CE3  
6194  C  CZ2  . TRP   A  396 ? 0.42927682 0.26813924 0.27851599 -0.10498895 -0.05965593 0.06964546  451  TRP   A CZ2  
6195  C  CZ3  . TRP   A  396 ? 0.41997036 0.24514470 0.26843241 -0.09103639 -0.06798051 0.06702258  451  TRP   A CZ3  
6196  C  CH2  . TRP   A  396 ? 0.41410232 0.23788115 0.25783840 -0.10036454 -0.06502417 0.07021683  451  TRP   A CH2  
6197  H  H    . TRP   A  396 ? 0.33345181 0.23626207 0.21914610 -0.08136222 -0.05221824 0.05602042  451  TRP   A H    
6198  H  HA   . TRP   A  396 ? 0.36577874 0.24034682 0.23519203 -0.08089443 -0.06022867 0.06166079  451  TRP   A HA   
6199  H  HB2  . TRP   A  396 ? 0.34094140 0.22832254 0.22561939 -0.08142878 -0.05577285 0.05445807  451  TRP   A HB2  
6200  H  HB3  . TRP   A  396 ? 0.35518306 0.22761443 0.23338240 -0.07783839 -0.06095462 0.05587817  451  TRP   A HB3  
6201  H  HD1  . TRP   A  396 ? 0.33422798 0.22371820 0.21192646 -0.09561309 -0.05010049 0.05990632  451  TRP   A HD1  
6202  H  HE1  . TRP   A  396 ? 0.35227251 0.22542036 0.21743178 -0.10712159 -0.05023668 0.06572324  451  TRP   A HE1  
6203  H  HE3  . TRP   A  396 ? 0.38651472 0.22909535 0.24788132 -0.08096613 -0.06734434 0.06152207  451  TRP   A HE3  
6204  H  HZ2  . TRP   A  396 ? 0.41503674 0.25394768 0.26190421 -0.11122968 -0.05747996 0.07153884  451  TRP   A HZ2  
6205  H  HZ3  . TRP   A  396 ? 0.42028582 0.23534340 0.26531336 -0.08763862 -0.07167524 0.06727792  451  TRP   A HZ3  
6206  H  HH2  . TRP   A  396 ? 0.43515727 0.24754527 0.27216315 -0.10355378 -0.06671386 0.07262921  451  TRP   A HH2  
6207  N  N    . HIS   A  397 ? 0.32928455 0.20314626 0.20675731 -0.06749015 -0.06617985 0.05679727  452  HIS   A N    
6208  C  CA   . HIS   A  397 ? 0.30414695 0.17913055 0.18710557 -0.05974863 -0.06923036 0.05376686  452  HIS   A CA   
6209  C  C    . HIS   A  397 ? 0.37605405 0.24236417 0.25943682 -0.05752029 -0.07098273 0.05164333  452  HIS   A C    
6210  O  O    . HIS   A  397 ? 0.36509031 0.22077127 0.24214959 -0.06177693 -0.07141339 0.05353054  452  HIS   A O    
6211  C  CB   . HIS   A  397 ? 0.35804576 0.22704136 0.23625174 -0.05582038 -0.07409053 0.05617685  452  HIS   A CB   
6212  C  CG   . HIS   A  397 ? 0.41572821 0.29424772 0.29547021 -0.05504536 -0.07375342 0.05667297  452  HIS   A CG   
6213  N  ND1  . HIS   A  397 ? 0.42729062 0.30046788 0.30140993 -0.05254317 -0.07833031 0.05933329  452  HIS   A ND1  
6214  C  CD2  . HIS   A  397 ? 0.47184607 0.36381668 0.35781217 -0.05607292 -0.06996626 0.05464675  452  HIS   A CD2  
6215  C  CE1  . HIS   A  397 ? 0.39151016 0.27503318 0.26831004 -0.05254183 -0.07712045 0.05876220  452  HIS   A CE1  
6216  N  NE2  . HIS   A  397 ? 0.39631534 0.29096574 0.28018975 -0.05454484 -0.07212397 0.05595773  452  HIS   A NE2  
6217  H  H    . HIS   A  397 ? 0.33817798 0.20304161 0.20912376 -0.06984514 -0.06758583 0.05940859  452  HIS   A H    
6218  H  HA   . HIS   A  397 ? 0.31678897 0.20189184 0.20617935 -0.05836187 -0.06717899 0.05139372  452  HIS   A HA   
6219  H  HB2  . HIS   A  397 ? 0.36887389 0.22842509 0.23942465 -0.05852279 -0.07551261 0.05931830  452  HIS   A HB2  
6220  H  HB3  . HIS   A  397 ? 0.36053336 0.22730052 0.24151811 -0.05083649 -0.07668270 0.05437751  452  HIS   A HB3  
6222  H  HD2  . HIS   A  397 ? 0.42573327 0.32364312 0.31617886 -0.05757776 -0.06672158 0.05275641  452  HIS   A HD2  
6223  H  HE1  . HIS   A  397 ? 0.40825427 0.29089209 0.28201762 -0.05120388 -0.07976557 0.06016231  452  HIS   A HE1  
6225  N  N    . VAL   A  398 ? 0.36509079 0.23608589 0.25581065 -0.05099914 -0.07188023 0.04756720  453  VAL   A N    
6226  C  CA   . VAL   A  398 ? 0.35602707 0.21848130 0.24706975 -0.04677767 -0.07428288 0.04495331  453  VAL   A CA   
6227  C  C    . VAL   A  398 ? 0.41284454 0.27369922 0.30608916 -0.03871682 -0.07873416 0.04407258  453  VAL   A C    
6228  O  O    . VAL   A  398 ? 0.38582027 0.25792295 0.28516659 -0.03573177 -0.07843213 0.04304884  453  VAL   A O    
6229  C  CB   . VAL   A  398 ? 0.34764299 0.21814844 0.24586734 -0.04614879 -0.07074654 0.04015376  453  VAL   A CB   
6230  C  CG1  . VAL   A  398 ? 0.35764802 0.24309304 0.26544234 -0.04158628 -0.06892808 0.03695327  453  VAL   A CG1  
6231  C  CG2  . VAL   A  398 ? 0.37178758 0.23147574 0.26825970 -0.04298609 -0.07288066 0.03744332  453  VAL   A CG2  
6232  H  H    . VAL   A  398 ? 0.35329700 0.23333722 0.24900395 -0.04914382 -0.07081550 0.04624087  453  VAL   A H    
6233  H  HA   . VAL   A  398 ? 0.37845048 0.23064956 0.26332730 -0.04943824 -0.07554251 0.04684852  453  VAL   A HA   
6234  H  HB   . VAL   A  398 ? 0.35002124 0.22315949 0.24752977 -0.05119688 -0.06809604 0.04086179  453  VAL   A HB   
6235  H  HG11 . VAL   A  398 ? 0.35401595 0.23801748 0.26384598 -0.03642552 -0.07117197 0.03543030  453  VAL   A HG11 
6236  H  HG12 . VAL   A  398 ? 0.34585938 0.23652852 0.25406227 -0.04300648 -0.06835667 0.03872634  453  VAL   A HG12 
6237  H  HG13 . VAL   A  398 ? 0.34387654 0.23480970 0.25508666 -0.04257915 -0.06615122 0.03465897  453  VAL   A HG13 
6238  H  HG21 . VAL   A  398 ? 0.36198217 0.22643790 0.26196563 -0.04321250 -0.07051528 0.03454776  453  VAL   A HG21 
6239  H  HG22 . VAL   A  398 ? 0.37689912 0.22667745 0.26713181 -0.04621365 -0.07416968 0.03958018  453  VAL   A HG22 
6240  H  HG23 . VAL   A  398 ? 0.37147519 0.22920927 0.26937881 -0.03751383 -0.07538201 0.03637061  453  VAL   A HG23 
6241  N  N    . ALA   A  399 ? 0.39584506 0.24249792 0.28429243 -0.03520094 -0.08308683 0.04433982  454  ALA   A N    
6242  C  CA   . ALA   A  399 ? 0.37670419 0.22080500 0.26767629 -0.02666285 -0.08791098 0.04310648  454  ALA   A CA   
6243  C  C    . ALA   A  399 ? 0.42633188 0.26060367 0.31741083 -0.02186303 -0.08975425 0.03958946  454  ALA   A C    
6244  O  O    . ALA   A  399 ? 0.36544964 0.19191667 0.25226611 -0.02593910 -0.08818065 0.03906769  454  ALA   A O    
6245  C  CB   . ALA   A  399 ? 0.40529406 0.23919684 0.28762379 -0.02665593 -0.09296570 0.04838191  454  ALA   A CB   
6246  H  H    . ALA   A  399 ? 0.40349466 0.24160713 0.28700578 -0.03820212 -0.08318586 0.04527277  454  ALA   A H    
6247  H  HA   . ALA   A  399 ? 0.38166499 0.23717511 0.27988169 -0.02393008 -0.08672769 0.04094551  454  ALA   A HA   
6248  H  HB1  . ALA   A  399 ? 0.40492225 0.23746139 0.28937626 -0.02063678 -0.09655133 0.04749017  454  ALA   A HB1  
6249  H  HB2  . ALA   A  399 ? 0.39469594 0.23493144 0.27664417 -0.02967131 -0.09161919 0.05028680  454  ALA   A HB2  
6250  H  HB3  . ALA   A  399 ? 0.41085315 0.23314425 0.28568220 -0.02970256 -0.09402964 0.05071888  454  ALA   A HB3  
6251  N  N    . ARG   A  400 ? 0.40264872 0.23746407 0.29877335 -0.01306307 -0.09324412 0.03692337  455  ARG   A N    
6252  C  CA   . ARG   A  400 ? 0.45134068 0.27909625 0.34911376 -0.00726979 -0.09443481 0.03242829  455  ARG   A CA   
6253  C  C    . ARG   A  400 ? 0.44771057 0.25344628 0.33443606 -0.00676149 -0.09976317 0.03535162  455  ARG   A C    
6254  O  O    . ARG   A  400 ? 0.43750751 0.23225844 0.31955063 -0.00861984 -0.09926773 0.03382585  455  ARG   A O    
6255  C  CB   . ARG   A  400 ? 0.42968851 0.26863298 0.33854449 0.00214302  -0.09550148 0.02791939  455  ARG   A CB   
6256  C  CG   . ARG   A  400 ? 0.48735079 0.32205296 0.39957926 0.00912135  -0.09584404 0.02217865  455  ARG   A CG   
6257  C  CD   . ARG   A  400 ? 0.53269827 0.37998328 0.45660239 0.01817738  -0.09665976 0.01790660  455  ARG   A CD   
6258  N  NE   . ARG   A  400 ? 0.54864854 0.39063984 0.47190654 0.02393364  -0.10346571 0.02056945  455  ARG   A NE   
6259  C  CZ   . ARG   A  400 ? 0.64065403 0.47972563 0.56841618 0.03380290  -0.10769429 0.01742904  455  ARG   A CZ   
6260  N  NH1  . ARG   A  400 ? 0.71017587 0.55384225 0.64505452 0.03960329  -0.10514668 0.01086680  455  ARG   A NH1  
6261  N  NH2  . ARG   A  400 ? 0.74409711 0.57589805 0.66918480 0.03822790  -0.11470102 0.02083870  455  ARG   A NH2  
6262  H  H    . ARG   A  400 ? 0.41492638 0.25478548 0.31364137 -0.01051505 -0.09494251 0.03772748  455  ARG   A H    
6263  H  HA   . ARG   A  400 ? 0.42956740 0.25998405 0.32844573 -0.01016420 -0.09080627 0.03024986  455  ARG   A HA   
6264  H  HB2  . ARG   A  400 ? 0.43169168 0.28394073 0.34664330 0.00069500  -0.09200739 0.02664388  455  ARG   A HB2  
6265  H  HB3  . ARG   A  400 ? 0.45168477 0.28836435 0.35974556 0.00510324  -0.09944636 0.03003641  455  ARG   A HB3  
6266  H  HG2  . ARG   A  400 ? 0.49856678 0.31911939 0.40443474 0.01060498  -0.09942900 0.02332170  455  ARG   A HG2  
6267  H  HG3  . ARG   A  400 ? 0.47967318 0.31709594 0.39254227 0.00620757  -0.09194147 0.01990519  455  ARG   A HG3  
6268  H  HD2  . ARG   A  400 ? 0.52715945 0.37323380 0.45351827 0.02213719  -0.09576893 0.01372251  455  ARG   A HD2  
6269  H  HD3  . ARG   A  400 ? 0.50933003 0.37020758 0.43912125 0.01624641  -0.09337617 0.01725903  455  ARG   A HD3  
6270  H  HE   . ARG   A  400 ? 0.56447899 0.40530691 0.48414332 0.02083290  -0.10497877 0.02445613  455  ARG   A HE   
6271  H  HH11 . ARG   A  400 ? 0.67425823 0.52819890 0.61394501 0.03783781  -0.10054880 0.00829133  455  ARG   A HH11 
6272  H  HH12 . ARG   A  400 ? 0.69654870 0.53298283 0.63121635 0.04536660  -0.10808147 0.00905731  455  ARG   A HH12 
6273  H  HH21 . ARG   A  400 ? 0.71834749 0.54979622 0.64753902 0.04519562  -0.11766190 0.01866428  455  ARG   A HH21 
6274  H  HH22 . ARG   A  400 ? 0.71242523 0.53981566 0.63154137 0.03427933  -0.11642380 0.02523494  455  ARG   A HH22 
6275  N  N    . LYS   A  401 ? 0.44525993 0.24401337 0.32737762 -0.00429166 -0.10514671 0.03953571  456  LYS   A N    
6276  C  CA   . LYS   A  401 ? 0.49666160 0.27346149 0.36676079 -0.00464169 -0.11049198 0.04343000  456  LYS   A CA   
6277  C  C    . LYS   A  401 ? 0.55485237 0.32694370 0.41712505 -0.00733747 -0.11415296 0.05013625  456  LYS   A C    
6278  O  O    . LYS   A  401 ? 0.47337213 0.25894564 0.34101620 -0.00600265 -0.11395614 0.05069834  456  LYS   A O    
6279  C  CB   . LYS   A  401 ? 0.59268904 0.36001620 0.46483833 0.00589240  -0.11545544 0.03966184  456  LYS   A CB   
6280  C  CG   . LYS   A  401 ? 0.66289192 0.43493021 0.54054332 0.01509199  -0.12066962 0.03958227  456  LYS   A CG   
6281  C  CD   . LYS   A  401 ? 0.72889173 0.50062203 0.61441129 0.02632356  -0.12310989 0.03344955  456  LYS   A CD   
6282  C  CE   . LYS   A  401 ? 0.78756016 0.53825873 0.66495931 0.02804989  -0.12551571 0.03212129  456  LYS   A CE   
6283  N  NZ   . LYS   A  401 ? 0.89563924 0.64587754 0.78068495 0.04015614  -0.12829933 0.02596223  456  LYS   A NZ   
6284  H  H    . LYS   A  401 ? 0.44883007 0.25630981 0.33502313 -0.00244584 -0.10567804 0.04004637  456  LYS   A H    
6285  H  HA   . LYS   A  401 ? 0.51377153 0.28431809 0.37900242 -0.01020121 -0.10845021 0.04404663  456  LYS   A HA   
6286  H  HB2  . LYS   A  401 ? 0.59994376 0.35131875 0.46359372 0.00473985  -0.11823194 0.04166276  456  LYS   A HB2  
6287  H  HB3  . LYS   A  401 ? 0.58010578 0.35330510 0.45824230 0.00790195  -0.11252228 0.03493109  456  LYS   A HB3  
6288  H  HG2  . LYS   A  401 ? 0.64511037 0.43157259 0.52885675 0.01413457  -0.11836651 0.03935465  456  LYS   A HG2  
6289  H  HG3  . LYS   A  401 ? 0.66936874 0.43056393 0.53922284 0.01460410  -0.12498603 0.04397327  456  LYS   A HG3  
6290  H  HD2  . LYS   A  401 ? 0.70996094 0.49511713 0.60416377 0.02728935  -0.11886300 0.02923908  456  LYS   A HD2  
6291  H  HD3  . LYS   A  401 ? 0.72666073 0.49921051 0.61444569 0.03195380  -0.12742257 0.03420268  456  LYS   A HD3  
6292  H  HE2  . LYS   A  401 ? 0.81209219 0.54872793 0.68011814 0.02619988  -0.12946904 0.03662622  456  LYS   A HE2  
6293  H  HE3  . LYS   A  401 ? 0.79255891 0.54336905 0.66859245 0.02289527  -0.12135086 0.03075842  456  LYS   A HE3  
6294  H  HZ1  . LYS   A  401 ? 0.86683762 0.61658710 0.75327009 0.04519448  -0.13259317 0.02723548  456  LYS   A HZ1  
6295  H  HZ2  . LYS   A  401 ? 0.85009843 0.61366296 0.74367803 0.04169502  -0.12441550 0.02183018  456  LYS   A HZ2  
6296  H  HZ3  . LYS   A  401 ? 0.87373936 0.61087799 0.75355506 0.04109748  -0.12963271 0.02492281  456  LYS   A HZ3  
6297  N  N    . PRO   A  402 ? 0.49719271 0.24995402 0.34597051 -0.01177723 -0.11742060 0.05541898  457  PRO   A N    
6298  C  CA   . PRO   A  402 ? 0.57181418 0.31893724 0.41115576 -0.01517902 -0.12059250 0.06215378  457  PRO   A CA   
6299  C  C    . PRO   A  402 ? 0.54288965 0.29470766 0.38557041 -0.00703384 -0.12608132 0.06279477  457  PRO   A C    
6300  O  O    . PRO   A  402 ? 0.59151173 0.35385931 0.43474293 -0.00947839 -0.12525713 0.06509929  457  PRO   A O    
6301  C  CB   . PRO   A  402 ? 0.59358871 0.31641722 0.41902620 -0.01831297 -0.12434817 0.06622529  457  PRO   A CB   
6302  C  CG   . PRO   A  402 ? 0.53028190 0.25174567 0.35703629 -0.02351885 -0.11942047 0.06302153  457  PRO   A CG   
6303  C  CD   . PRO   A  402 ? 0.53033531 0.26547948 0.37124518 -0.01507840 -0.11778472 0.05540756  457  PRO   A CD   
6304  H  HA   . PRO   A  402 ? 0.54249042 0.29724839 0.38135660 -0.02162137 -0.11653659 0.06368630  457  PRO   A HA   
6305  H  HB2  . PRO   A  402 ? 0.58987367 0.30346456 0.41406786 -0.01171075 -0.12935607 0.06574393  457  PRO   A HB2  
6306  H  HB3  . PRO   A  402 ? 0.58433074 0.30226746 0.40160909 -0.02358510 -0.12479630 0.07107442  457  PRO   A HB3  
6307  H  HG2  . PRO   A  402 ? 0.56054491 0.26633167 0.37999550 -0.02444435 -0.12192756 0.06426743  457  PRO   A HG2  
6308  H  HG3  . PRO   A  402 ? 0.53700763 0.26544964 0.36355928 -0.03059602 -0.11501053 0.06422965  457  PRO   A HG3  
6309  H  HD2  . PRO   A  402 ? 0.53285408 0.25933409 0.37358648 -0.00882730 -0.12145984 0.05351809  457  PRO   A HD2  
6310  H  HD3  . PRO   A  402 ? 0.51452488 0.25563696 0.35898805 -0.01846527 -0.11338812 0.05274666  457  PRO   A HD3  
6311  N  N    . LEU   A  403 ? 0.58297265 0.32799873 0.42866057 0.00294207  -0.13169135 0.06026075  458  LEU   A N    
6312  C  CA   . LEU   A  403 ? 0.61323714 0.36186799 0.46201342 0.01091255  -0.13788787 0.06107684  458  LEU   A CA   
6313  C  C    . LEU   A  403 ? 0.73415899 0.50753546 0.59787560 0.01407913  -0.13493994 0.05684438  458  LEU   A C    
6314  O  O    . LEU   A  403 ? 0.80598229 0.58505774 0.67220527 0.01855905  -0.13951838 0.05805418  458  LEU   A O    
6315  C  CB   . LEU   A  403 ? 0.63767666 0.37241161 0.48644704 0.02135957  -0.14482018 0.05912275  458  LEU   A CB   
6316  C  CG   . LEU   A  403 ? 0.59311187 0.30109608 0.42559868 0.02000834  -0.15061976 0.06464865  458  LEU   A CG   
6317  C  CD1  . LEU   A  403 ? 0.76930773 0.46615636 0.60341334 0.03153651  -0.15779203 0.06235718  458  LEU   A CD1  
6318  C  CD2  . LEU   A  403 ? 0.63914299 0.34122366 0.45980805 0.01492895  -0.15393694 0.07227679  458  LEU   A CD2  
6319  H  H    . LEU   A  403 ? 0.58612138 0.32442737 0.43212703 0.00497225  -0.13179493 0.05783788  458  LEU   A H    
6320  H  HA   . LEU   A  403 ? 0.63673580 0.37942079 0.47682324 0.00735028  -0.14006022 0.06605105  458  LEU   A HA   
6321  H  HB2  . LEU   A  403 ? 0.61373937 0.35139421 0.46872503 0.02363841  -0.14212814 0.05445314  458  LEU   A HB2  
6322  H  HB3  . LEU   A  403 ? 0.61876112 0.35995173 0.47306454 0.02759804  -0.14833894 0.05828802  458  LEU   A HB3  
6323  H  HG   . LEU   A  403 ? 0.63997585 0.34122589 0.46796852 0.01441232  -0.14732687 0.06476560  458  LEU   A HG   
6324  H  HD11 . LEU   A  403 ? 0.72478962 0.40329248 0.54834461 0.03023931  -0.16090302 0.06539690  458  LEU   A HD11 
6325  H  HD12 . LEU   A  403 ? 0.70893955 0.41015628 0.54572737 0.03661926  -0.16199155 0.06320874  458  LEU   A HD12 
6326  H  HD13 . LEU   A  403 ? 0.70108813 0.40430579 0.54405260 0.03555831  -0.15539311 0.05685153  458  LEU   A HD13 
6327  H  HD21 . LEU   A  403 ? 0.62239462 0.32761180 0.43949372 0.00657047  -0.14919759 0.07421976  458  LEU   A HD21 
6328  H  HD22 . LEU   A  403 ? 0.62562132 0.33784366 0.45165366 0.01891759  -0.15598790 0.07187384  458  LEU   A HD22 
6329  H  HD23 . LEU   A  403 ? 0.64760679 0.33240879 0.45847732 0.01592027  -0.15884691 0.07569437  458  LEU   A HD23 
6330  N  N    . ASP   A  404 ? 0.65402246 0.44156900 0.52710646 0.01141370  -0.12758645 0.05207372  459  ASP   A N    
6331  C  CA   . ASP   A  404 ? 0.56625247 0.37645638 0.45151484 0.01154076  -0.12355641 0.04894320  459  ASP   A CA   
6332  C  C    . ASP   A  404 ? 0.67090565 0.48649555 0.55083054 0.00406593  -0.12214684 0.05359754  459  ASP   A C    
6333  O  O    . ASP   A  404 ? 0.68210101 0.51367360 0.56995964 0.00477272  -0.12100873 0.05215464  459  ASP   A O    
6334  C  CB   . ASP   A  404 ? 0.55437893 0.37596765 0.44775212 0.00854885  -0.11570623 0.04391844  459  ASP   A CB   
6335  C  CG   . ASP   A  404 ? 0.67504966 0.49747494 0.57649344 0.01604153  -0.11541166 0.03778745  459  ASP   A CG   
6336  O  OD1  . ASP   A  404 ? 0.65725881 0.47621733 0.56192172 0.02507360  -0.12099496 0.03631879  459  ASP   A OD1  
6337  O  OD2  . ASP   A  404 ? 0.69114399 0.51722604 0.59528232 0.01306507  -0.10974068 0.03434467  459  ASP   A OD2  
6338  H  H    . ASP   A  404 ? 0.64929891 0.43170410 0.52082479 0.00940686  -0.12517914 0.05073746  459  ASP   A H    
6339  H  HA   . ASP   A  404 ? 0.59848058 0.41396150 0.49042934 0.01832234  -0.12670612 0.04688237  459  ASP   A HA   
6340  H  HB2  . ASP   A  404 ? 0.57836735 0.39376724 0.46534750 0.00246771  -0.11318094 0.04572102  459  ASP   A HB2  
6341  H  HB3  . ASP   A  404 ? 0.56579614 0.40105918 0.46531990 0.00716726  -0.11294313 0.04286779  459  ASP   A HB3  
6342  N  N    . VAL   A  405 ? 0.81799430 0.62073004 0.68469346 -0.00362274 -0.12153485 0.05876459  460  VAL   A N    
6343  C  CA   . VAL   A  405 ? 0.78118765 0.58739597 0.64115816 -0.01115627 -0.11964425 0.06316783  460  VAL   A CA   
6344  C  C    . VAL   A  405 ? 0.80539405 0.59830904 0.65388495 -0.00948129 -0.12707025 0.06873275  460  VAL   A C    
6345  O  O    . VAL   A  405 ? 0.79420036 0.57220030 0.63807046 -0.00435278 -0.13281377 0.06983068  460  VAL   A O    
6346  C  CB   . VAL   A  405 ? 0.81870198 0.62087423 0.67231977 -0.02104533 -0.11340974 0.06487015  460  VAL   A CB   
6347  C  CG1  . VAL   A  405 ? 1.20945895 1.01208746 1.05385625 -0.02913347 -0.11142826 0.06986760  460  VAL   A CG1  
6348  C  CG2  . VAL   A  405 ? 0.96981341 0.78635675 0.83491468 -0.02223619 -0.10669618 0.05942921  460  VAL   A CG2  
6349  H  H    . VAL   A  405 ? 0.77816534 0.56953329 0.63977337 -0.00439416 -0.12209401 0.05942336  460  VAL   A H    
6350  H  HA   . VAL   A  405 ? 0.78197646 0.60172987 0.64912683 -0.01069473 -0.11770770 0.06118469  460  VAL   A HA   
6351  H  HB   . VAL   A  405 ? 0.90771270 0.69672358 0.75535631 -0.02131992 -0.11523101 0.06618837  460  VAL   A HB   
6352  H  HG11 . VAL   A  405 ? 1.05970156 0.87314171 0.90855312 -0.02814265 -0.11090942 0.06895192  460  VAL   A HG11 
6353  H  HG12 . VAL   A  405 ? 1.07937348 0.87030053 0.91442382 -0.02956305 -0.11526264 0.07376517  460  VAL   A HG12 
6354  H  HG13 . VAL   A  405 ? 1.06308770 0.86687058 0.90634203 -0.03488765 -0.10685398 0.06999728  460  VAL   A HG13 
6355  H  HG21 . VAL   A  405 ? 0.91383237 0.72870618 0.77541327 -0.02833342 -0.10311236 0.06051236  460  VAL   A HG21 
6356  H  HG22 . VAL   A  405 ? 0.91536486 0.73018944 0.78486627 -0.01769110 -0.10761134 0.05636192  460  VAL   A HG22 
6357  H  HG23 . VAL   A  405 ? 0.90340257 0.73240602 0.77476072 -0.02148793 -0.10514467 0.05791203  460  VAL   A HG23 
6358  N  N    . TYR   A  406 ? 0.73072147 0.52867329 0.57430565 -0.01351421 -0.12711936 0.07204866  461  TYR   A N    
6359  C  CA   . TYR   A  406 ? 1.25370502 1.03780568 1.08315349 -0.01424610 -0.13324220 0.07824031  461  TYR   A CA   
6360  C  C    . TYR   A  406 ? 1.10954845 0.89754653 0.93050718 -0.02281413 -0.12975290 0.08197907  461  TYR   A C    
6361  O  O    . TYR   A  406 ? 0.96561444 0.77008951 0.79389930 -0.02403284 -0.12628441 0.07944439  461  TYR   A O    
6362  C  CB   . TYR   A  406 ? 1.66078758 1.44578528 1.49416041 -0.00440411 -0.14172511 0.07768664  461  TYR   A CB   
6363  C  CG   . TYR   A  406 ? 2.11293721 1.88514972 1.94738269 0.00397659  -0.14761366 0.07662942  461  TYR   A CG   
6364  C  CD1  . TYR   A  406 ? 1.92471838 1.67514026 1.74617720 0.00176654  -0.14977528 0.08063486  461  TYR   A CD1  
6365  C  CD2  . TYR   A  406 ? 2.29313374 2.07487011 2.14151716 0.01410150  -0.15104742 0.07152832  461  TYR   A CD2  
6366  C  CE1  . TYR   A  406 ? 1.85178494 1.58922040 1.67374134 0.00979321  -0.15535018 0.07939401  461  TYR   A CE1  
6367  C  CE2  . TYR   A  406 ? 2.47900581 2.24919152 2.32869291 0.02251003  -0.15635459 0.07006131  461  TYR   A CE2  
6368  C  CZ   . TYR   A  406 ? 2.29558182 2.04300141 2.13173723 0.02054919  -0.15865687 0.07396241  461  TYR   A CZ   
6369  O  OH   . TYR   A  406 ? 1.77863920 1.51339078 1.61557639 0.02920518  -0.16412225 0.07228310  461  TYR   A OH   
6370  H  H    . TYR   A  406 ? 0.82302254 0.63300079 0.67176270 -0.01587032 -0.12327820 0.07037510  461  TYR   A H    
6371  H  HA   . TYR   A  406 ? 1.15935230 0.92947221 0.98120981 -0.01557621 -0.13450003 0.08056718  461  TYR   A HA   
6372  H  HB2  . TYR   A  406 ? 1.63228393 1.43181324 1.47629726 -0.00198797 -0.14024775 0.07400662  461  TYR   A HB2  
6373  H  HB3  . TYR   A  406 ? 1.64633882 1.42641830 1.47098398 -0.00592753 -0.14496265 0.08162639  461  TYR   A HB3  
6374  H  HD1  . TYR   A  406 ? 1.94221425 1.68652010 1.75446773 -0.00538259 -0.14728791 0.08410908  461  TYR   A HD1  
6375  H  HD2  . TYR   A  406 ? 2.25734830 2.05375004 2.11462045 0.01528934  -0.14964847 0.06886979  461  TYR   A HD2  
6376  H  HE1  . TYR   A  406 ? 1.98382640 1.70570445 1.79652238 0.00794124  -0.15686475 0.08215971  461  TYR   A HE1  
6377  H  HE2  . TYR   A  406 ? 2.37054110 2.14827323 2.23030806 0.02949277  -0.15835159 0.06633254  461  TYR   A HE2  
6379  N  N    . LYS   A  407 ? 0.89030600 0.66239876 0.69541514 -0.02896037 -0.13042194 0.08790644  462  LYS   A N    
6380  C  CA   . LYS   A  407 ? 1.05618477 0.82825375 0.84994483 -0.03630540 -0.12854278 0.09235810  462  LYS   A CA   
6381  C  C    . LYS   A  407 ? 0.97126758 0.74283391 0.76052511 -0.03144475 -0.13591476 0.09451865  462  LYS   A C    
6382  O  O    . LYS   A  407 ? 0.83307481 0.60350966 0.62807220 -0.02255570 -0.14265543 0.09291676  462  LYS   A O    
6383  C  CB   . LYS   A  407 ? 1.35214067 1.10569668 1.12953997 -0.04395196 -0.12779509 0.09838974  462  LYS   A CB   
6384  C  CG   . LYS   A  407 ? 1.32616150 1.07791400 1.10605264 -0.04979390 -0.12133411 0.09701977  462  LYS   A CG   
6385  C  CD   . LYS   A  407 ? 1.38903034 1.12109268 1.15241003 -0.05718818 -0.12176337 0.10333223  462  LYS   A CD   
6386  C  CE   . LYS   A  407 ? 1.37715948 1.10946631 1.14228249 -0.06506225 -0.11473936 0.10239003  462  LYS   A CE   
6387  N  NZ   . LYS   A  407 ? 1.26285887 0.99159926 1.03678370 -0.06036698 -0.11583912 0.09813177  462  LYS   A NZ   
6388  H  H    . LYS   A  407 ? 0.99425954 0.75469327 0.79517210 -0.02863653 -0.13205297 0.08917824  462  LYS   A H    
6389  H  HA   . LYS   A  407 ? 1.03028715 0.81437027 0.82940376 -0.03965539 -0.12308189 0.09011369  462  LYS   A HA   
6390  H  HB2  . LYS   A  407 ? 1.28850317 1.02938390 1.05989730 -0.04050549 -0.13360378 0.10084486  462  LYS   A HB2  
6391  H  HB3  . LYS   A  407 ? 1.27479470 1.02912629 1.04464018 -0.04878637 -0.12621389 0.10118139  462  LYS   A HB3  
6392  H  HG2  . LYS   A  407 ? 1.32399154 1.08754539 1.10873508 -0.05362257 -0.11568204 0.09510365  462  LYS   A HG2  
6393  H  HG3  . LYS   A  407 ? 1.33036959 1.08219051 1.11792600 -0.04506419 -0.12248152 0.09378377  462  LYS   A HG3  
6394  H  HD2  . LYS   A  407 ? 1.39008069 1.10957241 1.14939463 -0.05313165 -0.12728170 0.10481799  462  LYS   A HD2  
6395  H  HD3  . LYS   A  407 ? 1.37890530 1.10971236 1.13363183 -0.06096936 -0.12155320 0.10683212  462  LYS   A HD3  
6396  H  HE2  . LYS   A  407 ? 1.36470187 1.08614850 1.11891150 -0.07083292 -0.11452059 0.10674867  462  LYS   A HE2  
6397  H  HE3  . LYS   A  407 ? 1.33704460 1.08282030 1.10804498 -0.06796560 -0.10947938 0.10023382  462  LYS   A HE3  
6398  H  HZ1  . LYS   A  407 ? 1.30921197 1.02538121 1.07805586 -0.05712813 -0.12083544 0.09981579  462  LYS   A HZ1  
6399  H  HZ2  . LYS   A  407 ? 1.28326440 1.02279532 1.06740725 -0.05558524 -0.11536275 0.09402022  462  LYS   A HZ2  
6400  H  HZ3  . LYS   A  407 ? 1.29424143 1.02245855 1.06830883 -0.06549598 -0.11203522 0.09784397  462  LYS   A HZ3  
6401  N  N    . LYS   A  408 ? 1.08159256 0.85396016 0.86033058 -0.03719013 -0.13480240 0.09805336  463  LYS   A N    
6402  C  CA   . LYS   A  408 ? 1.01730943 0.78408617 0.78663754 -0.03405161 -0.14258839 0.10165185  463  LYS   A CA   
6403  C  C    . LYS   A  408 ? 0.95992619 0.70393181 0.71576059 -0.03226308 -0.14960019 0.10727440  463  LYS   A C    
6404  O  O    . LYS   A  408 ? 0.86937851 0.60156476 0.61966223 -0.03657400 -0.14684089 0.10934773  463  LYS   A O    
6405  C  CB   . LYS   A  408 ? 0.88794994 0.65836084 0.64631140 -0.04162593 -0.13917764 0.10443377  463  LYS   A CB   
6406  C  CG   . LYS   A  408 ? 1.05995953 0.85132456 0.82995290 -0.04220859 -0.13427122 0.09918025  463  LYS   A CG   
6407  C  CD   . LYS   A  408 ? 1.27735734 1.07087779 1.03545952 -0.04776649 -0.13293275 0.10164978  463  LYS   A CD   
6408  C  CE   . LYS   A  408 ? 1.29686773 1.08873057 1.04616547 -0.05761455 -0.12428223 0.10376266  463  LYS   A CE   
6409  N  NZ   . LYS   A  408 ? 1.81923127 1.62824082 1.58162189 -0.06007832 -0.11586640 0.09828676  463  LYS   A NZ   
6410  H  H    . LYS   A  408 ? 1.03000867 0.80658650 0.80727237 -0.04311389 -0.12912330 0.09811787  463  LYS   A H    
6411  H  HA   . LYS   A  408 ? 0.98352230 0.75860572 0.76214242 -0.02800212 -0.14578669 0.09855857  463  LYS   A HA   
6412  H  HB2  . LYS   A  408 ? 0.96075207 0.72577655 0.71216714 -0.04793924 -0.13472985 0.10671175  463  LYS   A HB2  
6413  H  HB3  . LYS   A  408 ? 0.97292918 0.73625910 0.72221661 -0.04017578 -0.14474632 0.10768513  463  LYS   A HB3  
6414  H  HG2  . LYS   A  408 ? 1.04438639 0.84224063 0.82349831 -0.03615540 -0.13796280 0.09632204  463  LYS   A HG2  
6415  H  HG3  . LYS   A  408 ? 1.03850436 0.83594674 0.81513107 -0.04490872 -0.12820536 0.09669533  463  LYS   A HG3  
6416  H  HD2  . LYS   A  408 ? 1.24101150 1.02526855 0.98927414 -0.04637199 -0.13873060 0.10521922  463  LYS   A HD2  
6417  H  HD3  . LYS   A  408 ? 1.21832108 1.02386808 0.98409241 -0.04610828 -0.13229507 0.09818559  463  LYS   A HD3  
6418  H  HE2  . LYS   A  408 ? 1.40560770 1.18801355 1.15111816 -0.05951084 -0.12364335 0.10606998  463  LYS   A HE2  
6419  H  HE3  . LYS   A  408 ? 1.40904772 1.19755125 1.14719641 -0.06069398 -0.12488686 0.10656673  463  LYS   A HE3  
6420  H  HZ1  . LYS   A  408 ? 1.60263228 1.41487908 1.37496340 -0.05728439 -0.11533638 0.09569301  463  LYS   A HZ1  
6421  H  HZ2  . LYS   A  408 ? 1.61088002 1.42795491 1.37600207 -0.05883905 -0.11626202 0.09626563  463  LYS   A HZ2  
6422  H  HZ3  . LYS   A  408 ? 1.62011838 1.42833710 1.37781715 -0.06564493 -0.11085993 0.09948076  463  LYS   A HZ3  
6423  N  N    . PRO   A  409 ? 1.36019444 1.09659147 1.10981297 -0.02610293 -0.15917777 0.11008364  464  PRO   A N    
6424  C  CA   . PRO   A  409 ? 1.20670950 0.91954106 0.94122446 -0.02471992 -0.16634026 0.11621720  464  PRO   A CA   
6425  C  C    . PRO   A  409 ? 1.05094147 0.74981320 0.76553440 -0.03560870 -0.16281343 0.12298407  464  PRO   A C    
6426  O  O    . PRO   A  409 ? 0.92093110 0.60011429 0.62430149 -0.03758959 -0.16505782 0.12752077  464  PRO   A O    
6427  C  CB   . PRO   A  409 ? 1.17724514 0.88914967 0.91007006 -0.01638254 -0.17687474 0.11745554  464  PRO   A CB   
6428  C  CG   . PRO   A  409 ? 1.36591697 1.09899592 1.10673928 -0.01744144 -0.17400919 0.11378992  464  PRO   A CG   
6429  C  CD   . PRO   A  409 ? 1.36446691 1.11402631 1.12110913 -0.02026566 -0.16401102 0.10758940  464  PRO   A CD   
6430  H  HA   . PRO   A  409 ? 1.19443762 0.90219659 0.93402749 -0.02145440 -0.16699313 0.11466109  464  PRO   A HA   
6431  H  HB2  . PRO   A  409 ? 1.24626410 0.94460577 0.96447074 -0.01818600 -0.18095306 0.12283415  464  PRO   A HB2  
6432  H  HB3  . PRO   A  409 ? 1.22883630 0.94047791 0.97016311 -0.00884016 -0.18114725 0.11504979  464  PRO   A HB3  
6433  H  HG2  . PRO   A  409 ? 1.32533050 1.05589986 1.05483437 -0.02301285 -0.17283772 0.11705175  464  PRO   A HG2  
6434  H  HG3  . PRO   A  409 ? 1.31836700 1.05669343 1.06544948 -0.01082434 -0.17969932 0.11205425  464  PRO   A HG3  
6435  H  HD2  . PRO   A  409 ? 1.33894575 1.09848166 1.09616232 -0.02449094 -0.15976964 0.10652146  464  PRO   A HD2  
6436  H  HD3  . PRO   A  409 ? 1.34552705 1.10296512 1.11523700 -0.01419283 -0.16534242 0.10337672  464  PRO   A HD3  
6437  N  N    . SER   A  410 ? 1.07308555 0.78236884 0.78346366 -0.04280601 -0.15701617 0.12342443  465  SER   A N    
6438  C  CA   . SER   A  410 ? 1.10348523 0.80347073 0.79676092 -0.05379305 -0.15191223 0.12896669  465  SER   A CA   
6439  C  C    . SER   A  410 ? 1.23865807 0.93707007 0.93494695 -0.06072863 -0.14362271 0.12819423  465  SER   A C    
6440  O  O    . SER   A  410 ? 1.10134947 0.78789115 0.78332984 -0.06942467 -0.14054027 0.13341047  465  SER   A O    
6441  C  CB   . SER   A  410 ? 1.25105965 0.96475035 0.94120848 -0.05874420 -0.14729957 0.12831575  465  SER   A CB   
6442  O  OG   . SER   A  410 ? 1.26918530 1.00427902 0.97753239 -0.05782035 -0.14090668 0.12117461  465  SER   A OG   
6443  H  H    . SER   A  410 ? 1.06075048 0.78342551 0.77914441 -0.04078282 -0.15618819 0.12006205  465  SER   A H    
6444  H  HA   . SER   A  410 ? 1.16838503 0.85303593 0.84876072 -0.05367625 -0.15729733 0.13400789  465  SER   A HA   
6445  H  HB2  . SER   A  410 ? 1.23085439 0.93947625 0.91031748 -0.06621619 -0.14309907 0.13163280  465  SER   A HB2  
6446  H  HB3  . SER   A  410 ? 1.23049223 0.94271237 0.91587043 -0.05526561 -0.15310150 0.12965594  465  SER   A HB3  
6448  N  N    . GLY   A  411 ? 1.16185760 0.87265635 0.87662977 -0.05719768 -0.14003216 0.12168159  466  GLY   A N    
6449  C  CA   . GLY   A  411 ? 1.05033684 0.75954771 0.76932925 -0.06251531 -0.13349214 0.12036136  466  GLY   A CA   
6450  C  C    . GLY   A  411 ? 1.07162046 0.80053544 0.80092752 -0.06817629 -0.12340999 0.11598568  466  GLY   A C    
6451  O  O    . GLY   A  411 ? 0.93395269 0.66519964 0.66987580 -0.07170545 -0.11802823 0.11374005  466  GLY   A O    
6452  H  H    . GLY   A  411 ? 1.13489246 0.85576355 0.85984242 -0.05154084 -0.14167170 0.11791485  466  GLY   A H    
6453  H  HA2  . GLY   A  411 ? 1.08174372 0.78915161 0.80861908 -0.05709397 -0.13595834 0.11772909  466  GLY   A HA2  
6454  H  HA3  . GLY   A  411 ? 1.10005808 0.79610461 0.80700958 -0.06781719 -0.13345110 0.12500057  466  GLY   A HA3  
6455  N  N    . LYS   A  412 ? 1.06753087 0.80992770 0.79763216 -0.06901214 -0.12120985 0.11479243  467  LYS   A N    
6456  C  CA   . LYS   A  412 ? 1.04254460 0.80343503 0.78226930 -0.07340932 -0.11228589 0.11051310  467  LYS   A CA   
6457  C  C    . LYS   A  412 ? 0.93724358 0.71339214 0.69650435 -0.06616845 -0.11197294 0.10347224  467  LYS   A C    
6458  O  O    . LYS   A  412 ? 0.86503661 0.63995212 0.62950498 -0.05778213 -0.11873221 0.10197806  467  LYS   A O    
6459  C  CB   . LYS   A  412 ? 1.21025765 0.97752213 0.94128543 -0.07746778 -0.11003485 0.11209473  467  LYS   A CB   
6460  C  CG   . LYS   A  412 ? 1.45178699 1.20709336 1.16478109 -0.08702695 -0.10694710 0.11839793  467  LYS   A CG   
6461  C  CD   . LYS   A  412 ? 1.45011222 1.21111178 1.15293801 -0.09209925 -0.10340641 0.11990398  467  LYS   A CD   
6462  C  CE   . LYS   A  412 ? 1.48527002 1.23287678 1.16960466 -0.10137827 -0.10077878 0.12655360  467  LYS   A CE   
6463  N  NZ   . LYS   A  412 ? 1.54883599 1.30188417 1.22227037 -0.10656261 -0.09666570 0.12782860  467  LYS   A NZ   
6464  H  H    . LYS   A  412 ? 1.07579374 0.81536394 0.80000246 -0.06665652 -0.12563924 0.11666553  467  LYS   A H    
6465  H  HA   . LYS   A  412 ? 1.05577123 0.81456512 0.79448360 -0.07877535 -0.10777363 0.11120324  467  LYS   A HA   
6466  H  HB2  . LYS   A  412 ? 1.21735859 0.98320508 0.94599026 -0.07296306 -0.11551201 0.11262315  467  LYS   A HB2  
6467  H  HB3  . LYS   A  412 ? 1.19619012 0.97671342 0.93549597 -0.07847544 -0.10509787 0.10841568  467  LYS   A HB3  
6468  H  HG2  . LYS   A  412 ? 1.38858223 1.14512646 1.10471904 -0.09135106 -0.10197917 0.11784729  467  LYS   A HG2  
6469  H  HG3  . LYS   A  412 ? 1.41089058 1.15219295 1.11500227 -0.08594557 -0.11224187 0.12228330  467  LYS   A HG3  
6470  H  HD2  . LYS   A  412 ? 1.45801091 1.21847141 1.15795112 -0.08791438 -0.10841589 0.12015349  467  LYS   A HD2  
6471  H  HD3  . LYS   A  412 ? 1.43961442 1.21364927 1.15058935 -0.09358728 -0.09780230 0.11619659  467  LYS   A HD3  
6472  H  HE2  . LYS   A  412 ? 1.49219692 1.24066019 1.17990029 -0.10570674 -0.09599784 0.12625548  467  LYS   A HE2  
6473  H  HE3  . LYS   A  412 ? 1.51120090 1.24495351 1.18680632 -0.09990890 -0.10659377 0.13046005  467  LYS   A HE3  
6474  H  HZ1  . LYS   A  412 ? 1.51683140 1.28210473 1.19796991 -0.10803039 -0.09112828 0.12427232  467  LYS   A HZ1  
6475  H  HZ2  . LYS   A  412 ? 1.53353739 1.28598130 1.20374846 -0.10270509 -0.10122249 0.12794545  467  LYS   A HZ2  
6476  H  HZ3  . LYS   A  412 ? 1.54402149 1.28873420 1.20601392 -0.11217346 -0.09513649 0.13198695  467  LYS   A HZ3  
6477  N  N    . CYS   A  413 ? 0.90499914 0.69531047 0.67493349 -0.06947420 -0.10415708 0.09927016  468  CYS   A N    
6478  C  CA   . CYS   A  413 ? 0.78161633 0.58665240 0.56916982 -0.06374490 -0.10294043 0.09282466  468  CYS   A CA   
6479  C  C    . CYS   A  413 ? 0.62030995 0.43631926 0.41128907 -0.05975037 -0.10525347 0.09079455  468  CYS   A C    
6480  O  O    . CYS   A  413 ? 0.69683051 0.51280576 0.47799206 -0.06337386 -0.10479923 0.09330892  468  CYS   A O    
6481  C  CB   . CYS   A  413 ? 0.75419247 0.57112563 0.55121005 -0.06838275 -0.09442721 0.08920529  468  CYS   A CB   
6482  S  SG   . CYS   A  413 ? 1.17709351 0.98377609 0.96971625 -0.07563546 -0.09037977 0.09150007  468  CYS   A SG   
6483  H  H    . CYS   A  413 ? 0.88522291 0.67600507 0.65118021 -0.07553136 -0.09947878 0.10054385  468  CYS   A H    
6484  H  HA   . CYS   A  413 ? 0.76628494 0.56637067 0.55748069 -0.05908307 -0.10660375 0.09200352  468  CYS   A HA   
6485  H  HB2  . CYS   A  413 ? 0.81154656 0.63551235 0.60715771 -0.07160675 -0.09099788 0.08907610  468  CYS   A HB2  
6486  H  HB3  . CYS   A  413 ? 0.80684292 0.63141131 0.61461604 -0.06420323 -0.09436801 0.08530829  468  CYS   A HB3  
6487  N  N    . PHE   A  414 ? 0.65892357 0.48527080 0.46427464 -0.05291583 -0.10698038 0.08583520  469  PHE   A N    
6488  C  CA   . PHE   A  414 ? 0.73106432 0.57122701 0.54331136 -0.05013193 -0.10753497 0.08260102  469  PHE   A CA   
6489  C  C    . PHE   A  414 ? 0.83301079 0.68609428 0.64917231 -0.05552246 -0.09954444 0.07997461  469  PHE   A C    
6490  O  O    . PHE   A  414 ? 0.87752986 0.73858857 0.69362670 -0.05564732 -0.09955624 0.07870871  469  PHE   A O    
6491  C  CB   . PHE   A  414 ? 0.70018053 0.54818392 0.52770483 -0.04184671 -0.11095895 0.07791471  469  PHE   A CB   
6492  C  CG   . PHE   A  414 ? 0.92272568 0.76233608 0.74785334 -0.03481365 -0.12017846 0.07965013  469  PHE   A CG   
6493  C  CD1  . PHE   A  414 ? 0.94985360 0.79262370 0.77263010 -0.03206429 -0.12574103 0.08030277  469  PHE   A CD1  
6494  C  CD2  . PHE   A  414 ? 0.90649402 0.73441905 0.73117030 -0.03090222 -0.12364752 0.08062866  469  PHE   A CD2  
6495  C  CE1  . PHE   A  414 ? 0.98342949 0.81888890 0.80443364 -0.02518060 -0.13479424 0.08193919  469  PHE   A CE1  
6496  C  CE2  . PHE   A  414 ? 0.83158410 0.65126956 0.65402305 -0.02377776 -0.13253170 0.08223554  469  PHE   A CE2  
6497  C  CZ   . PHE   A  414 ? 0.96443784 0.78841019 0.78544831 -0.02082716 -0.13813132 0.08292796  469  PHE   A CZ   
6498  H  H    . PHE   A  414 ? 0.66311026 0.48769334 0.47404659 -0.05008412 -0.10776405 0.08435708  469  PHE   A H    
6499  H  HA   . PHE   A  414 ? 0.73773921 0.57365167 0.54203939 -0.04976136 -0.11142118 0.08509704  469  PHE   A HA   
6500  H  HB2  . PHE   A  414 ? 0.74078953 0.58900934 0.57376289 -0.04167247 -0.10836054 0.07625735  469  PHE   A HB2  
6501  H  HB3  . PHE   A  414 ? 0.73629582 0.59534389 0.57030964 -0.04135709 -0.10944240 0.07512214  469  PHE   A HB3  
6502  H  HD1  . PHE   A  414 ? 0.94046617 0.79054081 0.76311421 -0.03469292 -0.12357068 0.07944418  469  PHE   A HD1  
6503  H  HD2  . PHE   A  414 ? 0.88855898 0.71381944 0.71433133 -0.03296627 -0.12015995 0.08012906  469  PHE   A HD2  
6504  H  HE1  . PHE   A  414 ? 0.97235602 0.81049198 0.79201853 -0.02339144 -0.13883826 0.08229737  469  PHE   A HE1  
6505  H  HE2  . PHE   A  414 ? 0.88867325 0.69998592 0.71083999 -0.02080506 -0.13487822 0.08265807  469  PHE   A HE2  
6506  H  HZ   . PHE   A  414 ? 0.94671321 0.76557142 0.76666689 -0.01573235 -0.14446172 0.08397330  469  PHE   A HZ   
6507  N  N    . PHE   A  415 ? 0.52439141 0.37925908 0.34387252 -0.05981505 -0.09308045 0.07902876  470  PHE   A N    
6508  C  CA   . PHE   A  415 ? 0.50860018 0.37656569 0.33468610 -0.06342151 -0.08588877 0.07576887  470  PHE   A CA   
6509  C  C    . PHE   A  415 ? 0.43686703 0.30202627 0.25744253 -0.07087495 -0.07967120 0.07778423  470  PHE   A C    
6510  O  O    . PHE   A  415 ? 0.48164228 0.33652124 0.29788172 -0.07283176 -0.08022881 0.08037546  470  PHE   A O    
6511  C  CB   . PHE   A  415 ? 0.58938015 0.46740714 0.43123716 -0.05911218 -0.08460440 0.07066588  470  PHE   A CB   
6512  C  CG   . PHE   A  415 ? 0.76774752 0.63905138 0.61249924 -0.05842145 -0.08446482 0.07064059  470  PHE   A CG   
6513  C  CD1  . PHE   A  415 ? 0.86869639 0.72995144 0.71212375 -0.05336861 -0.09060480 0.07176519  470  PHE   A CD1  
6514  C  CD2  . PHE   A  415 ? 0.67754287 0.55195308 0.52579957 -0.06275233 -0.07854328 0.06944421  470  PHE   A CD2  
6515  C  CE1  . PHE   A  415 ? 0.70634812 0.56026500 0.55150318 -0.05278818 -0.09050954 0.07141907  470  PHE   A CE1  
6516  C  CE2  . PHE   A  415 ? 0.75696290 0.62445551 0.60690331 -0.06254470 -0.07872245 0.06928506  470  PHE   A CE2  
6517  C  CZ   . PHE   A  415 ? 0.60984272 0.46668142 0.45781404 -0.05770194 -0.08456513 0.07021823  470  PHE   A CZ   
6518  H  H    . PHE   A  415 ? 0.58730578 0.43467182 0.40468749 -0.06047845 -0.09341621 0.08048531  470  PHE   A H    
6519  H  HA   . PHE   A  415 ? 0.50756556 0.38003868 0.33167282 -0.06370906 -0.08598885 0.07538500  470  PHE   A HA   
6520  H  HB2  . PHE   A  415 ? 0.58745140 0.47380173 0.43356174 -0.06123700 -0.08020549 0.06858846  470  PHE   A HB2  
6521  H  HB3  . PHE   A  415 ? 0.59551060 0.47623974 0.44128475 -0.05468637 -0.08829290 0.06932396  470  PHE   A HB3  
6522  H  HD1  . PHE   A  415 ? 0.80309749 0.66241789 0.64445603 -0.05014709 -0.09503150 0.07260741  470  PHE   A HD1  
6523  H  HD2  . PHE   A  415 ? 0.70263004 0.58376670 0.55201817 -0.06581507 -0.07453845 0.06864142  470  PHE   A HD2  
6524  H  HE1  . PHE   A  415 ? 0.72445655 0.57119238 0.56865609 -0.04898718 -0.09471974 0.07194813  470  PHE   A HE1  
6525  H  HE2  . PHE   A  415 ? 0.69112504 0.56110370 0.54351544 -0.06562113 -0.07497139 0.06840163  470  PHE   A HE2  
6526  H  HZ   . PHE   A  415 ? 0.66725385 0.51903743 0.51619953 -0.05745223 -0.08467043 0.06977808  470  PHE   A HZ   
6527  N  N    . GLN   A  416 ? 0.41837132 0.29281133 0.23938182 -0.07504889 -0.07380164 0.07642028  471  GLN   A N    
6528  C  CA   . GLN   A  416 ? 0.39875782 0.27498132 0.21867356 -0.08155720 -0.06712932 0.07702018  471  GLN   A CA   
6529  C  C    . GLN   A  416 ? 0.36642662 0.25671226 0.19916458 -0.08134740 -0.06183676 0.07219353  471  GLN   A C    
6530  O  O    . GLN   A  416 ? 0.34299135 0.23679924 0.17743605 -0.08595616 -0.05651175 0.07196279  471  GLN   A O    
6531  C  CB   . GLN   A  416 ? 0.40555882 0.27980065 0.21291199 -0.08718410 -0.06434491 0.08007739  471  GLN   A CB   
6532  C  CG   . GLN   A  416 ? 0.57394814 0.43324226 0.36661634 -0.08783136 -0.06979049 0.08545294  471  GLN   A CG   
6533  C  CD   . GLN   A  416 ? 0.60952342 0.46624601 0.38864705 -0.09423114 -0.06634723 0.08873612  471  GLN   A CD   
6534  O  OE1  . GLN   A  416 ? 0.88884234 0.74461216 0.66480106 -0.10059439 -0.06112457 0.09047806  471  GLN   A OE1  
6535  N  NE2  . GLN   A  416 ? 0.88129306 0.73704398 0.65198720 -0.09297211 -0.06911959 0.08957916  471  GLN   A NE2  
6536  H  H    . GLN   A  416 ? 0.41290504 0.29283291 0.23490372 -0.07373592 -0.07410068 0.07499058  471  GLN   A H    
6537  H  HA   . GLN   A  416 ? 0.40473640 0.27410251 0.22334610 -0.08268590 -0.06780226 0.07862844  471  GLN   A HA   
6538  H  HB2  . GLN   A  416 ? 0.42737159 0.30840182 0.23602213 -0.08612769 -0.06343671 0.07811686  471  GLN   A HB2  
6539  H  HB3  . GLN   A  416 ? 0.43244642 0.30844137 0.23970100 -0.09157959 -0.05981124 0.08044310  471  GLN   A HB3  
6540  H  HG2  . GLN   A  416 ? 0.54080540 0.39254516 0.33248392 -0.08835012 -0.07122846 0.08723702  471  GLN   A HG2  
6541  H  HG3  . GLN   A  416 ? 0.53722727 0.39565858 0.33009356 -0.08337892 -0.07443086 0.08499549  471  GLN   A HG3  
6542  H  HE21 . GLN   A  416 ? 0.77307868 0.63111931 0.54741049 -0.08857076 -0.07260995 0.08786371  471  GLN   A HE21 
6543  H  HE22 . GLN   A  416 ? 0.78999341 0.64293820 0.55130470 -0.09667429 -0.06747437 0.09180405  471  GLN   A HE22 
6544  N  N    . GLY   A  417 ? 0.32003808 0.21835434 0.16153088 -0.07622924 -0.06344301 0.06849813  472  GLY   A N    
6545  C  CA   . GLY   A  417 ? 0.36348295 0.27381936 0.21659669 -0.07561842 -0.05911707 0.06417070  472  GLY   A CA   
6546  C  C    . GLY   A  417 ? 0.34253496 0.25643408 0.20636232 -0.06986935 -0.06203527 0.06106326  472  GLY   A C    
6547  O  O    . GLY   A  417 ? 0.36783713 0.27861217 0.23134476 -0.06558200 -0.06734589 0.06129839  472  GLY   A O    
6548  H  H    . GLY   A  417 ? 0.34379905 0.24003729 0.18398036 -0.07313082 -0.06744101 0.06873786  472  GLY   A H    
6549  H  HA2  . GLY   A  417 ? 0.34247443 0.25347245 0.19677013 -0.07860687 -0.05580842 0.06433711  472  GLY   A HA2  
6550  H  HA3  . GLY   A  417 ? 0.34124446 0.25690484 0.19388106 -0.07616062 -0.05741944 0.06303219  472  GLY   A HA3  
6551  N  N    . ASP   A  418 ? 0.32496190 0.24569261 0.19816411 -0.06986069 -0.05853124 0.05816849  473  ASP   A N    
6552  C  CA   . ASP   A  418 ? 0.28396884 0.20951851 0.16731690 -0.06508427 -0.06006394 0.05490679  473  ASP   A CA   
6553  C  C    . ASP   A  418 ? 0.29255956 0.22737214 0.18423371 -0.06622604 -0.05521375 0.05185876  473  ASP   A C    
6554  O  O    . ASP   A  418 ? 0.28610367 0.22361475 0.17624609 -0.07021576 -0.05111876 0.05221091  473  ASP   A O    
6555  C  CB   . ASP   A  418 ? 0.30895233 0.22618763 0.19258140 -0.06231957 -0.06368312 0.05565189  473  ASP   A CB   
6556  C  CG   . ASP   A  418 ? 0.31849265 0.23909050 0.21002167 -0.05614419 -0.06709103 0.05290680  473  ASP   A CG   
6557  O  OD1  . ASP   A  418 ? 0.30050313 0.23026276 0.19765231 -0.05447921 -0.06671329 0.05056414  473  ASP   A OD1  
6558  O  OD2  . ASP   A  418 ? 0.34511673 0.25932890 0.23732090 -0.05308801 -0.07000412 0.05293316  473  ASP   A OD2  
6559  H  H    . ASP   A  418 ? 0.31670177 0.23930860 0.18982066 -0.07301045 -0.05505637 0.05825290  473  ASP   A H    
6560  H  HA   . ASP   A  418 ? 0.29627755 0.22447935 0.18071678 -0.06272396 -0.06211869 0.05408201  473  ASP   A HA   
6561  H  HB2  . ASP   A  418 ? 0.31807345 0.22764291 0.19453090 -0.06300396 -0.06603480 0.05838243  473  ASP   A HB2  
6562  H  HB3  . ASP   A  418 ? 0.30558908 0.22235519 0.19104144 -0.06398158 -0.06149519 0.05522308  473  ASP   A HB3  
6563  N  N    . HIS   A  419 ? 0.29880017 0.23900133 0.19926691 -0.06248436 -0.05584224 0.04881974  474  HIS   A N    
6564  C  CA   . HIS   A  419 ? 0.26346520 0.21203303 0.17143467 -0.06291387 -0.05205544 0.04600696  474  HIS   A CA   
6565  C  C    . HIS   A  419 ? 0.25139660 0.20193076 0.16676155 -0.05900015 -0.05342597 0.04357550  474  HIS   A C    
6566  O  O    . HIS   A  419 ? 0.27497047 0.22181568 0.19050249 -0.05554473 -0.05720929 0.04367319  474  HIS   A O    
6567  C  CB   . HIS   A  419 ? 0.26439351 0.21999931 0.17364337 -0.06324188 -0.05052965 0.04464483  474  HIS   A CB   
6568  C  CG   . HIS   A  419 ? 0.29409623 0.25109783 0.20478389 -0.05994452 -0.05428540 0.04381081  474  HIS   A CG   
6569  N  ND1  . HIS   A  419 ? 0.28707445 0.24982579 0.20601332 -0.05708668 -0.05483206 0.04114989  474  HIS   A ND1  
6570  C  CD2  . HIS   A  419 ? 0.27566594 0.22915176 0.18055630 -0.05930736 -0.05780453 0.04537584  474  HIS   A CD2  
6571  C  CE1  . HIS   A  419 ? 0.26921535 0.23246264 0.18815923 -0.05478877 -0.05869501 0.04103162  474  HIS   A CE1  
6572  N  NE2  . HIS   A  419 ? 0.25003472 0.20760173 0.16050395 -0.05587119 -0.06085816 0.04353652  474  HIS   A NE2  
6573  H  H    . HIS   A  419 ? 0.29107141 0.22963238 0.19270760 -0.05951384 -0.05883122 0.04855783  474  HIS   A H    
6574  H  HA   . HIS   A  419 ? 0.26747328 0.21547617 0.17455547 -0.06554408 -0.04971104 0.04653502  474  HIS   A HA   
6575  H  HB2  . HIS   A  419 ? 0.26224950 0.22271737 0.17623891 -0.06338213 -0.04824089 0.04292627  474  HIS   A HB2  
6576  H  HB3  . HIS   A  419 ? 0.27269614 0.22709340 0.17698632 -0.06561682 -0.04935510 0.04593727  474  HIS   A HB3  
6578  H  HD2  . HIS   A  419 ? 0.28246975 0.23150879 0.18060958 -0.06102478 -0.05816790 0.04742944  474  HIS   A HD2  
6579  H  HE1  . HIS   A  419 ? 0.26609346 0.23357102 0.19031218 -0.05288458 -0.05969100 0.03936958  474  HIS   A HE1  
6581  N  N    . GLY   A  420 ? 0.26520991 0.22156376 0.18646607 -0.05943017 -0.05031389 0.04135443  475  GLY   A N    
6582  C  CA   . GLY   A  420 ? 0.25831422 0.21651435 0.18564761 -0.05644195 -0.05065913 0.03897220  475  GLY   A CA   
6583  C  C    . GLY   A  420 ? 0.25896272 0.21702328 0.18770003 -0.05831450 -0.04804796 0.03816257  475  GLY   A C    
6584  O  O    . GLY   A  420 ? 0.26215181 0.22311729 0.19565482 -0.05642818 -0.04735580 0.03582521  475  GLY   A O    
6585  H  H    . GLY   A  420 ? 0.25506455 0.21439278 0.17637369 -0.06153245 -0.04791521 0.04126491  475  GLY   A H    
6586  H  HA2  . GLY   A  420 ? 0.25429332 0.21802510 0.18572640 -0.05522508 -0.05019162 0.03743023  475  GLY   A HA2  
6587  H  HA3  . GLY   A  420 ? 0.26453802 0.21865876 0.19103383 -0.05423357 -0.05324848 0.03925261  475  GLY   A HA3  
6588  N  N    . PHE   A  421 ? 0.22129959 0.17657873 0.14581455 -0.06223680 -0.04657250 0.04003492  476  PHE   A N    
6589  C  CA   . PHE   A  421 ? 0.24500284 0.20014131 0.17044501 -0.06471628 -0.04459754 0.03955770  476  PHE   A CA   
6590  C  C    . PHE   A  421 ? 0.26927873 0.23262125 0.20006923 -0.06498276 -0.04182046 0.03752749  476  PHE   A C    
6591  O  O    . PHE   A  421 ? 0.21851787 0.18743122 0.15156253 -0.06420730 -0.04078497 0.03688633  476  PHE   A O    
6592  C  CB   . PHE   A  421 ? 0.23998097 0.19210167 0.16042744 -0.06945203 -0.04339871 0.04212815  476  PHE   A CB   
6593  C  CG   . PHE   A  421 ? 0.24660516 0.18974988 0.15994543 -0.07037227 -0.04581525 0.04495280  476  PHE   A CG   
6594  C  CD1  . PHE   A  421 ? 0.27018133 0.20427249 0.18068410 -0.07003631 -0.04829058 0.04556596  476  PHE   A CD1  
6595  C  CD2  . PHE   A  421 ? 0.27862084 0.22144967 0.18726104 -0.07155906 -0.04579332 0.04700242  476  PHE   A CD2  
6596  C  CE1  . PHE   A  421 ? 0.28763223 0.21213320 0.19082150 -0.07078483 -0.05092087 0.04850010  476  PHE   A CE1  
6597  C  CE2  . PHE   A  421 ? 0.31402254 0.24767447 0.21492228 -0.07251368 -0.04832502 0.05000283  476  PHE   A CE2  
6598  C  CZ   . PHE   A  421 ? 0.29219222 0.21648984 0.19041573 -0.07214941 -0.05095923 0.05091624  476  PHE   A CZ   
6599  H  H    . PHE   A  421 ? 0.23936114 0.19305040 0.16024546 -0.06357162 -0.04683419 0.04165434  476  PHE   A H    
6600  H  HA   . PHE   A  421 ? 0.24629286 0.19757199 0.17178451 -0.06345007 -0.04589942 0.03892775  476  PHE   A HA   
6601  H  HB2  . PHE   A  421 ? 0.23826730 0.19501904 0.15924832 -0.07054088 -0.04164147 0.04225808  476  PHE   A HB2  
6602  H  HB3  . PHE   A  421 ? 0.24125692 0.19311446 0.16265100 -0.07112860 -0.04256712 0.04173398  476  PHE   A HB3  
6603  H  HD1  . PHE   A  421 ? 0.26645988 0.20046610 0.17966385 -0.06919814 -0.04829638 0.04392569  476  PHE   A HD1  
6604  H  HD2  . PHE   A  421 ? 0.27132252 0.21972108 0.18152148 -0.07167488 -0.04417013 0.04635718  476  PHE   A HD2  
6605  H  HE1  . PHE   A  421 ? 0.29279554 0.21037482 0.19387420 -0.07042581 -0.05275539 0.04886002  476  PHE   A HE1  
6606  H  HE2  . PHE   A  421 ? 0.30303556 0.23635173 0.20002329 -0.07344069 -0.04831100 0.05142678  476  PHE   A HE2  
6607  H  HZ   . PHE   A  421 ? 0.30694658 0.22418657 0.19942462 -0.07279165 -0.05289909 0.05317528  476  PHE   A HZ   
6608  N  N    . ASP   A  422 ? 0.23934713 0.20248339 0.17144977 -0.06628755 -0.04095800 0.03663037  477  ASP   A N    
6609  C  CA   . ASP   A  422 ? 0.26039001 0.23002356 0.19640964 -0.06698697 -0.03878521 0.03519880  477  ASP   A CA   
6610  C  C    . ASP   A  422 ? 0.25783208 0.23312265 0.19486144 -0.06788231 -0.03693760 0.03575658  477  ASP   A C    
6611  O  O    . ASP   A  422 ? 0.28192857 0.25665885 0.21623579 -0.07011428 -0.03626250 0.03739735  477  ASP   A O    
6612  C  CB   . ASP   A  422 ? 0.28778365 0.25576532 0.22316360 -0.07005034 -0.03844304 0.03532301  477  ASP   A CB   
6613  C  CG   . ASP   A  422 ? 0.30544886 0.27934992 0.24443214 -0.07067601 -0.03703009 0.03394617  477  ASP   A CG   
6614  O  OD1  . ASP   A  422 ? 0.23655757 0.21601000 0.17810014 -0.06951339 -0.03575836 0.03351212  477  ASP   A OD1  
6615  O  OD2  . ASP   A  422 ? 0.34335399 0.31561121 0.28216082 -0.07225240 -0.03757408 0.03326365  477  ASP   A OD2  
6616  H  H    . ASP   A  422 ? 0.25697127 0.21524295 0.18711074 -0.06675327 -0.04203408 0.03694688  477  ASP   A H    
6617  H  HA   . ASP   A  422 ? 0.25655386 0.22768494 0.19477275 -0.06488802 -0.03890567 0.03369953  477  ASP   A HA   
6618  H  HB2  . ASP   A  422 ? 0.29208541 0.25546250 0.22614923 -0.06943905 -0.03977006 0.03484377  477  ASP   A HB2  
6619  H  HB3  . ASP   A  422 ? 0.28968972 0.25676122 0.22320549 -0.07245144 -0.03806214 0.03683214  477  ASP   A HB3  
6620  N  N    . ASN   A  423 ? 0.23022076 0.21052852 0.17071219 -0.06620044 -0.03600410 0.03429800  478  ASN   A N    
6621  C  CA   . ASN   A  423 ? 0.29933906 0.28385031 0.24055807 -0.06630135 -0.03462055 0.03436251  478  ASN   A CA   
6622  C  C    . ASN   A  423 ? 0.29908434 0.28731018 0.24140692 -0.06826486 -0.03268141 0.03455488  478  ASN   A C    
6623  O  O    . ASN   A  423 ? 0.30251119 0.29388294 0.24532039 -0.06798621 -0.03140844 0.03428658  478  ASN   A O    
6624  C  CB   . ASN   A  423 ? 0.22733283 0.21485600 0.17144224 -0.06412949 -0.03451448 0.03288490  478  ASN   A CB   
6625  C  CG   . ASN   A  423 ? 0.31725582 0.30685207 0.26388001 -0.06389400 -0.03376606 0.03180481  478  ASN   A CG   
6626  O  OD1  . ASN   A  423 ? 0.26927990 0.25723404 0.21562578 -0.06446869 -0.03412741 0.03162888  478  ASN   A OD1  
6627  N  ND2  . ASN   A  423 ? 0.22099018 0.21346217 0.16937514 -0.06319924 -0.03294513 0.03109613  478  ASN   A ND2  
6628  H  H    . ASN   A  423 ? 0.24836987 0.22910327 0.19046026 -0.06503447 -0.03620418 0.03319830  478  ASN   A H    
6629  H  HA   . ASN   A  423 ? 0.27227515 0.25515383 0.21114653 -0.06645396 -0.03511463 0.03520204  478  ASN   A HA   
6630  H  HB2  . ASN   A  423 ? 0.25884348 0.24815071 0.20290926 -0.06422209 -0.03384878 0.03287724  478  ASN   A HB2  
6631  H  HB3  . ASN   A  423 ? 0.26076573 0.24695309 0.20485941 -0.06288315 -0.03567625 0.03264209  478  ASN   A HB3  
6632  H  HD21 . ASN   A  423 ? 0.24475381 0.23782977 0.19322179 -0.06280278 -0.03292541 0.03101794  478  ASN   A HD21 
6633  H  HD22 . ASN   A  423 ? 0.24425356 0.23770902 0.19343928 -0.06323827 -0.03253635 0.03074358  478  ASN   A HD22 
6634  N  N    . LYS   A  424 ? 0.31104916 0.29890925 0.25380132 -0.07022469 -0.03260828 0.03486114  479  LYS   A N    
6635  C  CA   . LYS   A  424 ? 0.37599871 0.36834976 0.32056880 -0.07230539 -0.03096444 0.03508618  479  LYS   A CA   
6636  C  C    . LYS   A  424 ? 0.32172784 0.31319174 0.26334950 -0.07508799 -0.02987658 0.03668140  479  LYS   A C    
6637  O  O    . LYS   A  424 ? 0.31004670 0.30658939 0.25339055 -0.07650344 -0.02783081 0.03666580  479  LYS   A O    
6638  C  CB   . LYS   A  424 ? 0.43095154 0.42439085 0.37783080 -0.07369664 -0.03159696 0.03456969  479  LYS   A CB   
6639  C  CG   . LYS   A  424 ? 0.56592697 0.55479783 0.51038080 -0.07669606 -0.03251466 0.03553997  479  LYS   A CG   
6640  C  CD   . LYS   A  424 ? 0.91307390 0.90162843 0.85898501 -0.07761514 -0.03383701 0.03449216  479  LYS   A CD   
6641  C  CE   . LYS   A  424 ? 0.62673950 0.61434197 0.57227063 -0.08205911 -0.03408803 0.03532483  479  LYS   A CE   
6642  N  NZ   . LYS   A  424 ? 0.57957381 0.55867386 0.51999170 -0.08372907 -0.03501854 0.03671266  479  LYS   A NZ   
6643  H  H    . LYS   A  424 ? 0.32190463 0.30692866 0.26407304 -0.07023150 -0.03365462 0.03475394  479  LYS   A H    
6644  H  HA   . LYS   A  424 ? 0.35522562 0.35085797 0.30148724 -0.07108716 -0.03012471 0.03443395  479  LYS   A HA   
6645  H  HB2  . LYS   A  424 ? 0.44234562 0.44024232 0.39171076 -0.07421672 -0.03068995 0.03433740  479  LYS   A HB2  
6646  H  HB3  . LYS   A  424 ? 0.44516081 0.43788531 0.39260072 -0.07210150 -0.03241365 0.03370475  479  LYS   A HB3  
6647  H  HG2  . LYS   A  424 ? 0.59363413 0.57778895 0.53533447 -0.07596889 -0.03341056 0.03595272  479  LYS   A HG2  
6648  H  HG3  . LYS   A  424 ? 0.59299517 0.58346450 0.53730136 -0.07891494 -0.03144526 0.03643832  479  LYS   A HG3  
6649  H  HD2  . LYS   A  424 ? 0.73607284 0.72893298 0.68468338 -0.07669827 -0.03355635 0.03371554  479  LYS   A HD2  
6650  H  HD3  . LYS   A  424 ? 0.73516780 0.71973598 0.67945641 -0.07622807 -0.03495733 0.03389803  479  LYS   A HD3  
6651  H  HE2  . LYS   A  424 ? 0.66696101 0.65920293 0.61444867 -0.08351703 -0.03269378 0.03585425  479  LYS   A HE2  
6652  H  HE3  . LYS   A  424 ? 0.66849095 0.65644294 0.61513597 -0.08259614 -0.03511514 0.03440155  479  LYS   A HE3  
6653  H  HZ1  . LYS   A  424 ? 0.59630758 0.57516098 0.53531224 -0.08364265 -0.03418502 0.03776370  479  LYS   A HZ1  
6654  H  HZ2  . LYS   A  424 ? 0.59678894 0.57179803 0.53568763 -0.08186518 -0.03626681 0.03604031  479  LYS   A HZ2  
6655  H  HZ3  . LYS   A  424 ? 0.59921116 0.57725000 0.53925186 -0.08671176 -0.03526761 0.03717114  479  LYS   A HZ3  
6656  N  N    . VAL   A  425 ? 0.28704476 0.27206811 0.22414616 -0.07583102 -0.03123809 0.03805605  480  VAL   A N    
6657  C  CA   . VAL   A  425 ? 0.32912314 0.31184587 0.26178625 -0.07892973 -0.03034180 0.04008076  480  VAL   A CA   
6658  C  C    . VAL   A  425 ? 0.30786955 0.29447997 0.23925181 -0.07861651 -0.02820287 0.04002957  480  VAL   A C    
6659  O  O    . VAL   A  425 ? 0.22981480 0.21649531 0.16078597 -0.07577608 -0.02882300 0.03914889  480  VAL   A O    
6660  C  CB   . VAL   A  425 ? 0.33115071 0.30475554 0.25834841 -0.07893889 -0.03296733 0.04172235  480  VAL   A CB   
6661  C  CG1  . VAL   A  425 ? 0.36684507 0.33687389 0.28771639 -0.08205856 -0.03227282 0.04428840  480  VAL   A CG1  
6662  C  CG2  . VAL   A  425 ? 0.35875654 0.32772630 0.28639141 -0.07980891 -0.03469721 0.04157253  480  VAL   A CG2  
6663  H  H    . VAL   A  425 ? 0.30525231 0.28711435 0.24182519 -0.07433692 -0.03277488 0.03776533  480  VAL   A H    
6664  H  HA   . VAL   A  425 ? 0.31723434 0.30156916 0.25103763 -0.08142525 -0.02946303 0.04039320  480  VAL   A HA   
6665  H  HB   . VAL   A  425 ? 0.33978561 0.31249946 0.26697099 -0.07614417 -0.03418168 0.04111195  480  VAL   A HB   
6666  H  HG11 . VAL   A  425 ? 0.36039409 0.33270580 0.28179106 -0.08506458 -0.03051727 0.04478012  480  VAL   A HG11 
6667  H  HG12 . VAL   A  425 ? 0.35705990 0.32887372 0.27668536 -0.08105104 -0.03163286 0.04420640  480  VAL   A HG12 
6668  H  HG13 . VAL   A  425 ? 0.36385614 0.32741252 0.28117853 -0.08211768 -0.03426985 0.04549617  480  VAL   A HG13 
6669  H  HG21 . VAL   A  425 ? 0.35627273 0.31904018 0.28038087 -0.07947565 -0.03644780 0.04254448  480  VAL   A HG21 
6670  H  HG22 . VAL   A  425 ? 0.34624177 0.31707969 0.27704528 -0.07772878 -0.03514294 0.03994890  480  VAL   A HG22 
6671  H  HG23 . VAL   A  425 ? 0.35241809 0.32261139 0.28050387 -0.08281394 -0.03367358 0.04204991  480  VAL   A HG23 
6672  N  N    . ASN   A  426 ? 0.25478840 0.24509937 0.18577793 -0.08174317 -0.02550512 0.04069234  481  ASN   A N    
6673  C  CA   . ASN   A  426 ? 0.36096630 0.35573226 0.29089308 -0.08149950 -0.02283298 0.04008196  481  ASN   A CA   
6674  C  C    . ASN   A  426 ? 0.31297275 0.30243659 0.23625422 -0.08034945 -0.02404300 0.04089261  481  ASN   A C    
6675  O  O    . ASN   A  426 ? 0.28184515 0.27332842 0.20507373 -0.07792627 -0.02361577 0.03934463  481  ASN   A O    
6676  C  CB   . ASN   A  426 ? 0.44015828 0.43937305 0.36970422 -0.08581809 -0.01938221 0.04098161  481  ASN   A CB   
6677  C  CG   . ASN   A  426 ? 0.86945868 0.87380028 0.79784173 -0.08506906 -0.01612140 0.03972621  481  ASN   A CG   
6678  O  OD1  . ASN   A  426 ? 0.74106133 0.74410331 0.66323268 -0.08767436 -0.01413145 0.04104560  481  ASN   A OD1  
6679  N  ND2  . ASN   A  426 ? 0.73871130 0.74819726 0.67219663 -0.08134843 -0.01556318 0.03706784  481  ASN   A ND2  
6680  H  H    . ASN   A  426 ? 0.29094625 0.28112060 0.22236143 -0.08422405 -0.02521879 0.04141352  481  ASN   A H    
6681  H  HA   . ASN   A  426 ? 0.33225328 0.33103222 0.26606479 -0.07932230 -0.02236417 0.03838157  481  ASN   A HA   
6682  H  HB2  . ASN   A  426 ? 0.48882458 0.49205679 0.42318776 -0.08655856 -0.01891012 0.04035620  481  ASN   A HB2  
6683  H  HB3  . ASN   A  426 ? 0.49795935 0.49263418 0.42310524 -0.08838452 -0.01979282 0.04290675  481  ASN   A HB3  
6684  H  HD21 . ASN   A  426 ? 0.76699936 0.77821571 0.70490754 -0.08013792 -0.01650599 0.03632810  481  ASN   A HD21 
6685  H  HD22 . ASN   A  426 ? 0.77472609 0.78541374 0.70675337 -0.08013390 -0.01435150 0.03607865  481  ASN   A HD22 
6686  N  N    . SER   A  427 ? 0.25195396 0.23409319 0.16950469 -0.08207265 -0.02598767 0.04330528  482  SER   A N    
6687  C  CA   . SER   A  427 ? 0.31423855 0.29110694 0.22464661 -0.08142029 -0.02759109 0.04454477  482  SER   A CA   
6688  C  C    . SER   A  427 ? 0.28949821 0.26544690 0.20169964 -0.07709377 -0.03051499 0.04300874  482  SER   A C    
6689  O  O    . SER   A  427 ? 0.31770828 0.29154760 0.22538306 -0.07603575 -0.03184366 0.04318653  482  SER   A O    
6690  C  CB   . SER   A  427 ? 0.30605912 0.27442795 0.20993793 -0.08401570 -0.02955515 0.04773591  482  SER   A CB   
6691  O  OG   . SER   A  427 ? 0.37259346 0.33678457 0.27936035 -0.08276370 -0.03239384 0.04778984  482  SER   A OG   
6692  H  H    . SER   A  427 ? 0.28093910 0.26101199 0.19882001 -0.08368751 -0.02654131 0.04421278  482  SER   A H    
6693  H  HA   . SER   A  427 ? 0.29704115 0.27647901 0.20521295 -0.08234606 -0.02542313 0.04432411  482  SER   A HA   
6694  H  HB2  . SER   A  427 ? 0.32934403 0.29399589 0.22822052 -0.08331169 -0.03107658 0.04867572  482  SER   A HB2  
6695  H  HB3  . SER   A  427 ? 0.32816258 0.29729527 0.23032114 -0.08737081 -0.02738173 0.04883934  482  SER   A HB3  
6697  N  N    . MET   A  428 ? 0.23845053 0.21619600 0.15708601 -0.07489558 -0.03154777 0.04147604  483  MET   A N    
6698  C  CA   . MET   A  428 ? 0.29595017 0.27361849 0.21695662 -0.07140673 -0.03392357 0.04005153  483  MET   A CA   
6699  C  C    . MET   A  428 ? 0.27712029 0.26017871 0.20121437 -0.06997247 -0.03235663 0.03778988  483  MET   A C    
6700  O  O    . MET   A  428 ? 0.25909901 0.24244066 0.18486580 -0.06780179 -0.03407034 0.03662227  483  MET   A O    
6701  C  CB   . MET   A  428 ? 0.30565226 0.28235000 0.23116192 -0.06992908 -0.03545266 0.03944352  483  MET   A CB   
6702  C  CG   . MET   A  428 ? 0.28502867 0.25491154 0.20726025 -0.07064326 -0.03758873 0.04125921  483  MET   A CG   
6703  S  SD   . MET   A  428 ? 0.27843958 0.24249469 0.19593826 -0.06841278 -0.04150550 0.04251433  483  MET   A SD   
6704  C  CE   . MET   A  428 ? 0.25390303 0.21344444 0.16247289 -0.07232209 -0.04065990 0.04559416  483  MET   A CE   
6705  H  H    . MET   A  428 ? 0.25955427 0.23870814 0.18100429 -0.07578151 -0.03075209 0.04132079  483  MET   A H    
6706  H  HA   . MET   A  428 ? 0.28560379 0.25994650 0.20289165 -0.07097171 -0.03573491 0.04093120  483  MET   A HA   
6707  H  HB2  . MET   A  428 ? 0.29245579 0.27212790 0.22104588 -0.07052519 -0.03391754 0.03872075  483  MET   A HB2  
6708  H  HB3  . MET   A  428 ? 0.29292363 0.27052337 0.22050221 -0.06781195 -0.03660040 0.03837947  483  MET   A HB3  
6709  H  HG2  . MET   A  428 ? 0.29092109 0.25955322 0.21058898 -0.07326002 -0.03645484 0.04253861  483  MET   A HG2  
6710  H  HG3  . MET   A  428 ? 0.28611323 0.25576007 0.21127076 -0.06977315 -0.03809918 0.04045488  483  MET   A HG3  
6711  H  HE1  . MET   A  428 ? 0.26082498 0.22415777 0.16907527 -0.07324293 -0.03862806 0.04507924  483  MET   A HE1  
6712  H  HE2  . MET   A  428 ? 0.26459992 0.22213399 0.17235234 -0.07444388 -0.03981564 0.04654524  483  MET   A HE2  
6713  H  HE3  . MET   A  428 ? 0.26758879 0.22282594 0.17223495 -0.07148986 -0.04308211 0.04680378  483  MET   A HE3  
6714  N  N    . GLN   A  429 ? 0.25449657 0.24173519 0.17948052 -0.07117728 -0.02920980 0.03709266  484  GLN   A N    
6715  C  CA   . GLN   A  429 ? 0.28007376 0.27120429 0.20774300 -0.06942648 -0.02794209 0.03483261  484  GLN   A CA   
6716  C  C    . GLN   A  429 ? 0.25088957 0.24032663 0.17348598 -0.06898742 -0.02842666 0.03424148  484  GLN   A C    
6717  O  O    . GLN   A  429 ? 0.22269578 0.20966986 0.13923906 -0.07059108 -0.02833364 0.03556884  484  GLN   A O    
6718  C  CB   . GLN   A  429 ? 0.23096584 0.22733614 0.16152221 -0.07004737 -0.02466944 0.03389673  484  GLN   A CB   
6719  C  CG   . GLN   A  429 ? 0.27914312 0.27791429 0.21466719 -0.07087085 -0.02441115 0.03434836  484  GLN   A CG   
6720  C  CD   . GLN   A  429 ? 0.22362857 0.22082540 0.16237289 -0.06917558 -0.02673439 0.03400909  484  GLN   A CD   
6721  O  OE1  . GLN   A  429 ? 0.25466022 0.25316471 0.19601326 -0.06708626 -0.02699362 0.03262189  484  GLN   A OE1  
6722  N  NE2  . GLN   A  429 ? 0.26242852 0.25626445 0.20042165 -0.07019460 -0.02833865 0.03526459  484  GLN   A NE2  
6723  H  H    . GLN   A  429 ? 0.26756421 0.25520542 0.19162409 -0.07305276 -0.02788426 0.03795805  484  GLN   A H    
6724  H  HA   . GLN   A  429 ? 0.25498924 0.24638522 0.18586922 -0.06801477 -0.02905453 0.03412666  484  GLN   A HA   
6725  H  HB2  . GLN   A  429 ? 0.25549358 0.25224656 0.18293841 -0.07150947 -0.02316577 0.03437268  484  GLN   A HB2  
6726  H  HB3  . GLN   A  429 ? 0.24980167 0.24777503 0.18194206 -0.06844299 -0.02422846 0.03236610  484  GLN   A HB3  
6727  H  HG2  . GLN   A  429 ? 0.25687405 0.25430682 0.19061254 -0.07292899 -0.02432091 0.03572866  484  GLN   A HG2  
6728  H  HG3  . GLN   A  429 ? 0.25226682 0.25507504 0.19050910 -0.07061540 -0.02275424 0.03341994  484  GLN   A HG3  
6729  H  HE21 . GLN   A  429 ? 0.25375164 0.24551964 0.18903993 -0.07167360 -0.02841037 0.03640278  484  GLN   A HE21 
6730  H  HE22 . GLN   A  429 ? 0.24783966 0.24118891 0.18774706 -0.06937236 -0.02932446 0.03492043  484  GLN   A HE22 
6731  N  N    . THR   A  430 ? 0.30399948 0.29430324 0.22853956 -0.06711864 -0.02906290 0.03229212  485  THR   A N    
6732  C  CA   . THR   A  430 ? 0.24646077 0.23492713 0.16651578 -0.06675708 -0.03010510 0.03126837  485  THR   A CA   
6733  C  C    . THR   A  430 ? 0.29189509 0.28243923 0.21299620 -0.06568967 -0.02795920 0.02872557  485  THR   A C    
6734  O  O    . THR   A  430 ? 0.26392624 0.25759891 0.18810923 -0.06532173 -0.02539489 0.02816032  485  THR   A O    
6735  C  CB   . THR   A  430 ? 0.22455233 0.21112654 0.14578164 -0.06584795 -0.03378164 0.03143432  485  THR   A CB   
6736  O  OG1  . THR   A  430 ? 0.23784742 0.22274698 0.15454011 -0.06587936 -0.03533163 0.03044878  485  THR   A OG1  
6737  C  CG2  . THR   A  430 ? 0.22884171 0.21751782 0.15665878 -0.06463435 -0.03404679 0.03024911  485  THR   A CG2  
6738  H  H    . THR   A  430 ? 0.26963186 0.26146680 0.19814897 -0.06623201 -0.02892346 0.03157778  485  THR   A H    
6739  H  HA   . THR   A  430 ? 0.26511905 0.25220588 0.18047859 -0.06790350 -0.02976756 0.03215838  485  THR   A HA   
6740  H  HB   . THR   A  430 ? 0.23323026 0.21828839 0.15375035 -0.06613030 -0.03502678 0.03296584  485  THR   A HB   
6742  H  HG21 . THR   A  430 ? 0.22576481 0.21405017 0.15470551 -0.06422663 -0.03611412 0.03027662  485  THR   A HG21 
6743  H  HG22 . THR   A  430 ? 0.22571027 0.21500534 0.15383348 -0.06435361 -0.03311039 0.02888092  485  THR   A HG22 
6744  H  HG23 . THR   A  430 ? 0.22368562 0.21337493 0.15409556 -0.06461360 -0.03313187 0.03080849  485  THR   A HG23 
6745  N  N    . VAL   A  431 ? 0.25890815 0.24748272 0.17714468 -0.06515448 -0.02922555 0.02708163  486  VAL   A N    
6746  C  CA   . VAL   A  431 ? 0.24682391 0.23560934 0.16362759 -0.06417535 -0.02726927 0.02445730  486  VAL   A CA   
6747  C  C    . VAL   A  431 ? 0.25044751 0.23772737 0.17019637 -0.06302869 -0.02872680 0.02267468  486  VAL   A C    
6748  O  O    . VAL   A  431 ? 0.30615559 0.29244238 0.22775845 -0.06352493 -0.03144306 0.02323544  486  VAL   A O    
6749  C  CB   . VAL   A  431 ? 0.27889329 0.26572528 0.18768382 -0.06500914 -0.02678808 0.02361246  486  VAL   A CB   
6750  C  CG1  . VAL   A  431 ? 0.33516079 0.32376325 0.24101844 -0.06656291 -0.02427117 0.02541307  486  VAL   A CG1  
6751  C  CG2  . VAL   A  431 ? 0.30303860 0.28639370 0.20789583 -0.06581234 -0.03082920 0.02403696  486  VAL   A CG2  
6752  H  H    . VAL   A  431 ? 0.26410139 0.25108084 0.18135300 -0.06533410 -0.03151551 0.02746497  486  VAL   A H    
6753  H  HA   . VAL   A  431 ? 0.25516865 0.24634385 0.17410134 -0.06373462 -0.02505377 0.02428858  486  VAL   A HA   
6754  H  HB   . VAL   A  431 ? 0.28827143 0.27501148 0.19622089 -0.06405757 -0.02543069 0.02146732  486  VAL   A HB   
6755  H  HG11 . VAL   A  431 ? 0.31654632 0.30428982 0.22265793 -0.06748203 -0.02579089 0.02751761  486  VAL   A HG11 
6756  H  HG12 . VAL   A  431 ? 0.31459081 0.30624962 0.22385859 -0.06609424 -0.02191385 0.02498705  486  VAL   A HG12 
6757  H  HG13 . VAL   A  431 ? 0.32339957 0.31085521 0.22355197 -0.06721046 -0.02353166 0.02486115  486  VAL   A HG13 
6758  H  HG21 . VAL   A  431 ? 0.30253965 0.28436112 0.20163359 -0.06634124 -0.03062963 0.02335147  486  VAL   A HG21 
6759  H  HG22 . VAL   A  431 ? 0.29462290 0.27743596 0.20204391 -0.06525922 -0.03226202 0.02292634  486  VAL   A HG22 
6760  H  HG23 . VAL   A  431 ? 0.29530743 0.27854821 0.20080060 -0.06636369 -0.03224710 0.02604546  486  VAL   A HG23 
6761  N  N    . PHE   A  432 ? 0.25579384 0.24304591 0.17619871 -0.06149040 -0.02676966 0.02053414  487  PHE   A N    
6762  C  CA   . PHE   A  432 ? 0.27472979 0.25872874 0.19583815 -0.06077483 -0.02810880 0.01870183  487  PHE   A CA   
6763  C  C    . PHE   A  432 ? 0.30109537 0.28300753 0.21856940 -0.05915937 -0.02630895 0.01566274  487  PHE   A C    
6764  O  O    . PHE   A  432 ? 0.26321989 0.24770725 0.18218556 -0.05730052 -0.02352775 0.01487559  487  PHE   A O    
6765  C  CB   . PHE   A  432 ? 0.32821369 0.31277946 0.25543377 -0.05995266 -0.02832729 0.01952785  487  PHE   A CB   
6766  C  CG   . PHE   A  432 ? 0.26110071 0.24119407 0.18794549 -0.05944521 -0.02930122 0.01774989  487  PHE   A CG   
6767  C  CD1  . PHE   A  432 ? 0.28969914 0.26736003 0.21638693 -0.06144140 -0.03177313 0.01777633  487  PHE   A CD1  
6768  C  CD2  . PHE   A  432 ? 0.28602928 0.26420262 0.21267581 -0.05702522 -0.02785867 0.01593260  487  PHE   A CD2  
6769  C  CE1  . PHE   A  432 ? 0.26291552 0.23569740 0.18876342 -0.06170370 -0.03267152 0.01629172  487  PHE   A CE1  
6770  C  CE2  . PHE   A  432 ? 0.29017931 0.26254541 0.21566759 -0.05663294 -0.02904858 0.01442183  487  PHE   A CE2  
6771  C  CZ   . PHE   A  432 ? 0.25609750 0.22542600 0.18075015 -0.05934043 -0.03140439 0.01466533  487  PHE   A CZ   
6772  H  H    . PHE   A  432 ? 0.25928020 0.24846911 0.17975584 -0.06089132 -0.02461915 0.02020222  487  PHE   A H    
6773  H  HA   . PHE   A  432 ? 0.28437456 0.26675957 0.20401299 -0.06193953 -0.03020127 0.01878247  487  PHE   A HA   
6774  H  HB2  . PHE   A  432 ? 0.29286748 0.27839157 0.22206409 -0.06096148 -0.02951975 0.02104020  487  PHE   A HB2  
6775  H  HB3  . PHE   A  432 ? 0.29452744 0.28127283 0.22363673 -0.05884988 -0.02669885 0.01973119  487  PHE   A HB3  
6776  H  HD1  . PHE   A  432 ? 0.27357492 0.25296488 0.20089403 -0.06269076 -0.03289412 0.01881165  487  PHE   A HD1  
6777  H  HD2  . PHE   A  432 ? 0.28013104 0.26089907 0.20764326 -0.05560442 -0.02613045 0.01573716  487  PHE   A HD2  
6778  H  HE1  . PHE   A  432 ? 0.26891369 0.24058202 0.19501048 -0.06351560 -0.03425697 0.01632573  487  PHE   A HE1  
6779  H  HE2  . PHE   A  432 ? 0.28411788 0.25460246 0.20934835 -0.05457833 -0.02827934 0.01313501  487  PHE   A HE2  
6780  H  HZ   . PHE   A  432 ? 0.27049273 0.23548687 0.19414546 -0.05956125 -0.03221868 0.01375976  487  PHE   A HZ   
6781  N  N    . VAL   A  433 ? 0.24762256 0.22504151 0.16064711 -0.05983001 -0.02809584 0.01370792  488  VAL   A N    
6782  C  CA   . VAL   A  433 ? 0.24476647 0.21844533 0.15400270 -0.05814744 -0.02696319 0.01025909  488  VAL   A CA   
6783  C  C    . VAL   A  433 ? 0.27266064 0.24061754 0.18164773 -0.05902931 -0.02980953 0.00900504  488  VAL   A C    
6784  O  O    . VAL   A  433 ? 0.26669276 0.23399493 0.17524083 -0.06160802 -0.03264989 0.00986844  488  VAL   A O    
6785  C  CB   . VAL   A  433 ? 0.27552974 0.24874577 0.17691796 -0.05864041 -0.02585956 0.00855507  488  VAL   A CB   
6786  C  CG1  . VAL   A  433 ? 0.28887028 0.25757855 0.18573457 -0.05663197 -0.02466061 0.00429958  488  VAL   A CG1  
6787  C  CG2  . VAL   A  433 ? 0.30040577 0.27921900 0.20166978 -0.05867776 -0.02276524 0.01019975  488  VAL   A CG2  
6788  H  H    . VAL   A  433 ? 0.25771299 0.23438478 0.17011906 -0.06134828 -0.03020410 0.01442037  488  VAL   A H    
6789  H  HA   . VAL   A  433 ? 0.25509378 0.23007780 0.16679497 -0.05618611 -0.02508483 0.00977737  488  VAL   A HA   
6790  H  HB   . VAL   A  433 ? 0.27771455 0.24956737 0.17664491 -0.06050728 -0.02821372 0.00916905  488  VAL   A HB   
6791  H  HG11 . VAL   A  433 ? 0.28642088 0.25598565 0.18653867 -0.05440209 -0.02294274 0.00357689  488  VAL   A HG11 
6792  H  HG12 . VAL   A  433 ? 0.29007277 0.25453183 0.18567505 -0.05744108 -0.02699711 0.00335765  488  VAL   A HG12 
6793  H  HG13 . VAL   A  433 ? 0.29284120 0.26192886 0.18465918 -0.05676971 -0.02333041 0.00316595  488  VAL   A HG13 
6794  H  HG21 . VAL   A  433 ? 0.29766297 0.27595595 0.19340536 -0.05901772 -0.02168367 0.00902990  488  VAL   A HG21 
6795  H  HG22 . VAL   A  433 ? 0.28816983 0.26851919 0.19100891 -0.06013485 -0.02397800 0.01271661  488  VAL   A HG22 
6796  H  HG23 . VAL   A  433 ? 0.28980339 0.27107978 0.19479524 -0.05700525 -0.02070779 0.00986775  488  VAL   A HG23 
6797  N  N    . GLY   A  434 ? 0.29889345 0.26281282 0.20854160 -0.05692685 -0.02916961 0.00707138  489  GLY   A N    
6798  C  CA   . GLY   A  434 ? 0.30005491 0.25695965 0.20780833 -0.05816308 -0.03164924 0.00548193  489  GLY   A CA   
6799  C  C    . GLY   A  434 ? 0.32104611 0.27191594 0.22292189 -0.05607300 -0.03084897 0.00129899  489  GLY   A C    
6800  O  O    . GLY   A  434 ? 0.37765831 0.32907233 0.27971658 -0.05236767 -0.02816349 -0.00031535 489  GLY   A O    
6801  H  H    . GLY   A  434 ? 0.29086035 0.25625297 0.20218617 -0.05473983 -0.02729991 0.00675997  489  GLY   A H    
6802  H  HA2  . GLY   A  434 ? 0.30319738 0.26018512 0.20999417 -0.06069570 -0.03359295 0.00599702  489  GLY   A HA2  
6803  H  HA3  . GLY   A  434 ? 0.30133092 0.25712079 0.21253222 -0.05795943 -0.03203928 0.00659186  489  GLY   A HA3  
6804  N  N    . TYR   A  435 ? 0.33653921 0.28179425 0.23341060 -0.05841317 -0.03332647 -0.00074692 490  TYR   A N    
6805  C  CA   . TYR   A  435 ? 0.28689057 0.22554995 0.17681521 -0.05681733 -0.03291024 -0.00520467 490  TYR   A CA   
6806  C  C    . TYR   A  435 ? 0.34381396 0.27403238 0.23150130 -0.05958481 -0.03637201 -0.00661550 490  TYR   A C    
6807  O  O    . TYR   A  435 ? 0.34536386 0.27680755 0.23391347 -0.06380039 -0.03927804 -0.00512762 490  TYR   A O    
6808  C  CB   . TYR   A  435 ? 0.33463991 0.27562058 0.21790972 -0.05757492 -0.03229985 -0.00676981 490  TYR   A CB   
6809  C  CG   . TYR   A  435 ? 0.37346199 0.30774733 0.24833414 -0.05614460 -0.03175679 -0.01179833 490  TYR   A CG   
6810  C  CD1  . TYR   A  435 ? 0.36728221 0.29389057 0.23704293 -0.05881039 -0.03529798 -0.01421722 490  TYR   A CD1  
6811  C  CD2  . TYR   A  435 ? 0.45283866 0.38872594 0.32493103 -0.05222151 -0.02759346 -0.01445124 490  TYR   A CD2  
6812  C  CE1  . TYR   A  435 ? 0.37422591 0.29381695 0.23542741 -0.05747762 -0.03492242 -0.01927306 490  TYR   A CE1  
6813  C  CE2  . TYR   A  435 ? 0.39945537 0.32912719 0.26333725 -0.05056062 -0.02675697 -0.01959216 490  TYR   A CE2  
6814  C  CZ   . TYR   A  435 ? 0.44723597 0.36822197 0.30527824 -0.05313965 -0.03054732 -0.02203250 490  TYR   A CZ   
6815  O  OH   . TYR   A  435 ? 0.37229854 0.28670207 0.22147062 -0.05151829 -0.02976548 -0.02740278 490  TYR   A OH   
6816  H  H    . TYR   A  435 ? 0.31678110 0.26242775 0.21465525 -0.06110271 -0.03539917 0.00050533  490  TYR   A H    
6817  H  HA   . TYR   A  435 ? 0.31529999 0.25318098 0.20602705 -0.05358527 -0.03089194 -0.00634610 490  TYR   A HA   
6818  H  HB2  . TYR   A  435 ? 0.32574487 0.27202079 0.21040569 -0.05628146 -0.02995181 -0.00561982 490  TYR   A HB2  
6819  H  HB3  . TYR   A  435 ? 0.32749593 0.26946425 0.21039677 -0.06047823 -0.03466349 -0.00545679 490  TYR   A HB3  
6820  H  HD1  . TYR   A  435 ? 0.36719224 0.29346308 0.23932949 -0.06166894 -0.03798087 -0.01256601 490  TYR   A HD1  
6821  H  HD2  . TYR   A  435 ? 0.40988219 0.35141128 0.28574979 -0.05072515 -0.02521096 -0.01290674 490  TYR   A HD2  
6822  H  HE1  . TYR   A  435 ? 0.39676484 0.31094685 0.25433856 -0.05961606 -0.03757724 -0.02097061 490  TYR   A HE1  
6823  H  HE2  . TYR   A  435 ? 0.42369193 0.35521322 0.28597909 -0.04780201 -0.02359253 -0.02156132 490  TYR   A HE2  
6825  N  N    . GLY   A  436 ? 0.31175876 0.23363656 0.19667317 -0.05713333 -0.03607135 -0.00963064 491  GLY   A N    
6826  C  CA   . GLY   A  436 ? 0.31761950 0.22966945 0.19905528 -0.05991347 -0.03924419 -0.01148282 491  GLY   A CA   
6827  C  C    . GLY   A  436 ? 0.37902310 0.28289044 0.26176059 -0.05755400 -0.03928136 -0.01169949 491  GLY   A C    
6828  O  O    . GLY   A  436 ? 0.37844893 0.28462234 0.26492563 -0.05324957 -0.03706108 -0.01066377 491  GLY   A O    
6829  H  H    . GLY   A  436 ? 0.32078367 0.24300361 0.20606746 -0.05365081 -0.03391492 -0.01059997 491  GLY   A H    
6830  H  HA2  . GLY   A  436 ? 0.33725864 0.24576685 0.21293239 -0.05986528 -0.03961191 -0.01463379 491  GLY   A HA2  
6831  H  HA3  . GLY   A  436 ? 0.32686099 0.24078166 0.21043350 -0.06364714 -0.04123965 -0.00952632 491  GLY   A HA3  
6832  N  N    . PRO   A  437 ? 0.39532131 0.28906935 0.27497780 -0.06062028 -0.04220093 -0.01281689 492  PRO   A N    
6833  C  CA   . PRO   A  437 ? 0.38482273 0.26793867 0.26343501 -0.05825945 -0.04270606 -0.01344755 492  PRO   A CA   
6834  C  C    . PRO   A  437 ? 0.38836682 0.27439442 0.27356249 -0.05695046 -0.04196589 -0.00895101 492  PRO   A C    
6835  O  O    . PRO   A  437 ? 0.44138396 0.32113957 0.32622543 -0.05261881 -0.04165793 -0.00940217 492  PRO   A O    
6836  C  CB   . PRO   A  437 ? 0.42070997 0.29392070 0.29515797 -0.06406686 -0.04634211 -0.01445701 492  PRO   A CB   
6837  C  CG   . PRO   A  437 ? 0.40058064 0.28341514 0.27847090 -0.06974737 -0.04756932 -0.01213875 492  PRO   A CG   
6838  C  CD   . PRO   A  437 ? 0.36940855 0.26155740 0.24688026 -0.06685988 -0.04548106 -0.01316611 492  PRO   A CD   
6839  H  HA   . PRO   A  437 ? 0.40089309 0.28073022 0.27643150 -0.05419054 -0.04150835 -0.01647378 492  PRO   A HA   
6840  H  HB2  . PRO   A  437 ? 0.41478819 0.28245151 0.29014057 -0.06487256 -0.04722916 -0.01282936 492  PRO   A HB2  
6841  H  HB3  . PRO   A  437 ? 0.42192876 0.28892839 0.29083073 -0.06333397 -0.04696222 -0.01813941 492  PRO   A HB3  
6842  H  HG2  . PRO   A  437 ? 0.38967383 0.27664787 0.27259460 -0.07122058 -0.04737286 -0.00872744 492  PRO   A HG2  
6843  H  HG3  . PRO   A  437 ? 0.40273550 0.28144324 0.27781564 -0.07352012 -0.04985227 -0.01355613 492  PRO   A HG3  
6844  H  HD2  . PRO   A  437 ? 0.37260228 0.27241531 0.25369024 -0.06897251 -0.04569868 -0.01083058 492  PRO   A HD2  
6845  H  HD3  . PRO   A  437 ? 0.38818261 0.27721089 0.26030472 -0.06686410 -0.04608989 -0.01636324 492  PRO   A HD3  
6846  N  N    . THR   A  438 ? 0.40983188 0.30492288 0.30068961 -0.06039620 -0.04190745 -0.00479124 493  THR   A N    
6847  C  CA   . THR   A  438 ? 0.41628671 0.31301934 0.31214085 -0.05985091 -0.04151429 -0.00068344 493  THR   A CA   
6848  C  C    . THR   A  438 ? 0.39357418 0.29957727 0.29404509 -0.05493217 -0.03883342 0.00048855  493  THR   A C    
6849  O  O    . THR   A  438 ? 0.38499677 0.29093891 0.28851923 -0.05269297 -0.03858497 0.00289771  493  THR   A O    
6850  C  CB   . THR   A  438 ? 0.34550786 0.24602836 0.24482721 -0.06596265 -0.04267694 0.00287449  493  THR   A CB   
6851  O  OG1  . THR   A  438 ? 0.39123076 0.28480300 0.28697908 -0.07104564 -0.04508913 0.00146263  493  THR   A OG1  
6852  C  CG2  . THR   A  438 ? 0.37955940 0.27834976 0.28157547 -0.06603654 -0.04257611 0.00668298  493  THR   A CG2  
6853  H  H    . THR   A  438 ? 0.40007991 0.30007774 0.29141510 -0.06299017 -0.04223521 -0.00460778 493  THR   A H    
6854  H  HA   . THR   A  438 ? 0.40501049 0.29335892 0.29860729 -0.05861128 -0.04236853 -0.00112855 493  THR   A HA   
6855  H  HB   . THR   A  438 ? 0.36218899 0.27118909 0.26436138 -0.06658655 -0.04189944 0.00364750  493  THR   A HB   
6857  H  HG21 . THR   A  438 ? 0.36755317 0.26706949 0.27077472 -0.07037149 -0.04328219 0.00843153  493  THR   A HG21 
6858  H  HG22 . THR   A  438 ? 0.37651008 0.26694763 0.27556139 -0.06425543 -0.04327450 0.00602239  493  THR   A HG22 
6859  H  HG23 . THR   A  438 ? 0.36132562 0.26650840 0.26663694 -0.06359071 -0.04117646 0.00804932  493  THR   A HG23 
6860  N  N    . PHE   A  439 ? 0.41257584 0.32625544 0.31312114 -0.05360291 -0.03700763 -0.00115268 494  PHE   A N    
6861  C  CA   . PHE   A  439 ? 0.35399806 0.27673307 0.25872812 -0.04965289 -0.03428339 -0.00036237 494  PHE   A CA   
6862  C  C    . PHE   A  439 ? 0.41854015 0.33792961 0.32184595 -0.04355973 -0.03275814 -0.00371262 494  PHE   A C    
6863  O  O    . PHE   A  439 ? 0.41633692 0.32703903 0.31420159 -0.04228440 -0.03342805 -0.00739510 494  PHE   A O    
6864  C  CB   . PHE   A  439 ? 0.29723519 0.22907537 0.20207849 -0.05124555 -0.03285775 -0.00035373 494  PHE   A CB   
6865  C  CG   . PHE   A  439 ? 0.32815245 0.26592386 0.23664127 -0.05559517 -0.03395425 0.00332227  494  PHE   A CG   
6866  C  CD1  . PHE   A  439 ? 0.30985054 0.25369307 0.22411107 -0.05517149 -0.03313552 0.00671606  494  PHE   A CD1  
6867  C  CD2  . PHE   A  439 ? 0.32005206 0.25735849 0.22633187 -0.05990897 -0.03602172 0.00310495  494  PHE   A CD2  
6868  C  CE1  . PHE   A  439 ? 0.32643473 0.27518785 0.24390750 -0.05869368 -0.03403032 0.00960270  494  PHE   A CE1  
6869  C  CE2  . PHE   A  439 ? 0.36577600 0.30888015 0.27616453 -0.06319095 -0.03704077 0.00610344  494  PHE   A CE2  
6870  C  CZ   . PHE   A  439 ? 0.37692684 0.32569861 0.29276454 -0.06239635 -0.03582977 0.00923076  494  PHE   A CZ   
6871  H  H    . PHE   A  439 ? 0.39560485 0.30881572 0.29329422 -0.05549555 -0.03754993 -0.00274554 494  PHE   A H    
6872  H  HA   . PHE   A  439 ? 0.35639173 0.28160608 0.26495194 -0.04986787 -0.03441387 0.00244920  494  PHE   A HA   
6873  H  HB2  . PHE   A  439 ? 0.32258758 0.25152501 0.22298878 -0.05199121 -0.03325128 -0.00277758 494  PHE   A HB2  
6874  H  HB3  . PHE   A  439 ? 0.31411386 0.25077793 0.22071889 -0.04848591 -0.03079007 -0.00056781 494  PHE   A HB3  
6875  H  HD1  . PHE   A  439 ? 0.31701207 0.26155439 0.23306747 -0.05235350 -0.03208494 0.00690080  494  PHE   A HD1  
6876  H  HD2  . PHE   A  439 ? 0.34023023 0.27327585 0.24228469 -0.06046121 -0.03685895 0.00071272  494  PHE   A HD2  
6877  H  HE1  . PHE   A  439 ? 0.32534808 0.27785692 0.24625915 -0.05831871 -0.03342985 0.01163626  494  PHE   A HE1  
6878  H  HE2  . PHE   A  439 ? 0.35618222 0.29961464 0.26564202 -0.06583694 -0.03863027 0.00581806  494  PHE   A HE2  
6879  H  HZ   . PHE   A  439 ? 0.35351926 0.30607212 0.27204281 -0.06437269 -0.03642305 0.01098293  494  PHE   A HZ   
6880  N  N    . LYS   A  440 ? 0.37463975 0.30125612 0.28325456 -0.03977755 -0.03082244 -0.00256047 495  LYS   A N    
6881  C  CA   . LYS   A  440 ? 0.36602926 0.29305553 0.27548397 -0.03351514 -0.02891736 -0.00568892 495  LYS   A CA   
6882  C  C    . LYS   A  440 ? 0.37971321 0.31126690 0.28595692 -0.03266185 -0.02594145 -0.00937467 495  LYS   A C    
6883  O  O    . LYS   A  440 ? 0.37425172 0.31109640 0.27914464 -0.03659405 -0.02524901 -0.00829832 495  LYS   A O    
6884  C  CB   . LYS   A  440 ? 0.37686747 0.31233609 0.29390320 -0.03053821 -0.02792376 -0.00317033 495  LYS   A CB   
6885  C  CG   . LYS   A  440 ? 0.34980705 0.27941853 0.26864523 -0.03002061 -0.03085721 -0.00018911 495  LYS   A CG   
6886  C  CD   . LYS   A  440 ? 0.40858912 0.34513444 0.33412576 -0.02614599 -0.03055125 0.00149701  495  LYS   A CD   
6887  C  CE   . LYS   A  440 ? 0.41844302 0.34673002 0.34352052 -0.02567469 -0.03398308 0.00437696  495  LYS   A CE   
6888  N  NZ   . LYS   A  440 ? 0.47392583 0.40881449 0.40503052 -0.02246885 -0.03443295 0.00635567  495  LYS   A NZ   
6889  H  H    . LYS   A  440 ? 0.37201333 0.30389851 0.28416985 -0.04117929 -0.03072255 0.00018842  495  LYS   A H    
6890  H  HA   . LYS   A  440 ? 0.38251251 0.30116266 0.28947401 -0.03176138 -0.03031009 -0.00717221 495  LYS   A HA   
6891  H  HB2  . LYS   A  440 ? 0.35806173 0.30057859 0.27732795 -0.03296732 -0.02700729 -0.00124447 495  LYS   A HB2  
6892  H  HB3  . LYS   A  440 ? 0.36799181 0.30604994 0.28641564 -0.02652618 -0.02624296 -0.00550162 495  LYS   A HB3  
6893  H  HG2  . LYS   A  440 ? 0.37846985 0.29947028 0.29407489 -0.02837528 -0.03217115 -0.00180999 495  LYS   A HG2  
6894  H  HG3  . LYS   A  440 ? 0.36635447 0.29532298 0.28464934 -0.03415900 -0.03197204 0.00231657  495  LYS   A HG3  
6895  H  HD2  . LYS   A  440 ? 0.38512373 0.32940173 0.31365305 -0.02819102 -0.02951432 0.00330480  495  LYS   A HD2  
6896  H  HD3  . LYS   A  440 ? 0.39640218 0.33492476 0.32339430 -0.02194584 -0.02928154 -0.00109343 495  LYS   A HD3  
6897  H  HE2  . LYS   A  440 ? 0.43898362 0.35905415 0.36101565 -0.02337779 -0.03513550 0.00263571  495  LYS   A HE2  
6898  H  HE3  . LYS   A  440 ? 0.42695367 0.35316885 0.35028887 -0.03000018 -0.03491282 0.00664821  495  LYS   A HE3  
6899  H  HZ1  . LYS   A  440 ? 0.45434979 0.39369777 0.38823548 -0.01890691 -0.03312910 0.00425043  495  LYS   A HZ1  
6900  H  HZ2  . LYS   A  440 ? 0.44696659 0.38759217 0.38014281 -0.02518489 -0.03392909 0.00842802  495  LYS   A HZ2  
6901  H  HZ3  . LYS   A  440 ? 0.46001962 0.38895002 0.39006642 -0.02127761 -0.03661563 0.00760912  495  LYS   A HZ3  
6902  N  N    . TYR   A  441 ? 0.40547729 0.33428282 0.31010514 -0.02729311 -0.02433141 -0.01375322 496  TYR   A N    
6903  C  CA   . TYR   A  441 ? 0.39257637 0.32496276 0.29339099 -0.02563430 -0.02093478 -0.01798544 496  TYR   A CA   
6904  C  C    . TYR   A  441 ? 0.36488250 0.31041831 0.27191323 -0.02282216 -0.01690903 -0.01784049 496  TYR   A C    
6905  O  O    . TYR   A  441 ? 0.36989862 0.31855008 0.28344533 -0.01831074 -0.01654632 -0.01770627 496  TYR   A O    
6906  C  CB   . TYR   A  441 ? 0.47199485 0.39390457 0.36779660 -0.02094220 -0.02117697 -0.02335721 496  TYR   A CB   
6907  C  CG   . TYR   A  441 ? 0.38805711 0.31205881 0.27864158 -0.01854914 -0.01744999 -0.02873704 496  TYR   A CG   
6908  C  CD1  . TYR   A  441 ? 0.39241102 0.31518042 0.27517331 -0.02303579 -0.01722484 -0.02995763 496  TYR   A CD1  
6909  C  CD2  . TYR   A  441 ? 0.42737043 0.35456854 0.32062590 -0.01164956 -0.01425517 -0.03278197 496  TYR   A CD2  
6910  C  CE1  . TYR   A  441 ? 0.41210699 0.33617598 0.28874654 -0.02109765 -0.01375080 -0.03488776 496  TYR   A CE1  
6911  C  CE2  . TYR   A  441 ? 0.39175096 0.32098293 0.27971637 -0.00946326 -0.01031960 -0.03807148 496  TYR   A CE2  
6912  C  CZ   . TYR   A  441 ? 0.47165132 0.39883944 0.35066664 -0.01436041 -0.01001370 -0.03908672 496  TYR   A CZ   
6913  O  OH   . TYR   A  441 ? 0.47135153 0.40025532 0.34367028 -0.01264025 -0.00599151 -0.04427011 496  TYR   A OH   
6914  H  H    . TYR   A  441 ? 0.40126085 0.32558075 0.30709442 -0.02435830 -0.02539521 -0.01415400 496  TYR   A H    
6915  H  HA   . TYR   A  441 ? 0.40138602 0.33386517 0.29831111 -0.02947751 -0.02118979 -0.01768004 496  TYR   A HA   
6916  H  HB2  . TYR   A  441 ? 0.43712094 0.35038918 0.32888931 -0.02336206 -0.02388804 -0.02327642 496  TYR   A HB2  
6917  H  HB3  . TYR   A  441 ? 0.43303180 0.35442725 0.33283481 -0.01694538 -0.02138053 -0.02343669 496  TYR   A HB3  
6918  H  HD1  . TYR   A  441 ? 0.39237487 0.31354907 0.27385077 -0.02746741 -0.01953335 -0.02741110 496  TYR   A HD1  
6919  H  HD2  . TYR   A  441 ? 0.40758795 0.33571649 0.30629706 -0.00826716 -0.01476904 -0.03205366 496  TYR   A HD2  
6920  H  HE1  . TYR   A  441 ? 0.42411184 0.34696662 0.29482991 -0.02426764 -0.01395819 -0.03554282 496  TYR   A HE1  
6921  H  HE2  . TYR   A  441 ? 0.42118335 0.35331511 0.31155765 -0.00457085 -0.00790450 -0.04103141 496  TYR   A HE2  
6923  N  N    . ARG   A  442 ? 0.37879771 0.33181402 0.28357631 -0.02578484 -0.01415521 -0.01774064 497  ARG   A N    
6924  C  CA   . ARG   A  442 ? 0.37746590 0.34301135 0.28690761 -0.02438273 -0.00979525 -0.01776971 497  ARG   A CA   
6925  C  C    . ARG   A  442 ? 0.36909100 0.34190983 0.28855795 -0.02317020 -0.01026004 -0.01423896 497  ARG   A C    
6926  O  O    . ARG   A  442 ? 0.34515363 0.32527643 0.27066994 -0.01886305 -0.00774521 -0.01587013 497  ARG   A O    
6927  C  CB   . ARG   A  442 ? 0.36167461 0.32860103 0.26975608 -0.01890046 -0.00600517 -0.02349805 497  ARG   A CB   
6928  C  CG   . ARG   A  442 ? 0.38505134 0.34662294 0.28263277 -0.01970166 -0.00447525 -0.02775726 497  ARG   A CG   
6929  C  CD   . ARG   A  442 ? 0.53523052 0.50334096 0.43348551 -0.01462592 0.00089970  -0.03279426 497  ARG   A CD   
6930  N  NE   . ARG   A  442 ? 0.75571752 0.72051108 0.64325559 -0.01556134 0.00332067  -0.03699869 497  ARG   A NE   
6931  C  CZ   . ARG   A  442 ? 0.81901979 0.79189104 0.70276082 -0.01803041 0.00774670  -0.03738160 497  ARG   A CZ   
6932  N  NH1  . ARG   A  442 ? 0.76407373 0.74771649 0.65301657 -0.02132130 0.00960633  -0.03299189 497  ARG   A NH1  
6933  N  NH2  . ARG   A  442 ? 0.92106450 0.89010268 0.79446757 -0.01771420 0.01011632  -0.04211847 497  ARG   A NH2  
6934  H  H    . ARG   A  442 ? 0.37704760 0.32706642 0.27697635 -0.02906339 -0.01515610 -0.01754452 497  ARG   A H    
6935  H  HA   . ARG   A  442 ? 0.36989522 0.33860621 0.27661285 -0.02794916 -0.00889840 -0.01649011 497  ARG   A HA   
6936  H  HB2  . ARG   A  442 ? 0.37375635 0.33641976 0.28409672 -0.01509844 -0.00734024 -0.02486415 497  ARG   A HB2  
6937  H  HB3  . ARG   A  442 ? 0.36801839 0.34417737 0.28042933 -0.01808114 -0.00304645 -0.02329939 497  ARG   A HB3  
6938  H  HG2  . ARG   A  442 ? 0.40602803 0.36942610 0.30010933 -0.02394461 -0.00433860 -0.02593955 497  ARG   A HG2  
6939  H  HG3  . ARG   A  442 ? 0.41451895 0.36667490 0.30830812 -0.01921696 -0.00708660 -0.02919783 497  ARG   A HG3  
6940  H  HD2  . ARG   A  442 ? 0.53562713 0.50091404 0.43690777 -0.00996628 0.00036575  -0.03498220 497  ARG   A HD2  
6941  H  HD3  . ARG   A  442 ? 0.52648538 0.50433993 0.42975497 -0.01510466 0.00339214  -0.03116584 497  ARG   A HD3  
6942  H  HE   . ARG   A  442 ? 0.71860433 0.67510426 0.60135496 -0.01459943 0.00167620  -0.03942202 497  ARG   A HE   
6943  H  HH11 . ARG   A  442 ? 0.76610011 0.74943459 0.65737396 -0.02406634 0.00699257  -0.02916972 497  ARG   A HH11 
6944  H  HH12 . ARG   A  442 ? 0.77722281 0.76818818 0.66717297 -0.02084876 0.01350657  -0.03398506 497  ARG   A HH12 
6945  H  HH21 . ARG   A  442 ? 0.89167374 0.86452001 0.76088119 -0.02033904 0.01237704  -0.04174838 497  ARG   A HH21 
6946  H  HH22 . ARG   A  442 ? 0.89664173 0.85900295 0.76703203 -0.01493390 0.00936549  -0.04561761 497  ARG   A HH22 
6947  N  N    . THR   A  443 ? 0.37380719 0.34470809 0.29500997 -0.02690147 -0.01360405 -0.00968443 498  THR   A N    
6948  C  CA   . THR   A  443 ? 0.38761914 0.36336327 0.31688732 -0.02610121 -0.01485948 -0.00632537 498  THR   A CA   
6949  C  C    . THR   A  443 ? 0.32410499 0.30767655 0.25579962 -0.03086023 -0.01425737 -0.00237747 498  THR   A C    
6950  O  O    . THR   A  443 ? 0.36002597 0.34084624 0.28740615 -0.03533698 -0.01547811 -0.00054034 498  THR   A O    
6951  C  CB   . THR   A  443 ? 0.39570037 0.36185324 0.32459563 -0.02605909 -0.01916853 -0.00447479 498  THR   A CB   
6952  O  OG1  . THR   A  443 ? 0.33218813 0.29069945 0.25877872 -0.02130498 -0.01968112 -0.00819525 498  THR   A OG1  
6953  C  CG2  . THR   A  443 ? 0.40817636 0.37851009 0.34396839 -0.02568083 -0.02084742 -0.00076694 498  THR   A CG2  
6954  H  H    . THR   A  443 ? 0.37568504 0.34230837 0.29282060 -0.03005903 -0.01516025 -0.00877649 498  THR   A H    
6955  H  HA   . THR   A  443 ? 0.37328264 0.35343012 0.30658442 -0.02239064 -0.01330354 -0.00793233 498  THR   A HA   
6956  H  HB   . THR   A  443 ? 0.38084096 0.34291503 0.30593884 -0.02969449 -0.02052183 -0.00332296 498  THR   A HB   
6958  H  HG21 . THR   A  443 ? 0.40484393 0.36847785 0.33977526 -0.02499445 -0.02333593 0.00001832  498  THR   A HG21 
6959  H  HG22 . THR   A  443 ? 0.40132532 0.37749702 0.34153929 -0.02260469 -0.01946991 -0.00172533 498  THR   A HG22 
6960  H  HG23 . THR   A  443 ? 0.39540166 0.36917278 0.33186701 -0.02923721 -0.02089818 0.00173113  498  THR   A HG23 
6961  N  N    . LYS   A  444 ? 0.30748758 0.30075860 0.24632743 -0.02971394 -0.01259427 -0.00127006 499  LYS   A N    
6962  C  CA   . LYS   A  444 ? 0.28693461 0.28628778 0.22863415 -0.03394816 -0.01269443 0.00264843  499  LYS   A CA   
6963  C  C    . LYS   A  444 ? 0.29721373 0.29491752 0.24344593 -0.03373992 -0.01616894 0.00565263  499  LYS   A C    
6964  O  O    . LYS   A  444 ? 0.34436822 0.34069771 0.29403010 -0.02959278 -0.01750469 0.00479245  499  LYS   A O    
6965  C  CB   . LYS   A  444 ? 0.27759132 0.28819698 0.22359422 -0.03381493 -0.00876962 0.00198983  499  LYS   A CB   
6966  C  CG   . LYS   A  444 ? 0.37744653 0.39395937 0.32551005 -0.03858893 -0.00843373 0.00569724  499  LYS   A CG   
6967  C  CD   . LYS   A  444 ? 0.45388532 0.48173791 0.40646181 -0.03882992 -0.00421887 0.00481381  499  LYS   A CD   
6968  C  CE   . LYS   A  444 ? 0.53174400 0.56466091 0.48619515 -0.04378978 -0.00394458 0.00839934  499  LYS   A CE   
6969  N  NZ   . LYS   A  444 ? 0.61879486 0.66306031 0.57823569 -0.04444323 0.00025863  0.00745159  499  LYS   A NZ   
6970  H  H    . LYS   A  444 ? 0.31004328 0.30617937 0.25216091 -0.02618357 -0.01147800 -0.00312687 499  LYS   A H    
6971  H  HA   . LYS   A  444 ? 0.29070741 0.28740054 0.22803329 -0.03714870 -0.01313007 0.00364935  499  LYS   A HA   
6972  H  HB2  . LYS   A  444 ? 0.30423179 0.31518009 0.24658212 -0.03368636 -0.00641845 -0.00016497 499  LYS   A HB2  
6973  H  HB3  . LYS   A  444 ? 0.29975533 0.31378019 0.25089285 -0.03053015 -0.00855499 0.00094581  499  LYS   A HB3  
6974  H  HG2  . LYS   A  444 ? 0.35703102 0.37315398 0.30835435 -0.03874875 -0.01071063 0.00764366  499  LYS   A HG2  
6975  H  HG3  . LYS   A  444 ? 0.36186099 0.37508598 0.30491894 -0.04151365 -0.00875070 0.00672011  499  LYS   A HG3  
6976  H  HD2  . LYS   A  444 ? 0.45647547 0.48465872 0.40519744 -0.03884139 -0.00169447 0.00289334  499  LYS   A HD2  
6977  H  HD3  . LYS   A  444 ? 0.45224315 0.48393911 0.41034487 -0.03559982 -0.00404964 0.00353117  499  LYS   A HD3  
6978  H  HE2  . LYS   A  444 ? 0.52324539 0.55553257 0.48095039 -0.04387216 -0.00645653 0.01014506  499  LYS   A HE2  
6979  H  HE3  . LYS   A  444 ? 0.52829808 0.55753148 0.47728753 -0.04668060 -0.00411169 0.00963075  499  LYS   A HE3  
6980  H  HZ1  . LYS   A  444 ? 0.58839852 0.63647544 0.55286509 -0.04120757 0.00061585  0.00572480  499  LYS   A HZ1  
6981  H  HZ2  . LYS   A  444 ? 0.59387112 0.63867378 0.54934371 -0.04535966 0.00281415  0.00637030  499  LYS   A HZ2  
6982  H  HZ3  . LYS   A  444 ? 0.58648050 0.63344765 0.54790759 -0.04724312 -0.00007936 0.00963375  499  LYS   A HZ3  
6983  N  N    . VAL   A  445 ? 0.29044777 0.28767857 0.23604077 -0.03804408 -0.01777995 0.00909692  500  VAL   A N    
6984  C  CA   . VAL   A  445 ? 0.30975255 0.30553243 0.25841203 -0.03858291 -0.02070572 0.01199956  500  VAL   A CA   
6985  C  C    . VAL   A  445 ? 0.27979177 0.28268221 0.23169409 -0.04174684 -0.02013632 0.01459251  500  VAL   A C    
6986  O  O    . VAL   A  445 ? 0.32866353 0.33466437 0.27867204 -0.04438426 -0.01816846 0.01473012  500  VAL   A O    
6987  C  CB   . VAL   A  445 ? 0.26916099 0.25578550 0.21327680 -0.04064285 -0.02341217 0.01322183  500  VAL   A CB   
6988  C  CG1  . VAL   A  445 ? 0.33957881 0.31804499 0.27977622 -0.03810512 -0.02409037 0.01051893  500  VAL   A CG1  
6989  C  CG2  . VAL   A  445 ? 0.32216051 0.30862248 0.26286769 -0.04511363 -0.02331483 0.01446411  500  VAL   A CG2  
6990  H  H    . VAL   A  445 ? 0.29479003 0.29254973 0.23764250 -0.04066282 -0.01700614 0.00957850  500  VAL   A H    
6991  H  HA   . VAL   A  445 ? 0.29456800 0.29092529 0.24620181 -0.03553857 -0.02125553 0.01137658  500  VAL   A HA   
6992  H  HB   . VAL   A  445 ? 0.29478881 0.28069925 0.24079630 -0.04073271 -0.02502385 0.01501476  500  VAL   A HB   
6993  H  HG11 . VAL   A  445 ? 0.32187453 0.30071649 0.25964761 -0.03802798 -0.02253942 0.00854433  500  VAL   A HG11 
6994  H  HG12 . VAL   A  445 ? 0.32162759 0.29981142 0.26404765 -0.03483898 -0.02441990 0.00976536  500  VAL   A HG12 
6995  H  HG13 . VAL   A  445 ? 0.32055965 0.29354042 0.25828028 -0.03986939 -0.02581975 0.01145832  500  VAL   A HG13 
6996  H  HG21 . VAL   A  445 ? 0.30611926 0.28736162 0.24424458 -0.04621709 -0.02478700 0.01461418  500  VAL   A HG21 
6997  H  HG22 . VAL   A  445 ? 0.29908046 0.28884804 0.24193826 -0.04669372 -0.02352037 0.01640710  500  VAL   A HG22 
6998  H  HG23 . VAL   A  445 ? 0.30546319 0.29364669 0.24430917 -0.04528274 -0.02168208 0.01312496  500  VAL   A HG23 
6999  N  N    . PRO   A  446 ? 0.29720542 0.30227044 0.25338763 -0.04165869 -0.02196435 0.01667935  501  PRO   A N    
7000  C  CA   . PRO   A  446 ? 0.27355367 0.28383881 0.23203999 -0.04496679 -0.02182841 0.01897298  501  PRO   A CA   
7001  C  C    . PRO   A  446 ? 0.29133677 0.29768446 0.24544254 -0.04882993 -0.02247664 0.02070613  501  PRO   A C    
7002  O  O    . PRO   A  446 ? 0.28621405 0.28621426 0.23652966 -0.04920399 -0.02369214 0.02062635  501  PRO   A O    
7003  C  CB   . PRO   A  446 ? 0.26908296 0.28040057 0.23158008 -0.04372318 -0.02433163 0.02044804  501  PRO   A CB   
7004  C  CG   . PRO   A  446 ? 0.38497868 0.39416999 0.34881800 -0.03900776 -0.02525513 0.01874747  501  PRO   A CG   
7005  C  CD   . PRO   A  446 ? 0.31653064 0.31878722 0.27496597 -0.03830652 -0.02440054 0.01684752  501  PRO   A CD   
7006  H  HA   . PRO   A  446 ? 0.28031886 0.29606348 0.24074192 -0.04521239 -0.01985055 0.01829206  501  PRO   A HA   
7007  H  HB2  . PRO   A  446 ? 0.29020384 0.29766032 0.25064340 -0.04523759 -0.02585271 0.02194916  501  PRO   A HB2  
7008  H  HB3  . PRO   A  446 ? 0.28886887 0.30585560 0.25481230 -0.04443547 -0.02386666 0.02087877  501  PRO   A HB3  
7009  H  HG2  . PRO   A  446 ? 0.33844540 0.34467387 0.30227846 -0.03832010 -0.02749368 0.01995103  501  PRO   A HG2  
7010  H  HG3  . PRO   A  446 ? 0.33821625 0.35309485 0.30606094 -0.03712454 -0.02424774 0.01755394  501  PRO   A HG3  
7011  H  HD2  . PRO   A  446 ? 0.32769322 0.32385099 0.28314605 -0.03906303 -0.02604411 0.01777434  501  PRO   A HD2  
7012  H  HD3  . PRO   A  446 ? 0.32981595 0.33223355 0.28926951 -0.03513329 -0.02386061 0.01487915  501  PRO   A HD3  
7013  N  N    . PRO   A  447 ? 0.33555377 0.34562838 0.29024053 -0.05182550 -0.02176915 0.02220728  502  PRO   A N    
7014  C  CA   . PRO   A  447 ? 0.29451060 0.30103371 0.24571598 -0.05478964 -0.02279019 0.02380745  502  PRO   A CA   
7015  C  C    . PRO   A  447 ? 0.27916956 0.28226295 0.23097208 -0.05486090 -0.02520438 0.02508014  502  PRO   A C    
7016  O  O    . PRO   A  447 ? 0.34399793 0.34838244 0.29874456 -0.05356222 -0.02611849 0.02547691  502  PRO   A O    
7017  C  CB   . PRO   A  447 ? 0.28153819 0.29227859 0.23360226 -0.05745070 -0.02171587 0.02513478  502  PRO   A CB   
7018  C  CG   . PRO   A  447 ? 0.32001740 0.33743656 0.27724016 -0.05640984 -0.02040901 0.02449486  502  PRO   A CG   
7019  C  CD   . PRO   A  447 ? 0.39082953 0.40854362 0.34958652 -0.05254668 -0.02000796 0.02230441  502  PRO   A CD   
7020  H  HA   . PRO   A  447 ? 0.29860860 0.30249241 0.24654664 -0.05498854 -0.02251950 0.02307868  502  PRO   A HA   
7021  H  HB2  . PRO   A  447 ? 0.29032236 0.29981583 0.24247578 -0.05872039 -0.02300721 0.02644707  502  PRO   A HB2  
7022  H  HB3  . PRO   A  447 ? 0.29455841 0.30489087 0.24373414 -0.05853646 -0.02066543 0.02500073  502  PRO   A HB3  
7023  H  HG2  . PRO   A  447 ? 0.32200223 0.34045523 0.28165692 -0.05679545 -0.02166386 0.02542174  502  PRO   A HG2  
7024  H  HG3  . PRO   A  447 ? 0.32535166 0.34585318 0.28244874 -0.05787998 -0.01866131 0.02451622  502  PRO   A HG3  
7025  H  HD2  . PRO   A  447 ? 0.35869592 0.37893075 0.32122943 -0.05112560 -0.02077942 0.02227443  502  PRO   A HD2  
7026  H  HD3  . PRO   A  447 ? 0.36257306 0.38263804 0.32094508 -0.05207199 -0.01795683 0.02098472  502  PRO   A HD3  
7027  N  N    . PHE   A  448 ? 0.24432802 0.24357688 0.19328450 -0.05649901 -0.02622068 0.02571313  503  PHE   A N    
7028  C  CA   . PHE   A  448 ? 0.21049324 0.20677289 0.15953150 -0.05697889 -0.02788614 0.02668985  503  PHE   A CA   
7029  C  C    . PHE   A  448 ? 0.24220592 0.23813996 0.19019008 -0.05914250 -0.02842482 0.02756787  503  PHE   A C    
7030  O  O    . PHE   A  448 ? 0.22736213 0.22388828 0.17373265 -0.05998281 -0.02801124 0.02747271  503  PHE   A O    
7031  C  CB   . PHE   A  448 ? 0.28706279 0.27857390 0.23430994 -0.05597655 -0.02855801 0.02581795  503  PHE   A CB   
7032  C  CG   . PHE   A  448 ? 0.21502614 0.20381215 0.15919209 -0.05671339 -0.02847808 0.02452385  503  PHE   A CG   
7033  C  CD1  . PHE   A  448 ? 0.26748532 0.25467354 0.21058667 -0.05884837 -0.02950805 0.02494981  503  PHE   A CD1  
7034  C  CD2  . PHE   A  448 ? 0.26112205 0.24946553 0.20355712 -0.05521753 -0.02740384 0.02261871  503  PHE   A CD2  
7035  C  CE1  . PHE   A  448 ? 0.33630419 0.32141787 0.27664369 -0.05972686 -0.02999108 0.02367912  503  PHE   A CE1  
7036  C  CE2  . PHE   A  448 ? 0.30042657 0.28585577 0.23912570 -0.05608515 -0.02763439 0.02122883  503  PHE   A CE2  
7037  C  CZ   . PHE   A  448 ? 0.27636284 0.26015544 0.21404101 -0.05845072 -0.02918187 0.02186271  503  PHE   A CZ   
7038  H  H    . PHE   A  448 ? 0.24530318 0.24406976 0.19221669 -0.05738942 -0.02582346 0.02549902  503  PHE   A H    
7039  H  HA   . PHE   A  448 ? 0.23380935 0.23149848 0.18470509 -0.05659645 -0.02824841 0.02733298  503  PHE   A HA   
7040  H  HB2  . PHE   A  448 ? 0.24872142 0.23859733 0.19594155 -0.05668567 -0.02939643 0.02667329  503  PHE   A HB2  
7041  H  HB3  . PHE   A  448 ? 0.25078398 0.24231020 0.19880296 -0.05412742 -0.02838561 0.02522764  503  PHE   A HB3  
7042  H  HD1  . PHE   A  448 ? 0.26353341 0.25143737 0.20789807 -0.05971329 -0.02993422 0.02597968  503  PHE   A HD1  
7043  H  HD2  . PHE   A  448 ? 0.25865486 0.24889399 0.20245549 -0.05355893 -0.02653304 0.02210055  503  PHE   A HD2  
7044  H  HE1  . PHE   A  448 ? 0.30224770 0.28700778 0.24255802 -0.06116723 -0.03091334 0.02391094  503  PHE   A HE1  
7045  H  HE2  . PHE   A  448 ? 0.28907970 0.27402437 0.22606388 -0.05502136 -0.02676370 0.01971596  503  PHE   A HE2  
7046  H  HZ   . PHE   A  448 ? 0.29719734 0.27923647 0.23245513 -0.05913600 -0.02969022 0.02088123  503  PHE   A HZ   
7047  N  N    . GLU   A  449 ? 0.24884334 0.24385321 0.19754978 -0.05984672 -0.02934863 0.02841073  504  GLU   A N    
7048  C  CA   . GLU   A  449 ? 0.31563592 0.31070369 0.26422364 -0.06119490 -0.02993832 0.02888007  504  GLU   A CA   
7049  C  C    . GLU   A  449 ? 0.28761166 0.28084171 0.23520726 -0.06185287 -0.03055597 0.02821010  504  GLU   A C    
7050  O  O    . GLU   A  449 ? 0.21221048 0.20320018 0.15913704 -0.06177946 -0.03058186 0.02772740  504  GLU   A O    
7051  C  CB   . GLU   A  449 ? 0.33347869 0.32905456 0.28332129 -0.06154015 -0.03022994 0.02959259  504  GLU   A CB   
7052  C  CG   . GLU   A  449 ? 0.41172159 0.40902197 0.36254573 -0.06119103 -0.03013715 0.03007846  504  GLU   A CG   
7053  C  CD   . GLU   A  449 ? 0.56258887 0.56007421 0.51364475 -0.06177450 -0.03059633 0.03047480  504  GLU   A CD   
7054  O  OE1  . GLU   A  449 ? 0.46125266 0.45765334 0.41167480 -0.06200119 -0.03059119 0.03046873  504  GLU   A OE1  
7055  O  OE2  . GLU   A  449 ? 0.51206791 0.51066583 0.46363193 -0.06226531 -0.03082857 0.03067329  504  GLU   A OE2  
7056  H  H    . GLU   A  449 ? 0.26196155 0.25631061 0.21117111 -0.05932541 -0.02960797 0.02863443  504  GLU   A H    
7057  H  HA   . GLU   A  449 ? 0.29703191 0.29300261 0.24522825 -0.06148663 -0.02982236 0.02906060  504  GLU   A HA   
7058  H  HB2  . GLU   A  449 ? 0.34515262 0.33955461 0.29478058 -0.06158371 -0.03028769 0.02961013  504  GLU   A HB2  
7059  H  HB3  . GLU   A  449 ? 0.34359384 0.33948031 0.29366112 -0.06204055 -0.03050904 0.02963649  504  GLU   A HB3  
7060  H  HG2  . GLU   A  449 ? 0.42137796 0.41975644 0.37230670 -0.06140606 -0.02984368 0.03008280  504  GLU   A HG2  
7061  H  HG3  . GLU   A  449 ? 0.41817647 0.41544399 0.36927289 -0.06038373 -0.03012932 0.03002901  504  GLU   A HG3  
7062  N  N    . ASN   A  450 ? 0.23838580 0.23234163 0.18593735 -0.06252463 -0.03136483 0.02820911  505  ASN   A N    
7063  C  CA   . ASN   A  450 ? 0.29065403 0.28395182 0.23784515 -0.06333510 -0.03240304 0.02742295  505  ASN   A CA   
7064  C  C    . ASN   A  450 ? 0.24626103 0.24000645 0.19565439 -0.06439976 -0.03238605 0.02736373  505  ASN   A C    
7065  O  O    . ASN   A  450 ? 0.26376671 0.25653446 0.21302518 -0.06564018 -0.03294236 0.02664167  505  ASN   A O    
7066  C  CB   . ASN   A  450 ? 0.25224888 0.24648778 0.19890718 -0.06337855 -0.03384785 0.02752946  505  ASN   A CB   
7067  C  CG   . ASN   A  450 ? 0.35476488 0.35084772 0.30396754 -0.06295519 -0.03444903 0.02812246  505  ASN   A CG   
7068  O  OD1  . ASN   A  450 ? 0.28230536 0.27912784 0.23320240 -0.06276004 -0.03344496 0.02841092  505  ASN   A OD1  
7069  N  ND2  . ASN   A  450 ? 0.23568213 0.23213592 0.18474132 -0.06253926 -0.03631065 0.02819764  505  ASN   A ND2  
7070  H  H    . ASN   A  450 ? 0.26003149 0.25483456 0.20783207 -0.06246246 -0.03148825 0.02870132  505  ASN   A H    
7071  H  HA   . ASN   A  450 ? 0.26622996 0.25793844 0.21172477 -0.06325689 -0.03226885 0.02677681  505  ASN   A HA   
7072  H  HB2  . ASN   A  450 ? 0.28380144 0.27784395 0.23019257 -0.06393514 -0.03479134 0.02686274  505  ASN   A HB2  
7073  H  HB3  . ASN   A  450 ? 0.28291032 0.27645779 0.22743893 -0.06308341 -0.03360581 0.02778015  505  ASN   A HB3  
7074  H  HD21 . ASN   A  450 ? 0.26837319 0.26406413 0.21558984 -0.06275024 -0.03716793 0.02805275  505  ASN   A HD21 
7075  H  HD22 . ASN   A  450 ? 0.26576853 0.26305547 0.21639481 -0.06191500 -0.03681989 0.02834916  505  ASN   A HD22 
7076  N  N    . ILE   A  451 ? 0.23549998 0.23048182 0.18641019 -0.06428379 -0.03161610 0.02805110  506  ILE   A N    
7077  C  CA   . ILE   A  451 ? 0.22011307 0.21560970 0.17228091 -0.06566403 -0.03098747 0.02812482  506  ILE   A CA   
7078  C  C    . ILE   A  451 ? 0.21822625 0.20995581 0.16832358 -0.06666554 -0.03076823 0.02829355  506  ILE   A C    
7079  O  O    . ILE   A  451 ? 0.23955728 0.23088506 0.18996704 -0.06867970 -0.03034363 0.02844812  506  ILE   A O    
7080  C  CB   . ILE   A  451 ? 0.24543966 0.24211040 0.19803461 -0.06529845 -0.02998478 0.02873650  506  ILE   A CB   
7081  C  CG1  . ILE   A  451 ? 0.22872666 0.22318473 0.17920475 -0.06430535 -0.02986186 0.02955295  506  ILE   A CG1  
7082  C  CG2  . ILE   A  451 ? 0.32289067 0.32217917 0.27732447 -0.06427769 -0.03025363 0.02829667  506  ILE   A CG2  
7083  C  CD1  . ILE   A  451 ? 0.29734319 0.29196733 0.24700627 -0.06445315 -0.02926020 0.03013812  506  ILE   A CD1  
7084  H  H    . ILE   A  451 ? 0.23420390 0.22966167 0.18507655 -0.06355898 -0.03141571 0.02845076  506  ILE   A H    
7085  H  HA   . ILE   A  451 ? 0.22645929 0.22385523 0.18032815 -0.06634047 -0.03139102 0.02760807  506  ILE   A HA   
7086  H  HB   . ILE   A  451 ? 0.25052732 0.24751273 0.20338884 -0.06647708 -0.02930413 0.02880936  506  ILE   A HB   
7087  H  HG12 . ILE   A  451 ? 0.24531174 0.24024343 0.19591734 -0.06343695 -0.03020657 0.02948178  506  ILE   A HG12 
7088  H  HG13 . ILE   A  451 ? 0.24795821 0.24031530 0.19729272 -0.06440499 -0.02997857 0.02970117  506  ILE   A HG13 
7089  H  HG21 . ILE   A  451 ? 0.29517663 0.29370192 0.24887517 -0.06346589 -0.03085962 0.02848478  506  ILE   A HG21 
7090  H  HG22 . ILE   A  451 ? 0.29585555 0.29698357 0.25212431 -0.06452102 -0.03059338 0.02770628  506  ILE   A HG22 
7091  H  HG23 . ILE   A  451 ? 0.29568994 0.29541656 0.25005364 -0.06418737 -0.02956383 0.02836225  506  ILE   A HG23 
7092  H  HD11 . ILE   A  451 ? 0.27303463 0.26913476 0.22346677 -0.06401910 -0.02925390 0.02981972  506  ILE   A HD11 
7093  H  HD12 . ILE   A  451 ? 0.27511495 0.26969594 0.22451036 -0.06557347 -0.02862666 0.03022388  506  ILE   A HD12 
7094  H  HD13 . ILE   A  451 ? 0.27515611 0.26835826 0.22357839 -0.06390382 -0.02957731 0.03069190  506  ILE   A HD13 
7095  N  N    . GLU   A  452 ? 0.22058636 0.20937784 0.16852401 -0.06525190 -0.03094798 0.02827126  507  GLU   A N    
7096  C  CA   . GLU   A  452 ? 0.22310066 0.20708804 0.16872293 -0.06544489 -0.03109461 0.02832343  507  GLU   A CA   
7097  C  C    . GLU   A  452 ? 0.29421103 0.27564073 0.23871285 -0.06687105 -0.03186507 0.02706696  507  GLU   A C    
7098  O  O    . GLU   A  452 ? 0.26035637 0.23680645 0.20271669 -0.06780595 -0.03218392 0.02703390  507  GLU   A O    
7099  C  CB   . GLU   A  452 ? 0.22882962 0.21114343 0.17329416 -0.06276021 -0.03112086 0.02820369  507  GLU   A CB   
7100  C  CG   . GLU   A  452 ? 0.31247297 0.29714420 0.25804037 -0.06146549 -0.03088424 0.02928932  507  GLU   A CG   
7101  C  CD   . GLU   A  452 ? 0.26893297 0.25196150 0.21339276 -0.06251828 -0.03098157 0.03071145  507  GLU   A CD   
7102  O  OE1  . GLU   A  452 ? 0.24760024 0.22609067 0.18976605 -0.06357727 -0.03126749 0.03123830  507  GLU   A OE1  
7103  O  OE2  . GLU   A  452 ? 0.35419151 0.34001750 0.29945186 -0.06255406 -0.03075617 0.03130765  507  GLU   A OE2  
7104  H  H    . GLU   A  452 ? 0.21899252 0.20872954 0.16693489 -0.06407940 -0.03095603 0.02818764  507  GLU   A H    
7105  H  HA   . GLU   A  452 ? 0.23618381 0.21930206 0.18149020 -0.06641816 -0.03079130 0.02916400  507  GLU   A HA   
7106  H  HB2  . GLU   A  452 ? 0.24437836 0.22773299 0.18886958 -0.06205412 -0.03106514 0.02732951  507  GLU   A HB2  
7107  H  HB3  . GLU   A  452 ? 0.24858949 0.22712772 0.19144137 -0.06254528 -0.03145778 0.02812496  507  GLU   A HB3  
7108  H  HG2  . GLU   A  452 ? 0.27652979 0.26426107 0.22340068 -0.06164290 -0.03061479 0.02925455  507  GLU   A HG2  
7109  H  HG3  . GLU   A  452 ? 0.28012294 0.26439726 0.22564380 -0.05976199 -0.03100435 0.02904090  507  GLU   A HG3  
7110  N  N    . LEU   A  453 ? 0.17923464 0.16328523 0.12453378 -0.06702112 -0.03249510 0.02604415  508  LEU   A N    
7111  C  CA   . LEU   A  453 ? 0.23128289 0.21283993 0.17472537 -0.06802387 -0.03362215 0.02451291  508  LEU   A CA   
7112  C  C    . LEU   A  453 ? 0.22478610 0.20556977 0.16925877 -0.07134511 -0.03429560 0.02432545  508  LEU   A C    
7113  O  O    . LEU   A  453 ? 0.27183580 0.24785876 0.21380503 -0.07263817 -0.03513440 0.02325465  508  LEU   A O    
7114  C  CB   . LEU   A  453 ? 0.25716937 0.24155861 0.20035316 -0.06743216 -0.03451805 0.02373301  508  LEU   A CB   
7115  C  CG   . LEU   A  453 ? 0.40836444 0.38921982 0.34771773 -0.06752142 -0.03543348 0.02191367  508  LEU   A CG   
7116  C  CD1  . LEU   A  453 ? 0.44233507 0.41953734 0.37889934 -0.06528000 -0.03412060 0.02123687  508  LEU   A CD1  
7117  C  CD2  . LEU   A  453 ? 0.37460101 0.35789239 0.31259191 -0.06728484 -0.03663146 0.02148913  508  LEU   A CD2  
7118  H  H    . LEU   A  453 ? 0.20860478 0.19570225 0.15526332 -0.06649470 -0.03241433 0.02630690  508  LEU   A H    
7119  H  HA   . LEU   A  453 ? 0.22916564 0.20719743 0.17036916 -0.06699289 -0.03345693 0.02401790  508  LEU   A HA   
7120  H  HB2  . LEU   A  453 ? 0.27401549 0.25976959 0.21718213 -0.06593717 -0.03385015 0.02426871  508  LEU   A HB2  
7121  H  HB3  . LEU   A  453 ? 0.27478158 0.26196334 0.22012138 -0.06850284 -0.03524049 0.02388264  508  LEU   A HB3  
7122  H  HG   . LEU   A  453 ? 0.37308681 0.35221547 0.31241217 -0.06929763 -0.03626525 0.02132457  508  LEU   A HG   
7123  H  HD11 . LEU   A  453 ? 0.43212864 0.40716302 0.36588871 -0.06512547 -0.03450174 0.01978231  508  LEU   A HD11 
7124  H  HD12 . LEU   A  453 ? 0.42802429 0.40751132 0.36524349 -0.06386146 -0.03317168 0.02189021  508  LEU   A HD12 
7125  H  HD13 . LEU   A  453 ? 0.42826471 0.40296394 0.36509171 -0.06536993 -0.03388986 0.02151594  508  LEU   A HD13 
7126  H  HD21 . LEU   A  453 ? 0.38279736 0.36857820 0.32303077 -0.06835920 -0.03780294 0.02178578  508  LEU   A HD21 
7127  H  HD22 . LEU   A  453 ? 0.38216105 0.36681756 0.31993392 -0.06594523 -0.03575977 0.02221953  508  LEU   A HD22 
7128  H  HD23 . LEU   A  453 ? 0.38819471 0.36903477 0.32307157 -0.06743471 -0.03718356 0.02017952  508  LEU   A HD23 
7129  N  N    . TYR   A  454 ? 0.20416492 0.18957382 0.15229389 -0.07287813 -0.03378624 0.02516774  509  TYR   A N    
7130  C  CA   . TYR   A  454 ? 0.20931807 0.19558877 0.15931769 -0.07655618 -0.03410230 0.02486608  509  TYR   A CA   
7131  C  C    . TYR   A  454 ? 0.25878292 0.23794273 0.20525569 -0.07849971 -0.03372677 0.02542761  509  TYR   A C    
7132  O  O    . TYR   A  454 ? 0.22459294 0.20071977 0.17012081 -0.08140494 -0.03478198 0.02454044  509  TYR   A O    
7133  C  CB   . TYR   A  454 ? 0.21892011 0.21199463 0.17363133 -0.07744259 -0.03294108 0.02546213  509  TYR   A CB   
7134  C  CG   . TYR   A  454 ? 0.22012243 0.21555910 0.17750910 -0.08161424 -0.03216870 0.02548954  509  TYR   A CG   
7135  C  CD1  . TYR   A  454 ? 0.19639891 0.19586170 0.15744060 -0.08401585 -0.03365176 0.02410087  509  TYR   A CD1  
7136  C  CD2  . TYR   A  454 ? 0.22428173 0.21856543 0.18059134 -0.08340952 -0.02992865 0.02696492  509  TYR   A CD2  
7137  C  CE1  . TYR   A  454 ? 0.23403466 0.23678638 0.19833480 -0.08842036 -0.03267378 0.02406536  509  TYR   A CE1  
7138  C  CE2  . TYR   A  454 ? 0.22130021 0.21822360 0.17986700 -0.08784046 -0.02867095 0.02714027  509  TYR   A CE2  
7139  C  CZ   . TYR   A  454 ? 0.18541005 0.18679751 0.14834282 -0.09051488 -0.02991259 0.02564480  509  TYR   A CZ   
7140  O  OH   . TYR   A  454 ? 0.22569118 0.23093817 0.19174746 -0.09542798 -0.02840028 0.02574042  509  TYR   A OH   
7141  H  H    . TYR   A  454 ? 0.20545009 0.19360554 0.15497640 -0.07174537 -0.03316600 0.02578185  509  TYR   A H    
7142  H  HA   . TYR   A  454 ? 0.21968178 0.20665222 0.17002517 -0.07720412 -0.03549621 0.02372916  509  TYR   A HA   
7143  H  HB2  . TYR   A  454 ? 0.21282563 0.20963675 0.16971914 -0.07629990 -0.03377425 0.02484825  509  TYR   A HB2  
7144  H  HB3  . TYR   A  454 ? 0.21446553 0.20717318 0.16841511 -0.07617299 -0.03177882 0.02639347  509  TYR   A HB3  
7145  H  HD1  . TYR   A  454 ? 0.20894617 0.20893264 0.17011696 -0.08288015 -0.03541068 0.02317891  509  TYR   A HD1  
7146  H  HD2  . TYR   A  454 ? 0.22185631 0.21358870 0.17566434 -0.08176900 -0.02925778 0.02790581  509  TYR   A HD2  
7147  H  HE1  . TYR   A  454 ? 0.21297416 0.21902953 0.18028456 -0.09018871 -0.03389627 0.02300664  509  TYR   A HE1  
7148  H  HE2  . TYR   A  454 ? 0.21521665 0.21090013 0.17218749 -0.08925137 -0.02702263 0.02831079  509  TYR   A HE2  
7150  N  N    . ASN   A  455 ? 0.25652647 0.23235729 0.20065424 -0.07690649 -0.03261051 0.02692800  510  ASN   A N    
7151  C  CA   . ASN   A  455 ? 0.28549451 0.25324759 0.22544259 -0.07808537 -0.03271331 0.02782466  510  ASN   A CA   
7152  C  C    . ASN   A  455 ? 0.23920068 0.19991109 0.17558327 -0.07705027 -0.03426237 0.02619724  510  ASN   A C    
7153  O  O    . ASN   A  455 ? 0.28607491 0.23996851 0.21952033 -0.07950494 -0.03502144 0.02610674  510  ASN   A O    
7154  C  CB   . ASN   A  455 ? 0.27960795 0.24552381 0.21766198 -0.07568821 -0.03194819 0.02965725  510  ASN   A CB   
7155  C  CG   . ASN   A  455 ? 0.24096951 0.21035188 0.17994057 -0.07762516 -0.03035122 0.03139864  510  ASN   A CG   
7156  O  OD1  . ASN   A  455 ? 0.25135952 0.22282502 0.19162031 -0.08142044 -0.02939250 0.03165395  510  ASN   A OD1  
7157  N  ND2  . ASN   A  455 ? 0.25957215 0.22953826 0.19758540 -0.07515672 -0.02998729 0.03252616  510  ASN   A ND2  
7158  H  H    . ASN   A  455 ? 0.25757328 0.23593640 0.20256755 -0.07506484 -0.03201530 0.02743325  510  ASN   A H    
7159  H  HA   . ASN   A  455 ? 0.27156910 0.23932940 0.21197204 -0.08131581 -0.03233645 0.02832729  510  ASN   A HA   
7160  H  HB2  . ASN   A  455 ? 0.26822990 0.23640597 0.20718366 -0.07291050 -0.03202234 0.02919623  510  ASN   A HB2  
7161  H  HB3  . ASN   A  455 ? 0.27928269 0.23903683 0.21417077 -0.07539083 -0.03256922 0.03007819  510  ASN   A HB3  
7162  H  HD21 . ASN   A  455 ? 0.25295147 0.22128162 0.19015092 -0.07266021 -0.03073062 0.03240199  510  ASN   A HD21 
7163  H  HD22 . ASN   A  455 ? 0.25207502 0.22427739 0.19030970 -0.07604643 -0.02901059 0.03329323  510  ASN   A HD22 
7164  N  N    . VAL   A  456 ? 0.22830643 0.19040483 0.16457048 -0.07359499 -0.03461884 0.02473596  511  VAL   A N    
7165  C  CA   . VAL   A  456 ? 0.32032740 0.27641147 0.25298417 -0.07220425 -0.03565767 0.02267096  511  VAL   A CA   
7166  C  C    . VAL   A  456 ? 0.28733578 0.24230972 0.21948981 -0.07592553 -0.03707840 0.02106472  511  VAL   A C    
7167  O  O    . VAL   A  456 ? 0.30590856 0.25312480 0.23441413 -0.07724151 -0.03814636 0.01994789  511  VAL   A O    
7168  C  CB   . VAL   A  456 ? 0.37245309 0.33153164 0.30500266 -0.06817757 -0.03516180 0.02132541  511  VAL   A CB   
7169  C  CG1  . VAL   A  456 ? 0.36471903 0.31770104 0.29311499 -0.06655543 -0.03577383 0.01873565  511  VAL   A CG1  
7170  C  CG2  . VAL   A  456 ? 0.34520960 0.30668539 0.27929026 -0.06504689 -0.03398602 0.02280117  511  VAL   A CG2  
7171  H  H    . VAL   A  456 ? 0.24350697 0.21026489 0.18173088 -0.07218158 -0.03409484 0.02495434  511  VAL   A H    
7172  H  HA   . VAL   A  456 ? 0.30497023 0.25545853 0.23529778 -0.07161087 -0.03582336 0.02307886  511  VAL   A HA   
7173  H  HB   . VAL   A  456 ? 0.35067496 0.31442779 0.28484935 -0.06889250 -0.03524563 0.02110033  511  VAL   A HB   
7174  H  HG11 . VAL   A  456 ? 0.37364233 0.32112789 0.30029595 -0.06601001 -0.03605733 0.01884166  511  VAL   A HG11 
7175  H  HG12 . VAL   A  456 ? 0.37073696 0.32297519 0.29808769 -0.06859025 -0.03670019 0.01759425  511  VAL   A HG12 
7176  H  HG13 . VAL   A  456 ? 0.36712024 0.32229209 0.29544282 -0.06401457 -0.03499791 0.01800282  511  VAL   A HG13 
7177  H  HG21 . VAL   A  456 ? 0.35097820 0.31421030 0.28501645 -0.06285957 -0.03350494 0.02187772  511  VAL   A HG21 
7178  H  HG22 . VAL   A  456 ? 0.34607098 0.31164569 0.28245512 -0.06597214 -0.03356943 0.02408775  511  VAL   A HG22 
7179  H  HG23 . VAL   A  456 ? 0.35833848 0.31548658 0.29104692 -0.06434158 -0.03421401 0.02333104  511  VAL   A HG23 
7180  N  N    . MET   A  457 ? 0.25431386 0.21685451 0.19014549 -0.07743655 -0.03741277 0.02084702  512  MET   A N    
7181  C  CA   . MET   A  457 ? 0.27182472 0.23488963 0.20793450 -0.08070549 -0.03930411 0.01915860  512  MET   A CA   
7182  C  C    . MET   A  457 ? 0.35941258 0.31919646 0.29592395 -0.08555327 -0.03956618 0.01976018  512  MET   A C    
7183  O  O    . MET   A  457 ? 0.35073805 0.30605477 0.28514847 -0.08854797 -0.04132048 0.01811975  512  MET   A O    
7184  C  CB   . MET   A  457 ? 0.25382110 0.22603211 0.19434550 -0.08060236 -0.03990790 0.01915702  512  MET   A CB   
7185  C  CG   . MET   A  457 ? 0.28589684 0.25910640 0.22400714 -0.07673065 -0.04006619 0.01841672  512  MET   A CG   
7186  S  SD   . MET   A  457 ? 0.33352572 0.31487256 0.27479535 -0.07620237 -0.04169605 0.01850552  512  MET   A SD   
7187  C  CE   . MET   A  457 ? 0.35183036 0.33990347 0.29966402 -0.07616111 -0.04019342 0.02059082  512  MET   A CE   
7188  H  H    . MET   A  457 ? 0.25859722 0.22596410 0.19682279 -0.07629737 -0.03666836 0.02171167  512  MET   A H    
7189  H  HA   . MET   A  457 ? 0.28361526 0.24267128 0.21631220 -0.07972131 -0.04012249 0.01755042  512  MET   A HA   
7190  H  HB2  . MET   A  457 ? 0.25928181 0.23542595 0.20296386 -0.08062080 -0.03879172 0.02054028  512  MET   A HB2  
7191  H  HB3  . MET   A  457 ? 0.26580209 0.23933983 0.20745718 -0.08308047 -0.04138491 0.01823482  512  MET   A HB3  
7192  H  HG2  . MET   A  457 ? 0.29059413 0.25953835 0.22499591 -0.07651841 -0.04077009 0.01691888  512  MET   A HG2  
7193  H  HG3  . MET   A  457 ? 0.28333324 0.25626272 0.22120006 -0.07455647 -0.03857293 0.01935785  512  MET   A HG3  
7194  H  HE1  . MET   A  457 ? 0.34312776 0.33009490 0.29019457 -0.07452512 -0.03861894 0.02150829  512  MET   A HE1  
7195  H  HE2  . MET   A  457 ? 0.34591001 0.33459899 0.29584953 -0.07847122 -0.04001010 0.02064309  512  MET   A HE2  
7196  H  HE3  . MET   A  457 ? 0.34273148 0.33486211 0.29260623 -0.07547427 -0.04116034 0.02065783  512  MET   A HE3  
7197  N  N    . CYS   A  458 ? 0.26317018 0.22496229 0.20188679 -0.08667372 -0.03776352 0.02210661  513  CYS   A N    
7198  C  CA   . CYS   A  458 ? 0.26009849 0.21838541 0.19835749 -0.09160829 -0.03740313 0.02321462  513  CYS   A CA   
7199  C  C    . CYS   A  458 ? 0.26873845 0.21440490 0.20035604 -0.09181122 -0.03830883 0.02310578  513  CYS   A C    
7200  O  O    . CYS   A  458 ? 0.30535033 0.24561903 0.23508999 -0.09627103 -0.03948221 0.02248413  513  CYS   A O    
7201  C  CB   . CYS   A  458 ? 0.28816366 0.25103462 0.22892523 -0.09244077 -0.03494136 0.02574194  513  CYS   A CB   
7202  S  SG   . CYS   A  458 ? 0.29589632 0.27287921 0.24510419 -0.09388907 -0.03396600 0.02531234  513  CYS   A SG   
7203  H  H    . CYS   A  458 ? 0.27442461 0.23972249 0.21462381 -0.08454260 -0.03669443 0.02303823  513  CYS   A H    
7204  H  HA   . CYS   A  458 ? 0.26852864 0.22985676 0.20917445 -0.09457842 -0.03828670 0.02223730  513  CYS   A HA   
7205  H  HB2  . CYS   A  458 ? 0.28032809 0.24235716 0.21975054 -0.08910187 -0.03432606 0.02650649  513  CYS   A HB2  
7206  H  HB3  . CYS   A  458 ? 0.28814831 0.24682391 0.22696564 -0.09544858 -0.03447814 0.02684507  513  CYS   A HB3  
7208  N  N    . ASP   A  459 ? 0.26021111 0.20125461 0.18856686 -0.08692710 -0.03794645 0.02358473  514  ASP   A N    
7209  C  CA   . ASP   A  459 ? 0.29590499 0.22491127 0.21823540 -0.08560845 -0.03900652 0.02328890  514  ASP   A CA   
7210  C  C    . ASP   A  459 ? 0.31900728 0.24309048 0.23855905 -0.08579668 -0.04090315 0.01992100  514  ASP   A C    
7211  O  O    . ASP   A  459 ? 0.32723510 0.24095398 0.24219033 -0.08786924 -0.04227406 0.01924202  514  ASP   A O    
7212  C  CB   . ASP   A  459 ? 0.34772086 0.27491102 0.26858756 -0.07951836 -0.03844731 0.02405837  514  ASP   A CB   
7213  C  CG   . ASP   A  459 ? 0.46586448 0.39446664 0.38721848 -0.07955739 -0.03725419 0.02747240  514  ASP   A CG   
7214  O  OD1  . ASP   A  459 ? 0.41167054 0.34123507 0.33343741 -0.08434088 -0.03647418 0.02933317  514  ASP   A OD1  
7215  O  OD2  . ASP   A  459 ? 0.40620130 0.33588803 0.32772118 -0.07504566 -0.03700852 0.02809965  514  ASP   A OD2  
7216  H  H    . ASP   A  459 ? 0.26231918 0.20797384 0.19249329 -0.08422896 -0.03710866 0.02404447  514  ASP   A H    
7217  H  HA   . ASP   A  459 ? 0.30741417 0.23215142 0.22813568 -0.08876929 -0.03898953 0.02476429  514  ASP   A HA   
7218  H  HB2  . ASP   A  459 ? 0.34975472 0.28242683 0.27275828 -0.07692607 -0.03801943 0.02299791  514  ASP   A HB2  
7219  H  HB3  . ASP   A  459 ? 0.36244148 0.28195596 0.27970099 -0.07795017 -0.03941589 0.02324533  514  ASP   A HB3  
7220  N  N    . LEU   A  460 ? 0.29268616 0.22349116 0.21426804 -0.08374926 -0.04109088 0.01784469  515  LEU   A N    
7221  C  CA   . LEU   A  460 ? 0.32559818 0.25218266 0.24364689 -0.08363653 -0.04282871 0.01444157  515  LEU   A CA   
7222  C  C    . LEU   A  460 ? 0.35925025 0.28355801 0.27714294 -0.09000460 -0.04476394 0.01358176  515  LEU   A C    
7223  O  O    . LEU   A  460 ? 0.29228488 0.20910038 0.20555051 -0.09094968 -0.04662264 0.01083802  515  LEU   A O    
7224  C  CB   . LEU   A  460 ? 0.36452436 0.29928160 0.28426072 -0.08093926 -0.04263580 0.01302865  515  LEU   A CB   
7225  C  CG   . LEU   A  460 ? 0.40262330 0.33795536 0.32113522 -0.07498625 -0.04093984 0.01271618  515  LEU   A CG   
7226  C  CD1  . LEU   A  460 ? 0.36936289 0.31339771 0.28955752 -0.07337254 -0.04048249 0.01219482  515  LEU   A CD1  
7227  C  CD2  . LEU   A  460 ? 0.41704366 0.34290659 0.32991701 -0.07232784 -0.04130546 0.01004862  515  LEU   A CD2  
7228  H  H    . LEU   A  460 ? 0.29642093 0.23415571 0.22114220 -0.08243175 -0.04017050 0.01857937  515  LEU   A H    
7229  H  HA   . LEU   A  460 ? 0.33874726 0.25816405 0.25300884 -0.08128347 -0.04297774 0.01354673  515  LEU   A HA   
7230  H  HB2  . LEU   A  460 ? 0.35411707 0.29597288 0.27794626 -0.08218703 -0.04231484 0.01434248  515  LEU   A HB2  
7231  H  HB3  . LEU   A  460 ? 0.36538398 0.29835522 0.28292897 -0.08208986 -0.04405089 0.01092443  515  LEU   A HB3  
7232  H  HG   . LEU   A  460 ? 0.38689935 0.32335335 0.30732656 -0.07393047 -0.03987090 0.01471843  515  LEU   A HG   
7233  H  HD11 . LEU   A  460 ? 0.37392008 0.31949252 0.29430231 -0.07019587 -0.03906097 0.01251556  515  LEU   A HD11 
7234  H  HD12 . LEU   A  460 ? 0.38064694 0.32301104 0.29796466 -0.07377800 -0.04150195 0.01013490  515  LEU   A HD12 
7235  H  HD13 . LEU   A  460 ? 0.37141168 0.32088619 0.29514050 -0.07517853 -0.04066960 0.01359562  515  LEU   A HD13 
7236  H  HD21 . LEU   A  460 ? 0.41733626 0.33749491 0.32917142 -0.07243217 -0.04149608 0.01087032  515  LEU   A HD21 
7237  H  HD22 . LEU   A  460 ? 0.41919559 0.34243104 0.32949540 -0.07406870 -0.04259775 0.00803707  515  LEU   A HD22 
7238  H  HD23 . LEU   A  460 ? 0.41268152 0.34051830 0.32530504 -0.06869005 -0.04010968 0.00938535  515  LEU   A HD23 
7239  N  N    . LEU   A  461 ? 0.33022726 0.26132724 0.25329161 -0.09437009 -0.04423791 0.01566452  516  LEU   A N    
7240  C  CA   . LEU   A  461 ? 0.32005692 0.25155944 0.24474764 -0.10099956 -0.04585409 0.01497142  516  LEU   A CA   
7241  C  C    . LEU   A  461 ? 0.33663803 0.26192886 0.26009542 -0.10580675 -0.04501982 0.01732677  516  LEU   A C    
7242  O  O    . LEU   A  461 ? 0.33454102 0.26118174 0.26021433 -0.11222486 -0.04574341 0.01730684  516  LEU   A O    
7243  C  CB   . LEU   A  461 ? 0.29177088 0.23719805 0.22424808 -0.10275646 -0.04586355 0.01520431  516  LEU   A CB   
7244  C  CG   . LEU   A  461 ? 0.28765059 0.23879595 0.22083080 -0.09917641 -0.04735383 0.01319085  516  LEU   A CG   
7245  C  CD1  . LEU   A  461 ? 0.27440286 0.23890822 0.21543580 -0.09904692 -0.04702285 0.01421874  516  LEU   A CD1  
7246  C  CD2  . LEU   A  461 ? 0.31459159 0.26145566 0.24423921 -0.10168725 -0.05070965 0.00994389  516  LEU   A CD2  
7247  H  H    . LEU   A  461 ? 0.32529128 0.26146230 0.25122976 -0.09323376 -0.04276309 0.01741929  516  LEU   A H    
7248  H  HA   . LEU   A  461 ? 0.32665721 0.25335622 0.24807470 -0.10142640 -0.04765157 0.01269201  516  LEU   A HA   
7249  H  HB2  . LEU   A  461 ? 0.29061559 0.24050424 0.22597215 -0.10191982 -0.04395541 0.01716752  516  LEU   A HB2  
7250  H  HB3  . LEU   A  461 ? 0.29963237 0.24613261 0.23399729 -0.10737602 -0.04682295 0.01482926  516  LEU   A HB3  
7251  H  HG   . LEU   A  461 ? 0.28892374 0.23755959 0.21927094 -0.09501413 -0.04645001 0.01322672  516  LEU   A HG   
7252  H  HD11 . LEU   A  461 ? 0.27250606 0.23948224 0.21304202 -0.09617846 -0.04784962 0.01343405  516  LEU   A HD11 
7253  H  HD12 . LEU   A  461 ? 0.27657932 0.24471021 0.22097860 -0.10279689 -0.04817472 0.01373281  516  LEU   A HD12 
7254  H  HD13 . LEU   A  461 ? 0.27114847 0.23789948 0.21416329 -0.09805825 -0.04490840 0.01607031  516  LEU   A HD13 
7255  H  HD21 . LEU   A  461 ? 0.31567323 0.25366423 0.23999706 -0.10105645 -0.05085951 0.00898419  516  LEU   A HD21 
7256  H  HD22 . LEU   A  461 ? 0.31085759 0.26004112 0.24344763 -0.10611337 -0.05176449 0.00982709  516  LEU   A HD22 
7257  H  HD23 . LEU   A  461 ? 0.30617481 0.25678453 0.23578009 -0.09952983 -0.05171129 0.00889522  516  LEU   A HD23 
7258  N  N    . GLY   A  462 ? 0.33998501 0.25875223 0.25990829 -0.10303185 -0.04357713 0.01952912  517  GLY   A N    
7259  C  CA   . GLY   A  462 ? 0.31853837 0.23076275 0.23611198 -0.10767970 -0.04279967 0.02231789  517  GLY   A CA   
7260  C  C    . GLY   A  462 ? 0.30466712 0.22769979 0.22834897 -0.11224102 -0.04051764 0.02461860  517  GLY   A C    
7261  O  O    . GLY   A  462 ? 0.33778933 0.25760391 0.26057708 -0.11859025 -0.04002001 0.02614816  517  GLY   A O    
7262  H  H    . GLY   A  462 ? 0.33020085 0.24851015 0.24899572 -0.09836754 -0.04316465 0.01937761  517  GLY   A H    
7263  H  HA2  . GLY   A  462 ? 0.32527453 0.23197600 0.23950413 -0.10459059 -0.04233562 0.02366470  517  GLY   A HA2  
7264  H  HA3  . GLY   A  462 ? 0.33204871 0.23727599 0.24670231 -0.11101004 -0.04429156 0.02134565  517  GLY   A HA3  
7265  N  N    . LEU   A  463 ? 0.30831787 0.24387217 0.23799339 -0.10914529 -0.03903503 0.02470672  518  LEU   A N    
7266  C  CA   . LEU   A  463 ? 0.30166468 0.24825253 0.23747200 -0.11231457 -0.03656984 0.02632759  518  LEU   A CA   
7267  C  C    . LEU   A  463 ? 0.30258068 0.24855328 0.23630047 -0.10977843 -0.03406148 0.02928380  518  LEU   A C    
7268  O  O    . LEU   A  463 ? 0.33399433 0.27676469 0.26493558 -0.10395014 -0.03441929 0.02947137  518  LEU   A O    
7269  C  CB   . LEU   A  463 ? 0.31551424 0.27562940 0.25895685 -0.11010607 -0.03678177 0.02446152  518  LEU   A CB   
7270  C  CG   . LEU   A  463 ? 0.33886135 0.30214918 0.28525561 -0.11241647 -0.03975744 0.02146630  518  LEU   A CG   
7271  C  CD1  . LEU   A  463 ? 0.27703285 0.25152776 0.22921503 -0.10857195 -0.04047207 0.02011681  518  LEU   A CD1  
7272  C  CD2  . LEU   A  463 ? 0.38859522 0.35459092 0.33845586 -0.11998463 -0.03983510 0.02137792  518  LEU   A CD2  
7273  H  H    . LEU   A  463 ? 0.30001175 0.23707741 0.22979525 -0.10483646 -0.03950437 0.02362544  518  LEU   A H    
7274  H  HA   . LEU   A  463 ? 0.31257540 0.25831479 0.24882133 -0.11758840 -0.03641505 0.02670635  518  LEU   A HA   
7275  H  HB2  . LEU   A  463 ? 0.30927509 0.26961392 0.25181267 -0.10530557 -0.03682919 0.02429127  518  LEU   A HB2  
7276  H  HB3  . LEU   A  463 ? 0.31023857 0.27743444 0.25774449 -0.11167253 -0.03496629 0.02539124  518  LEU   A HB3  
7277  H  HG   . LEU   A  463 ? 0.33616647 0.29166669 0.27778405 -0.11121437 -0.04140548 0.02037682  518  LEU   A HG   
7278  H  HD11 . LEU   A  463 ? 0.29268336 0.26778495 0.24534073 -0.10931221 -0.04278713 0.01828652  518  LEU   A HD11 
7279  H  HD12 . LEU   A  463 ? 0.28733593 0.26975971 0.24473697 -0.10982843 -0.03913961 0.02071068  518  LEU   A HD12 
7280  H  HD13 . LEU   A  463 ? 0.28777343 0.26082161 0.23782642 -0.10411012 -0.04004062 0.02045632  518  LEU   A HD13 
7281  H  HD21 . LEU   A  463 ? 0.38020545 0.33780527 0.32556784 -0.12268975 -0.03956389 0.02238460  518  LEU   A HD21 
7282  H  HD22 . LEU   A  463 ? 0.36840677 0.34257582 0.32321212 -0.12115580 -0.03793922 0.02225146  518  LEU   A HD22 
7283  H  HD23 . LEU   A  463 ? 0.37339455 0.34142205 0.32504159 -0.12121797 -0.04209530 0.01939108  518  LEU   A HD23 
7284  N  N    . LYS   A  464 ? 0.33201706 0.28148928 0.26705694 -0.11445855 -0.03151680 0.03144223  519  LYS   A N    
7285  C  CA   . LYS   A  464 ? 0.31780678 0.26985037 0.25183403 -0.11261596 -0.02888755 0.03387678  519  LYS   A CA   
7286  C  C    . LYS   A  464 ? 0.30899766 0.27446374 0.25021076 -0.10893336 -0.02764483 0.03250442  519  LYS   A C    
7287  O  O    . LYS   A  464 ? 0.32597649 0.30185905 0.27419239 -0.11142508 -0.02677711 0.03112638  519  LYS   A O    
7288  C  CB   . LYS   A  464 ? 0.40990293 0.36098051 0.34217513 -0.11942437 -0.02639788 0.03632493  519  LYS   A CB   
7289  C  CG   . LYS   A  464 ? 0.67005491 0.60671437 0.59487462 -0.12408414 -0.02790371 0.03784505  519  LYS   A CG   
7290  C  CD   . LYS   A  464 ? 0.93360811 0.87268490 0.85961586 -0.13331704 -0.02553936 0.03921842  519  LYS   A CD   
7291  C  CE   . LYS   A  464 ? 0.84679866 0.77272701 0.76710588 -0.13886800 -0.02762099 0.03982132  519  LYS   A CE   
7292  N  NZ   . LYS   A  464 ? 1.01454604 0.92422158 0.92396504 -0.13747783 -0.02865328 0.04297123  519  LYS   A NZ   
7293  H  H    . LYS   A  464 ? 0.32940155 0.28002980 0.26601049 -0.11920340 -0.03135710 0.03126586  519  LYS   A H    
7294  H  HA   . LYS   A  464 ? 0.33724892 0.28233877 0.26660579 -0.10934059 -0.02970457 0.03475391  519  LYS   A HA   
7295  H  HB2  . LYS   A  464 ? 0.42577976 0.38536975 0.36364418 -0.12240151 -0.02525968 0.03532631  519  LYS   A HB2  
7296  H  HB3  . LYS   A  464 ? 0.42588264 0.37741911 0.35616475 -0.11817770 -0.02477711 0.03800167  519  LYS   A HB3  
7297  H  HG2  . LYS   A  464 ? 0.64183378 0.57073808 0.56083262 -0.12211341 -0.02816857 0.03974628  519  LYS   A HG2  
7298  H  HG3  . LYS   A  464 ? 0.63106847 0.56419271 0.55581665 -0.12317134 -0.03022048 0.03602325  519  LYS   A HG3  
7299  H  HD2  . LYS   A  464 ? 0.83387458 0.78343308 0.76695240 -0.13469028 -0.02477914 0.03743769  519  LYS   A HD2  
7300  H  HD3  . LYS   A  464 ? 0.84600043 0.78534859 0.76960516 -0.13445447 -0.02326936 0.04145233  519  LYS   A HD3  
7301  H  HE2  . LYS   A  464 ? 0.90241629 0.82699382 0.82411373 -0.13737258 -0.03003253 0.03747104  519  LYS   A HE2  
7302  H  HE3  . LYS   A  464 ? 0.90697265 0.83621931 0.82926762 -0.14504072 -0.02603776 0.04038945  519  LYS   A HE3  
7303  H  HZ1  . LYS   A  464 ? 0.95824921 0.86483687 0.86627269 -0.13188434 -0.03032730 0.04217403  519  LYS   A HZ1  
7304  H  HZ2  . LYS   A  464 ? 0.96250832 0.87335616 0.87008148 -0.13843094 -0.02660253 0.04519248  519  LYS   A HZ2  
7305  H  HZ3  . LYS   A  464 ? 0.97159773 0.87291634 0.87733108 -0.14124031 -0.02977788 0.04348934  519  LYS   A HZ3  
7306  N  N    . PRO   A  465 ? 0.30768630 0.27337557 0.24783948 -0.10269608 -0.02791299 0.03255982  520  PRO   A N    
7307  C  CA   . PRO   A  465 ? 0.32484055 0.30153456 0.27096164 -0.09933361 -0.02700673 0.03133816  520  PRO   A CA   
7308  C  C    . PRO   A  465 ? 0.27382606 0.25858432 0.22315076 -0.10178655 -0.02374529 0.03215126  520  PRO   A C    
7309  O  O    . PRO   A  465 ? 0.23282290 0.21350709 0.17760244 -0.10432522 -0.02188814 0.03437874  520  PRO   A O    
7310  C  CB   . PRO   A  465 ? 0.39452747 0.36754465 0.33732563 -0.09339440 -0.02777969 0.03180154  520  PRO   A CB   
7311  C  CG   . PRO   A  465 ? 0.42881134 0.39008990 0.36533099 -0.09274538 -0.02966222 0.03239267  520  PRO   A CG   
7312  C  CD   . PRO   A  465 ? 0.41019928 0.36582091 0.34383762 -0.09860490 -0.02928918 0.03364985  520  PRO   A CD   
7313  H  HA   . PRO   A  465 ? 0.31715637 0.29769278 0.26689535 -0.09909155 -0.02823171 0.02958265  520  PRO   A HA   
7314  H  HB2  . PRO   A  465 ? 0.37992018 0.35407224 0.32176667 -0.09280773 -0.02636164 0.03301357  520  PRO   A HB2  
7315  H  HB3  . PRO   A  465 ? 0.37612829 0.35305417 0.32169086 -0.09071391 -0.02856559 0.03042772  520  PRO   A HB3  
7316  H  HG2  . PRO   A  465 ? 0.41579828 0.37397790 0.34950536 -0.09016299 -0.02966426 0.03349539  520  PRO   A HG2  
7317  H  HG3  . PRO   A  465 ? 0.41500658 0.37545714 0.35207701 -0.09117620 -0.03114791 0.03079769  520  PRO   A HG3  
7318  H  HD2  . PRO   A  465 ? 0.39217374 0.34444904 0.32240835 -0.09938116 -0.02834359 0.03566308  520  PRO   A HD2  
7319  H  HD3  . PRO   A  465 ? 0.39299631 0.34218082 0.32412940 -0.09891961 -0.03093155 0.03304129  520  PRO   A HD3  
7320  N  N    . ALA   A  466 ? 0.23617223 0.23204900 0.19290382 -0.10078264 -0.02312250 0.03027257  521  ALA   A N    
7321  C  CA   . ALA   A  466 ? 0.26599014 0.27024794 0.22604732 -0.10111433 -0.01990488 0.03032153  521  ALA   A CA   
7322  C  C    . ALA   A  466 ? 0.25728720 0.25878108 0.21304819 -0.09666123 -0.01922749 0.03134949  521  ALA   A C    
7323  O  O    . ALA   A  466 ? 0.26458827 0.26109993 0.21764176 -0.09254413 -0.02144142 0.03142757  521  ALA   A O    
7324  C  CB   . ALA   A  466 ? 0.26511881 0.28106502 0.23424789 -0.09973294 -0.02014510 0.02773692  521  ALA   A CB   
7325  H  H    . ALA   A  466 ? 0.24829505 0.24638906 0.20788261 -0.09967624 -0.02484185 0.02881954  521  ALA   A H    
7326  H  HA   . ALA   A  466 ? 0.26376066 0.26777792 0.22275808 -0.10518647 -0.01806327 0.03131356  521  ALA   A HA   
7327  H  HB1  . ALA   A  466 ? 0.26194930 0.28337699 0.23331904 -0.09956577 -0.01787090 0.02748246  521  ALA   A HB1  
7328  H  HB2  . ALA   A  466 ? 0.26493141 0.28328341 0.23714626 -0.10272832 -0.02076922 0.02702782  521  ALA   A HB2  
7329  H  HB3  . ALA   A  466 ? 0.25948805 0.27497274 0.22901024 -0.09599757 -0.02205109 0.02699740  521  ALA   A HB3  
7330  N  N    . PRO   A  467 ? 0.23983188 0.24465919 0.19463044 -0.09750147 -0.01608993 0.03203947  522  PRO   A N    
7331  C  CA   . PRO   A  467 ? 0.30707091 0.30941373 0.25768885 -0.09344620 -0.01588097 0.03272278  522  PRO   A CA   
7332  C  C    . PRO   A  467 ? 0.26947358 0.27529421 0.22396900 -0.08807389 -0.01774512 0.03083681  522  PRO   A C    
7333  O  O    . PRO   A  467 ? 0.24023177 0.25406867 0.20126729 -0.08714010 -0.01740312 0.02878336  522  PRO   A O    
7334  C  CB   . PRO   A  467 ? 0.27999926 0.28743753 0.23008606 -0.09560783 -0.01196705 0.03287068  522  PRO   A CB   
7335  C  CG   . PRO   A  467 ? 0.33661771 0.34650537 0.28842619 -0.10197647 -0.00984180 0.03337355  522  PRO   A CG   
7336  C  CD   . PRO   A  467 ? 0.28740817 0.29878768 0.24489440 -0.10247527 -0.01255058 0.03199216  522  PRO   A CD   
7337  H  HA   . PRO   A  467 ? 0.28480780 0.27979043 0.23011357 -0.09330627 -0.01695271 0.03434455  522  PRO   A HA   
7338  H  HB2  . PRO   A  467 ? 0.29217046 0.30590993 0.24641785 -0.09348833 -0.01120632 0.03110533  522  PRO   A HB2  
7339  H  HB3  . PRO   A  467 ? 0.30012110 0.30287504 0.24451801 -0.09532428 -0.01161417 0.03435755  522  PRO   A HB3  
7340  H  HG2  . PRO   A  467 ? 0.31287169 0.32981384 0.26779249 -0.10316732 -0.00715450 0.03238749  522  PRO   A HG2  
7341  H  HG3  . PRO   A  467 ? 0.31958669 0.32292065 0.26556215 -0.10452820 -0.00955734 0.03549929  522  PRO   A HG3  
7342  H  HD2  . PRO   A  467 ? 0.28074872 0.30021858 0.24465384 -0.10195687 -0.01206143 0.03009755  522  PRO   A HD2  
7343  H  HD3  . PRO   A  467 ? 0.28974506 0.29790568 0.24568659 -0.10639365 -0.01253906 0.03297967  522  PRO   A HD3  
7344  N  N    . ASN   A  468 ? 0.29814857 0.29789397 0.24883775 -0.08470124 -0.01991409 0.03157205  523  ASN   A N    
7345  C  CA   . ASN   A  468 ? 0.29139119 0.29316887 0.24487017 -0.08040432 -0.02176181 0.03019143  523  ASN   A CA   
7346  C  C    . ASN   A  468 ? 0.25884032 0.25627080 0.20802554 -0.07738189 -0.02258641 0.03114004  523  ASN   A C    
7347  O  O    . ASN   A  468 ? 0.29320160 0.28626019 0.23741603 -0.07828528 -0.02208424 0.03279015  523  ASN   A O    
7348  C  CB   . ASN   A  468 ? 0.23978236 0.24021429 0.19515333 -0.08010422 -0.02420097 0.02942613  523  ASN   A CB   
7349  C  CG   . ASN   A  468 ? 0.29288489 0.28478539 0.24314298 -0.08015441 -0.02564802 0.03063478  523  ASN   A CG   
7350  O  OD1  . ASN   A  468 ? 0.22005129 0.20862824 0.16815138 -0.07695886 -0.02693833 0.03083593  523  ASN   A OD1  
7351  N  ND2  . ASN   A  468 ? 0.25991592 0.24806841 0.20817536 -0.08379349 -0.02535299 0.03142033  523  ASN   A ND2  
7352  H  H    . ASN   A  468 ? 0.29384363 0.28808483 0.24009085 -0.08517429 -0.02025596 0.03302393  523  ASN   A H    
7353  H  HA   . ASN   A  468 ? 0.27145380 0.27865541 0.22846182 -0.07975525 -0.02091672 0.02899434  523  ASN   A HA   
7354  H  HB2  . ASN   A  468 ? 0.25676924 0.25905317 0.21390329 -0.07763204 -0.02519455 0.02860200  523  ASN   A HB2  
7355  H  HB3  . ASN   A  468 ? 0.26130795 0.26469100 0.21947111 -0.08231921 -0.02391276 0.02880338  523  ASN   A HB3  
7356  H  HD21 . ASN   A  468 ? 0.27233618 0.26301882 0.22180092 -0.08633461 -0.02402386 0.03155155  523  ASN   A HD21 
7357  H  HD22 . ASN   A  468 ? 0.27368852 0.25666457 0.21934292 -0.08377479 -0.02643934 0.03177977  523  ASN   A HD22 
7358  N  N    . ASN   A  469 ? 0.26822668 0.26675510 0.21915504 -0.07407717 -0.02405996 0.03023681  524  ASN   A N    
7359  C  CA   . ASN   A  469 ? 0.26194084 0.25824475 0.21019220 -0.07159544 -0.02474708 0.03077091  524  ASN   A CA   
7360  C  C    . ASN   A  469 ? 0.28965047 0.28134441 0.23591356 -0.07008529 -0.02664522 0.03153212  524  ASN   A C    
7361  O  O    . ASN   A  469 ? 0.22180527 0.21219692 0.16650221 -0.06820371 -0.02746243 0.03200610  524  ASN   A O    
7362  C  CB   . ASN   A  469 ? 0.27459174 0.27486241 0.22579181 -0.06933911 -0.02490133 0.02933327  524  ASN   A CB   
7363  C  CG   . ASN   A  469 ? 0.32184041 0.32677275 0.27518076 -0.07006406 -0.02289798 0.02815174  524  ASN   A CG   
7364  O  OD1  . ASN   A  469 ? 0.20641878 0.21571212 0.16427216 -0.06913420 -0.02296626 0.02664039  524  ASN   A OD1  
7365  N  ND2  . ASN   A  469 ? 0.24765298 0.25188720 0.19763964 -0.07153792 -0.02110330 0.02873953  524  ASN   A ND2  
7366  H  H    . ASN   A  469 ? 0.26097989 0.26177895 0.21481115 -0.07355447 -0.02474281 0.02929750  524  ASN   A H    
7367  H  HA   . ASN   A  469 ? 0.27382055 0.26905185 0.21944503 -0.07240707 -0.02385178 0.03150472  524  ASN   A HA   
7368  H  HB2  . ASN   A  469 ? 0.27863792 0.27969033 0.23192018 -0.06858260 -0.02590371 0.02881224  524  ASN   A HB2  
7369  H  HB3  . ASN   A  469 ? 0.28025535 0.27902955 0.22968686 -0.06815782 -0.02539334 0.02965180  524  ASN   A HB3  
7370  H  HD21 . ASN   A  469 ? 0.27984327 0.28065366 0.22644013 -0.07204480 -0.02145245 0.02996222  524  ASN   A HD21 
7371  N  N    . GLY   A  470 ? 0.21055630 0.20005532 0.15704031 -0.07099392 -0.02732937 0.03140956  525  GLY   A N    
7372  C  CA   . GLY   A  470 ? 0.24706118 0.23146743 0.19112121 -0.06969687 -0.02869702 0.03188325  525  GLY   A CA   
7373  C  C    . GLY   A  470 ? 0.27875978 0.25819871 0.21854240 -0.07000197 -0.02887460 0.03366435  525  GLY   A C    
7374  O  O    . GLY   A  470 ? 0.28635931 0.26545328 0.22424912 -0.07235352 -0.02770388 0.03466681  525  GLY   A O    
7375  H  H    . GLY   A  470 ? 0.23505580 0.22640124 0.18338209 -0.07235821 -0.02699567 0.03081400  525  GLY   A H    
7376  H  HA2  . GLY   A  470 ? 0.24104789 0.22648536 0.18589140 -0.06770613 -0.02925345 0.03148600  525  GLY   A HA2  
7377  H  HA3  . GLY   A  470 ? 0.24490422 0.22794008 0.18917581 -0.07055765 -0.02906490 0.03137365  525  GLY   A HA3  
7378  N  N    . THR   A  471 ? 0.26994824 0.24605590 0.20824018 -0.06740792 -0.03034435 0.03402824  526  THR   A N    
7379  C  CA   . THR   A  471 ? 0.27915412 0.24930173 0.21314985 -0.06698919 -0.03143043 0.03578266  526  THR   A CA   
7380  C  C    . THR   A  471 ? 0.25706616 0.22088057 0.18933818 -0.06683652 -0.03242532 0.03556657  526  THR   A C    
7381  O  O    . THR   A  471 ? 0.26284873 0.22604589 0.19642885 -0.06399576 -0.03333263 0.03428511  526  THR   A O    
7382  C  CB   . THR   A  471 ? 0.32534322 0.29667014 0.25954199 -0.06381433 -0.03280106 0.03612966  526  THR   A CB   
7383  O  OG1  . THR   A  471 ? 0.27246958 0.24895865 0.20789690 -0.06432550 -0.03198649 0.03595047  526  THR   A OG1  
7384  C  CG2  . THR   A  471 ? 0.30987269 0.27517107 0.23955384 -0.06291804 -0.03458199 0.03809648  526  THR   A CG2  
7385  H  H    . THR   A  471 ? 0.26999483 0.24769863 0.21004075 -0.06574282 -0.03074161 0.03315706  526  THR   A H    
7386  H  HA   . THR   A  471 ? 0.28322941 0.25258964 0.21515062 -0.06906822 -0.03068882 0.03681181  526  THR   A HA   
7387  H  HB   . THR   A  471 ? 0.29940546 0.27197886 0.23585872 -0.06192808 -0.03322640 0.03507570  526  THR   A HB   
7389  H  HG21 . THR   A  471 ? 0.31530514 0.28238574 0.24561903 -0.06105108 -0.03562448 0.03823794  526  THR   A HG21 
7390  H  HG22 . THR   A  471 ? 0.31950402 0.28294304 0.24618313 -0.06515126 -0.03398837 0.03927856  526  THR   A HG22 
7391  H  HG23 . THR   A  471 ? 0.31948429 0.28079197 0.24840751 -0.06197361 -0.03539929 0.03803687  526  THR   A HG23 
7392  N  N    . HIS   A  472 ? 0.27095819 0.23009244 0.20013043 -0.07019381 -0.03202768 0.03665536  527  HIS   A N    
7393  C  CA   . HIS   A  472 ? 0.25413179 0.20671076 0.18145847 -0.07113313 -0.03287670 0.03614844  527  HIS   A CA   
7394  C  C    . HIS   A  472 ? 0.26914841 0.21424094 0.19301620 -0.06766599 -0.03504511 0.03690892  527  HIS   A C    
7395  O  O    . HIS   A  472 ? 0.27209049 0.21317402 0.19212107 -0.06752091 -0.03592527 0.03922451  527  HIS   A O    
7396  C  CB   . HIS   A  472 ? 0.28358096 0.23328361 0.20851000 -0.07640314 -0.03180980 0.03739350  527  HIS   A CB   
7397  C  CG   . HIS   A  472 ? 0.26772311 0.21236254 0.19183713 -0.07877183 -0.03244936 0.03634622  527  HIS   A CG   
7398  N  ND1  . HIS   A  472 ? 0.29389590 0.23584923 0.21615596 -0.08416478 -0.03157031 0.03743697  527  HIS   A ND1  
7399  C  CD2  . HIS   A  472 ? 0.33695638 0.27961296 0.26198503 -0.07678232 -0.03370025 0.03405969  527  HIS   A CD2  
7400  C  CE1  . HIS   A  472 ? 0.32680368 0.26446059 0.24884576 -0.08548165 -0.03274003 0.03582314  527  HIS   A CE1  
7401  N  NE2  . HIS   A  472 ? 0.27176452 0.20949064 0.19510880 -0.08088509 -0.03406781 0.03362060  527  HIS   A NE2  
7402  H  H    . HIS   A  472 ? 0.26505303 0.22491482 0.19299105 -0.07217118 -0.03113670 0.03769373  527  HIS   A H    
7403  H  HA   . HIS   A  472 ? 0.26205111 0.21715881 0.19197847 -0.07055258 -0.03278675 0.03440704  527  HIS   A HA   
7404  H  HB2  . HIS   A  472 ? 0.26848459 0.22411028 0.19599666 -0.07803652 -0.03033457 0.03709253  527  HIS   A HB2  
7405  H  HB3  . HIS   A  472 ? 0.27794719 0.22336137 0.19906536 -0.07697862 -0.03209795 0.03928424  527  HIS   A HB3  
7407  H  HD2  . HIS   A  472 ? 0.30239043 0.24663985 0.22871317 -0.07342833 -0.03416923 0.03293685  527  HIS   A HD2  
7408  H  HE1  . HIS   A  472 ? 0.31156862 0.24657281 0.23253718 -0.08931074 -0.03258453 0.03610897  527  HIS   A HE1  
7410  N  N    . GLY   A  473 ? 0.26192802 0.20570941 0.18719631 -0.06449956 -0.03594321 0.03481428  528  GLY   A N    
7411  C  CA   . GLY   A  473 ? 0.25569060 0.19379136 0.17915857 -0.06007805 -0.03796061 0.03477307  528  GLY   A CA   
7412  C  C    . GLY   A  473 ? 0.25745431 0.20285895 0.18566017 -0.05564407 -0.03787262 0.03313167  528  GLY   A C    
7413  O  O    . GLY   A  473 ? 0.27389431 0.21704409 0.20257804 -0.05142610 -0.03902719 0.03191852  528  GLY   A O    
7414  H  H    . GLY   A  473 ? 0.25929388 0.20598176 0.18670346 -0.06497437 -0.03527179 0.03324202  528  GLY   A H    
7415  H  HA2  . GLY   A  473 ? 0.26583683 0.19864318 0.18763788 -0.05995709 -0.03851283 0.03378831  528  GLY   A HA2  
7416  H  HA3  . GLY   A  473 ? 0.26490235 0.19939372 0.18553869 -0.06011263 -0.03893470 0.03677125  528  GLY   A HA3  
7417  N  N    . SER   A  474 ? 0.31649667 0.27072203 0.24836594 -0.05668850 -0.03638793 0.03293237  529  SER   A N    
7418  C  CA   . SER   A  474 ? 0.26477554 0.22605923 0.20093437 -0.05355631 -0.03615266 0.03180386  529  SER   A CA   
7419  C  C    . SER   A  474 ? 0.29210967 0.25524253 0.23029181 -0.05174081 -0.03522084 0.02908830  529  SER   A C    
7420  O  O    . SER   A  474 ? 0.29386765 0.26207191 0.23534019 -0.04890117 -0.03486411 0.02798851  529  SER   A O    
7421  C  CB   . SER   A  474 ? 0.30319884 0.27171874 0.24177569 -0.05553370 -0.03499283 0.03236454  529  SER   A CB   
7422  O  OG   . SER   A  474 ? 0.36501372 0.33660039 0.30489111 -0.05791518 -0.03344126 0.03129164  529  SER   A OG   
7423  H  H    . SER   A  474 ? 0.28445023 0.24024791 0.21618035 -0.05948691 -0.03549574 0.03348015  529  SER   A H    
7424  H  HA   . SER   A  474 ? 0.28837782 0.24844342 0.22437426 -0.05119053 -0.03747406 0.03242245  529  SER   A HA   
7425  H  HB2  . SER   A  474 ? 0.30243927 0.27487826 0.24343655 -0.05371486 -0.03515235 0.03199988  529  SER   A HB2  
7426  H  HB3  . SER   A  474 ? 0.30634531 0.27350739 0.24305062 -0.05690965 -0.03531826 0.03386030  529  SER   A HB3  
7428  N  N    . LEU   A  475 ? 0.31135646 0.27094203 0.24750021 -0.05376048 -0.03472820 0.02794041  530  LEU   A N    
7429  C  CA   . LEU   A  475 ? 0.37619436 0.33612514 0.31259373 -0.05215562 -0.03397632 0.02518096  530  LEU   A CA   
7430  C  C    . LEU   A  475 ? 0.38221651 0.33294848 0.31475377 -0.05114878 -0.03504962 0.02378898  530  LEU   A C    
7431  O  O    . LEU   A  475 ? 0.33183587 0.28116763 0.26291913 -0.05144115 -0.03452998 0.02142745  530  LEU   A O    
7432  C  CB   . LEU   A  475 ? 0.26248169 0.22645789 0.19939561 -0.05523973 -0.03284343 0.02440074  530  LEU   A CB   
7433  C  CG   . LEU   A  475 ? 0.29354405 0.26518720 0.23355612 -0.05625880 -0.03190931 0.02537414  530  LEU   A CG   
7434  C  CD1  . LEU   A  475 ? 0.33912000 0.31290919 0.27887297 -0.05891854 -0.03157622 0.02461784  530  LEU   A CD1  
7435  C  CD2  . LEU   A  475 ? 0.30207223 0.27892068 0.24468122 -0.05345524 -0.03100894 0.02478067  530  LEU   A CD2  
7436  H  H    . LEU   A  475 ? 0.32032365 0.27748019 0.25479484 -0.05636014 -0.03483069 0.02880487  530  LEU   A H    
7437  H  HA   . LEU   A  475 ? 0.33612752 0.29967824 0.27470863 -0.04960940 -0.03355346 0.02451710  530  LEU   A HA   
7438  H  HB2  . LEU   A  475 ? 0.29590142 0.25697449 0.23131669 -0.05770841 -0.03331340 0.02485046  530  LEU   A HB2  
7439  H  HB3  . LEU   A  475 ? 0.29470122 0.25841030 0.23091984 -0.05420469 -0.03242798 0.02260480  530  LEU   A HB3  
7440  H  HG   . LEU   A  475 ? 0.29369250 0.26557833 0.23411715 -0.05727313 -0.03222347 0.02691195  530  LEU   A HG   
7441  H  HD11 . LEU   A  475 ? 0.31880844 0.29684943 0.26026168 -0.05919958 -0.03111004 0.02517078  530  LEU   A HD11 
7442  H  HD12 . LEU   A  475 ? 0.32640699 0.29912269 0.26479691 -0.05821800 -0.03142537 0.02310698  530  LEU   A HD12 
7443  H  HD13 . LEU   A  475 ? 0.32530493 0.29717731 0.26444170 -0.06097572 -0.03210290 0.02507129  530  LEU   A HD13 
7444  H  HD21 . LEU   A  475 ? 0.30017349 0.27648932 0.24356465 -0.05177048 -0.03156484 0.02531209  530  LEU   A HD21 
7445  H  HD22 . LEU   A  475 ? 0.30058479 0.27726147 0.24252729 -0.05236113 -0.03040206 0.02318763  530  LEU   A HD22 
7446  H  HD23 . LEU   A  475 ? 0.29446572 0.27538162 0.23855819 -0.05451855 -0.03051490 0.02541417  530  LEU   A HD23 
7447  N  N    . ASN   A  476 ? 0.29218364 0.23597626 0.22244033 -0.04978224 -0.03677755 0.02515719  531  ASN   A N    
7448  C  CA   . ASN   A  476 ? 0.36834270 0.30181155 0.29443052 -0.04846060 -0.03813639 0.02384971  531  ASN   A CA   
7449  C  C    . ASN   A  476 ? 0.32406732 0.25818712 0.25133607 -0.04340904 -0.03762274 0.02043564  531  ASN   A C    
7450  O  O    . ASN   A  476 ? 0.34710157 0.27429160 0.27097395 -0.04279673 -0.03795874 0.01803162  531  ASN   A O    
7451  C  CB   . ASN   A  476 ? 0.32656628 0.25129098 0.24918139 -0.04775739 -0.04043687 0.02633870  531  ASN   A CB   
7452  C  CG   . ASN   A  476 ? 0.34162074 0.26075977 0.26022464 -0.05358583 -0.04078405 0.02881971  531  ASN   A CG   
7453  O  OD1  . ASN   A  476 ? 0.38300353 0.30736127 0.30302724 -0.05796370 -0.03927246 0.02915138  531  ASN   A OD1  
7454  N  ND2  . ASN   A  476 ? 0.46089992 0.36919183 0.37436831 -0.05377113 -0.04282313 0.03070981  531  ASN   A ND2  
7455  H  H    . ASN   A  476 ? 0.32485867 0.26983637 0.25574633 -0.04965010 -0.03727973 0.02693654  531  ASN   A H    
7456  H  HA   . ASN   A  476 ? 0.33990201 0.27093318 0.26409543 -0.05156994 -0.03794321 0.02339081  531  ASN   A HA   
7457  H  HB2  . ASN   A  476 ? 0.33699250 0.26540554 0.26157120 -0.04608182 -0.04078569 0.02762523  531  ASN   A HB2  
7458  H  HB3  . ASN   A  476 ? 0.34748673 0.26627690 0.26831102 -0.04499949 -0.04147090 0.02504756  531  ASN   A HB3  
7459  H  HD21 . ASN   A  476 ? 0.42530227 0.32980663 0.33790189 -0.05018694 -0.04419612 0.03054199  531  ASN   A HD21 
7460  H  HD22 . ASN   A  476 ? 0.42461073 0.32940057 0.33548218 -0.05749881 -0.04283869 0.03218343  531  ASN   A HD22 
7461  N  N    . HIS   A  477 ? 0.27286696 0.21593846 0.20498951 -0.04025003 -0.03651493 0.01993401  532  HIS   A N    
7462  C  CA   . HIS   A  477 ? 0.31330723 0.25923234 0.24741477 -0.03564420 -0.03526606 0.01655507  532  HIS   A CA   
7463  C  C    . HIS   A  477 ? 0.33431628 0.28260788 0.26692808 -0.03728893 -0.03301679 0.01376736  532  HIS   A C    
7464  O  O    . HIS   A  477 ? 0.35540119 0.30600467 0.28875256 -0.03380484 -0.03142757 0.01064588  532  HIS   A O    
7465  C  CB   . HIS   A  477 ? 0.28872898 0.24500178 0.22921079 -0.03267629 -0.03456036 0.01703144  532  HIS   A CB   
7466  C  CG   . HIS   A  477 ? 0.31373155 0.27928552 0.25707293 -0.03630462 -0.03289980 0.01847525  532  HIS   A CG   
7467  N  ND1  . HIS   A  477 ? 0.37828863 0.34455469 0.32158500 -0.03964718 -0.03395648 0.02167060  532  HIS   A ND1  
7468  C  CD2  . HIS   A  477 ? 0.34469151 0.31832188 0.29043680 -0.03695558 -0.03031996 0.01711898  532  HIS   A CD2  
7469  C  CE1  . HIS   A  477 ? 0.31642261 0.29062754 0.26228994 -0.04192124 -0.03223700 0.02197063  532  HIS   A CE1  
7470  N  NE2  . HIS   A  477 ? 0.33761340 0.31626013 0.28489119 -0.04058366 -0.03011819 0.01954319  532  HIS   A NE2  
7471  H  H    . HIS   A  477 ? 0.28711632 0.23475930 0.22138678 -0.04110172 -0.03645304 0.02166612  532  HIS   A H    
7472  H  HA   . HIS   A  477 ? 0.31440058 0.25377113 0.24660206 -0.03301883 -0.03650761 0.01563531  532  HIS   A HA   
7473  H  HB2  . HIS   A  477 ? 0.30233863 0.26093078 0.24453595 -0.02948913 -0.03353160 0.01466968  532  HIS   A HB2  
7474  H  HB3  . HIS   A  477 ? 0.30227739 0.25649130 0.24321570 -0.03133221 -0.03640204 0.01862659  532  HIS   A HB3  
7476  H  HD2  . HIS   A  477 ? 0.33744279 0.31269705 0.28342003 -0.03526938 -0.02886871 0.01490856  532  HIS   A HD2  
7477  H  HE1  . HIS   A  477 ? 0.32870540 0.30485368 0.27502790 -0.04413046 -0.03244430 0.02363313  532  HIS   A HE1  
7479  N  N    . LEU   A  478 ? 0.36120635 0.30967477 0.29185230 -0.04244164 -0.03286834 0.01484593  533  LEU   A N    
7480  C  CA   . LEU   A  478 ? 0.34837872 0.29801947 0.27659270 -0.04429874 -0.03158436 0.01255524  533  LEU   A CA   
7481  C  C    . LEU   A  478 ? 0.44192743 0.38138133 0.36468524 -0.04438507 -0.03278171 0.01003771  533  LEU   A C    
7482  O  O    . LEU   A  478 ? 0.41040564 0.34947285 0.33021846 -0.04414347 -0.03180172 0.00701183  533  LEU   A O    
7483  C  CB   . LEU   A  478 ? 0.31340080 0.26725006 0.24214934 -0.04928667 -0.03163563 0.01462097  533  LEU   A CB   
7484  C  CG   . LEU   A  478 ? 0.32960242 0.29340440 0.26187164 -0.04959677 -0.02988929 0.01561931  533  LEU   A CG   
7485  C  CD1  . LEU   A  478 ? 0.35723937 0.32559633 0.29402748 -0.04746918 -0.02960987 0.01739608  533  LEU   A CD1  
7486  C  CD2  . LEU   A  478 ? 0.29445547 0.26050827 0.22672875 -0.05365897 -0.03046119 0.01719296  533  LEU   A CD2  
7487  H  H    . LEU   A  478 ? 0.34671664 0.29484639 0.27757451 -0.04476263 -0.03366702 0.01704923  533  LEU   A H    
7488  H  HA   . LEU   A  478 ? 0.35723120 0.31157562 0.28682843 -0.04221769 -0.02997040 0.01114647  533  LEU   A HA   
7489  H  HB2  . LEU   A  478 ? 0.32458976 0.27665812 0.25382930 -0.05089420 -0.03268820 0.01657396  533  LEU   A HB2  
7490  H  HB3  . LEU   A  478 ? 0.32827538 0.27965954 0.25427276 -0.05100187 -0.03195153 0.01336625  533  LEU   A HB3  
7491  H  HG   . LEU   A  478 ? 0.32539049 0.29094112 0.25670159 -0.04839076 -0.02862921 0.01380609  533  LEU   A HG   
7492  H  HD11 . LEU   A  478 ? 0.34219795 0.31621820 0.28090563 -0.04803772 -0.02856088 0.01791482  533  LEU   A HD11 
7493  H  HD12 . LEU   A  478 ? 0.34599581 0.31246394 0.28308544 -0.04863610 -0.03077966 0.01916741  533  LEU   A HD12 
7494  H  HD13 . LEU   A  478 ? 0.35003129 0.31747407 0.28735456 -0.04442663 -0.02940784 0.01618561  533  LEU   A HD13 
7495  H  HD21 . LEU   A  478 ? 0.30645427 0.27021092 0.23608448 -0.05491183 -0.03088903 0.01594080  533  LEU   A HD21 
7496  H  HD22 . LEU   A  478 ? 0.30241680 0.26706746 0.23555194 -0.05498039 -0.03138117 0.01875957  533  LEU   A HD22 
7497  H  HD23 . LEU   A  478 ? 0.29893020 0.27016553 0.23291810 -0.05380354 -0.02956797 0.01787414  533  LEU   A HD23 
7498  N  N    . LEU   A  479 ? 0.31679267 0.24759221 0.23753892 -0.04523419 -0.03497491 0.01143760  534  LEU   A N    
7499  C  CA   . LEU   A  479 ? 0.34419537 0.26423097 0.25944540 -0.04709409 -0.03660202 0.00976897  534  LEU   A CA   
7500  C  C    . LEU   A  479 ? 0.35268116 0.26311108 0.26511994 -0.04226821 -0.03769154 0.00770805  534  LEU   A C    
7501  O  O    . LEU   A  479 ? 0.34868428 0.25929511 0.26360416 -0.03826216 -0.03815374 0.00896592  534  LEU   A O    
7502  C  CB   . LEU   A  479 ? 0.39242786 0.30892342 0.30687118 -0.05253626 -0.03818412 0.01298947  534  LEU   A CB   
7503  C  CG   . LEU   A  479 ? 0.43573421 0.36176670 0.35362899 -0.05680223 -0.03728415 0.01492169  534  LEU   A CG   
7504  C  CD1  . LEU   A  479 ? 0.44038451 0.36345184 0.35783654 -0.06210584 -0.03837575 0.01765795  534  LEU   A CD1  
7505  C  CD2  . LEU   A  479 ? 0.39237618 0.32245436 0.30938834 -0.05828678 -0.03673306 0.01229921  534  LEU   A CD2  
7506  H  H    . LEU   A  479 ? 0.34511513 0.27644348 0.26763266 -0.04488481 -0.03553905 0.01357242  534  LEU   A H    
7507  H  HA   . LEU   A  479 ? 0.35041654 0.27168196 0.26411659 -0.04820978 -0.03601399 0.00780916  534  LEU   A HA   
7508  H  HB2  . LEU   A  479 ? 0.39196157 0.30620512 0.30686381 -0.05145998 -0.03883267 0.01490656  534  LEU   A HB2  
7509  H  HB3  . LEU   A  479 ? 0.39797151 0.30758891 0.30891243 -0.05441770 -0.03928243 0.01187925  534  LEU   A HB3  
7510  H  HG   . LEU   A  479 ? 0.41094285 0.34291115 0.33197016 -0.05513199 -0.03634270 0.01612963  534  LEU   A HG   
7511  H  HD11 . LEU   A  479 ? 0.43570209 0.36547691 0.35613057 -0.06376689 -0.03764190 0.01903912  534  LEU   A HD11 
7512  H  HD12 . LEU   A  479 ? 0.44528133 0.36434031 0.36046207 -0.06466486 -0.03921486 0.01649559  534  LEU   A HD12 
7513  H  HD13 . LEU   A  479 ? 0.44597626 0.36447170 0.36232746 -0.06131691 -0.03896749 0.01911596  534  LEU   A HD13 
7514  H  HD21 . LEU   A  479 ? 0.40094039 0.33437851 0.31847331 -0.05537108 -0.03552852 0.01102765  534  LEU   A HD21 
7515  H  HD22 . LEU   A  479 ? 0.41010541 0.33422005 0.32376480 -0.05945669 -0.03776183 0.01061658  534  LEU   A HD22 
7516  H  HD23 . LEU   A  479 ? 0.39786303 0.33292225 0.31694549 -0.06098666 -0.03666582 0.01361743  534  LEU   A HD23 
7517  N  N    . ARG   A  480 ? 0.42717546 0.32897764 0.33431667 -0.04240359 -0.03840371 0.00434013  535  ARG   A N    
7518  C  CA   . ARG   A  480 ? 0.38477328 0.27522326 0.28840816 -0.03785921 -0.03985931 0.00216540  535  ARG   A CA   
7519  C  C    . ARG   A  480 ? 0.39514118 0.27346233 0.29490584 -0.04117418 -0.04284130 0.00492293  535  ARG   A C    
7520  O  O    . ARG   A  480 ? 0.39226389 0.26050729 0.28944144 -0.03738898 -0.04467816 0.00466667  535  ARG   A O    
7521  C  CB   . ARG   A  480 ? 0.53614241 0.42208549 0.43521816 -0.03571149 -0.03910277 -0.00329186 535  ARG   A CB   
7522  C  CG   . ARG   A  480 ? 0.49272898 0.37221795 0.38620126 -0.04137246 -0.04039269 -0.00474031 535  ARG   A CG   
7523  C  CD   . ARG   A  480 ? 0.50336552 0.37985045 0.39195049 -0.03876627 -0.03933999 -0.01048351 535  ARG   A CD   
7524  N  NE   . ARG   A  480 ? 0.49933285 0.36715633 0.38561463 -0.03202134 -0.03951697 -0.01386891 535  ARG   A NE   
7525  C  CZ   . ARG   A  480 ? 0.65911299 0.53152323 0.54622090 -0.02587174 -0.03681272 -0.01784264 535  ARG   A CZ   
7526  N  NH1  . ARG   A  480 ? 0.58742166 0.47237909 0.47675264 -0.02612505 -0.03359848 -0.01870353 535  ARG   A NH1  
7527  N  NH2  . ARG   A  480 ? 0.55211741 0.41629875 0.43774647 -0.01925801 -0.03727617 -0.02101951 535  ARG   A NH2  
7528  H  H    . ARG   A  480 ? 0.39759815 0.30029684 0.30313298 -0.04523795 -0.03817233 0.00329793  535  ARG   A H    
7529  H  HA   . ARG   A  480 ? 0.41458219 0.30831403 0.32136422 -0.03362660 -0.03937933 0.00244311  535  ARG   A HA   
7530  H  HB2  . ARG   A  480 ? 0.49379194 0.37300035 0.39130977 -0.03166521 -0.03987438 -0.00489989 535  ARG   A HB2  
7531  H  HB3  . ARG   A  480 ? 0.48038578 0.37463284 0.38175920 -0.03401752 -0.03691746 -0.00462048 535  ARG   A HB3  
7532  H  HG2  . ARG   A  480 ? 0.49508700 0.38109013 0.39041394 -0.04527982 -0.03998695 -0.00299595 535  ARG   A HG2  
7533  H  HG3  . ARG   A  480 ? 0.51007390 0.38054824 0.40087503 -0.04313358 -0.04245408 -0.00378917 535  ARG   A HG3  
7534  H  HD2  . ARG   A  480 ? 0.49493873 0.38044047 0.38555545 -0.03799408 -0.03720229 -0.01112477 535  ARG   A HD2  
7535  H  HD3  . ARG   A  480 ? 0.50363839 0.37516934 0.38829753 -0.04263692 -0.04069061 -0.01142476 535  ARG   A HD3  
7536  H  HE   . ARG   A  480 ? 0.54205853 0.40110320 0.42631587 -0.03192769 -0.04148656 -0.01330811 535  ARG   A HE   
7537  H  HH11 . ARG   A  480 ? 0.60272634 0.48901802 0.48952800 -0.02973549 -0.03348754 -0.01905154 535  ARG   A HH11 
7538  H  HH12 . ARG   A  480 ? 0.60126901 0.49312305 0.49450099 -0.02274715 -0.03165872 -0.01889253 535  ARG   A HH12 
7539  H  HH21 . ARG   A  480 ? 0.58593118 0.45377278 0.47247994 -0.01510082 -0.03525110 -0.02389109 535  ARG   A HH21 
7540  H  HH22 . ARG   A  480 ? 0.59051740 0.44558692 0.47423559 -0.01900035 -0.03959461 -0.02025688 535  ARG   A HH22 
7541  N  N    . THR   A  481 ? 0.47787625 0.35717833 0.37721512 -0.04825171 -0.04330133 0.00755906  536  THR   A N    
7542  C  CA   . THR   A  481 ? 0.54638433 0.41611752 0.44246897 -0.05256749 -0.04544223 0.01079393  536  THR   A CA   
7543  C  C    . THR   A  481 ? 0.59238005 0.47137243 0.49246901 -0.05748161 -0.04447188 0.01491955  536  THR   A C    
7544  O  O    . THR   A  481 ? 0.60396397 0.49214518 0.50701439 -0.06076062 -0.04314978 0.01448982  536  THR   A O    
7545  C  CB   . THR   A  481 ? 0.54738116 0.40655664 0.43775234 -0.05761879 -0.04706969 0.00893804  536  THR   A CB   
7546  O  OG1  . THR   A  481 ? 0.68008232 0.53183073 0.56651878 -0.05312753 -0.04759309 0.00416286  536  THR   A OG1  
7547  C  CG2  . THR   A  481 ? 0.64229977 0.48963684 0.52843004 -0.06189296 -0.04920448 0.01233540  536  THR   A CG2  
7548  H  H    . THR   A  481 ? 0.45895344 0.34527004 0.36008486 -0.05051702 -0.04218335 0.00730482  536  THR   A H    
7549  H  HA   . THR   A  481 ? 0.54398131 0.40798229 0.43883279 -0.04928498 -0.04653120 0.01162028  536  THR   A HA   
7550  H  HB   . THR   A  481 ? 0.58019757 0.44560754 0.47223431 -0.06139520 -0.04635806 0.00872128  536  THR   A HB   
7552  H  HG21 . THR   A  481 ? 0.62093210 0.46321216 0.50424623 -0.06613379 -0.05006612 0.01134913  536  THR   A HG21 
7553  H  HG22 . THR   A  481 ? 0.62299955 0.46237803 0.50650442 -0.05810669 -0.05041242 0.01230310  536  THR   A HG22 
7554  H  HG23 . THR   A  481 ? 0.60879576 0.46145296 0.49744827 -0.06425730 -0.04853762 0.01550984  536  THR   A HG23 
7555  N  N    . ASN   A  482 ? 0.52282536 0.39856920 0.42234665 -0.05790149 -0.04532714 0.01880113  537  ASN   A N    
7556  C  CA   . ASN   A  482 ? 0.41056842 0.29404914 0.31302282 -0.06232532 -0.04423412 0.02253746  537  ASN   A CA   
7557  C  C    . ASN   A  482 ? 0.49755242 0.37303853 0.39589024 -0.06908219 -0.04512446 0.02518385  537  ASN   A C    
7558  O  O    . ASN   A  482 ? 0.57572389 0.43860066 0.46852380 -0.06880644 -0.04705730 0.02658063  537  ASN   A O    
7559  C  CB   . ASN   A  482 ? 0.38693672 0.27389085 0.29145148 -0.05790142 -0.04429750 0.02493803  537  ASN   A CB   
7560  C  CG   . ASN   A  482 ? 0.45287955 0.35163626 0.36311412 -0.05359231 -0.04263349 0.02295801  537  ASN   A CG   
7561  O  OD1  . ASN   A  482 ? 0.50630176 0.41524315 0.42032641 -0.05616344 -0.04081755 0.02296751  537  ASN   A OD1  
7562  N  ND2  . ASN   A  482 ? 0.50844967 0.40609750 0.41949773 -0.04713919 -0.04319079 0.02112532  537  ASN   A ND2  
7563  H  H    . ASN   A  482 ? 0.51632118 0.38450491 0.41320348 -0.05522263 -0.04668799 0.01905956  537  ASN   A H    
7564  H  HA   . ASN   A  482 ? 0.43203270 0.32408085 0.33787030 -0.06366578 -0.04286488 0.02168885  537  ASN   A HA   
7565  H  HB2  . ASN   A  482 ? 0.41785663 0.29684982 0.31944606 -0.05503549 -0.04591599 0.02511794  537  ASN   A HB2  
7566  H  HB3  . ASN   A  482 ? 0.40563864 0.29486963 0.31044203 -0.06090033 -0.04391286 0.02762344  537  ASN   A HB3  
7567  H  HD21 . ASN   A  482 ? 0.49740139 0.38706404 0.40553442 -0.04517474 -0.04459444 0.02053435  537  ASN   A HD21 
7568  H  HD22 . ASN   A  482 ? 0.48348266 0.38847151 0.39814478 -0.04475591 -0.04214869 0.02041828  537  ASN   A HD22 
7569  N  N    . THR   A  483 ? 0.52234125 0.40526170 0.42348710 -0.07507110 -0.04372660 0.02595149  538  THR   A N    
7570  C  CA   . THR   A  483 ? 0.63319194 0.51109231 0.53159344 -0.08217454 -0.04385537 0.02860061  538  THR   A CA   
7571  C  C    . THR   A  483 ? 0.47427106 0.35557276 0.37295169 -0.08324931 -0.04266255 0.03279905  538  THR   A C    
7572  O  O    . THR   A  483 ? 0.47667360 0.35299170 0.37196001 -0.08881173 -0.04242931 0.03564753  538  THR   A O    
7573  C  CB   . THR   A  483 ? 0.66071439 0.54575223 0.56270128 -0.08836051 -0.04298298 0.02718129  538  THR   A CB   
7574  O  OG1  . THR   A  483 ? 0.75467646 0.65436041 0.66324109 -0.08802016 -0.04090098 0.02765850  538  THR   A OG1  
7575  C  CG2  . THR   A  483 ? 0.82442629 0.70680445 0.72556627 -0.08761770 -0.04438413 0.02291494  538  THR   A CG2  
7576  H  H    . THR   A  483 ? 0.52509642 0.41655096 0.43004751 -0.07476848 -0.04264092 0.02479534  538  THR   A H    
7577  H  HA   . THR   A  483 ? 0.59303308 0.46004614 0.48662120 -0.08250804 -0.04543160 0.02857604  538  THR   A HA   
7578  H  HB   . THR   A  483 ? 0.70693213 0.58809572 0.60704255 -0.09327986 -0.04302572 0.02882162  538  THR   A HB   
7580  H  HG21 . THR   A  483 ? 0.76905787 0.65583766 0.67242688 -0.09172643 -0.04425705 0.02224348  538  THR   A HG21 
7581  H  HG22 . THR   A  483 ? 0.76431566 0.65106499 0.66718876 -0.08315379 -0.04401259 0.02133324  538  THR   A HG22 
7582  H  HG23 . THR   A  483 ? 0.78136957 0.65315092 0.67778319 -0.08753556 -0.04584970 0.02233984  538  THR   A HG23 
7583  N  N    . PHE   A  484 ? 0.53625476 0.42596620 0.43857205 -0.07826658 -0.04183819 0.03309299  539  PHE   A N    
7584  C  CA   . PHE   A  484 ? 0.54116172 0.43457514 0.44342157 -0.07873034 -0.04088220 0.03657954  539  PHE   A CA   
7585  C  C    . PHE   A  484 ? 0.47912559 0.36952007 0.37987044 -0.07209353 -0.04254733 0.03748408  539  PHE   A C    
7586  O  O    . PHE   A  484 ? 0.50517678 0.39983004 0.40945333 -0.06664129 -0.04284896 0.03499699  539  PHE   A O    
7587  C  CB   . PHE   A  484 ? 0.54935247 0.45741504 0.45815822 -0.07998206 -0.03838006 0.03612961  539  PHE   A CB   
7588  C  CG   . PHE   A  484 ? 0.34249210 0.25464183 0.25091228 -0.08047087 -0.03720951 0.03914322  539  PHE   A CG   
7589  C  CD1  . PHE   A  484 ? 0.31623191 0.22632790 0.22149891 -0.08613719 -0.03595198 0.04183352  539  PHE   A CD1  
7590  C  CD2  . PHE   A  484 ? 0.38961738 0.30764741 0.30048430 -0.07551733 -0.03730386 0.03914790  539  PHE   A CD2  
7591  C  CE1  . PHE   A  484 ? 0.34085548 0.25428808 0.24460965 -0.08656363 -0.03473452 0.04440076  539  PHE   A CE1  
7592  C  CE2  . PHE   A  484 ? 0.38560581 0.30669013 0.29525644 -0.07609199 -0.03652607 0.04165907  539  PHE   A CE2  
7593  C  CZ   . PHE   A  484 ? 0.34317347 0.26177961 0.24893063 -0.08151344 -0.03519177 0.04419079  539  PHE   A CZ   
7594  H  H    . PHE   A  484 ? 0.51530850 0.40858799 0.42000970 -0.07469557 -0.04184192 0.03099621  539  PHE   A H    
7595  H  HA   . PHE   A  484 ? 0.53585052 0.42399585 0.43453592 -0.08276505 -0.04087590 0.03867953  539  PHE   A HA   
7596  H  HB2  . PHE   A  484 ? 0.48148474 0.39178061 0.39167255 -0.08399856 -0.03756974 0.03554755  539  PHE   A HB2  
7597  H  HB3  . PHE   A  484 ? 0.47514486 0.38787448 0.38703847 -0.07647214 -0.03838943 0.03422243  539  PHE   A HB3  
7598  H  HD1  . PHE   A  484 ? 0.33610612 0.24245575 0.23994011 -0.08997733 -0.03584145 0.04189668  539  PHE   A HD1  
7599  H  HD2  . PHE   A  484 ? 0.37210464 0.29203889 0.28526446 -0.07193154 -0.03788082 0.03736893  539  PHE   A HD2  
7600  H  HE1  . PHE   A  484 ? 0.34186831 0.25409454 0.24310264 -0.09063552 -0.03352626 0.04617428  539  PHE   A HE1  
7601  H  HE2  . PHE   A  484 ? 0.36779374 0.29277602 0.27912250 -0.07299163 -0.03681165 0.04153797  539  PHE   A HE2  
7602  H  HZ   . PHE   A  484 ? 0.35081702 0.27139208 0.25515458 -0.08190261 -0.03453689 0.04572785  539  PHE   A HZ   
7603  N  N    . ARG   A  485 ? 0.46819863 0.35111034 0.36346784 -0.07276911 -0.04374672 0.04107513  540  ARG   A N    
7604  C  CA   . ARG   A  485 ? 0.57037860 0.45107540 0.46433055 -0.06676832 -0.04587327 0.04237726  540  ARG   A CA   
7605  C  C    . ARG   A  485 ? 0.40696466 0.29468763 0.30113640 -0.06808291 -0.04482177 0.04521535  540  ARG   A C    
7606  O  O    . ARG   A  485 ? 0.41660476 0.30106530 0.30602488 -0.07321211 -0.04400667 0.04824702  540  ARG   A O    
7607  C  CB   . ARG   A  485 ? 0.71927029 0.58370477 0.60551751 -0.06518368 -0.04919773 0.04418418  540  ARG   A CB   
7608  C  CG   . ARG   A  485 ? 1.00265098 0.86159992 0.88980788 -0.06019498 -0.05079018 0.04044990  540  ARG   A CG   
7609  C  CD   . ARG   A  485 ? 1.34037399 1.18137336 1.21941459 -0.06064572 -0.05365018 0.04146916  540  ARG   A CD   
7610  N  NE   . ARG   A  485 ? 1.08290231 0.91950440 0.96267456 -0.05836931 -0.05405588 0.03702826  540  ARG   A NE   
7611  C  CZ   . ARG   A  485 ? 0.89935207 0.72916412 0.77837044 -0.05112454 -0.05639334 0.03468905  540  ARG   A CZ   
7612  N  NH1  . ARG   A  485 ? 1.09820998 0.91784161 0.97274518 -0.04688766 -0.05974615 0.03708325  540  ARG   A NH1  
7613  N  NH2  . ARG   A  485 ? 1.10117698 0.93436778 0.98374993 -0.04789793 -0.05540770 0.02973689  540  ARG   A NH2  
7614  H  H    . ARG   A  485 ? 0.49901390 0.37817663 0.39117408 -0.07724982 -0.04331741 0.04283214  540  ARG   A H    
7615  H  HA   . ARG   A  485 ? 0.52745980 0.41280511 0.42545262 -0.06259871 -0.04598166 0.04002877  540  ARG   A HA   
7616  H  HB2  . ARG   A  485 ? 0.74757117 0.60608262 0.62961364 -0.07011119 -0.04889980 0.04586423  540  ARG   A HB2  
7617  H  HB3  . ARG   A  485 ? 0.73706383 0.60030407 0.62168765 -0.06251796 -0.05066133 0.04608083  540  ARG   A HB3  
7618  H  HG2  . ARG   A  485 ? 0.98076302 0.84322596 0.87077361 -0.05483460 -0.05161304 0.03948583  540  ARG   A HG2  
7619  H  HG3  . ARG   A  485 ? 0.97263932 0.83643109 0.86294639 -0.06177835 -0.04914805 0.03801372  540  ARG   A HG3  
7620  H  HD2  . ARG   A  485 ? 1.19155002 1.02853298 1.06689560 -0.06636877 -0.05308194 0.04360107  540  ARG   A HD2  
7621  H  HD3  . ARG   A  485 ? 1.19595528 1.03185749 1.07252681 -0.05685388 -0.05590595 0.04301795  540  ARG   A HD3  
7622  H  HE   . ARG   A  485 ? 1.08198500 0.92065978 0.96270698 -0.06190856 -0.05268678 0.03567069  540  ARG   A HE   
7623  H  HH11 . ARG   A  485 ? 1.04578769 0.85776728 0.91514683 -0.04990048 -0.06088959 0.04008755  540  ARG   A HH11 
7624  H  HH12 . ARG   A  485 ? 1.03619421 0.85678571 0.91291022 -0.04105126 -0.06088699 0.03570289  540  ARG   A HH12 
7625  H  HH21 . ARG   A  485 ? 1.03781247 0.86647481 0.91985112 -0.04306339 -0.05672157 0.02789021  540  ARG   A HH21 
7626  H  HH22 . ARG   A  485 ? 1.02566612 0.86559272 0.91093850 -0.05052015 -0.05345434 0.02828607  540  ARG   A HH22 
7627  N  N    . PRO   A  486 ? 0.35312539 0.25080323 0.25259930 -0.06371344 -0.04466282 0.04413315  541  PRO   A N    
7628  C  CA   . PRO   A  486 ? 0.42494297 0.32912222 0.32440516 -0.06472307 -0.04388576 0.04627467  541  PRO   A CA   
7629  C  C    . PRO   A  486 ? 0.38654733 0.28137541 0.27864724 -0.06354813 -0.04681025 0.04990525  541  PRO   A C    
7630  O  O    . PRO   A  486 ? 0.44094929 0.32814848 0.33117425 -0.05888646 -0.05002267 0.04999520  541  PRO   A O    
7631  C  CB   . PRO   A  486 ? 0.41299373 0.32836831 0.31995055 -0.06015138 -0.04356455 0.04370671  541  PRO   A CB   
7632  C  CG   . PRO   A  486 ? 0.36432570 0.27644035 0.27327815 -0.05521419 -0.04518384 0.04130888  541  PRO   A CG   
7633  C  CD   . PRO   A  486 ? 0.40117759 0.30454561 0.30669010 -0.05811926 -0.04496763 0.04064427  541  PRO   A CD   
7634  H  HA   . PRO   A  486 ? 0.39609998 0.30347696 0.29563731 -0.06902806 -0.04171754 0.04668332  541  PRO   A HA   
7635  H  HB2  . PRO   A  486 ? 0.39877293 0.31627870 0.30540392 -0.05861947 -0.04448662 0.04489166  541  PRO   A HB2  
7636  H  HB3  . PRO   A  486 ? 0.39246807 0.31454468 0.30290213 -0.06209721 -0.04143917 0.04241698  541  PRO   A HB3  
7637  H  HG2  . PRO   A  486 ? 0.38859153 0.29689509 0.29594886 -0.05190422 -0.04744984 0.04221794  541  PRO   A HG2  
7638  H  HG3  . PRO   A  486 ? 0.37459421 0.29396045 0.28851080 -0.05352250 -0.04414698 0.03918173  541  PRO   A HG3  
7639  H  HD2  . PRO   A  486 ? 0.38855377 0.28546345 0.29245535 -0.05506373 -0.04675198 0.04000349  541  PRO   A HD2  
7640  H  HD3  . PRO   A  486 ? 0.37535235 0.28327635 0.28390437 -0.05958534 -0.04328473 0.03868921  541  PRO   A HD3  
7641  N  N    . THR   A  487 ? 0.39537805 0.29051763 0.28294960 -0.06770475 -0.04571579 0.05279940  542  THR   A N    
7642  C  CA   . THR   A  487 ? 0.47194377 0.35892081 0.35158172 -0.06684936 -0.04858512 0.05656147  542  THR   A CA   
7643  C  C    . THR   A  487 ? 0.41843849 0.31475210 0.29901320 -0.06680198 -0.04778850 0.05713037  542  THR   A C    
7644  O  O    . THR   A  487 ? 0.41622066 0.32160619 0.30020535 -0.07017528 -0.04416735 0.05584926  542  THR   A O    
7645  C  CB   . THR   A  487 ? 0.50671816 0.38206565 0.37705392 -0.07281688 -0.04814940 0.06000990  542  THR   A CB   
7646  O  OG1  . THR   A  487 ? 0.62529731 0.50829941 0.49657074 -0.07889564 -0.04379848 0.06003816  542  THR   A OG1  
7647  C  CG2  . THR   A  487 ? 0.48130301 0.34695607 0.35051236 -0.07377661 -0.04886129 0.05914111  542  THR   A CG2  
7648  H  H    . THR   A  487 ? 0.40233362 0.30289939 0.29156116 -0.07109170 -0.04314495 0.05239092  542  THR   A H    
7649  H  HA   . THR   A  487 ? 0.45500374 0.33807716 0.33477223 -0.06227299 -0.05146350 0.05633030  542  THR   A HA   
7650  H  HB   . THR   A  487 ? 0.52562588 0.39482051 0.38992468 -0.07201175 -0.05036803 0.06273568  542  THR   A HB   
7652  H  HG21 . THR   A  487 ? 0.49833891 0.35809821 0.36232370 -0.07868999 -0.04796321 0.06121993  542  THR   A HG21 
7653  H  HG22 . THR   A  487 ? 0.48258311 0.35431451 0.35774058 -0.07378902 -0.04722376 0.05626049  542  THR   A HG22 
7654  H  HG23 . THR   A  487 ? 0.49655288 0.35558015 0.36410880 -0.06951158 -0.05194220 0.05931886  542  THR   A HG23 
7655  N  N    . MET   A  488 ? 0.40740609 0.30127913 0.28509364 -0.06263079 -0.05153802 0.05880180  543  MET   A N    
7656  C  CA   . MET   A  488 ? 0.40809789 0.31010571 0.28652957 -0.06186043 -0.05174622 0.05897543  543  MET   A CA   
7657  C  C    . MET   A  488 ? 0.43207437 0.33112726 0.30173749 -0.06767640 -0.04978532 0.06196678  543  MET   A C    
7658  O  O    . MET   A  488 ? 0.44617701 0.33396268 0.30667979 -0.06987922 -0.05111311 0.06544887  543  MET   A O    
7659  C  CB   . MET   A  488 ? 0.38751090 0.28689378 0.26522565 -0.05582861 -0.05697227 0.05993971  543  MET   A CB   
7660  C  CG   . MET   A  488 ? 0.56652695 0.47392315 0.44539675 -0.05463338 -0.05810741 0.05981522  543  MET   A CG   
7661  S  SD   . MET   A  488 ? 0.57261044 0.47707582 0.45140031 -0.04732480 -0.06509193 0.06099394  543  MET   A SD   
7662  C  CE   . MET   A  488 ? 0.57988632 0.49065214 0.47072673 -0.04181200 -0.06515281 0.05690315  543  MET   A CE   
7663  H  H    . MET   A  488 ? 0.42055091 0.30713910 0.29561505 -0.06010800 -0.05430559 0.05979915  543  MET   A H    
7664  H  HA   . MET   A  488 ? 0.39530867 0.30606136 0.28011888 -0.06162238 -0.04979754 0.05648234  543  MET   A HA   
7665  H  HB2  . MET   A  488 ? 0.42634404 0.32729441 0.30953795 -0.05225608 -0.05784459 0.05795728  543  MET   A HB2  
7666  H  HB3  . MET   A  488 ? 0.43955556 0.32960057 0.31037888 -0.05604739 -0.05910000 0.06261314  543  MET   A HB3  
7667  H  HG2  . MET   A  488 ? 0.51022983 0.41605186 0.38321984 -0.05807586 -0.05711520 0.06157433  543  MET   A HG2  
7668  H  HG3  . MET   A  488 ? 0.49728644 0.41335201 0.38283959 -0.05437534 -0.05618886 0.05724037  543  MET   A HG3  
7669  H  HE1  . MET   A  488 ? 0.56448078 0.48355395 0.46078482 -0.04299165 -0.06244400 0.05469683  543  MET   A HE1  
7670  H  HE2  . MET   A  488 ? 0.57588816 0.48074418 0.46565562 -0.04183012 -0.06454594 0.05681966  543  MET   A HE2  
7671  H  HE3  . MET   A  488 ? 0.57553506 0.48741645 0.46856716 -0.03756355 -0.06850269 0.05683110  543  MET   A HE3  
7672  N  N    . PRO   A  489 ? 0.42392591 0.33241588 0.29547220 -0.07043561 -0.04644521 0.06072797  544  PRO   A N    
7673  C  CA   . PRO   A  489 ? 0.41593349 0.32235375 0.27907717 -0.07599355 -0.04386586 0.06313015  544  PRO   A CA   
7674  C  C    . PRO   A  489 ? 0.41807020 0.31649169 0.27043760 -0.07540562 -0.04747397 0.06692039  544  PRO   A C    
7675  O  O    . PRO   A  489 ? 0.36246610 0.26090544 0.21534085 -0.07040983 -0.05192856 0.06705260  544  PRO   A O    
7676  C  CB   . PRO   A  489 ? 0.42491072 0.34392059 0.29387888 -0.07709096 -0.04021343 0.06003674  544  PRO   A CB   
7677  C  CG   . PRO   A  489 ? 0.42694902 0.35281509 0.30492380 -0.07159546 -0.04245665 0.05712420  544  PRO   A CG   
7678  C  CD   . PRO   A  489 ? 0.41912532 0.33995950 0.30026627 -0.06835131 -0.04495858 0.05698889  544  PRO   A CD   
7679  H  HA   . PRO   A  489 ? 0.42422104 0.32696843 0.28554767 -0.07946369 -0.04193334 0.06391354  544  PRO   A HA   
7680  H  HB2  . PRO   A  489 ? 0.42631412 0.34568763 0.29027283 -0.07841385 -0.03983785 0.06101875  544  PRO   A HB2  
7681  H  HB3  . PRO   A  489 ? 0.41926122 0.34125590 0.29107943 -0.07988835 -0.03700255 0.05891316  544  PRO   A HB3  
7682  H  HG2  . PRO   A  489 ? 0.42331997 0.34974620 0.29940230 -0.06966354 -0.04470643 0.05760651  544  PRO   A HG2  
7683  H  HG3  . PRO   A  489 ? 0.41328394 0.34620202 0.29669833 -0.07218283 -0.04002400 0.05478941  544  PRO   A HG3  
7684  H  HD2  . PRO   A  489 ? 0.41641808 0.33882418 0.30033627 -0.06441658 -0.04759260 0.05634914  544  PRO   A HD2  
7685  H  HD3  . PRO   A  489 ? 0.41308045 0.33673850 0.29908904 -0.06905739 -0.04298021 0.05518831  544  PRO   A HD3  
7686  N  N    . ASP   A  490 ? 0.44608247 0.33775556 0.28839380 -0.08084457 -0.04557410 0.07013480  545  ASP   A N    
7687  C  CA   . ASP   A  490 ? 0.43452796 0.31807604 0.26477420 -0.08117789 -0.04864956 0.07408907  545  ASP   A CA   
7688  C  C    . ASP   A  490 ? 0.37807924 0.27036521 0.20733291 -0.08130018 -0.04752960 0.07267606  545  ASP   A C    
7689  O  O    . ASP   A  490 ? 0.41331163 0.31448483 0.24639797 -0.08437455 -0.04242110 0.07009371  545  ASP   A O    
7690  C  CB   . ASP   A  490 ? 0.47540429 0.34909883 0.29467025 -0.08785249 -0.04622871 0.07800638  545  ASP   A CB   
7691  C  CG   . ASP   A  490 ? 0.64614308 0.50683618 0.46233177 -0.08752746 -0.04909637 0.08051746  545  ASP   A CG   
7692  O  OD1  . ASP   A  490 ? 0.68635345 0.54457784 0.50744665 -0.08109602 -0.05374491 0.07953046  545  ASP   A OD1  
7693  O  OD2  . ASP   A  490 ? 0.78445858 0.63727546 0.59325862 -0.09376430 -0.04665062 0.08336364  545  ASP   A OD2  
7694  H  H    . ASP   A  490 ? 0.43610829 0.32837075 0.27892420 -0.08460967 -0.04228598 0.06990734  545  ASP   A H    
7695  H  HA   . ASP   A  490 ? 0.43759108 0.31631416 0.26727319 -0.07707374 -0.05308605 0.07505286  545  ASP   A HA   
7696  H  HB2  . ASP   A  490 ? 0.49401093 0.37314713 0.31605437 -0.09168327 -0.04167901 0.07659515  545  ASP   A HB2  
7697  H  HB3  . ASP   A  490 ? 0.50715405 0.37732905 0.31789115 -0.08898965 -0.04717127 0.08037218  545  ASP   A HB3  
7698  N  N    . GLU   A  491 ? 0.39621323 0.28540879 0.21995465 -0.07793112 -0.05257133 0.07433008  546  GLU   A N    
7699  C  CA   . GLU   A  491 ? 0.42069086 0.31606889 0.24123242 -0.07835280 -0.05226232 0.07325795  546  GLU   A CA   
7700  C  C    . GLU   A  491 ? 0.41341805 0.30561247 0.22236373 -0.08489527 -0.04787076 0.07538751  546  GLU   A C    
7701  O  O    . GLU   A  491 ? 0.43009460 0.31111270 0.22816125 -0.08767474 -0.04881801 0.07979388  546  GLU   A O    
7702  C  CB   . GLU   A  491 ? 0.46592647 0.35800749 0.28238922 -0.07352925 -0.05946534 0.07485275  546  GLU   A CB   
7703  C  CG   . GLU   A  491 ? 0.47905040 0.37588882 0.28995422 -0.07470902 -0.05951766 0.07393418  546  GLU   A CG   
7704  C  CD   . GLU   A  491 ? 0.77547598 0.67498279 0.58817387 -0.06960934 -0.06615810 0.07331429  546  GLU   A CD   
7705  O  OE1  . GLU   A  491 ? 0.53455818 0.42602032 0.34278589 -0.06643238 -0.07212360 0.07658710  546  GLU   A OE1  
7706  O  OE2  . GLU   A  491 ? 0.50042915 0.40962100 0.31882593 -0.06886537 -0.06564128 0.06964308  546  GLU   A OE2  
7707  H  H    . GLU   A  491 ? 0.40546244 0.28839695 0.22734135 -0.07519557 -0.05651371 0.07606548  546  GLU   A H    
7708  H  HA   . GLU   A  491 ? 0.40607828 0.31025198 0.23471116 -0.07757509 -0.05020530 0.06989362  546  GLU   A HA   
7709  H  HB2  . GLU   A  491 ? 0.45154691 0.34748334 0.27645963 -0.06947111 -0.06171698 0.07302907  546  GLU   A HB2  
7710  H  HB3  . GLU   A  491 ? 0.47072086 0.35349679 0.27968597 -0.07363153 -0.06205634 0.07825653  546  GLU   A HB3  
7711  H  HG2  . GLU   A  491 ? 0.53715259 0.42808530 0.33756611 -0.07786795 -0.05882760 0.07654840  546  GLU   A HG2  
7712  H  HG3  . GLU   A  491 ? 0.51539433 0.41963801 0.33129382 -0.07620460 -0.05552870 0.07099154  546  GLU   A HG3  
7713  N  N    . VAL   A  492 ? 0.38907981 0.29091018 0.20020001 -0.08714662 -0.04315347 0.07217611  547  VAL   A N    
7714  C  CA   . VAL   A  492 ? 0.38660705 0.28804731 0.18795240 -0.09306452 -0.03805386 0.07315559  547  VAL   A CA   
7715  C  C    . VAL   A  492 ? 0.44247359 0.34015846 0.23102501 -0.09322415 -0.04070490 0.07488274  547  VAL   A C    
7716  O  O    . VAL   A  492 ? 0.43276697 0.32249629 0.20781282 -0.09736334 -0.03984457 0.07866395  547  VAL   A O    
7717  C  CB   . VAL   A  492 ? 0.35827559 0.27198935 0.16887395 -0.09463947 -0.03177083 0.06837630  547  VAL   A CB   
7718  C  CG1  . VAL   A  492 ? 0.40611291 0.32157838 0.20777594 -0.10023622 -0.02585340 0.06846140  547  VAL   A CG1  
7719  C  CG2  . VAL   A  492 ? 0.35616356 0.27301848 0.17808181 -0.09510883 -0.02935195 0.06703632  547  VAL   A CG2  
7720  H  H    . VAL   A  492 ? 0.38005540 0.28899774 0.19909477 -0.08479163 -0.04305267 0.06913826  547  VAL   A H    
7721  H  HA   . VAL   A  492 ? 0.40056777 0.29606616 0.19753341 -0.09614762 -0.03680876 0.07577284  547  VAL   A HA   
7722  H  HB   . VAL   A  492 ? 0.36194855 0.28086925 0.17728350 -0.09146414 -0.03326634 0.06577703  547  VAL   A HB   
7723  H  HG11 . VAL   A  492 ? 0.40313506 0.31237411 0.19805582 -0.10367911 -0.02491487 0.07162841  547  VAL   A HG11 
7724  H  HG12 . VAL   A  492 ? 0.39775974 0.31301585 0.19359623 -0.09947370 -0.02711549 0.06820099  547  VAL   A HG12 
7725  H  HG13 . VAL   A  492 ? 0.38538426 0.30841777 0.19383809 -0.10114508 -0.02176262 0.06552824  547  VAL   A HG13 
7726  H  HG21 . VAL   A  492 ? 0.34681320 0.27127236 0.17409301 -0.09618397 -0.02549349 0.06422546  547  VAL   A HG21 
7727  H  HG22 . VAL   A  492 ? 0.34793487 0.26492274 0.17587888 -0.09132865 -0.03260816 0.06632020  547  VAL   A HG22 
7728  H  HG23 . VAL   A  492 ? 0.36142427 0.27246064 0.17897332 -0.09816199 -0.02849829 0.06965217  547  VAL   A HG23 
7729  N  N    . SER   A  493 ? 0.40249175 0.30548257 0.19467345 -0.08895326 -0.04424410 0.07223196  548  SER   A N    
7730  C  CA   . SER   A  493 ? 0.44836122 0.34794337 0.22846690 -0.08899591 -0.04744710 0.07352414  548  SER   A CA   
7731  C  C    . SER   A  493 ? 0.39605069 0.29063448 0.17578909 -0.08375257 -0.05614449 0.07562519  548  SER   A C    
7732  O  O    . SER   A  493 ? 0.42613527 0.32693946 0.21800004 -0.07911813 -0.05907760 0.07292791  548  SER   A O    
7733  C  CB   . SER   A  493 ? 0.44947016 0.35884017 0.23253979 -0.08882508 -0.04486895 0.06857982  548  SER   A CB   
7734  O  OG   . SER   A  493 ? 0.41521502 0.32954004 0.19864838 -0.09312062 -0.03689377 0.06646607  548  SER   A OG   
7735  H  H    . SER   A  493 ? 0.40610570 0.31479692 0.20808844 -0.08621322 -0.04474023 0.06960096  548  SER   A H    
7736  H  HA   . SER   A  493 ? 0.44444880 0.33827788 0.21414383 -0.09265858 -0.04572001 0.07626217  548  SER   A HA   
7737  H  HB2  . SER   A  493 ? 0.42842194 0.34316766 0.22151211 -0.08563307 -0.04641888 0.06604150  548  SER   A HB2  
7738  H  HB3  . SER   A  493 ? 0.44762903 0.35446563 0.22228885 -0.08884303 -0.04736721 0.06927429  548  SER   A HB3  
7740  N  N    . ARG   A  494 ? 0.44459450 0.32832471 0.21007313 -0.08464658 -0.06013735 0.08041088  549  ARG   A N    
7741  C  CA   . ARG   A  494 ? 0.52131045 0.40009862 0.28429735 -0.07964177 -0.06900738 0.08264321  549  ARG   A CA   
7742  C  C    . ARG   A  494 ? 0.50056553 0.38501853 0.26072454 -0.07852171 -0.07186823 0.08016060  549  ARG   A C    
7743  O  O    . ARG   A  494 ? 0.44482422 0.33064771 0.19636174 -0.08261494 -0.06788112 0.07902061  549  ARG   A O    
7744  C  CB   . ARG   A  494 ? 0.55042410 0.41413164 0.29790467 -0.08112940 -0.07255729 0.08907720  549  ARG   A CB   
7745  C  CG   . ARG   A  494 ? 0.78034019 0.63625187 0.53086388 -0.08114617 -0.07191550 0.09177717  549  ARG   A CG   
7746  C  CD   . ARG   A  494 ? 1.06126165 0.91726631 0.82313234 -0.07378557 -0.07823743 0.09118652  549  ARG   A CD   
7747  N  NE   . ARG   A  494 ? 1.50425076 1.35507369 1.25979686 -0.06916619 -0.08702570 0.09375311  549  ARG   A NE   
7748  C  CZ   . ARG   A  494 ? 1.25970840 1.11208272 1.02440798 -0.06205188 -0.09355834 0.09305871  549  ARG   A CZ   
7749  N  NH1  . ARG   A  494 ? 1.26764929 1.12336195 1.04585028 -0.05874526 -0.09252809 0.09076953  549  ARG   A NH1  
7750  N  NH2  . ARG   A  494 ? 1.12187445 0.97293806 0.88214028 -0.05813782 -0.10131096 0.09450039  549  ARG   A NH2  
7751  H  H    . ARG   A  494 ? 0.46008736 0.33932322 0.21689609 -0.08858926 -0.05726527 0.08245371  549  ARG   A H    
7752  H  HA   . ARG   A  494 ? 0.49601448 0.37750584 0.26927793 -0.07598672 -0.07101623 0.08149621  549  ARG   A HA   
7753  H  HB2  . ARG   A  494 ? 0.59703743 0.45813245 0.33440685 -0.08552948 -0.06938952 0.09028413  549  ARG   A HB2  
7754  H  HB3  . ARG   A  494 ? 0.59986174 0.46086341 0.34446734 -0.07782516 -0.07867368 0.09038687  549  ARG   A HB3  
7755  H  HG2  . ARG   A  494 ? 0.75307786 0.61354667 0.50922787 -0.08377184 -0.06632716 0.08978475  549  ARG   A HG2  
7756  H  HG3  . ARG   A  494 ? 0.77572012 0.62165624 0.51474434 -0.08359925 -0.07276648 0.09587637  549  ARG   A HG3  
7757  H  HD2  . ARG   A  494 ? 1.03954983 0.90534133 0.81285739 -0.07185965 -0.07685432 0.08725507  549  ARG   A HD2  
7758  H  HD3  . ARG   A  494 ? 1.06249273 0.91247010 0.82491487 -0.07399496 -0.07777121 0.09283875  549  ARG   A HD3  
7759  H  HE   . ARG   A  494 ? 1.30779171 1.15432894 1.05277669 -0.07117159 -0.08813008 0.09589158  549  ARG   A HE   
7760  H  HH11 . ARG   A  494 ? 1.26114988 1.11250758 1.03889203 -0.06063745 -0.08962724 0.09157510  549  ARG   A HH11 
7761  H  HH12 . ARG   A  494 ? 1.25311565 1.11543393 1.04057014 -0.05478832 -0.09472665 0.08839644  549  ARG   A HH12 
7762  H  HH21 . ARG   A  494 ? 1.16601431 1.01675260 0.93125224 -0.05339177 -0.10593686 0.09465443  549  ARG   A HH21 
7763  H  HH22 . ARG   A  494 ? 1.17359900 1.02433801 0.92605913 -0.06024260 -0.10186017 0.09518257  549  ARG   A HH22 
7764  N  N    . PRO   A  495 ? 0.50367761 0.39190727 0.27118611 -0.07305768 -0.07878528 0.07896499  550  PRO   A N    
7765  C  CA   . PRO   A  495 ? 0.50753790 0.39984322 0.27128056 -0.07224869 -0.08280813 0.07705177  550  PRO   A CA   
7766  C  C    . PRO   A  495 ? 0.58306551 0.46511376 0.32889104 -0.07309040 -0.08829301 0.08153223  550  PRO   A C    
7767  O  O    . PRO   A  495 ? 0.60937881 0.48104447 0.34830493 -0.07209060 -0.09181837 0.08652108  550  PRO   A O    
7768  C  CB   . PRO   A  495 ? 0.55189145 0.45163897 0.33049151 -0.06643932 -0.08840359 0.07482235  550  PRO   A CB   
7769  C  CG   . PRO   A  495 ? 0.53785962 0.43243313 0.32166472 -0.06314886 -0.09025013 0.07766765  550  PRO   A CG   
7770  C  CD   . PRO   A  495 ? 0.49160218 0.38087994 0.27150342 -0.06757363 -0.08294016 0.07909742  550  PRO   A CD   
7771  H  HA   . PRO   A  495 ? 0.52012062 0.41755021 0.28452301 -0.07468019 -0.07844294 0.07402670  550  PRO   A HA   
7772  H  HB2  . PRO   A  495 ? 0.54076433 0.44033119 0.31590813 -0.06485529 -0.09375962 0.07526060  550  PRO   A HB2  
7773  H  HB3  . PRO   A  495 ? 0.52247947 0.43014413 0.31028157 -0.06653748 -0.08541347 0.07116739  550  PRO   A HB3  
7774  H  HG2  . PRO   A  495 ? 0.53969681 0.42785746 0.31717360 -0.06124342 -0.09552101 0.08078381  550  PRO   A HG2  
7775  H  HG3  . PRO   A  495 ? 0.51813519 0.41912836 0.31399405 -0.06017450 -0.09087797 0.07537423  550  PRO   A HG3  
7776  H  HD2  . PRO   A  495 ? 0.51136565 0.39238417 0.28646028 -0.06704330 -0.08481690 0.08253492  550  PRO   A HD2  
7777  H  HD3  . PRO   A  495 ? 0.49131590 0.38625398 0.28117588 -0.06744184 -0.07927039 0.07653698  550  PRO   A HD3  
7778  N  N    . ASN   A  496 ? 0.67318082 0.55748576 0.41079384 -0.07500689 -0.08906993 0.07966444  551  ASN   A N    
7779  C  CA   . ASN   A  496 ? 0.61399555 0.49167305 0.33794957 -0.07412105 -0.09688853 0.08267653  551  ASN   A CA   
7780  C  C    . ASN   A  496 ? 0.65598291 0.54003596 0.39109021 -0.06827617 -0.10549084 0.08107249  551  ASN   A C    
7781  O  O    . ASN   A  496 ? 0.53740680 0.43257850 0.28824019 -0.06652248 -0.10419893 0.07637988  551  ASN   A O    
7782  C  CB   . ASN   A  496 ? 0.65687805 0.53502762 0.36802971 -0.07853838 -0.09414443 0.08061115  551  ASN   A CB   
7783  C  CG   . ASN   A  496 ? 0.79363096 0.66660839 0.49330312 -0.08437903 -0.08569687 0.08205730  551  ASN   A CG   
7784  O  OD1  . ASN   A  496 ? 1.14653087 1.00825834 0.83138514 -0.08664987 -0.08670662 0.08752620  551  ASN   A OD1  
7785  N  ND2  . ASN   A  496 ? 0.92789537 0.80886549 0.63367766 -0.08705810 -0.07727950 0.07727402  551  ASN   A ND2  
7786  H  H    . ASN   A  496 ? 0.62554950 0.51552093 0.36596170 -0.07685159 -0.08473591 0.07629200  551  ASN   A H    
7787  H  HA   . ASN   A  496 ? 0.65344429 0.52214992 0.36905879 -0.07446287 -0.09849918 0.08704296  551  ASN   A HA   
7788  H  HB2  . ASN   A  496 ? 0.66509879 0.55136681 0.38432974 -0.07821184 -0.09252387 0.07623632  551  ASN   A HB2  
7789  H  HB3  . ASN   A  496 ? 0.68615407 0.56018758 0.38834524 -0.07783058 -0.09985315 0.08243569  551  ASN   A HB3  
7790  H  HD21 . ASN   A  496 ? 0.86240220 0.75053364 0.57882696 -0.08528280 -0.07691256 0.07373536  551  ASN   A HD21 
7791  H  HD22 . ASN   A  496 ? 0.88376808 0.76287669 0.58297837 -0.09057186 -0.07210731 0.07767000  551  ASN   A HD22 
7792  N  N    . TYR   A  497 ? 0.61436456 0.49150634 0.34082940 -0.06552479 -0.11433688 0.08502237  552  TYR   A N    
7793  C  CA   . TYR   A  497 ? 0.65070319 0.53400433 0.38633555 -0.06007334 -0.12340499 0.08388034  552  TYR   A CA   
7794  C  C    . TYR   A  497 ? 0.84868741 0.72920716 0.57018101 -0.06106157 -0.13011332 0.08467077  552  TYR   A C    
7795  O  O    . TYR   A  497 ? 0.72662157 0.59956974 0.43939778 -0.05829094 -0.13834539 0.08904493  552  TYR   A O    
7796  C  CB   . TYR   A  497 ? 0.65340841 0.53163260 0.39431018 -0.05430292 -0.12915529 0.08777069  552  TYR   A CB   
7797  C  CG   . TYR   A  497 ? 0.56621981 0.44766885 0.32200342 -0.05258988 -0.12368423 0.08647840  552  TYR   A CG   
7798  C  CD1  . TYR   A  497 ? 0.58620936 0.45908123 0.33625895 -0.05578585 -0.11722428 0.08899815  552  TYR   A CD1  
7799  C  CD2  . TYR   A  497 ? 0.52398610 0.41681403 0.29894066 -0.04798834 -0.12524845 0.08287010  552  TYR   A CD2  
7800  C  CE1  . TYR   A  497 ? 0.48544595 0.36067563 0.24837312 -0.05421836 -0.11289552 0.08776583  552  TYR   A CE1  
7801  C  CE2  . TYR   A  497 ? 0.65674263 0.55199438 0.44411775 -0.04632527 -0.12053315 0.08166260  552  TYR   A CE2  
7802  C  CZ   . TYR   A  497 ? 0.56524092 0.45156929 0.34646082 -0.04941740 -0.11447176 0.08398630  552  TYR   A CZ   
7803  O  OH   . TYR   A  497 ? 0.68973529 0.57879961 0.48333150 -0.04783434 -0.11018396 0.08237244  552  TYR   A OH   
7804  H  H    . TYR   A  497 ? 0.64888191 0.51711738 0.36309502 -0.06718194 -0.11483402 0.08867821  552  TYR   A H    
7805  H  HA   . TYR   A  497 ? 0.65500510 0.54787922 0.40298593 -0.05942894 -0.12152378 0.07982961  552  TYR   A HA   
7806  H  HB2  . TYR   A  497 ? 0.65004492 0.51783270 0.37835160 -0.05515671 -0.13079411 0.09197284  552  TYR   A HB2  
7807  H  HB3  . TYR   A  497 ? 0.63528246 0.51791310 0.38160399 -0.05061939 -0.13551928 0.08709490  552  TYR   A HB3  
7808  H  HD1  . TYR   A  497 ? 0.57110375 0.43638849 0.30807137 -0.05925690 -0.11582405 0.09159786  552  TYR   A HD1  
7809  H  HD2  . TYR   A  497 ? 0.55736458 0.45657587 0.33692008 -0.04611542 -0.12957677 0.08113854  552  TYR   A HD2  
7810  H  HE1  . TYR   A  497 ? 0.52777708 0.39739126 0.28681603 -0.05677988 -0.10863551 0.08934173  552  TYR   A HE1  
7811  H  HE2  . TYR   A  497 ? 0.58293486 0.48622403 0.38290703 -0.04340839 -0.12129077 0.07910681  552  TYR   A HE2  
7813  N  N    . PRO   A  498 ? 0.73775566 0.62376773 0.45599115 -0.06487609 -0.12720306 0.08036298  553  PRO   A N    
7814  C  CA   . PRO   A  498 ? 0.74355304 0.62567049 0.44581270 -0.06662180 -0.13292590 0.08091912  553  PRO   A CA   
7815  C  C    . PRO   A  498 ? 0.72077990 0.60842383 0.42978927 -0.06193070 -0.14413875 0.08040189  553  PRO   A C    
7816  O  O    . PRO   A  498 ? 0.70724189 0.60670877 0.43445092 -0.05952405 -0.14515723 0.07633039  553  PRO   A O    
7817  C  CB   . PRO   A  498 ? 0.71717763 0.60476273 0.41748777 -0.07147497 -0.12576391 0.07531084  553  PRO   A CB   
7818  C  CG   . PRO   A  498 ? 0.65837359 0.55741954 0.38078985 -0.06995603 -0.12074664 0.07077728  553  PRO   A CG   
7819  C  CD   . PRO   A  498 ? 0.64353514 0.53923786 0.37314433 -0.06730021 -0.11891033 0.07462592  553  PRO   A CD   
7820  H  HA   . PRO   A  498 ? 0.75220621 0.62470961 0.44059819 -0.06805285 -0.13336071 0.08493626  553  PRO   A HA   
7821  H  HB2  . PRO   A  498 ? 0.71734095 0.60658634 0.41338038 -0.07188707 -0.12998496 0.07357617  553  PRO   A HB2  
7822  H  HB3  . PRO   A  498 ? 0.71946120 0.60172856 0.40961796 -0.07485937 -0.12029343 0.07632273  553  PRO   A HB3  
7823  H  HG2  . PRO   A  498 ? 0.65775943 0.56333381 0.38909876 -0.06780094 -0.12527408 0.06865621  553  PRO   A HG2  
7824  H  HG3  . PRO   A  498 ? 0.65872729 0.55988193 0.38085350 -0.07284981 -0.11440404 0.06784844  553  PRO   A HG3  
7825  H  HD2  . PRO   A  498 ? 0.64959764 0.55205369 0.39349729 -0.06460082 -0.11941179 0.07287341  553  PRO   A HD2  
7826  H  HD3  . PRO   A  498 ? 0.66147590 0.55423206 0.38775051 -0.06995358 -0.11236777 0.07506467  553  PRO   A HD3  
7827  N  N    . GLY   A  499 ? 0.72617996 0.60539222 0.42045888 -0.06076919 -0.15264823 0.08469293  554  GLY   A N    
7828  C  CA   . GLY   A  499 ? 0.71557736 0.60023946 0.41283387 -0.05751017 -0.16357775 0.08372600  554  GLY   A CA   
7829  C  C    . GLY   A  499 ? 0.91786987 0.80526400 0.60568994 -0.06210436 -0.16393916 0.07960004  554  GLY   A C    
7830  O  O    . GLY   A  499 ? 0.84928977 0.73847663 0.53549165 -0.06668554 -0.15501986 0.07579708  554  GLY   A O    
7831  H  H    . GLY   A  499 ? 0.73988485 0.60968792 0.42189890 -0.06213265 -0.15177181 0.08842263  554  GLY   A H    
7832  H  HA2  . GLY   A  499 ? 0.74304163 0.63664103 0.45664671 -0.05444318 -0.16493821 0.08150490  554  GLY   A HA2  
7833  H  HA3  . GLY   A  499 ? 0.76979506 0.64739281 0.45893741 -0.05525628 -0.16974756 0.08795837  554  GLY   A HA3  
7834  N  N    . ILE   A  500 ? 0.81414604 0.70183951 0.49594337 -0.06061915 -0.17458117 0.08012868  555  ILE   A N    
7835  C  CA   . ILE   A  500 ? 0.86214507 0.75104612 0.53311753 -0.06487943 -0.17628849 0.07633062  555  ILE   A CA   
7836  C  C    . ILE   A  500 ? 0.89808118 0.77337480 0.54384589 -0.06960915 -0.17153361 0.07922759  555  ILE   A C    
7837  O  O    . ILE   A  500 ? 0.90534049 0.76964819 0.53618306 -0.06857079 -0.17654072 0.08528467  555  ILE   A O    
7838  C  CB   . ILE   A  500 ? 0.85988617 0.75273705 0.53081012 -0.06206137 -0.18996017 0.07637662  555  ILE   A CB   
7839  C  CG1  . ILE   A  500 ? 0.81168240 0.71815932 0.50793314 -0.05674335 -0.19521584 0.07460332  555  ILE   A CG1  
7840  C  CG2  . ILE   A  500 ? 0.88726366 0.78166920 0.54797781 -0.06679656 -0.19162171 0.07169504  555  ILE   A CG2  
7841  C  CD1  . ILE   A  500 ? 0.78296173 0.70071566 0.49939862 -0.05789340 -0.18638401 0.06931678  555  ILE   A CD1  
7842  H  H    . ILE   A  500 ? 0.85060847 0.73761272 0.53505242 -0.05672887 -0.18114708 0.08284212  555  ILE   A H    
7843  H  HA   . ILE   A  500 ? 0.84148622 0.73728526 0.52113003 -0.06671559 -0.17142245 0.07178870  555  ILE   A HA   
7844  H  HB   . ILE   A  500 ? 0.87413818 0.75876510 0.53389710 -0.06048544 -0.19481729 0.08104733  555  ILE   A HB   
7845  H  HG12 . ILE   A  500 ? 0.81983685 0.72338194 0.51857561 -0.05278134 -0.19771588 0.07842660  555  ILE   A HG12 
7846  H  HG13 . ILE   A  500 ? 0.82282531 0.73378754 0.51991844 -0.05623865 -0.20259844 0.07323095  555  ILE   A HG13 
7847  H  HG21 . ILE   A  500 ? 0.86257964 0.76353681 0.53250533 -0.06868521 -0.18644048 0.06719541  555  ILE   A HG21 
7848  H  HG22 . ILE   A  500 ? 0.89274508 0.77826536 0.53623658 -0.06970367 -0.18924145 0.07315170  555  ILE   A HG22 
7849  H  HG23 . ILE   A  500 ? 0.88511586 0.78272128 0.54699993 -0.06511860 -0.20033808 0.07161052  555  ILE   A HG23 
7850  H  HD11 . ILE   A  500 ? 0.77820534 0.69220209 0.49490830 -0.05808903 -0.17955731 0.07063696  555  ILE   A HD11 
7851  H  HD12 . ILE   A  500 ? 0.77760065 0.69759309 0.49157658 -0.06164411 -0.18396059 0.06554046  555  ILE   A HD12 
7852  H  HD13 . ILE   A  500 ? 0.77426541 0.70065385 0.50565398 -0.05469885 -0.19012024 0.06837627  555  ILE   A HD13 
7853  N  N    . MET   A  501 ? 0.73714530 0.61317033 0.37829971 -0.07468994 -0.16179582 0.07492895  556  MET   A N    
7854  C  CA   . MET   A  501 ? 0.90071821 0.76580852 0.51872742 -0.07965144 -0.15606849 0.07667430  556  MET   A CA   
7855  C  C    . MET   A  501 ? 0.81806219 0.68320221 0.42273462 -0.08332132 -0.15789552 0.07207866  556  MET   A C    
7856  O  O    . MET   A  501 ? 1.01799119 0.87391597 0.60127586 -0.08521117 -0.16230330 0.07489303  556  MET   A O    
7857  C  CB   . MET   A  501 ? 0.87838417 0.74415118 0.50091738 -0.08240821 -0.14267805 0.07525834  556  MET   A CB   
7858  C  CG   . MET   A  501 ? 1.35437357 1.21947455 0.98946834 -0.07931033 -0.14033049 0.07942735  556  MET   A CG   
7859  S  SD   . MET   A  501 ? 1.21011412 1.06038618 0.83034801 -0.07736511 -0.14693116 0.08904543  556  MET   A SD   
7860  C  CE   . MET   A  501 ? 0.98244059 0.83364117 0.61950213 -0.07553353 -0.13939215 0.09098499  556  MET   A CE   
7861  H  H    . MET   A  501 ? 0.78835523 0.67205197 0.44127202 -0.07500897 -0.15850271 0.07072771  556  MET   A H    
7862  H  HA   . MET   A  501 ? 0.86369920 0.72067595 0.47131675 -0.07886148 -0.15986913 0.08181639  556  MET   A HA   
7863  H  HB2  . MET   A  501 ? 0.95401871 0.82719147 0.58606040 -0.08302879 -0.13923538 0.07025452  556  MET   A HB2  
7864  H  HB3  . MET   A  501 ? 0.97689569 0.83613467 0.58430016 -0.08584009 -0.13865675 0.07632460  556  MET   A HB3  
7865  H  HG2  . MET   A  501 ? 1.15390432 1.02641034 0.80470634 -0.07604925 -0.14319232 0.07772518  556  MET   A HG2  
7866  H  HG3  . MET   A  501 ? 1.16483760 1.03052056 0.80181628 -0.08154943 -0.13193053 0.07828909  556  MET   A HG3  
7867  H  HE1  . MET   A  501 ? 1.00893188 0.86827284 0.66213363 -0.07233791 -0.14083588 0.08847081  556  MET   A HE1  
7868  H  HE2  . MET   A  501 ? 1.02310610 0.87466574 0.65855694 -0.07905969 -0.13116635 0.08949416  556  MET   A HE2  
7869  H  HE3  . MET   A  501 ? 1.03648829 0.87955970 0.66760224 -0.07431068 -0.14231589 0.09592188  556  MET   A HE3  
7870  N  N    . TYR   A  502 ? 0.98944664 0.86440790 0.60640073 -0.08430957 -0.15491478 0.06497370  557  TYR   A N    
7871  C  CA   . TYR   A  502 ? 0.96665430 0.84129715 0.57177877 -0.08808755 -0.15498424 0.05955463  557  TYR   A CA   
7872  C  C    . TYR   A  502 ? 1.08280182 0.96321785 0.69301319 -0.08663132 -0.16666099 0.05698419  557  TYR   A C    
7873  O  O    . TYR   A  502 ? 1.07363272 0.96022606 0.69912410 -0.08248843 -0.17396680 0.05895469  557  TYR   A O    
7874  C  CB   . TYR   A  502 ? 0.88847256 0.76842660 0.50171548 -0.09053086 -0.14369623 0.05316291  557  TYR   A CB   
7875  C  CG   . TYR   A  502 ? 1.03916466 0.91419274 0.64620429 -0.09251513 -0.13226482 0.05525047  557  TYR   A CG   
7876  C  CD1  . TYR   A  502 ? 1.04823303 0.92606497 0.67008758 -0.09038097 -0.12742090 0.05807607  557  TYR   A CD1  
7877  C  CD2  . TYR   A  502 ? 1.07827520 0.94598937 0.66423023 -0.09670867 -0.12647079 0.05447720  557  TYR   A CD2  
7878  C  CE1  . TYR   A  502 ? 1.09349561 0.96728086 0.71004152 -0.09266081 -0.11736153 0.06006031  557  TYR   A CE1  
7879  C  CE2  . TYR   A  502 ? 1.06307483 0.92746884 0.64403009 -0.09895735 -0.11586189 0.05638203  557  TYR   A CE2  
7880  C  CZ   . TYR   A  502 ? 1.08931625 0.95687461 0.68591040 -0.09706100 -0.11149430 0.05921767  557  TYR   A CZ   
7881  O  OH   . TYR   A  502 ? 0.91488767 0.77981412 0.50711501 -0.09976688 -0.10122634 0.06094337  557  TYR   A OH   
7882  H  H    . TYR   A  502 ? 0.91220391 0.79380965 0.54508245 -0.08261652 -0.15275308 0.06341765  557  TYR   A H    
7883  H  HA   . TYR   A  502 ? 0.99484652 0.86138499 0.58193862 -0.09025336 -0.15457211 0.06169746  557  TYR   A HA   
7884  H  HB2  . TYR   A  502 ? 0.91859818 0.80596185 0.54904121 -0.08859173 -0.14378332 0.05139811  557  TYR   A HB2  
7885  H  HB3  . TYR   A  502 ? 0.94282579 0.82227570 0.54849225 -0.09276487 -0.14397921 0.04919113  557  TYR   A HB3  
7886  H  HD1  . TYR   A  502 ? 1.03913319 0.92193198 0.67492205 -0.08746979 -0.13100417 0.05853195  557  TYR   A HD1  
7887  H  HD2  . TYR   A  502 ? 1.07991624 0.94527018 0.65489799 -0.09820643 -0.12963122 0.05240632  557  TYR   A HD2  
7888  H  HE1  . TYR   A  502 ? 1.06490040 0.94061005 0.69163406 -0.09135461 -0.11436754 0.06174451  557  TYR   A HE1  
7889  H  HE2  . TYR   A  502 ? 1.08654284 0.94677520 0.65349209 -0.10190906 -0.11160367 0.05560968  557  TYR   A HE2  
7891  N  N    . LEU   A  503 ? 1.19770205 1.07600975 0.79438275 -0.09017821 -0.16834299 0.05245645  558  LEU   A N    
7892  C  CA   . LEU   A  503 ? 1.18283665 1.06644130 0.78275979 -0.09001990 -0.17902960 0.04912930  558  LEU   A CA   
7893  C  C    . LEU   A  503 ? 1.12914324 1.01931202 0.73818481 -0.09275401 -0.17433961 0.04086717  558  LEU   A C    
7894  O  O    . LEU   A  503 ? 1.05151427 0.93919551 0.65661716 -0.09512329 -0.16368407 0.03762739  558  LEU   A O    
7895  C  CB   . LEU   A  503 ? 1.49447370 1.36865938 1.06889975 -0.09209002 -0.18657055 0.05078216  558  LEU   A CB   
7896  C  CG   . LEU   A  503 ? 1.91321301 1.77920890 1.47615445 -0.08945860 -0.19293989 0.05929567  558  LEU   A CG   
7897  C  CD1  . LEU   A  503 ? 1.54010653 1.39499879 1.07421112 -0.09249467 -0.19804312 0.06079413  558  LEU   A CD1  
7898  C  CD2  . LEU   A  503 ? 2.44092298 2.31449628 2.02146220 -0.08405843 -0.20416783 0.06221248  558  LEU   A CD2  
7899  H  H    . LEU   A  503 ? 1.17085826 1.04428482 0.75571144 -0.09290767 -0.16256005 0.05126606  558  LEU   A H    
7900  H  HA   . LEU   A  503 ? 1.22226429 1.11124992 0.83507591 -0.08683649 -0.18454850 0.05112118  558  LEU   A HA   
7901  H  HB2  . LEU   A  503 ? 1.50159109 1.37067175 1.06323779 -0.09521382 -0.18053460 0.04864776  558  LEU   A HB2  
7902  H  HB3  . LEU   A  503 ? 1.49556744 1.37374711 1.07259345 -0.09233419 -0.19352980 0.04801840  558  LEU   A HB3  
7903  H  HG   . LEU   A  503 ? 1.81683803 1.67941213 1.37937677 -0.08922816 -0.18611462 0.06215223  558  LEU   A HG   
7904  H  HD11 . LEU   A  503 ? 1.65525603 1.50339913 1.18058527 -0.09124419 -0.20030437 0.06656466  558  LEU   A HD11 
7905  H  HD12 . LEU   A  503 ? 1.65008950 1.50792515 1.18435013 -0.09229565 -0.20627117 0.05884488  558  LEU   A HD12 
7906  H  HD13 . LEU   A  503 ? 1.64892960 1.50041199 1.17295027 -0.09593399 -0.19088717 0.05789631  558  LEU   A HD13 
7907  H  HD21 . LEU   A  503 ? 2.22750902 2.10707402 1.82480180 -0.08206125 -0.20028256 0.06194023  558  LEU   A HD21 
7908  H  HD22 . LEU   A  503 ? 2.26090431 2.13954663 1.84464097 -0.08445246 -0.21043760 0.05900117  558  LEU   A HD22 
7909  H  HD23 . LEU   A  503 ? 2.27149010 2.13885832 1.84324670 -0.08221068 -0.20898777 0.06748278  558  LEU   A HD23 
7910  N  N    . GLN   A  504 ? 1.26480162 1.16339970 0.88642240 -0.09237316 -0.18252985 0.03755707  559  GLN   A N    
7911  C  CA   . GLN   A  504 ? 1.21374047 1.11788273 0.84433061 -0.09518646 -0.17969568 0.02996463  559  GLN   A CA   
7912  C  C    . GLN   A  504 ? 1.30952895 1.20509219 0.92031729 -0.09933913 -0.17344530 0.02514919  559  GLN   A C    
7913  O  O    . GLN   A  504 ? 0.98454261 0.88104010 0.60044354 -0.10078835 -0.16449286 0.02026499  559  GLN   A O    
7914  C  CB   . GLN   A  504 ? 1.47452855 1.38596439 1.11285377 -0.09575699 -0.19166271 0.02736804  559  GLN   A CB   
7915  C  CG   . GLN   A  504 ? 1.32505202 1.24723744 0.98460621 -0.09164056 -0.19874980 0.03089923  559  GLN   A CG   
7916  C  CD   . GLN   A  504 ? 1.25335574 1.18470120 0.93640620 -0.09069423 -0.19181862 0.02895185  559  GLN   A CD   
7917  O  OE1  . GLN   A  504 ? 1.18360078 1.11826503 0.87343347 -0.09389519 -0.18838689 0.02315690  559  GLN   A OE1  
7918  N  NE2  . GLN   A  504 ? 1.20083213 1.13561547 0.89602113 -0.08632612 -0.18963777 0.03374589  559  GLN   A NE2  
7919  H  H    . GLN   A  504 ? 1.22505820 1.12589121 0.84967166 -0.09035590 -0.19032924 0.04018122  559  GLN   A H    
7920  H  HA   . GLN   A  504 ? 1.26297867 1.17186832 0.90774852 -0.09414920 -0.17416470 0.02931518  559  GLN   A HA   
7921  H  HB2  . GLN   A  504 ? 1.39198971 1.29846334 1.01563132 -0.09684265 -0.19725209 0.02789046  559  GLN   A HB2  
7922  H  HB3  . GLN   A  504 ? 1.37100387 1.28492606 1.01408470 -0.09811047 -0.18944398 0.02232588  559  GLN   A HB3  
7923  H  HG2  . GLN   A  504 ? 1.34334528 1.26258612 0.99924350 -0.08885330 -0.20015758 0.03591286  559  GLN   A HG2  
7924  H  HG3  . GLN   A  504 ? 1.34714663 1.27322769 1.00836313 -0.09231576 -0.20696974 0.02952067  559  GLN   A HG3  
7925  H  HE21 . GLN   A  504 ? 1.21965551 1.15340126 0.91251111 -0.08378770 -0.19428070 0.03762991  559  GLN   A HE21 
7926  H  HE22 . GLN   A  504 ? 1.20022440 1.13802958 0.90559906 -0.08589410 -0.18367848 0.03299344  559  GLN   A HE22 
7927  N  N    . SER   A  505 ? 1.11842978 1.00554001 0.70626891 -0.10096433 -0.17861068 0.02654477  560  SER   A N    
7928  C  CA   . SER   A  505 ? 1.04025221 0.91911912 0.60684699 -0.10490617 -0.17457202 0.02164747  560  SER   A CA   
7929  C  C    . SER   A  505 ? 0.95658243 0.83122492 0.51771712 -0.10574587 -0.16032393 0.02045720  560  SER   A C    
7930  O  O    . SER   A  505 ? 1.11021507 0.98193216 0.66350329 -0.10824986 -0.15429969 0.01405934  560  SER   A O    
7931  C  CB   . SER   A  505 ? 0.95703661 0.82710040 0.49910712 -0.10604658 -0.18229039 0.02510827  560  SER   A CB   
7932  O  OG   . SER   A  505 ? 1.12216640 0.99677169 0.67053616 -0.10425224 -0.19591342 0.02776583  560  SER   A OG   
7933  H  H    . SER   A  505 ? 1.14558256 1.03192699 0.73064005 -0.09940944 -0.18513039 0.03071824  560  SER   A H    
7934  H  HA   . SER   A  505 ? 1.01774883 0.89933348 0.58854085 -0.10649801 -0.17648633 0.01643009  560  SER   A HA   
7935  H  HB2  . SER   A  505 ? 1.01965988 0.88507998 0.55409932 -0.10532730 -0.17873119 0.02966595  560  SER   A HB2  
7936  H  HB3  . SER   A  505 ? 1.02741408 0.89301670 0.55624086 -0.10881520 -0.18133573 0.02091077  560  SER   A HB3  
7938  N  N    . GLU   A  506 ? 1.03367376 0.90820223 0.59944785 -0.10353862 -0.15511599 0.02645042  561  GLU   A N    
7939  C  CA   . GLU   A  506 ? 0.98675537 0.85791457 0.54711169 -0.10452174 -0.14207605 0.02618849  561  GLU   A CA   
7940  C  C    . GLU   A  506 ? 1.10812426 0.98632669 0.68759090 -0.10382665 -0.13355492 0.02091370  561  GLU   A C    
7941  O  O    . GLU   A  506 ? 0.87708807 0.75448084 0.45579022 -0.10422710 -0.12254968 0.01997088  561  GLU   A O    
7942  C  CB   . GLU   A  506 ? 1.19236517 1.06071460 0.75164253 -0.10281686 -0.14036356 0.03462968  561  GLU   A CB   
7943  C  CG   . GLU   A  506 ? 1.18995881 1.05306864 0.73777592 -0.10188985 -0.15196522 0.04089604  561  GLU   A CG   
7944  C  CD   . GLU   A  506 ? 1.38273621 1.23827100 0.91995478 -0.10155762 -0.14972878 0.04899834  561  GLU   A CD   
7945  O  OE1  . GLU   A  506 ? 1.43202829 1.28194547 0.95548546 -0.10457553 -0.14007007 0.04924309  561  GLU   A OE1  
7946  O  OE2  . GLU   A  506 ? 1.48295772 1.33795595 1.02522767 -0.09836123 -0.15775812 0.05505586  561  GLU   A OE2  
7947  H  H    . GLU   A  506 ? 1.00391936 0.88084972 0.57708436 -0.10134482 -0.15982303 0.03064204  561  GLU   A H    
7948  H  HA   . GLU   A  506 ? 1.06823158 0.93381083 0.61201119 -0.10687994 -0.14004223 0.02402601  561  GLU   A HA   
7949  H  HB2  . GLU   A  506 ? 1.11888480 0.99273443 0.69492501 -0.10063928 -0.13883442 0.03571357  561  GLU   A HB2  
7950  H  HB3  . GLU   A  506 ? 1.14291203 1.00720406 0.69234747 -0.10448422 -0.13295169 0.03490869  561  GLU   A HB3  
7951  H  HG2  . GLU   A  506 ? 1.24501288 1.10415089 0.77871913 -0.10388447 -0.15548645 0.03887656  561  GLU   A HG2  
7952  H  HG3  . GLU   A  506 ? 1.22227859 1.09069347 0.78326392 -0.09949791 -0.15845068 0.04166516  561  GLU   A HG3  
7953  N  N    . PHE   A  507 ? 0.91630220 0.80163503 0.51311576 -0.10289946 -0.13877152 0.01762283  562  PHE   A N    
7954  C  CA   . PHE   A  507 ? 1.01038754 0.90198600 0.62599540 -0.10207198 -0.13184735 0.01346797  562  PHE   A CA   
7955  C  C    . PHE   A  507 ? 0.85415339 0.74435782 0.46651858 -0.10443330 -0.13085581 0.00507986  562  PHE   A C    
7956  O  O    . PHE   A  507 ? 0.89044094 0.78244185 0.50574505 -0.10565533 -0.13923351 0.00231717  562  PHE   A O    
7957  C  CB   . PHE   A  507 ? 0.87689549 0.77753401 0.51566654 -0.09950650 -0.13702403 0.01602759  562  PHE   A CB   
7958  C  CG   . PHE   A  507 ? 0.88971424 0.79203582 0.53579736 -0.09653033 -0.13496318 0.02307759  562  PHE   A CG   
7959  C  CD1  . PHE   A  507 ? 0.75469577 0.65970081 0.41196993 -0.09526094 -0.12527783 0.02348288  562  PHE   A CD1  
7960  C  CD2  . PHE   A  507 ? 0.75188088 0.65262061 0.39347571 -0.09487238 -0.14309508 0.02919435  562  PHE   A CD2  
7961  C  CE1  . PHE   A  507 ? 0.66038543 0.56616849 0.32376820 -0.09280343 -0.12369286 0.02973225  562  PHE   A CE1  
7962  C  CE2  . PHE   A  507 ? 0.71685922 0.61785406 0.36465421 -0.09202338 -0.14144547 0.03545516  562  PHE   A CE2  
7963  C  CZ   . PHE   A  507 ? 0.64397103 0.54737127 0.30247068 -0.09119867 -0.13176727 0.03561144  562  PHE   A CZ   
7964  H  H    . PHE   A  507 ? 0.98279691 0.86918575 0.57978785 -0.10288572 -0.14688717 0.01809599  562  PHE   A H    
7965  H  HA   . PHE   A  507 ? 0.92875904 0.81952691 0.54431713 -0.10158931 -0.12401615 0.01444838  562  PHE   A HA   
7966  H  HB2  . PHE   A  507 ? 0.91062254 0.81249452 0.54896271 -0.09980503 -0.14527780 0.01623484  562  PHE   A HB2  
7967  H  HB3  . PHE   A  507 ? 0.89442158 0.79873657 0.54422331 -0.09956300 -0.13374694 0.01254192  562  PHE   A HB3  
7968  H  HD1  . PHE   A  507 ? 0.74884427 0.65483093 0.40932986 -0.09603043 -0.11996065 0.01943813  562  PHE   A HD1  
7969  H  HD2  . PHE   A  507 ? 0.78543448 0.68461442 0.41960505 -0.09559339 -0.15010597 0.02901884  562  PHE   A HD2  
7970  H  HE1  . PHE   A  507 ? 0.66425163 0.57191443 0.33509475 -0.09213099 -0.11735048 0.02987406  562  PHE   A HE1  
7971  H  HE2  . PHE   A  507 ? 0.71576321 0.61500466 0.36023918 -0.09059471 -0.14729671 0.03955757  562  PHE   A HE2  
7972  H  HZ   . PHE   A  507 ? 0.65967625 0.56279427 0.32197249 -0.08944994 -0.13079473 0.03971335  562  PHE   A HZ   
7973  N  N    . ASP   A  508 ? 0.87918550 0.76637554 0.48629573 -0.10498487 -0.12050226 0.00091247  563  ASP   A N    
7974  C  CA   . ASP   A  508 ? 1.25209808 1.13742936 0.85810959 -0.10641832 -0.11827347 -0.00736669 563  ASP   A CA   
7975  C  C    . ASP   A  508 ? 0.93469298 0.82521290 0.55991226 -0.10440463 -0.11038661 -0.00938496 563  ASP   A C    
7976  O  O    . ASP   A  508 ? 0.93344802 0.82218492 0.55555594 -0.10372544 -0.10069212 -0.01229904 563  ASP   A O    
7977  C  CB   . ASP   A  508 ? 1.38307953 1.25993884 0.96493727 -0.10835332 -0.11360466 -0.01135928 563  ASP   A CB   
7978  C  CG   . ASP   A  508 ? 1.63682079 1.51022410 1.21543932 -0.10935198 -0.11062004 -0.02048047 563  ASP   A CG   
7979  O  OD1  . ASP   A  508 ? 1.97996378 1.85448647 1.56696212 -0.11029690 -0.11722191 -0.02386892 563  ASP   A OD1  
7980  O  OD2  . ASP   A  508 ? 1.27847922 1.14798760 0.84613425 -0.10923744 -0.10162924 -0.02435145 563  ASP   A OD2  
7981  H  H    . ASP   A  508 ? 0.93944311 0.82563704 0.54362273 -0.10439491 -0.11469119 0.00321258  563  ASP   A H    
7982  H  HA   . ASP   A  508 ? 1.11584830 1.00204682 0.72434634 -0.10744959 -0.12548731 -0.00890104 563  ASP   A HA   
7983  H  HB2  . ASP   A  508 ? 1.42133701 1.29492664 0.99133331 -0.10970055 -0.11950005 -0.00971908 563  ASP   A HB2  
7984  H  HB3  . ASP   A  508 ? 1.40421557 1.28073132 0.98320389 -0.10764657 -0.10663769 -0.00948879 563  ASP   A HB3  
7985  N  N    . LEU   A  509 ? 0.86217809 0.75948727 0.50726998 -0.10343929 -0.11471958 -0.00793264 564  LEU   A N    
7986  C  CA   . LEU   A  509 ? 0.73036426 0.63260698 0.39388716 -0.10154422 -0.10819570 -0.00895760 564  LEU   A CA   
7987  C  C    . LEU   A  509 ? 0.60212499 0.50408304 0.27358514 -0.10266173 -0.10883261 -0.01549905 564  LEU   A C    
7988  O  O    . LEU   A  509 ? 0.67440891 0.57987374 0.36082608 -0.10116985 -0.10410040 -0.01624840 564  LEU   A O    
7989  C  CB   . LEU   A  509 ? 0.65520436 0.56524628 0.33631900 -0.09958832 -0.11117199 -0.00268969 564  LEU   A CB   
7990  C  CG   . LEU   A  509 ? 0.71660095 0.62677860 0.39336878 -0.09807543 -0.11104233 0.00433771  564  LEU   A CG   
7991  C  CD1  . LEU   A  509 ? 0.66808581 0.58590209 0.36337632 -0.09585091 -0.11501970 0.00924034  564  LEU   A CD1  
7992  C  CD2  . LEU   A  509 ? 0.65728402 0.56472898 0.32789266 -0.09734729 -0.10014649 0.00497739  564  LEU   A CD2  
7993  H  H    . LEU   A  509 ? 0.85056949 0.74966586 0.49767801 -0.10399439 -0.12195329 -0.00626297 564  LEU   A H    
7994  H  HA   . LEU   A  509 ? 0.71113241 0.61189950 0.37111169 -0.10063515 -0.10093318 -0.00925503 564  LEU   A HA   
7995  H  HB2  . LEU   A  509 ? 0.67958605 0.59202981 0.36536485 -0.10043024 -0.11802027 -0.00276095 564  LEU   A HB2  
7996  H  HB3  . LEU   A  509 ? 0.66798627 0.58096015 0.36035883 -0.09844580 -0.10663460 -0.00339597 564  LEU   A HB3  
7997  H  HG   . LEU   A  509 ? 0.70089239 0.60770655 0.36585906 -0.09915679 -0.11589146 0.00529461  564  LEU   A HG   
7998  H  HD11 . LEU   A  509 ? 0.68026221 0.59724063 0.37184739 -0.09484114 -0.11620355 0.01372178  564  LEU   A HD11 
7999  H  HD12 . LEU   A  509 ? 0.66494381 0.58577931 0.37094274 -0.09479144 -0.11007225 0.00875924  564  LEU   A HD12 
8000  H  HD13 . LEU   A  509 ? 0.67673874 0.59721529 0.37674740 -0.09650175 -0.12134673 0.00829620  564  LEU   A HD13 
8001  H  HD21 . LEU   A  509 ? 0.68567538 0.58846986 0.34318581 -0.09870874 -0.09809695 0.00216085  564  LEU   A HD21 
8002  H  HD22 . LEU   A  509 ? 0.66082937 0.57119370 0.34192580 -0.09633689 -0.09539232 0.00332432  564  LEU   A HD22 
8003  H  HD23 . LEU   A  509 ? 0.67303056 0.58053553 0.34234285 -0.09660510 -0.10015307 0.00979688  564  LEU   A HD23 
8004  N  N    . GLY   A  510 ? 0.68116701 0.57846880 0.34243646 -0.10546362 -0.11507392 -0.02001651 565  GLY   A N    
8005  C  CA   . GLY   A  510 ? 0.60309833 0.49817523 0.26962969 -0.10714358 -0.11612196 -0.02646289 565  GLY   A CA   
8006  C  C    . GLY   A  510 ? 0.52827388 0.43054044 0.21445143 -0.10813113 -0.12191734 -0.02474178 565  GLY   A C    
8007  O  O    . GLY   A  510 ? 0.52867079 0.42997688 0.22313097 -0.10935819 -0.12138884 -0.02878178 565  GLY   A O    
8008  H  H    . GLY   A  510 ? 0.65876794 0.55376220 0.30909431 -0.10649093 -0.11899193 -0.01902344 565  GLY   A H    
8009  H  HA2  . GLY   A  510 ? 0.61713362 0.50730479 0.27203912 -0.10916945 -0.11966973 -0.02984617 565  GLY   A HA2  
8010  H  HA3  . GLY   A  510 ? 0.60011321 0.49332696 0.26812583 -0.10575666 -0.10929781 -0.02899496 565  GLY   A HA3  
8011  N  N    . CYS   A  511 ? 0.53247696 0.44172937 0.22551280 -0.10766265 -0.12765226 -0.01875543 566  CYS   A N    
8012  C  CA   . CYS   A  511 ? 0.61374891 0.53177160 0.32641247 -0.10818224 -0.13239534 -0.01648046 566  CYS   A CA   
8013  C  C    . CYS   A  511 ? 0.63804388 0.55783415 0.34909305 -0.11176483 -0.14347287 -0.01793963 566  CYS   A C    
8014  O  O    . CYS   A  511 ? 0.64736164 0.56190944 0.34174407 -0.11318558 -0.14802659 -0.01934667 566  CYS   A O    
8015  C  CB   . CYS   A  511 ? 0.63625789 0.56161332 0.35903549 -0.10476483 -0.13137294 -0.00930575 566  CYS   A CB   
8016  S  SG   . CYS   A  511 ? 0.66752124 0.59260708 0.39597207 -0.10109282 -0.11894916 -0.00743148 566  CYS   A SG   
8017  H  H    . CYS   A  511 ? 0.55509835 0.46360511 0.24005964 -0.10695058 -0.12870151 -0.01600247 566  CYS   A H    
8018  H  HA   . CYS   A  511 ? 0.59101546 0.50898778 0.31147251 -0.10848320 -0.12896875 -0.01883585 566  CYS   A HA   
8019  H  HB2  . CYS   A  511 ? 0.64303219 0.56727111 0.35704422 -0.10424308 -0.13436873 -0.00682805 566  CYS   A HB2  
8020  H  HB3  . CYS   A  511 ? 0.62621814 0.55788457 0.36142582 -0.10508658 -0.13502230 -0.00795393 566  CYS   A HB3  
8021  N  N    . THR   A  512 ? 0.53576386 0.46359742 0.26428741 -0.11334251 -0.14783810 -0.01738731 567  THR   A N    
8022  C  CA   . THR   A  512 ? 0.58330250 0.51547986 0.31370324 -0.11682528 -0.15866956 -0.01825667 567  THR   A CA   
8023  C  C    . THR   A  512 ? 0.55228180 0.49747819 0.30250192 -0.11548051 -0.16246077 -0.01326359 567  THR   A C    
8024  O  O    . THR   A  512 ? 0.46546274 0.41523883 0.23001701 -0.11380482 -0.15666091 -0.01149258 567  THR   A O    
8025  C  CB   . THR   A  512 ? 0.63558125 0.56361157 0.36654115 -0.12181570 -0.16042018 -0.02484093 567  THR   A CB   
8026  O  OG1  . THR   A  512 ? 0.76354086 0.69601238 0.51229513 -0.12201825 -0.15568642 -0.02459614 567  THR   A OG1  
8027  C  CG2  . THR   A  512 ? 0.64495093 0.55997086 0.35784829 -0.12249624 -0.15584691 -0.03048064 567  THR   A CG2  
8028  H  H    . THR   A  512 ? 0.55273569 0.48379198 0.29240340 -0.11235641 -0.14395680 -0.01646197 567  THR   A H    
8029  H  HA   . THR   A  512 ? 0.59142214 0.52071643 0.30973315 -0.11680987 -0.16244319 -0.01785013 567  THR   A HA   
8030  H  HB   . THR   A  512 ? 0.65437710 0.58547783 0.38606963 -0.12450799 -0.16792262 -0.02552232 567  THR   A HB   
8032  H  HG21 . THR   A  512 ? 0.65156686 0.56351829 0.36431468 -0.12579012 -0.15815559 -0.03461376 567  THR   A HG21 
8033  H  HG22 . THR   A  512 ? 0.63959098 0.55237722 0.35368145 -0.12005545 -0.14845377 -0.03027982 567  THR   A HG22 
8034  H  HG23 . THR   A  512 ? 0.65760708 0.56938583 0.35754615 -0.12208641 -0.15797713 -0.03032575 567  THR   A HG23 
8035  N  N    . CYS   A  513 ? 0.52062118 0.47186470 0.27147859 -0.11599450 -0.17222361 -0.01121179 568  CYS   A N    
8036  C  CA   . CYS   A  513 ? 0.51393348 0.47868615 0.28461444 -0.11523504 -0.17700434 -0.00785083 568  CYS   A CA   
8037  C  C    . CYS   A  513 ? 0.53845501 0.50917673 0.30927214 -0.11780760 -0.18909678 -0.00847110 568  CYS   A C    
8038  O  O    . CYS   A  513 ? 0.53110868 0.49679387 0.28607577 -0.11739232 -0.19460049 -0.00807132 568  CYS   A O    
8039  C  CB   . CYS   A  513 ? 0.53813142 0.50707924 0.31418166 -0.10934085 -0.17415261 -0.00154134 568  CYS   A CB   
8040  S  SG   . CYS   A  513 ? 0.54720098 0.53321886 0.34936798 -0.10737216 -0.17802174 0.00209642  568  CYS   A SG   
8041  H  H    . CYS   A  513 ? 0.54368711 0.49071464 0.28222662 -0.11670591 -0.17605920 -0.01202267 568  CYS   A H    
8042  H  HA   . CYS   A  513 ? 0.51236778 0.48006529 0.29383308 -0.11693969 -0.17419559 -0.00938178 568  CYS   A HA   
8043  H  HB2  . CYS   A  513 ? 0.52797973 0.49292007 0.30303827 -0.10788632 -0.16662510 -0.00122912 568  CYS   A HB2  
8044  H  HB3  . CYS   A  513 ? 0.54319537 0.50914788 0.30876657 -0.10779993 -0.17745309 0.00033940  568  CYS   A HB3  
8045  N  N    . ASP   A  514 ? 0.55546451 0.53797090 0.34500241 -0.12019604 -0.19322474 -0.00891507 569  ASP   A N    
8046  C  CA   . ASP   A  514 ? 0.56092584 0.55279881 0.35538232 -0.12194590 -0.20490634 -0.00878257 569  ASP   A CA   
8047  C  C    . ASP   A  514 ? 0.60145134 0.60308737 0.40478766 -0.11594501 -0.20870481 -0.00279620 569  ASP   A C    
8048  O  O    . ASP   A  514 ? 0.64646870 0.66109240 0.47001401 -0.11485083 -0.20924705 -0.00109591 569  ASP   A O    
8049  C  CB   . ASP   A  514 ? 0.50105357 0.50146079 0.31182614 -0.12786235 -0.20697802 -0.01233790 569  ASP   A CB   
8050  C  CG   . ASP   A  514 ? 0.52589601 0.53649151 0.34264484 -0.13137534 -0.21903600 -0.01362102 569  ASP   A CG   
8051  O  OD1  . ASP   A  514 ? 0.52618802 0.53442633 0.33049059 -0.13005266 -0.22669336 -0.01294260 569  ASP   A OD1  
8052  O  OD2  . ASP   A  514 ? 0.59983289 0.62115908 0.43389302 -0.13548718 -0.22079897 -0.01510260 569  ASP   A OD2  
8053  H  H    . ASP   A  514 ? 0.53725082 0.52240360 0.33696592 -0.12082936 -0.18865071 -0.00930713 569  ASP   A H    
8054  H  HA   . ASP   A  514 ? 0.57098025 0.55660218 0.35152239 -0.12345852 -0.20906129 -0.01057882 569  ASP   A HA   
8055  H  HB2  . ASP   A  514 ? 0.52036595 0.51290131 0.32471883 -0.13115181 -0.20387475 -0.01589859 569  ASP   A HB2  
8056  H  HB3  . ASP   A  514 ? 0.50353587 0.51057678 0.32789540 -0.12643833 -0.20303513 -0.01044723 569  ASP   A HB3  
8057  N  N    . ASP   A  515 ? 0.64530861 0.63990796 0.43285254 -0.11194525 -0.21082321 0.00039173  570  ASP   A N    
8058  C  CA   . ASP   A  515 ? 0.84168541 0.84296286 0.63355327 -0.10634404 -0.21685277 0.00583356  570  ASP   A CA   
8059  C  C    . ASP   A  515 ? 0.80518508 0.82409227 0.62051022 -0.10592657 -0.22329478 0.00639094  570  ASP   A C    
8060  O  O    . ASP   A  515 ? 0.69271564 0.71844190 0.51042831 -0.10328420 -0.23303370 0.00865059  570  ASP   A O    
8061  C  CB   . ASP   A  515 ? 0.82935262 0.82341903 0.60092044 -0.10595044 -0.22573449 0.00677460  570  ASP   A CB   
8062  C  CG   . ASP   A  515 ? 1.36716580 1.36539054 1.13993835 -0.09974695 -0.23272005 0.01272806  570  ASP   A CG   
8063  O  OD1  . ASP   A  515 ? 1.40070617 1.39704931 1.17585659 -0.09461553 -0.22690108 0.01721920  570  ASP   A OD1  
8064  O  OD2  . ASP   A  515 ? 1.71772921 1.72049534 1.48858833 -0.09995833 -0.24432145 0.01286266  570  ASP   A OD2  
8065  H  H    . ASP   A  515 ? 0.67969537 0.66447461 0.45269316 -0.11275105 -0.20835185 -0.00090512 570  ASP   A H    
8066  H  HA   . ASP   A  515 ? 0.77854490 0.77719676 0.57047415 -0.10271530 -0.21109740 0.00880215  570  ASP   A HA   
8067  H  HB2  . ASP   A  515 ? 0.93872130 0.92203581 0.69528198 -0.10632794 -0.22120285 0.00635029  570  ASP   A HB2  
8068  H  HB3  . ASP   A  515 ? 0.94142938 0.93798828 0.71261501 -0.10966431 -0.23168907 0.00366141  570  ASP   A HB3  
8069  N  N    . HIS   A  531 ? 1.24387121 1.19507360 1.03804684 -0.04460142 -0.17595403 0.06539658  586  HIS   A N    
8070  C  CA   . HIS   A  531 ? 1.15949214 1.11859560 0.97087848 -0.03796019 -0.18035837 0.06624500  586  HIS   A CA   
8071  C  C    . HIS   A  531 ? 0.94816381 0.89611673 0.75465351 -0.03440594 -0.17750414 0.07094368  586  HIS   A C    
8072  O  O    . HIS   A  531 ? 0.81510752 0.75383782 0.61164492 -0.03798201 -0.16949792 0.07208372  586  HIS   A O    
8073  C  CB   . HIS   A  531 ? 1.53183222 1.50631034 1.36496234 -0.03861424 -0.17580315 0.06108472  586  HIS   A CB   
8074  C  CG   . HIS   A  531 ? 1.38674438 1.37194133 1.23943782 -0.03230209 -0.17894158 0.06078935  586  HIS   A CG   
8075  N  ND1  . HIS   A  531 ? 1.25450170 1.25341773 1.12033188 -0.03022372 -0.18667024 0.05851328  586  HIS   A ND1  
8076  C  CD2  . HIS   A  531 ? 0.97542727 0.96006560 0.83673549 -0.02796067 -0.17491457 0.06201450  586  HIS   A CD2  
8077  C  CE1  . HIS   A  531 ? 0.76765633 0.77426761 0.64970320 -0.02439735 -0.18681590 0.05843276  586  HIS   A CE1  
8078  N  NE2  . HIS   A  531 ? 1.02944791 1.02730489 0.90887415 -0.02276810 -0.17988658 0.06043507  586  HIS   A NE2  
8079  H  H    . HIS   A  531 ? 1.21302617 1.16913223 1.01285517 -0.04742485 -0.17105034 0.06209608  586  HIS   A H    
8080  H  HA   . HIS   A  531 ? 1.19504428 1.15626025 1.00593185 -0.03565249 -0.18846771 0.06709811  586  HIS   A HA   
8081  H  HB2  . HIS   A  531 ? 1.38891208 1.36878610 1.22306859 -0.04151065 -0.17782925 0.05838233  586  HIS   A HB2  
8082  H  HB3  . HIS   A  531 ? 1.34727907 1.31935203 1.18018341 -0.04094144 -0.16814432 0.06025973  586  HIS   A HB3  
8084  H  HD2  . HIS   A  531 ? 1.06801605 1.04486251 0.92394722 -0.02845614 -0.16969937 0.06353363  586  HIS   A HD2  
8085  H  HE1  . HIS   A  531 ? 0.91440183 0.93147784 0.80829394 -0.02180297 -0.19120102 0.05700237  586  HIS   A HE1  
8087  N  N    . THR   A  532 ? 1.16185296 1.11022139 0.97462451 -0.02741117 -0.18453053 0.07365415  587  THR   A N    
8088  C  CA   . THR   A  532 ? 1.22268689 1.15897739 1.02996719 -0.02360448 -0.18338194 0.07829808  587  THR   A CA   
8089  C  C    . THR   A  532 ? 1.54177403 1.48639512 1.36908185 -0.01895153 -0.17980196 0.07626808  587  THR   A C    
8090  O  O    . THR   A  532 ? 1.73640561 1.69146585 1.57840526 -0.01325521 -0.18581101 0.07489733  587  THR   A O    
8091  C  CB   . THR   A  532 ? 1.01295733 0.93995786 0.80900514 -0.01881038 -0.19425948 0.08339103  587  THR   A CB   
8092  O  OG1  . THR   A  532 ? 1.18170655 1.10099244 0.95800507 -0.02395786 -0.19661243 0.08496588  587  THR   A OG1  
8093  C  CG2  . THR   A  532 ? 0.90911287 0.82166624 0.69842541 -0.01495317 -0.19356793 0.08847374  587  THR   A CG2  
8094  H  H    . THR   A  532 ? 1.11767435 1.07408607 0.93857932 -0.02489707 -0.19032425 0.07245730  587  THR   A H    
8095  H  HA   . THR   A  532 ? 1.21570134 1.14390802 1.01285017 -0.02750226 -0.17750233 0.07938361  587  THR   A HA   
8096  H  HB   . THR   A  532 ? 1.05361259 0.98943573 0.86018270 -0.01478346 -0.20042394 0.08213497  587  THR   A HB   
8098  H  HG21 . THR   A  532 ? 0.95629168 0.86067307 0.73483598 -0.01305874 -0.20008844 0.09212951  587  THR   A HG21 
8099  H  HG22 . THR   A  532 ? 0.93922150 0.84530121 0.72162366 -0.01901628 -0.18647002 0.08909501  587  THR   A HG22 
8100  H  HG23 . THR   A  532 ? 0.93487382 0.85266316 0.73737180 -0.01039231 -0.19377850 0.08739731  587  THR   A HG23 
8101  N  N    . LYS   A  533 ? 1.47363126 1.41404688 1.30126238 -0.02157091 -0.16988747 0.07586633  588  LYS   A N    
8102  C  CA   . LYS   A  533 ? 1.49715066 1.44314361 1.34092247 -0.01778614 -0.16544668 0.07410623  588  LYS   A CA   
8103  C  C    . LYS   A  533 ? 1.30609345 1.26653230 1.16857052 -0.01152728 -0.17164245 0.07156435  588  LYS   A C    
8104  O  O    . LYS   A  533 ? 1.53511977 1.51012015 1.41067243 -0.01342336 -0.17011638 0.06713825  588  LYS   A O    
8105  C  CB   . LYS   A  533 ? 1.61349344 1.54446411 1.44876826 -0.01488925 -0.16452026 0.07859058  588  LYS   A CB   
8106  C  CG   . LYS   A  533 ? 1.40544069 1.33648896 1.24845004 -0.01571904 -0.15519908 0.07690308  588  LYS   A CG   
8107  C  CD   . LYS   A  533 ? 1.14194894 1.05810761 0.97776723 -0.01231415 -0.15550236 0.08113601  588  LYS   A CD   
8108  C  CE   . LYS   A  533 ? 1.40523660 1.31084132 1.23023796 -0.01851342 -0.14678107 0.08266889  588  LYS   A CE   
8109  N  NZ   . LYS   A  533 ? 1.54460239 1.44279492 1.35151207 -0.02491310 -0.14623165 0.08509959  588  LYS   A NZ   
8110  H  H    . LYS   A  533 ? 1.49285686 1.42682791 1.31007802 -0.02594315 -0.16572079 0.07660735  588  LYS   A H    
8111  H  HA   . LYS   A  533 ? 1.46041334 1.41037297 1.30824959 -0.02144277 -0.15864664 0.07152957  588  LYS   A HA   
8112  H  HB2  . LYS   A  533 ? 1.55004382 1.47093594 1.37058163 -0.01799265 -0.16440184 0.08141334  588  LYS   A HB2  
8113  H  HB3  . LYS   A  533 ? 1.54012227 1.47040987 1.37844837 -0.00938401 -0.17054546 0.08001545  588  LYS   A HB3  
8114  H  HG2  . LYS   A  533 ? 1.36398840 1.30558538 1.22116256 -0.01331059 -0.15462361 0.07382558  588  LYS   A HG2  
8115  H  HG3  . LYS   A  533 ? 1.36459732 1.29492092 1.20330095 -0.02101513 -0.14940670 0.07595468  588  LYS   A HG3  
8116  H  HD2  . LYS   A  533 ? 1.27266693 1.18168473 1.09986508 -0.01020389 -0.16171746 0.08435982  588  LYS   A HD2  
8117  H  HD3  . LYS   A  533 ? 1.25018501 1.17052209 1.09710157 -0.00792953 -0.15555905 0.07967983  588  LYS   A HD3  
8118  H  HE2  . LYS   A  533 ? 1.37110806 1.26766121 1.19273853 -0.01639747 -0.14709024 0.08511573  588  LYS   A HE2  
8119  H  HE3  . LYS   A  533 ? 1.34697270 1.25957370 1.18017471 -0.02055388 -0.14093876 0.07952486  588  LYS   A HE3  
8120  H  HZ1  . LYS   A  533 ? 1.51047766 1.40374136 1.31021094 -0.02310060 -0.15223032 0.08769229  588  LYS   A HZ1  
8121  H  HZ2  . LYS   A  533 ? 1.48446369 1.39029443 1.29424536 -0.02759997 -0.14438230 0.08241256  588  LYS   A HZ2  
8122  H  HZ3  . LYS   A  533 ? 1.50288033 1.39370823 1.30274892 -0.02800956 -0.14174235 0.08663628  588  LYS   A HZ3  
8123  N  N    . GLY   A  534 ? 1.35382152 1.30996156 1.21704423 -0.00413610 -0.17894439 0.07445890  589  GLY   A N    
8124  C  CA   . GLY   A  534 ? 1.12724662 1.09706354 1.00948799 0.00294014  -0.18404400 0.07198849  589  GLY   A CA   
8125  C  C    . GLY   A  534 ? 1.09882081 1.07644176 0.99699116 0.00437822  -0.17593591 0.06848201  589  GLY   A C    
8126  O  O    . GLY   A  534 ? 0.92380339 0.89104033 0.81723934 0.00436884  -0.17008334 0.06990062  589  GLY   A O    
8127  H  H    . GLY   A  534 ? 1.30798113 1.25240171 1.15933490 -0.00343743 -0.18106580 0.07807481  589  GLY   A H    
8128  H  HA2  . GLY   A  534 ? 1.18441427 1.14849544 1.06372833 0.00818577  -0.19002631 0.07466694  589  GLY   A HA2  
8129  H  HA3  . GLY   A  534 ? 1.17236912 1.15223277 1.05995464 0.00166320  -0.18714236 0.06987594  589  GLY   A HA3  
8130  N  N    . SER   A  535 ? 1.20971179 1.20578539 1.12638712 0.00514992  -0.17566881 0.06387771  590  SER   A N    
8131  C  CA   . SER   A  535 ? 1.17986012 1.18518031 1.11219788 0.00640343  -0.16830833 0.06023627  590  SER   A CA   
8132  C  C    . SER   A  535 ? 1.26781797 1.27945828 1.20287478 -0.00174772 -0.15956543 0.05703054  590  SER   A C    
8133  O  O    . SER   A  535 ? 1.12644100 1.14822316 1.07523024 -0.00168494 -0.15385483 0.05363294  590  SER   A O    
8134  C  CB   . SER   A  535 ? 1.10519755 1.12734318 1.05709672 0.01300104  -0.17330498 0.05726672  590  SER   A CB   
8135  O  OG   . SER   A  535 ? 1.00825870 1.04402542 0.96653354 0.00954765  -0.17723383 0.05500220  590  SER   A OG   
8136  H  H    . SER   A  535 ? 1.17588794 1.17906761 1.09526610 0.00464571  -0.18024991 0.06298785  590  SER   A H    
8137  H  HA   . SER   A  535 ? 1.18663907 1.18286264 1.11511302 0.00854147  -0.16572671 0.06176649  590  SER   A HA   
8138  H  HB2  . SER   A  535 ? 1.08726656 1.11527169 1.04901373 0.01394531  -0.16813990 0.05485610  590  SER   A HB2  
8139  H  HB3  . SER   A  535 ? 1.10665655 1.12439549 1.05704117 0.01881097  -0.17903885 0.05924712  590  SER   A HB3  
8141  N  N    . THR   A  536 ? 1.73074377 1.73600459 1.65224612 -0.00852384 -0.15864940 0.05807822  591  THR   A N    
8142  C  CA   . THR   A  536 ? 1.50315511 1.51233697 1.42541373 -0.01597212 -0.15090375 0.05522869  591  THR   A CA   
8143  C  C    . THR   A  536 ? 0.85798752 0.85943753 0.77769148 -0.01732607 -0.14175946 0.05553577  591  THR   A C    
8144  O  O    . THR   A  536 ? 0.92565018 0.93403208 0.85380197 -0.02031559 -0.13496467 0.05249248  591  THR   A O    
8145  C  CB   . THR   A  536 ? 1.48204875 1.48530889 1.38947117 -0.02208338 -0.15253088 0.05603898  591  THR   A CB   
8146  O  OG1  . THR   A  536 ? 1.40796781 1.39448678 1.29745901 -0.02261598 -0.15188010 0.06017094  591  THR   A OG1  
8147  C  CG2  . THR   A  536 ? 1.11860359 1.12895274 1.02739167 -0.02120319 -0.16218825 0.05566354  591  THR   A CG2  
8148  H  H    . THR   A  536 ? 1.55210888 1.54997301 1.46321368 -0.00833927 -0.16301017 0.06062588  591  THR   A H    
8149  H  HA   . THR   A  536 ? 1.36465597 1.38574731 1.29913509 -0.01613161 -0.15058529 0.05234693  591  THR   A HA   
8150  H  HB   . THR   A  536 ? 1.38371849 1.38990545 1.29269767 -0.02656379 -0.14741398 0.05381417  591  THR   A HB   
8152  H  HG21 . THR   A  536 ? 1.19623876 1.20259309 1.09524846 -0.02535124 -0.16266988 0.05579821  591  THR   A HG21 
8153  H  HG22 . THR   A  536 ? 1.22382736 1.23081005 1.13041162 -0.01662897 -0.16765301 0.05801840  591  THR   A HG22 
8154  H  HG23 . THR   A  536 ? 1.20264602 1.22487605 1.12418127 -0.02112621 -0.16252495 0.05287311  591  THR   A HG23 
8155  N  N    . LYS   A  537 ? 0.89338076 0.88001966 0.80076033 -0.01546030 -0.14196768 0.05939006  592  LYS   A N    
8156  C  CA   . LYS   A  537 ? 1.09675479 1.07523179 1.00108588 -0.01665818 -0.13419040 0.05998215  592  LYS   A CA   
8157  C  C    . LYS   A  537 ? 0.76728582 0.75400174 0.68759185 -0.01208604 -0.13143241 0.05735075  592  LYS   A C    
8158  O  O    . LYS   A  537 ? 0.89074087 0.87974948 0.81574887 -0.01468702 -0.12386242 0.05523121  592  LYS   A O    
8159  C  CB   . LYS   A  537 ? 0.82778764 0.78860056 0.71577382 -0.01562577 -0.13604684 0.06493746  592  LYS   A CB   
8160  C  CG   . LYS   A  537 ? 0.88364714 0.83513302 0.76551032 -0.01917715 -0.12772474 0.06573766  592  LYS   A CG   
8161  C  CD   . LYS   A  537 ? 1.00001574 0.93624967 0.86240625 -0.02315190 -0.12743056 0.07002935  592  LYS   A CD   
8162  C  CE   . LYS   A  537 ? 0.80825436 0.73944026 0.66614372 -0.02860150 -0.11835051 0.06977385  592  LYS   A CE   
8163  N  NZ   . LYS   A  537 ? 0.82035941 0.74205893 0.66116285 -0.03430950 -0.11671028 0.07249857  592  LYS   A NZ   
8164  H  H    . LYS   A  537 ? 0.94615096 0.92741776 0.84653866 -0.01360925 -0.14728522 0.06179909  592  LYS   A H    
8165  H  HA   . LYS   A  537 ? 0.92302531 0.90215433 0.82515615 -0.02156779 -0.12933341 0.05873979  592  LYS   A HA   
8166  H  HB2  . LYS   A  537 ? 0.90573072 0.86264318 0.78414273 -0.01787302 -0.13888380 0.06655506  592  LYS   A HB2  
8167  H  HB3  . LYS   A  537 ? 0.90256464 0.86171407 0.79318476 -0.01037002 -0.14026916 0.06609539  592  LYS   A HB3  
8168  H  HG2  . LYS   A  537 ? 0.89075840 0.84040982 0.77715814 -0.01561995 -0.12721963 0.06584914  592  LYS   A HG2  
8169  H  HG3  . LYS   A  537 ? 0.88171422 0.83921194 0.76815093 -0.02254652 -0.12276927 0.06317536  592  LYS   A HG3  
8170  H  HD2  . LYS   A  537 ? 0.93101513 0.86836934 0.78802085 -0.02542575 -0.12967549 0.07022522  592  LYS   A HD2  
8171  H  HD3  . LYS   A  537 ? 0.94169486 0.87002265 0.79931790 -0.01990639 -0.13122551 0.07286172  592  LYS   A HD3  
8172  H  HE2  . LYS   A  537 ? 0.84794992 0.77398038 0.70661628 -0.02670740 -0.11712809 0.07077640  592  LYS   A HE2  
8173  H  HE3  . LYS   A  537 ? 0.83541954 0.77493954 0.70116776 -0.03033338 -0.11450297 0.06663790  592  LYS   A HE3  
8174  H  HZ1  . LYS   A  537 ? 0.83136958 0.74552536 0.66421074 -0.03295390 -0.12075320 0.07555151  592  LYS   A HZ1  
8175  H  HZ2  . LYS   A  537 ? 0.81738698 0.74395573 0.65760958 -0.03648886 -0.11679268 0.07100489  592  LYS   A HZ2  
8176  H  HZ3  . LYS   A  537 ? 0.81634176 0.73484027 0.65499568 -0.03704814 -0.11156988 0.07256778  592  LYS   A HZ3  
8177  N  N    . GLU   A  538 ? 0.55981243 0.55182654 0.48874360 -0.00512027 -0.13780443 0.05722184  593  GLU   A N    
8178  C  CA   . GLU   A  538 ? 0.74714357 0.74722987 0.69097757 0.00006129  -0.13560651 0.05449111  593  GLU   A CA   
8179  C  C    . GLU   A  538 ? 0.81072664 0.82675660 0.76811785 -0.00359433 -0.13037853 0.05004039  593  GLU   A C    
8180  O  O    . GLU   A  538 ? 0.79051572 0.80916059 0.75430351 -0.00385952 -0.12370515 0.04791748  593  GLU   A O    
8181  C  CB   . GLU   A  538 ? 0.79709542 0.80099463 0.74802917 0.00868642  -0.14411083 0.05491734  593  GLU   A CB   
8182  C  CG   . GLU   A  538 ? 1.08512330 1.08969569 1.04548883 0.01554756  -0.14212912 0.05329663  593  GLU   A CG   
8183  C  CD   . GLU   A  538 ? 1.08195901 1.09934914 1.05769384 0.02377186  -0.14796746 0.05102171  593  GLU   A CD   
8184  O  OE1  . GLU   A  538 ? 0.97600603 0.99155915 0.94916642 0.02815949  -0.15693720 0.05323405  593  GLU   A OE1  
8185  O  OE2  . GLU   A  538 ? 0.92417359 0.95371521 0.91452456 0.02592896  -0.14353046 0.04696658  593  GLU   A OE2  
8186  H  H    . GLU   A  538 ? 0.65723729 0.64789629 0.58258468 -0.00339258 -0.14372313 0.05878087  593  GLU   A H    
8187  H  HA   . GLU   A  538 ? 0.72325772 0.71545434 0.66336608 0.00035458  -0.13187875 0.05524875  593  GLU   A HA   
8188  H  HB2  . GLU   A  538 ? 0.85154134 0.84587598 0.79236054 0.00983358  -0.14874086 0.05807217  593  GLU   A HB2  
8189  H  HB3  . GLU   A  538 ? 0.84032458 0.85580748 0.79954213 0.00870136  -0.14666808 0.05305475  593  GLU   A HB3  
8190  H  HG2  . GLU   A  538 ? 0.99367404 1.00224161 0.95869374 0.01295964  -0.13578676 0.05107474  593  GLU   A HG2  
8191  H  HG3  . GLU   A  538 ? 1.01458085 1.00637078 0.96598428 0.01724103  -0.14279288 0.05583508  593  GLU   A HG3  
8192  N  N    . ARG   A  539 ? 0.64884907 0.67474586 0.60973012 -0.00677192 -0.13356787 0.04874162  594  ARG   A N    
8193  C  CA   . ARG   A  539 ? 0.71829385 0.75936425 0.69228721 -0.01033439 -0.12959900 0.04477576  594  ARG   A CA   
8194  C  C    . ARG   A  539 ? 0.48505786 0.52342832 0.45356780 -0.01825523 -0.12235646 0.04384895  594  ARG   A C    
8195  O  O    . ARG   A  539 ? 0.58460987 0.63065606 0.56220567 -0.02031184 -0.11648110 0.04118888  594  ARG   A O    
8196  C  CB   . ARG   A  539 ? 0.94437486 0.99849176 0.92640334 -0.01068670 -0.13621305 0.04329642  594  ARG   A CB   
8197  C  CG   . ARG   A  539 ? 1.28716111 1.35712838 1.28392589 -0.01445484 -0.13148719 0.03925229  594  ARG   A CG   
8198  C  CD   . ARG   A  539 ? 1.40496671 1.49033451 1.41317785 -0.01469353 -0.13740899 0.03725315  594  ARG   A CD   
8199  N  NE   . ARG   A  539 ? 0.81200123 0.91069508 0.83251071 -0.01947780 -0.13204309 0.03382508  594  ARG   A NE   
8200  C  CZ   . ARG   A  539 ? 1.19417512 1.30733526 1.22535598 -0.02223690 -0.13533345 0.03158652  594  ARG   A CZ   
8201  N  NH1  . ARG   A  539 ? 1.74707627 1.86467528 1.77946556 -0.02021946 -0.14433171 0.03206471  594  ARG   A NH1  
8202  N  NH2  . ARG   A  539 ? 1.36919105 1.49240220 1.40973282 -0.02746850 -0.12968023 0.02891501  594  ARG   A NH2  
8203  H  H    . ARG   A  539 ? 0.70815617 0.73090291 0.66273355 -0.00691515 -0.13842718 0.05040967  594  ARG   A H    
8204  H  HA   . ARG   A  539 ? 0.68097663 0.72698092 0.66378170 -0.00728838 -0.12717514 0.04325150  594  ARG   A HA   
8205  H  HB2  . ARG   A  539 ? 0.95421618 1.01104128 0.94061410 -0.00532898 -0.14119859 0.04373943  594  ARG   A HB2  
8206  H  HB3  . ARG   A  539 ? 0.95065635 1.00020576 0.92388487 -0.01399097 -0.13854463 0.04446219  594  ARG   A HB3  
8207  H  HG2  . ARG   A  539 ? 1.19890940 1.26571333 1.19068146 -0.01978630 -0.12746069 0.03894428  594  ARG   A HG2  
8208  H  HG3  . ARG   A  539 ? 1.20210338 1.27521491 1.20580363 -0.01178188 -0.12799151 0.03814526  594  ARG   A HG3  
8209  H  HD2  . ARG   A  539 ? 1.21023762 1.30004990 1.22476971 -0.00906180 -0.14136489 0.03727860  594  ARG   A HD2  
8210  H  HD3  . ARG   A  539 ? 1.21561205 1.29765141 1.21658111 -0.01729054 -0.14124916 0.03822772  594  ARG   A HD3  
8211  H  HE   . ARG   A  539 ? 1.00515103 1.10205030 1.02582836 -0.02082337 -0.12638007 0.03329109  594  ARG   A HE   
8212  H  HH11 . ARG   A  539 ? 1.55499816 1.66784668 1.58365452 -0.01561227 -0.14834529 0.03373986  594  ARG   A HH11 
8213  H  HH12 . ARG   A  539 ? 1.54835498 1.67350245 1.58515882 -0.02355429 -0.14647573 0.03073475  594  ARG   A HH12 
8214  H  HH21 . ARG   A  539 ? 1.31034815 1.44358575 1.35861075 -0.02948067 -0.13172267 0.02741272  594  ARG   A HH21 
8215  H  HH22 . ARG   A  539 ? 1.29669642 1.41640782 1.33554173 -0.02905826 -0.12400229 0.02872913  594  ARG   A HH22 
8216  N  N    . HIS   A  540 ? 0.37103000 0.39884728 0.32480735 -0.02250437 -0.12284189 0.04591853  595  HIS   A N    
8217  C  CA   . HIS   A  540 ? 0.32969102 0.35604855 0.27892318 -0.02954206 -0.11697201 0.04460358  595  HIS   A CA   
8218  C  C    . HIS   A  540 ? 0.40356326 0.41885245 0.34476018 -0.03091822 -0.11019310 0.04586400  595  HIS   A C    
8219  O  O    . HIS   A  540 ? 0.37635595 0.39220047 0.31742394 -0.03555288 -0.10425068 0.04423716  595  HIS   A O    
8220  C  CB   . HIS   A  540 ? 0.34635818 0.37082744 0.28650633 -0.03361900 -0.12131417 0.04493024  595  HIS   A CB   
8221  C  CG   . HIS   A  540 ? 0.39324895 0.43124211 0.34439209 -0.03341617 -0.12692046 0.04276820  595  HIS   A CG   
8222  N  ND1  . HIS   A  540 ? 0.32669646 0.37731636 0.29132220 -0.03618662 -0.12362897 0.03936429  595  HIS   A ND1  
8223  C  CD2  . HIS   A  540 ? 0.37937436 0.42065465 0.33075505 -0.03074050 -0.13551208 0.04360071  595  HIS   A CD2  
8224  C  CE1  . HIS   A  540 ? 0.41329578 0.47458419 0.38595736 -0.03553202 -0.12997390 0.03816923  595  HIS   A CE1  
8225  N  NE2  . HIS   A  540 ? 0.40414140 0.46066689 0.36961526 -0.03201505 -0.13755895 0.04053440  595  HIS   A NE2  
8226  H  H    . HIS   A  540 ? 0.39767200 0.41907108 0.34399480 -0.02085025 -0.12694202 0.04813447  595  HIS   A H    
8227  H  HA   . HIS   A  540 ? 0.34404224 0.37934023 0.30285063 -0.03075485 -0.11467444 0.04223371  595  HIS   A HA   
8228  H  HB2  . HIS   A  540 ? 0.36516857 0.38184935 0.29616779 -0.03216593 -0.12447917 0.04735228  595  HIS   A HB2  
8229  H  HB3  . HIS   A  540 ? 0.35081488 0.37293261 0.28689688 -0.03791460 -0.11731255 0.04405014  595  HIS   A HB3  
8231  H  HD2  . HIS   A  540 ? 0.40013546 0.43453419 0.34339070 -0.02858128 -0.13949086 0.04593769  595  HIS   A HD2  
8232  H  HE1  . HIS   A  540 ? 0.37964547 0.45064658 0.36171687 -0.03746651 -0.12942615 0.03601780  595  HIS   A HE1  
8234  N  N    . LEU   A  541 ? 0.40016538 0.40553641 0.33507887 -0.02697003 -0.11131631 0.04868899  596  LEU   A N    
8235  C  CA   . LEU   A  541 ? 0.43882784 0.43447632 0.36767852 -0.02808617 -0.10517617 0.04979748  596  LEU   A CA   
8236  C  C    . LEU   A  541 ? 0.39341572 0.38910353 0.32973719 -0.02259489 -0.10427703 0.04956133  596  LEU   A C    
8237  O  O    . LEU   A  541 ? 0.43336678 0.42012629 0.36433238 -0.01853570 -0.10752355 0.05213107  596  LEU   A O    
8238  C  CB   . LEU   A  541 ? 0.48956388 0.47082567 0.40190110 -0.02962761 -0.10620555 0.05352310  596  LEU   A CB   
8239  C  CG   . LEU   A  541 ? 0.67385101 0.65109223 0.57597870 -0.03603250 -0.10270797 0.05354433  596  LEU   A CG   
8240  C  CD1  . LEU   A  541 ? 0.83930123 0.80310273 0.72558284 -0.03712074 -0.10383460 0.05742219  596  LEU   A CD1  
8241  C  CD2  . LEU   A  541 ? 0.59907418 0.57766449 0.50436658 -0.03945151 -0.09479926 0.05149800  596  LEU   A CD2  
8242  H  H    . LEU   A  541 ? 0.41703996 0.42142117 0.35129291 -0.02357371 -0.11627265 0.05000463  596  LEU   A H    
8243  H  HA   . LEU   A  541 ? 0.42184174 0.42012051 0.35241970 -0.03159825 -0.10059951 0.04814021  596  LEU   A HA   
8244  H  HB2  . LEU   A  541 ? 0.52575207 0.50531244 0.43517378 -0.02724940 -0.11169758 0.05510048  596  LEU   A HB2  
8245  H  HB3  . LEU   A  541 ? 0.51558149 0.49090597 0.42608646 -0.02838857 -0.10404932 0.05460794  596  LEU   A HB3  
8246  H  HG   . LEU   A  541 ? 0.64356333 0.62587607 0.54672879 -0.03740948 -0.10500070 0.05234676  596  LEU   A HG   
8247  H  HD11 . LEU   A  541 ? 0.77323145 0.73552781 0.65308797 -0.04091383 -0.10212735 0.05717187  596  LEU   A HD11 
8248  H  HD12 . LEU   A  541 ? 0.77279174 0.73139060 0.65765244 -0.03681289 -0.10088561 0.05843146  596  LEU   A HD12 
8249  H  HD13 . LEU   A  541 ? 0.78165412 0.74335319 0.66532588 -0.03441303 -0.10925737 0.05916164  596  LEU   A HD13 
8250  H  HD21 . LEU   A  541 ? 0.60410810 0.59084702 0.51848108 -0.03940158 -0.09382832 0.04914956  596  LEU   A HD21 
8251  H  HD22 . LEU   A  541 ? 0.61496544 0.58914137 0.51984507 -0.03818198 -0.09273595 0.05245323  596  LEU   A HD22 
8252  H  HD23 . LEU   A  541 ? 0.61814439 0.59380293 0.51669973 -0.04303863 -0.09272498 0.05150941  596  LEU   A HD23 
8253  N  N    . LEU   A  542 ? 0.40087536 0.40604484 0.34889340 -0.02264356 -0.09980192 0.04640206  597  LEU   A N    
8254  C  CA   . LEU   A  542 ? 0.34108397 0.34920073 0.29812950 -0.01723704 -0.09884996 0.04509929  597  LEU   A CA   
8255  C  C    . LEU   A  542 ? 0.34278113 0.33917066 0.29332194 -0.01678967 -0.09476738 0.04629003  597  LEU   A C    
8256  O  O    . LEU   A  542 ? 0.37973449 0.37422138 0.33408064 -0.01149921 -0.09535222 0.04587169  597  LEU   A O    
8257  C  CB   . LEU   A  542 ? 0.33405691 0.35625595 0.30438328 -0.01861305 -0.09468965 0.04132499  597  LEU   A CB   
8258  C  CG   . LEU   A  542 ? 0.35744435 0.39374083 0.33791980 -0.01854672 -0.09850451 0.03950433  597  LEU   A CG   
8259  C  CD1  . LEU   A  542 ? 0.32167146 0.37050757 0.31445545 -0.02001941 -0.09371488 0.03618270  597  LEU   A CD1  
8260  C  CD2  . LEU   A  542 ? 0.38512903 0.42428350 0.37015331 -0.01154210 -0.10579495 0.04013082  597  LEU   A CD2  
8261  H  H    . LEU   A  542 ? 0.37584993 0.38556081 0.32589236 -0.02623377 -0.09717570 0.04494499  597  LEU   A H    
8262  H  HA   . LEU   A  542 ? 0.35884267 0.36785340 0.31794304 -0.01295729 -0.10366297 0.04571326  597  LEU   A HA   
8263  H  HB2  . LEU   A  542 ? 0.33393428 0.35490406 0.30152571 -0.02297205 -0.09066225 0.04094412  597  LEU   A HB2  
8264  H  HB3  . LEU   A  542 ? 0.33685207 0.36015517 0.31198028 -0.01548433 -0.09296113 0.04028799  597  LEU   A HB3  
8265  H  HG   . LEU   A  542 ? 0.35175073 0.38706258 0.32743177 -0.02227889 -0.09970042 0.04012229  597  LEU   A HG   
8266  H  HD11 . LEU   A  542 ? 0.32720160 0.38434398 0.32521319 -0.02158763 -0.09565751 0.03518989  597  LEU   A HD11 
8267  H  HD12 . LEU   A  542 ? 0.32901895 0.38065606 0.32758594 -0.01589230 -0.09319767 0.03520981  597  LEU   A HD12 
8268  H  HD13 . LEU   A  542 ? 0.32430702 0.37014508 0.31394088 -0.02361283 -0.08918386 0.03595123  597  LEU   A HD13 
8269  H  HD21 . LEU   A  542 ? 0.38794968 0.41982740 0.36465299 -0.01135243 -0.10959797 0.04243945  597  LEU   A HD21 
8270  H  HD22 . LEU   A  542 ? 0.38053933 0.41795558 0.36810711 -0.00745095 -0.10488099 0.03980217  597  LEU   A HD22 
8271  H  HD23 . LEU   A  542 ? 0.37647992 0.42640066 0.37007234 -0.01137742 -0.10761140 0.03849648  597  LEU   A HD23 
8272  N  N    . TYR   A  543 ? 0.32430422 0.31329143 0.26556170 -0.02229727 -0.09063213 0.04744441  598  TYR   A N    
8273  C  CA   . TYR   A  543 ? 0.44432369 0.42428690 0.38103160 -0.02303843 -0.08609598 0.04802686  598  TYR   A CA   
8274  C  C    . TYR   A  543 ? 0.36415914 0.33066568 0.28644174 -0.02585133 -0.08672451 0.05167566  598  TYR   A C    
8275  O  O    . TYR   A  543 ? 0.46191275 0.42202610 0.37888297 -0.02932978 -0.08211803 0.05222483  598  TYR   A O    
8276  C  CB   . TYR   A  543 ? 0.35404053 0.33991587 0.29564399 -0.02718560 -0.07930555 0.04535566  598  TYR   A CB   
8277  C  CG   . TYR   A  543 ? 0.37565535 0.37555081 0.32964996 -0.02643633 -0.07870004 0.04222449  598  TYR   A CG   
8278  C  CD1  . TYR   A  543 ? 0.35056210 0.35654044 0.31424934 -0.02149650 -0.07878256 0.04020771  598  TYR   A CD1  
8279  C  CD2  . TYR   A  543 ? 0.35198689 0.35897958 0.30782276 -0.03075234 -0.07809881 0.04118981  598  TYR   A CD2  
8280  C  CE1  . TYR   A  543 ? 0.31921780 0.33886254 0.29436243 -0.02134839 -0.07782755 0.03742674  598  TYR   A CE1  
8281  C  CE2  . TYR   A  543 ? 0.37790561 0.39740840 0.34477940 -0.03087495 -0.07750446 0.03858814  598  TYR   A CE2  
8282  C  CZ   . TYR   A  543 ? 0.39070424 0.41700864 0.36737385 -0.02636721 -0.07723794 0.03681718  598  TYR   A CZ   
8283  O  OH   . TYR   A  543 ? 0.39367175 0.43310434 0.38126445 -0.02714718 -0.07618348 0.03432686  598  TYR   A OH   
8284  H  H    . TYR   A  543 ? 0.35071644 0.34055394 0.28863260 -0.02566284 -0.09066157 0.04770595  598  TYR   A H    
8285  H  HA   . TYR   A  543 ? 0.38741195 0.36620778 0.32741851 -0.01887947 -0.08711528 0.04769282  598  TYR   A HA   
8286  H  HB2  . TYR   A  543 ? 0.37636369 0.36028081 0.31280434 -0.03117991 -0.07776520 0.04597224  598  TYR   A HB2  
8287  H  HB3  . TYR   A  543 ? 0.37639990 0.35832644 0.31765759 -0.02653212 -0.07682599 0.04513111  598  TYR   A HB3  
8288  H  HD1  . TYR   A  543 ? 0.35484001 0.35553995 0.31718063 -0.01831642 -0.07935161 0.04065531  598  TYR   A HD1  
8289  H  HD2  . TYR   A  543 ? 0.36562896 0.36865664 0.31494606 -0.03381214 -0.07792149 0.04220053  598  TYR   A HD2  
8290  H  HE1  . TYR   A  543 ? 0.34030825 0.36453530 0.32201445 -0.01800257 -0.07748432 0.03589489  598  TYR   A HE1  
8291  H  HE2  . TYR   A  543 ? 0.36896324 0.39232033 0.33659410 -0.03407785 -0.07721796 0.03795136  598  TYR   A HE2  
8293  N  N    . GLY   A  544 ? 0.45327437 0.41591614 0.36919984 -0.02451833 -0.09253808 0.05420008  599  GLY   A N    
8294  C  CA   . GLY   A  544 ? 0.42714810 0.37750292 0.32840073 -0.02764916 -0.09326793 0.05789888  599  GLY   A CA   
8295  C  C    . GLY   A  544 ? 0.35391426 0.30697772 0.24994366 -0.03366211 -0.09080146 0.05750675  599  GLY   A C    
8296  O  O    . GLY   A  544 ? 0.37965584 0.34220558 0.28293645 -0.03585439 -0.08762077 0.05443529  599  GLY   A O    
8297  H  H    . GLY   A  544 ? 0.42401731 0.39188382 0.34468168 -0.02165455 -0.09620544 0.05365971  599  GLY   A H    
8298  H  HA2  . GLY   A  544 ? 0.42583835 0.37222868 0.32336837 -0.02492157 -0.09825862 0.05989460  599  GLY   A HA2  
8299  H  HA3  . GLY   A  544 ? 0.41867900 0.36245182 0.31668574 -0.02852935 -0.09049264 0.05868774  599  GLY   A HA3  
8300  N  N    . ARG   A  545 ? 0.35381788 0.29769728 0.23648021 -0.03628281 -0.09225527 0.06066841  600  ARG   A N    
8301  C  CA   . ARG   A  545 ? 0.40554971 0.34971589 0.28102839 -0.04199252 -0.08911807 0.06033936  600  ARG   A CA   
8302  C  C    . ARG   A  545 ? 0.40011692 0.34421605 0.27706355 -0.04577110 -0.08143523 0.05888258  600  ARG   A C    
8303  O  O    . ARG   A  545 ? 0.38201022 0.31958663 0.25757813 -0.04544785 -0.07942890 0.06025486  600  ARG   A O    
8304  C  CB   . ARG   A  545 ? 0.48170999 0.41454315 0.34147757 -0.04350196 -0.09218373 0.06450750  600  ARG   A CB   
8305  C  CG   . ARG   A  545 ? 0.74231505 0.67508316 0.59293157 -0.04870367 -0.09003705 0.06420355  600  ARG   A CG   
8306  C  CD   . ARG   A  545 ? 0.69096142 0.61322790 0.52569866 -0.04972403 -0.09408095 0.06839507  600  ARG   A CD   
8307  N  NE   . ARG   A  545 ? 0.59992748 0.51023465 0.42681456 -0.04995911 -0.09333191 0.07235621  600  ARG   A NE   
8308  C  CZ   . ARG   A  545 ? 0.55313694 0.45858824 0.37464136 -0.05460659 -0.08692330 0.07315326  600  ARG   A CZ   
8309  N  NH1  . ARG   A  545 ? 0.67002136 0.58264577 0.49626821 -0.05816412 -0.08034520 0.06978791  600  ARG   A NH1  
8310  N  NH2  . ARG   A  545 ? 0.53551853 0.42865077 0.34702086 -0.05570245 -0.08728316 0.07742108  600  ARG   A NH2  
8311  H  H    . ARG   A  545 ? 0.37881330 0.31565979 0.25628537 -0.03435265 -0.09529232 0.06311744  600  ARG   A H    
8312  H  HA   . ARG   A  545 ? 0.40079546 0.35211214 0.28038195 -0.04224185 -0.09024174 0.05843572  600  ARG   A HA   
8313  H  HB2  . ARG   A  545 ? 0.51635379 0.44844180 0.37568247 -0.04028888 -0.09761985 0.06570094  600  ARG   A HB2  
8314  H  HB3  . ARG   A  545 ? 0.51562029 0.44123787 0.37118152 -0.04406818 -0.09043079 0.06636167  600  ARG   A HB3  
8315  H  HG2  . ARG   A  545 ? 0.64388716 0.57629466 0.49385259 -0.05172491 -0.08476176 0.06341156  600  ARG   A HG2  
8316  H  HG3  . ARG   A  545 ? 0.64536482 0.58532441 0.50069433 -0.04858401 -0.09118886 0.06192404  600  ARG   A HG3  
8317  H  HD2  . ARG   A  545 ? 0.67646050 0.59868121 0.50496840 -0.05329850 -0.09186084 0.06789752  600  ARG   A HD2  
8318  H  HD3  . ARG   A  545 ? 0.68252963 0.60595071 0.51787567 -0.04682239 -0.09966929 0.06893377  600  ARG   A HD3  
8319  H  HE   . ARG   A  545 ? 0.61364293 0.51973093 0.43947253 -0.04690157 -0.09746307 0.07429408  600  ARG   A HE   
8320  H  HH11 . ARG   A  545 ? 0.62447608 0.54084933 0.44920087 -0.05975745 -0.07962642 0.06832224  600  ARG   A HH11 
8321  H  HH12 . ARG   A  545 ? 0.61983633 0.53323972 0.45061675 -0.05882071 -0.07687224 0.06897908  600  ARG   A HH12 
8322  H  HH21 . ARG   A  545 ? 0.54564124 0.43622151 0.35499877 -0.05879100 -0.08299377 0.07780763  600  ARG   A HH21 
8323  H  HH22 . ARG   A  545 ? 0.55506289 0.44251952 0.36210853 -0.05341591 -0.09190945 0.07988231  600  ARG   A HH22 
8324  N  N    . PRO   A  546 ? 0.34194648 0.29266906 0.22146150 -0.04936819 -0.07727940 0.05608346  601  PRO   A N    
8325  C  CA   . PRO   A  546 ? 0.40722537 0.35683069 0.28575936 -0.05321220 -0.07052615 0.05518195  601  PRO   A CA   
8326  C  C    . PRO   A  546 ? 0.45834714 0.39817703 0.32380062 -0.05659453 -0.06887157 0.05825672  601  PRO   A C    
8327  O  O    . PRO   A  546 ? 0.43476933 0.37039500 0.29024142 -0.05764923 -0.07167416 0.06018805  601  PRO   A O    
8328  C  CB   . PRO   A  546 ? 0.41473728 0.37235424 0.29677573 -0.05570519 -0.06812275 0.05184444  601  PRO   A CB   
8329  C  CG   . PRO   A  546 ? 0.36416918 0.32840478 0.25244594 -0.05300408 -0.07315852 0.05059777  601  PRO   A CG   
8330  C  CD   . PRO   A  546 ? 0.35024241 0.30920583 0.23325849 -0.05001106 -0.07914638 0.05365127  601  PRO   A CD   
8331  H  HA   . PRO   A  546 ? 0.39456666 0.34515312 0.27897212 -0.05197525 -0.06888390 0.05450861  601  PRO   A HA   
8332  H  HB2  . PRO   A  546 ? 0.40414900 0.35929841 0.27893183 -0.05823568 -0.06713031 0.05220285  601  PRO   A HB2  
8333  H  HB3  . PRO   A  546 ? 0.39145786 0.35219809 0.27890420 -0.05640969 -0.06459570 0.05017388  601  PRO   A HB3  
8334  H  HG2  . PRO   A  546 ? 0.36745775 0.33430713 0.25431588 -0.05482998 -0.07323741 0.04924938  601  PRO   A HG2  
8335  H  HG3  . PRO   A  546 ? 0.36058322 0.32973284 0.25751498 -0.05142635 -0.07253221 0.04916243  601  PRO   A HG3  
8336  H  HD2  . PRO   A  546 ? 0.35941505 0.31548810 0.23465675 -0.05146844 -0.08089017 0.05463991  601  PRO   A HD2  
8337  H  HD3  . PRO   A  546 ? 0.35079056 0.31436366 0.24038157 -0.04715806 -0.08230825 0.05299025  601  PRO   A HD3  
8338  N  N    . ALA   A  547 ? 0.43251923 0.36879382 0.29762328 -0.05867610 -0.06430202 0.05875092  602  ALA   A N    
8339  C  CA   . ALA   A  547 ? 0.34399998 0.27240974 0.19750676 -0.06295315 -0.06166288 0.06140900  602  ALA   A CA   
8340  C  C    . ALA   A  547 ? 0.30317396 0.23693429 0.15579903 -0.06708425 -0.05620173 0.05895947  602  ALA   A C    
8341  O  O    . ALA   A  547 ? 0.34940305 0.29095390 0.21125776 -0.06693594 -0.05329737 0.05555446  602  ALA   A O    
8342  C  CB   . ALA   A  547 ? 0.37192333 0.29364145 0.22513087 -0.06361122 -0.05987538 0.06322998  602  ALA   A CB   
8343  H  H    . ALA   A  547 ? 0.40347898 0.34239841 0.27547514 -0.05766674 -0.06278208 0.05741420  602  ALA   A H    
8344  H  HA   . ALA   A  547 ? 0.36679778 0.29063678 0.21283063 -0.06271891 -0.06485937 0.06357393  602  ALA   A HA   
8345  H  HB1  . ALA   A  547 ? 0.37010795 0.28752381 0.21625699 -0.06711155 -0.05754936 0.06483087  602  ALA   A HB1  
8346  H  HB2  . ALA   A  547 ? 0.36986771 0.28693786 0.22221142 -0.06082240 -0.06360172 0.06490069  602  ALA   A HB2  
8347  H  HB3  . ALA   A  547 ? 0.35548723 0.28166527 0.21625720 -0.06339701 -0.05738644 0.06108494  602  ALA   A HB3  
8348  N  N    . VAL   A  548 ? 0.34023166 0.26944143 0.18116117 -0.07066947 -0.05479769 0.06070888  603  VAL   A N    
8349  C  CA   . VAL   A  548 ? 0.36035633 0.29400331 0.19941244 -0.07442112 -0.04920742 0.05834005  603  VAL   A CA   
8350  C  C    . VAL   A  548 ? 0.39520043 0.32586044 0.23208660 -0.07827856 -0.04397756 0.05969518  603  VAL   A C    
8351  O  O    . VAL   A  548 ? 0.32025421 0.24248970 0.14729752 -0.08059001 -0.04439501 0.06348893  603  VAL   A O    
8352  C  CB   . VAL   A  548 ? 0.40547225 0.33712226 0.23312786 -0.07594369 -0.05063402 0.05876026  603  VAL   A CB   
8353  C  CG1  . VAL   A  548 ? 0.38821277 0.32350463 0.21240643 -0.07978248 -0.04426608 0.05626918  603  VAL   A CG1  
8354  C  CG2  . VAL   A  548 ? 0.36231846 0.29807097 0.19382969 -0.07244336 -0.05609493 0.05692876  603  VAL   A CG2  
8355  H  H    . VAL   A  548 ? 0.34797794 0.27104199 0.18165247 -0.07067143 -0.05738423 0.06343418  603  VAL   A H    
8356  H  HA   . VAL   A  548 ? 0.35665011 0.29659474 0.20354490 -0.07336099 -0.04807521 0.05545286  603  VAL   A HA   
8357  H  HB   . VAL   A  548 ? 0.39813465 0.32297298 0.21757208 -0.07673903 -0.05242312 0.06198516  603  VAL   A HB   
8358  H  HG11 . VAL   A  548 ? 0.38341945 0.32453728 0.21591017 -0.07909255 -0.04208684 0.05342473  603  VAL   A HG11 
8359  H  HG12 . VAL   A  548 ? 0.39843398 0.33064693 0.21827270 -0.08245371 -0.04133306 0.05797387  603  VAL   A HG12 
8360  H  HG13 . VAL   A  548 ? 0.39867735 0.33352497 0.21664494 -0.08022338 -0.04537264 0.05573991  603  VAL   A HG13 
8361  H  HG21 . VAL   A  548 ? 0.38066065 0.31454036 0.20430882 -0.07343585 -0.05747809 0.05725707  603  VAL   A HG21 
8362  H  HG22 . VAL   A  548 ? 0.37306678 0.30724984 0.20736064 -0.06981927 -0.05992328 0.05837991  603  VAL   A HG22 
8363  H  HG23 . VAL   A  548 ? 0.36366537 0.30544949 0.20260413 -0.07195064 -0.05440070 0.05393742  603  VAL   A HG23 
8364  N  N    . LEU   A  549 ? 0.32244882 0.26006570 0.16815919 -0.07923960 -0.03923378 0.05662195  604  LEU   A N    
8365  C  CA   . LEU   A  549 ? 0.39986208 0.33662474 0.24682048 -0.08259990 -0.03469061 0.05731375  604  LEU   A CA   
8366  C  C    . LEU   A  549 ? 0.45313665 0.39387912 0.29627761 -0.08683543 -0.02876478 0.05589142  604  LEU   A C    
8367  O  O    . LEU   A  549 ? 0.42669508 0.37120357 0.27459878 -0.08939111 -0.02419103 0.05482453  604  LEU   A O    
8368  C  CB   . LEU   A  549 ? 0.35203305 0.29438183 0.21216510 -0.08051768 -0.03381917 0.05476616  604  LEU   A CB   
8369  C  CG   . LEU   A  549 ? 0.37365684 0.31269455 0.23829824 -0.07657500 -0.03845783 0.05574873  604  LEU   A CG   
8370  C  CD1  . LEU   A  549 ? 0.42357248 0.36724174 0.29906520 -0.07573166 -0.03652687 0.05342280  604  LEU   A CD1  
8371  C  CD2  . LEU   A  549 ? 0.44287336 0.37041783 0.29847959 -0.07717839 -0.04142831 0.06023369  604  LEU   A CD2  
8372  H  H    . LEU   A  549 ? 0.34394830 0.28705668 0.19513266 -0.07781105 -0.03902094 0.05399282  604  LEU   A H    
8373  H  HA   . LEU   A  549 ? 0.39132383 0.32122588 0.23297577 -0.08355907 -0.03605861 0.06032422  604  LEU   A HA   
8374  H  HB2  . LEU   A  549 ? 0.35736865 0.30571198 0.22222432 -0.07940459 -0.03293937 0.05206899  604  LEU   A HB2  
8375  H  HB3  . LEU   A  549 ? 0.36543036 0.30803496 0.22654046 -0.08305316 -0.03073030 0.05488289  604  LEU   A HB3  
8376  H  HG   . LEU   A  549 ? 0.38555974 0.32673755 0.25180015 -0.07392100 -0.04114359 0.05490153  604  LEU   A HG   
8377  H  HD11 . LEU   A  549 ? 0.40100980 0.34380198 0.27991930 -0.07278272 -0.03927400 0.05340269  604  LEU   A HD11 
8378  H  HD12 . LEU   A  549 ? 0.40662122 0.34775120 0.28085503 -0.07821458 -0.03456266 0.05435883  604  LEU   A HD12 
8379  H  HD13 . LEU   A  549 ? 0.39651978 0.34641671 0.27646279 -0.07571091 -0.03460845 0.05100264  604  LEU   A HD13 
8380  H  HD21 . LEU   A  549 ? 0.43167490 0.35649526 0.28126389 -0.07655971 -0.04389166 0.06162373  604  LEU   A HD21 
8381  H  HD22 . LEU   A  549 ? 0.43017006 0.35506159 0.28215331 -0.08070967 -0.03865865 0.06141157  604  LEU   A HD22 
8382  H  HD23 . LEU   A  549 ? 0.42385271 0.34950674 0.28336638 -0.07465120 -0.04365372 0.06039594  604  LEU   A HD23 
8383  N  N    . TYR   A  550 ? 0.39592600 0.33606499 0.23036954 -0.08753753 -0.02893151 0.05572175  605  TYR   A N    
8384  C  CA   . TYR   A  550 ? 0.35394892 0.29724598 0.18300912 -0.09141285 -0.02317266 0.05438103  605  TYR   A CA   
8385  C  C    . TYR   A  550 ? 0.42862445 0.36504933 0.24236330 -0.09341054 -0.02458055 0.05708819  605  TYR   A C    
8386  O  O    . TYR   A  550 ? 0.43782187 0.36846295 0.24695660 -0.09097647 -0.03062436 0.05928043  605  TYR   A O    
8387  C  CB   . TYR   A  550 ? 0.38599885 0.33870119 0.22308266 -0.08947729 -0.02066345 0.04913133  605  TYR   A CB   
8388  C  CG   . TYR   A  550 ? 0.34194022 0.29534459 0.17837779 -0.08608413 -0.02478996 0.04708725  605  TYR   A CG   
8389  C  CD1  . TYR   A  550 ? 0.37104535 0.32547343 0.21569249 -0.08222695 -0.02952015 0.04655299  605  TYR   A CD1  
8390  C  CD2  . TYR   A  550 ? 0.44587332 0.39903170 0.27318841 -0.08707944 -0.02385402 0.04553206  605  TYR   A CD2  
8391  C  CE1  . TYR   A  550 ? 0.39870131 0.35435081 0.24328083 -0.07980322 -0.03331992 0.04461043  605  TYR   A CE1  
8392  C  CE2  . TYR   A  550 ? 0.39301968 0.34658799 0.21958803 -0.08447767 -0.02789877 0.04341336  605  TYR   A CE2  
8393  C  CZ   . TYR   A  550 ? 0.39803791 0.35298538 0.23351617 -0.08104094 -0.03271470 0.04304658  605  TYR   A CZ   
8394  O  OH   . TYR   A  550 ? 0.34251475 0.29822379 0.17716749 -0.07927573 -0.03660693 0.04090468  605  TYR   A OH   
8395  H  H    . TYR   A  550 ? 0.39898077 0.33694232 0.23079579 -0.08551456 -0.03271589 0.05628513  605  TYR   A H    
8396  H  HA   . TYR   A  550 ? 0.38157380 0.32498699 0.21157721 -0.09412193 -0.02001025 0.05524359  605  TYR   A HA   
8397  H  HB2  . TYR   A  550 ? 0.36901790 0.32424194 0.20321202 -0.09181534 -0.01647228 0.04798957  605  TYR   A HB2  
8398  H  HB3  . TYR   A  550 ? 0.35638887 0.31259629 0.20245399 -0.08833693 -0.02011446 0.04794893  605  TYR   A HB3  
8399  H  HD1  . TYR   A  550 ? 0.36290854 0.31744462 0.21332657 -0.08141565 -0.03007346 0.04736809  605  TYR   A HD1  
8400  H  HD2  . TYR   A  550 ? 0.41329890 0.36616957 0.23480721 -0.08975089 -0.02027964 0.04573704  605  TYR   A HD2  
8401  H  HE1  . TYR   A  550 ? 0.38386425 0.34083426 0.23438658 -0.07753352 -0.03622324 0.04426594  605  TYR   A HE1  
8402  H  HE2  . TYR   A  550 ? 0.41276777 0.36579010 0.23266627 -0.08526681 -0.02727741 0.04214484  605  TYR   A HE2  
8404  N  N    . ARG   A  551 ? 0.44100243 0.37838238 0.24694176 -0.09785249 -0.01899537 0.05694951  606  ARG   A N    
8405  C  CA   . ARG   A  551 ? 0.42345929 0.35404906 0.21322919 -0.10056614 -0.01948352 0.05967195  606  ARG   A CA   
8406  C  C    . ARG   A  551 ? 0.37061810 0.30408692 0.15735883 -0.09796372 -0.02132670 0.05621100  606  ARG   A C    
8407  O  O    . ARG   A  551 ? 0.35611039 0.29722315 0.14714098 -0.09772035 -0.01706655 0.05156690  606  ARG   A O    
8408  C  CB   . ARG   A  551 ? 0.49704266 0.42804652 0.27935186 -0.10689432 -0.01209351 0.06079834  606  ARG   A CB   
8409  C  CG   . ARG   A  551 ? 0.70107293 0.62171823 0.47490761 -0.11081087 -0.01315281 0.06690650  606  ARG   A CG   
8410  C  CD   . ARG   A  551 ? 0.96185184 0.88433588 0.73176855 -0.11766052 -0.00547389 0.06795441  606  ARG   A CD   
8411  N  NE   . ARG   A  551 ? 0.89621806 0.82289863 0.67851979 -0.11911113 -0.00287057 0.06748476  606  ARG   A NE   
8412  C  CZ   . ARG   A  551 ? 1.01112330 0.93018061 0.79528707 -0.11939215 -0.00640683 0.07101337  606  ARG   A CZ   
8413  N  NH1  . ARG   A  551 ? 0.90531933 0.81131685 0.67854851 -0.11918411 -0.01189553 0.07601688  606  ARG   A NH1  
8414  N  NH2  . ARG   A  551 ? 0.77506661 0.69937247 0.57209378 -0.11967427 -0.00465168 0.06934181  606  ARG   A NH2  
8415  H  H    . ARG   A  551 ? 0.42745537 0.37017447 0.23836289 -0.09921399 -0.01470496 0.05502945  606  ARG   A H    
8416  H  HA   . ARG   A  551 ? 0.43472397 0.35822418 0.22012551 -0.10002954 -0.02371613 0.06311636  606  ARG   A HA   
8417  H  HB2  . ARG   A  551 ? 0.50564730 0.44354963 0.29653448 -0.10739939 -0.00812516 0.05828435  606  ARG   A HB2  
8418  H  HB3  . ARG   A  551 ? 0.52053547 0.45176759 0.29492956 -0.10799427 -0.01055298 0.05990313  606  ARG   A HB3  
8419  H  HG2  . ARG   A  551 ? 0.69983310 0.61352772 0.46351406 -0.11071431 -0.01657115 0.06949143  606  ARG   A HG2  
8420  H  HG3  . ARG   A  551 ? 0.68455201 0.60359025 0.46524969 -0.10898028 -0.01584079 0.06778478  606  ARG   A HG3  
8421  H  HD2  . ARG   A  551 ? 0.87728190 0.80610156 0.64661694 -0.11846347 -0.00137173 0.06497286  606  ARG   A HD2  
8422  H  HD3  . ARG   A  551 ? 0.89403182 0.80851817 0.65279716 -0.12068474 -0.00616617 0.07191911  606  ARG   A HD3  
8423  H  HE   . ARG   A  551 ? 0.92625463 0.86088669 0.71509200 -0.11976588 0.00116102  0.06455389  606  ARG   A HE   
8424  H  HH11 . ARG   A  551 ? 0.94755781 0.84972143 0.71138114 -0.11952280 -0.01302795 0.07744553  606  ARG   A HH11 
8425  H  HH12 . ARG   A  551 ? 0.93762076 0.83860141 0.71288615 -0.11856797 -0.01454434 0.07785706  606  ARG   A HH12 
8426  H  HH21 . ARG   A  551 ? 0.83907533 0.75802904 0.63677686 -0.12016814 -0.00670585 0.07149599  606  ARG   A HH21 
8427  H  HH22 . ARG   A  551 ? 0.82926857 0.76217663 0.63390833 -0.11928243 -0.00160257 0.06603109  606  ARG   A HH22 
8428  N  N    . THR   A  552 ? 0.46328649 0.39026910 0.24226418 -0.09604497 -0.02791301 0.05841752  607  THR   A N    
8429  C  CA   . THR   A  552 ? 0.44009921 0.36877108 0.21478623 -0.09419754 -0.03038446 0.05536944  607  THR   A CA   
8430  C  C    . THR   A  552 ? 0.47191307 0.39149654 0.23374175 -0.09388889 -0.03712240 0.05945635  607  THR   A C    
8431  O  O    . THR   A  552 ? 0.52453017 0.43682894 0.28274035 -0.09431453 -0.03996179 0.06439836  607  THR   A O    
8432  C  CB   . THR   A  552 ? 0.47727901 0.41300917 0.26664075 -0.08965144 -0.03293956 0.05117113  607  THR   A CB   
8433  O  OG1  . THR   A  552 ? 0.43185651 0.37046140 0.21767983 -0.08911176 -0.03277527 0.04694124  607  THR   A OG1  
8434  C  CG2  . THR   A  552 ? 0.50548291 0.43846428 0.29990312 -0.08608159 -0.04036168 0.05354163  607  THR   A CG2  
8435  H  H    . THR   A  552 ? 0.43797165 0.35922912 0.21430692 -0.09582808 -0.03118325 0.06183368  607  THR   A H    
8436  H  HA   . THR   A  552 ? 0.45964634 0.39062750 0.22986962 -0.09630795 -0.02593844 0.05335542  607  THR   A HA   
8437  H  HB   . THR   A  552 ? 0.45223096 0.39246911 0.25005513 -0.08967605 -0.02938363 0.04964280  607  THR   A HB   
8439  H  HG21 . THR   A  552 ? 0.48456943 0.42243382 0.28907320 -0.08385375 -0.04088148 0.05115691  607  THR   A HG21 
8440  H  HG22 . THR   A  552 ? 0.50215441 0.43211070 0.28996804 -0.08548023 -0.04439119 0.05432690  607  THR   A HG22 
8441  H  HG23 . THR   A  552 ? 0.49696606 0.42633176 0.29120079 -0.08656926 -0.04069885 0.05660577  607  THR   A HG23 
8442  N  N    . SER   A  553 ? 0.43677825 0.35641316 0.19170690 -0.09300735 -0.04003472 0.05728059  608  SER   A N    
8443  C  CA   . SER   A  553 ? 0.48418397 0.39630055 0.22839752 -0.09194560 -0.04774811 0.06069263  608  SER   A CA   
8444  C  C    . SER   A  553 ? 0.47481424 0.39134753 0.22818936 -0.08749174 -0.05423395 0.05789170  608  SER   A C    
8445  O  O    . SER   A  553 ? 0.44802019 0.37057859 0.20554420 -0.08699948 -0.05268675 0.05284309  608  SER   A O    
8446  C  CB   . SER   A  553 ? 0.48476225 0.39172632 0.21006009 -0.09564613 -0.04628100 0.06143399  608  SER   A CB   
8447  O  OG   . SER   A  553 ? 0.65392327 0.56555063 0.37779158 -0.09512381 -0.04576207 0.05614619  608  SER   A OG   
8448  H  H    . SER   A  553 ? 0.44991702 0.37419134 0.20680207 -0.09300159 -0.03738956 0.05354263  608  SER   A H    
8449  H  HA   . SER   A  553 ? 0.47764468 0.38495260 0.22116303 -0.09173869 -0.04986954 0.06455217  608  SER   A HA   
8450  H  HB2  . SER   A  553 ? 0.53128099 0.43175435 0.24840917 -0.09539624 -0.05129034 0.06496475  608  SER   A HB2  
8451  H  HB3  . SER   A  553 ? 0.52508122 0.43141288 0.24652183 -0.09883966 -0.04070957 0.06224306  608  SER   A HB3  
8453  N  N    . TYR   A  554 ? 0.44469279 0.35848826 0.20224683 -0.08423467 -0.06122179 0.06103411  609  TYR   A N    
8454  C  CA   . TYR   A  554 ? 0.46001959 0.37889686 0.22718737 -0.08029228 -0.06748918 0.05873985  609  TYR   A CA   
8455  C  C    . TYR   A  554 ? 0.42143047 0.33483231 0.18423715 -0.07753593 -0.07639708 0.06288568  609  TYR   A C    
8456  O  O    . TYR   A  554 ? 0.42609680 0.33111560 0.18062197 -0.07799800 -0.07768565 0.06781489  609  TYR   A O    
8457  C  CB   . TYR   A  554 ? 0.43587959 0.36254764 0.22142436 -0.07791530 -0.06532999 0.05612095  609  TYR   A CB   
8458  C  CG   . TYR   A  554 ? 0.41701534 0.34138548 0.20946412 -0.07558234 -0.06703287 0.05959051  609  TYR   A CG   
8459  C  CD1  . TYR   A  554 ? 0.45699275 0.37650460 0.24631494 -0.07779541 -0.06249397 0.06237814  609  TYR   A CD1  
8460  C  CD2  . TYR   A  554 ? 0.39971516 0.32663232 0.20151989 -0.07127458 -0.07322093 0.05996545  609  TYR   A CD2  
8461  C  CE1  . TYR   A  554 ? 0.42940772 0.34563649 0.22429146 -0.07565880 -0.06427306 0.06525574  609  TYR   A CE1  
8462  C  CE2  . TYR   A  554 ? 0.44303980 0.36742771 0.25081581 -0.06865504 -0.07469369 0.06268169  609  TYR   A CE2  
8463  C  CZ   . TYR   A  554 ? 0.47390050 0.39242285 0.27796030 -0.07080860 -0.07028118 0.06522949  609  TYR   A CZ   
8464  O  OH   . TYR   A  554 ? 0.62933171 0.54441190 0.43880481 -0.06824582 -0.07182356 0.06753147  609  TYR   A OH   
8465  H  H    . TYR   A  554 ? 0.46134090 0.37010580 0.21584545 -0.08450090 -0.06205323 0.06460475  609  TYR   A H    
8466  H  HA   . TYR   A  554 ? 0.44554874 0.36654955 0.20960981 -0.08108498 -0.06744131 0.05588701  609  TYR   A HA   
8467  H  HB2  . TYR   A  554 ? 0.42734233 0.35827196 0.21851325 -0.07623736 -0.06826644 0.05382797  609  TYR   A HB2  
8468  H  HB3  . TYR   A  554 ? 0.42878950 0.35802352 0.21622226 -0.07963659 -0.05973240 0.05406132  609  TYR   A HB3  
8469  H  HD1  . TYR   A  554 ? 0.44607973 0.36464351 0.22956796 -0.08089025 -0.05803525 0.06211038  609  TYR   A HD1  
8470  H  HD2  . TYR   A  554 ? 0.41154045 0.34220013 0.21596302 -0.07011055 -0.07637829 0.05813269  609  TYR   A HD2  
8471  H  HE1  . TYR   A  554 ? 0.44870150 0.36143842 0.24145415 -0.07754564 -0.06121135 0.06698115  609  TYR   A HE1  
8472  H  HE2  . TYR   A  554 ? 0.43475717 0.36163926 0.24940589 -0.06548934 -0.07857672 0.06256180  609  TYR   A HE2  
8474  N  N    . ASP   A  555 ? 0.41186166 0.32996070 0.17986983 -0.07488078 -0.08262122 0.06073829  610  ASP   A N    
8475  C  CA   . ASP   A  555 ? 0.42093882 0.33580688 0.18564761 -0.07188296 -0.09185687 0.06377710  610  ASP   A CA   
8476  C  C    . ASP   A  555 ? 0.44166207 0.36417896 0.22402114 -0.06729797 -0.09599435 0.06254471  610  ASP   A C    
8477  O  O    . ASP   A  555 ? 0.46245837 0.39359537 0.25643474 -0.06723769 -0.09375741 0.05822850  610  ASP   A O    
8478  C  CB   . ASP   A  555 ? 0.43941414 0.35418338 0.19412450 -0.07316986 -0.09636541 0.06200530  610  ASP   A CB   
8479  C  CG   . ASP   A  555 ? 0.56263709 0.47138348 0.29978767 -0.07777066 -0.09195466 0.06196052  610  ASP   A CG   
8480  O  OD1  . ASP   A  555 ? 0.51731628 0.41898876 0.24536517 -0.07984668 -0.08819480 0.06562570  610  ASP   A OD1  
8481  O  OD2  . ASP   A  555 ? 0.53674042 0.44751698 0.26853147 -0.07942662 -0.09259541 0.05827599  610  ASP   A OD2  
8482  H  H    . ASP   A  555 ? 0.40599832 0.32972717 0.18014808 -0.07498840 -0.08110803 0.05716877  610  ASP   A H    
8483  H  HA   . ASP   A  555 ? 0.43749568 0.34538060 0.19494922 -0.07195551 -0.09278397 0.06766464  610  ASP   A HA   
8484  H  HB2  . ASP   A  555 ? 0.45004117 0.37140131 0.21274689 -0.07286070 -0.09630064 0.05829844  610  ASP   A HB2  
8485  H  HB3  . ASP   A  555 ? 0.46543419 0.37778813 0.21733065 -0.07116242 -0.10283203 0.06436528  610  ASP   A HB3  
8486  N  N    . ILE   A  556 ? 0.41026196 0.32946312 0.19403823 -0.06343313 -0.10219179 0.06625963  611  ILE   A N    
8487  C  CA   . ILE   A  556 ? 0.44066679 0.36789736 0.24024543 -0.05871759 -0.10704920 0.06494457  611  ILE   A CA   
8488  C  C    . ILE   A  556 ? 0.39859802 0.32922751 0.19581053 -0.05779749 -0.11498521 0.06396904  611  ILE   A C    
8489  O  O    . ILE   A  556 ? 0.40302354 0.32634509 0.18736279 -0.05742722 -0.12055033 0.06729755  611  ILE   A O    
8490  C  CB   . ILE   A  556 ? 0.47814584 0.40077108 0.28141549 -0.05415841 -0.11031435 0.06881507  611  ILE   A CB   
8491  C  CG1  . ILE   A  556 ? 0.51152462 0.43000144 0.31636891 -0.05544744 -0.10308080 0.06981413  611  ILE   A CG1  
8492  C  CG2  . ILE   A  556 ? 0.48706490 0.41931933 0.30688646 -0.04888330 -0.11542626 0.06701048  611  ILE   A CG2  
8493  C  CD1  . ILE   A  556 ? 0.52187437 0.44828564 0.33700794 -0.05731200 -0.09635130 0.06572129  611  ILE   A CD1  
8494  H  H    . ILE   A  556 ? 0.43717557 0.34890920 0.21182317 -0.06368580 -0.10337303 0.06966975  611  ILE   A H    
8495  H  HA   . ILE   A  556 ? 0.41652185 0.35010269 0.22571354 -0.05913236 -0.10333052 0.06196713  611  ILE   A HA   
8496  H  HB   . ILE   A  556 ? 0.49424362 0.40972894 0.28718752 -0.05373993 -0.11432514 0.07201036  611  ILE   A HB   
8497  H  HG12 . ILE   A  556 ? 0.51720798 0.42844951 0.31071290 -0.05825090 -0.10111248 0.07199265  611  ILE   A HG12 
8498  H  HG13 . ILE   A  556 ? 0.50774908 0.42437908 0.31699225 -0.05216208 -0.10528818 0.07143356  611  ILE   A HG13 
8499  H  HG21 . ILE   A  556 ? 0.46986955 0.40943986 0.29898530 -0.04969492 -0.11197178 0.06380738  611  ILE   A HG21 
8500  H  HG22 . ILE   A  556 ? 0.48640114 0.42041335 0.30455595 -0.04776174 -0.12107074 0.06708486  611  ILE   A HG22 
8501  H  HG23 . ILE   A  556 ? 0.48255855 0.41191971 0.30524021 -0.04587178 -0.11650556 0.06892636  611  ILE   A HG23 
8502  H  HD11 . ILE   A  556 ? 0.51196939 0.43911076 0.32210356 -0.06051162 -0.09364342 0.06419106  611  ILE   A HD11 
8503  H  HD12 . ILE   A  556 ? 0.50414199 0.43780011 0.32975459 -0.05506273 -0.09814087 0.06354377  611  ILE   A HD12 
8504  H  HD13 . ILE   A  556 ? 0.51187706 0.43580523 0.32865825 -0.05771789 -0.09254134 0.06649908  611  ILE   A HD13 
8505  N  N    . LEU   A  557 ? 0.42818126 0.36952263 0.23744182 -0.05775750 -0.11555661 0.05953841  612  LEU   A N    
8506  C  CA   . LEU   A  557 ? 0.39687824 0.34329015 0.20664649 -0.05726666 -0.12315439 0.05795510  612  LEU   A CA   
8507  C  C    . LEU   A  557 ? 0.40992808 0.36639029 0.23736089 -0.05276024 -0.12783198 0.05710601  612  LEU   A C    
8508  O  O    . LEU   A  557 ? 0.35051367 0.31426552 0.19169208 -0.05251904 -0.12320928 0.05454696  612  LEU   A O    
8509  C  CB   . LEU   A  557 ? 0.38081783 0.33135185 0.18989564 -0.06172831 -0.11967936 0.05313003  612  LEU   A CB   
8510  C  CG   . LEU   A  557 ? 0.39819181 0.34065378 0.19155593 -0.06592572 -0.11406973 0.05290411  612  LEU   A CG   
8511  C  CD1  . LEU   A  557 ? 0.38080272 0.32707489 0.17348182 -0.06946503 -0.11225206 0.04764056  612  LEU   A CD1  
8512  C  CD2  . LEU   A  557 ? 0.43526721 0.36718267 0.20950478 -0.06625377 -0.11864508 0.05730627  612  LEU   A CD2  
8513  H  H    . LEU   A  557 ? 0.39859813 0.34419405 0.21606283 -0.05827595 -0.11108845 0.05744207  612  LEU   A H    
8514  H  HA   . LEU   A  557 ? 0.41801092 0.35863727 0.21717907 -0.05699429 -0.12742591 0.06045560  612  LEU   A HA   
8515  H  HB2  . LEU   A  557 ? 0.37406492 0.33009917 0.19377607 -0.06178151 -0.11604039 0.05092242  612  LEU   A HB2  
8516  H  HB3  . LEU   A  557 ? 0.38913140 0.34282154 0.19831502 -0.06177088 -0.12494109 0.05197887  612  LEU   A HB3  
8517  H  HG   . LEU   A  557 ? 0.39087805 0.33188266 0.18615133 -0.06628478 -0.10831232 0.05335710  612  LEU   A HG   
8518  H  HD11 . LEU   A  557 ? 0.38813871 0.33032155 0.17301273 -0.07176208 -0.10729302 0.04693743  612  LEU   A HD11 
8519  H  HD12 . LEU   A  557 ? 0.39266890 0.33904028 0.18084322 -0.06978760 -0.11770996 0.04722973  612  LEU   A HD12 
8520  H  HD13 . LEU   A  557 ? 0.37373859 0.32623792 0.17811568 -0.06912028 -0.11067045 0.04534390  612  LEU   A HD13 
8521  H  HD21 . LEU   A  557 ? 0.43206394 0.35977957 0.20525451 -0.06466743 -0.11821112 0.06063597  612  LEU   A HD21 
8522  H  HD22 . LEU   A  557 ? 0.43571341 0.36913326 0.20923069 -0.06503358 -0.12531187 0.05751681  612  LEU   A HD22 
8523  H  HD23 . LEU   A  557 ? 0.43628091 0.36430538 0.20035499 -0.06932869 -0.11526249 0.05643598  612  LEU   A HD23 
8524  N  N    . TYR   A  558 ? 0.38087398 0.33784017 0.20779544 -0.04909318 -0.13687581 0.05927918  613  TYR   A N    
8525  C  CA   . TYR   A  558 ? 0.36408371 0.33173847 0.20803106 -0.04441351 -0.14175741 0.05830523  613  TYR   A CA   
8526  C  C    . TYR   A  558 ? 0.39631054 0.37390605 0.24562427 -0.04586860 -0.14757055 0.05506544  613  TYR   A C    
8527  O  O    . TYR   A  558 ? 0.40095645 0.37445486 0.23778613 -0.04846606 -0.15166979 0.05520338  613  TYR   A O    
8528  C  CB   . TYR   A  558 ? 0.36669099 0.32925218 0.20853159 -0.03845932 -0.14856891 0.06268297  613  TYR   A CB   
8529  C  CG   . TYR   A  558 ? 0.47558352 0.42723107 0.31183732 -0.03683742 -0.14420044 0.06623460  613  TYR   A CG   
8530  C  CD1  . TYR   A  558 ? 0.62731206 0.58257419 0.47630414 -0.03463324 -0.13883401 0.06511711  613  TYR   A CD1  
8531  C  CD2  . TYR   A  558 ? 0.51684487 0.45411313 0.33438414 -0.03800158 -0.14529505 0.07072118  613  TYR   A CD2  
8532  C  CE1  . TYR   A  558 ? 0.69084364 0.63568330 0.53464293 -0.03349873 -0.13513197 0.06816415  613  TYR   A CE1  
8533  C  CE2  . TYR   A  558 ? 0.58003432 0.50681967 0.39234236 -0.03724663 -0.14128645 0.07407042  613  TYR   A CE2  
8534  C  CZ   . TYR   A  558 ? 0.57967007 0.51026720 0.40542993 -0.03492275 -0.13644540 0.07267474  613  TYR   A CZ   
8535  O  OH   . TYR   A  558 ? 0.65306175 0.57323158 0.47400868 -0.03444557 -0.13280429 0.07566936  613  TYR   A OH   
8536  H  H    . TYR   A  558 ? 0.39896992 0.34961292 0.21452485 -0.04945176 -0.14013262 0.06141280  613  TYR   A H    
8537  H  HA   . TYR   A  558 ? 0.35846674 0.33049405 0.21229869 -0.04408814 -0.13700129 0.05677325  613  TYR   A HA   
8538  H  HB2  . TYR   A  558 ? 0.40075302 0.35916471 0.23277925 -0.03877088 -0.15368995 0.06427270  613  TYR   A HB2  
8539  H  HB3  . TYR   A  558 ? 0.38278797 0.35357654 0.23684518 -0.03514027 -0.15160860 0.06156354  613  TYR   A HB3  
8540  H  HD1  . TYR   A  558 ? 0.57683748 0.54162806 0.43794417 -0.03403540 -0.13783516 0.06224899  613  TYR   A HD1  
8541  H  HD2  . TYR   A  558 ? 0.53354228 0.46794185 0.34149194 -0.03957509 -0.14882489 0.07153162  613  TYR   A HD2  
8542  H  HE1  . TYR   A  558 ? 0.63183039 0.57907915 0.48402447 -0.03199983 -0.13177648 0.06719520  613  TYR   A HE1  
8543  H  HE2  . TYR   A  558 ? 0.57998955 0.49694055 0.37939918 -0.03843987 -0.14201781 0.07729183  613  TYR   A HE2  
8545  N  N    . HIS   A  559 ? 0.37848032 0.36914939 0.24622521 -0.04421797 -0.14818986 0.05224977  614  HIS   A N    
8546  C  CA   . HIS   A  559 ? 0.34957224 0.35143015 0.22544625 -0.04551547 -0.15407181 0.04921930  614  HIS   A CA   
8547  C  C    . HIS   A  559 ? 0.35621923 0.37070361 0.25154874 -0.04059566 -0.15673244 0.04850619  614  HIS   A C    
8548  O  O    . HIS   A  559 ? 0.32843000 0.34266245 0.23047510 -0.03746174 -0.15193774 0.04932865  614  HIS   A O    
8549  C  CB   . HIS   A  559 ? 0.35503116 0.36050609 0.23277722 -0.05188550 -0.14857429 0.04486273  614  HIS   A CB   
8550  C  CG   . HIS   A  559 ? 0.34082389 0.33460039 0.20295043 -0.05585531 -0.14221771 0.04495889  614  HIS   A CG   
8551  N  ND1  . HIS   A  559 ? 0.38257653 0.37099642 0.24390635 -0.05563116 -0.13385087 0.04597574  614  HIS   A ND1  
8552  C  CD2  . HIS   A  559 ? 0.35026368 0.33762664 0.19785956 -0.05992484 -0.14302057 0.04388248  614  HIS   A CD2  
8553  C  CE1  . HIS   A  559 ? 0.35915193 0.33902788 0.20654958 -0.05945466 -0.12971851 0.04550007  614  HIS   A CE1  
8554  N  NE2  . HIS   A  559 ? 0.36990157 0.34869191 0.20850185 -0.06209352 -0.13460433 0.04406663  614  HIS   A NE2  
8555  H  H    . HIS   A  559 ? 0.36445028 0.35724908 0.24000308 -0.04243307 -0.14464426 0.05218483  614  HIS   A H    
8556  H  HA   . HIS   A  559 ? 0.37118778 0.36998814 0.23878391 -0.04535644 -0.15993966 0.05042857  614  HIS   A HA   
8557  H  HB2  . HIS   A  559 ? 0.33684361 0.34837443 0.22581503 -0.05169546 -0.14472884 0.04340452  614  HIS   A HB2  
8558  H  HB3  . HIS   A  559 ? 0.35164538 0.36164549 0.23031871 -0.05358325 -0.15320349 0.04321448  614  HIS   A HB3  
8560  H  HD2  . HIS   A  559 ? 0.36168203 0.35059404 0.20625265 -0.06116154 -0.14818311 0.04288638  614  HIS   A HD2  
8561  H  HE1  . HIS   A  559 ? 0.36256942 0.33808416 0.20694497 -0.06023532 -0.12398627 0.04589762  614  HIS   A HE1  
8563  N  N    . THR   A  560 ? 0.35288057 0.37890023 0.25752956 -0.04016468 -0.16400115 0.04663160  615  THR   A N    
8564  C  CA   . THR   A  560 ? 0.36795127 0.40878767 0.29302877 -0.03628903 -0.16564937 0.04501111  615  THR   A CA   
8565  C  C    . THR   A  560 ? 0.31907755 0.36528388 0.25568593 -0.03797408 -0.15606287 0.04264296  615  THR   A C    
8566  O  O    . THR   A  560 ? 0.29688871 0.34734505 0.24400847 -0.03322751 -0.15378489 0.04298853  615  THR   A O    
8567  C  CB   . THR   A  560 ? 0.39038152 0.44460022 0.32465374 -0.03808624 -0.17313758 0.04230656  615  THR   A CB   
8568  O  OG1  . THR   A  560 ? 0.40267947 0.45142579 0.32521650 -0.03683927 -0.18210603 0.04442655  615  THR   A OG1  
8569  C  CG2  . THR   A  560 ? 0.42039299 0.49097222 0.37575310 -0.03348619 -0.17568912 0.04085032  615  THR   A CG2  
8570  H  H    . THR   A  560 ? 0.36631554 0.39127958 0.26450965 -0.04243990 -0.16796878 0.04622529  615  THR   A H    
8571  H  HA   . THR   A  560 ? 0.36384392 0.40280324 0.28959024 -0.03108761 -0.16849507 0.04725723  615  THR   A HA   
8572  H  HB   . THR   A  560 ? 0.38790256 0.44390821 0.32219720 -0.04334784 -0.17019983 0.03992049  615  THR   A HB   
8574  H  HG21 . THR   A  560 ? 0.41062909 0.48943287 0.37103739 -0.03460806 -0.18117245 0.03942379  615  THR   A HG21 
8575  H  HG22 . THR   A  560 ? 0.41185158 0.48006159 0.36746347 -0.02789608 -0.17795618 0.04300254  615  THR   A HG22 
8576  H  HG23 . THR   A  560 ? 0.39701831 0.47236854 0.36065298 -0.03499325 -0.16962132 0.03910620  615  THR   A HG23 
8577  N  N    . ASP   A  561 ? 0.31954369 0.36487526 0.25344488 -0.04460274 -0.15058772 0.04016584  616  ASP   A N    
8578  C  CA   . ASP   A  561 ? 0.30064315 0.35313243 0.24658599 -0.04696296 -0.14303133 0.03756901  616  ASP   A CA   
8579  C  C    . ASP   A  561 ? 0.34910488 0.39154041 0.28838301 -0.04809215 -0.13388942 0.03832167  616  ASP   A C    
8580  O  O    . ASP   A  561 ? 0.28491494 0.33228269 0.23352972 -0.04921606 -0.12771749 0.03668281  616  ASP   A O    
8581  C  CB   . ASP   A  561 ? 0.30880108 0.36795247 0.25832418 -0.05356710 -0.14338279 0.03409479  616  ASP   A CB   
8582  C  CG   . ASP   A  561 ? 0.33333760 0.40619293 0.29422346 -0.05356577 -0.15116405 0.03248127  616  ASP   A CG   
8583  O  OD1  . ASP   A  561 ? 0.32541126 0.40542468 0.29510209 -0.04769694 -0.15559429 0.03364995  616  ASP   A OD1  
8584  O  OD2  . ASP   A  561 ? 0.35054308 0.42728275 0.31221035 -0.05945916 -0.15274431 0.02982154  616  ASP   A OD2  
8585  H  H    . ASP   A  561 ? 0.32365137 0.36351120 0.24766403 -0.04763411 -0.15167752 0.04007654  616  ASP   A H    
8586  H  HA   . ASP   A  561 ? 0.30751032 0.36800334 0.26471204 -0.04362513 -0.14377624 0.03735416  616  ASP   A HA   
8587  H  HB2  . ASP   A  561 ? 0.31774828 0.36921224 0.25593626 -0.05641213 -0.14362872 0.03406423  616  ASP   A HB2  
8588  H  HB3  . ASP   A  561 ? 0.30291277 0.36476493 0.25826585 -0.05558313 -0.13791738 0.03270400  616  ASP   A HB3  
8589  N  N    . PHE   A  562 ? 0.31834269 0.34719011 0.24143185 -0.04820548 -0.13308538 0.04072799  617  PHE   A N    
8590  C  CA   . PHE   A  562 ? 0.33284020 0.35281202 0.24959370 -0.04962551 -0.12479719 0.04132860  617  PHE   A CA   
8591  C  C    . PHE   A  562 ? 0.34826455 0.35473099 0.24890968 -0.04826466 -0.12532207 0.04487744  617  PHE   A C    
8592  O  O    . PHE   A  562 ? 0.37802213 0.38043967 0.26922816 -0.04771536 -0.13172483 0.04654270  617  PHE   A O    
8593  C  CB   . PHE   A  562 ? 0.29441994 0.31361738 0.20851076 -0.05572949 -0.11986394 0.03836441  617  PHE   A CB   
8594  C  CG   . PHE   A  562 ? 0.30974737 0.32345426 0.21098708 -0.05956409 -0.12295755 0.03747013  617  PHE   A CG   
8595  C  CD1  . PHE   A  562 ? 0.32190967 0.34213412 0.22574623 -0.06129801 -0.12986673 0.03571594  617  PHE   A CD1  
8596  C  CD2  . PHE   A  562 ? 0.31415838 0.31672499 0.20086645 -0.06170582 -0.11883081 0.03799427  617  PHE   A CD2  
8597  C  CE1  . PHE   A  562 ? 0.36417240 0.37872750 0.25534904 -0.06496595 -0.13267070 0.03448249  617  PHE   A CE1  
8598  C  CE2  . PHE   A  562 ? 0.32651889 0.32408106 0.20095272 -0.06518084 -0.12114767 0.03662654  617  PHE   A CE2  
8599  C  CZ   . PHE   A  562 ? 0.36255902 0.36547613 0.23858443 -0.06671191 -0.12820975 0.03490666  617  PHE   A CZ   
8600  H  H    . PHE   A  562 ? 0.33971331 0.36501503 0.25555074 -0.04751620 -0.13783316 0.04202975  617  PHE   A H    
8601  H  HA   . PHE   A  562 ? 0.31580603 0.33892936 0.24060349 -0.04746472 -0.12184559 0.04133604  617  PHE   A HA   
8602  H  HB2  . PHE   A  562 ? 0.29901022 0.31343234 0.21045864 -0.05614524 -0.11443827 0.03872027  617  PHE   A HB2  
8603  H  HB3  . PHE   A  562 ? 0.29624838 0.32348895 0.22034013 -0.05685718 -0.11946882 0.03640158  617  PHE   A HB3  
8604  H  HD1  . PHE   A  562 ? 0.32329255 0.35204065 0.23761761 -0.06002450 -0.13260879 0.03521779  617  PHE   A HD1  
8605  H  HD2  . PHE   A  562 ? 0.31215987 0.31085041 0.19749017 -0.06088632 -0.11424077 0.03906890  617  PHE   A HD2  
8606  H  HE1  . PHE   A  562 ? 0.35745886 0.37633193 0.25031650 -0.06627678 -0.13764019 0.03322527  617  PHE   A HE1  
8607  H  HE2  . PHE   A  562 ? 0.33677661 0.32732219 0.20156211 -0.06646185 -0.11798145 0.03683135  617  PHE   A HE2  
8608  H  HZ   . PHE   A  562 ? 0.36349383 0.36256719 0.23056671 -0.06908450 -0.12990391 0.03380878  617  PHE   A HZ   
8609  N  N    . GLU   A  563 ? 0.32780105 0.32757393 0.22554822 -0.04792541 -0.11864299 0.04610943  618  GLU   A N    
8610  C  CA   . GLU   A  563 ? 0.32379675 0.31072116 0.20639688 -0.04819875 -0.11702281 0.04921933  618  GLU   A CA   
8611  C  C    . GLU   A  563 ? 0.32941794 0.31211865 0.20650820 -0.05284532 -0.10902215 0.04764564  618  GLU   A C    
8612  O  O    . GLU   A  563 ? 0.32817593 0.31628811 0.21494254 -0.05398988 -0.10385817 0.04518101  618  GLU   A O    
8613  C  CB   . GLU   A  563 ? 0.39826331 0.38136074 0.28349239 -0.04328243 -0.11685186 0.05213853  618  GLU   A CB   
8614  C  CG   . GLU   A  563 ? 0.50150710 0.47084981 0.37141597 -0.04395455 -0.11507851 0.05581617  618  GLU   A CG   
8615  C  CD   . GLU   A  563 ? 0.62963712 0.59263021 0.49912626 -0.03893029 -0.11742388 0.05932762  618  GLU   A CD   
8616  O  OE1  . GLU   A  563 ? 0.49523586 0.46422672 0.37524733 -0.03377905 -0.12210047 0.05910625  618  GLU   A OE1  
8617  O  OE2  . GLU   A  563 ? 0.52217084 0.47402799 0.38077605 -0.04023848 -0.11442063 0.06218576  618  GLU   A OE2  
8618  H  H    . GLU   A  563 ? 0.31953335 0.32320553 0.22526157 -0.04775176 -0.11487971 0.04493104  618  GLU   A H    
8619  H  HA   . GLU   A  563 ? 0.34942853 0.33305979 0.22385776 -0.04849590 -0.12145567 0.05034173  618  GLU   A HA   
8620  H  HB2  . GLU   A  563 ? 0.39825949 0.38446510 0.28753054 -0.03989996 -0.12218929 0.05285484  618  GLU   A HB2  
8621  H  HB3  . GLU   A  563 ? 0.38527951 0.37198159 0.27860504 -0.04298750 -0.11266530 0.05080895  618  GLU   A HB3  
8622  H  HG2  . GLU   A  563 ? 0.49173588 0.45915774 0.36009717 -0.04663635 -0.10924929 0.05500690  618  GLU   A HG2  
8623  H  HG3  . GLU   A  563 ? 0.50788295 0.47350141 0.36836389 -0.04544174 -0.11800549 0.05674908  618  GLU   A HG3  
8624  N  N    . SER   A  564 ? 0.29976064 0.27293542 0.16134167 -0.05535464 -0.10787938 0.04909342  619  SER   A N    
8625  C  CA   . SER   A  564 ? 0.33367753 0.30321679 0.19034602 -0.05913011 -0.10011966 0.04755233  619  SER   A CA   
8626  C  C    . SER   A  564 ? 0.34425324 0.30325943 0.18746507 -0.06019028 -0.09683441 0.05061049  619  SER   A C    
8627  O  O    . SER   A  564 ? 0.35538000 0.30785662 0.18871491 -0.05910686 -0.10114292 0.05400310  619  SER   A O    
8628  C  CB   . SER   A  564 ? 0.40690082 0.37850487 0.26003364 -0.06297152 -0.10003483 0.04391960  619  SER   A CB   
8629  O  OG   . SER   A  564 ? 0.44915211 0.41501597 0.28813520 -0.06425937 -0.10425559 0.04493369  619  SER   A OG   
8630  H  H    . SER   A  564 ? 0.32609674 0.29526904 0.18020049 -0.05464472 -0.11192250 0.05100868  619  SER   A H    
8631  H  HA   . SER   A  564 ? 0.32637984 0.29951745 0.19180731 -0.05864946 -0.09655501 0.04650148  619  SER   A HA   
8632  H  HB2  . SER   A  564 ? 0.38967326 0.36007905 0.24195188 -0.06487865 -0.09470981 0.04244074  619  SER   A HB2  
8633  H  HB3  . SER   A  564 ? 0.38851094 0.36668670 0.25020203 -0.06274094 -0.10229023 0.04213846  619  SER   A HB3  
8635  N  N    . GLY   A  565 ? 0.35685220 0.31451744 0.20030777 -0.06236653 -0.08919039 0.04950540  620  GLY   A N    
8636  C  CA   . GLY   A  565 ? 0.34227526 0.29178008 0.17359479 -0.06479427 -0.08464854 0.05140945  620  GLY   A CA   
8637  C  C    . GLY   A  565 ? 0.33678097 0.28615698 0.16094975 -0.06857026 -0.08088844 0.04821271  620  GLY   A C    
8638  O  O    . GLY   A  565 ? 0.42360210 0.37722182 0.25456953 -0.06966653 -0.07588582 0.04496626  620  GLY   A O    
8639  H  H    . GLY   A  565 ? 0.33730099 0.29976103 0.18920135 -0.06241730 -0.08669940 0.04744223  620  GLY   A H    
8640  H  HA2  . GLY   A  565 ? 0.35557532 0.29977107 0.17903826 -0.06422482 -0.08784188 0.05428711  620  GLY   A HA2  
8641  H  HA3  . GLY   A  565 ? 0.33984196 0.28912076 0.17534682 -0.06457233 -0.08079303 0.05184919  620  GLY   A HA3  
8642  N  N    . TYR   A  566 ? 0.35105222 0.29535717 0.16135941 -0.07023174 -0.08368460 0.04900393  621  TYR   A N    
8643  C  CA   . TYR   A  566 ? 0.34383684 0.28801849 0.14666639 -0.07328816 -0.08140647 0.04536672  621  TYR   A CA   
8644  C  C    . TYR   A  566 ? 0.35506988 0.29367763 0.14651331 -0.07613437 -0.07468521 0.04607522  621  TYR   A C    
8645  O  O    . TYR   A  566 ? 0.34946260 0.28123915 0.12965642 -0.07691840 -0.07557163 0.05007954  621  TYR   A O    
8646  C  CB   . TYR   A  566 ? 0.34624532 0.28852892 0.13983040 -0.07368010 -0.08862033 0.04526442  621  TYR   A CB   
8647  C  CG   . TYR   A  566 ? 0.40860125 0.34921059 0.19220360 -0.07689807 -0.08613823 0.04131666  621  TYR   A CG   
8648  C  CD1  . TYR   A  566 ? 0.43814129 0.38383347 0.22887030 -0.07764734 -0.08566990 0.03629901  621  TYR   A CD1  
8649  C  CD2  . TYR   A  566 ? 0.40300861 0.33647650 0.16958290 -0.07926881 -0.08414777 0.04248347  621  TYR   A CD2  
8650  C  CE1  . TYR   A  566 ? 0.43202060 0.37523308 0.21328679 -0.08019706 -0.08340403 0.03225720  621  TYR   A CE1  
8651  C  CE2  . TYR   A  566 ? 0.41134185 0.34332538 0.16855553 -0.08188198 -0.08135067 0.03834745  621  TYR   A CE2  
8652  C  CZ   . TYR   A  566 ? 0.42791507 0.36456144 0.19258586 -0.08208732 -0.08111177 0.03308491  621  TYR   A CZ   
8653  O  OH   . TYR   A  566 ? 0.43398032 0.36828968 0.18914372 -0.08425493 -0.07852481 0.02863174  621  TYR   A OH   
8654  H  H    . TYR   A  566 ? 0.35630947 0.29670209 0.16117030 -0.06932507 -0.08724757 0.05187755  621  TYR   A H    
8655  H  HA   . TYR   A  566 ? 0.33670211 0.28561693 0.14754911 -0.07339063 -0.07945413 0.04231732  621  TYR   A HA   
8656  H  HB2  . TYR   A  566 ? 0.35454449 0.30145687 0.15624675 -0.07216898 -0.09273411 0.04444769  621  TYR   A HB2  
8657  H  HB3  . TYR   A  566 ? 0.36846098 0.30587450 0.15434965 -0.07326720 -0.09113305 0.04859962  621  TYR   A HB3  
8658  H  HD1  . TYR   A  566 ? 0.41510296 0.36562705 0.21694526 -0.07644848 -0.08680382 0.03558632  621  TYR   A HD1  
8659  H  HD2  . TYR   A  566 ? 0.41386336 0.34319109 0.17491063 -0.07917147 -0.08436115 0.04607560  621  TYR   A HD2  
8660  H  HE1  . TYR   A  566 ? 0.42614174 0.37190366 0.21202831 -0.08068285 -0.08324869 0.02890182  621  TYR   A HE1  
8661  H  HE2  . TYR   A  566 ? 0.42720747 0.35463330 0.17259772 -0.08355673 -0.07961623 0.03909094  621  TYR   A HE2  
8663  N  N    . SER   A  567 ? 0.34411854 0.28575104 0.13853537 -0.07769207 -0.06810132 0.04217991  622  SER   A N    
8664  C  CA   . SER   A  567 ? 0.37145939 0.31012651 0.15750998 -0.08032695 -0.06088809 0.04209053  622  SER   A CA   
8665  C  C    . SER   A  567 ? 0.41902399 0.35425752 0.19028324 -0.08272943 -0.06047951 0.03988418  622  SER   A C    
8666  O  O    . SER   A  567 ? 0.37339056 0.31086797 0.14537400 -0.08268662 -0.06172563 0.03550658  622  SER   A O    
8667  C  CB   . SER   A  567 ? 0.45190036 0.39599031 0.24875720 -0.08027796 -0.05402532 0.03883731  622  SER   A CB   
8668  O  OG   . SER   A  567 ? 0.39353824 0.33634275 0.18248241 -0.08282401 -0.04719051 0.03772650  622  SER   A OG   
8669  H  H    . SER   A  567 ? 0.34272006 0.28853619 0.14475425 -0.07707402 -0.06811856 0.03948300  622  SER   A H    
8670  H  HA   . SER   A  567 ? 0.38990372 0.32503343 0.17231643 -0.08066905 -0.06068708 0.04567407  622  SER   A HA   
8671  H  HB2  . SER   A  567 ? 0.40373629 0.34920269 0.20815982 -0.07917736 -0.05363466 0.04057090  622  SER   A HB2  
8672  H  HB3  . SER   A  567 ? 0.40542251 0.35262236 0.20732525 -0.07954721 -0.05484439 0.03570704  622  SER   A HB3  
8674  N  N    . GLU   A  568 ? 0.40782762 0.33694202 0.16490442 -0.08504533 -0.05886973 0.04302869  623  GLU   A N    
8675  C  CA   . GLU   A  568 ? 0.50916255 0.43477723 0.25065544 -0.08773064 -0.05692473 0.04102138  623  GLU   A CA   
8676  C  C    . GLU   A  568 ? 0.48793757 0.41688928 0.22976023 -0.08938187 -0.04766392 0.03692619  623  GLU   A C    
8677  O  O    . GLU   A  568 ? 0.60322046 0.53035474 0.33327481 -0.09125854 -0.04500904 0.03404232  623  GLU   A O    
8678  C  CB   . GLU   A  568 ? 0.51282221 0.43029863 0.23819742 -0.08981097 -0.05890685 0.04633943  623  GLU   A CB   
8679  C  CG   . GLU   A  568 ? 0.56097555 0.47523963 0.28599167 -0.08741234 -0.06888065 0.05004882  623  GLU   A CG   
8680  C  CD   . GLU   A  568 ? 0.59269714 0.49764585 0.29890183 -0.08928456 -0.07245307 0.05480456  623  GLU   A CD   
8681  O  OE1  . GLU   A  568 ? 0.67233902 0.57299656 0.36677706 -0.09284195 -0.06639086 0.05630473  623  GLU   A OE1  
8682  O  OE2  . GLU   A  568 ? 0.47867447 0.38091207 0.18179834 -0.08731406 -0.08134026 0.05695678  623  GLU   A OE2  
8683  H  H    . GLU   A  568 ? 0.43227363 0.35904643 0.18902253 -0.08507198 -0.05888269 0.04652905  623  GLU   A H    
8684  H  HA   . GLU   A  568 ? 0.48426849 0.41043091 0.22490965 -0.08708119 -0.06079396 0.03871929  623  GLU   A HA   
8685  H  HB2  . GLU   A  568 ? 0.52459979 0.44107223 0.25060901 -0.09081779 -0.05520725 0.04877804  623  GLU   A HB2  
8686  H  HB3  . GLU   A  568 ? 0.53670305 0.45187080 0.25094682 -0.09175995 -0.05740706 0.04491118  623  GLU   A HB3  
8687  H  HG2  . GLU   A  568 ? 0.54939640 0.46641701 0.27760249 -0.08624633 -0.07252028 0.04732759  623  GLU   A HG2  
8688  H  HG3  . GLU   A  568 ? 0.54282641 0.45843405 0.27715892 -0.08562530 -0.06978144 0.05204113  623  GLU   A HG3  
8689  N  N    . ILE   A  569 ? 0.42736208 0.36142892 0.18274114 -0.08842360 -0.04302310 0.03644958  624  ILE   A N    
8690  C  CA   . ILE   A  569 ? 0.40779012 0.34653389 0.16656621 -0.08911502 -0.03486089 0.03221188  624  ILE   A CA   
8691  C  C    . ILE   A  569 ? 0.37736356 0.32032478 0.14549284 -0.08663047 -0.03570352 0.02660993  624  ILE   A C    
8692  O  O    . ILE   A  569 ? 0.41402209 0.35716492 0.17664465 -0.08696178 -0.03280632 0.02187446  624  ILE   A O    
8693  C  CB   . ILE   A  569 ? 0.40963441 0.35156089 0.17734590 -0.08966835 -0.02970952 0.03457539  624  ILE   A CB   
8694  C  CG1  . ILE   A  569 ? 0.42938483 0.36545992 0.18712591 -0.09264933 -0.02949343 0.04063068  624  ILE   A CG1  
8695  C  CG2  . ILE   A  569 ? 0.47145849 0.41943669 0.24350160 -0.09011725 -0.02141177 0.03002337  624  ILE   A CG2  
8696  C  CD1  . ILE   A  569 ? 0.46217054 0.39422125 0.20253249 -0.09626837 -0.02616518 0.04095775  624  ILE   A CD1  
8697  H  H    . ILE   A  569 ? 0.42688224 0.36159861 0.18950608 -0.08718346 -0.04508435 0.03877534  624  ILE   A H    
8698  H  HA   . ILE   A  569 ? 0.42005116 0.35679507 0.16831450 -0.09102408 -0.03219800 0.03139163  624  ILE   A HA   
8699  H  HB   . ILE   A  569 ? 0.40968978 0.35357127 0.18763925 -0.08766677 -0.03224993 0.03512694  624  ILE   A HB   
8700  H  HG12 . ILE   A  569 ? 0.43192959 0.36450323 0.18893890 -0.09158307 -0.03509045 0.04345734  624  ILE   A HG12 
8701  H  HG13 . ILE   A  569 ? 0.42510998 0.36333773 0.18893436 -0.09326079 -0.02616981 0.04172113  624  ILE   A HG13 
8702  H  HG21 . ILE   A  569 ? 0.45919245 0.40598059 0.22174558 -0.09165201 -0.01886394 0.02850660  624  ILE   A HG21 
8703  H  HG22 . ILE   A  569 ? 0.44123191 0.39233068 0.22125000 -0.08790971 -0.02193042 0.02685966  624  ILE   A HG22 
8704  H  HG23 . ILE   A  569 ? 0.44584972 0.39575279 0.22212355 -0.09105751 -0.01822251 0.03174164  624  ILE   A HG23 
8705  H  HD11 . ILE   A  569 ? 0.46398583 0.39303541 0.19719559 -0.09582190 -0.03007794 0.04036704  624  ILE   A HD11 
8706  H  HD12 . ILE   A  569 ? 0.45684433 0.39294165 0.19811301 -0.09702715 -0.02058779 0.03768933  624  ILE   A HD12 
8707  H  HD13 . ILE   A  569 ? 0.46363488 0.39191166 0.19858637 -0.09839901 -0.02566147 0.04500013  624  ILE   A HD13 
8708  N  N    . PHE   A  570 ? 0.36157045 0.30732366 0.14307374 -0.08424183 -0.03972150 0.02712497  625  PHE   A N    
8709  C  CA   . PHE   A  570 ? 0.42120558 0.37036294 0.21198797 -0.08236213 -0.04032078 0.02239882  625  PHE   A CA   
8710  C  C    . PHE   A  570 ? 0.41583520 0.36256415 0.20265669 -0.08227269 -0.04732515 0.02081733  625  PHE   A C    
8711  O  O    . PHE   A  570 ? 0.46204576 0.41053033 0.25573933 -0.08129202 -0.04877488 0.01714226  625  PHE   A O    
8712  C  CB   . PHE   A  570 ? 0.57072425 0.52448189 0.37765956 -0.08036692 -0.04034478 0.02354720  625  PHE   A CB   
8713  C  CG   . PHE   A  570 ? 0.51983047 0.47704268 0.33267140 -0.08034268 -0.03345593 0.02361605  625  PHE   A CG   
8714  C  CD1  . PHE   A  570 ? 1.04870856 1.00489306 0.85840750 -0.08193339 -0.03111401 0.02769946  625  PHE   A CD1  
8715  C  CD2  . PHE   A  570 ? 0.85569078 0.81688201 0.67706847 -0.07884760 -0.02971775 0.01964072  625  PHE   A CD2  
8716  C  CE1  . PHE   A  570 ? 1.07607424 1.03609157 0.89170337 -0.08240633 -0.02507760 0.02760976  625  PHE   A CE1  
8717  C  CE2  . PHE   A  570 ? 0.93385625 0.89907253 0.76126260 -0.07873820 -0.02395332 0.01961564  625  PHE   A CE2  
8718  C  CZ   . PHE   A  570 ? 0.81481713 0.77986759 0.63953555 -0.08071993 -0.02161807 0.02350031  625  PHE   A CZ   
8719  H  H    . PHE   A  570 ? 0.37675276 0.32201296 0.16134319 -0.08384161 -0.04205484 0.03047697  625  PHE   A H    
8720  H  HA   . PHE   A  570 ? 0.42659861 0.37667036 0.21569642 -0.08254207 -0.03588723 0.01919036  625  PHE   A HA   
8721  H  HB2  . PHE   A  570 ? 0.51083493 0.46388608 0.31928885 -0.08007662 -0.04391183 0.02680482  625  PHE   A HB2  
8722  H  HB3  . PHE   A  570 ? 0.50994539 0.46515745 0.32226151 -0.07935390 -0.04176097 0.02097292  625  PHE   A HB3  
8723  H  HD1  . PHE   A  570 ? 0.85967779 0.81234717 0.66307831 -0.08280897 -0.03385904 0.03061657  625  PHE   A HD1  
8724  H  HD2  . PHE   A  570 ? 0.74921227 0.71026886 0.57240194 -0.07791084 -0.03133952 0.01695360  625  PHE   A HD2  
8725  H  HE1  . PHE   A  570 ? 0.99486428 0.95385385 0.80815846 -0.08393828 -0.02358340 0.03042604  625  PHE   A HE1  
8726  H  HE2  . PHE   A  570 ? 0.87574697 0.84365475 0.70902818 -0.07739760 -0.02181527 0.01692655  625  PHE   A HE2  
8727  H  HZ   . PHE   A  570 ? 0.88937902 0.85755682 0.71852738 -0.08095805 -0.01783624 0.02338519  625  PHE   A HZ   
8728  N  N    . LEU   A  571 ? 0.36727479 0.30975047 0.14305454 -0.08348602 -0.05194283 0.02382644  626  LEU   A N    
8729  C  CA   . LEU   A  571 ? 0.42043307 0.36054188 0.19039664 -0.08387712 -0.05913784 0.02266710  626  LEU   A CA   
8730  C  C    . LEU   A  571 ? 0.43077439 0.37497258 0.21415849 -0.08231274 -0.06501728 0.02252788  626  LEU   A C    
8731  O  O    . LEU   A  571 ? 0.41953748 0.36353534 0.20188256 -0.08293743 -0.06973527 0.01970488  626  LEU   A O    
8732  C  CB   . LEU   A  571 ? 0.43768942 0.37541974 0.19855243 -0.08509869 -0.05683006 0.01692762  626  LEU   A CB   
8733  C  CG   . LEU   A  571 ? 0.48221657 0.41716129 0.23010051 -0.08668345 -0.04998382 0.01590752  626  LEU   A CG   
8734  C  CD1  . LEU   A  571 ? 0.45238808 0.38566428 0.19379516 -0.08698092 -0.04735348 0.00925834  626  LEU   A CD1  
8735  C  CD2  . LEU   A  571 ? 0.45480418 0.38446403 0.18714836 -0.08874404 -0.05265696 0.02036538  626  LEU   A CD2  
8736  H  H    . LEU   A  571 ? 0.39304984 0.33385497 0.16457850 -0.08418868 -0.05080689 0.02690496  626  LEU   A H    
8737  H  HA   . LEU   A  571 ? 0.42320684 0.36027023 0.18528965 -0.08454981 -0.06186214 0.02570095  626  LEU   A HA   
8738  H  HB2  . LEU   A  571 ? 0.43579188 0.37588978 0.20457143 -0.08419732 -0.05510946 0.01397204  626  LEU   A HB2  
8739  H  HB3  . LEU   A  571 ? 0.44968459 0.38532963 0.20530410 -0.08575169 -0.06184515 0.01635165  626  LEU   A HB3  
8740  H  HG   . LEU   A  571 ? 0.45322490 0.39080733 0.20678246 -0.08622395 -0.04516587 0.01669766  626  LEU   A HG   
8741  H  HD11 . LEU   A  571 ? 0.46772170 0.40075994 0.20344445 -0.08758783 -0.04188009 0.00826594  626  LEU   A HD11 
8742  H  HD12 . LEU   A  571 ? 0.47161716 0.40164083 0.20509511 -0.08792569 -0.05169575 0.00848497  626  LEU   A HD12 
8743  H  HD13 . LEU   A  571 ? 0.45443636 0.38998264 0.20511718 -0.08562206 -0.04684734 0.00665893  626  LEU   A HD13 
8744  H  HD21 . LEU   A  571 ? 0.46197730 0.39199156 0.19825630 -0.08831739 -0.05428248 0.02455236  626  LEU   A HD21 
8745  H  HD22 . LEU   A  571 ? 0.47341162 0.40060711 0.19992539 -0.08915517 -0.05770747 0.01962144  626  LEU   A HD22 
8746  H  HD23 . LEU   A  571 ? 0.47340125 0.40167308 0.19762510 -0.09009410 -0.04774745 0.01971412  626  LEU   A HD23 
8747  N  N    . MET   A  572 ? 0.39561492 0.34361255 0.19132090 -0.08058088 -0.06461407 0.02550488  627  MET   A N    
8748  C  CA   . MET   A  572 ? 0.37243766 0.32520497 0.18122563 -0.07913498 -0.06945694 0.02588145  627  MET   A CA   
8749  C  C    . MET   A  572 ? 0.34338391 0.29835564 0.16039307 -0.07712417 -0.06973822 0.03040751  627  MET   A C    
8750  O  O    . MET   A  572 ? 0.36511129 0.31776777 0.17891760 -0.07714954 -0.06547945 0.03278366  627  MET   A O    
8751  C  CB   . MET   A  572 ? 0.37688649 0.33310309 0.19603971 -0.07903709 -0.06666248 0.02171599  627  MET   A CB   
8752  C  CG   . MET   A  572 ? 0.34561765 0.30328345 0.17065404 -0.07810915 -0.05952356 0.02148544  627  MET   A CG   
8753  S  SD   . MET   A  572 ? 0.36063668 0.31999674 0.19397052 -0.07790717 -0.05661166 0.01640601  627  MET   A SD   
8754  C  CE   . MET   A  572 ? 0.38526392 0.33930430 0.20433719 -0.07912575 -0.05371871 0.01187031  627  MET   A CE   
8755  H  H    . MET   A  572 ? 0.39537203 0.34308016 0.19117758 -0.08043207 -0.06108005 0.02730824  627  MET   A H    
8756  H  HA   . MET   A  572 ? 0.38010934 0.33234912 0.18569134 -0.07953852 -0.07459254 0.02587668  627  MET   A HA   
8757  H  HB2  . MET   A  572 ? 0.36221534 0.32167062 0.18936568 -0.07852864 -0.06987192 0.02211188  627  MET   A HB2  
8758  H  HB3  . MET   A  572 ? 0.37435770 0.32849708 0.18817842 -0.08016747 -0.06675224 0.01864546  627  MET   A HB3  
8759  H  HG2  . MET   A  572 ? 0.36052936 0.31583267 0.17830975 -0.07866021 -0.05624220 0.02156686  627  MET   A HG2  
8760  H  HG3  . MET   A  572 ? 0.34820959 0.30808014 0.17967425 -0.07704331 -0.05969697 0.02411430  627  MET   A HG3  
8761  H  HE1  . MET   A  572 ? 0.39037240 0.34225315 0.20216981 -0.08019767 -0.05710306 0.01207991  627  MET   A HE1  
8762  H  HE2  . MET   A  572 ? 0.38372588 0.33757430 0.19986613 -0.07885373 -0.04948741 0.01229266  627  MET   A HE2  
8763  H  HE3  . MET   A  572 ? 0.38108534 0.33457285 0.20256568 -0.07897965 -0.05302382 0.00870230  627  MET   A HE3  
8764  N  N    . PRO   A  573 ? 0.34941974 0.30895197 0.17712896 -0.07544892 -0.07465638 0.03157623  628  PRO   A N    
8765  C  CA   . PRO   A  573 ? 0.32566476 0.28729230 0.16184156 -0.07307498 -0.07466098 0.03512885  628  PRO   A CA   
8766  C  C    . PRO   A  573 ? 0.35371101 0.31694236 0.19720407 -0.07278337 -0.06778983 0.03458029  628  PRO   A C    
8767  O  O    . PRO   A  573 ? 0.34497881 0.31064811 0.19341540 -0.07351714 -0.06460691 0.03118560  628  PRO   A O    
8768  C  CB   . PRO   A  573 ? 0.32464361 0.29253355 0.17188685 -0.07160405 -0.08036988 0.03482464  628  PRO   A CB   
8769  C  CG   . PRO   A  573 ? 0.32286185 0.28991336 0.16281599 -0.07333288 -0.08567578 0.03294752  628  PRO   A CG   
8770  C  CD   . PRO   A  573 ? 0.36034852 0.32336402 0.19200456 -0.07585940 -0.08078659 0.02957701  628  PRO   A CD   
8771  H  HA   . PRO   A  573 ? 0.34275979 0.30081344 0.17252347 -0.07267383 -0.07604451 0.03794289  628  PRO   A HA   
8772  H  HB2  . PRO   A  573 ? 0.31247061 0.28399795 0.16798025 -0.07168136 -0.07827201 0.03309615  628  PRO   A HB2  
8773  H  HB3  . PRO   A  573 ? 0.32042623 0.28890401 0.17024711 -0.06966862 -0.08272530 0.03743611  628  PRO   A HB3  
8774  H  HG2  . PRO   A  573 ? 0.32844505 0.30010733 0.17564224 -0.07338416 -0.08852270 0.03163144  628  PRO   A HG2  
8775  H  HG3  . PRO   A  573 ? 0.34043428 0.30477706 0.17368716 -0.07279187 -0.08907501 0.03510512  628  PRO   A HG3  
8776  H  HD2  . PRO   A  573 ? 0.34393674 0.30940896 0.18165585 -0.07646753 -0.07916673 0.02701785  628  PRO   A HD2  
8777  H  HD3  . PRO   A  573 ? 0.36005956 0.32026255 0.18297105 -0.07706382 -0.08327672 0.02879338  628  PRO   A HD3  
8778  N  N    . LEU   A  574 ? 0.29759780 0.25869748 0.14089482 -0.07177743 -0.06599578 0.03800832  629  LEU   A N    
8779  C  CA   . LEU   A  574 ? 0.32367647 0.28693455 0.17552842 -0.07112554 -0.06092472 0.03811309  629  LEU   A CA   
8780  C  C    . LEU   A  574 ? 0.29930186 0.26807240 0.16431026 -0.06883927 -0.06342565 0.03807431  629  LEU   A C    
8781  O  O    . LEU   A  574 ? 0.33802319 0.31040609 0.21185808 -0.06858238 -0.06005511 0.03647438  629  LEU   A O    
8782  C  CB   . LEU   A  574 ? 0.32551044 0.28384960 0.17196952 -0.07122163 -0.05912353 0.04195039  629  LEU   A CB   
8783  C  CG   . LEU   A  574 ? 0.36976123 0.32297549 0.20291664 -0.07405710 -0.05575732 0.04248002  629  LEU   A CG   
8784  C  CD1  . LEU   A  574 ? 0.36579925 0.31425428 0.19492646 -0.07481688 -0.05372946 0.04641815  629  LEU   A CD1  
8785  C  CD2  . LEU   A  574 ? 0.46684194 0.42289579 0.30100769 -0.07561012 -0.04985330 0.03856879  629  LEU   A CD2  
8786  H  H    . LEU   A  574 ? 0.32502669 0.28279874 0.16224754 -0.07158493 -0.06822300 0.04040711  629  LEU   A H    
8787  H  HA   . LEU   A  574 ? 0.31151897 0.27569866 0.16383746 -0.07217547 -0.05726076 0.03574764  629  LEU   A HA   
8788  H  HB2  . LEU   A  574 ? 0.33627993 0.29308492 0.18204984 -0.06984784 -0.06310988 0.04422205  629  LEU   A HB2  
8789  H  HB3  . LEU   A  574 ? 0.32612896 0.28607956 0.17871463 -0.07080212 -0.05624738 0.04196747  629  LEU   A HB3  
8790  H  HG   . LEU   A  574 ? 0.38439783 0.33530825 0.21036881 -0.07445400 -0.05894579 0.04279332  629  LEU   A HG   
8791  H  HD11 . LEU   A  574 ? 0.37716779 0.32212615 0.19681570 -0.07685824 -0.05222148 0.04720381  629  LEU   A HD11 
8792  H  HD12 . LEU   A  574 ? 0.36176002 0.31241268 0.19684161 -0.07496252 -0.05012311 0.04578588  629  LEU   A HD12 
8793  H  HD13 . LEU   A  574 ? 0.36979783 0.31629983 0.19965978 -0.07320502 -0.05758919 0.04879439  629  LEU   A HD13 
8794  H  HD21 . LEU   A  574 ? 0.43118456 0.38821673 0.26422623 -0.07568502 -0.05127256 0.03617993  629  LEU   A HD21 
8795  H  HD22 . LEU   A  574 ? 0.42243525 0.38165313 0.26508707 -0.07481077 -0.04780360 0.03776877  629  LEU   A HD22 
8796  H  HD23 . LEU   A  574 ? 0.43727130 0.39097351 0.26463529 -0.07732812 -0.04669544 0.03912486  629  LEU   A HD23 
8797  N  N    . TRP   A  575 ? 0.30311865 0.27260190 0.16897090 -0.06707748 -0.06946743 0.03992310  630  TRP   A N    
8798  C  CA   . TRP   A  575 ? 0.28280431 0.25846255 0.16079725 -0.06474335 -0.07230876 0.03983521  630  TRP   A CA   
8799  C  C    . TRP   A  575 ? 0.32297903 0.30102664 0.20079690 -0.06372230 -0.07948115 0.04022202  630  TRP   A C    
8800  O  O    . TRP   A  575 ? 0.28775570 0.26096383 0.15544334 -0.06375012 -0.08293914 0.04204356  630  TRP   A O    
8801  C  CB   . TRP   A  575 ? 0.33358288 0.30822366 0.21602936 -0.06213246 -0.07127631 0.04246470  630  TRP   A CB   
8802  C  CG   . TRP   A  575 ? 0.29808125 0.26564580 0.17130500 -0.06106537 -0.07378058 0.04611941  630  TRP   A CG   
8803  C  CD1  . TRP   A  575 ? 0.28726274 0.24783045 0.15143786 -0.06272926 -0.07035779 0.04806046  630  TRP   A CD1  
8804  C  CD2  . TRP   A  575 ? 0.29911470 0.26568362 0.17140511 -0.05810212 -0.08036166 0.04847103  630  TRP   A CD2  
8805  N  NE1  . TRP   A  575 ? 0.31662598 0.27057999 0.17258318 -0.06147148 -0.07449672 0.05176830  630  TRP   A NE1  
8806  C  CE2  . TRP   A  575 ? 0.34911793 0.30643237 0.21021147 -0.05816196 -0.08084255 0.05209424  630  TRP   A CE2  
8807  C  CE3  . TRP   A  575 ? 0.28797793 0.26076180 0.16783403 -0.05547730 -0.08597318 0.04788277  630  TRP   A CE3  
8808  C  CZ2  . TRP   A  575 ? 0.31444919 0.26749054 0.17113981 -0.05524432 -0.08720627 0.05527808  630  TRP   A CZ2  
8809  C  CZ3  . TRP   A  575 ? 0.32332611 0.29329753 0.20002374 -0.05227532 -0.09225709 0.05068859  630  TRP   A CZ3  
8810  C  CH2  . TRP   A  575 ? 0.29705617 0.25672793 0.16217577 -0.05189670 -0.09300168 0.05442741  630  TRP   A CH2  
8811  H  H    . TRP   A  575 ? 0.30855483 0.27469483 0.16699514 -0.06727091 -0.07189112 0.04129291  630  TRP   A H    
8812  H  HA   . TRP   A  575 ? 0.29342207 0.27256823 0.17714228 -0.06552721 -0.07027552 0.03765697  630  TRP   A HA   
8813  H  HB2  . TRP   A  575 ? 0.30368298 0.28281954 0.19399372 -0.06038405 -0.07318572 0.04216113  630  TRP   A HB2  
8814  H  HB3  . TRP   A  575 ? 0.30369836 0.27788511 0.18763350 -0.06291531 -0.06695972 0.04191430  630  TRP   A HB3  
8815  H  HD1  . TRP   A  575 ? 0.29298946 0.25316462 0.15603949 -0.06464054 -0.06597978 0.04704791  630  TRP   A HD1  
8816  H  HE1  . TRP   A  575 ? 0.32453135 0.27313513 0.17380303 -0.06252345 -0.07316902 0.05368303  630  TRP   A HE1  
8817  H  HE3  . TRP   A  575 ? 0.28925058 0.26821625 0.17648499 -0.05585461 -0.08560599 0.04563194  630  TRP   A HE3  
8818  H  HZ2  . TRP   A  575 ? 0.32805389 0.27405143 0.17657243 -0.05555201 -0.08751602 0.05793023  630  TRP   A HZ2  
8819  H  HZ3  . TRP   A  575 ? 0.30637938 0.28149593 0.18915975 -0.05025936 -0.09612742 0.05013282  630  TRP   A HZ3  
8820  H  HH2  . TRP   A  575 ? 0.31891716 0.27616483 0.18165952 -0.04950925 -0.09766696 0.05643008  630  TRP   A HH2  
8821  N  N    . THR   A  576 ? 0.29866815 0.28447348 0.18778726 -0.06305962 -0.08154144 0.03852576  631  THR   A N    
8822  C  CA   . THR   A  576 ? 0.29935855 0.29022130 0.19217873 -0.06193736 -0.08833510 0.03851922  631  THR   A CA   
8823  C  C    . THR   A  576 ? 0.29322594 0.29184228 0.20005868 -0.05909434 -0.08873652 0.03863797  631  THR   A C    
8824  O  O    . THR   A  576 ? 0.31027585 0.31344947 0.22545573 -0.06018201 -0.08486848 0.03677426  631  THR   A O    
8825  C  CB   . THR   A  576 ? 0.35678566 0.35030484 0.24900436 -0.06537839 -0.08988647 0.03534186  631  THR   A CB   
8826  O  OG1  . THR   A  576 ? 0.35994837 0.34588429 0.23849933 -0.06758837 -0.08888029 0.03490085  631  THR   A OG1  
8827  C  CG2  . THR   A  576 ? 0.47945654 0.47996506 0.37719002 -0.06489368 -0.09722248 0.03489969  631  THR   A CG2  
8828  H  H    . THR   A  576 ? 0.29441053 0.28281876 0.18945849 -0.06347063 -0.07846556 0.03729200  631  THR   A H    
8829  H  HA   . THR   A  576 ? 0.31655198 0.30388349 0.20305851 -0.06077443 -0.09150495 0.04046249  631  THR   A HA   
8830  H  HB   . THR   A  576 ? 0.35321626 0.34918433 0.25097236 -0.06658146 -0.08660333 0.03365978  631  THR   A HB   
8832  H  HG21 . THR   A  576 ? 0.44060585 0.44153857 0.33627990 -0.06755459 -0.09837384 0.03287879  631  THR   A HG21 
8833  H  HG22 . THR   A  576 ? 0.44487333 0.44326234 0.33805153 -0.06310163 -0.10084758 0.03681481  631  THR   A HG22 
8834  H  HG23 . THR   A  576 ? 0.43067133 0.43731064 0.33844328 -0.06376802 -0.09714019 0.03466435  631  THR   A HG23 
8835  N  N    . SER   A  577 ? 0.25691611 0.25695765 0.16592424 -0.05534165 -0.09361549 0.04072677  632  SER   A N    
8836  C  CA   . SER   A  577 ? 0.26657474 0.27330586 0.18783674 -0.05164951 -0.09398281 0.04089915  632  SER   A CA   
8837  C  C    . SER   A  577 ? 0.26216018 0.27808022 0.19145218 -0.04991937 -0.10055922 0.04017093  632  SER   A C    
8838  O  O    . SER   A  577 ? 0.28478909 0.29866379 0.20826685 -0.04866086 -0.10671203 0.04158726  632  SER   A O    
8839  C  CB   . SER   A  577 ? 0.27800906 0.27754989 0.19522147 -0.04780243 -0.09370030 0.04394883  632  SER   A CB   
8840  O  OG   . SER   A  577 ? 0.35878268 0.36417750 0.28723603 -0.04356507 -0.09426372 0.04376897  632  SER   A OG   
8841  H  H    . SER   A  577 ? 0.27759093 0.27410811 0.17982551 -0.05487838 -0.09698616 0.04205181  632  SER   A H    
8842  H  HA   . SER   A  577 ? 0.25604564 0.26590246 0.18298489 -0.05283263 -0.09001771 0.03941229  632  SER   A HA   
8843  H  HB2  . SER   A  577 ? 0.29171419 0.28636485 0.20481332 -0.04927006 -0.08935542 0.04424522  632  SER   A HB2  
8844  H  HB3  . SER   A  577 ? 0.30191010 0.29718292 0.21224788 -0.04689328 -0.09749625 0.04571712  632  SER   A HB3  
8846  N  N    . TYR   A  578 ? 0.25404993 0.28044316 0.19690368 -0.04968593 -0.09936004 0.03811357  633  TYR   A N    
8847  C  CA   . TYR   A  578 ? 0.25372094 0.29102108 0.20668648 -0.04793831 -0.10503425 0.03717142  633  TYR   A CA   
8848  C  C    . TYR   A  578 ? 0.29746807 0.34566891 0.26550752 -0.04632704 -0.10225812 0.03551283  633  TYR   A C    
8849  O  O    . TYR   A  578 ? 0.31037539 0.35874465 0.28104806 -0.04856452 -0.09594076 0.03442518  633  TYR   A O    
8850  C  CB   . TYR   A  578 ? 0.24954246 0.29034543 0.20129535 -0.05283349 -0.10795151 0.03523576  633  TYR   A CB   
8851  C  CG   . TYR   A  578 ? 0.25030869 0.29220915 0.20400026 -0.05817824 -0.10249809 0.03283840  633  TYR   A CG   
8852  C  CD1  . TYR   A  578 ? 0.25833327 0.29026586 0.20136499 -0.06100325 -0.09812105 0.03274499  633  TYR   A CD1  
8853  C  CD2  . TYR   A  578 ? 0.27319434 0.32608813 0.23911226 -0.06058106 -0.10206152 0.03064213  633  TYR   A CD2  
8854  C  CE1  . TYR   A  578 ? 0.27878734 0.31086481 0.22321300 -0.06543141 -0.09384177 0.03054394  633  TYR   A CE1  
8855  C  CE2  . TYR   A  578 ? 0.27565464 0.32817057 0.24229406 -0.06570148 -0.09763374 0.02876266  633  TYR   A CE2  
8856  C  CZ   . TYR   A  578 ? 0.32130626 0.36301780 0.27706146 -0.06786761 -0.09386797 0.02870076  633  TYR   A CZ   
8857  O  OH   . TYR   A  578 ? 0.32989427 0.37073064 0.28657472 -0.07236811 -0.09002661 0.02685397  633  TYR   A OH   
8858  H  H    . TYR   A  578 ? 0.24763206 0.27470708 0.19357347 -0.05073703 -0.09487802 0.03727270  633  TYR   A H    
8859  H  HA   . TYR   A  578 ? 0.26770756 0.30310953 0.21829127 -0.04460363 -0.10918453 0.03881668  633  TYR   A HA   
8860  H  HB2  . TYR   A  578 ? 0.25379556 0.30258664 0.21289125 -0.05186340 -0.11191081 0.03458211  633  TYR   A HB2  
8861  H  HB3  . TYR   A  578 ? 0.26028383 0.29448587 0.20216714 -0.05347406 -0.11014970 0.03618765  633  TYR   A HB3  
8862  H  HD1  . TYR   A  578 ? 0.26738191 0.29230973 0.20209752 -0.05985229 -0.09809158 0.03419777  633  TYR   A HD1  
8863  H  HD2  . TYR   A  578 ? 0.26789337 0.32861677 0.24176113 -0.05874030 -0.10485024 0.03046154  633  TYR   A HD2  
8864  H  HE1  . TYR   A  578 ? 0.28272361 0.30833322 0.22034419 -0.06684725 -0.09101492 0.03032115  633  TYR   A HE1  
8865  H  HE2  . TYR   A  578 ? 0.27930313 0.33895615 0.25385201 -0.06769780 -0.09732503 0.02751454  633  TYR   A HE2  
8867  N  N    . THR   A  579 ? 0.27343664 0.33119822 0.25132519 -0.04241967 -0.10715599 0.03521087  634  THR   A N    
8868  C  CA   . THR   A  579 ? 0.24300086 0.31224579 0.23556510 -0.04012557 -0.10468842 0.03348100  634  THR   A CA   
8869  C  C    . THR   A  579 ? 0.26407695 0.34745207 0.26781845 -0.04306238 -0.10758525 0.03114576  634  THR   A C    
8870  O  O    . THR   A  579 ? 0.24951899 0.33618903 0.25327408 -0.04260054 -0.11456704 0.03130667  634  THR   A O    
8871  C  CB   . THR   A  579 ? 0.26069468 0.32932410 0.25609931 -0.03251569 -0.10716393 0.03476330  634  THR   A CB   
8872  O  OG1  . THR   A  579 ? 0.24888074 0.30297977 0.23255560 -0.03120013 -0.10419808 0.03704917  634  THR   A OG1  
8873  C  CG2  . THR   A  579 ? 0.27724856 0.35794854 0.28760749 -0.02932177 -0.10446458 0.03257422  634  THR   A CG2  
8874  H  H    . THR   A  579 ? 0.27939749 0.33673185 0.25472924 -0.04105819 -0.11221245 0.03603150  634  THR   A H    
8875  H  HA   . THR   A  579 ? 0.24901512 0.31652895 0.24163637 -0.04191645 -0.09929889 0.03295369  634  THR   A HA   
8876  H  HB   . THR   A  579 ? 0.26518077 0.33483115 0.25987959 -0.03053919 -0.11289324 0.03551169  634  THR   A HB   
8878  H  HG21 . THR   A  579 ? 0.27286360 0.35133114 0.28379658 -0.02420920 -0.10564883 0.03328523  634  THR   A HG21 
8879  H  HG22 . THR   A  579 ? 0.26397040 0.34443209 0.27509272 -0.03181194 -0.09904105 0.03174623  634  THR   A HG22 
8880  H  HG23 . THR   A  579 ? 0.26892209 0.35985440 0.28745124 -0.02990382 -0.10696591 0.03120777  634  THR   A HG23 
8881  N  N    . ILE   A  580 ? 0.21756178 0.30870530 0.23003796 -0.04650331 -0.10222833 0.02912120  635  ILE   A N    
8882  C  CA   . ILE   A  580 ? 0.27344099 0.37817580 0.29703668 -0.05065439 -0.10354680 0.02686225  635  ILE   A CA   
8883  C  C    . ILE   A  580 ? 0.29527074 0.41295058 0.33360130 -0.04755559 -0.10050868 0.02537955  635  ILE   A C    
8884  O  O    . ILE   A  580 ? 0.38414407 0.50021005 0.42331111 -0.04771731 -0.09379230 0.02509708  635  ILE   A O    
8885  C  CB   . ILE   A  580 ? 0.32826525 0.42928657 0.34746438 -0.05850694 -0.09943360 0.02592975  635  ILE   A CB   
8886  C  CG1  . ILE   A  580 ? 0.39008415 0.47764516 0.39402249 -0.06107209 -0.10148058 0.02689890  635  ILE   A CG1  
8887  C  CG2  . ILE   A  580 ? 0.37357366 0.48786819 0.40398443 -0.06392265 -0.10034307 0.02372343  635  ILE   A CG2  
8888  C  CD1  . ILE   A  580 ? 0.31173688 0.40109503 0.31314239 -0.06155800 -0.10969728 0.02676710  635  ILE   A CD1  
8889  H  H    . ILE   A  580 ? 0.23409460 0.32170263 0.24527174 -0.04648454 -0.09749704 0.02924362  635  ILE   A H    
8890  H  HA   . ILE   A  580 ? 0.27833688 0.38606194 0.30259198 -0.05025037 -0.10904898 0.02685053  635  ILE   A HA   
8891  H  HB   . ILE   A  580 ? 0.32871240 0.42689562 0.34737411 -0.05855905 -0.09421670 0.02606523  635  ILE   A HB   
8892  H  HG12 . ILE   A  580 ? 0.35379359 0.43337300 0.35099685 -0.05819611 -0.10018227 0.02834076  635  ILE   A HG12 
8893  H  HG13 . ILE   A  580 ? 0.35258317 0.43748534 0.35417008 -0.06543962 -0.09853297 0.02612650  635  ILE   A HG13 
8894  H  HG21 . ILE   A  580 ? 0.36230490 0.48145673 0.39533293 -0.06341612 -0.10568547 0.02338865  635  ILE   A HG21 
8895  H  HG22 . ILE   A  580 ? 0.35376456 0.47586709 0.39293259 -0.06311800 -0.09743025 0.02302978  635  ILE   A HG22 
8896  H  HG23 . ILE   A  580 ? 0.35855001 0.46853757 0.38457763 -0.06879055 -0.09853830 0.02331385  635  ILE   A HG23 
8897  H  HD11 . ILE   A  580 ? 0.33702981 0.42753750 0.33938545 -0.05696972 -0.11294861 0.02782172  635  ILE   A HD11 
8898  H  HD12 . ILE   A  580 ? 0.33314252 0.43101519 0.34187770 -0.06445134 -0.11129272 0.02527087  635  ILE   A HD12 
8899  H  HD13 . ILE   A  580 ? 0.33757341 0.41831020 0.32889050 -0.06360120 -0.11016313 0.02707876  635  ILE   A HD13 
8900  N  N    . SER   A  581 ? 0.24629422 0.37703624 0.29615057 -0.04439072 -0.10553611 0.02429590  636  SER   A N    
8901  C  CA   . SER   A  581 ? 0.27030021 0.41498011 0.33509022 -0.04082695 -0.10286038 0.02241724  636  SER   A CA   
8902  C  C    . SER   A  581 ? 0.22456294 0.38072208 0.29874837 -0.04773456 -0.09798931 0.02032878  636  SER   A C    
8903  O  O    . SER   A  581 ? 0.23624456 0.39075851 0.30686647 -0.05506966 -0.09822937 0.02022897  636  SER   A O    
8904  C  CB   . SER   A  581 ? 0.37376994 0.53000748 0.44904101 -0.03494362 -0.10994288 0.02165604  636  SER   A CB   
8905  O  OG   . SER   A  581 ? 0.34931514 0.51728696 0.43208152 -0.04026407 -0.11391632 0.02024000  636  SER   A OG   
8906  H  H    . SER   A  581 ? 0.26896471 0.40029484 0.31744477 -0.04434063 -0.11084303 0.02460686  636  SER   A H    
8907  H  HA   . SER   A  581 ? 0.27119437 0.41051027 0.33339614 -0.03758512 -0.09932556 0.02289243  636  SER   A HA   
8908  H  HB2  . SER   A  581 ? 0.33900782 0.50253838 0.42286527 -0.03115347 -0.10773695 0.02044001  636  SER   A HB2  
8909  H  HB3  . SER   A  581 ? 0.34714809 0.49540234 0.41534692 -0.03128577 -0.11410118 0.02329816  636  SER   A HB3  
8911  N  N    . LYS   A  582 ? 0.29013065 0.45686385 0.37540346 -0.04537493 -0.09320670 0.01866578  637  LYS   A N    
8912  C  CA   . LYS   A  582 ? 0.32124010 0.49965078 0.41579947 -0.05173337 -0.08792864 0.01687158  637  LYS   A CA   
8913  C  C    . LYS   A  582 ? 0.28842542 0.47906840 0.39141005 -0.05740989 -0.09262981 0.01568419  637  LYS   A C    
8914  O  O    . LYS   A  582 ? 0.34172422 0.53406012 0.44490677 -0.06574906 -0.08991201 0.01531828  637  LYS   A O    
8915  C  CB   . LYS   A  582 ? 0.37266934 0.56324542 0.47941297 -0.04660121 -0.08335485 0.01485163  637  LYS   A CB   
8916  C  CG   . LYS   A  582 ? 0.37765011 0.57715416 0.49085468 -0.05268401 -0.07598265 0.01347379  637  LYS   A CG   
8917  C  CD   . LYS   A  582 ? 0.45625809 0.67187345 0.58386457 -0.04788144 -0.07236381 0.01077770  637  LYS   A CD   
8918  C  CE   . LYS   A  582 ? 0.46375397 0.69173157 0.59947282 -0.05565814 -0.06606051 0.00941607  637  LYS   A CE   
8919  N  NZ   . LYS   A  582 ? 0.73494351 0.98289180 0.88737917 -0.05177752 -0.06349641 0.00626139  637  LYS   A NZ   
8920  H  H    . LYS   A  582 ? 0.27903637 0.44545102 0.36580616 -0.03965123 -0.09314269 0.01863138  637  LYS   A H    
8921  H  HA   . LYS   A  582 ? 0.31270283 0.48298603 0.39994746 -0.05571910 -0.08402166 0.01764989  637  LYS   A HA   
8922  H  HB2  . LYS   A  582 ? 0.36128405 0.54362190 0.46249828 -0.04213325 -0.08174829 0.01551022  637  LYS   A HB2  
8923  H  HB3  . LYS   A  582 ? 0.36484337 0.56541109 0.48050871 -0.04318183 -0.08715388 0.01374205  637  LYS   A HB3  
8924  H  HG2  . LYS   A  582 ? 0.39263850 0.59723914 0.50877577 -0.05839492 -0.07729043 0.01325531  637  LYS   A HG2  
8925  H  HG3  . LYS   A  582 ? 0.39048150 0.58001214 0.49517581 -0.05456426 -0.07197514 0.01451429  637  LYS   A HG3  
8926  H  HD2  . LYS   A  582 ? 0.43785343 0.64731491 0.56149125 -0.04344338 -0.06964497 0.01083745  637  LYS   A HD2  
8927  H  HD3  . LYS   A  582 ? 0.43927097 0.66339111 0.57476252 -0.04409380 -0.07685869 0.00978691  637  LYS   A HD3  
8928  H  HE2  . LYS   A  582 ? 0.51259816 0.74310184 0.64938223 -0.06131200 -0.06839702 0.00978423  637  LYS   A HE2  
8929  H  HE3  . LYS   A  582 ? 0.51201677 0.73222905 0.64063936 -0.05801561 -0.06120543 0.01022794  637  LYS   A HE3  
8930  H  HZ1  . LYS   A  582 ? 0.63571852 0.89179653 0.79555345 -0.04975176 -0.06815743 0.00543803  637  LYS   A HZ1  
8931  H  HZ2  . LYS   A  582 ? 0.63418514 0.87950802 0.78551394 -0.04626919 -0.06148750 0.00568212  637  LYS   A HZ2  
8932  H  HZ3  . LYS   A  582 ? 0.63287240 0.88777339 0.78937507 -0.05685509 -0.05927274 0.00561975  637  LYS   A HZ3  
8933  N  N    . GLN   A  583 ? 0.30341366 0.50228727 0.41329408 -0.05283996 -0.10005571 0.01510516  638  GLN   A N    
8934  C  CA   . GLN   A  583 ? 0.37576672 0.58877480 0.49592012 -0.05728541 -0.10534351 0.01360250  638  GLN   A CA   
8935  C  C    . GLN   A  583 ? 0.38959011 0.59233534 0.49838838 -0.06144972 -0.11192749 0.01484521  638  GLN   A C    
8936  O  O    . GLN   A  583 ? 0.30932695 0.52204889 0.42492533 -0.06453488 -0.11794230 0.01368214  638  GLN   A O    
8937  C  CB   . GLN   A  583 ? 0.33036444 0.55924141 0.46519923 -0.04957383 -0.11056957 0.01203035  638  GLN   A CB   
8938  C  CG   . GLN   A  583 ? 0.56835616 0.81077397 0.71684676 -0.04549503 -0.10425416 0.00986718  638  GLN   A CG   
8939  C  CD   . GLN   A  583 ? 0.98354691 1.21825683 1.12848854 -0.03482109 -0.10382592 0.01043385  638  GLN   A CD   
8940  O  OE1  . GLN   A  583 ? 0.71305209 0.92864037 0.84242988 -0.03310397 -0.10262419 0.01279543  638  GLN   A OE1  
8941  N  NE2  . GLN   A  583 ? 0.82171416 1.07126844 0.98133427 -0.02731771 -0.10498678 0.00811300  638  GLN   A NE2  
8942  H  H    . GLN   A  583 ? 0.31615961 0.51162374 0.42428863 -0.04663959 -0.10215529 0.01568889  638  GLN   A H    
8943  H  HA   . GLN   A  583 ? 0.35046017 0.57037675 0.47615355 -0.06272368 -0.10132996 0.01256635  638  GLN   A HA   
8944  H  HB2  . GLN   A  583 ? 0.39166698 0.61268520 0.52037573 -0.04400183 -0.11447359 0.01329700  638  GLN   A HB2  
8945  H  HB3  . GLN   A  583 ? 0.38656062 0.62469673 0.52793127 -0.05265943 -0.11473798 0.01108445  638  GLN   A HB3  
8946  H  HG2  . GLN   A  583 ? 0.56054956 0.81826353 0.72182941 -0.04528789 -0.10649461 0.00807021  638  GLN   A HG2  
8947  H  HG3  . GLN   A  583 ? 0.55214310 0.79358828 0.69935328 -0.05026488 -0.09802601 0.00970463  638  GLN   A HG3  
8948  H  HE21 . GLN   A  583 ? 0.86002105 1.12388837 1.03121614 -0.02907584 -0.10393610 0.00617866  638  GLN   A HE21 
8949  H  HE22 . GLN   A  583 ? 0.86943370 1.11445916 1.02723205 -0.02056975 -0.10676553 0.00845160  638  GLN   A HE22 
8950  N  N    . ALA   A  584 ? 0.45080814 0.63409543 0.54239976 -0.06163952 -0.11080162 0.01696648  639  ALA   A N    
8951  C  CA   . ALA   A  584 ? 0.36629266 0.53888297 0.44567209 -0.06469584 -0.11668423 0.01793128  639  ALA   A CA   
8952  C  C    . ALA   A  584 ? 0.35078001 0.52813953 0.43261254 -0.07444250 -0.11737438 0.01634812  639  ALA   A C    
8953  O  O    . ALA   A  584 ? 0.33744323 0.51834589 0.42368466 -0.08004052 -0.11118670 0.01552538  639  ALA   A O    
8954  C  CB   . ALA   A  584 ? 0.35246658 0.50477743 0.41407108 -0.06401603 -0.11358640 0.02006475  639  ALA   A CB   
8955  H  H    . ALA   A  584 ? 0.40674135 0.58352733 0.49409828 -0.05988409 -0.10620207 0.01768990  639  ALA   A H    
8956  H  HA   . ALA   A  584 ? 0.37952077 0.55502445 0.46048969 -0.06084065 -0.12259109 0.01813348  639  ALA   A HA   
8957  H  HB1  . ALA   A  584 ? 0.36192143 0.50764787 0.41542637 -0.06598264 -0.11726961 0.02047184  639  ALA   A HB1  
8958  H  HB2  . ALA   A  584 ? 0.35689983 0.50575829 0.41665953 -0.05823987 -0.11343578 0.02114009  639  ALA   A HB2  
8959  H  HB3  . ALA   A  584 ? 0.35285503 0.50223053 0.41295356 -0.06743447 -0.10810406 0.01989136  639  ALA   A HB3  
8960  N  N    . GLU   A  585 ? 0.33466664 0.51165974 0.41314250 -0.07652281 -0.12524192 0.01596943  640  GLU   A N    
8961  C  CA   . GLU   A  585 ? 0.34685028 0.52711111 0.42660621 -0.08580939 -0.12717512 0.01426301  640  GLU   A CA   
8962  C  C    . GLU   A  585 ? 0.31552267 0.47671887 0.37696385 -0.08988625 -0.12689286 0.01488606  640  GLU   A C    
8963  O  O    . GLU   A  585 ? 0.41694123 0.56627429 0.46577394 -0.08574402 -0.12992954 0.01626004  640  GLU   A O    
8964  C  CB   . GLU   A  585 ? 0.41265422 0.60675359 0.50203216 -0.08610512 -0.13640125 0.01279112  640  GLU   A CB   
8965  C  CG   . GLU   A  585 ? 0.67235720 0.88719559 0.78165448 -0.08208339 -0.13632245 0.01165419  640  GLU   A CG   
8966  C  CD   . GLU   A  585 ? 0.65468192 0.88878989 0.77991331 -0.08830574 -0.13978426 0.00911322  640  GLU   A CD   
8967  O  OE1  . GLU   A  585 ? 0.73160660 0.97365242 0.86533225 -0.09441769 -0.13329263 0.00802629  640  GLU   A OE1  
8968  O  OE2  . GLU   A  585 ? 0.63196778 0.87386096 0.76163048 -0.08710057 -0.14888358 0.00828654  640  GLU   A OE2  
8969  H  H    . GLU   A  585 ? 0.34664541 0.52077019 0.42142737 -0.07210778 -0.12971535 0.01681001  640  GLU   A H    
8970  H  HA   . GLU   A  585 ? 0.34503460 0.53127182 0.43169802 -0.08946586 -0.12248014 0.01350833  640  GLU   A HA   
8971  H  HB2  . GLU   A  585 ? 0.44852769 0.63657248 0.53065169 -0.08232789 -0.14129882 0.01370822  640  GLU   A HB2  
8972  H  HB3  . GLU   A  585 ? 0.44679123 0.64215505 0.53629899 -0.09277270 -0.13773382 0.01157316  640  GLU   A HB3  
8973  H  HG2  . GLU   A  585 ? 0.57880092 0.79424751 0.69082415 -0.08127895 -0.12978430 0.01186277  640  GLU   A HG2  
8974  H  HG3  . GLU   A  585 ? 0.59111840 0.80672765 0.70078492 -0.07539994 -0.14028408 0.01235853  640  GLU   A HG3  
8975  N  N    . VAL   A  586 ? 0.33384395 0.49176115 0.39368671 -0.09788647 -0.12260406 0.01390833  641  VAL   A N    
8976  C  CA   . VAL   A  586 ? 0.32130209 0.46211836 0.36513340 -0.10214470 -0.12219421 0.01381177  641  VAL   A CA   
8977  C  C    . VAL   A  586 ? 0.30416530 0.44781032 0.34757474 -0.10788650 -0.12973541 0.01177462  641  VAL   A C    
8978  O  O    . VAL   A  586 ? 0.32004702 0.47670269 0.37570816 -0.11321619 -0.13106011 0.01025394  641  VAL   A O    
8979  C  CB   . VAL   A  586 ? 0.30930865 0.44358999 0.35076159 -0.10740064 -0.11443640 0.01380471  641  VAL   A CB   
8980  C  CG1  . VAL   A  586 ? 0.29287723 0.41081530 0.31936023 -0.11218484 -0.11489584 0.01298410  641  VAL   A CG1  
8981  C  CG2  . VAL   A  586 ? 0.28645128 0.41706836 0.32706487 -0.10179842 -0.10736044 0.01571310  641  VAL   A CG2  
8982  H  H    . VAL   A  586 ? 0.32178643 0.48826751 0.39071584 -0.10071071 -0.11981292 0.01324232  641  VAL   A H    
8983  H  HA   . VAL   A  586 ? 0.31932431 0.45115227 0.35407937 -0.09787605 -0.12257627 0.01495064  641  VAL   A HA   
8984  H  HB   . VAL   A  586 ? 0.30200770 0.44579649 0.35289967 -0.11165137 -0.11376426 0.01293524  641  VAL   A HB   
8985  H  HG11 . VAL   A  586 ? 0.30230206 0.41238296 0.31987506 -0.10851085 -0.11651020 0.01351606  641  VAL   A HG11 
8986  H  HG12 . VAL   A  586 ? 0.30449876 0.42529181 0.33261088 -0.11692407 -0.11863183 0.01149620  641  VAL   A HG12 
8987  H  HG13 . VAL   A  586 ? 0.29717249 0.40958536 0.32125556 -0.11415351 -0.10986276 0.01333338  641  VAL   A HG13 
8988  H  HG21 . VAL   A  586 ? 0.28914720 0.41587090 0.32829121 -0.10515589 -0.10276743 0.01579256  641  VAL   A HG21 
8989  H  HG22 . VAL   A  586 ? 0.28723279 0.42822337 0.33743167 -0.09883590 -0.10699888 0.01587211  641  VAL   A HG22 
8990  H  HG23 . VAL   A  586 ? 0.29319042 0.41488421 0.32499543 -0.09788334 -0.10785860 0.01663242  641  VAL   A HG23 
8991  N  N    . SER   A  587 ? 0.28179312 0.41335809 0.31091741 -0.10709079 -0.13437629 0.01166194  642  SER   A N    
8992  C  CA   . SER   A  587 ? 0.32982749 0.46177024 0.35583580 -0.11243594 -0.14190565 0.00949152  642  SER   A CA   
8993  C  C    . SER   A  587 ? 0.37436855 0.48816863 0.38374239 -0.11675423 -0.13999079 0.00840353  642  SER   A C    
8994  O  O    . SER   A  587 ? 0.45791250 0.56070119 0.45991957 -0.11519717 -0.13310565 0.00946892  642  SER   A O    
8995  C  CB   . SER   A  587 ? 0.37044376 0.50522280 0.39400104 -0.10702410 -0.15036112 0.01005984  642  SER   A CB   
8996  O  OG   . SER   A  587 ? 0.46268481 0.58558905 0.47419089 -0.09993558 -0.14863107 0.01245230  642  SER   A OG   
8997  H  H    . SER   A  587 ? 0.29739732 0.42005885 0.31805810 -0.10320193 -0.13273807 0.01291420  642  SER   A H    
8998  H  HA   . SER   A  587 ? 0.33256802 0.47452852 0.36875838 -0.11699182 -0.14268586 0.00824937  642  SER   A HA   
8999  H  HB2  . SER   A  587 ? 0.38871253 0.52092397 0.40709171 -0.11056650 -0.15520522 0.00860072  642  SER   A HB2  
9000  H  HB3  . SER   A  587 ? 0.37761053 0.52530754 0.41321623 -0.10500093 -0.15251245 0.01019004  642  SER   A HB3  
9002  N  N    . SER   A  588 ? 0.40494689 0.51617283 0.40898848 -0.12212283 -0.14622274 0.00600265  643  SER   A N    
9003  C  CA   . SER   A  588 ? 0.52621132 0.62097782 0.51544690 -0.12669857 -0.14479934 0.00415851  643  SER   A CA   
9004  C  C    . SER   A  588 ? 0.48731014 0.56951106 0.45949292 -0.12238155 -0.14781758 0.00422790  643  SER   A C    
9005  O  O    . SER   A  588 ? 0.49644119 0.58292669 0.46829122 -0.11689511 -0.15222041 0.00580591  643  SER   A O    
9006  C  CB   . SER   A  588 ? 0.65721911 0.75496280 0.64947850 -0.13579474 -0.14938703 0.00106961  643  SER   A CB   
9007  O  OG   . SER   A  588 ? 1.23601675 1.31735551 1.21556211 -0.14013088 -0.14636698 -0.00076252 643  SER   A OG   
9008  H  H    . SER   A  588 ? 0.42430884 0.54431146 0.43420899 -0.12291338 -0.15159231 0.00531254  643  SER   A H    
9009  H  HA   . SER   A  588 ? 0.50390100 0.59329432 0.49190605 -0.12681654 -0.13861650 0.00481070  643  SER   A HA   
9010  H  HB2  . SER   A  588 ? 0.71785641 0.82581770 0.72217077 -0.13861413 -0.14810397 0.00121737  643  SER   A HB2  
9011  H  HB3  . SER   A  588 ? 0.72762674 0.82836014 0.71851504 -0.13588822 -0.15582345 0.00012448  643  SER   A HB3  
9013  N  N    . ILE   A  589 ? 0.48768604 0.55412328 0.44554135 -0.12468768 -0.14511991 0.00257558  644  ILE   A N    
9014  C  CA   . ILE   A  589 ? 0.48961005 0.54459095 0.43054771 -0.12317079 -0.14888716 0.00139327  644  ILE   A CA   
9015  C  C    . ILE   A  589 ? 0.46937832 0.52714705 0.40965027 -0.12948097 -0.15712345 -0.00182349 644  ILE   A C    
9016  O  O    . ILE   A  589 ? 0.63509548 0.68822205 0.57439035 -0.13619912 -0.15653375 -0.00464674 644  ILE   A O    
9017  C  CB   . ILE   A  589 ? 0.44289708 0.48081583 0.36938524 -0.12276504 -0.14246029 0.00034976  644  ILE   A CB   
9018  C  CG1  . ILE   A  589 ? 0.41271478 0.44862396 0.33986402 -0.11653987 -0.13509439 0.00354066  644  ILE   A CG1  
9019  C  CG2  . ILE   A  589 ? 0.38392040 0.41078329 0.29302573 -0.12259934 -0.14632654 -0.00176722 644  ILE   A CG2  
9020  C  CD1  . ILE   A  589 ? 0.47965866 0.50236434 0.39805025 -0.11677920 -0.12799516 0.00247433  644  ILE   A CD1  
9021  H  H    . ILE   A  589 ? 0.48497087 0.54762840 0.44341800 -0.12718104 -0.14074740 0.00211164  644  ILE   A H    
9022  H  HA   . ILE   A  589 ? 0.47367716 0.53084540 0.41342479 -0.11838815 -0.15054806 0.00328143  644  ILE   A HA   
9023  H  HB   . ILE   A  589 ? 0.43130064 0.46684539 0.35973933 -0.12709884 -0.14052427 -0.00125200 644  ILE   A HB   
9024  H  HG12 . ILE   A  589 ? 0.43248147 0.46761036 0.35477382 -0.11248880 -0.13661431 0.00495971  644  ILE   A HG12 
9025  H  HG13 . ILE   A  589 ? 0.42340833 0.46790701 0.36193028 -0.11612261 -0.13354956 0.00500077  644  ILE   A HG13 
9026  H  HG21 . ILE   A  589 ? 0.40539587 0.43495256 0.31246236 -0.11909765 -0.14927888 -0.00015234 644  ILE   A HG21 
9027  H  HG22 . ILE   A  589 ? 0.41104889 0.43754315 0.31893075 -0.12716185 -0.15041864 -0.00427148 644  ILE   A HG22 
9028  H  HG23 . ILE   A  589 ? 0.40524417 0.42246747 0.30601332 -0.12147213 -0.14184438 -0.00232524 644  ILE   A HG23 
9029  H  HD11 . ILE   A  589 ? 0.46414536 0.47866258 0.37123841 -0.11643622 -0.12891522 0.00103525  644  ILE   A HD11 
9030  H  HD12 . ILE   A  589 ? 0.45703274 0.47913730 0.37895754 -0.12088473 -0.12695126 0.00108073  644  ILE   A HD12 
9031  H  HD13 . ILE   A  589 ? 0.44986457 0.47277653 0.37029144 -0.11315133 -0.12358589 0.00456231  644  ILE   A HD13 
9032  N  N    . PRO   A  590 ? 0.44275260 0.50799990 0.38369292 -0.12777393 -0.16545385 -0.00152172 645  PRO   A N    
9033  C  CA   . PRO   A  590 ? 0.40314388 0.47176349 0.34391674 -0.13410562 -0.17383316 -0.00474898 645  PRO   A CA   
9034  C  C    . PRO   A  590 ? 0.40486860 0.45654643 0.32850939 -0.13853997 -0.17338155 -0.00837675 645  PRO   A C    
9035  O  O    . PRO   A  590 ? 0.39813218 0.43655172 0.30709863 -0.13479911 -0.16944648 -0.00817893 645  PRO   A O    
9036  C  CB   . PRO   A  590 ? 0.39930302 0.47450027 0.33855104 -0.12944159 -0.18234079 -0.00329409 645  PRO   A CB   
9037  C  CG   . PRO   A  590 ? 0.43544495 0.51484275 0.37992495 -0.12108035 -0.17836702 0.00098827  645  PRO   A CG   
9038  C  CD   . PRO   A  590 ? 0.38713461 0.45699972 0.32836521 -0.11987949 -0.16766368 0.00188380  645  PRO   A CD   
9039  H  HA   . PRO   A  590 ? 0.40423441 0.48210132 0.35717788 -0.13795702 -0.17421393 -0.00530794 645  PRO   A HA   
9040  H  HB2  . PRO   A  590 ? 0.42136604 0.48720127 0.34689295 -0.12919746 -0.18482485 -0.00427213 645  PRO   A HB2  
9041  H  HB3  . PRO   A  590 ? 0.41266817 0.49842399 0.36117423 -0.13211615 -0.18773206 -0.00416243 645  PRO   A HB3  
9042  H  HG2  . PRO   A  590 ? 0.41979975 0.49535573 0.35579172 -0.11716898 -0.18139926 0.00226246  645  PRO   A HG2  
9043  H  HG3  . PRO   A  590 ? 0.40817940 0.50017369 0.36649647 -0.12036874 -0.17978790 0.00184979  645  PRO   A HG3  
9044  H  HD2  . PRO   A  590 ? 0.41059941 0.47050181 0.33985454 -0.11695376 -0.16588837 0.00258373  645  PRO   A HD2  
9045  H  HD3  . PRO   A  590 ? 0.39844340 0.47519732 0.34969479 -0.11718883 -0.16439642 0.00381283  645  PRO   A HD3  
9046  N  N    . GLU   A  591 ? 0.44660240 0.49904066 0.37212560 -0.14654624 -0.17771406 -0.01191069 646  GLU   A N    
9047  C  CA   . GLU   A  591 ? 0.46654516 0.50270438 0.37612176 -0.15101358 -0.17797545 -0.01600567 646  GLU   A CA   
9048  C  C    . GLU   A  591 ? 0.45407051 0.48036805 0.34503603 -0.14684649 -0.18142533 -0.01675740 646  GLU   A C    
9049  O  O    . GLU   A  591 ? 0.46267945 0.47349399 0.33815923 -0.14618002 -0.17748241 -0.01882712 646  GLU   A O    
9050  C  CB   . GLU   A  591 ? 0.48872530 0.52852410 0.40325093 -0.16043113 -0.18430072 -0.01967882 646  GLU   A CB   
9051  C  CG   . GLU   A  591 ? 0.45983320 0.48210251 0.35728621 -0.16523620 -0.18561192 -0.02453727 646  GLU   A CG   
9052  C  CD   . GLU   A  591 ? 0.52775300 0.54209489 0.40757799 -0.16295262 -0.19154696 -0.02664337 646  GLU   A CD   
9053  O  OE1  . GLU   A  591 ? 0.54262245 0.56735170 0.42513138 -0.16121784 -0.19898114 -0.02537516 646  GLU   A OE1  
9054  O  OE2  . GLU   A  591 ? 0.61805540 0.61560631 0.48103732 -0.16289043 -0.18884893 -0.02971574 646  GLU   A OE2  
9055  H  H    . GLU   A  591 ? 0.43675226 0.50010860 0.37383735 -0.14934978 -0.18057154 -0.01191171 646  GLU   A H    
9056  H  HA   . GLU   A  591 ? 0.45946652 0.48815534 0.36674270 -0.15073025 -0.17157198 -0.01598637 646  GLU   A HA   
9057  H  HB2  . GLU   A  591 ? 0.46770298 0.51294541 0.39322996 -0.16339965 -0.18137220 -0.01904222 646  GLU   A HB2  
9058  H  HB3  . GLU   A  591 ? 0.47722217 0.52618581 0.39595461 -0.16065660 -0.19072784 -0.01954831 646  GLU   A HB3  
9059  H  HG2  . GLU   A  591 ? 0.47922778 0.49202925 0.37177789 -0.16391002 -0.17931090 -0.02460622 646  GLU   A HG2  
9060  H  HG3  . GLU   A  591 ? 0.48520023 0.50974828 0.38756359 -0.17167130 -0.18856406 -0.02655755 646  GLU   A HG3  
9061  N  N    . HIS   A  592 ? 0.46256816 0.49808657 0.35512951 -0.14391002 -0.18874781 -0.01503633 647  HIS   A N    
9062  C  CA   . HIS   A  592 ? 0.48066622 0.50757790 0.35510904 -0.14099644 -0.19338319 -0.01560332 647  HIS   A CA   
9063  C  C    . HIS   A  592 ? 0.46481663 0.48365647 0.32961744 -0.13337360 -0.18644316 -0.01236553 647  HIS   A C    
9064  O  O    . HIS   A  592 ? 0.52192163 0.53105986 0.36939096 -0.13111401 -0.18796700 -0.01276477 647  HIS   A O    
9065  C  CB   . HIS   A  592 ? 0.50048661 0.53972709 0.37972590 -0.14066584 -0.20453233 -0.01469291 647  HIS   A CB   
9066  C  CG   . HIS   A  592 ? 0.61159390 0.66033357 0.49813920 -0.13283378 -0.20527136 -0.00953893 647  HIS   A CG   
9067  N  ND1  . HIS   A  592 ? 0.56290627 0.62703288 0.47050434 -0.13106222 -0.20359710 -0.00701009 647  HIS   A ND1  
9068  C  CD2  . HIS   A  592 ? 0.55218816 0.59643972 0.42703670 -0.12660867 -0.20774326 -0.00666095 647  HIS   A CD2  
9069  C  CE1  . HIS   A  592 ? 0.51492631 0.58287299 0.42316839 -0.12345403 -0.20510803 -0.00294517 647  HIS   A CE1  
9070  N  NE2  . HIS   A  592 ? 0.51330042 0.56917763 0.40193534 -0.12072906 -0.20771359 -0.00236086 647  HIS   A NE2  
9071  H  H    . HIS   A  592 ? 0.45959318 0.50704694 0.36468941 -0.14367357 -0.19097053 -0.01346053 647  HIS   A H    
9072  H  HA   . HIS   A  592 ? 0.48977226 0.50745058 0.35426819 -0.14471610 -0.19408211 -0.01904668 647  HIS   A HA   
9073  H  HB2  . HIS   A  592 ? 0.53328574 0.56554782 0.39944252 -0.14152513 -0.20876560 -0.01647293 647  HIS   A HB2  
9074  H  HB3  . HIS   A  592 ? 0.52127826 0.56900269 0.41149914 -0.14513083 -0.20764758 -0.01604002 647  HIS   A HB3  
9076  H  HD2  . HIS   A  592 ? 0.56824517 0.60277331 0.42794546 -0.12638073 -0.20896444 -0.00748453 647  HIS   A HD2  
9077  H  HE1  . HIS   A  592 ? 0.51483661 0.59237993 0.43535662 -0.12043564 -0.20436773 -0.00080716 647  HIS   A HE1  
9079  N  N    . LEU   A  593 ? 0.43926781 0.46208233 0.31489986 -0.12979774 -0.17873950 -0.00922150 648  LEU   A N    
9080  C  CA   . LEU   A  593 ? 0.42633224 0.44210961 0.29429525 -0.12321720 -0.17189896 -0.00618885 648  LEU   A CA   
9081  C  C    . LEU   A  593 ? 0.48007846 0.48692816 0.34660774 -0.12369938 -0.16195932 -0.00730653 648  LEU   A C    
9082  O  O    . LEU   A  593 ? 0.54354537 0.54669940 0.40792125 -0.11877672 -0.15514487 -0.00475185 648  LEU   A O    
9083  C  CB   . LEU   A  593 ? 0.45531362 0.48319471 0.33630562 -0.11759166 -0.17224045 -0.00132214 648  LEU   A CB   
9084  C  CG   . LEU   A  593 ? 0.52023864 0.55508482 0.40052950 -0.11470604 -0.18170717 0.00069730  648  LEU   A CG   
9085  C  CD1  . LEU   A  593 ? 0.52012873 0.56232220 0.40957612 -0.10748252 -0.18013746 0.00565974  648  LEU   A CD1  
9086  C  CD2  . LEU   A  593 ? 0.53195858 0.55436528 0.39005256 -0.11408199 -0.18547434 -0.00005879 648  LEU   A CD2  
9087  H  H    . LEU   A  593 ? 0.43230650 0.46267706 0.32043481 -0.13168697 -0.17781931 -0.00895547 648  LEU   A H    
9088  H  HA   . LEU   A  593 ? 0.45565549 0.46444917 0.31038469 -0.12204546 -0.17388588 -0.00664632 648  LEU   A HA   
9089  H  HB2  . LEU   A  593 ? 0.44822562 0.48424935 0.34251219 -0.11922699 -0.17116739 -0.00125409 648  LEU   A HB2  
9090  H  HB3  . LEU   A  593 ? 0.45270133 0.47596148 0.33022434 -0.11386420 -0.16682363 0.00061978  648  LEU   A HB3  
9091  H  HG   . LEU   A  593 ? 0.51034582 0.55328870 0.39869693 -0.11793587 -0.18691000 -0.00074995 648  LEU   A HG   
9092  H  HD11 . LEU   A  593 ? 0.52085793 0.56935227 0.41307032 -0.10588770 -0.18672612 0.00674088  648  LEU   A HD11 
9093  H  HD12 . LEU   A  593 ? 0.51804280 0.55210000 0.39809811 -0.10438923 -0.17640540 0.00728599  648  LEU   A HD12 
9094  H  HD13 . LEU   A  593 ? 0.50635922 0.55485487 0.40804094 -0.10763284 -0.17635898 0.00601144  648  LEU   A HD13 
9095  H  HD21 . LEU   A  593 ? 0.54027706 0.55993778 0.39360961 -0.11852723 -0.18856695 -0.00336099 648  LEU   A HD21 
9096  H  HD22 . LEU   A  593 ? 0.53275722 0.54650772 0.38232237 -0.11222409 -0.17962530 0.00049608  648  LEU   A HD22 
9097  H  HD23 . LEU   A  593 ? 0.53688610 0.56283695 0.39414757 -0.11115374 -0.19061968 0.00217306  648  LEU   A HD23 
9098  N  N    . THR   A  594 ? 0.41572183 0.41876101 0.28333700 -0.12977603 -0.16151796 -0.01115651 649  THR   A N    
9099  C  CA   . THR   A  594 ? 0.42023122 0.41488200 0.28737152 -0.13043995 -0.15314654 -0.01232070 649  THR   A CA   
9100  C  C    . THR   A  594 ? 0.49410453 0.47632152 0.34599391 -0.12569110 -0.14724268 -0.01251088 649  THR   A C    
9101  O  O    . THR   A  594 ? 0.47195840 0.45347998 0.32709089 -0.12161081 -0.14003101 -0.01001052 649  THR   A O    
9102  C  CB   . THR   A  594 ? 0.43927318 0.42865685 0.30604839 -0.13782345 -0.15488966 -0.01677658 649  THR   A CB   
9103  O  OG1  . THR   A  594 ? 0.49862319 0.50072479 0.38000673 -0.14293940 -0.16036059 -0.01655586 649  THR   A OG1  
9104  C  CG2  . THR   A  594 ? 0.49453449 0.47600293 0.36246544 -0.13821882 -0.14695309 -0.01741540 649  THR   A CG2  
9105  H  H    . THR   A  594 ? 0.43842322 0.44380951 0.30687207 -0.13365701 -0.16685259 -0.01310983 649  THR   A H    
9106  H  HA   . THR   A  594 ? 0.42049974 0.42163691 0.29856318 -0.12907669 -0.14995129 -0.00984803 649  THR   A HA   
9107  H  HB   . THR   A  594 ? 0.46992075 0.45197904 0.32514536 -0.13906969 -0.15777317 -0.01958992 649  THR   A HB   
9109  H  HG21 . THR   A  594 ? 0.47964269 0.45757714 0.34771699 -0.14310472 -0.14841650 -0.01999620 649  THR   A HG21 
9110  H  HG22 . THR   A  594 ? 0.46288371 0.45105785 0.34106958 -0.13671938 -0.14385305 -0.01457067 649  THR   A HG22 
9111  H  HG23 . THR   A  594 ? 0.47686201 0.44982284 0.33503062 -0.13510804 -0.14343342 -0.01813392 649  THR   A HG23 
9112  N  N    . ASN   A  595 ? 0.49521250 0.46806830 0.33044958 -0.12629467 -0.15012406 -0.01557209 650  ASN   A N    
9113  C  CA   . ASN   A  595 ? 0.49843484 0.46042073 0.31922325 -0.12217820 -0.14410658 -0.01612156 650  ASN   A CA   
9114  C  C    . ASN   A  595 ? 0.51089585 0.47333723 0.32164344 -0.11816359 -0.14647020 -0.01339496 650  ASN   A C    
9115  O  O    . ASN   A  595 ? 0.59736013 0.55040711 0.39242363 -0.11648531 -0.14380151 -0.01489427 650  ASN   A O    
9116  C  CB   . ASN   A  595 ? 0.51295960 0.46177250 0.32051012 -0.12533846 -0.14333098 -0.02208819 650  ASN   A CB   
9117  C  CG   . ASN   A  595 ? 0.51737148 0.46266460 0.33307821 -0.12806882 -0.13912848 -0.02414500 650  ASN   A CG   
9118  O  OD1  . ASN   A  595 ? 0.60294479 0.54170847 0.41521281 -0.13295481 -0.14184323 -0.02854028 650  ASN   A OD1  
9119  N  ND2  . ASN   A  595 ? 0.48979032 0.43847251 0.31585521 -0.12513542 -0.13261750 -0.02097759 650  ASN   A ND2  
9120  H  H    . ASN   A  595 ? 0.50599474 0.47948152 0.33877110 -0.12938467 -0.15578087 -0.01744044 650  ASN   A H    
9121  H  HA   . ASN   A  595 ? 0.49111724 0.45347723 0.31727049 -0.11985276 -0.13833773 -0.01445416 650  ASN   A HA   
9122  H  HB2  . ASN   A  595 ? 0.52473807 0.47318053 0.32796350 -0.12841654 -0.14928645 -0.02412714 650  ASN   A HB2  
9123  H  HB3  . ASN   A  595 ? 0.51949942 0.46203914 0.31695527 -0.12253369 -0.13973913 -0.02268285 650  ASN   A HB3  
9124  H  HD21 . ASN   A  595 ? 0.48995912 0.43757069 0.31343666 -0.12132438 -0.12858862 -0.01949263 650  ASN   A HD21 
9125  H  HD22 . ASN   A  595 ? 0.48786968 0.43984991 0.32320660 -0.12716724 -0.13233039 -0.02036542 650  ASN   A HD22 
9126  N  N    . CYS   A  596 ? 0.48846593 0.46178144 0.30819809 -0.11650149 -0.15134908 -0.00930569 651  CYS   A N    
9127  C  CA   . CYS   A  596 ? 0.46662185 0.44002151 0.27771872 -0.11236012 -0.15380834 -0.00582154 651  CYS   A CA   
9128  C  C    . CYS   A  596 ? 0.52414221 0.49403203 0.33286691 -0.10727642 -0.14529262 -0.00251750 651  CYS   A C    
9129  O  O    . CYS   A  596 ? 0.40481076 0.37965992 0.22648430 -0.10532816 -0.14024128 -0.00029681 651  CYS   A O    
9130  C  CB   . CYS   A  596 ? 0.52725857 0.51335597 0.35030496 -0.11146377 -0.16156696 -0.00252731 651  CYS   A CB   
9131  S  SG   . CYS   A  596 ? 0.57070124 0.55759329 0.38719878 -0.10514592 -0.16409962 0.00325728  651  CYS   A SG   
9132  H  H    . CYS   A  596 ? 0.48011905 0.46089798 0.31167153 -0.11793243 -0.15319262 -0.00863990 651  CYS   A H    
9133  H  HA   . CYS   A  596 ? 0.50569046 0.47294867 0.30410570 -0.11361953 -0.15638098 -0.00792033 651  CYS   A HA   
9134  H  HB2  . CYS   A  596 ? 0.52495837 0.51258361 0.34671354 -0.11462754 -0.16763686 -0.00464851 651  CYS   A HB2  
9135  H  HB3  . CYS   A  596 ? 0.50521487 0.49805933 0.34169054 -0.11135170 -0.15959756 -0.00151546 651  CYS   A HB3  
9136  N  N    . VAL   A  597 ? 0.45836985 0.41949540 0.24979192 -0.10564167 -0.14369746 -0.00246912 652  VAL   A N    
9137  C  CA   . VAL   A  597 ? 0.50658727 0.46514684 0.29355991 -0.10119978 -0.13785407 0.00147836  652  VAL   A CA   
9138  C  C    . VAL   A  597 ? 0.48877421 0.44457558 0.26183018 -0.10006584 -0.14371720 0.00396523  652  VAL   A C    
9139  O  O    . VAL   A  597 ? 0.43063679 0.38089731 0.18999252 -0.10266895 -0.14789191 0.00095663  652  VAL   A O    
9140  C  CB   . VAL   A  597 ? 0.55384886 0.50369722 0.33266577 -0.10066959 -0.12823719 -0.00102281 652  VAL   A CB   
9141  C  CG1  . VAL   A  597 ? 0.56113678 0.50917745 0.33572385 -0.09678216 -0.12240252 0.00320852  652  VAL   A CG1  
9142  C  CG2  . VAL   A  597 ? 0.50598472 0.45729375 0.29737794 -0.10175421 -0.12329624 -0.00355286 652  VAL   A CG2  
9143  H  H    . VAL   A  597 ? 0.49681222 0.45317620 0.27833399 -0.10770231 -0.14632446 -0.00514307 652  VAL   A H    
9144  H  HA   . VAL   A  597 ? 0.48372239 0.44819808 0.28192249 -0.09927747 -0.13680251 0.00426940  652  VAL   A HA   
9145  H  HB   . VAL   A  597 ? 0.55223691 0.49616760 0.31937584 -0.10236171 -0.12923324 -0.00402578 652  VAL   A HB   
9146  H  HG11 . VAL   A  597 ? 0.54783922 0.50135952 0.33281505 -0.09498694 -0.12229909 0.00630893  652  VAL   A HG11 
9147  H  HG12 . VAL   A  597 ? 0.56732267 0.51245606 0.33134171 -0.09651262 -0.12495820 0.00447607  652  VAL   A HG12 
9148  H  HG13 . VAL   A  597 ? 0.55642784 0.50064385 0.32836974 -0.09645844 -0.11627282 0.00149840  652  VAL   A HG13 
9149  H  HG21 . VAL   A  597 ? 0.51655394 0.46276373 0.30316943 -0.10091691 -0.11759916 -0.00506225 652  VAL   A HG21 
9150  H  HG22 . VAL   A  597 ? 0.51926827 0.47042644 0.31187329 -0.10471085 -0.12672715 -0.00641032 652  VAL   A HG22 
9151  H  HG23 . VAL   A  597 ? 0.50486577 0.46219772 0.30761975 -0.10036370 -0.12249696 -0.00080857 652  VAL   A HG23 
9152  N  N    . ARG   A  598 ? 0.49034742 0.44918025 0.26618564 -0.09617632 -0.14411318 0.00946472  653  ARG   A N    
9153  C  CA   . ARG   A  598 ? 0.45325089 0.40938067 0.21687114 -0.09468520 -0.15038882 0.01283177  653  ARG   A CA   
9154  C  C    . ARG   A  598 ? 0.50017846 0.44890720 0.25230277 -0.09215615 -0.14408527 0.01637155  653  ARG   A C    
9155  O  O    . ARG   A  598 ? 0.48555744 0.43576413 0.24612638 -0.08994570 -0.13715322 0.01838236  653  ARG   A O    
9156  C  CB   . ARG   A  598 ? 0.47415632 0.44003266 0.25103864 -0.09200206 -0.15783110 0.01670713  653  ARG   A CB   
9157  C  CG   . ARG   A  598 ? 0.49496228 0.46946079 0.28241825 -0.09481310 -0.16549581 0.01373189  653  ARG   A CG   
9158  C  CD   . ARG   A  598 ? 0.57341421 0.55983233 0.37768677 -0.09169497 -0.17130668 0.01703045  653  ARG   A CD   
9159  N  NE   . ARG   A  598 ? 0.53835762 0.52362669 0.33507544 -0.08801805 -0.17847683 0.02138003  653  ARG   A NE   
9160  C  CZ   . ARG   A  598 ? 0.52449691 0.51196289 0.32693920 -0.08273141 -0.17837150 0.02630392  653  ARG   A CZ   
9161  N  NH1  . ARG   A  598 ? 0.49236178 0.48366618 0.30794522 -0.08046947 -0.17129697 0.02747677  653  ARG   A NH1  
9162  N  NH2  . ARG   A  598 ? 0.64961147 0.63459086 0.44367850 -0.07957187 -0.18580942 0.03012958  653  ARG   A NH2  
9163  H  H    . ARG   A  598 ? 0.46555310 0.42774028 0.25085643 -0.09435659 -0.14046091 0.01122770  653  ARG   A H    
9164  H  HA   . ARG   A  598 ? 0.48658830 0.43931758 0.24056417 -0.09705330 -0.15413938 0.01035088  653  ARG   A HA   
9165  H  HB2  . ARG   A  598 ? 0.46055609 0.42998010 0.24765638 -0.08983743 -0.15393321 0.01857337  653  ARG   A HB2  
9166  H  HB3  . ARG   A  598 ? 0.48117766 0.44427699 0.24960193 -0.09036919 -0.16152449 0.01952361  653  ARG   A HB3  
9167  H  HG2  . ARG   A  598 ? 0.51912010 0.49038851 0.29636899 -0.09670015 -0.17044646 0.01226284  653  ARG   A HG2  
9168  H  HG3  . ARG   A  598 ? 0.50060123 0.47617310 0.29398626 -0.09710457 -0.16189516 0.01073512  653  ARG   A HG3  
9169  H  HD2  . ARG   A  598 ? 0.53849101 0.53122807 0.35061294 -0.09409375 -0.17532688 0.01470982  653  ARG   A HD2  
9170  H  HD3  . ARG   A  598 ? 0.52762449 0.51684296 0.34124860 -0.08975114 -0.16626243 0.01841701  653  ARG   A HD3  
9171  H  HE   . ARG   A  598 ? 0.55843484 0.54086590 0.34582400 -0.08933122 -0.18335623 0.02070231  653  ARG   A HE   
9172  H  HH11 . ARG   A  598 ? 0.49285677 0.48021701 0.30641949 -0.08148855 -0.16468503 0.02659800  653  ARG   A HH11 
9173  H  HH12 . ARG   A  598 ? 0.49074990 0.48858738 0.31696671 -0.07783160 -0.17329279 0.02906797  653  ARG   A HH12 
9174  H  HH21 . ARG   A  598 ? 0.60601985 0.59123576 0.40293837 -0.07598645 -0.18570231 0.03338258  653  ARG   A HH21 
9175  H  HH22 . ARG   A  598 ? 0.61926615 0.60198474 0.40463611 -0.08103053 -0.19099376 0.02942779  653  ARG   A HH22 
9176  N  N    . PRO   A  599 ? 0.66556013 0.60622472 0.39799470 -0.09269413 -0.14634831 0.01743749  654  PRO   A N    
9177  C  CA   . PRO   A  599 ? 0.60469329 0.53871226 0.32631823 -0.09085253 -0.14060818 0.02148140  654  PRO   A CA   
9178  C  C    . PRO   A  599 ? 0.48724949 0.42524672 0.21796831 -0.08686920 -0.14397152 0.02770067  654  PRO   A C    
9179  O  O    . PRO   A  599 ? 0.47087556 0.41471404 0.20904291 -0.08550633 -0.15278269 0.02903030  654  PRO   A O    
9180  C  CB   . PRO   A  599 ? 0.60241461 0.52741873 0.30045000 -0.09308722 -0.14383489 0.02083956  654  PRO   A CB   
9181  C  CG   . PRO   A  599 ? 0.71052450 0.63926268 0.40975943 -0.09456629 -0.15496337 0.01876022  654  PRO   A CG   
9182  C  CD   . PRO   A  599 ? 0.57341015 0.51075172 0.29254946 -0.09550135 -0.15433615 0.01485860  654  PRO   A CD   
9183  H  HA   . PRO   A  599 ? 0.57756484 0.51040924 0.30101207 -0.09106278 -0.13309565 0.02005107  654  PRO   A HA   
9184  H  HB2  . PRO   A  599 ? 0.63428199 0.55569911 0.32467633 -0.09181817 -0.14439513 0.02496637  654  PRO   A HB2  
9185  H  HB3  . PRO   A  599 ? 0.63155800 0.55252337 0.32232308 -0.09487503 -0.13854538 0.01752542  654  PRO   A HB3  
9186  H  HG2  . PRO   A  599 ? 0.65725082 0.58797669 0.35784832 -0.09269769 -0.16090533 0.02245055  654  PRO   A HG2  
9187  H  HG3  . PRO   A  599 ? 0.66770267 0.59133554 0.35376534 -0.09686126 -0.15634698 0.01619164  654  PRO   A HG3  
9188  H  HD2  . PRO   A  599 ? 0.61728883 0.56028879 0.34383750 -0.09537469 -0.16121614 0.01531074  654  PRO   A HD2  
9189  H  HD3  . PRO   A  599 ? 0.62358999 0.55826920 0.33889124 -0.09800427 -0.15205932 0.01044826  654  PRO   A HD3  
9190  N  N    . ASP   A  600 ? 0.47138172 0.40604901 0.20103981 -0.08502271 -0.13716048 0.03126953  655  ASP   A N    
9191  C  CA   . ASP   A  600 ? 0.45498973 0.39076185 0.19030829 -0.08113521 -0.13978665 0.03725509  655  ASP   A CA   
9192  C  C    . ASP   A  600 ? 0.48171538 0.40723383 0.19676971 -0.08115878 -0.14150345 0.04175880  655  ASP   A C    
9193  O  O    . ASP   A  600 ? 0.55339348 0.47208428 0.25693989 -0.08299565 -0.13384981 0.04220577  655  ASP   A O    
9194  C  CB   . ASP   A  600 ? 0.45549881 0.39395726 0.20374578 -0.07942631 -0.13114318 0.03826819  655  ASP   A CB   
9195  C  CG   . ASP   A  600 ? 0.46496177 0.40569293 0.22247916 -0.07512014 -0.13410226 0.04339593  655  ASP   A CG   
9196  O  OD1  . ASP   A  600 ? 0.44667554 0.38252735 0.19463752 -0.07336382 -0.14059468 0.04768489  655  ASP   A OD1  
9197  O  OD2  . ASP   A  600 ? 0.38533324 0.33241886 0.15947291 -0.07327654 -0.13036668 0.04307268  655  ASP   A OD2  
9198  H  H    . ASP   A  600 ? 0.47173512 0.40321875 0.19703680 -0.08621257 -0.13065705 0.02981569  655  ASP   A H    
9199  H  HA   . ASP   A  600 ? 0.46022189 0.40139425 0.20372999 -0.07968163 -0.14617191 0.03766051  655  ASP   A HA   
9200  H  HB2  . ASP   A  600 ? 0.44405752 0.38780499 0.20273486 -0.08004594 -0.12919715 0.03508794  655  ASP   A HB2  
9201  H  HB3  . ASP   A  600 ? 0.45783529 0.39114204 0.19790836 -0.08060966 -0.12529343 0.03850336  655  ASP   A HB3  
9202  N  N    . VAL   A  601 ? 0.52258593 0.44727093 0.23345909 -0.07916263 -0.15159145 0.04518393  656  VAL   A N    
9203  C  CA   . VAL   A  601 ? 0.59058446 0.50459218 0.28031537 -0.07954637 -0.15465637 0.04959486  656  VAL   A CA   
9204  C  C    . VAL   A  601 ? 0.67155802 0.57911718 0.35799772 -0.07799115 -0.14910887 0.05509111  656  VAL   A C    
9205  O  O    . VAL   A  601 ? 0.62499416 0.52231932 0.29218346 -0.07958298 -0.14855826 0.05861090  656  VAL   A O    
9206  C  CB   . VAL   A  601 ? 0.60644990 0.52067202 0.29212162 -0.07741126 -0.16776794 0.05215522  656  VAL   A CB   
9207  C  CG1  . VAL   A  601 ? 0.64692366 0.56618559 0.33246094 -0.08013072 -0.17339736 0.04657299  656  VAL   A CG1  
9208  C  CG2  . VAL   A  601 ? 0.53690052 0.45780078 0.24013478 -0.07192110 -0.17337683 0.05560611  656  VAL   A CG2  
9209  H  H    . VAL   A  601 ? 0.51879966 0.44976425 0.24015433 -0.07754426 -0.15673287 0.04480077  656  VAL   A H    
9210  H  HA   . VAL   A  601 ? 0.60085845 0.51082420 0.27909127 -0.08262443 -0.15172735 0.04723125  656  VAL   A HA   
9211  H  HB   . VAL   A  601 ? 0.61583561 0.52175850 0.28588676 -0.07794636 -0.16913892 0.05528342  656  VAL   A HB   
9212  H  HG11 . VAL   A  601 ? 0.62081790 0.54779005 0.32106334 -0.08009413 -0.17189689 0.04353748  656  VAL   A HG11 
9213  H  HG12 . VAL   A  601 ? 0.64318395 0.55732632 0.31631407 -0.08328706 -0.17006911 0.04435847  656  VAL   A HG12 
9214  H  HG13 . VAL   A  601 ? 0.64374328 0.56350243 0.32674032 -0.07882053 -0.18189768 0.04820641  656  VAL   A HG13 
9215  H  HG21 . VAL   A  601 ? 0.56283635 0.48438564 0.26373208 -0.07043952 -0.18183371 0.05690823  656  VAL   A HG21 
9216  H  HG22 . VAL   A  601 ? 0.55474502 0.47098643 0.25613734 -0.07029830 -0.17045657 0.05926181  656  VAL   A HG22 
9217  H  HG23 . VAL   A  601 ? 0.53884530 0.46796784 0.25734565 -0.07150948 -0.17146371 0.05276851  656  VAL   A HG23 
9218  N  N    . ARG   A  602 ? 0.56245953 0.47570193 0.26698568 -0.07533792 -0.14494954 0.05569819  657  ARG   A N    
9219  C  CA   . ARG   A  602 ? 0.54890519 0.45636728 0.25199896 -0.07421897 -0.13933696 0.06033654  657  ARG   A CA   
9220  C  C    . ARG   A  602 ? 0.53832793 0.44211870 0.23476958 -0.07810213 -0.12763360 0.05875203  657  ARG   A C    
9221  O  O    . ARG   A  602 ? 0.52777433 0.42516804 0.21849433 -0.07854029 -0.12296578 0.06279225  657  ARG   A O    
9222  C  CB   . ARG   A  602 ? 0.53243852 0.44725320 0.25684038 -0.06993497 -0.13932116 0.06115558  657  ARG   A CB   
9223  C  CG   . ARG   A  602 ? 0.51393718 0.43315589 0.24665076 -0.06520633 -0.15031154 0.06313519  657  ARG   A CG   
9224  C  CD   . ARG   A  602 ? 0.46934342 0.39908352 0.22558852 -0.06143617 -0.14940441 0.06180072  657  ARG   A CD   
9225  N  NE   . ARG   A  602 ? 0.42281398 0.36241722 0.19150034 -0.06381812 -0.14524722 0.05589894  657  ARG   A NE   
9226  C  CZ   . ARG   A  602 ? 0.40540454 0.35534424 0.19395822 -0.06169504 -0.14422742 0.05380369  657  ARG   A CZ   
9227  N  NH1  . ARG   A  602 ? 0.39121741 0.34388232 0.19043264 -0.05680877 -0.14661667 0.05656092  657  ARG   A NH1  
9228  N  NH2  . ARG   A  602 ? 0.37017846 0.32763323 0.16758412 -0.06450262 -0.14121670 0.04874957  657  ARG   A NH2  
9229  H  H    . ARG   A  602 ? 0.56506312 0.48583418 0.28289855 -0.07437041 -0.14579633 0.05316469  657  ARG   A H    
9230  H  HA   . ARG   A  602 ? 0.56458986 0.46533948 0.25687262 -0.07355516 -0.14346632 0.06434298  657  ARG   A HA   
9231  H  HB2  . ARG   A  602 ? 0.51345617 0.43473735 0.24818300 -0.07069873 -0.13550378 0.05739155  657  ARG   A HB2  
9232  H  HB3  . ARG   A  602 ? 0.52664369 0.43702644 0.24951904 -0.06947757 -0.13550317 0.06401653  657  ARG   A HB3  
9233  H  HG2  . ARG   A  602 ? 0.52520859 0.43764523 0.24976958 -0.06358971 -0.15363771 0.06740950  657  ARG   A HG2  
9234  H  HG3  . ARG   A  602 ? 0.51744044 0.43950611 0.24823041 -0.06612188 -0.15505230 0.06100146  657  ARG   A HG3  
9235  H  HD2  . ARG   A  602 ? 0.46293879 0.38955933 0.22076060 -0.06057479 -0.14484493 0.06375684  657  ARG   A HD2  
9236  H  HD3  . ARG   A  602 ? 0.46810818 0.40083539 0.22944561 -0.05814725 -0.15632600 0.06311115  657  ARG   A HD3  
9237  H  HE   . ARG   A  602 ? 0.43308824 0.37143666 0.19542220 -0.06686682 -0.14336158 0.05361291  657  ARG   A HE   
9238  H  HH11 . ARG   A  602 ? 0.40322018 0.34972841 0.19676022 -0.05511279 -0.14711523 0.05987569  657  ARG   A HH11 
9239  H  HH12 . ARG   A  602 ? 0.38549674 0.34599358 0.19735995 -0.05528915 -0.14760557 0.05499545  657  ARG   A HH12 
9240  H  HH21 . ARG   A  602 ? 0.36599502 0.32800674 0.17390704 -0.06403489 -0.13758850 0.04754451  657  ARG   A HH21 
9241  H  HH22 . ARG   A  602 ? 0.38276157 0.34017283 0.17509978 -0.06687566 -0.14295349 0.04665579  657  ARG   A HH22 
9242  N  N    . VAL   A  603 ? 0.58230770 0.49011087 0.27965844 -0.08091708 -0.12302738 0.05278373  658  VAL   A N    
9243  C  CA   . VAL   A  603 ? 0.56680936 0.47347477 0.26129648 -0.08382558 -0.11194776 0.05026436  658  VAL   A CA   
9244  C  C    . VAL   A  603 ? 0.61510819 0.51728958 0.29187366 -0.08760400 -0.11003238 0.04680770  658  VAL   A C    
9245  O  O    . VAL   A  603 ? 0.54774994 0.45213914 0.22328244 -0.08823812 -0.11482550 0.04273358  658  VAL   A O    
9246  C  CB   . VAL   A  603 ? 0.62631714 0.54221058 0.34072298 -0.08292095 -0.10679823 0.04573116  658  VAL   A CB   
9247  C  CG1  . VAL   A  603 ? 0.57490098 0.49031156 0.28630418 -0.08559549 -0.09605378 0.04220495  658  VAL   A CG1  
9248  C  CG2  . VAL   A  603 ? 0.55220222 0.47220099 0.28296617 -0.07938227 -0.10745639 0.04894342  658  VAL   A CG2  
9249  H  H    . VAL   A  603 ? 0.56665921 0.47811550 0.26680207 -0.08093642 -0.12709454 0.05006645  658  VAL   A H    
9250  H  HA   . VAL   A  603 ? 0.58968073 0.49235016 0.28060278 -0.08394817 -0.10883098 0.05371768  658  VAL   A HA   
9251  H  HB   . VAL   A  603 ? 0.58723754 0.50687766 0.30570850 -0.08287209 -0.11055452 0.04269084  658  VAL   A HB   
9252  H  HG11 . VAL   A  603 ? 0.59445226 0.50539744 0.29786399 -0.08663757 -0.09265878 0.04493049  658  VAL   A HG11 
9253  H  HG12 . VAL   A  603 ? 0.59460360 0.50931644 0.29952687 -0.08722261 -0.09593720 0.03875053  658  VAL   A HG12 
9254  H  HG13 . VAL   A  603 ? 0.57481503 0.49511379 0.29879948 -0.08459830 -0.09282597 0.04063503  658  VAL   A HG13 
9255  H  HG21 . VAL   A  603 ? 0.55592221 0.48130447 0.29808551 -0.07906346 -0.10402703 0.04622740  658  VAL   A HG21 
9256  H  HG22 . VAL   A  603 ? 0.56979519 0.49124324 0.30372721 -0.07735549 -0.11424960 0.05042364  658  VAL   A HG22 
9257  H  HG23 . VAL   A  603 ? 0.57141078 0.48710883 0.29790133 -0.07948215 -0.10455026 0.05215136  658  VAL   A HG23 
9258  N  N    . SER   A  604 ? 0.60750598 0.50345397 0.27050582 -0.09031835 -0.10281890 0.04833790  659  SER   A N    
9259  C  CA   . SER   A  604 ? 0.67310715 0.56490684 0.31872338 -0.09389002 -0.09916104 0.04482901  659  SER   A CA   
9260  C  C    . SER   A  604 ? 0.73202568 0.62973690 0.38533211 -0.09418055 -0.09687109 0.03703618  659  SER   A C    
9261  O  O    . SER   A  604 ? 0.81417489 0.71867204 0.48530754 -0.09255354 -0.09335715 0.03464340  659  SER   A O    
9262  C  CB   . SER   A  604 ? 0.66928208 0.55724519 0.30563515 -0.09666708 -0.08896164 0.04643868  659  SER   A CB   
9263  O  OG   . SER   A  604 ? 0.81491220 0.70369571 0.44392973 -0.09910493 -0.08206393 0.04041684  659  SER   A OG   
9264  H  H    . SER   A  604 ? 0.62051094 0.51484561 0.28498250 -0.09003096 -0.09998242 0.05159137  659  SER   A H    
9265  H  HA   . SER   A  604 ? 0.68830234 0.57561481 0.32238978 -0.09443036 -0.10501612 0.04643893  659  SER   A HA   
9266  H  HB2  . SER   A  604 ? 0.71528900 0.59697306 0.33939955 -0.09782335 -0.09087121 0.05069382  659  SER   A HB2  
9267  H  HB3  . SER   A  604 ? 0.68864697 0.57981026 0.33633673 -0.09564248 -0.08523544 0.04744016  659  SER   A HB3  
9269  N  N    . PRO   A  605 ? 0.75124729 0.64570457 0.39063418 -0.09629072 -0.09910884 0.03295398  660  PRO   A N    
9270  C  CA   . PRO   A  605 ? 0.79620278 0.69375134 0.43907672 -0.09707725 -0.09527362 0.02519308  660  PRO   A CA   
9271  C  C    . PRO   A  605 ? 0.73834908 0.63868958 0.38737202 -0.09715609 -0.08353551 0.02253398  660  PRO   A C    
9272  O  O    . PRO   A  605 ? 0.64847404 0.55412054 0.31200784 -0.09582593 -0.08086131 0.01822503  660  PRO   A O    
9273  C  CB   . PRO   A  605 ? 0.75691164 0.64759183 0.37753609 -0.09986790 -0.09754481 0.02246533  660  PRO   A CB   
9274  C  CG   . PRO   A  605 ? 0.78605211 0.67211092 0.39656526 -0.09982969 -0.10715923 0.02864023  660  PRO   A CG   
9275  C  CD   . PRO   A  605 ? 0.73017919 0.61696041 0.34899849 -0.09794017 -0.10582006 0.03561722  660  PRO   A CD   
9276  H  HA   . PRO   A  605 ? 0.75709927 0.65876639 0.41121536 -0.09585357 -0.09954710 0.02354570  660  PRO   A HA   
9277  H  HB2  . PRO   A  605 ? 0.77970767 0.66774523 0.39104113 -0.10132577 -0.09090760 0.02159563  660  PRO   A HB2  
9278  H  HB3  . PRO   A  605 ? 0.77325118 0.66511512 0.39568472 -0.10011516 -0.09977029 0.01783909  660  PRO   A HB3  
9279  H  HG2  . PRO   A  605 ? 0.78713882 0.66748548 0.38083759 -0.10183582 -0.10692480 0.02892786  660  PRO   A HG2  
9280  H  HG3  . PRO   A  605 ? 0.76957023 0.65780258 0.38511693 -0.09899133 -0.11440855 0.02777612  660  PRO   A HG3  
9281  H  HD2  . PRO   A  605 ? 0.75914538 0.64120013 0.36682597 -0.09946354 -0.10194895 0.03827119  660  PRO   A HD2  
9282  H  HD3  . PRO   A  605 ? 0.74980283 0.63679969 0.37183058 -0.09632307 -0.11314511 0.03880525  660  PRO   A HD3  
9283  N  N    . GLY   A  606 ? 0.66623741 0.56302357 0.30416557 -0.09885398 -0.07687566 0.02540732  661  GLY   A N    
9284  C  CA   . GLY   A  606 ? 0.67117357 0.57116878 0.31345463 -0.09926016 -0.06560400 0.02300929  661  GLY   A CA   
9285  C  C    . GLY   A  606 ? 0.68672675 0.59365928 0.35092297 -0.09677445 -0.06261073 0.02401231  661  GLY   A C    
9286  O  O    . GLY   A  606 ? 0.58803499 0.49928632 0.25991163 -0.09627473 -0.05483545 0.02019383  661  GLY   A O    
9287  H  H    . GLY   A  606 ? 0.69873685 0.59104192 0.32594660 -0.09991199 -0.07956536 0.02904488  661  GLY   A H    
9288  H  HA2  . GLY   A  606 ? 0.67881721 0.57929361 0.31858096 -0.09953557 -0.06293037 0.01772249  661  GLY   A HA2  
9289  H  HA3  . GLY   A  606 ? 0.68529761 0.58222717 0.31743085 -0.10110652 -0.06207796 0.02570242  661  GLY   A HA3  
9290  N  N    . PHE   A  607 ? 0.57294977 0.48093432 0.24684469 -0.09499829 -0.06886443 0.02900412  662  PHE   A N    
9291  C  CA   . PHE   A  607 ? 0.62924570 0.54329562 0.32280833 -0.09269367 -0.06652565 0.03017654  662  PHE   A CA   
9292  C  C    . PHE   A  607 ? 0.55002964 0.46884894 0.25831142 -0.09027622 -0.07297596 0.02801390  662  PHE   A C    
9293  O  O    . PHE   A  607 ? 0.54301625 0.46604359 0.26618227 -0.08812796 -0.07437392 0.03036621  662  PHE   A O    
9294  C  CB   . PHE   A  607 ? 0.61404407 0.52555007 0.30778798 -0.09251997 -0.06743664 0.03747159  662  PHE   A CB   
9295  C  CG   . PHE   A  607 ? 0.58644480 0.49305165 0.26584223 -0.09575822 -0.06091273 0.04022000  662  PHE   A CG   
9296  C  CD1  . PHE   A  607 ? 0.72674394 0.63679028 0.40731683 -0.09732775 -0.05088924 0.03694144  662  PHE   A CD1  
9297  C  CD2  . PHE   A  607 ? 0.81213158 0.71088696 0.47728586 -0.09727889 -0.06484085 0.04624534  662  PHE   A CD2  
9298  C  CE1  . PHE   A  607 ? 0.81046712 0.71714503 0.47847128 -0.10089481 -0.04440355 0.03943858  662  PHE   A CE1  
9299  C  CE2  . PHE   A  607 ? 0.77662212 0.67055404 0.42792818 -0.10103301 -0.05854364 0.04905801  662  PHE   A CE2  
9300  C  CZ   . PHE   A  607 ? 0.76900268 0.66743588 0.42209068 -0.10306614 -0.04809179 0.04556081  662  PHE   A CZ   
9301  H  H    . PHE   A  607 ? 0.61954927 0.52436721 0.28744709 -0.09509493 -0.07477719 0.03168296  662  PHE   A H    
9302  H  HA   . PHE   A  607 ? 0.59329146 0.50990784 0.29036102 -0.09293717 -0.05988991 0.02750392  662  PHE   A HA   
9303  H  HB2  . PHE   A  607 ? 0.61366475 0.52271569 0.30456710 -0.09176981 -0.07424553 0.04004510  662  PHE   A HB2  
9304  H  HB3  . PHE   A  607 ? 0.59440804 0.50990665 0.30105540 -0.09098215 -0.06588259 0.03789750  662  PHE   A HB3  
9305  H  HD1  . PHE   A  607 ? 0.69045365 0.60532099 0.38046709 -0.09602202 -0.04845617 0.03297737  662  PHE   A HD1  
9306  H  HD2  . PHE   A  607 ? 0.74094987 0.63756865 0.40553862 -0.09584182 -0.07192812 0.04845432  662  PHE   A HD2  
9307  H  HE1  . PHE   A  607 ? 0.77493632 0.68498421 0.44456545 -0.10188402 -0.03753731 0.03695063  662  PHE   A HE1  
9308  H  HE2  . PHE   A  607 ? 0.79633629 0.68408227 0.43722239 -0.10222235 -0.06143675 0.05341044  662  PHE   A HE2  
9309  H  HZ   . PHE   A  607 ? 0.79031700 0.68622029 0.43451664 -0.10593409 -0.04354100 0.04745319  662  PHE   A HZ   
9310  N  N    . SER   A  608 ? 0.58932972 0.50734502 0.29279521 -0.09099574 -0.07654614 0.02330367  663  SER   A N    
9311  C  CA   . SER   A  608 ? 0.50862437 0.43096229 0.22454205 -0.08978485 -0.08240972 0.02064593  663  SER   A CA   
9312  C  C    . SER   A  608 ? 0.47829902 0.40205243 0.19826384 -0.09013027 -0.07771523 0.01382631  663  SER   A C    
9313  O  O    . SER   A  608 ? 0.49934733 0.41974264 0.20844853 -0.09128170 -0.07218318 0.01037310  663  SER   A O    
9314  C  CB   . SER   A  608 ? 0.52832073 0.44800109 0.23534520 -0.09068096 -0.09217036 0.02105842  663  SER   A CB   
9315  O  OG   . SER   A  608 ? 0.55216628 0.47091863 0.25789270 -0.08946483 -0.09807754 0.02733531  663  SER   A OG   
9316  H  H    . SER   A  608 ? 0.57529128 0.48980799 0.26690409 -0.09255469 -0.07514669 0.02157553  663  SER   A H    
9317  H  HA   . SER   A  608 ? 0.50558209 0.43168020 0.23333648 -0.08816667 -0.08323640 0.02298287  663  SER   A HA   
9318  H  HB2  . SER   A  608 ? 0.54419303 0.45953575 0.23810026 -0.09235523 -0.09136013 0.01913652  663  SER   A HB2  
9319  H  HB3  . SER   A  608 ? 0.52592671 0.44874120 0.24087243 -0.09049334 -0.09548770 0.01855658  663  SER   A HB3  
9321  N  N    . GLN   A  609 ? 0.50440598 0.43290964 0.23979911 -0.08907489 -0.08003405 0.01190232  664  GLN   A N    
9322  C  CA   . GLN   A  609 ? 0.44609517 0.37459978 0.18528414 -0.08940056 -0.07746669 0.00565740  664  GLN   A CA   
9323  C  C    . GLN   A  609 ? 0.54324317 0.46704811 0.26999694 -0.09161239 -0.08306612 0.00193557  664  GLN   A C    
9324  O  O    . GLN   A  609 ? 0.47448194 0.39628804 0.19178438 -0.09262141 -0.08898786 0.00466322  664  GLN   A O    
9325  C  CB   . GLN   A  609 ? 0.41262722 0.34667426 0.17033283 -0.08834387 -0.07921300 0.00541106  664  GLN   A CB   
9326  C  CG   . GLN   A  609 ? 0.40479261 0.34300190 0.17447263 -0.08620831 -0.07317686 0.00789585  664  GLN   A CG   
9327  C  CD   . GLN   A  609 ? 0.46576190 0.40907311 0.25248167 -0.08543675 -0.07485919 0.00759771  664  GLN   A CD   
9328  O  OE1  . GLN   A  609 ? 0.38128066 0.32384270 0.17114726 -0.08648577 -0.07633533 0.00349032  664  GLN   A OE1  
9329  N  NE2  . GLN   A  609 ? 0.46675408 0.41480756 0.26406962 -0.08383352 -0.07481136 0.01197244  664  GLN   A NE2  
9330  H  H    . GLN   A  609 ? 0.47324783 0.40483302 0.21686541 -0.08813053 -0.08333632 0.01463424  664  GLN   A H    
9331  H  HA   . GLN   A  609 ? 0.46554407 0.39308727 0.20237181 -0.08902196 -0.07119948 0.00395042  664  GLN   A HA   
9332  H  HB2  . GLN   A  609 ? 0.41753858 0.35364139 0.17848660 -0.08856963 -0.08494474 0.00753319  664  GLN   A HB2  
9333  H  HB3  . GLN   A  609 ? 0.42035341 0.35314655 0.17888692 -0.08897752 -0.07894466 0.00134304  664  GLN   A HB3  
9334  H  HG2  . GLN   A  609 ? 0.41946173 0.35629323 0.18648760 -0.08589245 -0.06762196 0.00576153  664  GLN   A HG2  
9335  H  HG3  . GLN   A  609 ? 0.41827643 0.35716537 0.18702170 -0.08569452 -0.07357865 0.01186676  664  GLN   A HG3  
9336  H  HE21 . GLN   A  609 ? 0.46111584 0.40886423 0.25584960 -0.08316946 -0.07340571 0.01469652  664  GLN   A HE21 
9337  H  HE22 . GLN   A  609 ? 0.45353818 0.40484869 0.26026642 -0.08351202 -0.07612809 0.01210982  664  GLN   A HE22 
9338  N  N    . ASN   A  610 ? 0.55806470 0.47952068 0.28441656 -0.09226332 -0.08143256 -0.00428455 665  ASN   A N    
9339  C  CA   . ASN   A  610 ? 0.63200521 0.54867518 0.34761351 -0.09464350 -0.08720829 -0.00847136 665  ASN   A CA   
9340  C  C    . ASN   A  610 ? 0.50693268 0.42359585 0.23244750 -0.09523961 -0.08836358 -0.01332492 665  ASN   A C    
9341  O  O    . ASN   A  610 ? 0.47137457 0.39003241 0.20799637 -0.09349729 -0.08297111 -0.01425128 665  ASN   A O    
9342  C  CB   . ASN   A  610 ? 0.62478924 0.53485799 0.32095966 -0.09545688 -0.08326874 -0.01172004 665  ASN   A CB   
9343  C  CG   . ASN   A  610 ? 0.71920502 0.62746137 0.41570038 -0.09400610 -0.07454139 -0.01705270 665  ASN   A CG   
9344  O  OD1  . ASN   A  610 ? 0.64503545 0.54984200 0.34198606 -0.09432096 -0.07522888 -0.02299775 665  ASN   A OD1  
9345  N  ND2  . ASN   A  610 ? 0.62203580 0.53236949 0.31816387 -0.09241892 -0.06639463 -0.01519590 665  ASN   A ND2  
9346  H  H    . ASN   A  610 ? 0.55678535 0.47925621 0.28938311 -0.09117942 -0.07682240 -0.00601266 665  ASN   A H    
9347  H  HA   . ASN   A  610 ? 0.59027946 0.50808537 0.30494344 -0.09546410 -0.09336855 -0.00581563 665  ASN   A HA   
9348  H  HB2  . ASN   A  610 ? 0.66098690 0.56774181 0.34908298 -0.09716611 -0.08803146 -0.01392180 665  ASN   A HB2  
9349  H  HB3  . ASN   A  610 ? 0.65317178 0.56332219 0.34377807 -0.09528454 -0.08190501 -0.00811463 665  ASN   A HB3  
9350  H  HD21 . ASN   A  610 ? 0.64170223 0.55505431 0.34207556 -0.09204119 -0.06610017 -0.01080206 665  ASN   A HD21 
9351  H  HD22 . ASN   A  610 ? 0.65239012 0.56118453 0.34419861 -0.09179225 -0.06134359 -0.01847404 665  ASN   A HD22 
9352  N  N    . CYS   A  611 ? 0.45463577 0.36887610 0.17597550 -0.09793155 -0.09583788 -0.01607203 666  CYS   A N    
9353  C  CA   . CYS   A  611 ? 0.58924973 0.50293785 0.31963646 -0.09951142 -0.09832602 -0.02010808 666  CYS   A CA   
9354  C  C    . CYS   A  611 ? 0.55833870 0.46394509 0.28036565 -0.09945453 -0.09363522 -0.02715361 666  CYS   A C    
9355  O  O    . CYS   A  611 ? 0.53207070 0.43605363 0.26260301 -0.09959480 -0.09255363 -0.03024717 666  CYS   A O    
9356  C  CB   . CYS   A  611 ? 0.62262833 0.53784698 0.35332352 -0.10289430 -0.10858199 -0.02009194 666  CYS   A CB   
9357  S  SG   . CYS   A  611 ? 0.70328104 0.62955701 0.44884539 -0.10225169 -0.11448449 -0.01267686 666  CYS   A SG   
9358  H  H    . CYS   A  611 ? 0.50501680 0.41766843 0.21727738 -0.09903715 -0.09966718 -0.01534341 666  CYS   A H    
9359  H  HA   . CYS   A  611 ? 0.53636223 0.45425853 0.27914834 -0.09837158 -0.09638978 -0.01815913 666  CYS   A HA   
9360  H  HB2  . CYS   A  611 ? 0.64023232 0.55171412 0.35840645 -0.10391925 -0.11103970 -0.02132040 666  CYS   A HB2  
9361  H  HB3  . CYS   A  611 ? 0.62993419 0.54363739 0.36476302 -0.10455027 -0.10992028 -0.02329172 666  CYS   A HB3  
9362  N  N    . LEU   A  612 ? 0.51948673 0.41976488 0.22455047 -0.09905621 -0.09056929 -0.02963960 667  LEU   A N    
9363  C  CA   . LEU   A  612 ? 0.59166300 0.48441783 0.28798664 -0.09832378 -0.08571006 -0.03678503 667  LEU   A CA   
9364  C  C    . LEU   A  612 ? 0.58381093 0.47821972 0.29130822 -0.09477998 -0.07746115 -0.03772058 667  LEU   A C    
9365  O  O    . LEU   A  612 ? 0.52712756 0.41638511 0.23642570 -0.09403265 -0.07580215 -0.04311443 667  LEU   A O    
9366  C  CB   . LEU   A  612 ? 0.69587445 0.58399481 0.37180161 -0.09847553 -0.08324356 -0.03877422 667  LEU   A CB   
9367  C  CG   . LEU   A  612 ? 0.92233819 0.80245394 0.58702642 -0.09759740 -0.07861921 -0.04693993 667  LEU   A CG   
9368  C  CD1  . LEU   A  612 ? 0.99145305 0.86467028 0.65403616 -0.10025461 -0.08544735 -0.05246821 667  LEU   A CD1  
9369  C  CD2  . LEU   A  612 ? 0.94521552 0.82208312 0.58996284 -0.09786811 -0.07536520 -0.04828890 667  LEU   A CD2  
9370  H  H    . LEU   A  612 ? 0.54861045 0.44981366 0.24718653 -0.09919044 -0.09151003 -0.02688429 667  LEU   A H    
9371  H  HA   . LEU   A  612 ? 0.59921813 0.48854017 0.29538506 -0.10021172 -0.08992290 -0.03995558 667  LEU   A HA   
9372  H  HB2  . LEU   A  612 ? 0.71929079 0.60652006 0.38861519 -0.10069036 -0.08914572 -0.03767443 667  LEU   A HB2  
9373  H  HB3  . LEU   A  612 ? 0.70747900 0.59888977 0.38354331 -0.09700374 -0.07891670 -0.03551965 667  LEU   A HB3  
9374  H  HG   . LEU   A  612 ? 0.87422621 0.75553989 0.54603922 -0.09503964 -0.07292538 -0.04803566 667  LEU   A HG   
9375  H  HD11 . LEU   A  612 ? 0.98086667 0.84836900 0.63609159 -0.09931172 -0.08229795 -0.05789421 667  LEU   A HD11 
9376  H  HD12 . LEU   A  612 ? 0.97881716 0.85125518 0.63471192 -0.10284861 -0.09135555 -0.05158050 667  LEU   A HD12 
9377  H  HD13 . LEU   A  612 ? 0.95498085 0.83016211 0.63006771 -0.10038079 -0.08708516 -0.05151154 667  LEU   A HD13 
9378  H  HD21 . LEU   A  612 ? 0.93816161 0.81913745 0.58439773 -0.09653223 -0.07068506 -0.04487678 667  LEU   A HD21 
9379  H  HD22 . LEU   A  612 ? 0.95142269 0.82686222 0.58853424 -0.10027773 -0.08118200 -0.04699013 667  LEU   A HD22 
9380  H  HD23 . LEU   A  612 ? 0.95273447 0.82474852 0.59056091 -0.09703778 -0.07215236 -0.05390049 667  LEU   A HD23 
9381  N  N    . ALA   A  613 ? 0.47228777 0.37356800 0.18759765 -0.09263735 -0.07294943 -0.03232319 668  ALA   A N    
9382  C  CA   . ALA   A  613 ? 0.47686541 0.38081771 0.20335329 -0.08930882 -0.06569201 -0.03264459 668  ALA   A CA   
9383  C  C    . ALA   A  613 ? 0.50248599 0.40577400 0.24251682 -0.08939414 -0.06823292 -0.03395317 668  ALA   A C    
9384  O  O    . ALA   A  613 ? 0.54800844 0.44834906 0.29189137 -0.08701993 -0.06387196 -0.03775016 668  ALA   A O    
9385  C  CB   . ALA   A  613 ? 0.51697195 0.42860585 0.25093409 -0.08795606 -0.06240676 -0.02601707 668  ALA   A CB   
9386  H  H    . ALA   A  613 ? 0.49583888 0.39991170 0.20919606 -0.09327386 -0.07467134 -0.02840396 668  ALA   A H    
9387  H  HA   . ALA   A  613 ? 0.49516404 0.39603329 0.21506657 -0.08788300 -0.06110873 -0.03652203 668  ALA   A HA   
9388  H  HB1  . ALA   A  613 ? 0.49221647 0.40578461 0.23333752 -0.08582576 -0.05770228 -0.02641907 668  ALA   A HB1  
9389  H  HB2  . ALA   A  613 ? 0.50647324 0.41790360 0.23127651 -0.08825444 -0.06073006 -0.02500673 668  ALA   A HB2  
9390  H  HB3  . ALA   A  613 ? 0.49279168 0.40747684 0.23338585 -0.08897202 -0.06674936 -0.02242497 668  ALA   A HB3  
9391  N  N    . TYR   A  614 ? 0.47733027 0.38354194 0.22456782 -0.09212601 -0.07532985 -0.03066310 669  TYR   A N    
9392  C  CA   . TYR   A  614 ? 0.43629059 0.34272093 0.19665936 -0.09302155 -0.07768737 -0.03095799 669  TYR   A CA   
9393  C  C    . TYR   A  614 ? 0.48305276 0.38017291 0.23739275 -0.09484749 -0.08018996 -0.03752119 669  TYR   A C    
9394  O  O    . TYR   A  614 ? 0.47524810 0.36886489 0.23637009 -0.09387273 -0.07821228 -0.03974634 669  TYR   A O    
9395  C  CB   . TYR   A  614 ? 0.47646767 0.39018130 0.24676055 -0.09544490 -0.08390329 -0.02558672 669  TYR   A CB   
9396  C  CG   . TYR   A  614 ? 0.47721583 0.39894444 0.25609010 -0.09296753 -0.08068077 -0.01954796 669  TYR   A CG   
9397  C  CD1  . TYR   A  614 ? 0.46099594 0.38603237 0.25274277 -0.09089208 -0.07639060 -0.01779700 669  TYR   A CD1  
9398  C  CD2  . TYR   A  614 ? 0.55196357 0.47700891 0.32502136 -0.09267405 -0.08198839 -0.01561392 669  TYR   A CD2  
9399  C  CE1  . TYR   A  614 ? 0.48215592 0.41399324 0.28130105 -0.08877929 -0.07357381 -0.01257381 669  TYR   A CE1  
9400  C  CE2  . TYR   A  614 ? 0.42661312 0.35778320 0.20696980 -0.09050935 -0.07918881 -0.01020204 669  TYR   A CE2  
9401  C  CZ   . TYR   A  614 ? 0.46724212 0.40186775 0.26061630 -0.08860164 -0.07485071 -0.00891408 669  TYR   A CZ   
9402  O  OH   . TYR   A  614 ? 0.47645542 0.41655532 0.27663743 -0.08664229 -0.07222927 -0.00394917 669  TYR   A OH   
9403  H  H    . TYR   A  614 ? 0.47605455 0.38433525 0.22001271 -0.09348368 -0.07873822 -0.02812093 669  TYR   A H    
9404  H  HA   . TYR   A  614 ? 0.44926852 0.35732418 0.21653421 -0.09062929 -0.07313982 -0.03027840 669  TYR   A HA   
9405  H  HB2  . TYR   A  614 ? 0.47492605 0.38821697 0.23854735 -0.09735583 -0.08833384 -0.02559895 669  TYR   A HB2  
9406  H  HB3  . TYR   A  614 ? 0.46319109 0.37662041 0.24079999 -0.09683330 -0.08585475 -0.02623988 669  TYR   A HB3  
9407  H  HD1  . TYR   A  614 ? 0.46807304 0.39032459 0.26334360 -0.09100240 -0.07564525 -0.02013954 669  TYR   A HD1  
9408  H  HD2  . TYR   A  614 ? 0.51235825 0.43496144 0.27605468 -0.09404551 -0.08510267 -0.01659036 669  TYR   A HD2  
9409  H  HE1  . TYR   A  614 ? 0.45983738 0.39377210 0.26728857 -0.08747505 -0.07087096 -0.01154829 669  TYR   A HE1  
9410  H  HE2  . TYR   A  614 ? 0.46395156 0.39636886 0.23983355 -0.09036805 -0.08032163 -0.00747523 669  TYR   A HE2  
9412  N  N    A LYS   A  615 ? 0.53518629 0.42748386 0.27591714 -0.09740301 -0.08457965 -0.04066643 670  LYS   A N    
9413  N  N    B LYS   A  615 ? 0.51526374 0.40780151 0.25626922 -0.09751736 -0.08482355 -0.04048194 670  LYS   A N    
9414  C  CA   A LYS   A  615 ? 0.57600641 0.45830345 0.30929270 -0.09936339 -0.08721176 -0.04739352 670  LYS   A CA   
9415  C  CA   B LYS   A  615 ? 0.54862642 0.43095306 0.28080168 -0.09934731 -0.08720580 -0.04740883 670  LYS   A CA   
9416  C  C    A LYS   A  615 ? 0.56816196 0.44338495 0.29631236 -0.09530199 -0.07995614 -0.05293849 670  LYS   A C    
9417  C  C    B LYS   A  615 ? 0.55648887 0.43210986 0.28521377 -0.09525294 -0.07988279 -0.05266403 670  LYS   A C    
9418  O  O    A LYS   A  615 ? 0.63285816 0.50037694 0.36251357 -0.09538472 -0.08041477 -0.05733173 670  LYS   A O    
9419  O  O    B LYS   A  615 ? 0.64805508 0.51673293 0.37992626 -0.09526535 -0.08023385 -0.05648476 670  LYS   A O    
9420  C  CB   A LYS   A  615 ? 0.71798170 0.59670180 0.43626755 -0.10278986 -0.09334903 -0.04974316 670  LYS   A CB   
9421  C  CB   B LYS   A  615 ? 0.61079627 0.48958915 0.32605946 -0.10189915 -0.09178346 -0.04977389 670  LYS   A CB   
9422  C  CG   A LYS   A  615 ? 0.88995492 0.75769794 0.60007840 -0.10559726 -0.09718236 -0.05693210 670  LYS   A CG   
9423  C  CG   B LYS   A  615 ? 0.69641936 0.56387299 0.40039402 -0.10409043 -0.09472752 -0.05744377 670  LYS   A CG   
9424  C  CD   A LYS   A  615 ? 0.79851925 0.66475624 0.52153915 -0.10861096 -0.10104941 -0.05703379 670  LYS   A CD   
9425  C  CD   B LYS   A  615 ? 0.64767814 0.51233280 0.33547702 -0.10722192 -0.10050710 -0.05925797 670  LYS   A CD   
9426  C  CE   A LYS   A  615 ? 0.76655436 0.64200962 0.49983162 -0.11276804 -0.10810207 -0.05166533 670  LYS   A CE   
9427  C  CE   B LYS   A  615 ? 0.61195588 0.46620399 0.29107124 -0.11073189 -0.10570832 -0.06616200 670  LYS   A CE   
9428  N  NZ   A LYS   A  615 ? 0.64726770 0.52044815 0.39034885 -0.11701936 -0.11222328 -0.05262543 670  LYS   A NZ   
9429  N  NZ   B LYS   A  615 ? 0.65108365 0.50443608 0.31685856 -0.11448600 -0.11307715 -0.06678274 670  LYS   A NZ   
9430  H  H    A LYS   A  615 ? 0.53312647 0.42798585 0.26875722 -0.09798259 -0.08617471 -0.03858081 670  LYS   A H    
9431  H  H    B LYS   A  615 ? 0.51616734 0.41172326 0.25309777 -0.09824399 -0.08680811 -0.03806538 670  LYS   A H    
9432  H  HA   A LYS   A  615 ? 0.58109152 0.46332848 0.32265913 -0.10127410 -0.09016746 -0.04694001 670  LYS   A HA   
9433  H  HA   B LYS   A  615 ? 0.55008531 0.43187335 0.28908584 -0.10174359 -0.09102588 -0.04730752 670  LYS   A HA   
9434  H  HB2  A LYS   A  615 ? 0.70822340 0.59218156 0.43070036 -0.10494178 -0.09810708 -0.04608620 670  LYS   A HB2  
9435  H  HB2  B LYS   A  615 ? 0.61060762 0.49392772 0.32875463 -0.10423595 -0.09691521 -0.04644297 670  LYS   A HB2  
9436  H  HB3  A LYS   A  615 ? 0.71808791 0.59645903 0.42730311 -0.10111011 -0.09027573 -0.05013612 670  LYS   A HB3  
9437  H  HB3  B LYS   A  615 ? 0.61578715 0.49538901 0.32414818 -0.09983047 -0.08785765 -0.04940215 670  LYS   A HB3  
9438  H  HG2  A LYS   A  615 ? 0.84013414 0.70666659 0.54167402 -0.10810289 -0.10178587 -0.05783210 670  LYS   A HG2  
9439  H  HG2  B LYS   A  615 ? 0.66851258 0.53134781 0.36843166 -0.10129341 -0.08954827 -0.06104987 670  LYS   A HG2  
9440  H  HG3  A LYS   A  615 ? 0.83698225 0.69916296 0.54085326 -0.10307942 -0.09259477 -0.06095541 670  LYS   A HG3  
9441  H  HG3  B LYS   A  615 ? 0.66168725 0.52774084 0.37277943 -0.10628729 -0.09809656 -0.05789276 670  LYS   A HG3  
9442  H  HD2  A LYS   A  615 ? 0.82244718 0.68059421 0.53910106 -0.11038008 -0.10319808 -0.06183982 670  LYS   A HD2  
9443  H  HD2  B LYS   A  615 ? 0.64203191 0.51270312 0.33390874 -0.10905636 -0.10494505 -0.05495906 670  LYS   A HD2  
9444  H  HD3  A LYS   A  615 ? 0.80174124 0.66875708 0.53268749 -0.10608437 -0.09667918 -0.05602599 670  LYS   A HD3  
9445  H  HD3  B LYS   A  615 ? 0.65288365 0.51668811 0.33132759 -0.10514964 -0.09652403 -0.06003271 670  LYS   A HD3  
9446  H  HE2  A LYS   A  615 ? 0.72755015 0.61040646 0.46855521 -0.11081047 -0.10580872 -0.04704694 670  LYS   A HE2  
9447  H  HE2  B LYS   A  615 ? 0.63652772 0.48412287 0.30900314 -0.10859146 -0.10146870 -0.07085048 670  LYS   A HE2  
9448  H  HE3  A LYS   A  615 ? 0.74788797 0.62376815 0.47363245 -0.11469732 -0.11238066 -0.05204288 670  LYS   A HE3  
9449  H  HE3  B LYS   A  615 ? 0.62337548 0.47769922 0.31199309 -0.11278256 -0.10865358 -0.06576465 670  LYS   A HE3  
9450  H  HZ1  A LYS   A  615 ? 0.67255008 0.54493105 0.42213389 -0.11526396 -0.10847551 -0.05207407 670  LYS   A HZ1  
9451  H  HZ1  B LYS   A  615 ? 0.64917177 0.50190592 0.30523902 -0.11280496 -0.11029755 -0.06710295 670  LYS   A HZ1  
9452  H  HZ2  A LYS   A  615 ? 0.69133258 0.55723155 0.42718437 -0.11911097 -0.11466283 -0.05690397 670  LYS   A HZ2  
9453  H  HZ2  B LYS   A  615 ? 0.63624060 0.49601120 0.30855411 -0.11616644 -0.11722335 -0.06254155 670  LYS   A HZ2  
9454  H  HZ3  A LYS   A  615 ? 0.67385995 0.55362016 0.42361581 -0.11942299 -0.11612335 -0.04950833 670  LYS   A HZ3  
9455  H  HZ3  B LYS   A  615 ? 0.65368736 0.50061345 0.31419504 -0.11683716 -0.11638805 -0.07111788 670  LYS   A HZ3  
9456  N  N    . ASN   A  616 ? 0.55478764 0.43271625 0.27725893 -0.09173329 -0.07325339 -0.05269743 671  ASN   A N    
9457  C  CA   . ASN   A  616 ? 0.55521923 0.42848599 0.27394912 -0.08734402 -0.06591102 -0.05803991 671  ASN   A CA   
9458  C  C    . ASN   A  616 ? 0.61368454 0.48969942 0.34773099 -0.08384293 -0.06162363 -0.05651895 671  ASN   A C    
9459  O  O    . ASN   A  616 ? 0.61241627 0.48316365 0.34599137 -0.08019608 -0.05737080 -0.06151776 671  ASN   A O    
9460  C  CB   . ASN   A  616 ? 0.66449469 0.54067874 0.37210467 -0.08532701 -0.05995167 -0.05844888 671  ASN   A CB   
9461  C  CG   . ASN   A  616 ? 0.83544207 0.70563185 0.52433378 -0.08818807 -0.06349828 -0.06211288 671  ASN   A CG   
9462  O  OD1  . ASN   A  616 ? 0.70933259 0.57201385 0.39272994 -0.09109773 -0.06982336 -0.06588811 671  ASN   A OD1  
9463  N  ND2  . ASN   A  616 ? 0.86785090 0.74094099 0.54610217 -0.08782796 -0.05970764 -0.06099548 671  ASN   A ND2  
9464  H  H    . ASN   A  616 ? 0.55548835 0.43828785 0.27627802 -0.09208734 -0.07330040 -0.04922931 671  ASN   A H    
9465  H  HA   . ASN   A  616 ? 0.60009170 0.46570003 0.31241411 -0.08801861 -0.06773055 -0.06301390 671  ASN   A HA   
9466  H  HB2  . ASN   A  616 ? 0.65452909 0.53748798 0.36655623 -0.08551311 -0.05920225 -0.05330388 671  ASN   A HB2  
9467  H  HB3  . ASN   A  616 ? 0.66446924 0.53967583 0.37237245 -0.08201736 -0.05444453 -0.06147761 671  ASN   A HB3  
9468  H  HD21 . ASN   A  616 ? 0.84868360 0.72700381 0.53101087 -0.08616220 -0.05530842 -0.05827564 671  ASN   A HD21 
9469  H  HD22 . ASN   A  616 ? 0.86931783 0.73898631 0.53595740 -0.08944733 -0.06155589 -0.06290638 671  ASN   A HD22 
9470  N  N    . ASP   A  617 ? 0.57453513 0.45850182 0.32186079 -0.08474621 -0.06304859 -0.04982445 672  ASP   A N    
9471  C  CA   . ASP   A  617 ? 0.65105540 0.53778303 0.41242400 -0.08177020 -0.05953014 -0.04791947 672  ASP   A CA   
9472  C  C    . ASP   A  617 ? 0.59419274 0.47570360 0.36246496 -0.08448189 -0.06497429 -0.04830360 672  ASP   A C    
9473  O  O    . ASP   A  617 ? 0.64275360 0.52808255 0.41661280 -0.08847450 -0.07032205 -0.04425716 672  ASP   A O    
9474  C  CB   . ASP   A  617 ? 0.64598513 0.54372603 0.41719308 -0.08115572 -0.05745213 -0.04078343 672  ASP   A CB   
9475  C  CG   . ASP   A  617 ? 0.68279898 0.58400512 0.46579611 -0.07720397 -0.05216675 -0.03946371 672  ASP   A CG   
9476  O  OD1  . ASP   A  617 ? 0.63298261 0.52988565 0.42304838 -0.07665055 -0.05343462 -0.04068688 672  ASP   A OD1  
9477  O  OD2  . ASP   A  617 ? 0.65806723 0.56597990 0.44299525 -0.07493031 -0.04702945 -0.03708434 672  ASP   A OD2  
9478  H  H    . ASP   A  617 ? 0.59296560 0.48071575 0.34040266 -0.08707958 -0.06627882 -0.04642922 672  ASP   A H    
9479  H  HA   . ASP   A  617 ? 0.62615240 0.51044393 0.38558248 -0.07848071 -0.05505589 -0.05129919 672  ASP   A HA   
9480  H  HB2  . ASP   A  617 ? 0.65690839 0.55729473 0.42195618 -0.08085927 -0.05545675 -0.04007139 672  ASP   A HB2  
9481  H  HB3  . ASP   A  617 ? 0.64835829 0.54854012 0.42415467 -0.08378597 -0.06176887 -0.03754317 672  ASP   A HB3  
9482  N  N    . LYS   A  618 ? 0.60664880 0.47946018 0.37462443 -0.08220862 -0.06342398 -0.05320103 673  LYS   A N    
9483  C  CA   . LYS   A  618 ? 0.79038537 0.65571189 0.56223440 -0.08530849 -0.06851842 -0.05424979 673  LYS   A CA   
9484  C  C    . LYS   A  618 ? 0.64227873 0.51313651 0.42942104 -0.08570320 -0.06866433 -0.04847025 673  LYS   A C    
9485  O  O    . LYS   A  618 ? 0.74188447 0.61074853 0.53386533 -0.09014820 -0.07361506 -0.04686286 673  LYS   A O    
9486  C  CB   . LYS   A  618 ? 0.76868880 0.62106740 0.53339058 -0.08260826 -0.06721731 -0.06159427 673  LYS   A CB   
9487  C  CG   . LYS   A  618 ? 0.85923088 0.70538080 0.60739595 -0.08285395 -0.06759950 -0.06792073 673  LYS   A CG   
9488  C  CD   . LYS   A  618 ? 0.97822094 0.82406771 0.72005272 -0.08948019 -0.07490938 -0.06718916 673  LYS   A CD   
9489  C  CE   . LYS   A  618 ? 1.06107044 0.90003395 0.78580910 -0.08990145 -0.07565497 -0.07346794 673  LYS   A CE   
9490  N  NZ   . LYS   A  618 ? 1.07368243 0.91907579 0.79186451 -0.08617534 -0.06947778 -0.07340895 673  LYS   A NZ   
9491  H  H    . LYS   A  618 ? 0.64309263 0.51450217 0.40841562 -0.07867752 -0.05911548 -0.05592124 673  LYS   A H    
9492  H  HA   . LYS   A  618 ? 0.72215927 0.58701551 0.49052405 -0.08931017 -0.07314917 -0.05403561 673  LYS   A HA   
9493  H  HB2  . LYS   A  618 ? 0.78855789 0.64183605 0.55667818 -0.07823750 -0.06268530 -0.06207714 673  LYS   A HB2  
9494  H  HB3  . LYS   A  618 ? 0.79457587 0.64127111 0.56182873 -0.08496855 -0.07067363 -0.06195275 673  LYS   A HB3  
9495  H  HG2  . LYS   A  618 ? 0.86400384 0.71507519 0.60924655 -0.08019968 -0.06338827 -0.06790884 673  LYS   A HG2  
9496  H  HG3  . LYS   A  618 ? 0.87495285 0.71218777 0.61907625 -0.08118182 -0.06718946 -0.07275378 673  LYS   A HG3  
9497  H  HD2  . LYS   A  618 ? 0.96515274 0.80690432 0.71062416 -0.09253458 -0.07897162 -0.06705575 673  LYS   A HD2  
9498  H  HD3  . LYS   A  618 ? 0.95317709 0.80771220 0.69882560 -0.09066777 -0.07540945 -0.06251135 673  LYS   A HD3  
9499  H  HE2  . LYS   A  618 ? 1.05860901 0.88854384 0.77925813 -0.08850303 -0.07514626 -0.07844147 673  LYS   A HE2  
9500  H  HE3  . LYS   A  618 ? 1.05277288 0.89160138 0.77410656 -0.09422050 -0.08087983 -0.07286971 673  LYS   A HE3  
9501  H  HZ1  . LYS   A  618 ? 1.06536436 0.90933406 0.78420299 -0.08220237 -0.06474818 -0.07573453 673  LYS   A HZ1  
9502  H  HZ2  . LYS   A  618 ? 1.04819179 0.90166807 0.77195233 -0.08660118 -0.06903747 -0.06846172 673  LYS   A HZ2  
9503  H  HZ3  . LYS   A  618 ? 1.07761753 0.92026472 0.78527087 -0.08750333 -0.07082836 -0.07603535 673  LYS   A HZ3  
9504  N  N    . GLN   A  619 ? 0.61084890 0.48948240 0.40536943 -0.08166379 -0.06338514 -0.04513251 674  GLN   A N    
9505  C  CA   . GLN   A  619 ? 0.56568241 0.44977826 0.37379712 -0.08189470 -0.06331088 -0.03970212 674  GLN   A CA   
9506  C  C    . GLN   A  619 ? 0.48728168 0.38249126 0.30187482 -0.08477137 -0.06531129 -0.03342047 674  GLN   A C    
9507  O  O    . GLN   A  619 ? 0.54941010 0.44811112 0.37407410 -0.08671702 -0.06705180 -0.02945127 674  GLN   A O    
9508  C  CB   . GLN   A  619 ? 0.53229189 0.41872567 0.34593713 -0.07598855 -0.05705813 -0.03949193 674  GLN   A CB   
9509  C  CG   . GLN   A  619 ? 0.69603997 0.57252312 0.51057452 -0.07302335 -0.05629092 -0.04326114 674  GLN   A CG   
9510  C  CD   . GLN   A  619 ? 1.06874096 0.94967651 0.89399552 -0.06881180 -0.05252687 -0.04028374 674  GLN   A CD   
9511  O  OE1  . GLN   A  619 ? 0.98846972 0.87994117 0.82023793 -0.06800991 -0.04994736 -0.03586916 674  GLN   A OE1  
9512  N  NE2  . GLN   A  619 ? 1.22458231 1.09696031 1.05161631 -0.06602864 -0.05252825 -0.04260851 674  GLN   A NE2  
9513  H  H    . GLN   A  619 ? 0.60932291 0.48992819 0.40020370 -0.07888454 -0.05971965 -0.04632888 674  GLN   A H    
9514  H  HA   . GLN   A  619 ? 0.55822325 0.43685102 0.36821029 -0.08392090 -0.06609708 -0.04035353 674  GLN   A HA   
9515  H  HB2  . GLN   A  619 ? 0.57225245 0.46101177 0.38125250 -0.07377625 -0.05392028 -0.04099492 674  GLN   A HB2  
9516  H  HB3  . GLN   A  619 ? 0.56106782 0.45391673 0.38253367 -0.07617763 -0.05653315 -0.03515609 674  GLN   A HB3  
9517  H  HG2  . GLN   A  619 ? 0.71576583 0.58678329 0.53045529 -0.07613742 -0.06011529 -0.04334129 674  GLN   A HG2  
9518  H  HG3  . GLN   A  619 ? 0.72350419 0.59547132 0.53110391 -0.07069112 -0.05461975 -0.04779973 674  GLN   A HG3  
9519  H  HE21 . GLN   A  619 ? 1.17982864 1.04394615 1.00183237 -0.06647927 -0.05435775 -0.04591023 674  GLN   A HE21 
9520  H  HE22 . GLN   A  619 ? 1.16637099 1.04092002 0.99938929 -0.06366999 -0.05088076 -0.04086498 674  GLN   A HE22 
9521  N  N    . MET   A  620 ? 0.50542903 0.40578622 0.31392211 -0.08498842 -0.06514016 -0.03252427 675  MET   A N    
9522  C  CA   . MET   A  620 ? 0.45671797 0.36729062 0.27118009 -0.08628123 -0.06635118 -0.02657949 675  MET   A CA   
9523  C  C    . MET   A  620 ? 0.44500333 0.35720223 0.25701183 -0.09105299 -0.07323514 -0.02551908 675  MET   A C    
9524  O  O    . MET   A  620 ? 0.45027515 0.35775983 0.25111657 -0.09260038 -0.07581624 -0.02898507 675  MET   A O    
9525  C  CB   . MET   A  620 ? 0.43149275 0.34668756 0.24108581 -0.08318619 -0.06154785 -0.02547579 675  MET   A CB   
9526  C  CG   . MET   A  620 ? 0.41047117 0.33528924 0.22695845 -0.08325944 -0.06149637 -0.01909817 675  MET   A CG   
9527  S  SD   . MET   A  620 ? 0.44115877 0.37152624 0.27398854 -0.08171987 -0.05929750 -0.01488710 675  MET   A SD   
9528  C  CE   . MET   A  620 ? 0.43906015 0.36676744 0.27067742 -0.07694674 -0.05202800 -0.01815685 675  MET   A CE   
9529  H  H    . MET   A  620 ? 0.50244296 0.39946723 0.30244315 -0.08422733 -0.06428111 -0.03571949 675  MET   A H    
9530  H  HA   . MET   A  620 ? 0.44608122 0.35973942 0.26955926 -0.08595552 -0.06569405 -0.02386401 675  MET   A HA   
9531  H  HB2  . MET   A  620 ? 0.43429393 0.34828335 0.24470307 -0.08027492 -0.05730058 -0.02705768 675  MET   A HB2  
9532  H  HB3  . MET   A  620 ? 0.44440860 0.35701719 0.24467689 -0.08398449 -0.06254766 -0.02765611 675  MET   A HB3  
9533  H  HG2  . MET   A  620 ? 0.42203784 0.34850430 0.23415370 -0.08173686 -0.05847496 -0.01869073 675  MET   A HG2  
9534  H  HG3  . MET   A  620 ? 0.42212796 0.34846547 0.23788498 -0.08573312 -0.06582892 -0.01765225 675  MET   A HG3  
9535  H  HE1  . MET   A  620 ? 0.44580537 0.36775440 0.27490073 -0.07664376 -0.05235260 -0.02167537 675  MET   A HE1  
9536  H  HE2  . MET   A  620 ? 0.44316503 0.37204382 0.26915559 -0.07603230 -0.04971951 -0.01865975 675  MET   A HE2  
9537  H  HE3  . MET   A  620 ? 0.43088418 0.36184397 0.27003160 -0.07558230 -0.05016411 -0.01596664 675  MET   A HE3  
9538  N  N    . SER   A  621 ? 0.38721171 0.30662942 0.20976365 -0.09322222 -0.07621463 -0.02088348 676  SER   A N    
9539  C  CA   . SER   A  621 ? 0.38685137 0.31121409 0.20931844 -0.09677722 -0.08243138 -0.01891620 676  SER   A CA   
9540  C  C    . SER   A  621 ? 0.35161039 0.28517577 0.17834242 -0.09473231 -0.08151683 -0.01362844 676  SER   A C    
9541  O  O    . SER   A  621 ? 0.42656100 0.36118284 0.25267753 -0.09114089 -0.07613354 -0.01230466 676  SER   A O    
9542  C  CB   . SER   A  621 ? 0.41991055 0.34586200 0.25152516 -0.10123320 -0.08708171 -0.01827385 676  SER   A CB   
9543  O  OG   . SER   A  621 ? 0.39275742 0.32415387 0.22498614 -0.10476489 -0.09360322 -0.01708520 676  SER   A OG   
9544  H  H    . SER   A  621 ? 0.38926405 0.31086877 0.21948832 -0.09231278 -0.07434003 -0.01897463 676  SER   A H    
9545  H  HA   . SER   A  621 ? 0.39885563 0.31937873 0.21196224 -0.09768107 -0.08435771 -0.02157935 676  SER   A HA   
9546  H  HB2  . SER   A  621 ? 0.41090947 0.32990187 0.23957741 -0.10254940 -0.08742127 -0.02152434 676  SER   A HB2  
9547  H  HB3  . SER   A  621 ? 0.39417613 0.32420519 0.23455957 -0.10043358 -0.08513634 -0.01552080 676  SER   A HB3  
9549  N  N    . TYR   A  622 ? 0.39401922 0.33428478 0.22543824 -0.09699553 -0.08692666 -0.01069793 677  TYR   A N    
9550  C  CA   . TYR   A  622 ? 0.35074708 0.29882574 0.18616334 -0.09483119 -0.08686415 -0.00573549 677  TYR   A CA   
9551  C  C    . TYR   A  622 ? 0.35129914 0.30789617 0.20003532 -0.09657051 -0.09062140 -0.00268194 677  TYR   A C    
9552  O  O    . TYR   A  622 ? 0.33116233 0.28799197 0.18386543 -0.10032215 -0.09429944 -0.00445377 677  TYR   A O    
9553  C  CB   . TYR   A  622 ? 0.34848368 0.29573292 0.17219858 -0.09452519 -0.08976053 -0.00527948 677  TYR   A CB   
9554  C  CG   . TYR   A  622 ? 0.38253212 0.33058625 0.20314957 -0.09805207 -0.09774514 -0.00648269 677  TYR   A CG   
9555  C  CD1  . TYR   A  622 ? 0.39321941 0.34995914 0.22292002 -0.09888083 -0.10317997 -0.00309062 677  TYR   A CD1  
9556  C  CD2  . TYR   A  622 ? 0.44408327 0.38463330 0.25355396 -0.10056622 -0.10009594 -0.01136909 677  TYR   A CD2  
9557  C  CE1  . TYR   A  622 ? 0.41997758 0.37868613 0.24821573 -0.10230549 -0.11103660 -0.00440728 677  TYR   A CE1  
9558  C  CE2  . TYR   A  622 ? 0.45663667 0.39812088 0.26360640 -0.10428692 -0.10797696 -0.01272216 677  TYR   A CE2  
9559  C  CZ   . TYR   A  622 ? 0.45421588 0.40518633 0.27082556 -0.10521414 -0.11355760 -0.00914254 677  TYR   A CZ   
9560  O  OH   . TYR   A  622 ? 0.42942128 0.38225335 0.24392791 -0.10893656 -0.12185192 -0.01065144 677  TYR   A OH   
9561  H  H    . TYR   A  622 ? 0.37785435 0.31774330 0.21003117 -0.09989703 -0.09088331 -0.01191933 677  TYR   A H    
9562  H  HA   . TYR   A  622 ? 0.35062474 0.29899311 0.18800043 -0.09229261 -0.08218961 -0.00455237 677  TYR   A HA   
9563  H  HB2  . TYR   A  622 ? 0.35143912 0.30271637 0.17761569 -0.09270369 -0.08907118 -0.00185741 677  TYR   A HB2  
9564  H  HB3  . TYR   A  622 ? 0.36346015 0.30544448 0.17855023 -0.09368145 -0.08691239 -0.00754393 677  TYR   A HB3  
9565  H  HD1  . TYR   A  622 ? 0.38434780 0.34598112 0.22158183 -0.09704766 -0.10164177 -0.00004617 677  TYR   A HD1  
9566  H  HD2  . TYR   A  622 ? 0.43631378 0.37111175 0.23984912 -0.09972136 -0.09642340 -0.01402189 677  TYR   A HD2  
9567  H  HE1  . TYR   A  622 ? 0.41593689 0.38129532 0.25092900 -0.10250150 -0.11467532 -0.00220350 677  TYR   A HE1  
9568  H  HE2  . TYR   A  622 ? 0.46589762 0.40172917 0.26454884 -0.10604624 -0.10958952 -0.01623684 677  TYR   A HE2  
9570  N  N    . GLY   A  623 ? 0.30899674 0.27240622 0.16476873 -0.09385248 -0.08911420 0.00172020  678  GLY   A N    
9571  C  CA   . GLY   A  623 ? 0.32970762 0.30244619 0.19754219 -0.09453233 -0.09248893 0.00472778  678  GLY   A CA   
9572  C  C    . GLY   A  623 ? 0.31581315 0.29306385 0.18287481 -0.09145225 -0.09411875 0.00851385  678  GLY   A C    
9573  O  O    . GLY   A  623 ? 0.34633774 0.31894243 0.20235868 -0.08990222 -0.09353661 0.00876410  678  GLY   A O    
9574  H  H    . GLY   A  623 ? 0.32093501 0.28308851 0.17380883 -0.09144700 -0.08571641 0.00271320  678  GLY   A H    
9575  H  HA2  . GLY   A  623 ? 0.32360101 0.29766440 0.19255978 -0.09740089 -0.09669735 0.00338042  678  GLY   A HA2  
9576  H  HA3  . GLY   A  623 ? 0.31178650 0.28650969 0.18712062 -0.09414257 -0.08957964 0.00560014  678  GLY   A HA3  
9577  N  N    . PHE   A  624 ? 0.31916279 0.30515361 0.19784483 -0.09059270 -0.09597287 0.01139965  679  PHE   A N    
9578  C  CA   . PHE   A  624 ? 0.36395326 0.35438341 0.24325277 -0.08760776 -0.09897439 0.01488564  679  PHE   A CA   
9579  C  C    . PHE   A  624 ? 0.33772534 0.33342370 0.22776432 -0.08460222 -0.09525388 0.01788966  679  PHE   A C    
9580  O  O    . PHE   A  624 ? 0.30736554 0.30777210 0.20793685 -0.08581372 -0.09354533 0.01745136  679  PHE   A O    
9581  C  CB   . PHE   A  624 ? 0.37484354 0.37196296 0.25819516 -0.08936027 -0.10690075 0.01472542  679  PHE   A CB   
9582  C  CG   . PHE   A  624 ? 0.36545259 0.35716325 0.23667735 -0.09205594 -0.11160357 0.01204378  679  PHE   A CG   
9583  C  CD1  . PHE   A  624 ? 0.38232565 0.36767119 0.23961797 -0.09031498 -0.11253010 0.01292452  679  PHE   A CD1  
9584  C  CD2  . PHE   A  624 ? 0.39612722 0.38867503 0.26920262 -0.09666738 -0.11505596 0.00864489  679  PHE   A CD2  
9585  C  CE1  . PHE   A  624 ? 0.42401993 0.40414590 0.26912189 -0.09281906 -0.11677710 0.01028159  679  PHE   A CE1  
9586  C  CE2  . PHE   A  624 ? 0.43364799 0.42088810 0.29489607 -0.09925207 -0.11988065 0.00585613  679  PHE   A CE2  
9587  C  CZ   . PHE   A  624 ? 0.42518193 0.40618804 0.27232015 -0.09715697 -0.12050429 0.00656581  679  PHE   A CZ   
9588  H  H    . PHE   A  624 ? 0.31978562 0.30893594 0.20627064 -0.09184190 -0.09532104 0.01114035  679  PHE   A H    
9589  H  HA   . PHE   A  624 ? 0.35773456 0.34330437 0.22771825 -0.08640465 -0.09838495 0.01532059  679  PHE   A HA   
9590  H  HB2  . PHE   A  624 ? 0.36292535 0.36473143 0.25500926 -0.09124578 -0.10714843 0.01391034  679  PHE   A HB2  
9591  H  HB3  . PHE   A  624 ? 0.36599183 0.36674917 0.25170210 -0.08682309 -0.10886388 0.01721548  679  PHE   A HB3  
9592  H  HD1  . PHE   A  624 ? 0.38514957 0.36941355 0.24081939 -0.08760042 -0.11012430 0.01533489  679  PHE   A HD1  
9593  H  HD2  . PHE   A  624 ? 0.38857347 0.38535273 0.27078182 -0.09829280 -0.11442182 0.00824543  679  PHE   A HD2  
9594  H  HE1  . PHE   A  624 ? 0.42377383 0.39948690 0.25878540 -0.09177922 -0.11716903 0.01100233  679  PHE   A HE1  
9595  H  HE2  . PHE   A  624 ? 0.42664018 0.41399938 0.28902450 -0.10265689 -0.12235238 0.00339699  679  PHE   A HE2  
9596  H  HZ   . PHE   A  624 ? 0.43957978 0.41675389 0.27802420 -0.09891830 -0.12361539 0.00456467  679  PHE   A HZ   
9597  N  N    . LEU   A  625 ? 0.33608502 0.33037561 0.22264513 -0.08098331 -0.09407596 0.02091633  680  LEU   A N    
9598  C  CA   . LEU   A  625 ? 0.30007762 0.29804295 0.19541502 -0.07800163 -0.09048233 0.02350127  680  LEU   A CA   
9599  C  C    . LEU   A  625 ? 0.35452372 0.36192054 0.26104495 -0.07653614 -0.09493748 0.02504826  680  LEU   A C    
9600  O  O    . LEU   A  625 ? 0.32319498 0.33658916 0.24097919 -0.07634170 -0.09261840 0.02511175  680  LEU   A O    
9601  C  CB   . LEU   A  625 ? 0.26330543 0.25566190 0.15098476 -0.07511571 -0.08744820 0.02606294  680  LEU   A CB   
9602  C  CG   . LEU   A  625 ? 0.26519459 0.25036451 0.14444289 -0.07605772 -0.08179374 0.02458739  680  LEU   A CG   
9603  C  CD1  . LEU   A  625 ? 0.31443617 0.29511714 0.18655851 -0.07396580 -0.07917067 0.02737403  680  LEU   A CD1  
9604  C  CD2  . LEU   A  625 ? 0.29707798 0.28377783 0.18467420 -0.07663587 -0.07669244 0.02303266  680  LEU   A CD2  
9605  H  H    . LEU   A  625 ? 0.33713299 0.32773757 0.21531889 -0.08052521 -0.09557109 0.02136882  680  LEU   A H    
9606  H  HA   . LEU   A  625 ? 0.30015686 0.29828063 0.19957456 -0.07896360 -0.08696007 0.02240000  680  LEU   A HA   
9607  H  HB2  . LEU   A  625 ? 0.27810562 0.26913530 0.16030744 -0.07442534 -0.09097961 0.02723117  680  LEU   A HB2  
9608  H  HB3  . LEU   A  625 ? 0.26521936 0.26023343 0.15908113 -0.07316477 -0.08590378 0.02771322  680  LEU   A HB3  
9609  H  HG   . LEU   A  625 ? 0.28659481 0.26886690 0.15933833 -0.07783709 -0.08318165 0.02264432  680  LEU   A HG   
9610  H  HD11 . LEU   A  625 ? 0.30162871 0.27825749 0.16752595 -0.07483596 -0.07596745 0.02615253  680  LEU   A HD11 
9611  H  HD12 . LEU   A  625 ? 0.29191190 0.27452755 0.16999386 -0.07243203 -0.07710256 0.02883575  680  LEU   A HD12 
9612  H  HD13 . LEU   A  625 ? 0.30479008 0.28458247 0.17242023 -0.07337272 -0.08279695 0.02890649  680  LEU   A HD13 
9613  H  HD21 . LEU   A  625 ? 0.28405231 0.27153921 0.17350562 -0.07863624 -0.07793000 0.02098263  680  LEU   A HD21 
9614  H  HD22 . LEU   A  625 ? 0.27649224 0.26704675 0.17141539 -0.07527861 -0.07616816 0.02458880  680  LEU   A HD22 
9615  H  HD23 . LEU   A  625 ? 0.28378922 0.26666051 0.16721378 -0.07637973 -0.07286932 0.02253485  680  LEU   A HD23 
9616  N  N    . PHE   A  626 ? 0.32613513 0.33507338 0.22955610 -0.07529751 -0.10127301 0.02624780  681  PHE   A N    
9617  C  CA   . PHE   A  626 ? 0.31366169 0.33290541 0.22870362 -0.07406627 -0.10621861 0.02686163  681  PHE   A CA   
9618  C  C    . PHE   A  626 ? 0.30390000 0.32811099 0.22342873 -0.07882323 -0.10919214 0.02372573  681  PHE   A C    
9619  O  O    . PHE   A  626 ? 0.28916192 0.30883726 0.19949213 -0.08149301 -0.11246274 0.02203167  681  PHE   A O    
9620  C  CB   . PHE   A  626 ? 0.32427466 0.34426621 0.23603639 -0.07059642 -0.11271184 0.02929078  681  PHE   A CB   
9621  C  CG   . PHE   A  626 ? 0.33874765 0.37120080 0.26455534 -0.06937841 -0.11777633 0.02909685  681  PHE   A CG   
9622  C  CD1  . PHE   A  626 ? 0.29831684 0.33773261 0.23626760 -0.06590173 -0.11560163 0.03021290  681  PHE   A CD1  
9623  C  CD2  . PHE   A  626 ? 0.35256541 0.39034915 0.27974677 -0.07183602 -0.12460698 0.02745181  681  PHE   A CD2  
9624  C  CE1  . PHE   A  626 ? 0.29679698 0.34894973 0.24851951 -0.06468768 -0.11965835 0.02959692  681  PHE   A CE1  
9625  C  CE2  . PHE   A  626 ? 0.29491737 0.34571010 0.23637836 -0.07093724 -0.12893833 0.02700054  681  PHE   A CE2  
9626  C  CZ   . PHE   A  626 ? 0.31066751 0.36897874 0.26464802 -0.06722316 -0.12622638 0.02804437  681  PHE   A CZ   
9627  H  H    . PHE   A  626 ? 0.33885473 0.34264946 0.23299798 -0.07514855 -0.10250910 0.02665944  681  PHE   A H    
9628  H  HA   . PHE   A  626 ? 0.30693308 0.32988670 0.22988221 -0.07259031 -0.10335527 0.02754082  681  PHE   A HA   
9629  H  HB2  . PHE   A  626 ? 0.32685339 0.34336036 0.23613822 -0.06772738 -0.11084273 0.03142611  681  PHE   A HB2  
9630  H  HB3  . PHE   A  626 ? 0.33586475 0.35167348 0.23874959 -0.07203095 -0.11552446 0.02879519  681  PHE   A HB3  
9631  H  HD1  . PHE   A  626 ? 0.30128849 0.33706191 0.23829728 -0.06438981 -0.11119477 0.03120303  681  PHE   A HD1  
9632  H  HD2  . PHE   A  626 ? 0.34266099 0.37550431 0.26120254 -0.07428526 -0.12620120 0.02641615  681  PHE   A HD2  
9633  H  HE1  . PHE   A  626 ? 0.29404664 0.35092548 0.25376084 -0.06211982 -0.11782918 0.03010767  681  PHE   A HE1  
9634  H  HE2  . PHE   A  626 ? 0.31657124 0.37139156 0.25924578 -0.07284554 -0.13380197 0.02581937  681  PHE   A HE2  
9635  H  HZ   . PHE   A  626 ? 0.30077088 0.36863768 0.26480997 -0.06639147 -0.12900145 0.02755755  681  PHE   A HZ   
9636  N  N    . PRO   A  627 ? 0.31230271 0.34564084 0.24550717 -0.08034782 -0.10807107 0.02282385  682  PRO   A N    
9637  C  CA   . PRO   A  627 ? 0.31295332 0.35083702 0.25084704 -0.08572601 -0.11058004 0.02001287  682  PRO   A CA   
9638  C  C    . PRO   A  627 ? 0.31656492 0.36185002 0.25738525 -0.08661675 -0.11897556 0.01942555  682  PRO   A C    
9639  O  O    . PRO   A  627 ? 0.29813588 0.35292900 0.24849385 -0.08336766 -0.12190490 0.02091810  682  PRO   A O    
9640  C  CB   . PRO   A  627 ? 0.28382957 0.32996097 0.23559791 -0.08656114 -0.10642025 0.02007971  682  PRO   A CB   
9641  C  CG   . PRO   A  627 ? 0.31068778 0.36056891 0.26766318 -0.08064293 -0.10465173 0.02277361  682  PRO   A CG   
9642  C  CD   . PRO   A  627 ? 0.34046745 0.37945351 0.28441447 -0.07745524 -0.10377145 0.02435957  682  PRO   A CD   
9643  H  HA   . PRO   A  627 ? 0.31289023 0.34385946 0.24367444 -0.08825990 -0.10898656 0.01846450  682  PRO   A HA   
9644  H  HB2  . PRO   A  627 ? 0.29485914 0.34832907 0.25378516 -0.08903033 -0.10918108 0.01907791  682  PRO   A HB2  
9645  H  HB3  . PRO   A  627 ? 0.29245293 0.33382612 0.24213523 -0.08835551 -0.10223650 0.01938913  682  PRO   A HB3  
9646  H  HG2  . PRO   A  627 ? 0.30842248 0.36564130 0.27144283 -0.07908609 -0.10849220 0.02318402  682  PRO   A HG2  
9647  H  HG3  . PRO   A  627 ? 0.30118844 0.35277379 0.26333433 -0.08061882 -0.10031090 0.02296174  682  PRO   A HG3  
9648  H  HD2  . PRO   A  627 ? 0.32462978 0.36527777 0.26969081 -0.07376818 -0.10542171 0.02610901  682  PRO   A HD2  
9649  H  HD3  . PRO   A  627 ? 0.32151341 0.35551786 0.26277307 -0.07744252 -0.09892844 0.02449239  682  PRO   A HD3  
9650  N  N    . PRO   A  628 ? 0.34506083 0.38677239 0.27857944 -0.09095211 -0.12323751 0.01696327  683  PRO   A N    
9651  C  CA   . PRO   A  628 ? 0.33763516 0.38722423 0.27467287 -0.09234025 -0.13177294 0.01615311  683  PRO   A CA   
9652  C  C    . PRO   A  628 ? 0.30369067 0.36807358 0.25862128 -0.09455096 -0.13310727 0.01544626  683  PRO   A C    
9653  O  O    . PRO   A  628 ? 0.32584131 0.40014702 0.28762603 -0.09419979 -0.13994940 0.01533272  683  PRO   A O    
9654  C  CB   . PRO   A  628 ? 0.37565255 0.41680411 0.30069104 -0.09733298 -0.13442400 0.01309384  683  PRO   A CB   
9655  C  CG   . PRO   A  628 ? 0.41314173 0.44068116 0.32561120 -0.09653024 -0.12753344 0.01288638  683  PRO   A CG   
9656  C  CD   . PRO   A  628 ? 0.38348520 0.41326690 0.30463955 -0.09433196 -0.12043190 0.01460807  683  PRO   A CD   
9657  H  HA   . PRO   A  628 ? 0.34248814 0.39231077 0.27684259 -0.08859286 -0.13479146 0.01795093  683  PRO   A HA   
9658  H  HB2  . PRO   A  628 ? 0.37570077 0.42019367 0.30610090 -0.10156799 -0.13497415 0.01114635  683  PRO   A HB2  
9659  H  HB3  . PRO   A  628 ? 0.38424990 0.42512679 0.30407909 -0.09669635 -0.13978817 0.01317651  683  PRO   A HB3  
9660  H  HG2  . PRO   A  628 ? 0.40476978 0.42732644 0.31255329 -0.10010538 -0.12705246 0.01040013  683  PRO   A HG2  
9661  H  HG3  . PRO   A  628 ? 0.40539846 0.42806926 0.30907419 -0.09390032 -0.12839428 0.01405552  683  PRO   A HG3  
9662  H  HD2  . PRO   A  628 ? 0.37596011 0.40618548 0.30126905 -0.09743856 -0.11803979 0.01317192  683  PRO   A HD2  
9663  H  HD3  . PRO   A  628 ? 0.37799755 0.40127653 0.29259467 -0.09194023 -0.11676510 0.01558562  683  PRO   A HD3  
9664  N  N    . TYR   A  629 ? 0.32735983 0.39345169 0.28971058 -0.09663831 -0.12648483 0.01510123  684  TYR   A N    
9665  C  CA   . TYR   A  629 ? 0.35496289 0.43469512 0.33367425 -0.09964897 -0.12619022 0.01439902  684  TYR   A CA   
9666  C  C    . TYR   A  629 ? 0.33799428 0.43007222 0.32903531 -0.09398614 -0.12696972 0.01634597  684  TYR   A C    
9667  O  O    . TYR   A  629 ? 0.34084392 0.44711095 0.34609574 -0.09573176 -0.12889206 0.01552394  684  TYR   A O    
9668  C  CB   . TYR   A  629 ? 0.34555238 0.42275685 0.32749975 -0.10293616 -0.11844026 0.01407870  684  TYR   A CB   
9669  C  CG   . TYR   A  629 ? 0.31893757 0.38242871 0.28891852 -0.10735193 -0.11637855 0.01225788  684  TYR   A CG   
9670  C  CD1  . TYR   A  629 ? 0.37046772 0.43313792 0.33937734 -0.11414141 -0.12006278 0.00956528  684  TYR   A CD1  
9671  C  CD2  . TYR   A  629 ? 0.29370484 0.34503314 0.25349483 -0.10458492 -0.11104812 0.01298840  684  TYR   A CD2  
9672  C  CE1  . TYR   A  629 ? 0.40056628 0.44966197 0.35817367 -0.11766982 -0.11827759 0.00754407  684  TYR   A CE1  
9673  C  CE2  . TYR   A  629 ? 0.36346060 0.40250093 0.31271553 -0.10777059 -0.10920496 0.01098863  684  TYR   A CE2  
9674  C  CZ   . TYR   A  629 ? 0.39702937 0.43443495 0.34487382 -0.11405496 -0.11281094 0.00820931  684  TYR   A CZ   
9675  O  OH   . TYR   A  629 ? 0.48072103 0.50487679 0.41751546 -0.11633870 -0.11096904 0.00598456  684  TYR   A OH   
9676  H  H    . TYR   A  629 ? 0.32402033 0.38250780 0.28079969 -0.09631557 -0.12190474 0.01532198  684  TYR   A H    
9677  H  HA   . TYR   A  629 ? 0.35100877 0.43441036 0.33149153 -0.10346067 -0.13060719 0.01275612  684  TYR   A HA   
9678  H  HB2  . TYR   A  629 ? 0.33181098 0.40778306 0.31426528 -0.09912610 -0.11445969 0.01568346  684  TYR   A HB2  
9679  H  HB3  . TYR   A  629 ? 0.33506727 0.42129660 0.32701623 -0.10583574 -0.11867105 0.01349263  684  TYR   A HB3  
9680  H  HD1  . TYR   A  629 ? 0.36570054 0.43724054 0.34202886 -0.11642745 -0.12380064 0.00896941  684  TYR   A HD1  
9681  H  HD2  . TYR   A  629 ? 0.30940425 0.36092252 0.26962841 -0.10033291 -0.10868133 0.01476162  684  TYR   A HD2  
9682  H  HE1  . TYR   A  629 ? 0.39971745 0.44755045 0.35623702 -0.12233680 -0.12097307 0.00558315  684  TYR   A HE1  
9683  H  HE2  . TYR   A  629 ? 0.35103026 0.38274688 0.29413426 -0.10560162 -0.10557489 0.01138397  684  TYR   A HE2  
9685  N  N    . LEU   A  630 ? 0.24663609 0.33317214 0.23209411 -0.08733016 -0.12553500 0.01874085  685  LEU   A N    
9686  C  CA   . LEU   A  630 ? 0.26880074 0.36459851 0.26474220 -0.08120555 -0.12545778 0.02047606  685  LEU   A CA   
9687  C  C    . LEU   A  630 ? 0.25624472 0.35226995 0.24865204 -0.07569905 -0.13271308 0.02203944  685  LEU   A C    
9688  O  O    . LEU   A  630 ? 0.31535885 0.41478837 0.31270513 -0.06942429 -0.13278207 0.02380349  685  LEU   A O    
9689  C  CB   . LEU   A  630 ? 0.29721630 0.38611421 0.29057467 -0.07799551 -0.11751461 0.02209877  685  LEU   A CB   
9690  C  CG   . LEU   A  630 ? 0.32912582 0.41836590 0.32673547 -0.08289028 -0.11043269 0.02092424  685  LEU   A CG   
9691  C  CD1  . LEU   A  630 ? 0.31295401 0.39509076 0.30729479 -0.07970729 -0.10313227 0.02246600  685  LEU   A CD1  
9692  C  CD2  . LEU   A  630 ? 0.37616810 0.48092148 0.38988060 -0.08494475 -0.11033287 0.01981341  685  LEU   A CD2  
9693  H  H    . LEU   A  630 ? 0.27414489 0.35073817 0.24898767 -0.08663116 -0.12445159 0.01921591  685  LEU   A H    
9694  H  HA   . LEU   A  630 ? 0.26265931 0.36922097 0.26997572 -0.08283883 -0.12576589 0.01948181  685  LEU   A HA   
9695  H  HB2  . LEU   A  630 ? 0.29943633 0.37814605 0.28189325 -0.07690348 -0.11696627 0.02296986  685  LEU   A HB2  
9696  H  HB3  . LEU   A  630 ? 0.29319322 0.38717502 0.29258633 -0.07364239 -0.11754587 0.02311454  685  LEU   A HB3  
9697  H  HG   . LEU   A  630 ? 0.33138049 0.41506422 0.32299700 -0.08706728 -0.11064928 0.01981292  685  LEU   A HG   
9698  H  HD11 . LEU   A  630 ? 0.31344548 0.39288697 0.30705038 -0.08313127 -0.09940301 0.02180243  685  LEU   A HD11 
9699  H  HD12 . LEU   A  630 ? 0.31167173 0.40028244 0.31356946 -0.07663144 -0.10205457 0.02305007  685  LEU   A HD12 
9700  H  HD13 . LEU   A  630 ? 0.31852812 0.39233664 0.30386257 -0.07739357 -0.10339648 0.02346705  685  LEU   A HD13 
9701  H  HD21 . LEU   A  630 ? 0.35997403 0.46888781 0.37588477 -0.08852138 -0.11419077 0.01852887  685  LEU   A HD21 
9702  H  HD22 . LEU   A  630 ? 0.35505256 0.46624282 0.37496030 -0.08053683 -0.11137122 0.02049812  685  LEU   A HD22 
9703  H  HD23 . LEU   A  630 ? 0.35290217 0.45734483 0.36879069 -0.08720133 -0.10537288 0.01962369  685  LEU   A HD23 
9704  N  N    . SER   A  631 ? 0.28869712 0.38135320 0.27284592 -0.07809412 -0.13926567 0.02126938  686  SER   A N    
9705  C  CA   . SER   A  631 ? 0.32072231 0.41438919 0.30154458 -0.07353029 -0.14750478 0.02275822  686  SER   A CA   
9706  C  C    . SER   A  631 ? 0.35264724 0.46312556 0.35064232 -0.06982306 -0.15238158 0.02269064  686  SER   A C    
9707  O  O    . SER   A  631 ? 0.31428909 0.43784207 0.32661563 -0.07338082 -0.15150593 0.02051268  686  SER   A O    
9708  C  CB   . SER   A  631 ? 0.33459532 0.42342016 0.30461234 -0.07794676 -0.15393595 0.02128486  686  SER   A CB   
9709  O  OG   . SER   A  631 ? 0.39277434 0.49159104 0.37254333 -0.08427741 -0.15603721 0.01819042  686  SER   A OG   
9710  H  H    . SER   A  631 ? 0.29012817 0.37929368 0.27007121 -0.08272613 -0.13880141 0.01973752  686  SER   A H    
9711  H  HA   . SER   A  631 ? 0.32344997 0.40925577 0.29684615 -0.06967244 -0.14601819 0.02483514  686  SER   A HA   
9712  H  HB2  . SER   A  631 ? 0.35329694 0.44262758 0.32061860 -0.07482658 -0.15973790 0.02248188  686  SER   A HB2  
9713  H  HB3  . SER   A  631 ? 0.34942597 0.42732039 0.30787024 -0.07959212 -0.15094735 0.02124123  686  SER   A HB3  
9715  N  N    . SER   A  632 ? 0.33233762 0.44222450 0.32875934 -0.06258985 -0.15732636 0.02511813  687  SER   A N    
9716  C  CA   . SER   A  632 ? 0.32619846 0.45130417 0.33879995 -0.05734531 -0.16185878 0.02509303  687  SER   A CA   
9717  C  C    . SER   A  632 ? 0.36156532 0.49746883 0.37979820 -0.05925587 -0.17174307 0.02353380  687  SER   A C    
9718  O  O    . SER   A  632 ? 0.38551486 0.53768587 0.42051947 -0.05658640 -0.17511113 0.02247299  687  SER   A O    
9719  C  CB   . SER   A  632 ? 0.36221004 0.48150030 0.37099701 -0.04836542 -0.16370137 0.02829976  687  SER   A CB   
9720  O  OG   . SER   A  632 ? 0.30207500 0.40806687 0.29332247 -0.04736749 -0.16913693 0.03062962  687  SER   A OG   
9721  H  H    . SER   A  632 ? 0.34241319 0.44198436 0.32722288 -0.06085936 -0.15794110 0.02680744  687  SER   A H    
9722  H  HA   . SER   A  632 ? 0.32898653 0.46207500 0.35249877 -0.05828162 -0.15729551 0.02384372  687  SER   A HA   
9723  H  HB2  . SER   A  632 ? 0.33432639 0.46399590 0.35412514 -0.04451410 -0.16732241 0.02800459  687  SER   A HB2  
9724  H  HB3  . SER   A  632 ? 0.33025143 0.44460255 0.33777145 -0.04705546 -0.15747263 0.02903022  687  SER   A HB3  
9726  N  N    . SER   A  633 ? 0.36016101 0.48739970 0.36456040 -0.06375785 -0.17629002 0.02316779  688  SER   A N    
9727  C  CA   . SER   A  633 ? 0.36643177 0.50220323 0.37382677 -0.06636549 -0.18616943 0.02153514  688  SER   A CA   
9728  C  C    . SER   A  633 ? 0.36744326 0.49065155 0.35756862 -0.07319471 -0.18750815 0.02030982  688  SER   A C    
9729  O  O    . SER   A  633 ? 0.34094638 0.44822532 0.31538811 -0.07374114 -0.18215232 0.02144780  688  SER   A O    
9730  C  CB   . SER   A  633 ? 0.40940982 0.54698771 0.41580850 -0.05868325 -0.19556278 0.02393657  688  SER   A CB   
9731  O  OG   . SER   A  633 ? 0.39358485 0.51282620 0.37851351 -0.05662813 -0.19722892 0.02683654  688  SER   A OG   
9732  H  H    . SER   A  633 ? 0.36426353 0.47974581 0.35663208 -0.06524138 -0.17310663 0.02384334  688  SER   A H    
9733  H  HA   . SER   A  633 ? 0.36668831 0.51513731 0.38776797 -0.06892802 -0.18601570 0.01950106  688  SER   A HA   
9734  H  HB2  . SER   A  633 ? 0.40007508 0.54635769 0.41188252 -0.06023664 -0.20218253 0.02256310  688  SER   A HB2  
9735  H  HB3  . SER   A  633 ? 0.39086562 0.53401119 0.40641576 -0.05348868 -0.19413699 0.02482931  688  SER   A HB3  
9737  N  N    . PRO   A  634 ? 0.39747691 0.52767855 0.39015493 -0.07868235 -0.19449858 0.01764357  689  PRO   A N    
9738  C  CA   . PRO   A  634 ? 0.39132643 0.50942802 0.36694625 -0.08481492 -0.19677134 0.01598706  689  PRO   A CA   
9739  C  C    . PRO   A  634 ? 0.39705575 0.49846470 0.35113248 -0.08107576 -0.19899707 0.01864911  689  PRO   A C    
9740  O  O    . PRO   A  634 ? 0.48140433 0.56852806 0.41953105 -0.08448718 -0.19480130 0.01795192  689  PRO   A O    
9741  C  CB   . PRO   A  634 ? 0.46591324 0.59713942 0.45019591 -0.08894409 -0.20668900 0.01332758  689  PRO   A CB   
9742  C  CG   . PRO   A  634 ? 0.42091340 0.57179856 0.42929506 -0.08829401 -0.20535204 0.01249733  689  PRO   A CG   
9743  C  CD   . PRO   A  634 ? 0.49923980 0.64994526 0.51189947 -0.07955287 -0.20037676 0.01571028  689  PRO   A CD   
9744  H  HA   . PRO   A  634 ? 0.39986193 0.51373702 0.37391025 -0.08912615 -0.19071804 0.01454879  689  PRO   A HA   
9745  H  HB2  . PRO   A  634 ? 0.45077407 0.58146900 0.43021530 -0.08576980 -0.21368079 0.01450429  689  PRO   A HB2  
9746  H  HB3  . PRO   A  634 ? 0.44512969 0.57254523 0.42431411 -0.09508643 -0.20657720 0.01098847  689  PRO   A HB3  
9747  H  HG2  . PRO   A  634 ? 0.44959712 0.61108351 0.46575141 -0.08817922 -0.21251276 0.01168786  689  PRO   A HG2  
9748  H  HG3  . PRO   A  634 ? 0.44026738 0.59316218 0.45343196 -0.09356608 -0.20049834 0.01067192  689  PRO   A HG3  
9749  H  HD2  . PRO   A  634 ? 0.45384935 0.60911202 0.46937799 -0.07431158 -0.20612739 0.01705959  689  PRO   A HD2  
9750  H  HD3  . PRO   A  634 ? 0.43997800 0.59867632 0.46463138 -0.08009849 -0.19530751 0.01501831  689  PRO   A HD3  
9751  N  N    . GLU   A  635 ? 0.40343833 0.50664353 0.35693532 -0.07405956 -0.20563856 0.02167912  690  GLU   A N    
9752  C  CA   . GLU   A  635 ? 0.45441699 0.54186916 0.38758093 -0.07032876 -0.20766315 0.02494070  690  GLU   A CA   
9753  C  C    . GLU   A  635 ? 0.48642457 0.56069899 0.41054535 -0.06864154 -0.19701277 0.02699251  690  GLU   A C    
9754  O  O    . GLU   A  635 ? 0.41785756 0.47758496 0.32371837 -0.07103180 -0.19391841 0.02725035  690  GLU   A O    
9755  C  CB   . GLU   A  635 ? 0.52939433 0.62224573 0.46656543 -0.06241365 -0.21663623 0.02819860  690  GLU   A CB   
9756  C  CG   . GLU   A  635 ? 0.77592528 0.88240671 0.72198617 -0.06361072 -0.22814675 0.02625617  690  GLU   A CG   
9757  C  CD   . GLU   A  635 ? 0.84174776 0.97007227 0.81407762 -0.06202105 -0.23034614 0.02440028  690  GLU   A CD   
9758  O  OE1  . GLU   A  635 ? 0.59632468 0.73226702 0.58221668 -0.06452262 -0.22209850 0.02246706  690  GLU   A OE1  
9759  O  OE2  . GLU   A  635 ? 0.97981131 1.11822951 0.95904720 -0.05846276 -0.24083300 0.02476265  690  GLU   A OE2  
9760  H  H    . GLU   A  635 ? 0.41187418 0.52641356 0.37803668 -0.07150247 -0.20893720 0.02176478  690  GLU   A H    
9761  H  HA   . GLU   A  635 ? 0.47325304 0.55506873 0.39553404 -0.07410953 -0.21067563 0.02365658  690  GLU   A HA   
9762  H  HB2  . GLU   A  635 ? 0.54450947 0.64283550 0.49252701 -0.05847018 -0.21360119 0.02916230  690  GLU   A HB2  
9763  H  HB3  . GLU   A  635 ? 0.56194389 0.64352965 0.48479363 -0.06020217 -0.21793726 0.03070279  690  GLU   A HB3  
9764  H  HG2  . GLU   A  635 ? 0.73030806 0.83286256 0.66868579 -0.05989625 -0.23461579 0.02852292  690  GLU   A HG2  
9765  H  HG3  . GLU   A  635 ? 0.71898174 0.82349622 0.65964878 -0.06953041 -0.22887775 0.02381386  690  GLU   A HG3  
9766  N  N    . ALA   A  636 ? 0.39003044 0.47011161 0.32746598 -0.06462060 -0.19122243 0.02815940  691  ALA   A N    
9767  C  CA   . ALA   A  636 ? 0.42027092 0.48964053 0.35154453 -0.06293835 -0.18138598 0.02999133  691  ALA   A CA   
9768  C  C    . ALA   A  636 ? 0.37355492 0.43542618 0.29794124 -0.06948851 -0.17330778 0.02742776  691  ALA   A C    
9769  O  O    . ALA   A  636 ? 0.33677667 0.38585785 0.24850667 -0.06920492 -0.16719416 0.02879513  691  ALA   A O    
9770  C  CB   . ALA   A  636 ? 0.45584852 0.53458035 0.40435421 -0.05826632 -0.17689128 0.03075875  691  ALA   A CB   
9771  H  H    . ALA   A  636 ? 0.41116107 0.50252891 0.36204851 -0.06289154 -0.19352221 0.02766387  691  ALA   A H    
9772  H  HA   . ALA   A  636 ? 0.42082739 0.48105875 0.34055370 -0.06020658 -0.18284701 0.03253647  691  ALA   A HA   
9773  H  HB1  . ALA   A  636 ? 0.43589747 0.50728291 0.37990054 -0.05731717 -0.17074576 0.03193327  691  ALA   A HB1  
9774  H  HB2  . ALA   A  636 ? 0.44322163 0.52585697 0.39572984 -0.05345277 -0.18180235 0.03234372  691  ALA   A HB2  
9775  H  HB3  . ALA   A  636 ? 0.43257558 0.52062243 0.39236212 -0.06107939 -0.17530161 0.02840937  691  ALA   A HB3  
9776  N  N    . LYS   A  637 ? 0.39605507 0.46582773 0.32869592 -0.07543149 -0.17368819 0.02368151  692  LYS   A N    
9777  C  CA   . LYS   A  637 ? 0.39431986 0.45737940 0.32199699 -0.08140658 -0.16660675 0.02100312  692  LYS   A CA   
9778  C  C    . LYS   A  637 ? 0.41236016 0.45977658 0.31838769 -0.08334276 -0.16646910 0.02068780  692  LYS   A C    
9779  O  O    . LYS   A  637 ? 0.35894027 0.39737380 0.25785291 -0.08569331 -0.15902427 0.01952194  692  LYS   A O    
9780  C  CB   . LYS   A  637 ? 0.42320430 0.49707079 0.36288953 -0.08783174 -0.16872194 0.01721745  692  LYS   A CB   
9781  C  CG   . LYS   A  637 ? 0.39255935 0.46142980 0.33189738 -0.09343030 -0.16066210 0.01471876  692  LYS   A CG   
9782  C  CD   . LYS   A  637 ? 0.37275666 0.44941002 0.32049525 -0.10087728 -0.16365634 0.01106322  692  LYS   A CD   
9783  C  CE   . LYS   A  637 ? 0.31866166 0.41231376 0.28750068 -0.10127295 -0.16328520 0.01109382  692  LYS   A CE   
9784  N  NZ   . LYS   A  637 ? 0.33921009 0.43211043 0.31402913 -0.10088090 -0.15356714 0.01189737  692  LYS   A NZ   
9785  H  H    . LYS   A  637 ? 0.39082050 0.47034341 0.33257726 -0.07575101 -0.17856240 0.02278481  692  LYS   A H    
9786  H  HA   . LYS   A  637 ? 0.39197367 0.45380741 0.32303172 -0.08001057 -0.16019617 0.02181509  692  LYS   A HA   
9787  H  HB2  . LYS   A  637 ? 0.40384126 0.48883343 0.35695627 -0.08621920 -0.16996361 0.01757613  692  LYS   A HB2  
9788  H  HB3  . LYS   A  637 ? 0.41875628 0.49212381 0.35325637 -0.09002546 -0.17463419 0.01600716  692  LYS   A HB3  
9789  H  HG2  . LYS   A  637 ? 0.39817530 0.45599973 0.32466131 -0.09411492 -0.15862919 0.01440745  692  LYS   A HG2  
9790  H  HG3  . LYS   A  637 ? 0.38293138 0.45394766 0.32898942 -0.09156663 -0.15531757 0.01580054  692  LYS   A HG3  
9791  H  HD2  . LYS   A  637 ? 0.37466455 0.45168772 0.31808722 -0.10223062 -0.17011002 0.01009225  692  LYS   A HD2  
9792  H  HD3  . LYS   A  637 ? 0.36553848 0.43524808 0.30847567 -0.10440923 -0.15948845 0.00948620  692  LYS   A HD3  
9793  H  HE2  . LYS   A  637 ? 0.33440953 0.43480685 0.30850321 -0.09689485 -0.16675870 0.01266122  692  LYS   A HE2  
9794  H  HE3  . LYS   A  637 ? 0.33739579 0.43633658 0.31102484 -0.10623434 -0.16621882 0.00893650  692  LYS   A HE3  
9795  H  HZ1  . LYS   A  637 ? 0.32569617 0.41643339 0.29904205 -0.09607270 -0.15136831 0.01392795  692  LYS   A HZ1  
9796  H  HZ2  . LYS   A  637 ? 0.32981098 0.41454154 0.29791382 -0.10389310 -0.15025097 0.01083436  692  LYS   A HZ2  
9797  H  HZ3  . LYS   A  637 ? 0.32353711 0.42627430 0.31017905 -0.10247271 -0.15308800 0.01139501  692  LYS   A HZ3  
9798  N  N    . TYR   A  638 ? 0.35895297 0.40334004 0.25437707 -0.08233657 -0.17470431 0.02155537  693  TYR   A N    
9799  C  CA   . TYR   A  638 ? 0.38754171 0.41740024 0.26152915 -0.08417574 -0.17435308 0.02117838  693  TYR   A CA   
9800  C  C    . TYR   A  638 ? 0.38748252 0.40601796 0.25117204 -0.08113501 -0.16636498 0.02389713  693  TYR   A C    
9801  O  O    . TYR   A  638 ? 0.37765312 0.38538861 0.22709131 -0.08373665 -0.16202213 0.02244200  693  TYR   A O    
9802  C  CB   . TYR   A  638 ? 0.43505186 0.46292889 0.29796666 -0.08304658 -0.18471430 0.02239530  693  TYR   A CB   
9803  C  CG   . TYR   A  638 ? 0.41923034 0.45433420 0.28574213 -0.08790311 -0.19271964 0.01870367  693  TYR   A CG   
9804  C  CD1  . TYR   A  638 ? 0.47260600 0.52334350 0.35715306 -0.08713925 -0.19916692 0.01847043  693  TYR   A CD1  
9805  C  CD2  . TYR   A  638 ? 0.53931290 0.56599808 0.39176786 -0.09346120 -0.19354330 0.01507020  693  TYR   A CD2  
9806  C  CE1  . TYR   A  638 ? 0.58400679 0.64214730 0.47267550 -0.09226564 -0.20661280 0.01496352  693  TYR   A CE1  
9807  C  CE2  . TYR   A  638 ? 0.51508689 0.54777396 0.37051493 -0.09846555 -0.20110078 0.01143960  693  TYR   A CE2  
9808  C  CZ   . TYR   A  638 ? 0.57449609 0.62307799 0.44817248 -0.09809064 -0.20776683 0.01152319  693  TYR   A CZ   
9809  O  OH   . TYR   A  638 ? 0.57418633 0.62955630 0.45178789 -0.10361353 -0.21529686 0.00787379  693  TYR   A OH   
9810  H  H    . TYR   A  638 ? 0.37894487 0.43050718 0.28039095 -0.08050933 -0.18058707 0.02229012  693  TYR   A H    
9811  H  HA   . TYR   A  638 ? 0.39086032 0.41878241 0.26284760 -0.08865458 -0.17260081 0.01804883  693  TYR   A HA   
9812  H  HB2  . TYR   A  638 ? 0.42160246 0.45332307 0.28924620 -0.07865922 -0.18773520 0.02523845  693  TYR   A HB2  
9813  H  HB3  . TYR   A  638 ? 0.43050304 0.44803631 0.27847785 -0.08335849 -0.18325169 0.02291876  693  TYR   A HB3  
9814  H  HD1  . TYR   A  638 ? 0.46993685 0.52664506 0.36428285 -0.08312076 -0.19853614 0.02058223  693  TYR   A HD1  
9815  H  HD2  . TYR   A  638 ? 0.50513548 0.52184016 0.34569016 -0.09386704 -0.18895036 0.01491518  693  TYR   A HD2  
9816  H  HE1  . TYR   A  638 ? 0.54534924 0.61507851 0.44701636 -0.09178878 -0.21090728 0.01477828  693  TYR   A HE1  
9817  H  HE2  . TYR   A  638 ? 0.54355681 0.56970102 0.38872367 -0.10215364 -0.20167227 0.00877421  693  TYR   A HE2  
9819  N  N    . ASP   A  639 ? 0.41147318 0.43259439 0.28217345 -0.07558337 -0.16480830 0.02767902  694  ASP   A N    
9820  C  CA   . ASP   A  639 ? 0.43724713 0.44861740 0.30000627 -0.07295708 -0.15732506 0.03042233  694  ASP   A CA   
9821  C  C    . ASP   A  639 ? 0.38790819 0.39674175 0.25314590 -0.07592110 -0.14742723 0.02798368  694  ASP   A C    
9822  O  O    . ASP   A  639 ? 0.40136796 0.40041727 0.25581136 -0.07594649 -0.14110249 0.02872537  694  ASP   A O    
9823  C  CB   . ASP   A  639 ? 0.47207454 0.48776698 0.34487760 -0.06677213 -0.15743260 0.03422664  694  ASP   A CB   
9824  C  CG   . ASP   A  639 ? 0.50938427 0.52481222 0.37820709 -0.06227358 -0.16639581 0.03762313  694  ASP   A CG   
9825  O  OD1  . ASP   A  639 ? 0.54223555 0.55038428 0.39552370 -0.06368408 -0.17139578 0.03823121  694  ASP   A OD1  
9826  O  OD2  . ASP   A  639 ? 0.59587848 0.61762667 0.47641161 -0.05694038 -0.16834301 0.03977912  694  ASP   A OD2  
9827  H  H    . ASP   A  639 ? 0.40659478 0.43582761 0.28736001 -0.07340940 -0.16859919 0.02844002  694  ASP   A H    
9828  H  HA   . ASP   A  639 ? 0.44128305 0.44447482 0.29017535 -0.07311692 -0.15854904 0.03146826  694  ASP   A HA   
9829  H  HB2  . ASP   A  639 ? 0.45723653 0.48188931 0.34373400 -0.06657157 -0.15679914 0.03301804  694  ASP   A HB2  
9830  H  HB3  . ASP   A  639 ? 0.46424550 0.47389650 0.33303621 -0.06575552 -0.15181637 0.03563535  694  ASP   A HB3  
9831  N  N    . ALA   A  640 ? 0.33426571 0.35243151 0.21441180 -0.07829205 -0.14611064 0.02529253  695  ALA   A N    
9832  C  CA   . ALA   A  640 ? 0.32502130 0.34087753 0.20810266 -0.08104461 -0.13758785 0.02307534  695  ALA   A CA   
9833  C  C    . ALA   A  640 ? 0.34673616 0.35259289 0.21595940 -0.08530782 -0.13500255 0.01988159  695  ALA   A C    
9834  O  O    . ALA   A  640 ? 0.33436927 0.33499479 0.20177299 -0.08609799 -0.12743688 0.01881634  695  ALA   A O    
9835  C  CB   . ALA   A  640 ? 0.32478786 0.35234720 0.22563091 -0.08312152 -0.13744470 0.02123235  695  ALA   A CB   
9836  H  H    . ALA   A  640 ? 0.34338668 0.36951959 0.23201320 -0.07820109 -0.15062195 0.02493132  695  ALA   A H    
9837  H  HA   . ALA   A  640 ? 0.32496253 0.33814248 0.20796435 -0.07846572 -0.13306984 0.02499308  695  ALA   A HA   
9838  H  HB1  . ALA   A  640 ? 0.31540740 0.34108809 0.21826053 -0.08446969 -0.13179979 0.02028725  695  ALA   A HB1  
9839  H  HB2  . ALA   A  640 ? 0.31700647 0.35118100 0.22653446 -0.08011226 -0.13880548 0.02298445  695  ALA   A HB2  
9840  H  HB3  . ALA   A  640 ? 0.32621229 0.35649797 0.22761111 -0.08620231 -0.14164199 0.01921076  695  ALA   A HB3  
9841  N  N    . PHE   A  641 ? 0.34187526 0.34447086 0.20027676 -0.08749420 -0.14134610 0.01838969  696  PHE   A N    
9842  C  CA   . PHE   A  641 ? 0.36500311 0.35792539 0.20916778 -0.09122117 -0.13960598 0.01485244  696  PHE   A CA   
9843  C  C    . PHE   A  641 ? 0.37221184 0.35452008 0.19799922 -0.08948277 -0.13795587 0.01642641  696  PHE   A C    
9844  O  O    . PHE   A  641 ? 0.34722936 0.32144427 0.15949123 -0.09208729 -0.13673055 0.01339301  696  PHE   A O    
9845  C  CB   . PHE   A  641 ? 0.38306254 0.37873060 0.22609279 -0.09554050 -0.14757682 0.01151204  696  PHE   A CB   
9846  C  CG   . PHE   A  641 ? 0.41032448 0.41626579 0.27096894 -0.09852803 -0.14857465 0.00966745  696  PHE   A CG   
9847  C  CD1  . PHE   A  641 ? 0.48943341 0.49240911 0.35285500 -0.10228493 -0.14328289 0.00640418  696  PHE   A CD1  
9848  C  CD2  . PHE   A  641 ? 0.47704500 0.49563849 0.35154507 -0.09748613 -0.15459405 0.01130626  696  PHE   A CD2  
9849  C  CE1  . PHE   A  641 ? 0.51161218 0.52348888 0.39044887 -0.10565306 -0.14389613 0.00514334  696  PHE   A CE1  
9850  C  CE2  . PHE   A  641 ? 0.57778108 0.60665905 0.46862721 -0.10076866 -0.15482935 0.00965126  696  PHE   A CE2  
9851  C  CZ   . PHE   A  641 ? 0.53815275 0.56328845 0.43062606 -0.10514553 -0.14936808 0.00676693  696  PHE   A CZ   
9852  H  H    . PHE   A  641 ? 0.35311478 0.35979152 0.21312177 -0.08649671 -0.14716317 0.01946514  696  PHE   A H    
9853  H  HA   . PHE   A  641 ? 0.35719216 0.34859326 0.20439434 -0.09245469 -0.13419111 0.01322226  696  PHE   A HA   
9854  H  HB2  . PHE   A  641 ? 0.39487010 0.39246935 0.23525824 -0.09420525 -0.15335776 0.01312749  696  PHE   A HB2  
9855  H  HB3  . PHE   A  641 ? 0.39604712 0.38459876 0.22891615 -0.09785794 -0.14641921 0.00889454  696  PHE   A HB3  
9856  H  HD1  . PHE   A  641 ? 0.47513676 0.46995500 0.32989478 -0.10256898 -0.13920939 0.00508020  696  PHE   A HD1  
9857  H  HD2  . PHE   A  641 ? 0.48001432 0.50036144 0.35284585 -0.09454674 -0.15855071 0.01354970  696  PHE   A HD2  
9858  H  HE1  . PHE   A  641 ? 0.50809836 0.51693964 0.38796693 -0.10827901 -0.14049199 0.00317253  696  PHE   A HE1  
9859  H  HE2  . PHE   A  641 ? 0.53399467 0.57232261 0.43467498 -0.09998130 -0.15872435 0.01056278  696  PHE   A HE2  
9860  H  HZ   . PHE   A  641 ? 0.52969247 0.56133920 0.43256795 -0.10777716 -0.14945824 0.00587735  696  PHE   A HZ   
9861  N  N    . LEU   A  642 ? 0.37835181 0.36028978 0.20344153 -0.08519322 -0.13737123 0.02107591  697  LEU   A N    
9862  C  CA   . LEU   A  642 ? 0.42103383 0.39287144 0.22922216 -0.08401793 -0.13456884 0.02312843  697  LEU   A CA   
9863  C  C    . LEU   A  642 ? 0.45254630 0.41830540 0.25621298 -0.08530056 -0.12477238 0.02087486  697  LEU   A C    
9864  O  O    . LEU   A  642 ? 0.37378561 0.34307468 0.18925901 -0.08504722 -0.11938973 0.01996862  697  LEU   A O    
9865  C  CB   . LEU   A  642 ? 0.38990918 0.36185959 0.19936830 -0.07947700 -0.13541588 0.02869439  697  LEU   A CB   
9866  C  CG   . LEU   A  642 ? 0.40513915 0.38097805 0.21544477 -0.07722785 -0.14558938 0.03133852  697  LEU   A CG   
9867  C  CD1  . LEU   A  642 ? 0.39549440 0.37273708 0.21229099 -0.07212459 -0.14564745 0.03623782  697  LEU   A CD1  
9868  C  CD2  . LEU   A  642 ? 0.42125314 0.38903168 0.21219829 -0.07864363 -0.15069014 0.03181037  697  LEU   A CD2  
9869  H  H    . LEU   A  642 ? 0.37602520 0.36390266 0.21108334 -0.08308583 -0.13867201 0.02297128  697  LEU   A H    
9870  H  HA   . LEU   A  642 ? 0.42452812 0.39305192 0.22260410 -0.08549338 -0.13873112 0.02221308  697  LEU   A HA   
9871  H  HB2  . LEU   A  642 ? 0.38663125 0.36264670 0.20699434 -0.07801012 -0.13208348 0.02934205  697  LEU   A HB2  
9872  H  HB3  . LEU   A  642 ? 0.40394035 0.36894500 0.20265219 -0.07929489 -0.13227363 0.03003147  697  LEU   A HB3  
9873  H  HG   . LEU   A  642 ? 0.39817941 0.38124979 0.21808615 -0.07815123 -0.14903809 0.02938967  697  LEU   A HG   
9874  H  HD11 . LEU   A  642 ? 0.40042883 0.38137043 0.22018257 -0.07020725 -0.15229534 0.03759513  697  LEU   A HD11 
9875  H  HD12 . LEU   A  642 ? 0.40225852 0.37205070 0.20886585 -0.07152238 -0.14312434 0.03846647  697  LEU   A HD12 
9876  H  HD13 . LEU   A  642 ? 0.38506386 0.36678928 0.21308264 -0.07137867 -0.14163658 0.03573569  697  LEU   A HD13 
9877  H  HD21 . LEU   A  642 ? 0.42599714 0.39317685 0.21334375 -0.08179117 -0.15120317 0.02832773  697  LEU   A HD21 
9878  H  HD22 . LEU   A  642 ? 0.42677382 0.38744390 0.20776275 -0.07830283 -0.14679655 0.03356154  697  LEU   A HD22 
9879  H  HD23 . LEU   A  642 ? 0.42722043 0.39735508 0.21887729 -0.07680301 -0.15745568 0.03381230  697  LEU   A HD23 
9880  N  N    . VAL   A  643 ? 0.41242817 0.36926752 0.19860619 -0.08661152 -0.12267175 0.01987397  698  VAL   A N    
9881  C  CA   . VAL   A  643 ? 0.40211409 0.35355896 0.18296656 -0.08747450 -0.11365103 0.01740589  698  VAL   A CA   
9882  C  C    . VAL   A  643 ? 0.37533963 0.32777157 0.16276942 -0.08470670 -0.10701232 0.02091428  698  VAL   A C    
9883  O  O    . VAL   A  643 ? 0.38299060 0.33468434 0.17378414 -0.08477703 -0.09954645 0.01903167  698  VAL   A O    
9884  C  CB   . VAL   A  643 ? 0.42264637 0.36521876 0.18264209 -0.08921083 -0.11313507 0.01591341  698  VAL   A CB   
9885  C  CG1  . VAL   A  643 ? 0.48220354 0.42070216 0.23114727 -0.08762788 -0.11428461 0.02127492  698  VAL   A CG1  
9886  C  CG2  . VAL   A  643 ? 0.46215510 0.40013209 0.21692890 -0.09021726 -0.10436526 0.01185549  698  VAL   A CG2  
9887  H  H    . VAL   A  643 ? 0.43210250 0.38644099 0.20942132 -0.08690621 -0.12707902 0.02068107  698  VAL   A H    
9888  H  HA   . VAL   A  643 ? 0.39662331 0.34960359 0.18306518 -0.08885641 -0.11240050 0.01418091  698  VAL   A HA   
9889  H  HB   . VAL   A  643 ? 0.44480366 0.38708520 0.20116094 -0.09088757 -0.11837195 0.01388808  698  VAL   A HB   
9890  H  HG11 . VAL   A  643 ? 0.45920330 0.39750451 0.21094352 -0.08635794 -0.10912285 0.02320323  698  VAL   A HG11 
9891  H  HG12 . VAL   A  643 ? 0.46574980 0.40698269 0.21816501 -0.08651012 -0.12024367 0.02375294  698  VAL   A HG12 
9892  H  HG13 . VAL   A  643 ? 0.47777402 0.41094077 0.21318474 -0.08908039 -0.11428094 0.02024920  698  VAL   A HG13 
9893  H  HG21 . VAL   A  643 ? 0.46118522 0.39406329 0.20275719 -0.09113758 -0.10367637 0.01109310  698  VAL   A HG21 
9894  H  HG22 . VAL   A  643 ? 0.44736671 0.38627487 0.20668183 -0.09139834 -0.10455053 0.00831585  698  VAL   A HG22 
9895  H  HG23 . VAL   A  643 ? 0.44150078 0.38066152 0.20147990 -0.08874733 -0.09930591 0.01346910  698  VAL   A HG23 
9896  N  N    . THR   A  644 ? 0.38306871 0.33702576 0.17255172 -0.08212416 -0.11021666 0.02592868  699  THR   A N    
9897  C  CA   . THR   A  644 ? 0.40231109 0.35655046 0.19747917 -0.07962457 -0.10489390 0.02946316  699  THR   A CA   
9898  C  C    . THR   A  644 ? 0.38411814 0.34613204 0.19814645 -0.07811741 -0.10293607 0.02911140  699  THR   A C    
9899  O  O    . THR   A  644 ? 0.33408582 0.29671791 0.15378374 -0.07595886 -0.09905632 0.03182911  699  THR   A O    
9900  C  CB   . THR   A  644 ? 0.38295427 0.33437464 0.17221601 -0.07736533 -0.10951021 0.03478094  699  THR   A CB   
9901  O  OG1  . THR   A  644 ? 0.38816828 0.34478015 0.18309283 -0.07620312 -0.11865653 0.03524170  699  THR   A OG1  
9902  C  CG2  . THR   A  644 ? 0.36923951 0.31135181 0.13830459 -0.07910771 -0.10843227 0.03605825  699  THR   A CG2  
9903  H  H    . THR   A  644 ? 0.39349711 0.34793648 0.18038292 -0.08185309 -0.11608607 0.02714347  699  THR   A H    
9904  H  HA   . THR   A  644 ? 0.39157107 0.34203273 0.18093428 -0.08048601 -0.09933005 0.02864435  699  THR   A HA   
9905  H  HB   . THR   A  644 ? 0.37486005 0.32715610 0.17007774 -0.07555451 -0.10685651 0.03702851  699  THR   A HB   
9907  H  HG21 . THR   A  644 ? 0.38333809 0.32288498 0.14821815 -0.07772257 -0.11170539 0.03976985  699  THR   A HG21 
9908  H  HG22 . THR   A  644 ? 0.38494298 0.32587850 0.14748882 -0.08087537 -0.11093120 0.03360947  699  THR   A HG22 
9909  H  HG23 . THR   A  644 ? 0.37568837 0.31553298 0.14234996 -0.07990721 -0.10198551 0.03557488  699  THR   A HG23 
9910  N  N    . ASN   A  645 ? 0.31820071 0.28570828 0.14102064 -0.07963402 -0.10576472 0.02580038  700  ASN   A N    
9911  C  CA   . ASN   A  645 ? 0.32827562 0.30349222 0.16820206 -0.07890804 -0.10442594 0.02530093  700  ASN   A CA   
9912  C  C    . ASN   A  645 ? 0.32877272 0.30364284 0.17221114 -0.08151437 -0.09969505 0.02101556  700  ASN   A C    
9913  O  O    . ASN   A  645 ? 0.33286679 0.31305683 0.18918630 -0.08155651 -0.09776081 0.02041255  700  ASN   A O    
9914  C  CB   . ASN   A  645 ? 0.33280694 0.31599888 0.18189423 -0.07834037 -0.11238786 0.02598076  700  ASN   A CB   
9915  C  CG   . ASN   A  645 ? 0.36976203 0.36191028 0.23660409 -0.07776798 -0.11084180 0.02561144  700  ASN   A CG   
9916  O  OD1  . ASN   A  645 ? 0.31294781 0.30572748 0.18587203 -0.07570896 -0.10537330 0.02712421  700  ASN   A OD1  
9917  N  ND2  . ASN   A  645 ? 0.32263315 0.32190663 0.19792284 -0.08012780 -0.11528040 0.02335429  700  ASN   A ND2  
9918  H  H    . ASN   A  645 ? 0.34435984 0.31061372 0.16185418 -0.08142784 -0.10879917 0.02383517  700  ASN   A H    
9919  H  HA   . ASN   A  645 ? 0.31936994 0.29492974 0.16287296 -0.07685590 -0.10143094 0.02755529  700  ASN   A HA   
9920  H  HB2  . ASN   A  645 ? 0.34567714 0.32843536 0.19231212 -0.07613571 -0.11536332 0.02878567  700  ASN   A HB2  
9921  H  HB3  . ASN   A  645 ? 0.34798372 0.33095241 0.19348212 -0.08060443 -0.11581927 0.02381781  700  ASN   A HB3  
9922  H  HD21 . ASN   A  645 ? 0.34121647 0.33885142 0.21173146 -0.08251147 -0.11769865 0.02139739  700  ASN   A HD21 
9923  H  HD22 . ASN   A  645 ? 0.32837948 0.33400631 0.21392018 -0.07945004 -0.11566218 0.02376384  700  ASN   A HD22 
9924  N  N    . MET   A  646 ? 0.36435828 0.33243048 0.19571753 -0.08355688 -0.09777212 0.01800772  701  MET   A N    
9925  C  CA   . MET   A  646 ? 0.44945475 0.41564021 0.28244910 -0.08575591 -0.09437019 0.01356313  701  MET   A CA   
9926  C  C    . MET   A  646 ? 0.33846211 0.30131936 0.17044011 -0.08426660 -0.08601273 0.01329743  701  MET   A C    
9927  O  O    . MET   A  646 ? 0.31008548 0.27057004 0.13583113 -0.08269043 -0.08301571 0.01564511  701  MET   A O    
9928  C  CB   . MET   A  646 ? 0.42343879 0.38414186 0.24468723 -0.08872062 -0.09746231 0.00937012  701  MET   A CB   
9929  C  CG   . MET   A  646 ? 0.57141840 0.52445602 0.37677759 -0.08845816 -0.09384853 0.00819471  701  MET   A CG   
9930  S  SD   . MET   A  646 ? 0.56144166 0.50784409 0.35029221 -0.09162571 -0.09888224 0.00373060  701  MET   A SD   
9931  C  CE   . MET   A  646 ? 0.47164977 0.41628513 0.26597178 -0.09404041 -0.09813282 -0.00188995 701  MET   A CE   
9932  H  H    . MET   A  646 ? 0.38037866 0.34452277 0.20186533 -0.08347964 -0.09851837 0.01869419  701  MET   A H    
9933  H  HA   . MET   A  646 ? 0.39079595 0.36155230 0.23384675 -0.08627335 -0.09544139 0.01334481  701  MET   A HA   
9934  H  HB2  . MET   A  646 ? 0.45674023 0.41699591 0.28165880 -0.09020524 -0.09649221 0.00661209  701  MET   A HB2  
9935  H  HB3  . MET   A  646 ? 0.46318883 0.42600590 0.28384611 -0.08952722 -0.10315033 0.00997176  701  MET   A HB3  
9936  H  HG2  . MET   A  646 ? 0.52331316 0.47642744 0.32566664 -0.08700155 -0.09361653 0.01137494  701  MET   A HG2  
9937  H  HG3  . MET   A  646 ? 0.51889515 0.47011563 0.32513782 -0.08794796 -0.08849615 0.00664482  701  MET   A HG3  
9938  H  HE1  . MET   A  646 ? 0.48682123 0.42996982 0.28320563 -0.09286945 -0.09267665 -0.00281814 701  MET   A HE1  
9939  H  HE2  . MET   A  646 ? 0.48484468 0.43406940 0.28877899 -0.09491327 -0.10117561 -0.00112352 701  MET   A HE2  
9940  H  HE3  . MET   A  646 ? 0.50233376 0.44263881 0.28784195 -0.09574614 -0.10021632 -0.00490033 701  MET   A HE3  
9941  N  N    . VAL   A  647 ? 0.30911800 0.27187440 0.14746812 -0.08500399 -0.08264727 0.01045533  702  VAL   A N    
9942  C  CA   . VAL   A  647 ? 0.37427926 0.33520746 0.21434338 -0.08339186 -0.07534188 0.00986571  702  VAL   A CA   
9943  C  C    . VAL   A  647 ? 0.35967726 0.31651467 0.19912072 -0.08482394 -0.07373525 0.00504191  702  VAL   A C    
9944  O  O    . VAL   A  647 ? 0.32818061 0.28562760 0.17176096 -0.08713888 -0.07771340 0.00340466  702  VAL   A O    
9945  C  CB   . VAL   A  647 ? 0.36478606 0.33143771 0.21791489 -0.08150280 -0.07315699 0.01318917  702  VAL   A CB   
9946  C  CG1  . VAL   A  647 ? 0.33227122 0.30095050 0.18465179 -0.07951974 -0.07374001 0.01768181  702  VAL   A CG1  
9947  C  CG2  . VAL   A  647 ? 0.34067744 0.31256735 0.20533986 -0.08282879 -0.07669342 0.01319407  702  VAL   A CG2  
9948  H  H    . VAL   A  647 ? 0.32935771 0.29320633 0.17120537 -0.08665980 -0.08526517 0.00884273  702  VAL   A H    
9949  H  HA   . VAL   A  647 ? 0.35817671 0.31651637 0.19084488 -0.08264507 -0.07303917 0.01027830  702  VAL   A HA   
9950  H  HB   . VAL   A  647 ? 0.35073271 0.31612021 0.20524079 -0.08070268 -0.06869920 0.01230886  702  VAL   A HB   
9951  H  HG11 . VAL   A  647 ? 0.34358782 0.31398195 0.19580299 -0.07981876 -0.07840809 0.01875884  702  VAL   A HG11 
9952  H  HG12 . VAL   A  647 ? 0.34614056 0.31139416 0.19062045 -0.07924270 -0.07152232 0.01784704  702  VAL   A HG12 
9953  H  HG13 . VAL   A  647 ? 0.33249462 0.30397627 0.19229095 -0.07826386 -0.07173622 0.01926191  702  VAL   A HG13 
9954  H  HG21 . VAL   A  647 ? 0.33758065 0.31280577 0.20960350 -0.08155724 -0.07491448 0.01507426  702  VAL   A HG21 
9955  H  HG22 . VAL   A  647 ? 0.34681410 0.31659770 0.21177882 -0.08430102 -0.07622422 0.01058218  702  VAL   A HG22 
9956  H  HG23 . VAL   A  647 ? 0.34846938 0.32249260 0.21276212 -0.08355358 -0.08121371 0.01389442  702  VAL   A HG23 
9957  N  N    . PRO   A  648 ? 0.31453648 0.26701897 0.14889321 -0.08352521 -0.06801238 0.00253387  703  PRO   A N    
9958  C  CA   . PRO   A  648 ? 0.36981007 0.31750268 0.20384623 -0.08403667 -0.06642992 -0.00210950 703  PRO   A CA   
9959  C  C    . PRO   A  648 ? 0.40341169 0.35337138 0.25013894 -0.08417495 -0.06613505 -0.00147760 703  PRO   A C    
9960  O  O    . PRO   A  648 ? 0.36601281 0.31987566 0.22064830 -0.08223289 -0.06285469 0.00124073  703  PRO   A O    
9961  C  CB   . PRO   A  648 ? 0.35676467 0.30140096 0.18445639 -0.08162858 -0.05994944 -0.00422172 703  PRO   A CB   
9962  C  CG   . PRO   A  648 ? 0.33079550 0.27855787 0.15511581 -0.08072150 -0.05810193 -0.00051501 703  PRO   A CG   
9963  C  CD   . PRO   A  648 ? 0.31515187 0.26740050 0.14465240 -0.08147939 -0.06277933 0.00402262  703  PRO   A CD   
9964  H  HA   . PRO   A  648 ? 0.36971354 0.31443736 0.19836189 -0.08587307 -0.06972647 -0.00433683 703  PRO   A HA   
9965  H  HB2  . PRO   A  648 ? 0.34821939 0.29325193 0.18183286 -0.08023769 -0.05698511 -0.00468522 703  PRO   A HB2  
9966  H  HB3  . PRO   A  648 ? 0.36325333 0.30345219 0.18311752 -0.08214405 -0.06006876 -0.00758637 703  PRO   A HB3  
9967  H  HG2  . PRO   A  648 ? 0.32855654 0.27793568 0.15639436 -0.07908678 -0.05383553 0.00014048  703  PRO   A HG2  
9968  H  HG3  . PRO   A  648 ? 0.34294957 0.28796840 0.15760455 -0.08120018 -0.05785573 -0.00182661 703  PRO   A HG3  
9969  H  HD2  . PRO   A  648 ? 0.30885816 0.26438811 0.14535879 -0.08026483 -0.06088717 0.00645924  703  PRO   A HD2  
9970  H  HD3  . PRO   A  648 ? 0.32393938 0.27552494 0.14655294 -0.08192682 -0.06439458 0.00533046  703  PRO   A HD3  
9971  N  N    . MET   A  649 ? 0.32877696 0.27571064 0.17660832 -0.08685561 -0.06964462 -0.00405822 704  MET   A N    
9972  C  CA   . MET   A  649 ? 0.31859964 0.26627523 0.17666662 -0.08775544 -0.06943823 -0.00361669 704  MET   A CA   
9973  C  C    . MET   A  649 ? 0.38004017 0.31913459 0.23422003 -0.08935422 -0.07005212 -0.00822668 704  MET   A C    
9974  O  O    . MET   A  649 ? 0.37486875 0.31002179 0.22255620 -0.09216373 -0.07410828 -0.01102196 704  MET   A O    
9975  C  CB   . MET   A  649 ? 0.32850209 0.28345188 0.19549680 -0.09037353 -0.07397125 -0.00046461 704  MET   A CB   
9976  C  CG   . MET   A  649 ? 0.31966242 0.28224176 0.19239688 -0.08808473 -0.07292312 0.00398222  704  MET   A CG   
9977  S  SD   . MET   A  649 ? 0.36519232 0.33725834 0.25050804 -0.09011884 -0.07694387 0.00713203  704  MET   A SD   
9978  C  CE   . MET   A  649 ? 0.39207685 0.36961025 0.28193027 -0.08579469 -0.07353193 0.01148211  704  MET   A CE   
9979  H  H    . MET   A  649 ? 0.35233188 0.29633719 0.19391766 -0.08839799 -0.07225996 -0.00611508 704  MET   A H    
9980  H  HA   . MET   A  649 ? 0.32494169 0.27397844 0.18680912 -0.08552454 -0.06579232 -0.00232854 704  MET   A HA   
9981  H  HB2  . MET   A  649 ? 0.33129257 0.28595728 0.19465005 -0.09240325 -0.07783708 -0.00147493 704  MET   A HB2  
9982  H  HB3  . MET   A  649 ? 0.32225686 0.27694839 0.19477698 -0.09170310 -0.07393430 -0.00058341 704  MET   A HB3  
9983  H  HG2  . MET   A  649 ? 0.32318226 0.28559715 0.19825497 -0.08603948 -0.06901349 0.00474004  704  MET   A HG2  
9984  H  HG3  . MET   A  649 ? 0.33261940 0.29519770 0.19960645 -0.08726919 -0.07371154 0.00441599  704  MET   A HG3  
9985  H  HE1  . MET   A  649 ? 0.37813699 0.35349083 0.26825991 -0.08441345 -0.06966323 0.01138244  704  MET   A HE1  
9986  H  HE2  . MET   A  649 ? 0.38432500 0.36132157 0.26879820 -0.08473810 -0.07446633 0.01209612  704  MET   A HE2  
9987  H  HE3  . MET   A  649 ? 0.37562552 0.35855377 0.27278554 -0.08599787 -0.07472429 0.01320661  704  MET   A HE3  
9988  N  N    . TYR   A  650 ? 0.35260642 0.28830123 0.21061601 -0.08749026 -0.06636142 -0.00900942 705  TYR   A N    
9989  C  CA   . TYR   A  650 ? 0.35874939 0.28560287 0.21472518 -0.08892289 -0.06735120 -0.01266789 705  TYR   A CA   
9990  C  C    . TYR   A  650 ? 0.30662295 0.23463967 0.16790280 -0.09407558 -0.07227074 -0.01147208 705  TYR   A C    
9991  O  O    . TYR   A  650 ? 0.31202579 0.24845660 0.18212014 -0.09530518 -0.07311676 -0.00741489 705  TYR   A O    
9992  C  CB   . TYR   A  650 ? 0.41733468 0.34100443 0.27808607 -0.08588295 -0.06328207 -0.01265942 705  TYR   A CB   
9993  C  CG   . TYR   A  650 ? 0.39949566 0.32224533 0.25675347 -0.08074891 -0.05811322 -0.01445305 705  TYR   A CG   
9994  C  CD1  . TYR   A  650 ? 0.38042933 0.29608071 0.22817691 -0.07900459 -0.05697876 -0.01963025 705  TYR   A CD1  
9995  C  CD2  . TYR   A  650 ? 0.33375573 0.26298338 0.19748934 -0.07773491 -0.05424376 -0.01129028 705  TYR   A CD2  
9996  C  CE1  . TYR   A  650 ? 0.39568821 0.31192505 0.24128048 -0.07432035 -0.05178614 -0.02152350 705  TYR   A CE1  
9997  C  CE2  . TYR   A  650 ? 0.35263914 0.28215998 0.21434748 -0.07349698 -0.04950849 -0.01299849 705  TYR   A CE2  
9998  C  CZ   . TYR   A  650 ? 0.39264876 0.31616652 0.24575251 -0.07173226 -0.04811049 -0.01810335 705  TYR   A CZ   
9999  O  OH   . TYR   A  650 ? 0.51043648 0.43605942 0.36264980 -0.06758999 -0.04297610 -0.01981534 705  TYR   A OH   
10000 H  H    . TYR   A  650 ? 0.35058177 0.28918836 0.21236973 -0.08523389 -0.06336331 -0.00718242 705  TYR   A H    
10001 H  HA   . TYR   A  650 ? 0.36548096 0.28736401 0.21350297 -0.08874501 -0.06774446 -0.01599837 705  TYR   A HA   
10002 H  HB2  . TYR   A  650 ? 0.38678455 0.31538370 0.25472265 -0.08615457 -0.06288358 -0.00937427 705  TYR   A HB2  
10003 H  HB3  . TYR   A  650 ? 0.40240330 0.31965911 0.26188979 -0.08722691 -0.06467175 -0.01469006 705  TYR   A HB3  
10004 H  HD1  . TYR   A  650 ? 0.39987692 0.31054461 0.24267656 -0.08108817 -0.05970550 -0.02205033 705  TYR   A HD1  
10005 H  HD2  . TYR   A  650 ? 0.34283686 0.27654696 0.21265858 -0.07870771 -0.05485253 -0.00805607 705  TYR   A HD2  
10006 H  HE1  . TYR   A  650 ? 0.40317178 0.31501198 0.24240582 -0.07298011 -0.05074241 -0.02529506 705  TYR   A HE1  
10007 H  HE2  . TYR   A  650 ? 0.34778166 0.28187841 0.21411359 -0.07182466 -0.04712815 -0.01084937 705  TYR   A HE2  
10009 N  N    . PRO   A  651 ? 0.32494104 0.24486186 0.18117976 -0.09743741 -0.07560906 -0.01512075 706  PRO   A N    
10010 C  CA   . PRO   A  651 ? 0.37210187 0.29332510 0.23384316 -0.10321937 -0.08016019 -0.01409680 706  PRO   A CA   
10011 C  C    . PRO   A  651 ? 0.33825052 0.26251668 0.21061772 -0.10407802 -0.07832284 -0.01045211 706  PRO   A C    
10012 O  O    . PRO   A  651 ? 0.32447264 0.25671527 0.20486331 -0.10755344 -0.08042369 -0.00751830 706  PRO   A O    
10013 C  CB   . PRO   A  651 ? 0.34849733 0.25779182 0.20146005 -0.10596811 -0.08297997 -0.01921135 706  PRO   A CB   
10014 C  CG   . PRO   A  651 ? 0.36967927 0.27545321 0.21179904 -0.10248563 -0.08173758 -0.02266155 706  PRO   A CG   
10015 C  CD   . PRO   A  651 ? 0.34774426 0.25759745 0.19240892 -0.09638382 -0.07555529 -0.02057026 706  PRO   A CD   
10016 H  HA   . PRO   A  651 ? 0.34829754 0.27584320 0.21139541 -0.10477114 -0.08274110 -0.01282465 706  PRO   A HA   
10017 H  HB2  . PRO   A  651 ? 0.36159319 0.26457882 0.21502885 -0.10558005 -0.08153868 -0.01999730 706  PRO   A HB2  
10018 H  HB3  . PRO   A  651 ? 0.36299646 0.27345592 0.21680713 -0.11028616 -0.08695246 -0.01940491 706  PRO   A HB3  
10019 H  HG2  . PRO   A  651 ? 0.37404266 0.27103496 0.20988405 -0.10262486 -0.08210516 -0.02641198 706  PRO   A HG2  
10020 H  HG3  . PRO   A  651 ? 0.36690563 0.27673331 0.20669654 -0.10386663 -0.08432352 -0.02242692 706  PRO   A HG3  
10021 H  HD2  . PRO   A  651 ? 0.34999451 0.25437465 0.19413988 -0.09421475 -0.07307033 -0.02208335 706  PRO   A HD2  
10022 H  HD3  . PRO   A  651 ? 0.35079175 0.26237428 0.19036090 -0.09451883 -0.07455430 -0.02122927 706  PRO   A HD3  
10023 N  N    . ALA   A  652 ? 0.38608539 0.30462453 0.25857246 -0.10066733 -0.07432513 -0.01062988 707  ALA   A N    
10024 C  CA   . ALA   A  652 ? 0.38598323 0.30658877 0.26702103 -0.10125208 -0.07251774 -0.00708424 707  ALA   A CA   
10025 C  C    . ALA   A  652 ? 0.35413054 0.28765756 0.24326259 -0.09992966 -0.07097538 -0.00274713 707  ALA   A C    
10026 O  O    . ALA   A  652 ? 0.32906917 0.26847848 0.22605012 -0.10289729 -0.07157212 0.00026160  707  ALA   A O    
10027 C  CB   . ALA   A  652 ? 0.36123532 0.27382377 0.24041829 -0.09692913 -0.06893174 -0.00802506 707  ALA   A CB   
10028 H  H    . ALA   A  652 ? 0.37846631 0.29183587 0.24550742 -0.09788170 -0.07276218 -0.01305931 707  ALA   A H    
10029 H  HA   . ALA   A  652 ? 0.37914383 0.29803184 0.26187673 -0.10553607 -0.07491066 -0.00691114 707  ALA   A HA   
10030 H  HB1  . ALA   A  652 ? 0.36419439 0.27793211 0.24843745 -0.09752025 -0.06803808 -0.00550165 707  ALA   A HB1  
10031 H  HB2  . ALA   A  652 ? 0.37829384 0.28219607 0.25227123 -0.09750629 -0.07009505 -0.01094573 707  ALA   A HB2  
10032 H  HB3  . ALA   A  652 ? 0.36523479 0.28017625 0.24328691 -0.09296595 -0.06645268 -0.00828961 707  ALA   A HB3  
10033 N  N    . PHE   A  653 ? 0.35582066 0.29359227 0.24270737 -0.09569988 -0.06897719 -0.00253736 708  PHE   A N    
10034 C  CA   . PHE   A  653 ? 0.30419326 0.25286973 0.19782405 -0.09428700 -0.06791041 0.00135270  708  PHE   A CA   
10035 C  C    . PHE   A  653 ? 0.31150708 0.26776481 0.20907794 -0.09805208 -0.07226920 0.00262692  708  PHE   A C    
10036 O  O    . PHE   A  653 ? 0.29367405 0.25810343 0.19996464 -0.09891434 -0.07222775 0.00570742  708  PHE   A O    
10037 C  CB   . PHE   A  653 ? 0.33942342 0.29012418 0.22906339 -0.08965924 -0.06513881 0.00149991  708  PHE   A CB   
10038 C  CG   . PHE   A  653 ? 0.32456094 0.28446838 0.22143008 -0.08786289 -0.06356254 0.00562841  708  PHE   A CG   
10039 C  CD1  . PHE   A  653 ? 0.34537706 0.30709925 0.24876074 -0.08633827 -0.06039230 0.00782619  708  PHE   A CD1  
10040 C  CD2  . PHE   A  653 ? 0.29310727 0.25933233 0.19022410 -0.08789747 -0.06584534 0.00727868  708  PHE   A CD2  
10041 C  CE1  . PHE   A  653 ? 0.37032682 0.33983397 0.27987346 -0.08475091 -0.05907869 0.01120995  708  PHE   A CE1  
10042 C  CE2  . PHE   A  653 ? 0.32291034 0.29652411 0.22648245 -0.08602418 -0.06466716 0.01080061  708  PHE   A CE2  
10043 C  CZ   . PHE   A  653 ? 0.35216266 0.32726273 0.26178002 -0.08448468 -0.06111416 0.01256036  708  PHE   A CZ   
10044 H  H    . PHE   A  653 ? 0.34987938 0.28348222 0.23080528 -0.09371784 -0.06818043 -0.00486429 708  PHE   A H    
10045 H  HA   . PHE   A  653 ? 0.31391710 0.26408798 0.21277341 -0.09392084 -0.06608599 0.00328192  708  PHE   A HA   
10046 H  HB2  . PHE   A  653 ? 0.33034036 0.27659813 0.21748741 -0.08737101 -0.06253091 0.00015748  708  PHE   A HB2  
10047 H  HB3  . PHE   A  653 ? 0.33406687 0.28419265 0.21852177 -0.09018107 -0.06701364 0.00011630  708  PHE   A HB3  
10048 H  HD1  . PHE   A  653 ? 0.34648365 0.30367345 0.24959859 -0.08615026 -0.05918447 0.00692491  708  PHE   A HD1  
10049 H  HD2  . PHE   A  653 ? 0.31569904 0.28073812 0.20811526 -0.08900145 -0.06835923 0.00593083  708  PHE   A HD2  
10050 H  HE1  . PHE   A  653 ? 0.35117686 0.32159981 0.26446384 -0.08372984 -0.05696196 0.01249412  708  PHE   A HE1  
10051 H  HE2  . PHE   A  653 ? 0.32146186 0.29862165 0.22480106 -0.08566186 -0.06643084 0.01190652  708  PHE   A HE2  
10052 H  HZ   . PHE   A  653 ? 0.33972570 0.31942040 0.25335521 -0.08323039 -0.06036241 0.01468539  708  PHE   A HZ   
10053 N  N    . LYS   A  654 ? 0.36763874 0.32123256 0.25912002 -0.10057343 -0.07633246 -0.00007266 709  LYS   A N    
10054 C  CA   . LYS   A  654 ? 0.28462833 0.24633446 0.18027399 -0.10376479 -0.08101533 0.00099978  709  LYS   A CA   
10055 C  C    . LYS   A  654 ? 0.31194496 0.27851564 0.21750012 -0.10824732 -0.08214317 0.00260020  709  LYS   A C    
10056 O  O    . LYS   A  654 ? 0.40209335 0.37896478 0.31525648 -0.10976405 -0.08452681 0.00451707  709  LYS   A O    
10057 C  CB   . LYS   A  654 ? 0.35238463 0.30934584 0.23892435 -0.10618225 -0.08565164 -0.00257977 709  LYS   A CB   
10058 C  CG   . LYS   A  654 ? 0.31046981 0.26564950 0.18750720 -0.10222737 -0.08500199 -0.00340041 709  LYS   A CG   
10059 C  CD   . LYS   A  654 ? 0.42635685 0.37542382 0.29289898 -0.10434556 -0.08883956 -0.00725407 709  LYS   A CD   
10060 C  CE   . LYS   A  654 ? 0.43379569 0.38922036 0.30300030 -0.10843045 -0.09563628 -0.00693617 709  LYS   A CE   
10061 N  NZ   . LYS   A  654 ? 0.44411975 0.39266142 0.30114302 -0.11041703 -0.09966701 -0.01103008 709  LYS   A NZ   
10062 H  H    . LYS   A  654 ? 0.34061307 0.28755891 0.22540799 -0.10016419 -0.07628499 -0.00270238 709  LYS   A H    
10063 H  HA   . LYS   A  654 ? 0.30740705 0.27488029 0.20516092 -0.10134476 -0.08051577 0.00301528  709  LYS   A HA   
10064 H  HB2  . LYS   A  654 ? 0.33583939 0.28537577 0.21865985 -0.10780577 -0.08563451 -0.00498957 709  LYS   A HB2  
10065 H  HB3  . LYS   A  654 ? 0.32871163 0.29100883 0.21901383 -0.10897057 -0.08926091 -0.00205106 709  LYS   A HB3  
10066 H  HG2  . LYS   A  654 ? 0.33503753 0.29686362 0.21516253 -0.10098581 -0.08577579 -0.00097644 709  LYS   A HG2  
10067 H  HG3  . LYS   A  654 ? 0.33821046 0.28981870 0.21297614 -0.09934500 -0.08103609 -0.00364236 709  LYS   A HG3  
10068 H  HD2  . LYS   A  654 ? 0.39870411 0.34591329 0.25848305 -0.10172350 -0.08751459 -0.00777718 709  LYS   A HD2  
10069 H  HD3  . LYS   A  654 ? 0.40267587 0.34484017 0.26646340 -0.10572862 -0.08839757 -0.00981699 709  LYS   A HD3  
10070 H  HE2  . LYS   A  654 ? 0.42865729 0.38609940 0.30445373 -0.11152410 -0.09684017 -0.00667896 709  LYS   A HE2  
10071 H  HE3  . LYS   A  654 ? 0.42562082 0.38778192 0.29796168 -0.10673591 -0.09633046 -0.00435284 709  LYS   A HE3  
10072 H  HZ1  . LYS   A  654 ? 0.45057833 0.39159361 0.30254775 -0.11035141 -0.09781642 -0.01358571 709  LYS   A HZ1  
10073 H  HZ2  . LYS   A  654 ? 0.44716194 0.39659426 0.29920503 -0.10830704 -0.09992816 -0.01052733 709  LYS   A HZ2  
10074 H  HZ3  . LYS   A  654 ? 0.44852638 0.39935774 0.30782220 -0.11385231 -0.10381636 -0.01157560 709  LYS   A HZ3  
10075 N  N    . ARG   A  655 ? 0.34685597 0.30608603 0.25232643 -0.11040390 -0.08043984 0.00183552  710  ARG   A N    
10076 C  CA   . ARG   A  655 ? 0.33324134 0.29652196 0.24728981 -0.11520135 -0.08080267 0.00369409  710  ARG   A CA   
10077 C  C    . ARG   A  655 ? 0.30072719 0.27437294 0.22403249 -0.11272551 -0.07763545 0.00756644  710  ARG   A C    
10078 O  O    . ARG   A  655 ? 0.30622542 0.28966224 0.23826464 -0.11573442 -0.07880548 0.00926435  710  ARG   A O    
10079 C  CB   . ARG   A  655 ? 0.39476955 0.34662959 0.30578753 -0.11744776 -0.07919572 0.00282302  710  ARG   A CB   
10080 C  CG   . ARG   A  655 ? 0.38903284 0.32973707 0.29172385 -0.12084272 -0.08256513 -0.00115411 710  ARG   A CG   
10081 C  CD   . ARG   A  655 ? 0.36543489 0.29392803 0.26515508 -0.12312689 -0.08154583 -0.00175350 710  ARG   A CD   
10082 N  NE   . ARG   A  655 ? 0.37844592 0.31163955 0.28626230 -0.12842585 -0.08125594 0.00143662  710  ARG   A NE   
10083 C  CZ   . ARG   A  655 ? 0.39375934 0.31841794 0.30071431 -0.13039351 -0.07963476 0.00267045  710  ARG   A CZ   
10084 N  NH1  . ARG   A  655 ? 0.42238969 0.33464271 0.32228854 -0.12625885 -0.07796805 0.00134551  710  ARG   A NH1  
10085 N  NH2  . ARG   A  655 ? 0.31963375 0.24857479 0.23299626 -0.13653409 -0.07963730 0.00538067  710  ARG   A NH2  
10086 H  H    . ARG   A  655 ? 0.34058684 0.29207104 0.24040136 -0.10894876 -0.07907265 0.00013071  710  ARG   A H    
10087 H  HA   . ARG   A  655 ? 0.34377733 0.31062400 0.25966126 -0.11878818 -0.08426050 0.00303723  710  ARG   A HA   
10088 H  HB2  . ARG   A  655 ? 0.37343687 0.32165235 0.28229994 -0.11355256 -0.07618871 0.00315496  710  ARG   A HB2  
10089 H  HB3  . ARG   A  655 ? 0.37304312 0.32832316 0.28984058 -0.12045894 -0.07878901 0.00468609  710  ARG   A HB3  
10090 H  HG2  . ARG   A  655 ? 0.38826141 0.33293891 0.29303721 -0.12483134 -0.08584408 -0.00160932 710  ARG   A HG2  
10091 H  HG3  . ARG   A  655 ? 0.38865378 0.32571787 0.28512138 -0.11767498 -0.08254326 -0.00318427 710  ARG   A HG3  
10092 H  HD2  . ARG   A  655 ? 0.38597035 0.30693942 0.28000629 -0.12524983 -0.08399586 -0.00459984 710  ARG   A HD2  
10093 H  HD3  . ARG   A  655 ? 0.37440956 0.29886848 0.27197200 -0.11887612 -0.07866110 -0.00154562 710  ARG   A HD3  
10094 H  HE   . ARG   A  655 ? 0.37226260 0.31434238 0.28562754 -0.13047837 -0.08220895 0.00261912  710  ARG   A HE   
10095 H  HH11 . ARG   A  655 ? 0.41718397 0.32511854 0.31196040 -0.12339007 -0.07843922 -0.00120311 710  ARG   A HH11 
10096 H  HH12 . ARG   A  655 ? 0.41335422 0.32173905 0.31367081 -0.12631409 -0.07641431 0.00297515  710  ARG   A HH12 
10097 H  HH21 . ARG   A  655 ? 0.34341258 0.26620242 0.25554889 -0.13805050 -0.07861552 0.00645400  710  ARG   A HH21 
10098 H  HH22 . ARG   A  655 ? 0.33599293 0.27401111 0.25477839 -0.13908526 -0.08063010 0.00610701  710  ARG   A HH22 
10099 N  N    . VAL   A  656 ? 0.26931199 0.24084857 0.19064438 -0.10725415 -0.07358670 0.00861879  711  VAL   A N    
10100 C  CA   . VAL   A  656 ? 0.29994416 0.27981973 0.22849357 -0.10430585 -0.07050575 0.01187541  711  VAL   A CA   
10101 C  C    . VAL   A  656 ? 0.26871926 0.25895587 0.20130476 -0.10263894 -0.07264102 0.01298418  711  VAL   A C    
10102 O  O    . VAL   A  656 ? 0.31079745 0.31068039 0.25218344 -0.10347459 -0.07272855 0.01490905  711  VAL   A O    
10103 C  CB   . VAL   A  656 ? 0.26465422 0.23913234 0.18935388 -0.09917582 -0.06627534 0.01227595  711  VAL   A CB   
10104 C  CG1  . VAL   A  656 ? 0.30845374 0.29080108 0.23955667 -0.09606079 -0.06340677 0.01530984  711  VAL   A CG1  
10105 C  CG2  . VAL   A  656 ? 0.32147026 0.28610703 0.24318628 -0.10026431 -0.06463115 0.01146486  711  VAL   A CG2  
10106 H  H    . VAL   A  656 ? 0.28856197 0.25330251 0.20385814 -0.10533158 -0.07274285 0.00707396  711  VAL   A H    
10107 H  HA   . VAL   A  656 ? 0.27838451 0.26052716 0.21177645 -0.10683681 -0.06983004 0.01306816  711  VAL   A HA   
10108 H  HB   . VAL   A  656 ? 0.29102254 0.26292261 0.21048602 -0.09707910 -0.06667125 0.01089437  711  VAL   A HB   
10109 H  HG11 . VAL   A  656 ? 0.28714663 0.27359837 0.22363622 -0.09824286 -0.06324848 0.01657697  711  VAL   A HG11 
10110 H  HG12 . VAL   A  656 ? 0.28782138 0.27447775 0.21928675 -0.09439621 -0.06435358 0.01566094  711  VAL   A HG12 
10111 H  HG13 . VAL   A  656 ? 0.28818452 0.26704550 0.21748967 -0.09355732 -0.06082480 0.01557511  711  VAL   A HG13 
10112 H  HG21 . VAL   A  656 ? 0.30120370 0.26377925 0.22173439 -0.09689612 -0.06207746 0.01186502  711  VAL   A HG21 
10113 H  HG22 . VAL   A  656 ? 0.31121522 0.26972878 0.22790638 -0.10151552 -0.06632534 0.00917166  711  VAL   A HG22 
10114 H  HG23 . VAL   A  656 ? 0.30297297 0.26933521 0.22883034 -0.10306913 -0.06453060 0.01281357  711  VAL   A HG23 
10115 N  N    . TRP   A  657 ? 0.30894676 0.29680598 0.23461959 -0.09995021 -0.07420380 0.01176177  712  TRP   A N    
10116 C  CA   . TRP   A  657 ? 0.28438929 0.27985203 0.21199656 -0.09734417 -0.07618298 0.01320859  712  TRP   A CA   
10117 C  C    . TRP   A  657 ? 0.29453999 0.29857016 0.22825164 -0.10070218 -0.08126202 0.01312301  712  TRP   A C    
10118 O  O    . TRP   A  657 ? 0.25936767 0.27296990 0.20050573 -0.09899455 -0.08224215 0.01507061  712  TRP   A O    
10119 C  CB   . TRP   A  657 ? 0.39025253 0.37939805 0.30704081 -0.09462379 -0.07668083 0.01184903  712  TRP   A CB   
10120 C  CG   . TRP   A  657 ? 0.33429170 0.32845068 0.25071004 -0.09131215 -0.07809819 0.01384933  712  TRP   A CG   
10121 C  CD1  . TRP   A  657 ? 0.40343833 0.39904225 0.31555408 -0.09151158 -0.08291074 0.01348471  712  TRP   A CD1  
10122 C  CD2  . TRP   A  657 ? 0.32610697 0.32342428 0.24577168 -0.08727647 -0.07500230 0.01662819  712  TRP   A CD2  
10123 N  NE1  . TRP   A  657 ? 0.38778886 0.38676715 0.30004060 -0.08763092 -0.08302047 0.01616247  712  TRP   A NE1  
10124 C  CE2  . TRP   A  657 ? 0.27825582 0.27799648 0.19497168 -0.08508292 -0.07808820 0.01798334  712  TRP   A CE2  
10125 C  CE3  . TRP   A  657 ? 0.33764634 0.33527499 0.26174268 -0.08536688 -0.07018547 0.01808185  712  TRP   A CE3  
10126 C  CZ2  . TRP   A  657 ? 0.34244829 0.34446931 0.26087344 -0.08123069 -0.07645597 0.02073322  712  TRP   A CZ2  
10127 C  CZ3  . TRP   A  657 ? 0.37762409 0.37807941 0.30348587 -0.08166299 -0.06853082 0.02052299  712  TRP   A CZ3  
10128 C  CH2  . TRP   A  657 ? 0.42763412 0.42997134 0.35075587 -0.07969109 -0.07159107 0.02181678  712  TRP   A CH2  
10129 H  H    . TRP   A  657 ? 0.30054802 0.28149927 0.21975535 -0.09970120 -0.07403266 0.00997495  712  TRP   A H    
10130 H  HA   . TRP   A  657 ? 0.29830787 0.29725984 0.22996074 -0.09494691 -0.07376306 0.01512603  712  TRP   A HA   
10131 H  HB2  . TRP   A  657 ? 0.34900743 0.33317024 0.26261458 -0.09292942 -0.07339559 0.01151102  712  TRP   A HB2  
10132 H  HB3  . TRP   A  657 ? 0.35746393 0.34341958 0.26997992 -0.09692398 -0.07931716 0.00979633  712  TRP   A HB3  
10133 H  HD1  . TRP   A  657 ? 0.39021039 0.38418293 0.29916984 -0.09395823 -0.08593408 0.01167646  712  TRP   A HD1  
10134 H  HE1  . TRP   A  657 ? 0.36446056 0.36433601 0.27384591 -0.08696119 -0.08594196 0.01661060  712  TRP   A HE1  
10135 H  HE3  . TRP   A  657 ? 0.34180623 0.33730805 0.26727456 -0.08663801 -0.06832279 0.01741272  712  TRP   A HE3  
10136 H  HZ2  . TRP   A  657 ? 0.34468231 0.34757745 0.26080412 -0.07979231 -0.07881596 0.02181805  712  TRP   A HZ2  
10137 H  HZ3  . TRP   A  657 ? 0.36927974 0.36990964 0.29789242 -0.08048972 -0.06549598 0.02136872  712  TRP   A HZ3  
10138 H  HH2  . TRP   A  657 ? 0.38447657 0.38779598 0.30849552 -0.07726505 -0.07047583 0.02350331  712  TRP   A HH2  
10139 N  N    . ALA   A  658 ? 0.26800546 0.26864597 0.19887181 -0.10543913 -0.08465586 0.01062921  713  ALA   A N    
10140 C  CA   . ALA   A  658 ? 0.27050814 0.27966237 0.20772094 -0.10941555 -0.08975555 0.01019583  713  ALA   A CA   
10141 C  C    . ALA   A  658 ? 0.25681052 0.27593082 0.20676702 -0.11174646 -0.08812820 0.01203111  713  ALA   A C    
10142 O  O    . ALA   A  658 ? 0.31931606 0.35003144 0.27797720 -0.11231725 -0.09099141 0.01274703  713  ALA   A O    
10143 C  CB   . ALA   A  658 ? 0.28879020 0.29093218 0.21983275 -0.11471105 -0.09342514 0.00689059  713  ALA   A CB   
10144 H  H    . ALA   A  658 ? 0.28076786 0.27363575 0.20570147 -0.10620428 -0.08387887 0.00901832  713  ALA   A H    
10145 H  HA   . ALA   A  658 ? 0.27051181 0.28376830 0.20758912 -0.10714554 -0.09214175 0.01075066  713  ALA   A HA   
10146 H  HB1  . ALA   A  658 ? 0.28897893 0.29737189 0.22452495 -0.11753144 -0.09709682 0.00656091  713  ALA   A HB1  
10147 H  HB2  . ALA   A  658 ? 0.29247242 0.28857225 0.21510261 -0.11307538 -0.09426609 0.00551646  713  ALA   A HB2  
10148 H  HB3  . ALA   A  658 ? 0.28984517 0.28715312 0.22068700 -0.11694735 -0.09132541 0.00641470  713  ALA   A HB3  
10149 N  N    . TYR   A  659 ? 0.26463425 0.27943516 0.21559694 -0.11303645 -0.08353682 0.01272576  714  TYR   A N    
10150 C  CA   . TYR   A  659 ? 0.26150507 0.28523165 0.22326830 -0.11531927 -0.08114939 0.01458810  714  TYR   A CA   
10151 C  C    . TYR   A  659 ? 0.23427173 0.26690668 0.20245679 -0.10983095 -0.07873958 0.01689191  714  TYR   A C    
10152 O  O    . TYR   A  659 ? 0.24091929 0.28576910 0.21930197 -0.11040827 -0.07943956 0.01768570  714  TYR   A O    
10153 C  CB   . TYR   A  659 ? 0.27315056 0.28825396 0.23244151 -0.11825220 -0.07720125 0.01496196  714  TYR   A CB   
10154 C  CG   . TYR   A  659 ? 0.28129143 0.30474877 0.25028771 -0.12226852 -0.07484764 0.01674729  714  TYR   A CG   
10155 C  CD1  . TYR   A  659 ? 0.30539158 0.33424371 0.27989402 -0.12929037 -0.07741658 0.01602778  714  TYR   A CD1  
10156 C  CD2  . TYR   A  659 ? 0.28740370 0.31414497 0.26012504 -0.11922903 -0.06998985 0.01906527  714  TYR   A CD2  
10157 C  CE1  . TYR   A  659 ? 0.34573978 0.38283357 0.32896695 -0.13347141 -0.07464363 0.01768728  714  TYR   A CE1  
10158 C  CE2  . TYR   A  659 ? 0.34062397 0.37531978 0.32145959 -0.12293459 -0.06738637 0.02058220  714  TYR   A CE2  
10159 C  CZ   . TYR   A  659 ? 0.39072865 0.43068230 0.37679619 -0.13016325 -0.06945197 0.01996291  714  TYR   A CZ   
10160 O  OH   . TYR   A  659 ? 0.37049356 0.41871458 0.36433917 -0.13432483 -0.06623166 0.02151432  714  TYR   A OH   
10161 H  H    . TYR   A  659 ? 0.26550451 0.27173197 0.21019408 -0.11245947 -0.08187026 0.01200556  714  TYR   A H    
10162 H  HA   . TYR   A  659 ? 0.26164508 0.29137611 0.22823562 -0.11895778 -0.08399102 0.01397919  714  TYR   A HA   
10163 H  HB2  . TYR   A  659 ? 0.28077698 0.28894669 0.23510738 -0.12119952 -0.07899000 0.01331304  714  TYR   A HB2  
10164 H  HB3  . TYR   A  659 ? 0.27071282 0.28104967 0.22632802 -0.11454533 -0.07444172 0.01561461  714  TYR   A HB3  
10165 H  HD1  . TYR   A  659 ? 0.31617606 0.34266573 0.28804076 -0.13162148 -0.08093382 0.01432487  714  TYR   A HD1  
10166 H  HD2  . TYR   A  659 ? 0.29293934 0.31645679 0.26236263 -0.11476035 -0.06837476 0.01953078  714  TYR   A HD2  
10167 H  HE1  . TYR   A  659 ? 0.34836709 0.38927931 0.33542967 -0.13870864 -0.07623398 0.01719882  714  TYR   A HE1  
10168 H  HE2  . TYR   A  659 ? 0.32956281 0.36582935 0.31199837 -0.12086835 -0.06409458 0.02197832  714  TYR   A HE2  
10170 N  N    . PHE   A  660 ? 0.24379914 0.27044624 0.20622720 -0.10449673 -0.07588730 0.01774532  715  PHE   A N    
10171 C  CA   . PHE   A  660 ? 0.26323235 0.29615718 0.22972506 -0.09902344 -0.07436600 0.01962078  715  PHE   A CA   
10172 C  C    . PHE   A  660 ? 0.30396557 0.34573963 0.27465349 -0.09724116 -0.07919944 0.01963138  715  PHE   A C    
10173 O  O    . PHE   A  660 ? 0.30667838 0.35900003 0.28679264 -0.09552116 -0.07920230 0.02065049  715  PHE   A O    
10174 C  CB   . PHE   A  660 ? 0.25585103 0.27919516 0.21335588 -0.09441682 -0.07154562 0.02008083  715  PHE   A CB   
10175 C  CG   . PHE   A  660 ? 0.25619954 0.28348976 0.21530193 -0.08901916 -0.07101972 0.02179819  715  PHE   A CG   
10176 C  CD1  . PHE   A  660 ? 0.24769089 0.28191781 0.21473798 -0.08707801 -0.06841962 0.02332023  715  PHE   A CD1  
10177 C  CD2  . PHE   A  660 ? 0.33486453 0.35870984 0.28710908 -0.08610833 -0.07337204 0.02184575  715  PHE   A CD2  
10178 C  CE1  . PHE   A  660 ? 0.27249163 0.30944633 0.24082351 -0.08204477 -0.06834602 0.02470823  715  PHE   A CE1  
10179 C  CE2  . PHE   A  660 ? 0.42633465 0.45255738 0.37945074 -0.08138722 -0.07316598 0.02371028  715  PHE   A CE2  
10180 C  CZ   . PHE   A  660 ? 0.29881987 0.33124679 0.26008558 -0.07928679 -0.07077336 0.02504413  715  PHE   A CZ   
10181 H  H    . PHE   A  660 ? 0.24930683 0.26763692 0.20516431 -0.10428889 -0.07486103 0.01705051  715  PHE   A H    
10182 H  HA   . PHE   A  660 ? 0.25812659 0.29543972 0.23035946 -0.09940135 -0.07180315 0.02060004  715  PHE   A HA   
10183 H  HB2  . PHE   A  660 ? 0.25684127 0.27657905 0.21374026 -0.09484223 -0.06839652 0.02038731  715  PHE   A HB2  
10184 H  HB3  . PHE   A  660 ? 0.26436540 0.28215799 0.21534675 -0.09483834 -0.07325628 0.01882620  715  PHE   A HB3  
10185 H  HD1  . PHE   A  660 ? 0.25428045 0.29110584 0.22560218 -0.08927439 -0.06669670 0.02337000  715  PHE   A HD1  
10186 H  HD2  . PHE   A  660 ? 0.33510298 0.35423556 0.28138477 -0.08737382 -0.07496797 0.02062941  715  PHE   A HD2  
10187 H  HE1  . PHE   A  660 ? 0.26687369 0.30804402 0.24026872 -0.08059712 -0.06645516 0.02544125  715  PHE   A HE1  
10188 H  HE2  . PHE   A  660 ? 0.37081975 0.39400262 0.31852436 -0.07972039 -0.07469556 0.02400815  715  PHE   A HE2  
10189 H  HZ   . PHE   A  660 ? 0.31406379 0.34740490 0.27570215 -0.07605087 -0.07082871 0.02616086  715  PHE   A HZ   
10190 N  N    . GLN   A  661 ? 0.23261735 0.27007005 0.19606438 -0.09747188 -0.08356788 0.01833850  716  GLN   A N    
10191 C  CA   . GLN   A  661 ? 0.28300720 0.32747227 0.24882551 -0.09533264 -0.08887033 0.01858747  716  GLN   A CA   
10192 C  C    . GLN   A  661 ? 0.24766009 0.30420375 0.22428212 -0.09898753 -0.09282916 0.01776843  716  GLN   A C    
10193 O  O    . GLN   A  661 ? 0.33864042 0.40543935 0.32339525 -0.09608608 -0.09505767 0.01864501  716  GLN   A O    
10194 C  CB   . GLN   A  661 ? 0.25901869 0.29548562 0.21314009 -0.09497146 -0.09266323 0.01746216  716  GLN   A CB   
10195 C  CG   . GLN   A  661 ? 0.28352684 0.31020045 0.22738390 -0.09082927 -0.08930944 0.01839236  716  GLN   A CG   
10196 C  CD   . GLN   A  661 ? 0.30142498 0.32208234 0.23388246 -0.09006727 -0.09320328 0.01763456  716  GLN   A CD   
10197 O  OE1  . GLN   A  661 ? 0.33337122 0.35138080 0.26121795 -0.09376270 -0.09673692 0.01526428  716  GLN   A OE1  
10198 N  NE2  . GLN   A  661 ? 0.29685935 0.31483954 0.22396962 -0.08566242 -0.09272564 0.01959335  716  GLN   A NE2  
10199 H  H    . GLN   A  661 ? 0.26262814 0.29253125 0.21931374 -0.09883016 -0.08336403 0.01724314  716  GLN   A H    
10200 H  HA   . GLN   A  661 ? 0.25609681 0.30298835 0.22402534 -0.09134276 -0.08765185 0.02008784  716  GLN   A HA   
10201 H  HB2  . GLN   A  661 ? 0.27601853 0.30881616 0.22715485 -0.09871738 -0.09352788 0.01572379  716  GLN   A HB2  
10202 H  HB3  . GLN   A  661 ? 0.27369612 0.31510848 0.22964877 -0.09400158 -0.09675723 0.01769457  716  GLN   A HB3  
10203 H  HG2  . GLN   A  661 ? 0.27459875 0.30414283 0.22169840 -0.08753321 -0.08780099 0.02014925  716  GLN   A HG2  
10204 H  HG3  . GLN   A  661 ? 0.27851662 0.29981634 0.21977535 -0.09194828 -0.08591671 0.01773942  716  GLN   A HG3  
10205 H  HE21 . GLN   A  661 ? 0.29314643 0.31163907 0.22267359 -0.08335610 -0.08981153 0.02101905  716  GLN   A HE21 
10206 H  HE22 . GLN   A  661 ? 0.30460685 0.31998086 0.22536382 -0.08519832 -0.09535859 0.01951642  716  GLN   A HE22 
10207 N  N    . ARG   A  662 ? 0.27651411 0.33197647 0.25371259 -0.10539719 -0.09358349 0.01602112  717  ARG   A N    
10208 C  CA   . ARG   A  662 ? 0.27140418 0.33858389 0.25889444 -0.11001346 -0.09746036 0.01500960  717  ARG   A CA   
10209 C  C    . ARG   A  662 ? 0.25853390 0.33679521 0.25894260 -0.11152251 -0.09347650 0.01602028  717  ARG   A C    
10210 O  O    . ARG   A  662 ? 0.21455774 0.30666518 0.22634751 -0.11225889 -0.09600995 0.01577538  717  ARG   A O    
10211 C  CB   . ARG   A  662 ? 0.36680588 0.42724162 0.34887677 -0.11705576 -0.09999745 0.01262274  717  ARG   A CB   
10212 C  CG   . ARG   A  662 ? 0.43040043 0.50179768 0.42070585 -0.12216423 -0.10602079 0.01107442  717  ARG   A CG   
10213 C  CD   . ARG   A  662 ? 0.38986501 0.45240909 0.37346530 -0.12946184 -0.10835649 0.00854391  717  ARG   A CD   
10214 N  NE   . ARG   A  662 ? 0.47221169 0.53146642 0.45818725 -0.13477381 -0.10361701 0.00881900  717  ARG   A NE   
10215 C  CZ   . ARG   A  662 ? 0.66499764 0.73531830 0.66290927 -0.14004377 -0.10267287 0.00930839  717  ARG   A CZ   
10216 N  NH1  . ARG   A  662 ? 0.78873581 0.87515128 0.79848951 -0.14104970 -0.10644233 0.00902238  717  ARG   A NH1  
10217 N  NH2  . ARG   A  662 ? 0.54881024 0.61417723 0.54679918 -0.14438966 -0.09781387 0.01015667  717  ARG   A NH2  
10218 H  H    . ARG   A  662 ? 0.27194405 0.31916365 0.24311459 -0.10704563 -0.09171452 0.01538793  717  ARG   A H    
10219 H  HA   . ARG   A  662 ? 0.28608021 0.35843605 0.27541438 -0.10777921 -0.10142530 0.01503353  717  ARG   A HA   
10220 H  HB2  . ARG   A  662 ? 0.35739315 0.40913790 0.32991114 -0.11580448 -0.10125005 0.01184273  717  ARG   A HB2  
10221 H  HB3  . ARG   A  662 ? 0.35226691 0.40905330 0.33433959 -0.11970851 -0.09644960 0.01273576  717  ARG   A HB3  
10222 H  HG2  . ARG   A  662 ? 0.40103543 0.48192650 0.40133816 -0.12355074 -0.10452367 0.01172412  717  ARG   A HG2  
10223 H  HG3  . ARG   A  662 ? 0.40576264 0.48054171 0.39574856 -0.11940140 -0.11003147 0.01098385  717  ARG   A HG3  
10224 H  HD2  . ARG   A  662 ? 0.42553365 0.49432367 0.41294995 -0.13233604 -0.11303160 0.00737745  717  ARG   A HD2  
10225 H  HD3  . ARG   A  662 ? 0.42368299 0.47595009 0.39687791 -0.12779266 -0.10874576 0.00776128  717  ARG   A HD3  
10226 H  HE   . ARG   A  662 ? 0.48952848 0.53885245 0.46847463 -0.13454676 -0.10121015 0.00871060  717  ARG   A HE   
10227 H  HH11 . ARG   A  662 ? 0.72884673 0.81963360 0.73976356 -0.13688596 -0.10885899 0.00913130  717  ARG   A HH11 
10228 H  HH12 . ARG   A  662 ? 0.74067867 0.83354622 0.75728613 -0.14590298 -0.10656803 0.00873843  717  ARG   A HH12 
10229 H  HH21 . ARG   A  662 ? 0.58295143 0.65533912 0.58822072 -0.14841184 -0.09705191 0.01051223  717  ARG   A HH21 
10230 H  HH22 . ARG   A  662 ? 0.58135104 0.63647413 0.57204783 -0.14324574 -0.09541055 0.01040979  717  ARG   A HH22 
10231 N  N    . VAL   A  663 ? 0.24812734 0.32074714 0.24675557 -0.11168701 -0.08719748 0.01710848  718  VAL   A N    
10232 C  CA   . VAL   A  663 ? 0.24787295 0.32970455 0.25688386 -0.11422384 -0.08304194 0.01795060  718  VAL   A CA   
10233 C  C    . VAL   A  663 ? 0.21099702 0.29507348 0.22243038 -0.10798484 -0.07828909 0.01970580  718  VAL   A C    
10234 O  O    . VAL   A  663 ? 0.22838441 0.32509881 0.25047576 -0.10630435 -0.07729968 0.02000046  718  VAL   A O    
10235 C  CB   . VAL   A  663 ? 0.26046664 0.33443516 0.26583391 -0.12109404 -0.08013012 0.01780731  718  VAL   A CB   
10236 C  CG1  . VAL   A  663 ? 0.24872527 0.33062342 0.26270336 -0.12397007 -0.07507079 0.01910666  718  VAL   A CG1  
10237 C  CG2  . VAL   A  663 ? 0.36695662 0.43928334 0.37090307 -0.12791252 -0.08508018 0.01579332  718  VAL   A CG2  
10238 H  H    . VAL   A  663 ? 0.25177848 0.31489426 0.24253124 -0.11026236 -0.08550793 0.01729408  718  VAL   A H    
10239 H  HA   . VAL   A  663 ? 0.24226749 0.33438495 0.25933239 -0.11581112 -0.08543193 0.01738004  718  VAL   A HA   
10240 H  HB   . VAL   A  663 ? 0.27246284 0.33595645 0.26964977 -0.11924750 -0.07833083 0.01814112  718  VAL   A HB   
10241 H  HG11 . VAL   A  663 ? 0.24925944 0.34286222 0.27220839 -0.12470553 -0.07621478 0.01876645  718  VAL   A HG11 
10242 H  HG12 . VAL   A  663 ? 0.24631199 0.32643226 0.25902641 -0.12012188 -0.07167766 0.02023810  718  VAL   A HG12 
10243 H  HG13 . VAL   A  663 ? 0.25583667 0.33284926 0.26745325 -0.12900414 -0.07408136 0.01910787  718  VAL   A HG13 
10244 H  HG21 . VAL   A  663 ? 0.33507943 0.40181553 0.33662692 -0.13224690 -0.08327217 0.01583142  718  VAL   A HG21 
10245 H  HG22 . VAL   A  663 ? 0.33550918 0.40140921 0.33246750 -0.12619193 -0.08792076 0.01484606  718  VAL   A HG22 
10246 H  HG23 . VAL   A  663 ? 0.33178127 0.41495207 0.34404355 -0.12972201 -0.08729261 0.01534696  718  VAL   A HG23 
10247 N  N    . LEU   A  664 ? 0.26406336 0.33611327 0.26589984 -0.10469544 -0.07519807 0.02061466  719  LEU   A N    
10248 C  CA   . LEU   A  664 ? 0.20654294 0.27939254 0.21005678 -0.10018761 -0.07020886 0.02213906  719  LEU   A CA   
10249 C  C    . LEU   A  664 ? 0.27040425 0.34928906 0.27753639 -0.09333573 -0.07173136 0.02263973  719  LEU   A C    
10250 O  O    . LEU   A  664 ? 0.24994355 0.33602780 0.26397943 -0.09051020 -0.06871166 0.02320422  719  LEU   A O    
10251 C  CB   . LEU   A  664 ? 0.22552755 0.28456190 0.21851957 -0.09915161 -0.06700753 0.02278983  719  LEU   A CB   
10252 C  CG   . LEU   A  664 ? 0.29204041 0.34428960 0.28175977 -0.10463401 -0.06453611 0.02278341  719  LEU   A CG   
10253 C  CD1  . LEU   A  664 ? 0.29769719 0.33739001 0.27802336 -0.10189676 -0.06152660 0.02341580  719  LEU   A CD1  
10254 C  CD2  . LEU   A  664 ? 0.29705113 0.35805517 0.29534358 -0.10817807 -0.06108361 0.02366234  719  LEU   A CD2  
10255 H  H    . LEU   A  664 ? 0.24090332 0.30438179 0.23518199 -0.10529900 -0.07622617 0.02012261  719  LEU   A H    
10256 H  HA   . LEU   A  664 ? 0.22838286 0.30711457 0.23787484 -0.10257251 -0.06784455 0.02235144  719  LEU   A HA   
10257 H  HB2  . LEU   A  664 ? 0.23657858 0.28992796 0.22352237 -0.09772553 -0.06922024 0.02232286  719  LEU   A HB2  
10258 H  HB3  . LEU   A  664 ? 0.22911593 0.28853539 0.22271547 -0.09569293 -0.06437309 0.02371323  719  LEU   A HB3  
10259 H  HG   . LEU   A  664 ? 0.28525156 0.33521733 0.27300486 -0.10794697 -0.06729162 0.02170587  719  LEU   A HG   
10260 H  HD11 . LEU   A  664 ? 0.29957590 0.33335245 0.27656382 -0.10511541 -0.06104014 0.02317541  719  LEU   A HD11 
10261 H  HD12 . LEU   A  664 ? 0.29133198 0.33285767 0.27357247 -0.09970023 -0.05861920 0.02447243  719  LEU   A HD12 
10262 H  HD13 . LEU   A  664 ? 0.29614097 0.33201414 0.27191651 -0.09916529 -0.06309845 0.02293551  719  LEU   A HD13 
10263 H  HD21 . LEU   A  664 ? 0.29520321 0.36336577 0.29907990 -0.11122324 -0.06305386 0.02299379  719  LEU   A HD21 
10264 H  HD22 . LEU   A  664 ? 0.28972191 0.35514602 0.29121959 -0.10474329 -0.05898209 0.02432714  719  LEU   A HD22 
10265 H  HD23 . LEU   A  664 ? 0.29670030 0.35157552 0.29140565 -0.11086859 -0.05904582 0.02417458  719  LEU   A HD23 
10266 N  N    . VAL   A  665 ? 0.29353219 0.36927000 0.29568583 -0.09062846 -0.07655521 0.02239489  720  VAL   A N    
10267 C  CA   . VAL   A  665 ? 0.21587086 0.29587072 0.22058101 -0.08415174 -0.07856325 0.02319730  720  VAL   A CA   
10268 C  C    . VAL   A  665 ? 0.20635930 0.30204719 0.22495808 -0.08341092 -0.07992318 0.02259759  720  VAL   A C    
10269 O  O    . VAL   A  665 ? 0.19386350 0.29475272 0.21799722 -0.07849037 -0.07798716 0.02309457  720  VAL   A O    
10270 C  CB   . VAL   A  665 ? 0.26104689 0.33476481 0.25722113 -0.08171698 -0.08379211 0.02340975  720  VAL   A CB   
10271 C  CG1  . VAL   A  665 ? 0.22709614 0.30609366 0.22709841 -0.07538124 -0.08685067 0.02445073  720  VAL   A CG1  
10272 C  CG2  . VAL   A  665 ? 0.25085229 0.31015915 0.23398277 -0.08095840 -0.08114196 0.02404471  720  VAL   A CG2  
10273 H  H    . VAL   A  665 ? 0.27290851 0.34337339 0.26962256 -0.09279949 -0.07861111 0.02174809  720  VAL   A H    
10274 H  HA   . VAL   A  665 ? 0.23033731 0.30687004 0.23313752 -0.08143827 -0.07524821 0.02406583  720  VAL   A HA   
10275 H  HB   . VAL   A  665 ? 0.24835652 0.32374632 0.24463937 -0.08491222 -0.08709706 0.02237428  720  VAL   A HB   
10276 H  HG11 . VAL   A  665 ? 0.23208834 0.31127799 0.23406574 -0.07260682 -0.08359665 0.02514934  720  VAL   A HG11 
10277 H  HG12 . VAL   A  665 ? 0.23652346 0.32459632 0.24413772 -0.07576416 -0.08968109 0.02376482  720  VAL   A HG12 
10278 H  HG13 . VAL   A  665 ? 0.24059604 0.31349730 0.23326507 -0.07371024 -0.08932905 0.02506743  720  VAL   A HG13 
10279 H  HG21 . VAL   A  665 ? 0.25872582 0.31427851 0.23606253 -0.07979435 -0.08417301 0.02416878  720  VAL   A HG21 
10280 H  HG22 . VAL   A  665 ? 0.25516644 0.31079817 0.23590019 -0.08451732 -0.07952021 0.02326505  720  VAL   A HG22 
10281 H  HG23 . VAL   A  665 ? 0.25055119 0.30826968 0.23362620 -0.07810788 -0.07809675 0.02503324  720  VAL   A HG23 
10282 N  N    . LYS   A  666 ? 0.21016017 0.31373993 0.23471782 -0.08823115 -0.08334029 0.02126407  721  LYS   A N    
10283 C  CA   . LYS   A  666 ? 0.24559453 0.36586937 0.28471205 -0.08808480 -0.08445822 0.02035890  721  LYS   A CA   
10284 C  C    . LYS   A  666 ? 0.22141168 0.34783041 0.26767954 -0.08861223 -0.07760356 0.02046523  721  LYS   A C    
10285 O  O    . LYS   A  666 ? 0.22491968 0.36251262 0.28108585 -0.08441958 -0.07674988 0.02001926  721  LYS   A O    
10286 C  CB   . LYS   A  666 ? 0.30199188 0.42931694 0.34604996 -0.09485345 -0.08880105 0.01880135  721  LYS   A CB   
10287 C  CG   . LYS   A  666 ? 0.32388383 0.47030729 0.38460088 -0.09639549 -0.08893815 0.01758990  721  LYS   A CG   
10288 C  CD   . LYS   A  666 ? 0.27392840 0.43116572 0.34342059 -0.08875404 -0.09235791 0.01733719  721  LYS   A CD   
10289 C  CE   . LYS   A  666 ? 0.32340589 0.50083077 0.41018414 -0.09090523 -0.09288750 0.01559351  721  LYS   A CE   
10290 N  NZ   . LYS   A  666 ? 0.30537897 0.49289274 0.40124279 -0.08219171 -0.09465189 0.01521184  721  LYS   A NZ   
10291 H  H    . LYS   A  666 ? 0.22265996 0.32144657 0.24238071 -0.09170479 -0.08503163 0.02075116  721  LYS   A H    
10292 H  HA   . LYS   A  666 ? 0.24162239 0.36492294 0.28277946 -0.08314663 -0.08713470 0.02058302  721  LYS   A HA   
10293 H  HB2  . LYS   A  666 ? 0.29768068 0.42268783 0.33805478 -0.09374265 -0.09365605 0.01859343  721  LYS   A HB2  
10294 H  HB3  . LYS   A  666 ? 0.29466826 0.41604012 0.33427891 -0.09964404 -0.08686873 0.01868873  721  LYS   A HB3  
10295 H  HG2  . LYS   A  666 ? 0.31117892 0.46112925 0.37427139 -0.10132601 -0.09176679 0.01663508  721  LYS   A HG2  
10296 H  HG3  . LYS   A  666 ? 0.30262443 0.45119733 0.36634302 -0.09795561 -0.08386412 0.01778768  721  LYS   A HG3  
10297 H  HD2  . LYS   A  666 ? 0.29140523 0.44579190 0.35944515 -0.08415269 -0.08924586 0.01811299  721  LYS   A HD2  
10298 H  HD3  . LYS   A  666 ? 0.29895741 0.45283306 0.36422199 -0.08685166 -0.09746403 0.01748107  721  LYS   A HD3  
10299 H  HE2  . LYS   A  666 ? 0.31073299 0.49180114 0.39956713 -0.09466255 -0.09714491 0.01477453  721  LYS   A HE2  
10300 H  HE3  . LYS   A  666 ? 0.30446190 0.48478758 0.39445204 -0.09433949 -0.08785434 0.01544554  721  LYS   A HE3  
10301 H  HZ1  . LYS   A  666 ? 0.31294602 0.49687326 0.40506724 -0.07893521 -0.09940421 0.01563455  721  LYS   A HZ1  
10302 H  HZ2  . LYS   A  666 ? 0.30688924 0.49120122 0.40108690 -0.07896274 -0.09061757 0.01576274  721  LYS   A HZ2  
10303 H  HZ3  . LYS   A  666 ? 0.30915996 0.50963837 0.41600007 -0.08320927 -0.09511082 0.01394483  721  LYS   A HZ3  
10304 N  N    . LYS   A  667 ? 0.23842692 0.35763907 0.27955317 -0.09384591 -0.07300425 0.02090663  722  LYS   A N    
10305 C  CA   . LYS   A  667 ? 0.24808279 0.37137568 0.29367745 -0.09518488 -0.06642389 0.02126635  722  LYS   A CA   
10306 C  C    . LYS   A  667 ? 0.18706077 0.30893403 0.23191704 -0.08764118 -0.06337367 0.02190162  722  LYS   A C    
10307 O  O    . LYS   A  667 ? 0.18436234 0.31699973 0.23829475 -0.08538237 -0.06061767 0.02123781  722  LYS   A O    
10308 C  CB   . LYS   A  667 ? 0.28718293 0.39906019 0.32415718 -0.10126454 -0.06290111 0.02213968  722  LYS   A CB   
10309 C  CG   . LYS   A  667 ? 0.29714641 0.40999711 0.33538070 -0.10258431 -0.05609627 0.02303390  722  LYS   A CG   
10310 C  CD   . LYS   A  667 ? 0.48668739 0.59010899 0.51809293 -0.10962135 -0.05406566 0.02392875  722  LYS   A CD   
10311 C  CE   . LYS   A  667 ? 0.62073416 0.72234225 0.65057397 -0.11124497 -0.04783344 0.02527063  722  LYS   A CE   
10312 N  NZ   . LYS   A  667 ? 0.73774332 0.82694209 0.75785738 -0.10652331 -0.04590978 0.02633962  722  LYS   A NZ   
10313 H  H    . LYS   A  667 ? 0.24027395 0.35151786 0.27453873 -0.09657858 -0.07413971 0.02096508  722  LYS   A H    
10314 H  HA   . LYS   A  667 ? 0.23780310 0.37240762 0.29261446 -0.09725155 -0.06633399 0.02044205  722  LYS   A HA   
10315 H  HB2  . LYS   A  667 ? 0.28531000 0.39880574 0.32367462 -0.10633481 -0.06471045 0.02159558  722  LYS   A HB2  
10316 H  HB3  . LYS   A  667 ? 0.28200126 0.38341653 0.31040645 -0.09947488 -0.06363373 0.02263444  722  LYS   A HB3  
10317 H  HG2  . LYS   A  667 ? 0.32387298 0.43220478 0.35846084 -0.09811658 -0.05434302 0.02359056  722  LYS   A HG2  
10318 H  HG3  . LYS   A  667 ? 0.32582173 0.44987744 0.37278873 -0.10323860 -0.05484754 0.02244067  722  LYS   A HG3  
10319 H  HD2  . LYS   A  667 ? 0.45950580 0.56748402 0.49474335 -0.11442285 -0.05569113 0.02336396  722  LYS   A HD2  
10320 H  HD3  . LYS   A  667 ? 0.45921254 0.55225289 0.48263383 -0.10874449 -0.05565522 0.02415840  722  LYS   A HD3  
10321 H  HE2  . LYS   A  667 ? 0.60685706 0.71829993 0.64374083 -0.11012559 -0.04571350 0.02491105  722  LYS   A HE2  
10322 H  HE3  . LYS   A  667 ? 0.61412823 0.71322286 0.64242029 -0.11682640 -0.04709688 0.02577000  722  LYS   A HE3  
10323 H  HZ1  . LYS   A  667 ? 0.69444668 0.78532225 0.71558845 -0.10167985 -0.04660073 0.02596257  722  LYS   A HZ1  
10324 H  HZ2  . LYS   A  667 ? 0.69697428 0.77745819 0.71085185 -0.10750299 -0.04753396 0.02654768  722  LYS   A HZ2  
10325 H  HZ3  . LYS   A  667 ? 0.69725341 0.78578210 0.71647757 -0.10749688 -0.04245579 0.02712525  722  LYS   A HZ3  
10326 N  N    . TYR   A  668 ? 0.23553908 0.34432864 0.26964504 -0.08388875 -0.06396879 0.02295552  723  TYR   A N    
10327 C  CA   . TYR   A  668 ? 0.20781165 0.31292617 0.23957533 -0.07744334 -0.06138159 0.02363456  723  TYR   A CA   
10328 C  C    . TYR   A  668 ? 0.25496069 0.36986297 0.29513216 -0.07139803 -0.06426015 0.02289198  723  TYR   A C    
10329 O  O    . TYR   A  668 ? 0.21559560 0.33643907 0.26160267 -0.06774033 -0.06097180 0.02230343  723  TYR   A O    
10330 C  CB   . TYR   A  668 ? 0.23580028 0.32532278 0.25445783 -0.07562343 -0.06197680 0.02489685  723  TYR   A CB   
10331 C  CG   . TYR   A  668 ? 0.22656997 0.30633503 0.23736107 -0.08058441 -0.05918575 0.02536509  723  TYR   A CG   
10332 C  CD1  . TYR   A  668 ? 0.24333487 0.32576248 0.25702697 -0.08511224 -0.05521764 0.02533861  723  TYR   A CD1  
10333 C  CD2  . TYR   A  668 ? 0.23058861 0.29845485 0.23090956 -0.08056523 -0.06058129 0.02581403  723  TYR   A CD2  
10334 C  CE1  . TYR   A  668 ? 0.27760443 0.35027924 0.28389305 -0.08919881 -0.05328270 0.02591245  723  TYR   A CE1  
10335 C  CE2  . TYR   A  668 ? 0.25749910 0.31655920 0.25120631 -0.08429122 -0.05833332 0.02594670  723  TYR   A CE2  
10336 C  CZ   . TYR   A  668 ? 0.36214346 0.42322487 0.35881895 -0.08848194 -0.05501105 0.02606936  723  TYR   A CZ   
10337 O  OH   . TYR   A  668 ? 0.27790004 0.32955790 0.26791471 -0.09194881 -0.05342235 0.02632475  723  TYR   A OH   
10338 H  H    . TYR   A  668 ? 0.22014776 0.32202858 0.24807897 -0.08560305 -0.06603581 0.02315592  723  TYR   A H    
10339 H  HA   . TYR   A  668 ? 0.22301166 0.32941437 0.25623906 -0.07839895 -0.05713548 0.02367200  723  TYR   A HA   
10340 H  HB2  . TYR   A  668 ? 0.23011982 0.31817004 0.24662632 -0.07484782 -0.06596772 0.02489538  723  TYR   A HB2  
10341 H  HB3  . TYR   A  668 ? 0.22547016 0.31274360 0.24286681 -0.07165458 -0.06039998 0.02534956  723  TYR   A HB3  
10342 H  HD1  . TYR   A  668 ? 0.24428499 0.33521584 0.26497415 -0.08543105 -0.05382146 0.02494076  723  TYR   A HD1  
10343 H  HD2  . TYR   A  668 ? 0.23827794 0.30394644 0.23581830 -0.07786337 -0.06308099 0.02599927  723  TYR   A HD2  
10344 H  HE1  . TYR   A  668 ? 0.28463972 0.35864967 0.29243004 -0.09241210 -0.05082468 0.02615182  723  TYR   A HE1  
10345 H  HE2  . TYR   A  668 ? 0.27287292 0.32457098 0.25997519 -0.08399514 -0.05919034 0.02594243  723  TYR   A HE2  
10347 N  N    . ALA   A  669 ? 0.25446805 0.37186688 0.29581490 -0.07059074 -0.07060181 0.02266289  724  ALA   A N    
10348 C  CA   . ALA   A  669 ? 0.21775858 0.34458423 0.26740652 -0.06470267 -0.07455014 0.02201380  724  ALA   A CA   
10349 C  C    . ALA   A  669 ? 0.20671299 0.35044107 0.27111423 -0.06512173 -0.07212475 0.02016444  724  ALA   A C    
10350 O  O    . ALA   A  669 ? 0.16727081 0.31735855 0.23833747 -0.05888013 -0.07121674 0.01935185  724  ALA   A O    
10351 C  CB   . ALA   A  669 ? 0.20775031 0.33499303 0.25603214 -0.06480864 -0.08218492 0.02211419  724  ALA   A CB   
10352 H  H    . ALA   A  669 ? 0.24791828 0.36071762 0.28447634 -0.07362579 -0.07267832 0.02286868  724  ALA   A H    
10353 H  HA   . ALA   A  669 ? 0.21953350 0.34131873 0.26589122 -0.05998786 -0.07385568 0.02266812  724  ALA   A HA   
10354 H  HB1  . ALA   A  669 ? 0.21319517 0.34655875 0.26706362 -0.06049636 -0.08505911 0.02180049  724  ALA   A HB1  
10355 H  HB2  . ALA   A  669 ? 0.21460715 0.33128500 0.25318557 -0.06438346 -0.08335017 0.02322292  724  ALA   A HB2  
10356 H  HB3  . ALA   A  669 ? 0.21287432 0.34472960 0.26418728 -0.06965429 -0.08312258 0.02133692  724  ALA   A HB3  
10357 N  N    . SER   A  670 ? 0.20786192 0.35838360 0.27698261 -0.07261816 -0.07068062 0.01940432  725  SER   A N    
10358 C  CA   . SER   A  670 ? 0.27339208 0.44093031 0.35662413 -0.07428416 -0.06759676 0.01765344  725  SER   A CA   
10359 C  C    . SER   A  670 ? 0.22539042 0.39344162 0.30937722 -0.07231622 -0.06009929 0.01742461  725  SER   A C    
10360 O  O    . SER   A  670 ? 0.27645150 0.45769361 0.37148637 -0.06900818 -0.05790858 0.01566761  725  SER   A O    
10361 C  CB   . SER   A  670 ? 0.23215339 0.40588179 0.31941849 -0.08377751 -0.06725206 0.01718022  725  SER   A CB   
10362 O  OG   . SER   A  670 ? 0.34265354 0.51491320 0.42811990 -0.08600653 -0.07430108 0.01710862  725  SER   A OG   
10363 H  H    . SER   A  670 ? 0.22235195 0.36689961 0.28585511 -0.07683476 -0.07153487 0.01992043  725  SER   A H    
10364 H  HA   . SER   A  670 ? 0.24176022 0.41773957 0.33236372 -0.07034021 -0.07082827 0.01670967  725  SER   A HA   
10365 H  HB2  . SER   A  670 ? 0.26243791 0.42833316 0.34309119 -0.08753940 -0.06383619 0.01808953  725  SER   A HB2  
10366 H  HB3  . SER   A  670 ? 0.26145923 0.44790560 0.35899740 -0.08473103 -0.06551982 0.01596076  725  SER   A HB3  
10368 N  N    . GLU   A  671 ? 0.23394914 0.38761091 0.30599219 -0.07388359 -0.05648031 0.01899674  726  GLU   A N    
10369 C  CA   . GLU   A  671 ? 0.21881548 0.37125903 0.28953519 -0.07295014 -0.04959993 0.01892886  726  GLU   A CA   
10370 C  C    . GLU   A  671 ? 0.23739132 0.38600677 0.30636019 -0.06416759 -0.04929468 0.01856149  726  GLU   A C    
10371 O  O    . GLU   A  671 ? 0.28798476 0.44102603 0.36031628 -0.06152298 -0.04456054 0.01738797  726  GLU   A O    
10372 C  CB   . GLU   A  671 ? 0.23236102 0.37096983 0.29115134 -0.07813346 -0.04649901 0.02077722  726  GLU   A CB   
10373 C  CG   . GLU   A  671 ? 0.29742438 0.43884772 0.35748750 -0.08725966 -0.04519267 0.02115634  726  GLU   A CG   
10374 C  CD   . GLU   A  671 ? 0.31125256 0.43753904 0.35903758 -0.09170713 -0.04343759 0.02302001  726  GLU   A CD   
10375 O  OE1  . GLU   A  671 ? 0.34169245 0.45557779 0.38017684 -0.08819400 -0.04477915 0.02388733  726  GLU   A OE1  
10376 O  OE2  . GLU   A  671 ? 0.46051228 0.58725393 0.50799930 -0.09867050 -0.04082290 0.02363962  726  GLU   A OE2  
10377 H  H    . GLU   A  671 ? 0.23056847 0.37507671 0.29503906 -0.07554936 -0.05842019 0.02003610  726  GLU   A H    
10378 H  HA   . GLU   A  671 ? 0.22663251 0.38984749 0.30533922 -0.07488751 -0.04706026 0.01782892  726  GLU   A HA   
10379 H  HB2  . GLU   A  671 ? 0.24287882 0.37207609 0.29459915 -0.07695585 -0.04924129 0.02167244  726  GLU   A HB2  
10380 H  HB3  . GLU   A  671 ? 0.24043939 0.37673479 0.29702669 -0.07653801 -0.04265333 0.02086035  726  GLU   A HB3  
10381 H  HG2  . GLU   A  671 ? 0.28303462 0.43320030 0.34922752 -0.08886912 -0.04177195 0.02048616  726  GLU   A HG2  
10382 H  HG3  . GLU   A  671 ? 0.28445250 0.42956018 0.34778315 -0.08895218 -0.04903946 0.02073931  726  GLU   A HG3  
10383 N  N    . ARG   A  672 ? 0.22711797 0.36634776 0.28967237 -0.05994835 -0.05425069 0.01959921  727  ARG   A N    
10384 C  CA   . ARG   A  672 ? 0.24406773 0.37545341 0.30182588 -0.05280989 -0.05395545 0.01984526  727  ARG   A CA   
10385 C  C    . ARG   A  672 ? 0.24715722 0.38474616 0.31188464 -0.04538868 -0.05857220 0.01884076  727  ARG   A C    
10386 O  O    . ARG   A  672 ? 0.20583476 0.33648115 0.26677418 -0.03922490 -0.05891391 0.01902845  727  ARG   A O    
10387 C  CB   . ARG   A  672 ? 0.27987975 0.39436492 0.32372928 -0.05380713 -0.05509419 0.02207045  727  ARG   A CB   
10388 C  CG   . ARG   A  672 ? 0.29794881 0.40588671 0.33534837 -0.05903301 -0.04983075 0.02277482  727  ARG   A CG   
10389 C  CD   . ARG   A  672 ? 0.27871683 0.37173405 0.30374789 -0.06049780 -0.05079315 0.02460261  727  ARG   A CD   
10390 N  NE   . ARG   A  672 ? 0.30841130 0.39283478 0.32761592 -0.05497885 -0.05175636 0.02532890  727  ARG   A NE   
10391 C  CZ   . ARG   A  672 ? 0.27857161 0.35094947 0.28769025 -0.05541205 -0.05222129 0.02676990  727  ARG   A CZ   
10392 N  NH1  . ARG   A  672 ? 0.35282409 0.42016459 0.35660142 -0.06028419 -0.05195427 0.02738020  727  ARG   A NH1  
10393 N  NH2  . ARG   A  672 ? 0.26596025 0.33119407 0.27036798 -0.05089349 -0.05291100 0.02749373  727  ARG   A NH2  
10394 H  H    . ARG   A  672 ? 0.23532519 0.37268746 0.29606095 -0.06178391 -0.05787616 0.02017931  727  ARG   A H    
10395 H  HA   . ARG   A  672 ? 0.24560475 0.37821788 0.30421382 -0.05236076 -0.04955420 0.01915685  727  ARG   A HA   
10396 H  HB2  . ARG   A  672 ? 0.27660483 0.38963842 0.31867993 -0.05552006 -0.05875492 0.02268554  727  ARG   A HB2  
10397 H  HB3  . ARG   A  672 ? 0.27612513 0.38529021 0.31679595 -0.04928244 -0.05572465 0.02239659  727  ARG   A HB3  
10398 H  HG2  . ARG   A  672 ? 0.28841650 0.39685327 0.32645214 -0.05715876 -0.04644112 0.02223297  727  ARG   A HG2  
10399 H  HG3  . ARG   A  672 ? 0.28787571 0.40114775 0.32868785 -0.06349733 -0.04896439 0.02247246  727  ARG   A HG3  
10400 H  HD2  . ARG   A  672 ? 0.28976852 0.37950629 0.31164643 -0.06350580 -0.04765738 0.02493156  727  ARG   A HD2  
10401 H  HD3  . ARG   A  672 ? 0.29159617 0.38386631 0.31543383 -0.06253523 -0.05389944 0.02493804  727  ARG   A HD3  
10402 H  HE   . ARG   A  672 ? 0.29372942 0.38113171 0.31634074 -0.05126705 -0.05195492 0.02473352  727  ARG   A HE   
10403 H  HH11 . ARG   A  672 ? 0.32746124 0.39712125 0.33239678 -0.06251374 -0.05396284 0.02722168  727  ARG   A HH11 
10404 H  HH12 . ARG   A  672 ? 0.32637060 0.38795668 0.32546479 -0.06119034 -0.04988793 0.02783828  727  ARG   A HH12 
10405 H  HH21 . ARG   A  672 ? 0.27185732 0.32977188 0.26992756 -0.05142471 -0.05306685 0.02842774  727  ARG   A HH21 
10406 H  HH22 . ARG   A  672 ? 0.27159470 0.33935928 0.27923188 -0.04744942 -0.05317901 0.02699617  727  ARG   A HH22 
10407 N  N    . ASN   A  673 ? 0.20300025 0.35465139 0.27895528 -0.04597119 -0.06175307 0.01753441  728  ASN   A N    
10408 C  CA   . ASN   A  673 ? 0.22182754 0.38057214 0.30544835 -0.03892757 -0.06712675 0.01657282  728  ASN   A CA   
10409 C  C    . ASN   A  673 ? 0.21537036 0.36055768 0.28821778 -0.03650159 -0.07332752 0.01896848  728  ASN   A C    
10410 O  O    . ASN   A  673 ? 0.23665723 0.37540859 0.30636054 -0.02959908 -0.07565941 0.01953483  728  ASN   A O    
10411 C  CB   . ASN   A  673 ? 0.18901685 0.35255468 0.27879176 -0.03163789 -0.06411728 0.01455718  728  ASN   A CB   
10412 C  CG   . ASN   A  673 ? 0.19522697 0.36995023 0.29636040 -0.02450313 -0.06907281 0.01286719  728  ASN   A CG   
10413 O  OD1  . ASN   A  673 ? 0.20528063 0.38605529 0.31098056 -0.02510321 -0.07518058 0.01319504  728  ASN   A OD1  
10414 N  ND2  . ASN   A  673 ? 0.21778801 0.39580846 0.32395327 -0.01747969 -0.06661027 0.01076202  728  ASN   A ND2  
10415 H  H    . ASN   A  673 ? 0.21531339 0.37238079 0.29438746 -0.05102599 -0.06068602 0.01724022  728  ASN   A H    
10416 H  HA   . ASN   A  673 ? 0.20966204 0.37924492 0.30148298 -0.04095251 -0.06898922 0.01562473  728  ASN   A HA   
10417 H  HB2  . ASN   A  673 ? 0.19390854 0.36376610 0.28779706 -0.03411313 -0.05918355 0.01328848  728  ASN   A HB2  
10418 H  HB3  . ASN   A  673 ? 0.19826128 0.35068905 0.27997836 -0.02905743 -0.06339601 0.01550083  728  ASN   A HB3  
10419 H  HD21 . ASN   A  673 ? 0.20950958 0.38307601 0.31195778 -0.01747178 -0.06222114 0.01041856  728  ASN   A HD21 
10420 H  HD22 . ASN   A  673 ? 0.21305066 0.39763850 0.32625383 -0.01261540 -0.06945183 0.00957278  728  ASN   A HD22 
10421 N  N    . GLY   A  674 ? 0.22739238 0.36804035 0.29418057 -0.04259482 -0.07586166 0.02030747  729  GLY   A N    
10422 C  CA   . GLY   A  674 ? 0.22139180 0.34937412 0.27675617 -0.04169834 -0.08110379 0.02251532  729  GLY   A CA   
10423 C  C    . GLY   A  674 ? 0.21353859 0.32534361 0.25520110 -0.04329948 -0.07731134 0.02426577  729  GLY   A C    
10424 O  O    . GLY   A  674 ? 0.21944278 0.32852042 0.26024756 -0.04244684 -0.07173792 0.02394210  729  GLY   A O    
10425 H  H    . GLY   A  674 ? 0.21990688 0.36541671 0.28954023 -0.04760330 -0.07416719 0.01974910  729  GLY   A H    
10426 H  HA2  . GLY   A  674 ? 0.22456029 0.35477120 0.27998945 -0.04543741 -0.08395594 0.02255163  729  GLY   A HA2  
10427 H  HA3  . GLY   A  674 ? 0.22722900 0.35516873 0.28373471 -0.03632093 -0.08456634 0.02277874  729  GLY   A HA3  
10428 N  N    . VAL   A  675 ? 0.25471330 0.35634285 0.28573442 -0.04573469 -0.08044164 0.02592469  730  VAL   A N    
10429 C  CA   . VAL   A  675 ? 0.21327052 0.30007315 0.23144875 -0.04677144 -0.07766858 0.02756904  730  VAL   A CA   
10430 C  C    . VAL   A  675 ? 0.24890578 0.32605898 0.25703615 -0.04492891 -0.08289374 0.02951853  730  VAL   A C    
10431 O  O    . VAL   A  675 ? 0.27177709 0.35216838 0.28026605 -0.04587209 -0.08837845 0.02952712  730  VAL   A O    
10432 C  CB   . VAL   A  675 ? 0.19866210 0.28152555 0.21216977 -0.05375438 -0.07360027 0.02733355  730  VAL   A CB   
10433 C  CG1  . VAL   A  675 ? 0.19115975 0.28046355 0.21157503 -0.05585470 -0.06763604 0.02607525  730  VAL   A CG1  
10434 C  CG2  . VAL   A  675 ? 0.23592240 0.32075888 0.24840528 -0.05876076 -0.07758927 0.02687397  730  VAL   A CG2  
10435 H  H    . VAL   A  675 ? 0.23754960 0.34199166 0.26948071 -0.04682830 -0.08444732 0.02589266  730  VAL   A H    
10436 H  HA   . VAL   A  675 ? 0.22210392 0.30681223 0.24039507 -0.04390963 -0.07498176 0.02762914  730  VAL   A HA   
10437 H  HB   . VAL   A  675 ? 0.20728941 0.28071618 0.21263660 -0.05357776 -0.07230572 0.02837799  730  VAL   A HB   
10438 H  HG11 . VAL   A  675 ? 0.19088140 0.29012448 0.21973872 -0.05612213 -0.06836861 0.02498487  730  VAL   A HG11 
10439 H  HG12 . VAL   A  675 ? 0.19034174 0.27715939 0.21001883 -0.05283484 -0.06524151 0.02624876  730  VAL   A HG12 
10440 H  HG13 . VAL   A  675 ? 0.19049346 0.27629569 0.20732470 -0.05999146 -0.06558248 0.02617215  730  VAL   A HG13 
10441 H  HG21 . VAL   A  675 ? 0.22341259 0.30632263 0.23407193 -0.06289870 -0.07496592 0.02650650  730  VAL   A HG21 
10442 H  HG22 . VAL   A  675 ? 0.22955793 0.30811310 0.23516712 -0.05793450 -0.08050078 0.02777034  730  VAL   A HG22 
10443 H  HG23 . VAL   A  675 ? 0.22545159 0.31960323 0.24581215 -0.05865210 -0.07987387 0.02598061  730  VAL   A HG23 
10444 N  N    . ASN   A  676 ? 0.23945707 0.30467427 0.23814496 -0.04293292 -0.08096593 0.03116229  731  ASN   A N    
10445 C  CA   . ASN   A  676 ? 0.28436309 0.33819064 0.27066904 -0.04314698 -0.08381833 0.03324265  731  ASN   A CA   
10446 C  C    . ASN   A  676 ? 0.30069086 0.34772551 0.27937859 -0.04853665 -0.07957190 0.03312857  731  ASN   A C    
10447 O  O    . ASN   A  676 ? 0.24761426 0.29298490 0.22689509 -0.04962111 -0.07417398 0.03265683  731  ASN   A O    
10448 C  CB   . ASN   A  676 ? 0.29047078 0.33540952 0.27128947 -0.03793133 -0.08426881 0.03522122  731  ASN   A CB   
10449 C  CG   . ASN   A  676 ? 0.32859251 0.36129582 0.29575226 -0.03891151 -0.08608610 0.03764226  731  ASN   A CG   
10450 O  OD1  . ASN   A  676 ? 0.29841655 0.32242095 0.25765914 -0.04120246 -0.08182065 0.03841912  731  ASN   A OD1  
10451 N  ND2  . ASN   A  676 ? 0.26474649 0.29688561 0.22861049 -0.03753367 -0.09239534 0.03884424  731  ASN   A ND2  
10452 H  H    . ASN   A  676 ? 0.24690723 0.31119832 0.24685596 -0.04157894 -0.07760131 0.03093528  731  ASN   A H    
10453 H  HA   . ASN   A  676 ? 0.28269741 0.33891591 0.26899916 -0.04330451 -0.08822660 0.03336444  731  ASN   A HA   
10454 H  HB2  . ASN   A  676 ? 0.29934675 0.34828746 0.28498617 -0.03411198 -0.08740833 0.03520364  731  ASN   A HB2  
10455 H  HB3  . ASN   A  676 ? 0.29304725 0.33643845 0.27472600 -0.03766231 -0.08016866 0.03484255  731  ASN   A HB3  
10456 H  HD21 . ASN   A  676 ? 0.28430027 0.32353640 0.25419050 -0.03666947 -0.09534220 0.03801157  731  ASN   A HD21 
10457 H  HD22 . ASN   A  676 ? 0.28969482 0.31447592 0.24523169 -0.03757473 -0.09371772 0.04050310  731  ASN   A HD22 
10458 N  N    . VAL   A  677 ? 0.24525434 0.28784955 0.21616876 -0.05142981 -0.08233971 0.03351286  732  VAL   A N    
10459 C  CA   . VAL   A  677 ? 0.24699996 0.28328198 0.21051496 -0.05609718 -0.07910045 0.03299133  732  VAL   A CA   
10460 C  C    . VAL   A  677 ? 0.29681918 0.32223344 0.24749926 -0.05565279 -0.08010538 0.03474576  732  VAL   A C    
10461 O  O    . VAL   A  677 ? 0.26487827 0.28887868 0.21133962 -0.05418923 -0.08522667 0.03586695  732  VAL   A O    
10462 C  CB   . VAL   A  677 ? 0.22859795 0.26995105 0.19446625 -0.06066873 -0.08123809 0.03112089  732  VAL   A CB   
10463 C  CG1  . VAL   A  677 ? 0.24330564 0.27726299 0.20112815 -0.06485675 -0.07837477 0.03025281  732  VAL   A CG1  
10464 C  CG2  . VAL   A  677 ? 0.24619731 0.29895005 0.22481878 -0.06176415 -0.08019583 0.02964570  732  VAL   A CG2  
10465 H  H    . VAL   A  677 ? 0.26358849 0.30705515 0.23359621 -0.05023705 -0.08659604 0.03400939  732  VAL   A H    
10466 H  HA   . VAL   A  677 ? 0.24545300 0.28107208 0.21051112 -0.05663302 -0.07499807 0.03265828  732  VAL   A HA   
10467 H  HB   . VAL   A  677 ? 0.24398452 0.28604746 0.20809442 -0.06006280 -0.08566577 0.03141408  732  VAL   A HB   
10468 H  HG11 . VAL   A  677 ? 0.23485319 0.26679030 0.19301882 -0.06492195 -0.07431818 0.03029755  732  VAL   A HG11 
10469 H  HG12 . VAL   A  677 ? 0.24422565 0.27232307 0.19419107 -0.06451461 -0.07959907 0.03090096  732  VAL   A HG12 
10470 H  HG13 . VAL   A  677 ? 0.23939583 0.27637249 0.19942608 -0.06783234 -0.07940745 0.02891900  732  VAL   A HG13 
10471 H  HG21 . VAL   A  677 ? 0.23943871 0.29457033 0.21909869 -0.06526419 -0.08127271 0.02853218  732  VAL   A HG21 
10472 H  HG22 . VAL   A  677 ? 0.23916391 0.29746836 0.22321180 -0.05891855 -0.08260989 0.02985303  732  VAL   A HG22 
10473 H  HG23 . VAL   A  677 ? 0.23416385 0.28631052 0.21439546 -0.06189545 -0.07604109 0.02955932  732  VAL   A HG23 
10474 N  N    . ILE   A  678 ? 0.25909385 0.27736911 0.20374778 -0.05705616 -0.07523279 0.03497897  733  ILE   A N    
10475 C  CA   . ILE   A  678 ? 0.23160017 0.24062485 0.16424692 -0.05799445 -0.07488505 0.03611125  733  ILE   A CA   
10476 C  C    . ILE   A  678 ? 0.20869692 0.21556848 0.13825938 -0.06193974 -0.07126746 0.03415598  733  ILE   A C    
10477 O  O    . ILE   A  678 ? 0.22295809 0.23059881 0.15651271 -0.06270047 -0.06692333 0.03331222  733  ILE   A O    
10478 C  CB   . ILE   A  678 ? 0.28418481 0.28669289 0.21261561 -0.05552845 -0.07264310 0.03831692  733  ILE   A CB   
10479 C  CG1  . ILE   A  678 ? 0.35237262 0.35644975 0.28467512 -0.05113283 -0.07620386 0.03989965  733  ILE   A CG1  
10480 C  CG2  . ILE   A  678 ? 0.30752480 0.30117983 0.22320098 -0.05710291 -0.07217409 0.03966685  733  ILE   A CG2  
10481 C  CD1  . ILE   A  678 ? 0.48744711 0.48391750 0.41586721 -0.04878444 -0.07390243 0.04202314  733  ILE   A CD1  
10482 H  H    . ILE   A  678 ? 0.25205037 0.27169627 0.20041160 -0.05747932 -0.07193533 0.03436079  733  ILE   A H    
10483 H  HA   . ILE   A  678 ? 0.24771106 0.25617456 0.17687362 -0.05783881 -0.07867623 0.03658210  733  ILE   A HA   
10484 H  HB   . ILE   A  678 ? 0.28049827 0.28335297 0.21187335 -0.05593148 -0.06889663 0.03770957  733  ILE   A HB   
10485 H  HG12 . ILE   A  678 ? 0.36254874 0.36594200 0.29160959 -0.05051787 -0.08025022 0.04070592  733  ILE   A HG12 
10486 H  HG13 . ILE   A  678 ? 0.35088062 0.36146104 0.29151738 -0.05019642 -0.07625461 0.03875561  733  ILE   A HG13 
10487 H  HG21 . ILE   A  678 ? 0.30950013 0.30213791 0.22132671 -0.05664649 -0.07597288 0.04048743  733  ILE   A HG21 
10488 H  HG22 . ILE   A  678 ? 0.30133864 0.29437447 0.21491158 -0.05955496 -0.06988584 0.03828824  733  ILE   A HG22 
10489 H  HG23 . ILE   A  678 ? 0.30510902 0.29474640 0.21845891 -0.05617470 -0.07036728 0.04103381  733  ILE   A HG23 
10490 H  HD11 . ILE   A  678 ? 0.44751322 0.43783432 0.36774391 -0.04957115 -0.07445163 0.04351409  733  ILE   A HD11 
10491 H  HD12 . ILE   A  678 ? 0.43782464 0.43433100 0.36817205 -0.04984196 -0.06994824 0.04121211  733  ILE   A HD12 
10492 H  HD13 . ILE   A  678 ? 0.44438189 0.44223493 0.37657893 -0.04560302 -0.07599059 0.04257557  733  ILE   A HD13 
10493 N  N    . SER   A  679 ? 0.23918274 0.24282870 0.16106190 -0.06416436 -0.07330388 0.03337001  734  SER   A N    
10494 C  CA   . SER   A  679 ? 0.23754254 0.23852101 0.15597594 -0.06742761 -0.07049013 0.03107679  734  SER   A CA   
10495 C  C    . SER   A  679 ? 0.25203538 0.24538338 0.15824157 -0.06810407 -0.06952012 0.03127427  734  SER   A C    
10496 O  O    . SER   A  679 ? 0.27261531 0.26312551 0.17214073 -0.06710292 -0.07247016 0.03303824  734  SER   A O    
10497 C  CB   . SER   A  679 ? 0.22788385 0.23294869 0.14935471 -0.07012915 -0.07379653 0.02892406  734  SER   A CB   
10498 O  OG   . SER   A  679 ? 0.24699710 0.26036280 0.17987482 -0.06964093 -0.07493889 0.02902298  734  SER   A OG   
10499 H  H    . SER   A  679 ? 0.23853081 0.24130075 0.15688604 -0.06346986 -0.07668620 0.03420524  734  SER   A H    
10500 H  HA   . SER   A  679 ? 0.23164436 0.23291165 0.15349586 -0.06750779 -0.06696539 0.03072117  734  SER   A HA   
10501 H  HB2  . SER   A  679 ? 0.24241945 0.24653181 0.15934448 -0.07035638 -0.07728098 0.02899637  734  SER   A HB2  
10502 H  HB3  . SER   A  679 ? 0.23629957 0.23913753 0.15617502 -0.07211038 -0.07170432 0.02730528  734  SER   A HB3  
10504 N  N    . GLY   A  680 ? 0.24880992 0.23883229 0.15190831 -0.06971774 -0.06526164 0.02946105  735  GLY   A N    
10505 C  CA   . GLY   A  680 ? 0.29652625 0.28047508 0.18855041 -0.07048958 -0.06360454 0.02912670  735  GLY   A CA   
10506 C  C    . GLY   A  680 ? 0.25021580 0.23201752 0.14122871 -0.07170276 -0.05891307 0.02642824  735  GLY   A C    
10507 O  O    . GLY   A  680 ? 0.23670803 0.22082260 0.13508981 -0.07190616 -0.05726996 0.02523225  735  GLY   A O    
10508 H  H    . GLY   A  680 ? 0.25212812 0.24374887 0.15994631 -0.07026437 -0.06334813 0.02839627  735  GLY   A H    
10509 H  HA2  . GLY   A  680 ? 0.28118515 0.26409525 0.16838142 -0.07130961 -0.06670146 0.02866939  735  GLY   A HA2  
10510 H  HA3  . GLY   A  680 ? 0.27586865 0.25801811 0.16549021 -0.06937663 -0.06258436 0.03110188  735  GLY   A HA3  
10511 N  N    . PRO   A  681 ? 0.22848448 0.20570862 0.10983355 -0.07240694 -0.05679787 0.02543509  736  PRO   A N    
10512 C  CA   . PRO   A  681 ? 0.26398617 0.23918468 0.14371596 -0.07289829 -0.05240343 0.02250085  736  PRO   A CA   
10513 C  C    . PRO   A  681 ? 0.29371679 0.26971301 0.17675950 -0.07169680 -0.04740096 0.02361511  736  PRO   A C    
10514 O  O    . PRO   A  681 ? 0.31672680 0.29254279 0.19837399 -0.07121124 -0.04680403 0.02648250  736  PRO   A O    
10515 C  CB   . PRO   A  681 ? 0.25636640 0.22732005 0.12407035 -0.07400474 -0.05255317 0.02113176  736  PRO   A CB   
10516 C  CG   . PRO   A  681 ? 0.25651839 0.22648534 0.11898828 -0.07372534 -0.05433823 0.02497374  736  PRO   A CG   
10517 C  CD   . PRO   A  681 ? 0.26337558 0.23716888 0.13452406 -0.07261167 -0.05854902 0.02718022  736  PRO   A CD   
10518 H  HA   . PRO   A  681 ? 0.25577861 0.23165882 0.13924146 -0.07338125 -0.05302576 0.02074404  736  PRO   A HA   
10519 H  HB2  . PRO   A  681 ? 0.26090631 0.23051065 0.12611708 -0.07392194 -0.04886694 0.01958909  736  PRO   A HB2  
10520 H  HB3  . PRO   A  681 ? 0.26335019 0.23345304 0.12904572 -0.07495659 -0.05533783 0.01950420  736  PRO   A HB3  
10521 H  HG2  . PRO   A  681 ? 0.25985253 0.22931813 0.12163911 -0.07339514 -0.05107960 0.02614906  736  PRO   A HG2  
10522 H  HG3  . PRO   A  681 ? 0.26902044 0.23647550 0.12365788 -0.07459972 -0.05613054 0.02466568  736  PRO   A HG3  
10523 H  HD2  . PRO   A  681 ? 0.25374353 0.22749621 0.12559105 -0.07161722 -0.05829103 0.02968699  736  PRO   A HD2  
10524 H  HD3  . PRO   A  681 ? 0.25900748 0.23298146 0.12824890 -0.07306042 -0.06256451 0.02708612  736  PRO   A HD3  
10525 N  N    . ILE   A  682 ? 0.27488172 0.25114363 0.16155116 -0.07132626 -0.04409607 0.02121456  737  ILE   A N    
10526 C  CA   . ILE   A  682 ? 0.28074616 0.25791776 0.16937864 -0.07041329 -0.03925874 0.02134453  737  ILE   A CA   
10527 C  C    . ILE   A  682 ? 0.25653082 0.23201507 0.14102682 -0.07022544 -0.03590038 0.01772771  737  ILE   A C    
10528 O  O    . ILE   A  682 ? 0.25711867 0.23057038 0.14099650 -0.07019232 -0.03704784 0.01480129  737  ILE   A O    
10529 C  CB   . ILE   A  682 ? 0.24608150 0.22622472 0.14480688 -0.06935822 -0.03876633 0.02222666  737  ILE   A CB   
10530 C  CG1  . ILE   A  682 ? 0.24282588 0.22476748 0.14474410 -0.06896876 -0.04016847 0.02569191  737  ILE   A CG1  
10531 C  CG2  . ILE   A  682 ? 0.28677991 0.26784232 0.18823712 -0.06835197 -0.03434767 0.02076920  737  ILE   A CG2  
10532 C  CD1  . ILE   A  682 ? 0.23803645 0.22271284 0.14814615 -0.06829057 -0.04120778 0.02634513  737  ILE   A CD1  
10533 H  H    . ILE   A  682 ? 0.27995294 0.25577444 0.16800781 -0.07167311 -0.04509246 0.01943732  737  ILE   A H    
10534 H  HA   . ILE   A  682 ? 0.26982731 0.24680850 0.15572663 -0.07063036 -0.03863075 0.02323489  737  ILE   A HA   
10535 H  HB   . ILE   A  682 ? 0.25638127 0.23655118 0.15761767 -0.06957293 -0.04059138 0.02128171  737  ILE   A HB   
10536 H  HG12 . ILE   A  682 ? 0.24352658 0.22537231 0.14463566 -0.06883274 -0.03790592 0.02660231  737  ILE   A HG12 
10537 H  HG13 . ILE   A  682 ? 0.24789402 0.22898333 0.14640236 -0.06934479 -0.04264869 0.02663196  737  ILE   A HG13 
10538 H  HG21 . ILE   A  682 ? 0.27406305 0.25532341 0.17266464 -0.06857722 -0.03229523 0.02130695  737  ILE   A HG21 
10539 H  HG22 . ILE   A  682 ? 0.27441660 0.25422126 0.17487626 -0.06807616 -0.03383814 0.01837928  737  ILE   A HG22 
10540 H  HG23 . ILE   A  682 ? 0.26659015 0.24932934 0.17364502 -0.06776333 -0.03418528 0.02164637  737  ILE   A HG23 
10541 H  HD11 . ILE   A  682 ? 0.23362401 0.21889299 0.14672747 -0.06785702 -0.03898510 0.02573961  737  ILE   A HD11 
10542 H  HD12 . ILE   A  682 ? 0.23754773 0.22257611 0.14875078 -0.06880480 -0.04319207 0.02544729  737  ILE   A HD12 
10543 H  HD13 . ILE   A  682 ? 0.23582178 0.22140300 0.14738141 -0.06778687 -0.04219370 0.02825560  737  ILE   A HD13 
10544 N  N    . PHE   A  683 ? 0.23674241 0.21316466 0.11876459 -0.07013379 -0.03165946 0.01784331  738  PHE   A N    
10545 C  CA   . PHE   A  683 ? 0.22423339 0.20061332 0.10354646 -0.06943703 -0.02763132 0.01422627  738  PHE   A CA   
10546 C  C    . PHE   A  683 ? 0.25666219 0.23720950 0.14355308 -0.06823221 -0.02380029 0.01439178  738  PHE   A C    
10547 O  O    . PHE   A  683 ? 0.30415744 0.28672352 0.19087924 -0.06932695 -0.02181662 0.01685581  738  PHE   A O    
10548 C  CB   . PHE   A  683 ? 0.23718116 0.21207932 0.10583630 -0.07087771 -0.02547365 0.01372669  738  PHE   A CB   
10549 C  CG   . PHE   A  683 ? 0.30477560 0.27564150 0.16511996 -0.07224918 -0.02975092 0.01412802  738  PHE   A CG   
10550 C  CD1  . PHE   A  683 ? 0.36520022 0.33510593 0.22295065 -0.07346544 -0.03307397 0.01826673  738  PHE   A CD1  
10551 C  CD2  . PHE   A  683 ? 0.33354849 0.30121005 0.18827364 -0.07219611 -0.03082446 0.01023933  738  PHE   A CD2  
10552 C  CE1  . PHE   A  683 ? 0.31248960 0.27912098 0.16270049 -0.07452627 -0.03775521 0.01867739  738  PHE   A CE1  
10553 C  CE2  . PHE   A  683 ? 0.36421782 0.32833433 0.21088307 -0.07376242 -0.03535406 0.01051717  738  PHE   A CE2  
10554 C  CZ   . PHE   A  683 ? 0.31678146 0.28087541 0.16165447 -0.07486186 -0.03891267 0.01483093  738  PHE   A CZ   
10555 H  H    . PHE   A  683 ? 0.23668745 0.21395922 0.11890246 -0.07053905 -0.03120652 0.02018397  738  PHE   A H    
10556 H  HA   . PHE   A  683 ? 0.23601277 0.21075746 0.11572635 -0.06876364 -0.02871003 0.01185012  738  PHE   A HA   
10557 H  HB2  . PHE   A  683 ? 0.24793653 0.22422090 0.11628531 -0.07170767 -0.02387754 0.01600096  738  PHE   A HB2  
10558 H  HB3  . PHE   A  683 ? 0.25134188 0.22662340 0.11869318 -0.07012866 -0.02269403 0.01079935  738  PHE   A HB3  
10559 H  HD1  . PHE   A  683 ? 0.32963067 0.30096757 0.19081971 -0.07343045 -0.03244506 0.02073225  738  PHE   A HD1  
10560 H  HD2  . PHE   A  683 ? 0.33244261 0.30012667 0.18866885 -0.07103595 -0.02872348 0.00731312  738  PHE   A HD2  
10561 H  HE1  . PHE   A  683 ? 0.32502556 0.29104102 0.17382902 -0.07492522 -0.04030352 0.02148304  738  PHE   A HE1  
10562 H  HE2  . PHE   A  683 ? 0.35163620 0.31326661 0.19426021 -0.07392495 -0.03625556 0.00770493  738  PHE   A HE2  
10563 H  HZ   . PHE   A  683 ? 0.33327484 0.29531997 0.17298537 -0.07574126 -0.04230705 0.01501932  738  PHE   A HZ   
10564 N  N    . ASP   A  684 ? 0.27124995 0.25251299 0.16408584 -0.06615984 -0.02312953 0.01181260  739  ASP   A N    
10565 C  CA   . ASP   A  684 ? 0.28067195 0.26617935 0.18088230 -0.06467043 -0.02008401 0.01152270  739  ASP   A CA   
10566 C  C    . ASP   A  684 ? 0.30809635 0.29330948 0.21000139 -0.06197125 -0.01844386 0.00717085  739  ASP   A C    
10567 O  O    . ASP   A  684 ? 0.27011114 0.25496507 0.17830278 -0.06005261 -0.01969863 0.00659121  739  ASP   A O    
10568 C  CB   . ASP   A  684 ? 0.25469950 0.24140626 0.16240002 -0.06452032 -0.02226051 0.01435091  739  ASP   A CB   
10569 C  CG   . ASP   A  684 ? 0.31506431 0.30648097 0.22966714 -0.06352934 -0.01948289 0.01455394  739  ASP   A CG   
10570 O  OD1  . ASP   A  684 ? 0.23803809 0.23282301 0.15157978 -0.06397198 -0.01573742 0.01370428  739  ASP   A OD1  
10571 O  OD2  . ASP   A  684 ? 0.20308064 0.19508108 0.12390700 -0.06254936 -0.02102501 0.01545101  739  ASP   A OD2  
10572 H  H    . ASP   A  684 ? 0.27146611 0.25025487 0.16359870 -0.06570791 -0.02490061 0.01024180  739  ASP   A H    
10573 H  HA   . ASP   A  684 ? 0.27992642 0.26772192 0.17866202 -0.06555122 -0.01756493 0.01219883  739  ASP   A HA   
10574 H  HB2  . ASP   A  684 ? 0.27103868 0.25730067 0.17725381 -0.06586670 -0.02362493 0.01675578  739  ASP   A HB2  
10575 H  HB3  . ASP   A  684 ? 0.27030158 0.25512892 0.17986134 -0.06379179 -0.02430588 0.01367965  739  ASP   A HB3  
10576 N  N    . TYR   A  685 ? 0.29237044 0.27759176 0.18811418 -0.06175112 -0.01547669 0.00418365  740  TYR   A N    
10577 C  CA   . TYR   A  685 ? 0.29886085 0.28369907 0.19505461 -0.05871285 -0.01341589 -0.00061425 740  TYR   A CA   
10578 C  C    . TYR   A  685 ? 0.36056611 0.35141027 0.26590472 -0.05616411 -0.01058250 -0.00150756 740  TYR   A C    
10579 O  O    . TYR   A  685 ? 0.30338979 0.29283902 0.21207026 -0.05276965 -0.01089996 -0.00461495 740  TYR   A O    
10580 C  CB   . TYR   A  685 ? 0.36012712 0.34406722 0.24682590 -0.05915843 -0.01043898 -0.00381421 740  TYR   A CB   
10581 C  CG   . TYR   A  685 ? 0.33264554 0.30920190 0.21075282 -0.06031236 -0.01417634 -0.00493620 740  TYR   A CG   
10582 C  CD1  . TYR   A  685 ? 0.30433464 0.27551639 0.18146873 -0.05810448 -0.01589294 -0.00891333 740  TYR   A CD1  
10583 C  CD2  . TYR   A  685 ? 0.33328378 0.30787727 0.20479566 -0.06363023 -0.01667001 -0.00181717 740  TYR   A CD2  
10584 C  CE1  . TYR   A  685 ? 0.33552557 0.29999417 0.20508118 -0.05971014 -0.01963088 -0.01006491 740  TYR   A CE1  
10585 C  CE2  . TYR   A  685 ? 0.37774697 0.34643692 0.24226469 -0.06484898 -0.02067587 -0.00284580 740  TYR   A CE2  
10586 C  CZ   . TYR   A  685 ? 0.38717180 0.35097241 0.25073767 -0.06316724 -0.02207900 -0.00705751 740  TYR   A CZ   
10587 O  OH   . TYR   A  685 ? 0.35374385 0.31168878 0.21069857 -0.06495365 -0.02643749 -0.00814298 740  TYR   A OH   
10588 H  H    . TYR   A  685 ? 0.30216336 0.28740758 0.19286473 -0.06349287 -0.01472586 0.00515431  740  TYR   A H    
10589 H  HA   . TYR   A  685 ? 0.31830347 0.29901713 0.21482560 -0.05786343 -0.01617817 -0.00147279 740  TYR   A HA   
10590 H  HB2  . TYR   A  685 ? 0.33986950 0.32651326 0.22418386 -0.06110109 -0.00850308 -0.00205531 740  TYR   A HB2  
10591 H  HB3  . TYR   A  685 ? 0.34202701 0.32762289 0.23043579 -0.05680678 -0.00794202 -0.00701961 740  TYR   A HB3  
10592 H  HD1  . TYR   A  685 ? 0.31716490 0.28907192 0.19858712 -0.05548579 -0.01457078 -0.01100791 740  TYR   A HD1  
10593 H  HD2  . TYR   A  685 ? 0.33909416 0.31629395 0.21085873 -0.06506081 -0.01583755 0.00100898  740  TYR   A HD2  
10594 H  HE1  . TYR   A  685 ? 0.34408462 0.30430722 0.21275449 -0.05844461 -0.02081611 -0.01283433 740  TYR   A HE1  
10595 H  HE2  . TYR   A  685 ? 0.37055978 0.33833644 0.23092026 -0.06684867 -0.02265441 -0.00071120 740  TYR   A HE2  
10597 N  N    . ASN   A  686 ? 0.24771091 0.24465090 0.15687546 -0.05776810 -0.00825712 0.00109985  741  ASN   A N    
10598 C  CA   . ASN   A  686 ? 0.31433135 0.31770772 0.23296615 -0.05571415 -0.00626129 0.00042683  741  ASN   A CA   
10599 C  C    . ASN   A  686 ? 0.32254055 0.32571137 0.24827430 -0.05547885 -0.00967144 0.00345483  741  ASN   A C    
10600 O  O    . ASN   A  686 ? 0.35382408 0.36253789 0.28699574 -0.05448226 -0.00854557 0.00359169  741  ASN   A O    
10601 C  CB   . ASN   A  686 ? 0.30227998 0.31298378 0.22165877 -0.05785207 -0.00152017 0.00090812  741  ASN   A CB   
10602 C  CG   . ASN   A  686 ? 0.30887622 0.31869709 0.22516038 -0.06217739 -0.00226423 0.00567547  741  ASN   A CG   
10603 O  OD1  . ASN   A  686 ? 0.33201742 0.33627290 0.24550515 -0.06331180 -0.00629609 0.00854250  741  ASN   A OD1  
10604 N  ND2  . ASN   A  686 ? 0.37365210 0.38892061 0.29054484 -0.06465463 0.00157125  0.00654233  741  ASN   A ND2  
10605 H  H    . ASN   A  686 ? 0.28398535 0.28085101 0.18968832 -0.06023771 -0.00814134 0.00331949  741  ASN   A H    
10606 H  HA   . ASN   A  686 ? 0.30068943 0.30410320 0.22078516 -0.05287437 -0.00557550 -0.00276561 741  ASN   A HA   
10607 H  HB2  . ASN   A  686 ? 0.30407715 0.31963080 0.23031406 -0.05644932 -0.00040170 0.00015282  741  ASN   A HB2  
10608 H  HB3  . ASN   A  686 ? 0.31336507 0.32467932 0.22833937 -0.05779817 0.00108592  -0.00135205 741  ASN   A HB3  
10609 H  HD21 . ASN   A  686 ? 0.35288879 0.37287635 0.27230975 -0.06387048 0.00455590  0.00434012  741  ASN   A HD21 
10610 H  HD22 . ASN   A  686 ? 0.35138190 0.36566931 0.26623112 -0.06720056 0.00123102  0.00932092  741  ASN   A HD22 
10611 N  N    . TYR   A  687 ? 0.28564590 0.28283858 0.20908272 -0.05644291 -0.01380969 0.00562667  742  TYR   A N    
10612 C  CA   . TYR   A  687 ? 0.31568226 0.31183979 0.24442282 -0.05632323 -0.01700046 0.00825428  742  TYR   A CA   
10613 C  C    . TYR   A  687 ? 0.29495731 0.29660782 0.22962001 -0.05717054 -0.01594268 0.01051962  742  TYR   A C    
10614 O  O    . TYR   A  687 ? 0.28675735 0.28995278 0.22745648 -0.05546342 -0.01701998 0.01061671  742  TYR   A O    
10615 C  CB   . TYR   A  687 ? 0.32256791 0.31531632 0.25434855 -0.05312074 -0.01909254 0.00622054  742  TYR   A CB   
10616 C  CG   . TYR   A  687 ? 0.30712575 0.30288851 0.24273059 -0.04936069 -0.01691593 0.00256953  742  TYR   A CG   
10617 C  CD1  . TYR   A  687 ? 0.33294407 0.33403045 0.27637294 -0.04755042 -0.01654605 0.00288399  742  TYR   A CD1  
10618 C  CD2  . TYR   A  687 ? 0.34436923 0.33772549 0.27595153 -0.04729121 -0.01550473 -0.00150162 742  TYR   A CD2  
10619 C  CE1  . TYR   A  687 ? 0.30020285 0.30491644 0.24818686 -0.04356164 -0.01494014 -0.00063186 742  TYR   A CE1  
10620 C  CE2  . TYR   A  687 ? 0.32141566 0.31805015 0.25711760 -0.04317002 -0.01341019 -0.00526384 742  TYR   A CE2  
10621 C  CZ   . TYR   A  687 ? 0.33490258 0.33757788 0.27927238 -0.04119219 -0.01321808 -0.00474705 742  TYR   A CZ   
10622 O  OH   . TYR   A  687 ? 0.36104402 0.36765629 0.31040055 -0.03668615 -0.01157990 -0.00854001 742  TYR   A OH   
10623 H  H    . TYR   A  687 ? 0.30494699 0.29877543 0.22306457 -0.05734671 -0.01461264 0.00536821  742  TYR   A H    
10624 H  HA   . TYR   A  687 ? 0.30507720 0.29827651 0.23094408 -0.05797817 -0.01898794 0.01003748  742  TYR   A HA   
10625 H  HB2  . TYR   A  687 ? 0.31233719 0.30480132 0.24732763 -0.05327038 -0.02087380 0.00813544  742  TYR   A HB2  
10626 H  HB3  . TYR   A  687 ? 0.32046753 0.30860949 0.24822488 -0.05340169 -0.02055866 0.00550036  742  TYR   A HB3  
10627 H  HD1  . TYR   A  687 ? 0.31220213 0.31451741 0.25792870 -0.04890729 -0.01756692 0.00537199  742  TYR   A HD1  
10628 H  HD2  . TYR   A  687 ? 0.33492929 0.32464659 0.26091170 -0.04862532 -0.01595598 -0.00186462 742  TYR   A HD2  
10629 H  HE1  . TYR   A  687 ? 0.31127188 0.32003394 0.26482064 -0.04234827 -0.01502992 -0.00040956 742  TYR   A HE1  
10630 H  HE2  . TYR   A  687 ? 0.33754107 0.33236074 0.27030233 -0.04155513 -0.01231794 -0.00829531 742  TYR   A HE2  
10632 N  N    . ASP   A  688 ? 0.33919865 0.34305236 0.27135122 -0.06003165 -0.01410763 0.01241622  743  ASP   A N    
10633 C  CA   . ASP   A  688 ? 0.31028336 0.31853706 0.24714389 -0.06150695 -0.01308937 0.01444012  743  ASP   A CA   
10634 C  C    . ASP   A  688 ? 0.31742617 0.32214952 0.25248069 -0.06358106 -0.01572727 0.01810813  743  ASP   A C    
10635 O  O    . ASP   A  688 ? 0.26085290 0.26732692 0.19833517 -0.06518505 -0.01546209 0.02010793  743  ASP   A O    
10636 C  CB   . ASP   A  688 ? 0.28284854 0.29635882 0.21879466 -0.06331540 -0.00858319 0.01357006  743  ASP   A CB   
10637 C  CG   . ASP   A  688 ? 0.31064802 0.32089627 0.23753482 -0.06622996 -0.00751952 0.01504346  743  ASP   A CG   
10638 O  OD1  . ASP   A  688 ? 0.26171130 0.26608872 0.18358624 -0.06636824 -0.01061902 0.01637899  743  ASP   A OD1  
10639 O  OD2  . ASP   A  688 ? 0.29831490 0.31202340 0.22316343 -0.06861309 -0.00377121 0.01509473  743  ASP   A OD2  
10640 H  H    . ASP   A  688 ? 0.32540074 0.32754168 0.25237915 -0.06121219 -0.01360768 0.01245488  743  ASP   A H    
10641 H  HA   . ASP   A  688 ? 0.30643326 0.31661907 0.24848655 -0.05984005 -0.01367137 0.01374358  743  ASP   A HA   
10642 H  HB2  . ASP   A  688 ? 0.29153436 0.30812725 0.23120488 -0.06446514 -0.00799014 0.01469551  743  ASP   A HB2  
10643 H  HB3  . ASP   A  688 ? 0.29623559 0.31234890 0.23376371 -0.06150314 -0.00690308 0.01085249  743  ASP   A HB3  
10644 N  N    . GLY   A  689 ? 0.30043074 0.30022547 0.23147509 -0.06344897 -0.01842731 0.01872678  744  GLY   A N    
10645 C  CA   . GLY   A  689 ? 0.25109112 0.24821204 0.18118583 -0.06467362 -0.02107396 0.02170440  744  GLY   A CA   
10646 C  C    . GLY   A  689 ? 0.26205778 0.25792295 0.18672936 -0.06698837 -0.02041505 0.02379031  744  GLY   A C    
10647 O  O    . GLY   A  689 ? 0.25637126 0.25011259 0.18037477 -0.06766005 -0.02248091 0.02627118  744  GLY   A O    
10648 H  H    . GLY   A  689 ? 0.29588655 0.29414856 0.22498140 -0.06252235 -0.01866452 0.01708826  744  GLY   A H    
10649 H  HA2  . GLY   A  689 ? 0.26302361 0.25776792 0.19197474 -0.06417265 -0.02303579 0.02151919  744  GLY   A HA2  
10650 H  HA3  . GLY   A  689 ? 0.25911474 0.25742143 0.19320309 -0.06444422 -0.02152491 0.02253553  744  GLY   A HA3  
10651 N  N    . LEU   A  690 ? 0.22627836 0.22339445 0.14699693 -0.06808862 -0.01740585 0.02274517  745  LEU   A N    
10652 C  CA   . LEU   A  690 ? 0.25942925 0.25432423 0.17335244 -0.07061698 -0.01671480 0.02494892  745  LEU   A CA   
10653 C  C    . LEU   A  690 ? 0.24550200 0.23761567 0.15110347 -0.07100060 -0.01682682 0.02398515  745  LEU   A C    
10654 O  O    . LEU   A  690 ? 0.29635084 0.28961390 0.20109499 -0.06981426 -0.01537234 0.02077669  745  LEU   A O    
10655 C  CB   . LEU   A  690 ? 0.35006946 0.34885532 0.26514530 -0.07268307 -0.01260121 0.02498327  745  LEU   A CB   
10656 C  CG   . LEU   A  690 ? 0.29958963 0.30201566 0.22311719 -0.07256664 -0.01230702 0.02526482  745  LEU   A CG   
10657 C  CD1  . LEU   A  690 ? 0.31041813 0.31743780 0.23519607 -0.07523850 -0.00826942 0.02509692  745  LEU   A CD1  
10658 C  CD2  . LEU   A  690 ? 0.31483787 0.31349525 0.23889294 -0.07303744 -0.01528942 0.02816465  745  LEU   A CD2  
10659 H  H    . LEU   A  690 ? 0.24289271 0.24211982 0.16486801 -0.06721383 -0.01573523 0.02062099  745  LEU   A H    
10660 H  HA   . LEU   A  690 ? 0.26157856 0.25424993 0.17539725 -0.07093259 -0.01882559 0.02708230  745  LEU   A HA   
10661 H  HB2  . LEU   A  690 ? 0.31756526 0.31883267 0.23217939 -0.07231568 -0.01031350 0.02277972  745  LEU   A HB2  
10662 H  HB3  . LEU   A  690 ? 0.32044369 0.31696883 0.23074406 -0.07472640 -0.01227526 0.02694719  745  LEU   A HB3  
10663 H  HG   . LEU   A  690 ? 0.30725205 0.31166744 0.23515038 -0.07046249 -0.01279058 0.02347036  745  LEU   A HG   
10664 H  HD11 . LEU   A  690 ? 0.30313045 0.31318265 0.23377629 -0.07493374 -0.00824064 0.02469408  745  LEU   A HD11 
10665 H  HD12 . LEU   A  690 ? 0.31167114 0.31602812 0.23229983 -0.07761882 -0.00802625 0.02727838  745  LEU   A HD12 
10666 H  HD13 . LEU   A  690 ? 0.31065711 0.32031012 0.23445848 -0.07498597 -0.00594525 0.02315940  745  LEU   A HD13 
10667 H  HD21 . LEU   A  690 ? 0.30617204 0.30295846 0.23048021 -0.07138784 -0.01767676 0.02814936  745  LEU   A HD21 
10668 H  HD22 . LEU   A  690 ? 0.31336850 0.30922714 0.23279673 -0.07480643 -0.01520712 0.03001079  745  LEU   A HD22 
10669 H  HD23 . LEU   A  690 ? 0.30565929 0.30643705 0.23431401 -0.07322028 -0.01498588 0.02815838  745  LEU   A HD23 
10670 N  N    . ARG   A  691 ? 0.26764709 0.25570148 0.16663036 -0.07258579 -0.01866370 0.02674535  746  ARG   A N    
10671 C  CA   . ARG   A  691 ? 0.30083510 0.28573245 0.19028430 -0.07356857 -0.01905789 0.02653502  746  ARG   A CA   
10672 C  C    . ARG   A  691 ? 0.32128185 0.30865690 0.20679522 -0.07460384 -0.01420659 0.02399607  746  ARG   A C    
10673 O  O    . ARG   A  691 ? 0.30919969 0.29922929 0.19520813 -0.07650337 -0.01051886 0.02474217  746  ARG   A O    
10674 C  CB   . ARG   A  691 ? 0.33768004 0.31806415 0.22073479 -0.07539371 -0.02108826 0.03058784  746  ARG   A CB   
10675 C  CG   . ARG   A  691 ? 0.46771258 0.44467875 0.33901292 -0.07731286 -0.02053361 0.03105063  746  ARG   A CG   
10676 C  CD   . ARG   A  691 ? 0.47295824 0.44460201 0.33763462 -0.07905310 -0.02261226 0.03549112  746  ARG   A CD   
10677 N  NE   . ARG   A  691 ? 0.48354876 0.45521581 0.34668568 -0.08200479 -0.01853403 0.03733030  746  ARG   A NE   
10678 C  CZ   . ARG   A  691 ? 0.58356971 0.55632746 0.44047529 -0.08487149 -0.01382476 0.03673617  746  ARG   A CZ   
10679 N  NH1  . ARG   A  691 ? 0.43479234 0.40678978 0.28338486 -0.08524016 -0.01298035 0.03496357  746  ARG   A NH1  
10680 N  NH2  . ARG   A  691 ? 0.57300681 0.54788703 0.43196169 -0.08768840 -0.00975621 0.03780580  746  ARG   A NH2  
10681 H  H    . ARG   A  691 ? 0.26758456 0.25452268 0.16786318 -0.07294504 -0.01994530 0.02886308  746  ARG   A H    
10682 H  HA   . ARG   A  691 ? 0.30381298 0.28761214 0.19316922 -0.07234876 -0.02140928 0.02540970  746  ARG   A HA   
10683 H  HB2  . ARG   A  691 ? 0.34899384 0.32785094 0.23367523 -0.07424542 -0.02452909 0.03160782  746  ARG   A HB2  
10684 H  HB3  . ARG   A  691 ? 0.34986421 0.33080074 0.23470844 -0.07648183 -0.01953222 0.03201969  746  ARG   A HB3  
10685 H  HG2  . ARG   A  691 ? 0.43684715 0.41589236 0.30655503 -0.07841681 -0.01675438 0.02965882  746  ARG   A HG2  
10686 H  HG3  . ARG   A  691 ? 0.43791717 0.41385898 0.30707014 -0.07634021 -0.02265040 0.02973492  746  ARG   A HG3  
10687 H  HD2  . ARG   A  691 ? 0.48219329 0.45094049 0.33939105 -0.07958876 -0.02400164 0.03591619  746  ARG   A HD2  
10688 H  HD3  . ARG   A  691 ? 0.46818811 0.43884781 0.33675286 -0.07768245 -0.02567130 0.03681133  746  ARG   A HD3  
10689 H  HE   . ARG   A  691 ? 0.49963206 0.47065985 0.36620784 -0.08208343 -0.01913199 0.03888700  746  ARG   A HE   
10690 H  HH11 . ARG   A  691 ? 0.47861075 0.44790280 0.32386327 -0.08414868 -0.01619006 0.03506628  746  ARG   A HH11 
10691 H  HH12 . ARG   A  691 ? 0.48067346 0.45503169 0.32707685 -0.08660934 -0.00918932 0.03356311  746  ARG   A HH12 
10692 H  HH21 . ARG   A  691 ? 0.57916111 0.55492920 0.43379724 -0.08994297 -0.00650634 0.03767357  746  ARG   A HH21 
10693 H  HH22 . ARG   A  691 ? 0.56929773 0.54482734 0.43389153 -0.08745163 -0.01028532 0.03857199  746  ARG   A HH22 
10694 N  N    . ASP   A  692 ? 0.37533015 0.36187562 0.25689095 -0.07347975 -0.01421566 0.02080417  747  ASP   A N    
10695 C  CA   . ASP   A  692 ? 0.34665275 0.33551615 0.22385417 -0.07390800 -0.00951325 0.01767201  747  ASP   A CA   
10696 C  C    . ASP   A  692 ? 0.38665688 0.37287024 0.25279480 -0.07723281 -0.00798904 0.01996102  747  ASP   A C    
10697 O  O    . ASP   A  692 ? 0.38317728 0.36409673 0.24290982 -0.07817604 -0.01196678 0.02274967  747  ASP   A O    
10698 C  CB   . ASP   A  692 ? 0.29414427 0.28116286 0.16830750 -0.07176907 -0.01030817 0.01336518  747  ASP   A CB   
10699 C  CG   . ASP   A  692 ? 0.36305651 0.35223061 0.24654727 -0.06851017 -0.01059297 0.01037646  747  ASP   A CG   
10700 O  OD1  . ASP   A  692 ? 0.26542553 0.25825337 0.15780099 -0.06779473 -0.01007947 0.01151954  747  ASP   A OD1  
10701 O  OD2  . ASP   A  692 ? 0.27794445 0.26444846 0.15935355 -0.06674231 -0.01165697 0.00696150  747  ASP   A OD2  
10702 H  H    . ASP   A  692 ? 0.35212645 0.33662009 0.23370928 -0.07244564 -0.01721466 0.02040972  747  ASP   A H    
10703 H  HA   . ASP   A  692 ? 0.34240460 0.33556592 0.22508490 -0.07357824 -0.00665012 0.01674595  747  ASP   A HA   
10704 H  HB2  . ASP   A  692 ? 0.32344460 0.30662674 0.19380184 -0.07205329 -0.01381764 0.01427887  747  ASP   A HB2  
10705 H  HB3  . ASP   A  692 ? 0.32810876 0.31588858 0.19726667 -0.07232675 -0.00726376 0.01154777  747  ASP   A HB3  
10706 N  N    . THR   A  693 ? 0.35045129 0.34064931 0.21447642 -0.07887465 -0.00226709 0.01858945  748  THR   A N    
10707 C  CA   . THR   A  693 ? 0.42577946 0.41350174 0.27733567 -0.08204987 0.00020093  0.01957583  748  THR   A CA   
10708 C  C    . THR   A  693 ? 0.40625173 0.39191604 0.25060031 -0.08046616 0.00002211  0.01550550  748  THR   A C    
10709 O  O    . THR   A  693 ? 0.34968475 0.33661488 0.19964854 -0.07710940 -0.00086325 0.01161007  748  THR   A O    
10710 C  CB   . THR   A  693 ? 0.43343472 0.42713228 0.28602117 -0.08462964 0.00682218  0.01918569  748  THR   A CB   
10711 O  OG1  . THR   A  693 ? 0.47346082 0.47381914 0.33302176 -0.08164138 0.01029875  0.01381674  748  THR   A OG1  
10712 C  CG2  . THR   A  693 ? 0.40090474 0.39627737 0.26068434 -0.08662391 0.00681847  0.02292256  748  THR   A CG2  
10713 H  H    . THR   A  693 ? 0.36891907 0.36375672 0.23941974 -0.07804982 0.00021950  0.01696957  748  THR   A H    
10714 H  HA   . THR   A  693 ? 0.41076589 0.39404225 0.25776324 -0.08352290 -0.00257838 0.02302007  748  THR   A HA   
10715 H  HB   . THR   A  693 ? 0.44479972 0.43657088 0.28821459 -0.08705203 0.00868428  0.01996690  748  THR   A HB   
10717 H  HG21 . THR   A  693 ? 0.41112965 0.41026258 0.27077982 -0.08901855 0.01109221  0.02290875  748  THR   A HG21 
10718 H  HG22 . THR   A  693 ? 0.39909446 0.39699987 0.26773182 -0.08432506 0.00552094  0.02185359  748  THR   A HG22 
10719 H  HG23 . THR   A  693 ? 0.41031775 0.40033609 0.26578796 -0.08785951 0.00377480  0.02632754  748  THR   A HG23 
10720 N  N    . GLU   A  694 ? 0.48478061 0.46682948 0.31589869 -0.08307856 0.00112686  0.01626338  749  GLU   A N    
10721 C  CA   . GLU   A  694 ? 0.56639773 0.54518187 0.38922894 -0.08181931 0.00001626  0.01253359  749  GLU   A CA   
10722 C  C    . GLU   A  694 ? 0.45423973 0.43873584 0.28048092 -0.07972787 0.00577915  0.00663549  749  GLU   A C    
10723 O  O    . GLU   A  694 ? 0.45883912 0.44145146 0.28433484 -0.07693017 0.00438346  0.00225226  749  GLU   A O    
10724 C  CB   . GLU   A  694 ? 0.72766685 0.70068872 0.53424788 -0.08502579 -0.00064941 0.01465038  749  GLU   A CB   
10725 C  CG   . GLU   A  694 ? 1.17251515 1.14117384 0.97161168 -0.08343013 -0.00389243 0.01088039  749  GLU   A CG   
10726 C  CD   . GLU   A  694 ? 1.41714704 1.37943566 1.19945180 -0.08614123 -0.00590985 0.01251355  749  GLU   A CD   
10727 O  OE1  . GLU   A  694 ? 1.41410196 1.37533510 1.18842626 -0.08954252 -0.00322865 0.01616572  749  GLU   A OE1  
10728 O  OE2  . GLU   A  694 ? 1.10662019 1.06459606 0.88341606 -0.08511181 -0.01045696 0.01026408  749  GLU   A OE2  
10729 H  H    . GLU   A  694 ? 0.48638672 0.46756440 0.31318611 -0.08573975 0.00243047  0.01907487  749  GLU   A H    
10730 H  HA   . GLU   A  694 ? 0.54656982 0.52307498 0.37251583 -0.07998828 -0.00437120 0.01221363  749  GLU   A HA   
10731 H  HB2  . GLU   A  694 ? 0.76269174 0.73248249 0.56775713 -0.08623648 -0.00398082 0.01873537  749  GLU   A HB2  
10732 H  HB3  . GLU   A  694 ? 0.76687694 0.74210948 0.56924498 -0.08693954 0.00422417  0.01428283  749  GLU   A HB3  
10733 H  HG2  . GLU   A  694 ? 1.07356095 1.04489088 0.87382829 -0.08204720 -0.00045308 0.00667254  749  GLU   A HG2  
10734 H  HG3  . GLU   A  694 ? 1.07212591 1.03940296 0.87655795 -0.08174467 -0.00838000 0.01106478  749  GLU   A HG3  
10735 N  N    . ASP   A  695 ? 0.48837006 0.47982210 0.31892753 -0.08104318 0.01195394  0.00651371  750  ASP   A N    
10736 C  CA   . ASP   A  695 ? 0.50229675 0.50096244 0.33802924 -0.07862914 0.01779375  0.00088559  750  ASP   A CA   
10737 C  C    . ASP   A  695 ? 0.43140188 0.43218678 0.28007591 -0.07368437 0.01549263  -0.00220914 750  ASP   A C    
10738 O  O    . ASP   A  695 ? 0.56530893 0.56933933 0.41691154 -0.07029568 0.01840743  -0.00762149 750  ASP   A O    
10739 C  CB   . ASP   A  695 ? 0.70061868 0.70771956 0.54058015 -0.08142059 0.02437232  0.00188692  750  ASP   A CB   
10740 C  CG   . ASP   A  695 ? 1.03126550 1.03623879 0.85897160 -0.08712151 0.02715374  0.00577696  750  ASP   A CG   
10741 O  OD1  . ASP   A  695 ? 1.29941261 1.29670596 1.11348891 -0.08848442 0.02473276  0.00685419  750  ASP   A OD1  
10742 O  OD2  . ASP   A  695 ? 1.36313522 1.37365508 1.19450748 -0.09047166 0.03137744  0.00795360  750  ASP   A OD2  
10743 H  H    . ASP   A  695 ? 0.48546475 0.47730100 0.31591588 -0.08351664 0.01248718  0.00997722  750  ASP   A H    
10744 H  HA   . ASP   A  695 ? 0.52517569 0.52203238 0.35293898 -0.07841227 0.01920253  -0.00185335 750  ASP   A HA   
10745 H  HB2  . ASP   A  695 ? 0.68967140 0.69885564 0.53821093 -0.08129672 0.02300060  0.00391993  750  ASP   A HB2  
10746 H  HB3  . ASP   A  695 ? 0.70135242 0.71376663 0.54427081 -0.07963780 0.02839526  -0.00219506 750  ASP   A HB3  
10747 N  N    . GLU   A  696 ? 0.45682505 0.45545435 0.31280884 -0.07320260 0.01030136  0.00126837  751  GLU   A N    
10748 C  CA   . GLU   A  696 ? 0.41046375 0.41018325 0.27774668 -0.06913210 0.00772262  -0.00071646 751  GLU   A CA   
10749 C  C    . GLU   A  696 ? 0.47462624 0.46696866 0.33898720 -0.06690943 0.00239975  -0.00251265 751  GLU   A C    
10750 O  O    . GLU   A  696 ? 0.38320678 0.37512410 0.25540569 -0.06369511 0.00024352  -0.00433434 751  GLU   A O    
10751 C  CB   . GLU   A  696 ? 0.41657728 0.41827053 0.29279876 -0.07018728 0.00554461  0.00381505  751  GLU   A CB   
10752 C  CG   . GLU   A  696 ? 0.41790706 0.42805132 0.30086285 -0.07153366 0.01060847  0.00421468  751  GLU   A CG   
10753 C  CD   . GLU   A  696 ? 0.45709482 0.46790886 0.34633985 -0.07349821 0.00843684  0.00889613  751  GLU   A CD   
10754 O  OE1  . GLU   A  696 ? 0.43443680 0.43895629 0.31992537 -0.07488780 0.00400259  0.01275283  751  GLU   A OE1  
10755 O  OE2  . GLU   A  696 ? 0.57024741 0.58824182 0.46861458 -0.07341673 0.01109448  0.00837639  751  GLU   A OE2  
10756 H  H    . GLU   A  696 ? 0.43904257 0.43529499 0.29257953 -0.07549050 0.00838034  0.00503574  751  GLU   A H    
10757 H  HA   . GLU   A  696 ? 0.43174559 0.43614477 0.30320311 -0.06720858 0.01113009  -0.00394705 751  GLU   A HA   
10758 H  HB2  . GLU   A  696 ? 0.41444850 0.41242599 0.28611848 -0.07237954 0.00318896  0.00712721  751  GLU   A HB2  
10759 H  HB3  . GLU   A  696 ? 0.40763196 0.40849829 0.28974441 -0.06785254 0.00283476  0.00320614  751  GLU   A HB3  
10760 H  HG2  . GLU   A  696 ? 0.42554513 0.43987322 0.31468490 -0.06885252 0.01225192  0.00107409  751  GLU   A HG2  
10761 H  HG3  . GLU   A  696 ? 0.43413562 0.44550794 0.31114492 -0.07387645 0.01396239  0.00427348  751  GLU   A HG3  
10762 N  N    . ILE   A  697 ? 0.45784891 0.44411838 0.31062347 -0.06885651 0.00004740  -0.00197880 752  ILE   A N    
10763 C  CA   . ILE   A  697 ? 0.38568974 0.36532053 0.23549895 -0.06751630 -0.00508379 -0.00383149 752  ILE   A CA   
10764 C  C    . ILE   A  697 ? 0.36744183 0.34622538 0.21477281 -0.06456539 -0.00233790 -0.01028208 752  ILE   A C    
10765 O  O    . ILE   A  697 ? 0.39824751 0.37889180 0.23863211 -0.06491197 0.00245472  -0.01298866 752  ILE   A O    
10766 C  CB   . ILE   A  697 ? 0.52419341 0.49814028 0.36296803 -0.07053131 -0.00919011 -0.00120171 752  ILE   A CB   
10767 C  CG1  . ILE   A  697 ? 0.54024410 0.51515895 0.37974900 -0.07319250 -0.01065181 0.00496345  752  ILE   A CG1  
10768 C  CG2  . ILE   A  697 ? 0.45307761 0.42136556 0.29130316 -0.06981053 -0.01526861 -0.00239405 752  ILE   A CG2  
10769 C  CD1  . ILE   A  697 ? 0.47117168 0.44579405 0.31891280 -0.07257687 -0.01501664 0.00773471  752  ILE   A CD1  
10770 H  H    . ILE   A  697 ? 0.45098704 0.43720973 0.29739177 -0.07121116 0.00161802  -0.00049278 752  ILE   A H    
10771 H  HA   . ILE   A  697 ? 0.40523970 0.38465029 0.26214895 -0.06645592 -0.00777986 -0.00275501 752  ILE   A HA   
10772 H  HB   . ILE   A  697 ? 0.49231029 0.46549624 0.32284865 -0.07136894 -0.00676606 -0.00292697 752  ILE   A HB   
10773 H  HG12 . ILE   A  697 ? 0.51584506 0.49459007 0.35753143 -0.07374471 -0.00678771 0.00565177  752  ILE   A HG12 
10774 H  HG13 . ILE   A  697 ? 0.52697140 0.49876791 0.35785910 -0.07501926 -0.01208015 0.00629416  752  ILE   A HG13 
10775 H  HG21 . ILE   A  697 ? 0.46281016 0.43199661 0.30915713 -0.06884738 -0.01710674 -0.00128231 752  ILE   A HG21 
10776 H  HG22 . ILE   A  697 ? 0.47680146 0.44311768 0.31216529 -0.06854471 -0.01443349 -0.00634787 752  ILE   A HG22 
10777 H  HG23 . ILE   A  697 ? 0.47488028 0.44053453 0.30737716 -0.07167141 -0.01825551 -0.00036712 752  ILE   A HG23 
10778 H  HD11 . ILE   A  697 ? 0.48150712 0.45812815 0.33671066 -0.07066903 -0.01436356 0.00610505  752  ILE   A HD11 
10779 H  HD12 . ILE   A  697 ? 0.49003434 0.46121180 0.33486843 -0.07284331 -0.01903906 0.00799258  752  ILE   A HD12 
10780 H  HD13 . ILE   A  697 ? 0.48546028 0.46127915 0.33455837 -0.07380775 -0.01487950 0.01109951  752  ILE   A HD13 
10781 N  N    . LYS   A  698 ? 0.36796081 0.34358576 0.22071037 -0.06160196 -0.00522584 -0.01287558 753  LYS   A N    
10782 C  CA   . LYS   A  698 ? 0.40190202 0.37608001 0.25344527 -0.05800700 -0.00274524 -0.01921156 753  LYS   A CA   
10783 C  C    . LYS   A  698 ? 0.46176994 0.42675468 0.30551895 -0.05786642 -0.00704026 -0.02227469 753  LYS   A C    
10784 O  O    . LYS   A  698 ? 0.60146785 0.56345809 0.44334370 -0.05471948 -0.00558155 -0.02783267 753  LYS   A O    
10785 C  CB   . LYS   A  698 ? 0.42129385 0.39866352 0.28546476 -0.05388440 -0.00201454 -0.02067823 753  LYS   A CB   
10786 C  CG   . LYS   A  698 ? 0.51246059 0.49939036 0.38524705 -0.05403229 0.00189634  -0.01817186 753  LYS   A CG   
10787 C  CD   . LYS   A  698 ? 0.59798563 0.59104365 0.46589383 -0.05499654 0.00850414  -0.02017023 753  LYS   A CD   
10788 C  CE   . LYS   A  698 ? 0.63154769 0.63491404 0.50986999 -0.05438472 0.01284135  -0.01938794 753  LYS   A CE   
10789 N  NZ   . LYS   A  698 ? 0.61893815 0.62841666 0.49756473 -0.05157158 0.01909998  -0.02508378 753  LYS   A NZ   
10790 H  H    . LYS   A  698 ? 0.36778367 0.34187144 0.22484460 -0.06177118 -0.00872417 -0.01074496 753  LYS   A H    
10791 H  HA   . LYS   A  698 ? 0.41661656 0.39376384 0.26399973 -0.05817186 0.00148552  -0.02094398 753  LYS   A HA   
10792 H  HB2  . LYS   A  698 ? 0.42983529 0.40381086 0.29737800 -0.05385591 -0.00603905 -0.01905547 753  LYS   A HB2  
10793 H  HB3  . LYS   A  698 ? 0.44066983 0.41692829 0.30391365 -0.05109330 -0.00032374 -0.02504912 753  LYS   A HB3  
10794 H  HG2  . LYS   A  698 ? 0.49440652 0.48168820 0.36847502 -0.05649393 -0.00006848 -0.01396072 753  LYS   A HG2  
10795 H  HG3  . LYS   A  698 ? 0.49822032 0.48704970 0.37863702 -0.05114836 0.00200931  -0.01942237 753  LYS   A HG3  
10796 H  HD2  . LYS   A  698 ? 0.59284514 0.58443087 0.45714575 -0.05286920 0.01018316  -0.02452954 753  LYS   A HD2  
10797 H  HD3  . LYS   A  698 ? 0.58384788 0.57554245 0.44485494 -0.05833096 0.00831150  -0.01773610 753  LYS   A HD3  
10798 H  HE2  . LYS   A  698 ? 0.61527896 0.62092429 0.49219269 -0.05776031 0.01375372  -0.01592583 753  LYS   A HE2  
10799 H  HE3  . LYS   A  698 ? 0.60848254 0.61241162 0.49481657 -0.05250676 0.01063056  -0.01867818 753  LYS   A HE3  
10800 H  HZ1  . LYS   A  698 ? 0.63186979 0.64041704 0.50231588 -0.05331841 0.02122800  -0.02594527 753  LYS   A HZ1  
10801 H  HZ2  . LYS   A  698 ? 0.62615478 0.63339901 0.50675750 -0.04801524 0.01814354  -0.02834837 753  LYS   A HZ2  
10802 H  HZ3  . LYS   A  698 ? 0.62082446 0.63733077 0.50581867 -0.05162339 0.02182394  -0.02458165 753  LYS   A HZ3  
10803 N  N    . GLN   A  699 ? 0.48675263 0.44739109 0.32593459 -0.06120801 -0.01233501 -0.01895473 754  GLN   A N    
10804 C  CA   . GLN   A  699 ? 0.51722467 0.46961474 0.34890884 -0.06186217 -0.01673438 -0.02184045 754  GLN   A CA   
10805 C  C    . GLN   A  699 ? 0.51867926 0.46895242 0.34112239 -0.06598413 -0.02041242 -0.01877690 754  GLN   A C    
10806 O  O    . GLN   A  699 ? 0.43675256 0.39012867 0.26251400 -0.06804530 -0.02240947 -0.01333037 754  GLN   A O    
10807 C  CB   . GLN   A  699 ? 0.45147687 0.39977449 0.29121864 -0.06081312 -0.02129562 -0.02177805 754  GLN   A CB   
10808 C  CG   . GLN   A  699 ? 0.64750117 0.58703512 0.48011050 -0.06215968 -0.02606710 -0.02477783 754  GLN   A CG   
10809 C  CD   . GLN   A  699 ? 0.80351835 0.73914051 0.64365131 -0.06241643 -0.03064551 -0.02370340 754  GLN   A CD   
10810 O  OE1  . GLN   A  699 ? 0.78867149 0.72778648 0.63908780 -0.06114073 -0.03017692 -0.02089637 754  GLN   A OE1  
10811 N  NE2  . GLN   A  699 ? 0.76375347 0.69187808 0.59830534 -0.06448732 -0.03519937 -0.02591946 754  GLN   A NE2  
10812 H  H    . GLN   A  699 ? 0.47761843 0.44051200 0.31852621 -0.06307655 -0.01334518 -0.01498820 754  GLN   A H    
10813 H  HA   . GLN   A  699 ? 0.50836229 0.45898724 0.33522063 -0.06028411 -0.01426990 -0.02613588 754  GLN   A HA   
10814 H  HB2  . GLN   A  699 ? 0.49842605 0.44759351 0.34331334 -0.05792302 -0.01912105 -0.02371128 754  GLN   A HB2  
10815 H  HB3  . GLN   A  699 ? 0.49333334 0.44396091 0.33814776 -0.06221139 -0.02329076 -0.01773878 754  GLN   A HB3  
10816 H  HG2  . GLN   A  699 ? 0.62377620 0.56284583 0.45076287 -0.06484560 -0.02818961 -0.02324448 754  GLN   A HG2  
10817 H  HG3  . GLN   A  699 ? 0.63093740 0.56748325 0.45883033 -0.06038017 -0.02411743 -0.02916753 754  GLN   A HG3  
10818 H  HE21 . GLN   A  699 ? 0.78518242 0.71089762 0.61203772 -0.06539015 -0.03556844 -0.02800852 754  GLN   A HE21 
10819 H  HE22 . GLN   A  699 ? 0.77594507 0.70143658 0.61429888 -0.06516861 -0.03788682 -0.02530766 754  GLN   A HE22 
10820 N  N    . TYR   A  700 ? 0.41389719 0.35859847 0.22432975 -0.06683180 -0.02135244 -0.02263413 755  TYR   A N    
10821 C  CA   . TYR   A  700 ? 0.42014372 0.36222413 0.22012335 -0.07043526 -0.02521673 -0.02046078 755  TYR   A CA   
10822 C  C    . TYR   A  700 ? 0.42790091 0.36237028 0.22264166 -0.07140871 -0.03079211 -0.02390923 755  TYR   A C    
10823 O  O    . TYR   A  700 ? 0.42827728 0.35858229 0.22364902 -0.06917893 -0.02987156 -0.02897370 755  TYR   A O    
10824 C  CB   . TYR   A  700 ? 0.40370542 0.34678602 0.19159524 -0.07132133 -0.02041788 -0.02158493 755  TYR   A CB   
10825 C  CG   . TYR   A  700 ? 0.37371892 0.32377225 0.16532439 -0.07188421 -0.01580057 -0.01724464 755  TYR   A CG   
10826 C  CD1  . TYR   A  700 ? 0.41265297 0.36857408 0.21294059 -0.06931832 -0.00975285 -0.01865534 755  TYR   A CD1  
10827 C  CD2  . TYR   A  700 ? 0.38203335 0.33256829 0.16862184 -0.07502176 -0.01783571 -0.01169366 755  TYR   A CD2  
10828 C  CE1  . TYR   A  700 ? 0.38634360 0.34873945 0.19032918 -0.07045062 -0.00563975 -0.01477937 755  TYR   A CE1  
10829 C  CE2  . TYR   A  700 ? 0.46017158 0.41596356 0.24971402 -0.07598996 -0.01372550 -0.00762814 755  TYR   A CE2  
10830 C  CZ   . TYR   A  700 ? 0.42964840 0.39153802 0.22808135 -0.07397680 -0.00754253 -0.00924881 755  TYR   A CZ   
10831 O  OH   . TYR   A  700 ? 0.48426473 0.45166165 0.28680927 -0.07532419 -0.00360089 -0.00546604 755  TYR   A OH   
10832 H  H    . TYR   A  700 ? 0.44358325 0.38586298 0.25215709 -0.06494524 -0.01969459 -0.02687056 755  TYR   A H    
10833 H  HA   . TYR   A  700 ? 0.40839899 0.35285586 0.21251598 -0.07178616 -0.02754134 -0.01600641 755  TYR   A HA   
10834 H  HB2  . TYR   A  700 ? 0.40959185 0.35145968 0.19476461 -0.06950327 -0.01726076 -0.02616044 755  TYR   A HB2  
10835 H  HB3  . TYR   A  700 ? 0.41073096 0.35065204 0.19018793 -0.07349907 -0.02356511 -0.02087535 755  TYR   A HB3  
10836 H  HD1  . TYR   A  700 ? 0.39645410 0.35185838 0.20028450 -0.06676754 -0.00858869 -0.02238539 755  TYR   A HD1  
10837 H  HD2  . TYR   A  700 ? 0.40181613 0.34881225 0.18286341 -0.07654110 -0.02227167 -0.01065904 755  TYR   A HD2  
10838 H  HE1  . TYR   A  700 ? 0.39609766 0.36304113 0.20665222 -0.06879324 -0.00180525 -0.01588135 755  TYR   A HE1  
10839 H  HE2  . TYR   A  700 ? 0.43255481 0.38768792 0.21837206 -0.07801949 -0.01541578 -0.00374712 755  TYR   A HE2  
10841 N  N    . VAL   A  701 ? 0.44173276 0.37430239 0.23152877 -0.07468751 -0.03678870 -0.02122589 756  VAL   A N    
10842 C  CA   . VAL   A  701 ? 0.47941983 0.40497887 0.26181301 -0.07645369 -0.04207096 -0.02484933 756  VAL   A CA   
10843 C  C    . VAL   A  701 ? 0.47574490 0.39681870 0.24433471 -0.07564852 -0.03835798 -0.03057225 756  VAL   A C    
10844 O  O    . VAL   A  701 ? 0.45938498 0.38272846 0.21941483 -0.07607103 -0.03460206 -0.02968450 756  VAL   A O    
10845 C  CB   . VAL   A  701 ? 0.49584997 0.42182642 0.27577820 -0.07998856 -0.04921485 -0.02080151 756  VAL   A CB   
10846 C  CG1  . VAL   A  701 ? 0.48749083 0.40686068 0.26097178 -0.08238481 -0.05532302 -0.02462961 756  VAL   A CG1  
10847 C  CG2  . VAL   A  701 ? 0.46324840 0.39507705 0.25740966 -0.08015345 -0.05154316 -0.01523674 756  VAL   A CG2  
10848 H  H    . VAL   A  701 ? 0.44090712 0.37656718 0.23190768 -0.07581390 -0.03773300 -0.01718631 756  VAL   A H    
10849 H  HA   . VAL   A  701 ? 0.46956468 0.39312238 0.25791776 -0.07570711 -0.04322848 -0.02644535 756  VAL   A HA   
10850 H  HB   . VAL   A  701 ? 0.49049371 0.41739243 0.26322746 -0.08066520 -0.04833784 -0.01925975 756  VAL   A HB   
10851 H  HG11 . VAL   A  701 ? 0.48955452 0.40715477 0.26923496 -0.08199876 -0.05604149 -0.02627176 756  VAL   A HG11 
10852 H  HG12 . VAL   A  701 ? 0.50357449 0.41909775 0.26705998 -0.08229673 -0.05391383 -0.02812682 756  VAL   A HG12 
10853 H  HG13 . VAL   A  701 ? 0.49266696 0.41337997 0.26573944 -0.08446181 -0.05997644 -0.02197329 756  VAL   A HG13 
10854 H  HG21 . VAL   A  701 ? 0.46855736 0.40061852 0.26234549 -0.08209394 -0.05648361 -0.01349599 756  VAL   A HG21 
10855 H  HG22 . VAL   A  701 ? 0.46262306 0.39820307 0.25869432 -0.07930298 -0.04866016 -0.01238865 756  VAL   A HG22 
10856 H  HG23 . VAL   A  701 ? 0.46243700 0.39392275 0.26392299 -0.07919231 -0.05100418 -0.01637525 756  VAL   A HG23 
10857 N  N    . GLU   A  702 ? 0.48876870 0.40327114 0.25545385 -0.07433377 -0.03885367 -0.03656331 757  GLU   A N    
10858 C  CA   . GLU   A  702 ? 0.67896485 0.58940816 0.43483838 -0.07224637 -0.03409803 -0.04310587 757  GLU   A CA   
10859 C  C    . GLU   A  702 ? 0.57914317 0.48825771 0.31875998 -0.07485918 -0.03420541 -0.04346422 757  GLU   A C    
10860 O  O    . GLU   A  702 ? 0.65558434 0.56221938 0.38957536 -0.07838874 -0.04071797 -0.04132394 757  GLU   A O    
10861 C  CB   . GLU   A  702 ? 0.83347273 0.73447907 0.58711296 -0.07117727 -0.03670122 -0.04956403 757  GLU   A CB   
10862 C  CG   . GLU   A  702 ? 0.84463286 0.74258232 0.59202123 -0.06701385 -0.03033349 -0.05673398 757  GLU   A CG   
10863 C  CD   . GLU   A  702 ? 1.31580555 1.20251298 1.05797827 -0.06598006 -0.03314986 -0.06365746 757  GLU   A CD   
10864 O  OE1  . GLU   A  702 ? 1.23629749 1.11647284 0.96498263 -0.06864420 -0.03640297 -0.06694213 757  GLU   A OE1  
10865 O  OE2  . GLU   A  702 ? 1.04943240 0.93318224 0.80066806 -0.06266517 -0.03259580 -0.06563907 757  GLU   A OE2  
10866 H  H    . GLU   A  702 ? 0.51857370 0.43084133 0.29059780 -0.07476382 -0.04218266 -0.03666665 757  GLU   A H    
10867 H  HA   . GLU   A  702 ? 0.62829506 0.54272342 0.38843450 -0.06966960 -0.02881803 -0.04344016 757  GLU   A HA   
10868 H  HB2  . GLU   A  702 ? 0.78524327 0.68608767 0.54848897 -0.07053193 -0.03829747 -0.04837519 757  GLU   A HB2  
10869 H  HB3  . GLU   A  702 ? 0.80152422 0.69833207 0.54821837 -0.07393745 -0.04123846 -0.05026672 757  GLU   A HB3  
10870 H  HG2  . GLU   A  702 ? 0.93149269 0.83078063 0.66981041 -0.06767841 -0.02784767 -0.05751542 757  GLU   A HG2  
10871 H  HG3  . GLU   A  702 ? 0.92084855 0.82308817 0.67643809 -0.06410032 -0.02635941 -0.05626751 757  GLU   A HG3  
10872 N  N    . GLY   A  703 ? 0.62555063 0.53674161 0.35778823 -0.07313851 -0.02694295 -0.04615334 758  GLY   A N    
10873 C  CA   . GLY   A  703 ? 0.61307353 0.52251095 0.32819533 -0.07554447 -0.02589237 -0.04689959 758  GLY   A CA   
10874 C  C    . GLY   A  703 ? 0.59981740 0.51367903 0.31241232 -0.07884630 -0.02757561 -0.03926861 758  GLY   A C    
10875 O  O    . GLY   A  703 ? 0.96139246 0.87262124 0.65892774 -0.08144097 -0.02844443 -0.03882612 758  GLY   A O    
10876 H  H    . GLY   A  703 ? 0.60625279 0.52028227 0.34433442 -0.07041051 -0.02239787 -0.04758032 758  GLY   A H    
10877 H  HA2  . GLY   A  703 ? 0.62269801 0.53344101 0.33408403 -0.07371645 -0.01989100 -0.05015938 758  GLY   A HA2  
10878 H  HA3  . GLY   A  703 ? 0.62682992 0.53019202 0.33440661 -0.07681968 -0.03001390 -0.04967098 758  GLY   A HA3  
10879 N  N    . SER   A  704 ? 0.62671554 0.54638314 0.35349146 -0.07867383 -0.02853404 -0.03333016 759  SER   A N    
10880 C  CA   . SER   A  704 ? 0.49829352 0.42101312 0.22452760 -0.08134413 -0.03141795 -0.02592256 759  SER   A CA   
10881 C  C    . SER   A  704 ? 0.50028616 0.43050981 0.23723228 -0.08013348 -0.02568817 -0.02188670 759  SER   A C    
10882 O  O    . SER   A  704 ? 0.47856447 0.41215992 0.22482610 -0.07723294 -0.02061592 -0.02466688 759  SER   A O    
10883 C  CB   . SER   A  704 ? 0.56025887 0.48216540 0.29397133 -0.08270404 -0.04026923 -0.02238736 759  SER   A CB   
10884 O  OG   . SER   A  704 ? 0.44035539 0.36715373 0.19153985 -0.08097086 -0.03998286 -0.01971437 759  SER   A OG   
10885 H  H    . SER   A  704 ? 0.57382119 0.49530646 0.31075734 -0.07664485 -0.02732114 -0.03401765 759  SER   A H    
10886 H  HA   . SER   A  704 ? 0.54618287 0.46677387 0.26022279 -0.08311465 -0.03132019 -0.02570375 759  SER   A HA   
10887 H  HB2  . SER   A  704 ? 0.51801884 0.44008136 0.24699356 -0.08451832 -0.04315899 -0.01859766 759  SER   A HB2  
10888 H  HB3  . SER   A  704 ? 0.52109170 0.43876225 0.25176114 -0.08313500 -0.04364377 -0.02579046 759  SER   A HB3  
10890 N  N    . SER   A  705 ? 0.50704491 0.43942398 0.24289721 -0.08230066 -0.02720580 -0.01529791 760  SER   A N    
10891 C  CA   . SER   A  705 ? 0.49124622 0.42993081 0.23843107 -0.08170987 -0.02361027 -0.01074786 760  SER   A CA   
10892 C  C    . SER   A  705 ? 0.43370831 0.37360662 0.19199385 -0.08179151 -0.03007906 -0.00565427 760  SER   A C    
10893 O  O    . SER   A  705 ? 0.44854951 0.39154291 0.21162677 -0.08238675 -0.02957287 -0.00027439 760  SER   A O    
10894 C  CB   . SER   A  705 ? 0.57365274 0.51341367 0.31061950 -0.08417448 -0.01909499 -0.00740041 760  SER   A CB   
10895 O  OG   . SER   A  705 ? 0.66537178 0.59991688 0.39035171 -0.08679745 -0.02510905 -0.00393593 760  SER   A OG   
10896 H  H    . SER   A  705 ? 0.51148784 0.44094110 0.23902082 -0.08417493 -0.03080840 -0.01364055 760  SER   A H    
10897 H  HA   . SER   A  705 ? 0.48786747 0.42937696 0.24222611 -0.07962599 -0.01961862 -0.01346038 760  SER   A HA   
10898 H  HB2  . SER   A  705 ? 0.56262857 0.50617027 0.30697832 -0.08415996 -0.01710714 -0.00416592 760  SER   A HB2  
10899 H  HB3  . SER   A  705 ? 0.57894444 0.51910394 0.31009203 -0.08401510 -0.01411194 -0.01091905 760  SER   A HB3  
10901 N  N    . ILE   A  706 ? 0.43161309 0.36906880 0.19417612 -0.08128248 -0.03597640 -0.00762545 761  ILE   A N    
10902 C  CA   . ILE   A  706 ? 0.45696086 0.39680111 0.23186076 -0.08106739 -0.04127517 -0.00379407 761  ILE   A CA   
10903 C  C    . ILE   A  706 ? 0.36490268 0.30878279 0.15422019 -0.07854262 -0.03726320 -0.00486492 761  ILE   A C    
10904 O  O    . ILE   A  706 ? 0.36434171 0.30635419 0.15638602 -0.07708240 -0.03639173 -0.00962631 761  ILE   A O    
10905 C  CB   . ILE   A  706 ? 0.46795547 0.40456301 0.24211429 -0.08224379 -0.04901900 -0.00517721 761  ILE   A CB   
10906 C  CG1  . ILE   A  706 ? 0.55514610 0.48723805 0.31364462 -0.08455674 -0.05315889 -0.00529459 761  ILE   A CG1  
10907 C  CG2  . ILE   A  706 ? 0.53630912 0.47687823 0.32337749 -0.08218990 -0.05395508 -0.00086356 761  ILE   A CG2  
10908 C  CD1  . ILE   A  706 ? 0.55593973 0.48530093 0.31403777 -0.08610504 -0.06107928 -0.00743395 761  ILE   A CD1  
10909 H  H    . ILE   A  706 ? 0.44840416 0.38271272 0.20613058 -0.08118681 -0.03653607 -0.01155928 761  ILE   A H    
10910 H  HA   . ILE   A  706 ? 0.43176943 0.37298304 0.20634228 -0.08179241 -0.04214078 0.00040887  761  ILE   A HA   
10911 H  HB   . ILE   A  706 ? 0.49119532 0.42600599 0.26686803 -0.08155676 -0.04824001 -0.00919027 761  ILE   A HB   
10912 H  HG12 . ILE   A  706 ? 0.53578824 0.46897757 0.29242361 -0.08513533 -0.05443822 -0.00112755 761  ILE   A HG12 
10913 H  HG13 . ILE   A  706 ? 0.54268634 0.47239494 0.29253960 -0.08461883 -0.04954502 -0.00815575 761  ILE   A HG13 
10914 H  HG21 . ILE   A  706 ? 0.50962198 0.45127732 0.29483303 -0.08265136 -0.05548583 0.00287629  761  ILE   A HG21 
10915 H  HG22 . ILE   A  706 ? 0.49903920 0.44227931 0.29515141 -0.08082160 -0.05119847 -0.00057929 761  ILE   A HG22 
10916 H  HG23 . ILE   A  706 ? 0.51085198 0.45019859 0.29890329 -0.08308028 -0.05836081 -0.00219373 761  ILE   A HG23 
10917 H  HD11 . ILE   A  706 ? 0.54883587 0.48105037 0.31391019 -0.08634083 -0.06497718 -0.00423126 761  ILE   A HD11 
10918 H  HD12 . ILE   A  706 ? 0.55492520 0.48307082 0.31679723 -0.08557889 -0.06012959 -0.01098914 761  ILE   A HD12 
10919 H  HD13 . ILE   A  706 ? 0.56813115 0.49410227 0.31512058 -0.08746491 -0.06319314 -0.00849254 761  ILE   A HD13 
10920 N  N    . PRO   A  707 ? 0.39100605 0.33976376 0.18944947 -0.07792898 -0.03520309 -0.00052405 762  PRO   A N    
10921 C  CA   . PRO   A  707 ? 0.34372124 0.29641956 0.15522909 -0.07559360 -0.03171939 -0.00129797 762  PRO   A CA   
10922 C  C    . PRO   A  707 ? 0.29964721 0.25193679 0.12076185 -0.07512382 -0.03676569 -0.00117535 762  PRO   A C    
10923 O  O    . PRO   A  707 ? 0.32542562 0.27756029 0.14714760 -0.07657886 -0.04219232 0.00175065  762  PRO   A O    
10924 C  CB   . PRO   A  707 ? 0.34649521 0.30360180 0.16224359 -0.07595471 -0.02900803 0.00360776  762  PRO   A CB   
10925 C  CG   . PRO   A  707 ? 0.35002181 0.30496842 0.15951289 -0.07802310 -0.03399149 0.00805851  762  PRO   A CG   
10926 C  CD   . PRO   A  707 ? 0.43868548 0.38866460 0.23498432 -0.07938632 -0.03655443 0.00536157  762  PRO   A CD   
10927 H  HA   . PRO   A  707 ? 0.34671545 0.29921994 0.15689982 -0.07438698 -0.02799471 -0.00488380 762  PRO   A HA   
10928 H  HB2  . PRO   A  707 ? 0.33432806 0.29403114 0.15968266 -0.07485168 -0.02899540 0.00465496  762  PRO   A HB2  
10929 H  HB3  . PRO   A  707 ? 0.34750971 0.30592746 0.15997380 -0.07602309 -0.02437828 0.00275395  762  PRO   A HB3  
10930 H  HG2  . PRO   A  707 ? 0.35905814 0.31479388 0.17495745 -0.07768299 -0.03773260 0.00981027  762  PRO   A HG2  
10931 H  HG3  . PRO   A  707 ? 0.36887866 0.32469416 0.17617166 -0.07880461 -0.03188667 0.01076824  762  PRO   A HG3  
10932 H  HD2  . PRO   A  707 ? 0.40905750 0.35762897 0.20423335 -0.08011932 -0.04170830 0.00704372  762  PRO   A HD2  
10933 H  HD3  . PRO   A  707 ? 0.41551429 0.36443064 0.20330110 -0.08041896 -0.03392464 0.00563413  762  PRO   A HD3  
10934 N  N    . VAL   A  708 ? 0.31661886 0.26875100 0.14490011 -0.07311609 -0.03497072 -0.00436878 763  VAL   A N    
10935 C  CA   . VAL   A  708 ? 0.33701089 0.28880584 0.17482512 -0.07300867 -0.03884138 -0.00387520 763  VAL   A CA   
10936 C  C    . VAL   A  708 ? 0.35986194 0.31697488 0.20942038 -0.07199121 -0.03763238 0.00008807  763  VAL   A C    
10937 O  O    . VAL   A  708 ? 0.36762947 0.32724336 0.22177775 -0.06992892 -0.03301254 -0.00053003 763  VAL   A O    
10938 C  CB   . VAL   A  708 ? 0.31131554 0.25869995 0.15003914 -0.07137664 -0.03792562 -0.00899717 763  VAL   A CB   
10939 C  CG1  . VAL   A  708 ? 0.33320662 0.27953464 0.18094738 -0.07194351 -0.04173954 -0.00806731 763  VAL   A CG1  
10940 C  CG2  . VAL   A  708 ? 0.40796447 0.34925020 0.23461807 -0.07217647 -0.03891932 -0.01369306 763  VAL   A CG2  
10941 H  H    . VAL   A  708 ? 0.31990239 0.27211305 0.14698356 -0.07176674 -0.03116581 -0.00690491 763  VAL   A H    
10942 H  HA   . VAL   A  708 ? 0.33342898 0.28405991 0.16928464 -0.07472552 -0.04303904 -0.00291132 763  VAL   A HA   
10943 H  HB   . VAL   A  708 ? 0.33290413 0.28203982 0.17422794 -0.06928980 -0.03387333 -0.00997019 763  VAL   A HB   
10944 H  HG11 . VAL   A  708 ? 0.32364804 0.27060103 0.17136736 -0.07401659 -0.04539622 -0.00610601 763  VAL   A HG11 
10945 H  HG12 . VAL   A  708 ? 0.31639609 0.26581675 0.17128007 -0.07072563 -0.04006052 -0.00623859 763  VAL   A HG12 
10946 H  HG13 . VAL   A  708 ? 0.32952303 0.27137876 0.17574281 -0.07153515 -0.04223040 -0.01129520 763  VAL   A HG13 
10947 H  HG21 . VAL   A  708 ? 0.38088161 0.31861025 0.20840013 -0.07105201 -0.03876172 -0.01691199 763  VAL   A HG21 
10948 H  HG22 . VAL   A  708 ? 0.38273251 0.32483843 0.20370066 -0.07164477 -0.03567659 -0.01456786 763  VAL   A HG22 
10949 H  HG23 . VAL   A  708 ? 0.38137269 0.32136929 0.20491053 -0.07438208 -0.04301994 -0.01268788 763  VAL   A HG23 
10950 N  N    . PRO   A  709 ? 0.36925387 0.32856929 0.22434410 -0.07323283 -0.04175246 0.00389324  764  PRO   A N    
10951 C  CA   . PRO   A  709 ? 0.35311788 0.31677592 0.21913701 -0.07222805 -0.04086659 0.00701712  764  PRO   A CA   
10952 C  C    . PRO   A  709 ? 0.32942331 0.29242057 0.20282944 -0.07072850 -0.03951705 0.00502766  764  PRO   A C    
10953 O  O    . PRO   A  709 ? 0.32540148 0.28410769 0.19755895 -0.07109886 -0.04132824 0.00204592  764  PRO   A O    
10954 C  CB   . PRO   A  709 ? 0.35225868 0.31779188 0.22157142 -0.07376857 -0.04601682 0.01018566  764  PRO   A CB   
10955 C  CG   . PRO   A  709 ? 0.34213716 0.30532128 0.20089811 -0.07532933 -0.04902066 0.01009461  764  PRO   A CG   
10956 C  CD   . PRO   A  709 ? 0.35640705 0.31476197 0.20764974 -0.07547084 -0.04748485 0.00522602  764  PRO   A CD   
10957 H  HA   . PRO   A  709 ? 0.34799212 0.31375268 0.21388035 -0.07166120 -0.03816501 0.00851822  764  PRO   A HA   
10958 H  HB2  . PRO   A  709 ? 0.34499907 0.31011036 0.21817882 -0.07433137 -0.04800400 0.00936880  764  PRO   A HB2  
10959 H  HB3  . PRO   A  709 ? 0.34104416 0.30951256 0.21459930 -0.07322621 -0.04543985 0.01291663  764  PRO   A HB3  
10960 H  HG2  . PRO   A  709 ? 0.34736747 0.31129205 0.20754863 -0.07636131 -0.05303657 0.01099149  764  PRO   A HG2  
10961 H  HG3  . PRO   A  709 ? 0.34889069 0.31270653 0.20437400 -0.07510416 -0.04772487 0.01197932  764  PRO   A HG3  
10962 H  HD2  . PRO   A  709 ? 0.36011624 0.31668508 0.21259478 -0.07628682 -0.04999307 0.00352032  764  PRO   A HD2  
10963 H  HD3  . PRO   A  709 ? 0.36531836 0.32193452 0.20837201 -0.07611707 -0.04765450 0.00476966  764  PRO   A HD3  
10964 N  N    . THR   A  710 ? 0.27666757 0.24331897 0.15719658 -0.06913144 -0.03656141 0.00677228  765  THR   A N    
10965 C  CA   . THR   A  710 ? 0.26092613 0.22715679 0.14865722 -0.06748842 -0.03563766 0.00572373  765  THR   A CA   
10966 C  C    . THR   A  710 ? 0.25231832 0.21985093 0.14655282 -0.06888971 -0.03901231 0.00857543  765  THR   A C    
10967 O  O    . THR   A  710 ? 0.25682881 0.22229703 0.15519731 -0.06879205 -0.03995641 0.00794277  765  THR   A O    
10968 C  CB   . THR   A  710 ? 0.27847883 0.24858092 0.17084183 -0.06527893 -0.03133380 0.00619837  765  THR   A CB   
10969 O  OG1  . THR   A  710 ? 0.25888056 0.23332834 0.15413442 -0.06618422 -0.03110666 0.01023993  765  THR   A OG1  
10970 C  CG2  . THR   A  710 ? 0.42947799 0.39971265 0.31663397 -0.06389929 -0.02733556 0.00302688  765  THR   A CG2  
10971 H  H    . THR   A  710 ? 0.28213817 0.25130165 0.16267718 -0.06912843 -0.03521948 0.00871588  765  THR   A H    
10972 H  HA   . THR   A  710 ? 0.27215999 0.23468773 0.15739538 -0.06705495 -0.03589007 0.00284971  765  THR   A HA   
10973 H  HB   . THR   A  710 ? 0.28778350 0.25737336 0.18485540 -0.06414976 -0.03140806 0.00578506  765  THR   A HB   
10975 H  HG21 . THR   A  710 ? 0.37064713 0.34417525 0.26170018 -0.06266832 -0.02470694 0.00331835  765  THR   A HG21 
10976 H  HG22 . THR   A  710 ? 0.37767404 0.34803820 0.25939438 -0.06523348 -0.02716226 0.00357739  765  THR   A HG22 
10977 H  HG23 . THR   A  710 ? 0.37911251 0.34602410 0.26432139 -0.06293470 -0.02754499 0.00005553  765  THR   A HG23 
10978 N  N    . HIS   A  711 ? 0.27590340 0.24677673 0.17074446 -0.07012299 -0.04071877 0.01174192  766  HIS   A N    
10979 C  CA   . HIS   A  711 ? 0.24537599 0.21889478 0.14677313 -0.07123253 -0.04349517 0.01426464  766  HIS   A CA   
10980 C  C    . HIS   A  711 ? 0.24448243 0.22017503 0.14412825 -0.07265664 -0.04705042 0.01620653  766  HIS   A C    
10981 O  O    . HIS   A  711 ? 0.26168469 0.23667134 0.15486066 -0.07259171 -0.04713091 0.01654470  766  HIS   A O    
10982 C  CB   . HIS   A  711 ? 0.24237207 0.21962032 0.15061393 -0.06975996 -0.04111538 0.01674769  766  HIS   A CB   
10983 C  CG   . HIS   A  711 ? 0.22818002 0.20425671 0.13931020 -0.06807130 -0.03829587 0.01533084  766  HIS   A CG   
10984 N  ND1  . HIS   A  711 ? 0.23600060 0.21186344 0.14459652 -0.06635925 -0.03492070 0.01363841  766  HIS   A ND1  
10985 C  CD2  . HIS   A  711 ? 0.20640065 0.18173341 0.12263422 -0.06784468 -0.03858963 0.01548487  766  HIS   A CD2  
10986 C  CE1  . HIS   A  711 ? 0.27150059 0.24667367 0.18434429 -0.06469513 -0.03369990 0.01260778  766  HIS   A CE1  
10987 N  NE2  . HIS   A  711 ? 0.26063237 0.23484711 0.17754713 -0.06559954 -0.03600845 0.01389833  766  HIS   A NE2  
10988 H  H    . HIS   A  711 ? 0.26578623 0.23732354 0.15686265 -0.07018480 -0.04007310 0.01234005  766  HIS   A H    
10989 H  HA   . HIS   A  711 ? 0.25134885 0.22295475 0.15420787 -0.07198333 -0.04467832 0.01309904  766  HIS   A HA   
10990 H  HB2  . HIS   A  711 ? 0.23798788 0.21662286 0.14463606 -0.06930202 -0.04005035 0.01791907  766  HIS   A HB2  
10991 H  HB3  . HIS   A  711 ? 0.23455966 0.21373029 0.14686719 -0.07042183 -0.04271677 0.01822593  766  HIS   A HB3  
10993 H  HD2  . HIS   A  711 ? 0.22021851 0.19590697 0.13897853 -0.06906433 -0.04028096 0.01649087  766  HIS   A HD2  
10994 H  HE1  . HIS   A  711 ? 0.26097128 0.23656216 0.17407246 -0.06311586 -0.03152632 0.01125678  766  HIS   A HE1  
10996 N  N    . TYR   A  712 ? 0.22135030 0.20004347 0.12702164 -0.07381158 -0.04985264 0.01762731  767  TYR   A N    
10997 C  CA   . TYR   A  712 ? 0.25548026 0.23786388 0.16216210 -0.07430392 -0.05327797 0.01973436  767  TYR   A CA   
10998 C  C    . TYR   A  712 ? 0.24843681 0.23588157 0.16388983 -0.07339928 -0.05287544 0.02223674  767  TYR   A C    
10999 O  O    . TYR   A  712 ? 0.28320569 0.27185744 0.20427692 -0.07418209 -0.05214502 0.02195333  767  TYR   A O    
11000 C  CB   . TYR   A  712 ? 0.30422223 0.28655091 0.20961937 -0.07687357 -0.05781914 0.01825297  767  TYR   A CB   
11001 C  CG   . TYR   A  712 ? 0.30846012 0.28592634 0.20353355 -0.07758193 -0.05900436 0.01601011  767  TYR   A CG   
11002 C  CD1  . TYR   A  712 ? 0.31087053 0.28831857 0.19964743 -0.07697088 -0.06070095 0.01734252  767  TYR   A CD1  
11003 C  CD2  . TYR   A  712 ? 0.33230072 0.30446273 0.22311530 -0.07876290 -0.05844961 0.01251638  767  TYR   A CD2  
11004 C  CE1  . TYR   A  712 ? 0.31678182 0.28958708 0.19491279 -0.07780216 -0.06155009 0.01526396  767  TYR   A CE1  
11005 C  CE2  . TYR   A  712 ? 0.32654533 0.29410145 0.20725077 -0.07927470 -0.05922470 0.01001227  767  TYR   A CE2  
11006 C  CZ   . TYR   A  712 ? 0.32690951 0.29509124 0.20111087 -0.07893705 -0.06066423 0.01140991  767  TYR   A CZ   
11007 O  OH   . TYR   A  712 ? 0.32594213 0.28945577 0.18905976 -0.07965152 -0.06129555 0.00894334  767  TYR   A OH   
11008 H  H    . TYR   A  712 ? 0.23064643 0.20922384 0.14004475 -0.07424417 -0.04960560 0.01724335  767  TYR   A H    
11009 H  HA   . TYR   A  712 ? 0.25723186 0.23885088 0.15945438 -0.07351960 -0.05301040 0.02046168  767  TYR   A HA   
11010 H  HB2  . TYR   A  712 ? 0.29122737 0.27297187 0.19958821 -0.07809623 -0.05772358 0.01720258  767  TYR   A HB2  
11011 H  HB3  . TYR   A  712 ? 0.29047766 0.27661914 0.19891568 -0.07695965 -0.06018736 0.01976639  767  TYR   A HB3  
11012 H  HD1  . TYR   A  712 ? 0.30753273 0.28774443 0.19880559 -0.07594100 -0.06129931 0.01969804  767  TYR   A HD1  
11013 H  HD2  . TYR   A  712 ? 0.32133096 0.29259217 0.21577172 -0.07915204 -0.05754300 0.01177396  767  TYR   A HD2  
11014 H  HE1  . TYR   A  712 ? 0.32323971 0.29567224 0.19645259 -0.07753934 -0.06279557 0.01644228  767  TYR   A HE1  
11015 H  HE2  . TYR   A  712 ? 0.33333117 0.29691786 0.21110871 -0.07983486 -0.05883267 0.00735005  767  TYR   A HE2  
11017 N  N    . TYR   A  713 ? 0.22500755 0.21470030 0.14079392 -0.07176925 -0.05339513 0.02464095  768  TYR   A N    
11018 C  CA   . TYR   A  713 ? 0.21840347 0.21248159 0.14163338 -0.07039326 -0.05302932 0.02668313  768  TYR   A CA   
11019 C  C    . TYR   A  713 ? 0.25205007 0.25101304 0.17922577 -0.07030471 -0.05721246 0.02764605  768  TYR   A C    
11020 O  O    . TYR   A  713 ? 0.28508621 0.28349724 0.20795731 -0.07078632 -0.06069924 0.02750344  768  TYR   A O    
11021 C  CB   . TYR   A  713 ? 0.21748799 0.21012595 0.13901070 -0.06829982 -0.05065208 0.02855607  768  TYR   A CB   
11022 C  CG   . TYR   A  713 ? 0.25613531 0.24709746 0.17211235 -0.06736813 -0.05294302 0.03033317  768  TYR   A CG   
11023 C  CD1  . TYR   A  713 ? 0.24743050 0.24101171 0.16692847 -0.06556899 -0.05565994 0.03228880  768  TYR   A CD1  
11024 C  CD2  . TYR   A  713 ? 0.23101279 0.21745375 0.13782054 -0.06812327 -0.05231843 0.03007436  768  TYR   A CD2  
11025 C  CE1  . TYR   A  713 ? 0.26967090 0.26050606 0.18342750 -0.06443162 -0.05829098 0.03426616  768  TYR   A CE1  
11026 C  CE2  . TYR   A  713 ? 0.26861092 0.25248390 0.16907150 -0.06755295 -0.05445138 0.03219436  768  TYR   A CE2  
11027 C  CZ   . TYR   A  713 ? 0.25434709 0.23996593 0.15812337 -0.06566469 -0.05777861 0.03443505  768  TYR   A CZ   
11028 O  OH   . TYR   A  713 ? 0.26214087 0.24406834 0.15906650 -0.06484497 -0.06038857 0.03683027  768  TYR   A OH   
11029 H  H    . TYR   A  713 ? 0.23452733 0.22248282 0.14520136 -0.07148162 -0.05402368 0.02495167  768  TYR   A H    
11030 H  HA   . TYR   A  713 ? 0.22084120 0.21579891 0.14801538 -0.07088012 -0.05158097 0.02616473  768  TYR   A HA   
11031 H  HB2  . TYR   A  713 ? 0.21945722 0.21443474 0.14599895 -0.06743786 -0.04993396 0.02937674  768  TYR   A HB2  
11032 H  HB3  . TYR   A  713 ? 0.22456583 0.21477458 0.14361200 -0.06847040 -0.04813251 0.02778673  768  TYR   A HB3  
11033 H  HD1  . TYR   A  713 ? 0.24772856 0.24486263 0.17344335 -0.06499388 -0.05579541 0.03226505  768  TYR   A HD1  
11034 H  HD2  . TYR   A  713 ? 0.24568127 0.23058483 0.15027425 -0.06896926 -0.05029817 0.02847487  768  TYR   A HD2  
11035 H  HE1  . TYR   A  713 ? 0.26007101 0.25242609 0.17647517 -0.06276655 -0.06036195 0.03549856  768  TYR   A HE1  
11036 H  HE2  . TYR   A  713 ? 0.26323003 0.24402474 0.15689173 -0.06836472 -0.05374931 0.03206399  768  TYR   A HE2  
11038 N  N    . SER   A  714 ? 0.21123439 0.21525043 0.14648438 -0.06937818 -0.05681159 0.02858939  769  SER   A N    
11039 C  CA   . SER   A  714 ? 0.25885752 0.26857689 0.19917683 -0.06799583 -0.06013129 0.02965214  769  SER   A CA   
11040 C  C    . SER   A  714 ? 0.21471962 0.22724275 0.16089593 -0.06546327 -0.05789527 0.03086961  769  SER   A C    
11041 O  O    . SER   A  714 ? 0.22476283 0.23760247 0.17391640 -0.06613349 -0.05448588 0.03044216  769  SER   A O    
11042 C  CB   . SER   A  714 ? 0.25792408 0.27342421 0.20380610 -0.07053217 -0.06282384 0.02835547  769  SER   A CB   
11043 O  OG   . SER   A  714 ? 0.35698906 0.36964029 0.29686508 -0.07266047 -0.06586800 0.02711843  769  SER   A OG   
11044 H  H    . SER   A  714 ? 0.22467840 0.22873464 0.16238748 -0.06946393 -0.05436245 0.02845014  769  SER   A H    
11045 H  HA   . SER   A  714 ? 0.24414477 0.25205791 0.18024687 -0.06700483 -0.06220519 0.03038296  769  SER   A HA   
11046 H  HB2  . SER   A  714 ? 0.27499038 0.29116032 0.22371286 -0.07204144 -0.06071291 0.02772056  769  SER   A HB2  
11047 H  HB3  . SER   A  714 ? 0.27563757 0.29621583 0.22642231 -0.06927167 -0.06460862 0.02895079  769  SER   A HB3  
11049 N  N    . ILE   A  715 ? 0.18865407 0.20239353 0.13564168 -0.06244928 -0.06009338 0.03231177  770  ILE   A N    
11050 C  CA   . ILE   A  715 ? 0.22749339 0.24380752 0.17994839 -0.05951171 -0.05873870 0.03309237  770  ILE   A CA   
11051 C  C    . ILE   A  715 ? 0.26267460 0.28728706 0.22299623 -0.05800192 -0.06209862 0.03277089  770  ILE   A C    
11052 O  O    . ILE   A  715 ? 0.28385091 0.30902964 0.24275693 -0.05655890 -0.06650405 0.03343810  770  ILE   A O    
11053 C  CB   . ILE   A  715 ? 0.26093823 0.27098501 0.20792626 -0.05688388 -0.05856739 0.03488609  770  ILE   A CB   
11054 C  CG1  . ILE   A  715 ? 0.26765662 0.27093089 0.20756102 -0.05877584 -0.05515286 0.03503276  770  ILE   A CG1  
11055 C  CG2  . ILE   A  715 ? 0.22865337 0.24068910 0.18113893 -0.05349191 -0.05767455 0.03529272  770  ILE   A CG2  
11056 C  CD1  . ILE   A  715 ? 0.27428561 0.27101150 0.20706013 -0.05765032 -0.05544877 0.03694709  770  ILE   A CD1  
11057 H  H    . ILE   A  715 ? 0.20853958 0.22100088 0.15209110 -0.06208866 -0.06273091 0.03277233  770  ILE   A H    
11058 H  HA   . ILE   A  715 ? 0.22347000 0.24048777 0.17828357 -0.06033495 -0.05587780 0.03252288  770  ILE   A HA   
11059 H  HB   . ILE   A  715 ? 0.25522050 0.26412356 0.19924609 -0.05612905 -0.06163052 0.03566770  770  ILE   A HB   
11060 H  HG12 . ILE   A  715 ? 0.26198030 0.26582530 0.20452623 -0.05898239 -0.05244910 0.03454717  770  ILE   A HG12 
11061 H  HG13 . ILE   A  715 ? 0.26676673 0.26956370 0.20423467 -0.06075370 -0.05533063 0.03420517  770  ILE   A HG13 
11062 H  HG21 . ILE   A  715 ? 0.23226219 0.24633145 0.18805565 -0.05424958 -0.05500208 0.03442093  770  ILE   A HG21 
11063 H  HG22 . ILE   A  715 ? 0.23783377 0.25401077 0.19432560 -0.05177007 -0.06015055 0.03521710  770  ILE   A HG22 
11064 H  HG23 . ILE   A  715 ? 0.23967317 0.24666947 0.18815181 -0.05231514 -0.05734983 0.03640959  770  ILE   A HG23 
11065 H  HD11 . ILE   A  715 ? 0.27307475 0.26931053 0.20786205 -0.05580094 -0.05513844 0.03765916  770  ILE   A HD11 
11066 H  HD12 . ILE   A  715 ? 0.27892196 0.27472520 0.20855044 -0.05732936 -0.05832744 0.03764153  770  ILE   A HD12 
11067 H  HD13 . ILE   A  715 ? 0.27417460 0.26784974 0.20317376 -0.05916564 -0.05311916 0.03678986  770  ILE   A HD13 
11068 N  N    . ILE   A  716 ? 0.18329486 0.21458155 0.15183011 -0.05824546 -0.05995740 0.03176751  771  ILE   A N    
11069 C  CA   . ILE   A  716 ? 0.19916317 0.24029325 0.17692059 -0.05700328 -0.06212633 0.03102928  771  ILE   A CA   
11070 C  C    . ILE   A  716 ? 0.26388621 0.30758667 0.24658430 -0.05277183 -0.06036061 0.03105501  771  ILE   A C    
11071 O  O    . ILE   A  716 ? 0.22868471 0.27337486 0.21370912 -0.05336741 -0.05608269 0.03041359  771  ILE   A O    
11072 C  CB   . ILE   A  716 ? 0.19977915 0.24722642 0.18292922 -0.06148387 -0.06075444 0.02961324  771  ILE   A CB   
11073 C  CG1  . ILE   A  716 ? 0.20541096 0.24770775 0.18202934 -0.06561179 -0.06214276 0.02927653  771  ILE   A CG1  
11074 C  CG2  . ILE   A  716 ? 0.22988755 0.28904542 0.22332355 -0.06081789 -0.06299736 0.02868610  771  ILE   A CG2  
11075 C  CD1  . ILE   A  716 ? 0.23554078 0.28082019 0.21541387 -0.07061961 -0.06050170 0.02811411  771  ILE   A CD1  
11076 H  H    . ILE   A  716 ? 0.19895104 0.22882912 0.16731626 -0.05927894 -0.05690330 0.03150101  771  ILE   A H    
11077 H  HA   . ILE   A  716 ? 0.21101651 0.25290757 0.18808153 -0.05611153 -0.06576005 0.03135248  771  ILE   A HA   
11078 H  HB   . ILE   A  716 ? 0.20173672 0.24850929 0.18554446 -0.06215062 -0.05725716 0.02946230  771  ILE   A HB   
11079 H  HG12 . ILE   A  716 ? 0.21500607 0.25830832 0.19083007 -0.06528315 -0.06573205 0.02929512  771  ILE   A HG12 
11080 H  HG13 . ILE   A  716 ? 0.21203487 0.24746674 0.18247670 -0.06536984 -0.06070000 0.02975950  771  ILE   A HG13 
11081 H  HG21 . ILE   A  716 ? 0.22326344 0.28336090 0.21627557 -0.06004935 -0.06684063 0.02884019  771  ILE   A HG21 
11082 H  HG22 . ILE   A  716 ? 0.21854214 0.28055391 0.21578504 -0.05784217 -0.06181180 0.02862148  771  ILE   A HG22 
11083 H  HG23 . ILE   A  716 ? 0.21850520 0.28157005 0.21524213 -0.06416462 -0.06185117 0.02792428  771  ILE   A HG23 
11084 H  HD11 . ILE   A  716 ? 0.22542356 0.27786201 0.21139151 -0.07144724 -0.06200191 0.02759314  771  ILE   A HD11 
11085 H  HD12 . ILE   A  716 ? 0.22246772 0.26685518 0.20299514 -0.07088132 -0.05717281 0.02825411  771  ILE   A HD12 
11086 H  HD13 . ILE   A  716 ? 0.22823736 0.26895365 0.20322484 -0.07278653 -0.06135361 0.02773945  771  ILE   A HD13 
11087 N  N    . THR   A  717 ? 0.20574179 0.25043914 0.18985675 -0.04840580 -0.06398780 0.03166041  772  THR   A N    
11088 C  CA   . THR   A  717 ? 0.29003024 0.33583260 0.27807623 -0.04356104 -0.06299021 0.03143900  772  THR   A CA   
11089 C  C    . THR   A  717 ? 0.28856108 0.34604061 0.28751135 -0.04055050 -0.06538972 0.03004785  772  THR   A C    
11090 O  O    . THR   A  717 ? 0.23258412 0.29498953 0.23421676 -0.04066540 -0.06997417 0.03009878  772  THR   A O    
11091 C  CB   . THR   A  717 ? 0.26335165 0.29885790 0.24341536 -0.04020439 -0.06516335 0.03339269  772  THR   A CB   
11092 O  OG1  . THR   A  717 ? 0.20005451 0.22659785 0.17049697 -0.04378710 -0.06342489 0.03458866  772  THR   A OG1  
11093 C  CG2  . THR   A  717 ? 0.24891050 0.28236097 0.23097035 -0.03562995 -0.06353287 0.03303719  772  THR   A CG2  
11094 H  H    . THR   A  717 ? 0.23836723 0.28264582 0.22062978 -0.04830146 -0.06737693 0.03217366  772  THR   A H    
11095 H  HA   . THR   A  717 ? 0.25913924 0.30449611 0.24770409 -0.04442872 -0.05925326 0.03085911  772  THR   A HA   
11096 H  HB   . THR   A  717 ? 0.25491107 0.29135269 0.23495734 -0.03870795 -0.06915949 0.03400878  772  THR   A HB   
11098 H  HG21 . THR   A  717 ? 0.25920036 0.28523305 0.23559046 -0.03406674 -0.06496504 0.03446277  772  THR   A HG21 
11099 H  HG22 . THR   A  717 ? 0.24985531 0.28287348 0.23208180 -0.03707741 -0.05979289 0.03230690  772  THR   A HG22 
11100 H  HG23 . THR   A  717 ? 0.25422841 0.29403931 0.24288312 -0.03283051 -0.06485077 0.03203622  772  THR   A HG23 
11101 N  N    . SER   A  718 ? 0.20662686 0.26867723 0.21178070 -0.03771377 -0.06225440 0.02860004  773  SER   A N    
11102 C  CA   . SER   A  718 ? 0.22402990 0.29778317 0.24036483 -0.03387969 -0.06359926 0.02681506  773  SER   A CA   
11103 C  C    . SER   A  718 ? 0.31482539 0.38720685 0.33302289 -0.02874803 -0.06077362 0.02561577  773  SER   A C    
11104 O  O    . SER   A  718 ? 0.27333227 0.33540189 0.28385973 -0.02869973 -0.05818836 0.02633490  773  SER   A O    
11105 C  CB   . SER   A  718 ? 0.27067614 0.35710925 0.29583022 -0.03834594 -0.06163906 0.02516605  773  SER   A CB   
11106 O  OG   . SER   A  718 ? 0.21403888 0.29977995 0.23812413 -0.04163102 -0.05561812 0.02453881  773  SER   A OG   
11107 H  H    . SER   A  718 ? 0.22594917 0.28383830 0.22824633 -0.03813229 -0.05907669 0.02856811  773  SER   A H    
11108 H  HA   . SER   A  718 ? 0.24645245 0.32050902 0.26316395 -0.03155319 -0.06802811 0.02744538  773  SER   A HA   
11109 H  HB2  . SER   A  718 ? 0.24585076 0.34111038 0.27911502 -0.03575599 -0.06263928 0.02387732  773  SER   A HB2  
11110 H  HB3  . SER   A  718 ? 0.24531266 0.33151764 0.26862901 -0.04161833 -0.06375746 0.02582807  773  SER   A HB3  
11112 N  N    . CYS   A  719 ? 0.25659400 0.33960068 0.28520203 -0.02427546 -0.06144949 0.02352757  774  CYS   A N    
11113 C  CA   . CYS   A  719 ? 0.29784629 0.38026190 0.32879201 -0.01888781 -0.05877265 0.02169622  774  CYS   A CA   
11114 C  C    . CYS   A  719 ? 0.24540259 0.33194822 0.27808073 -0.02226938 -0.05187618 0.01991682  774  CYS   A C    
11115 O  O    . CYS   A  719 ? 0.30439338 0.40205854 0.34384879 -0.02608093 -0.04960444 0.01884574  774  CYS   A O    
11116 C  CB   . CYS   A  719 ? 0.26679021 0.35953823 0.30855691 -0.01233767 -0.06204105 0.01977736  774  CYS   A CB   
11117 S  SG   . CYS   A  719 ? 0.31953770 0.40626764 0.36115366 -0.00351619 -0.06161757 0.01800704  774  CYS   A SG   
11118 H  H    . CYS   A  719 ? 0.27692372 0.36781710 0.31138888 -0.02448798 -0.06365382 0.02305130  774  CYS   A H    
11119 H  HA   . CYS   A  719 ? 0.27794015 0.34996793 0.30174297 -0.01726845 -0.05955426 0.02288456  774  CYS   A HA   
11120 H  HB2  . CYS   A  719 ? 0.28578427 0.37801701 0.32719031 -0.01153475 -0.06673813 0.02107323  774  CYS   A HB2  
11121 H  HB3  . CYS   A  719 ? 0.27905163 0.38289624 0.32871342 -0.01370012 -0.05997799 0.01806653  774  CYS   A HB3  
11122 N  N    . LEU   A  720 ? 0.22621194 0.30383816 0.25263730 -0.02098979 -0.04866100 0.01958623  775  LEU   A N    
11123 C  CA   . LEU   A  720 ? 0.32865563 0.40937519 0.35562101 -0.02358112 -0.04245794 0.01787835  775  LEU   A CA   
11124 C  C    . LEU   A  720 ? 0.29241011 0.38761142 0.33089629 -0.02055077 -0.04012969 0.01464174  775  LEU   A C    
11125 O  O    . LEU   A  720 ? 0.22998317 0.33326334 0.27192792 -0.02441022 -0.03553932 0.01348833  775  LEU   A O    
11126 C  CB   . LEU   A  720 ? 0.28197908 0.35038459 0.30021229 -0.02202081 -0.04026046 0.01777491  775  LEU   A CB   
11127 C  CG   . LEU   A  720 ? 0.40632343 0.47657314 0.42351636 -0.02433852 -0.03430240 0.01602017  775  LEU   A CG   
11128 C  CD1  . LEU   A  720 ? 0.37723520 0.44761461 0.39099276 -0.03171098 -0.03206436 0.01772195  775  LEU   A CD1  
11129 C  CD2  . LEU   A  720 ? 0.38686043 0.44558051 0.39643705 -0.02182176 -0.03320551 0.01541077  775  LEU   A CD2  
11130 H  H    . LEU   A  720 ? 0.25487381 0.32405514 0.27621761 -0.01862803 -0.05046735 0.02048824  775  LEU   A H    
11131 H  HA   . LEU   A  720 ? 0.28499141 0.36665702 0.31046122 -0.02860724 -0.04123559 0.01884844  775  LEU   A HA   
11132 H  HB2  . LEU   A  720 ? 0.31745976 0.37785921 0.32915834 -0.02424734 -0.04158857 0.01979234  775  LEU   A HB2  
11133 H  HB3  . LEU   A  720 ? 0.32199249 0.38826984 0.34110057 -0.01711746 -0.04181496 0.01690461  775  LEU   A HB3  
11134 H  HG   . LEU   A  720 ? 0.36799914 0.44710320 0.39178973 -0.02257506 -0.03254676 0.01395605  775  LEU   A HG   
11135 H  HD11 . LEU   A  720 ? 0.38331783 0.45580769 0.39685333 -0.03299482 -0.02846032 0.01663201  775  LEU   A HD11 
11136 H  HD12 . LEU   A  720 ? 0.38384092 0.44579530 0.39121488 -0.03320628 -0.03323806 0.01938290  775  LEU   A HD12 
11137 H  HD13 . LEU   A  720 ? 0.38098732 0.45758903 0.39897716 -0.03366878 -0.03313576 0.01819972  775  LEU   A HD13 
11138 H  HD21 . LEU   A  720 ? 0.39753979 0.45603091 0.40935940 -0.01696427 -0.03431479 0.01400858  775  LEU   A HD21 
11139 H  HD22 . LEU   A  720 ? 0.39389852 0.44443104 0.39758003 -0.02336639 -0.03499874 0.01738198  775  LEU   A HD22 
11140 H  HD23 . LEU   A  720 ? 0.39260197 0.45221514 0.40078846 -0.02358913 -0.02967092 0.01439066  775  LEU   A HD23 
11141 N  N    . ASP   A  721 ? 0.22732192 0.32583761 0.27170977 -0.01355315 -0.04336418 0.01321546  776  ASP   A N    
11142 C  CA   . ASP   A  721 ? 0.22082552 0.33482260 0.27779549 -0.01000070 -0.04180015 0.00992018  776  ASP   A CA   
11143 C  C    . ASP   A  721 ? 0.21225905 0.33780721 0.27750790 -0.01273269 -0.04531194 0.01072814  776  ASP   A C    
11144 O  O    . ASP   A  721 ? 0.23478201 0.36063811 0.30269843 -0.00892698 -0.05144995 0.01152876  776  ASP   A O    
11145 C  CB   . ASP   A  721 ? 0.23066959 0.34252644 0.29035977 -0.00066564 -0.04399354 0.00777399  776  ASP   A CB   
11146 C  CG   . ASP   A  721 ? 0.22209102 0.35088962 0.29599258 0.00400958  -0.04317743 0.00418178  776  ASP   A CG   
11147 O  OD1  . ASP   A  721 ? 0.28077006 0.42322779 0.36208880 -0.00063422 -0.03974837 0.00318000  776  ASP   A OD1  
11148 O  OD2  . ASP   A  721 ? 0.26264542 0.39127237 0.34069699 0.01240140  -0.04649074 0.00249420  776  ASP   A OD2  
11149 H  H    . ASP   A  721 ? 0.24354511 0.33438718 0.28398097 -0.01080651 -0.04663959 0.01431589  776  ASP   A H    
11150 H  HA   . ASP   A  721 ? 0.22086374 0.33906078 0.27886602 -0.01228608 -0.03701542 0.00855281  776  ASP   A HA   
11151 H  HB2  . ASP   A  721 ? 0.23094895 0.33584717 0.28544125 0.00047814  -0.04139022 0.00694567  776  ASP   A HB2  
11152 H  HB3  . ASP   A  721 ? 0.23109192 0.33654940 0.28788275 0.00140099  -0.04874534 0.00954138  776  ASP   A HB3  
11153 N  N    . PHE   A  722 ? 0.29583347 0.43029821 0.36452979 -0.01968178 -0.04160850 0.01061309  777  PHE   A N    
11154 C  CA   . PHE   A  722 ? 0.26857045 0.41260391 0.34365535 -0.02417142 -0.04461010 0.01150894  777  PHE   A CA   
11155 C  C    . PHE   A  722 ? 0.21387929 0.37391609 0.30342087 -0.01938310 -0.04739686 0.00909287  777  PHE   A C    
11156 O  O    . PHE   A  722 ? 0.27082431 0.43864340 0.36608577 -0.02218135 -0.05133876 0.00973688  777  PHE   A O    
11157 C  CB   . PHE   A  722 ? 0.28328794 0.43267927 0.35866416 -0.03303542 -0.03955429 0.01183543  777  PHE   A CB   
11158 C  CG   . PHE   A  722 ? 0.22998814 0.39028800 0.31186521 -0.03328386 -0.03270086 0.00904880  777  PHE   A CG   
11159 C  CD1  . PHE   A  722 ? 0.22378540 0.40221423 0.31985635 -0.03183278 -0.03180203 0.00635531  777  PHE   A CD1  
11160 C  CD2  . PHE   A  722 ? 0.31822836 0.47097903 0.39184695 -0.03500548 -0.02715078 0.00903198  777  PHE   A CD2  
11161 C  CE1  . PHE   A  722 ? 0.28707373 0.47588834 0.38866833 -0.03209584 -0.02489782 0.00360860  777  PHE   A CE1  
11162 C  CE2  . PHE   A  722 ? 0.27915579 0.44159254 0.35742110 -0.03565473 -0.02066540 0.00652567  777  PHE   A CE2  
11163 C  CZ   . PHE   A  722 ? 0.31576174 0.49610311 0.40778768 -0.03420724 -0.01929825 0.00379657  777  PHE   A CZ   
11164 H  H    . PHE   A  722 ? 0.26296031 0.39704427 0.32952729 -0.02188780 -0.03718367 0.00999917  777  PHE   A H    
11165 H  HA   . PHE   A  722 ? 0.26480246 0.40104979 0.33421022 -0.02501768 -0.04849615 0.01361962  777  PHE   A HA   
11166 H  HB2  . PHE   A  722 ? 0.26443624 0.41986102 0.34413275 -0.03607071 -0.04185422 0.01229831  777  PHE   A HB2  
11167 H  HB3  . PHE   A  722 ? 0.26524612 0.40432221 0.33157012 -0.03594737 -0.03868962 0.01355633  777  PHE   A HB3  
11168 H  HD1  . PHE   A  722 ? 0.23966220 0.42373857 0.34176865 -0.03044721 -0.03590649 0.00626043  777  PHE   A HD1  
11169 H  HD2  . PHE   A  722 ? 0.28470623 0.42596084 0.34934306 -0.03612679 -0.02777449 0.01077115  777  PHE   A HD2  
11170 H  HE1  . PHE   A  722 ? 0.27616543 0.47825122 0.38801455 -0.03121753 -0.02403062 0.00163691  777  PHE   A HE1  
11171 H  HE2  . PHE   A  722 ? 0.29583448 0.45272142 0.36778212 -0.03685299 -0.01720572 0.00657488  777  PHE   A HE2  
11172 H  HZ   . PHE   A  722 ? 0.29989943 0.48712403 0.39492282 -0.03460177 -0.01451726 0.00195044  777  PHE   A HZ   
11173 N  N    . THR   A  723 ? 0.21134992 0.37663150 0.30707625 -0.01211412 -0.04551562 0.00605872  778  THR   A N    
11174 C  CA   . THR   A  723 ? 0.22817951 0.40902644 0.33844018 -0.00640292 -0.04842211 0.00345350  778  THR   A CA   
11175 C  C    . THR   A  723 ? 0.20283011 0.37715703 0.31163090 -0.00060211 -0.05709734 0.00510413  778  THR   A C    
11176 O  O    . THR   A  723 ? 0.18294229 0.36916894 0.30325145 0.00426472  -0.06120108 0.00349555  778  THR   A O    
11177 C  CB   . THR   A  723 ? 0.25959510 0.44843796 0.37728554 0.00023913  -0.04365567 -0.00078575 778  THR   A CB   
11178 O  OG1  . THR   A  723 ? 0.35652852 0.52983075 0.46513230 0.00692074  -0.04459273 -0.00086454 778  THR   A OG1  
11179 C  CG2  . THR   A  723 ? 0.28000095 0.47639781 0.39888209 -0.00583550 -0.03481473 -0.00241930 778  THR   A CG2  
11180 H  H    . THR   A  723 ? 0.21841276 0.37776902 0.30945802 -0.01060416 -0.04239518 0.00541341  778  THR   A H    
11181 H  HA   . THR   A  723 ? 0.22117524 0.41262209 0.33797216 -0.01085950 -0.04800972 0.00326251  778  THR   A HA   
11182 H  HB   . THR   A  723 ? 0.27293074 0.47323403 0.40125304 0.00401056  -0.04586608 -0.00256572 778  THR   A HB   
11184 H  HG21 . THR   A  723 ? 0.27450669 0.47670412 0.39825642 -0.00147119 -0.03170857 -0.00539718 778  THR   A HG21 
11185 H  HG22 . THR   A  723 ? 0.27093020 0.45620328 0.37952739 -0.00923018 -0.03287223 -0.00072179 778  THR   A HG22 
11186 H  HG23 . THR   A  723 ? 0.26953691 0.47594824 0.39436829 -0.01073071 -0.03428859 -0.00219644 778  THR   A HG23 
11187 N  N    . GLN   A  724 ? 0.25674444 0.41228992 0.35136616 -0.00082123 -0.05970919 0.00822749  779  GLN   A N    
11188 C  CA   . GLN   A  724 ? 0.34100461 0.48828086 0.43163508 0.00363230  -0.06786295 0.01049791  779  GLN   A CA   
11189 C  C    . GLN   A  724 ? 0.23882070 0.38095194 0.32223392 -0.00372351 -0.07113416 0.01384871  779  GLN   A C    
11190 O  O    . GLN   A  724 ? 0.24819040 0.38396266 0.32372004 -0.01070977 -0.06713469 0.01517239  779  GLN   A O    
11191 C  CB   . GLN   A  724 ? 0.33351547 0.46263605 0.41288549 0.00913587  -0.06891321 0.01165849  779  GLN   A CB   
11192 C  CG   . GLN   A  724 ? 0.38696992 0.51898652 0.47241211 0.01747042  -0.06691775 0.00816267  779  GLN   A CG   
11193 C  CD   . GLN   A  724 ? 0.53626889 0.64905185 0.60932398 0.02106152  -0.06701918 0.00925841  779  GLN   A CD   
11194 O  OE1  . GLN   A  724 ? 0.64079678 0.74536216 0.70579320 0.01731649  -0.06181528 0.00935312  779  GLN   A OE1  
11195 N  NE2  . GLN   A  724 ? 0.64633048 0.75158048 0.71781689 0.02848740  -0.07310509 0.01001718  779  GLN   A NE2  
11196 H  H    . GLN   A  724 ? 0.25437140 0.40201020 0.34144217 -0.00377301 -0.05635298 0.00900130  779  GLN   A H    
11197 H  HA   . GLN   A  724 ? 0.29876944 0.45569074 0.39868277 0.00779147  -0.07085357 0.00906853  779  GLN   A HA   
11198 H  HB2  . GLN   A  724 ? 0.34573850 0.46644312 0.41682327 0.00504501  -0.06572022 0.01280488  779  GLN   A HB2  
11199 H  HB3  . GLN   A  724 ? 0.35143870 0.47445324 0.42698309 0.01096530  -0.07428376 0.01368761  779  GLN   A HB3  
11200 H  HG2  . GLN   A  724 ? 0.40678379 0.54571962 0.49987045 0.02241832  -0.07078265 0.00718352  779  GLN   A HG2  
11201 H  HG3  . GLN   A  724 ? 0.39726022 0.53724122 0.48744553 0.01571214  -0.06164778 0.00591120  779  GLN   A HG3  
11202 H  HE21 . GLN   A  724 ? 0.61065668 0.72038913 0.68636703 0.03049587  -0.07759406 0.01062169  779  GLN   A HE21 
11203 H  HE22 . GLN   A  724 ? 0.61693746 0.71231210 0.68291891 0.03143188  -0.07289012 0.00997518  779  GLN   A HE22 
11204 N  N    . PRO   A  725 ? 0.22997795 0.37535244 0.31622368 -0.00220663 -0.07861818 0.01502470  780  PRO   A N    
11205 C  CA   . PRO   A  725 ? 0.26221520 0.40180385 0.34055501 -0.00869403 -0.08208919 0.01786501  780  PRO   A CA   
11206 C  C    . PRO   A  725 ? 0.28758705 0.40680766 0.34918976 -0.00928328 -0.08259535 0.02102477  780  PRO   A C    
11207 O  O    . PRO   A  725 ? 0.30567726 0.41526669 0.36245495 -0.00359033 -0.08286955 0.02148987  780  PRO   A O    
11208 C  CB   . PRO   A  725 ? 0.27765608 0.42592454 0.36340529 -0.00536929 -0.09029476 0.01790765  780  PRO   A CB   
11209 C  CG   . PRO   A  725 ? 0.35579449 0.50842267 0.44946736 0.00447584  -0.09231021 0.01610532  780  PRO   A CG   
11210 C  CD   . PRO   A  725 ? 0.24576366 0.40072250 0.34287789 0.00593222  -0.08415873 0.01343982  780  PRO   A CD   
11211 H  HA   . PRO   A  725 ? 0.25590199 0.40041804 0.33599788 -0.01454836 -0.07884877 0.01738913  780  PRO   A HA   
11212 H  HB2  . PRO   A  725 ? 0.29395649 0.43330300 0.37136513 -0.00604567 -0.09439371 0.02021139  780  PRO   A HB2  
11213 H  HB3  . PRO   A  725 ? 0.28682375 0.44654369 0.38030249 -0.00896324 -0.09014915 0.01672382  780  PRO   A HB3  
11214 H  HG2  . PRO   A  725 ? 0.31566334 0.45735013 0.40193260 0.00825494  -0.09589516 0.01791647  780  PRO   A HG2  
11215 H  HG3  . PRO   A  725 ? 0.30976230 0.47458270 0.41365895 0.00628393  -0.09542981 0.01474742  780  PRO   A HG3  
11216 H  HD2  . PRO   A  725 ? 0.26747835 0.41572782 0.36207151 0.01172269  -0.08473272 0.01326610  780  PRO   A HD2  
11217 H  HD3  . PRO   A  725 ? 0.25984466 0.42877710 0.36812928 0.00607020  -0.08217168 0.01095205  780  PRO   A HD3  
11218 N  N    . ALA   A  726 ? 0.33797055 0.45084137 0.39093244 -0.01631301 -0.08267496 0.02301923  781  ALA   A N    
11219 C  CA   . ALA   A  726 ? 0.38841054 0.48376399 0.42628008 -0.01798960 -0.08191050 0.02569111  781  ALA   A CA   
11220 C  C    . ALA   A  726 ? 0.35646713 0.44141144 0.38716775 -0.01245184 -0.08805880 0.02800575  781  ALA   A C    
11221 O  O    . ALA   A  726 ? 0.33912134 0.40988487 0.35901415 -0.01161212 -0.08706141 0.02990414  781  ALA   A O    
11222 C  CB   . ALA   A  726 ? 0.37821934 0.47055045 0.40956870 -0.02584807 -0.08155356 0.02689512  781  ALA   A CB   
11223 H  H    . ALA   A  726 ? 0.33190984 0.45169374 0.38863146 -0.02019078 -0.08315213 0.02256763  781  ALA   A H    
11224 H  HA   . ALA   A  726 ? 0.36697963 0.45884651 0.40316799 -0.01774499 -0.07747333 0.02516097  781  ALA   A HA   
11225 H  HB1  . ALA   A  726 ? 0.38140073 0.46290511 0.40321371 -0.02679817 -0.08096611 0.02851333  781  ALA   A HB1  
11226 H  HB2  . ALA   A  726 ? 0.37292525 0.47028029 0.40781093 -0.02941888 -0.07763813 0.02570699  781  ALA   A HB2  
11227 H  HB3  . ALA   A  726 ? 0.38227844 0.47833294 0.41527957 -0.02638483 -0.08588388 0.02716220  781  ALA   A HB3  
11228 N  N    . ASP   A  727 ? 0.31292105 0.40471333 0.34934789 -0.00889319 -0.09478404 0.02803894  782  ASP   A N    
11229 C  CA   . ASP   A  727 ? 0.37582192 0.45686597 0.40421537 -0.00396143 -0.10128472 0.03072685  782  ASP   A CA   
11230 C  C    . ASP   A  727 ? 0.32852119 0.40976968 0.36258286 0.00511497  -0.10296621 0.02974356  782  ASP   A C    
11231 O  O    . ASP   A  727 ? 0.36296511 0.43545666 0.39132676 0.01010665  -0.10886766 0.03196567  782  ASP   A O    
11232 C  CB   . ASP   A  727 ? 0.35990658 0.44461358 0.38766354 -0.00519203 -0.10885803 0.03201243  782  ASP   A CB   
11233 C  CG   . ASP   A  727 ? 0.33918452 0.44182819 0.38251314 -0.00281464 -0.11240217 0.02950584  782  ASP   A CG   
11234 O  OD1  . ASP   A  727 ? 0.41635901 0.52960545 0.47201738 0.00071451  -0.10897002 0.02662477  782  ASP   A OD1  
11235 O  OD2  . ASP   A  727 ? 0.54286218 0.64992315 0.58658397 -0.00472568 -0.11831084 0.03010816  782  ASP   A OD2  
11236 H  H    . ASP   A  727 ? 0.33407950 0.43713444 0.37925428 -0.00962423 -0.09549549 0.02648953  782  ASP   A H    
11237 H  HA   . ASP   A  727 ? 0.35242563 0.42191130 0.37041149 -0.00597910 -0.09971882 0.03255591  782  ASP   A HA   
11238 H  HB2  . ASP   A  727 ? 0.36742735 0.44358099 0.38826427 -0.00215636 -0.11299779 0.03414717  782  ASP   A HB2  
11239 H  HB3  . ASP   A  727 ? 0.35700768 0.43993667 0.37993225 -0.01088870 -0.10751123 0.03249399  782  ASP   A HB3  
11240 N  N    . LYS   A  728 ? 0.33504954 0.42530027 0.37937456 0.00727450  -0.09770753 0.02642192  783  LYS   A N    
11241 C  CA   . LYS   A  728 ? 0.32022965 0.41020745 0.36976033 0.01615121  -0.09851675 0.02479768  783  LYS   A CA   
11242 C  C    . LYS   A  728 ? 0.33143589 0.41962853 0.38108549 0.01543338  -0.09028195 0.02254834  783  LYS   A C    
11243 O  O    . LYS   A  728 ? 0.43933636 0.53901392 0.50027072 0.01884278  -0.08701152 0.01891839  783  LYS   A O    
11244 C  CB   . LYS   A  728 ? 0.45422658 0.56197679 0.52010739 0.02170674  -0.10212217 0.02195762  783  LYS   A CB   
11245 C  CG   . LYS   A  728 ? 0.50553584 0.61607707 0.57262558 0.02397652  -0.11165539 0.02389086  783  LYS   A CG   
11246 C  CD   . LYS   A  728 ? 0.51823390 0.64461315 0.60202086 0.03247843  -0.11584390 0.02084009  783  LYS   A CD   
11247 C  CE   . LYS   A  728 ? 0.93821865 1.06112146 1.02052736 0.03883778  -0.12639931 0.02312304  783  LYS   A CE   
11248 N  NZ   . LYS   A  728 ? 0.93843722 1.06582427 1.01898277 0.03313495  -0.13190475 0.02507154  783  LYS   A NZ   
11249 H  H    . LYS   A  728 ? 0.32094187 0.41743502 0.36882132 0.00315831  -0.09350725 0.02506199  783  LYS   A H    
11250 H  HA   . LYS   A  728 ? 0.35514197 0.43374985 0.39683038 0.01904522  -0.10205443 0.02698307  783  LYS   A HA   
11251 H  HB2  . LYS   A  728 ? 0.41653579 0.53562003 0.48988396 0.01813146  -0.09851455 0.01998727  783  LYS   A HB2  
11252 H  HB3  . LYS   A  728 ? 0.42808619 0.53542823 0.49740261 0.02769400  -0.10170326 0.02043353  783  LYS   A HB3  
11253 H  HG2  . LYS   A  728 ? 0.50434333 0.60187227 0.56129909 0.02565065  -0.11501602 0.02658924  783  LYS   A HG2  
11254 H  HG3  . LYS   A  728 ? 0.49276280 0.60784769 0.55981028 0.01825633  -0.11189914 0.02436935  783  LYS   A HG3  
11255 H  HD2  . LYS   A  728 ? 0.58125669 0.72171819 0.67467332 0.02946434  -0.11437187 0.01889232  783  LYS   A HD2  
11256 H  HD3  . LYS   A  728 ? 0.58647764 0.71227336 0.67322600 0.03693377  -0.11286356 0.01899447  783  LYS   A HD3  
11257 H  HE2  . LYS   A  728 ? 0.81632578 0.94851601 0.90938050 0.04504484  -0.12843163 0.02090456  783  LYS   A HE2  
11258 H  HE3  . LYS   A  728 ? 0.82125401 0.92916763 0.89273334 0.04094470  -0.12794973 0.02551304  783  LYS   A HE3  
11259 H  HZ1  . LYS   A  728 ? 0.93166381 1.07269597 1.02217495 0.03078305  -0.13061820 0.02291219  783  LYS   A HZ1  
11260 H  HZ2  . LYS   A  728 ? 0.93429905 1.05274487 1.00461757 0.02780397  -0.13017799 0.02702030  783  LYS   A HZ2  
11261 H  HZ3  . LYS   A  728 ? 0.94531167 1.07065630 1.02485967 0.03725614  -0.13837913 0.02641317  783  LYS   A HZ3  
11262 N  N    . CYS   A  729 ? 0.38260907 0.45662490 0.41943890 0.01084916  -0.08694998 0.02463224  784  CYS   A N    
11263 C  CA   . CYS   A  729 ? 0.36681607 0.43790683 0.40198761 0.00921120  -0.07956885 0.02284118  784  CYS   A CA   
11264 C  C    . CYS   A  729 ? 0.37279385 0.42894572 0.40036446 0.01461323  -0.08008743 0.02333162  784  CYS   A C    
11265 O  O    . CYS   A  729 ? 0.45274746 0.49452204 0.46905810 0.01425343  -0.08349358 0.02671206  784  CYS   A O    
11266 C  CB   . CYS   A  729 ? 0.33399326 0.40108865 0.36152926 0.00023479  -0.07549158 0.02441362  784  CYS   A CB   
11267 S  SG   . CYS   A  729 ? 0.46549919 0.52898133 0.49006039 -0.00266477 -0.06695909 0.02257922  784  CYS   A SG   
11268 H  H    . CYS   A  729 ? 0.37097639 0.43712437 0.39982301 0.00865918  -0.08941175 0.02719326  784  CYS   A H    
11269 H  HA   . CYS   A  729 ? 0.36121628 0.44319940 0.40557295 0.01045249  -0.07700660 0.02009962  784  CYS   A HA   
11270 H  HB2  . CYS   A  729 ? 0.35708544 0.43313479 0.38947126 -0.00297299 -0.07547804 0.02399480  784  CYS   A HB2  
11271 H  HB3  . CYS   A  729 ? 0.36551329 0.42283797 0.38439378 -0.00111170 -0.07780062 0.02695094  784  CYS   A HB3  
11272 N  N    . ASP   A  730 ? 0.51809406 0.57745081 0.55148375 0.01939547  -0.07657563 0.01983374  785  ASP   A N    
11273 C  CA   . ASP   A  730 ? 0.48297155 0.52807122 0.50954103 0.02442500  -0.07667567 0.01959596  785  ASP   A CA   
11274 C  C    . ASP   A  730 ? 0.52882504 0.56357819 0.54574203 0.01900956  -0.07109968 0.01998173  785  ASP   A C    
11275 O  O    . ASP   A  730 ? 0.95923960 0.97799879 0.96538270 0.01902615  -0.07242116 0.02213160  785  ASP   A O    
11276 C  CB   . ASP   A  730 ? 0.54459178 0.59696376 0.58112478 0.03245328  -0.07519918 0.01500326  785  ASP   A CB   
11277 C  CG   . ASP   A  730 ? 0.64036095 0.70015812 0.68613797 0.04030993  -0.08145098 0.01423798  785  ASP   A CG   
11278 O  OD1  . ASP   A  730 ? 0.82411236 0.87358105 0.86355919 0.04279906  -0.08825393 0.01762307  785  ASP   A OD1  
11279 O  OD2  . ASP   A  730 ? 0.65619040 0.73243499 0.71560776 0.04406216  -0.07959956 0.01024563  785  ASP   A OD2  
11280 H  H    . ASP   A  730 ? 0.46200749 0.53269368 0.50369042 0.01937763  -0.07394820 0.01740780  785  ASP   A H    
11281 H  HA   . ASP   A  730 ? 0.51743007 0.55397046 0.53870595 0.02646332  -0.08142970 0.02201816  785  ASP   A HA   
11282 H  HB2  . ASP   A  730 ? 0.54273862 0.60529757 0.58520502 0.03032235  -0.07067878 0.01266741  785  ASP   A HB2  
11283 H  HB3  . ASP   A  730 ? 0.55484593 0.59689903 0.58583230 0.03471328  -0.07436574 0.01457391  785  ASP   A HB3  
11284 N  N    . GLY   A  731 ? 0.41313607 0.45734134 0.43418503 0.01436029  -0.06501502 0.01788065  786  GLY   A N    
11285 C  CA   . GLY   A  731 ? 0.44415686 0.48089069 0.45827502 0.01069052  -0.05958351 0.01719695  786  GLY   A CA   
11286 C  C    . GLY   A  731 ? 0.40331110 0.43503243 0.40933403 0.00225410  -0.05805188 0.02025197  786  GLY   A C    
11287 O  O    . GLY   A  731 ? 0.37142077 0.39972758 0.37334061 -0.00026180 -0.06174744 0.02344732  786  GLY   A O    
11288 H  H    . GLY   A  731 ? 0.43909791 0.49457347 0.46729296 0.01331303  -0.06437393 0.01691413  786  GLY   A H    
11289 H  HA2  . GLY   A  731 ? 0.43799302 0.46478772 0.44727939 0.01376078  -0.06056427 0.01715870  786  GLY   A HA2  
11290 H  HA3  . GLY   A  731 ? 0.42514998 0.47001898 0.44476119 0.01091317  -0.05580844 0.01448010  786  GLY   A HA3  
11291 N  N    . PRO   A  732 ? 0.42267489 0.45373279 0.42589599 -0.00212597 -0.05258293 0.01918423  787  PRO   A N    
11292 C  CA   . PRO   A  732 ? 0.40215838 0.42989224 0.39903170 -0.00964340 -0.05088452 0.02159322  787  PRO   A CA   
11293 C  C    . PRO   A  732 ? 0.35079601 0.38829687 0.35208446 -0.01359854 -0.05189266 0.02276119  787  PRO   A C    
11294 O  O    . PRO   A  732 ? 0.33965132 0.38918364 0.35030004 -0.01176460 -0.05263873 0.02126750  787  PRO   A O    
11295 C  CB   . PRO   A  732 ? 0.40525609 0.43345344 0.40086946 -0.01217294 -0.04519374 0.01950569  787  PRO   A CB   
11296 C  CG   . PRO   A  732 ? 0.38212949 0.41784650 0.38520843 -0.00675226 -0.04328187 0.01570534  787  PRO   A CG   
11297 C  CD   . PRO   A  732 ? 0.44177544 0.47453701 0.44709069 0.00024304  -0.04805554 0.01553950  787  PRO   A CD   
11298 H  HA   . PRO   A  732 ? 0.40046537 0.41851467 0.39050403 -0.01027335 -0.05275701 0.02360398  787  PRO   A HA   
11299 H  HB2  . PRO   A  732 ? 0.39182168 0.42475405 0.38826358 -0.01638393 -0.04324973 0.01989198  787  PRO   A HB2  
11300 H  HB3  . PRO   A  732 ? 0.40031356 0.41930214 0.38947955 -0.01292167 -0.04488741 0.02014467  787  PRO   A HB3  
11301 H  HG2  . PRO   A  732 ? 0.39486963 0.44094706 0.40408993 -0.00788522 -0.04167539 0.01474688  787  PRO   A HG2  
11302 H  HG3  . PRO   A  732 ? 0.40046641 0.43250972 0.40061820 -0.00664334 -0.04061911 0.01425999  787  PRO   A HG3  
11303 H  HD2  . PRO   A  732 ? 0.42513919 0.46652406 0.43791226 0.00373774  -0.04767134 0.01332531  787  PRO   A HD2  
11304 H  HD3  . PRO   A  732 ? 0.43055812 0.45382786 0.43084231 0.00238378  -0.04861163 0.01536993  787  PRO   A HD3  
11305 N  N    . LEU   A  733 ? 0.32803199 0.35997343 0.32238874 -0.01909785 -0.05198387 0.02528927  788  LEU   A N    
11306 C  CA   . LEU   A  733 ? 0.27265972 0.31045169 0.26864213 -0.02319093 -0.05344719 0.02656484  788  LEU   A CA   
11307 C  C    . LEU   A  733 ? 0.25122374 0.29337877 0.24780777 -0.02881495 -0.04882468 0.02588639  788  LEU   A C    
11308 O  O    . LEU   A  733 ? 0.28898379 0.32759482 0.28260005 -0.02998194 -0.04504891 0.02515232  788  LEU   A O    
11309 C  CB   . LEU   A  733 ? 0.34365764 0.37126794 0.33047593 -0.02507440 -0.05681459 0.02969589  788  LEU   A CB   
11310 C  CG   . LEU   A  733 ? 0.30802548 0.32983857 0.29243314 -0.02014973 -0.06210238 0.03118471  788  LEU   A CG   
11311 C  CD1  . LEU   A  733 ? 0.35866752 0.36916989 0.33207077 -0.02295731 -0.06415567 0.03441194  788  LEU   A CD1  
11312 C  CD2  . LEU   A  733 ? 0.42046630 0.45269287 0.41316175 -0.01731430 -0.06618061 0.03054920  788  LEU   A CD2  
11313 H  H    . LEU   A  733 ? 0.32168892 0.34580284 0.31004116 -0.02033557 -0.05106525 0.02608019  788  LEU   A H    
11314 H  HA   . LEU   A  733 ? 0.29119641 0.33643445 0.29349217 -0.02112724 -0.05531587 0.02579661  788  LEU   A HA   
11315 H  HB2  . LEU   A  733 ? 0.31614590 0.33715230 0.29749906 -0.02697768 -0.05480460 0.03027685  788  LEU   A HB2  
11316 H  HB3  . LEU   A  733 ? 0.31342596 0.34444386 0.30065784 -0.02808810 -0.05745347 0.03025209  788  LEU   A HB3  
11317 H  HG   . LEU   A  733 ? 0.34554160 0.36396885 0.33001441 -0.01682999 -0.06160039 0.03038972  788  LEU   A HG   
11318 H  HD11 . LEU   A  733 ? 0.35094008 0.35603416 0.32162699 -0.01986464 -0.06715883 0.03555704  788  LEU   A HD11 
11319 H  HD12 . LEU   A  733 ? 0.34251702 0.35605502 0.31565434 -0.02543522 -0.06532521 0.03505534  788  LEU   A HD12 
11320 H  HD13 . LEU   A  733 ? 0.34258974 0.34825516 0.31182939 -0.02541569 -0.06129498 0.03462359  788  LEU   A HD13 
11321 H  HD21 . LEU   A  733 ? 0.37916684 0.41843596 0.37898684 -0.01495513 -0.06480934 0.02842820  788  LEU   A HD21 
11322 H  HD22 . LEU   A  733 ? 0.37843949 0.41474363 0.37173137 -0.02085184 -0.06639580 0.03090601  788  LEU   A HD22 
11323 H  HD23 . LEU   A  733 ? 0.38804752 0.41583112 0.37826842 -0.01436117 -0.07004134 0.03185279  788  LEU   A HD23 
11324 N  N    . SER   A  734 ? 0.22647089 0.27567589 0.22637919 -0.03242301 -0.04958752 0.02623428  789  SER   A N    
11325 C  CA   . SER   A  734 ? 0.29524231 0.34681767 0.29450715 -0.03815122 -0.04609552 0.02615915  789  SER   A CA   
11326 C  C    . SER   A  734 ? 0.26692426 0.31491870 0.26138711 -0.04222973 -0.04847649 0.02799828  789  SER   A C    
11327 O  O    . SER   A  734 ? 0.24218237 0.29290408 0.23836893 -0.04169679 -0.05258094 0.02853442  789  SER   A O    
11328 C  CB   . SER   A  734 ? 0.32068563 0.38514259 0.32936460 -0.03913280 -0.04384722 0.02421599  789  SER   A CB   
11329 O  OG   . SER   A  734 ? 0.38148373 0.44750017 0.38903329 -0.04519397 -0.04150261 0.02468547  789  SER   A OG   
11330 H  H    . SER   A  734 ? 0.24812853 0.30042455 0.25060380 -0.03129590 -0.05264573 0.02654727  789  SER   A H    
11331 H  HA   . SER   A  734 ? 0.27775177 0.32440203 0.27311122 -0.03876294 -0.04359698 0.02612571  789  SER   A HA   
11332 H  HB2  . SER   A  734 ? 0.32808852 0.39413273 0.33864409 -0.03696747 -0.04147604 0.02286632  789  SER   A HB2  
11333 H  HB3  . SER   A  734 ? 0.32880312 0.39897880 0.34249526 -0.03767677 -0.04645001 0.02391160  789  SER   A HB3  
11335 N  N    . VAL   A  735 ? 0.24657843 0.28807688 0.23465176 -0.04588235 -0.04609379 0.02878376  790  VAL   A N    
11336 C  CA   . VAL   A  735 ? 0.25564378 0.29265261 0.23828024 -0.04934017 -0.04768052 0.03007327  790  VAL   A CA   
11337 C  C    . VAL   A  735 ? 0.31503895 0.35264134 0.29690191 -0.05412642 -0.04487209 0.02978603  790  VAL   A C    
11338 O  O    . VAL   A  735 ? 0.26544946 0.30264357 0.24729840 -0.05481262 -0.04144590 0.02933192  790  VAL   A O    
11339 C  CB   . VAL   A  735 ? 0.24228680 0.26888353 0.21666135 -0.04816330 -0.04845611 0.03155134  790  VAL   A CB   
11340 C  CG1  . VAL   A  735 ? 0.27979782 0.30116868 0.25075027 -0.04886563 -0.04471239 0.03141688  790  VAL   A CG1  
11341 C  CG2  . VAL   A  735 ? 0.22990981 0.25252840 0.19855362 -0.05082108 -0.05052994 0.03264993  790  VAL   A CG2  
11342 H  H    . VAL   A  735 ? 0.25348690 0.29343385 0.24060035 -0.04604554 -0.04345878 0.02834983  790  VAL   A H    
11343 H  HA   . VAL   A  735 ? 0.26212183 0.30237389 0.24681276 -0.04922667 -0.05037048 0.03015271  790  VAL   A HA   
11344 H  HB   . VAL   A  735 ? 0.25209239 0.27793664 0.22699946 -0.04503180 -0.05026520 0.03181963  790  VAL   A HB   
11345 H  HG11 . VAL   A  735 ? 0.26524025 0.28682476 0.23538843 -0.05162074 -0.04319770 0.03127171  790  VAL   A HG11 
11346 H  HG12 . VAL   A  735 ? 0.26692376 0.29059458 0.24093437 -0.04716775 -0.04343855 0.03052899  790  VAL   A HG12 
11347 H  HG13 . VAL   A  735 ? 0.26996180 0.28545529 0.23636597 -0.04829163 -0.04523567 0.03231536  790  VAL   A HG13 
11348 H  HG21 . VAL   A  735 ? 0.23666736 0.25323302 0.20016575 -0.05042276 -0.05051748 0.03358213  790  VAL   A HG21 
11349 H  HG22 . VAL   A  735 ? 0.23632188 0.26167345 0.20651515 -0.05014512 -0.05335452 0.03277636  790  VAL   A HG22 
11350 H  HG23 . VAL   A  735 ? 0.23222844 0.25553349 0.20061149 -0.05361554 -0.04907444 0.03221493  790  VAL   A HG23 
11351 N  N    . SER   A  736 ? 0.26089031 0.29891860 0.24164000 -0.05731938 -0.04672543 0.03002110  791  SER   A N    
11352 C  CA   . SER   A  736 ? 0.26390910 0.29855499 0.24110585 -0.06151658 -0.04511276 0.03006553  791  SER   A CA   
11353 C  C    . SER   A  736 ? 0.23630434 0.26526064 0.20733464 -0.06260551 -0.04763374 0.03052733  791  SER   A C    
11354 O  O    . SER   A  736 ? 0.27170712 0.30200812 0.24271636 -0.06155208 -0.05110128 0.03071966  791  SER   A O    
11355 C  CB   . SER   A  736 ? 0.35221341 0.39363584 0.33471024 -0.06505925 -0.04452700 0.02934758  791  SER   A CB   
11356 O  OG   . SER   A  736 ? 0.35087255 0.39735103 0.33674893 -0.06584431 -0.04814664 0.02896344  791  SER   A OG   
11357 H  H    . SER   A  736 ? 0.27494904 0.31526169 0.25712368 -0.05668736 -0.04938856 0.03006495  791  SER   A H    
11358 H  HA   . SER   A  736 ? 0.26918265 0.30043542 0.24410473 -0.06140183 -0.04280514 0.03022314  791  SER   A HA   
11359 H  HB2  . SER   A  736 ? 0.32822952 0.36621663 0.30781138 -0.06764174 -0.04346804 0.02947762  791  SER   A HB2  
11360 H  HB3  . SER   A  736 ? 0.32659316 0.37229675 0.31298625 -0.06440505 -0.04267826 0.02897838  791  SER   A HB3  
11362 N  N    . SER   A  737 ? 0.19563629 0.21842596 0.16131997 -0.06449640 -0.04597115 0.03057086  792  SER   A N    
11363 C  CA   . SER   A  737 ? 0.24381170 0.26099670 0.20301533 -0.06524470 -0.04747370 0.03061219  792  SER   A CA   
11364 C  C    . SER   A  737 ? 0.27047259 0.28418323 0.22705553 -0.06820367 -0.04607194 0.02977944  792  SER   A C    
11365 O  O    . SER   A  737 ? 0.22716522 0.24098134 0.18558124 -0.06919477 -0.04373082 0.02972544  792  SER   A O    
11366 C  CB   . SER   A  737 ? 0.29229182 0.30387223 0.24626058 -0.06300771 -0.04667062 0.03152788  792  SER   A CB   
11367 O  OG   . SER   A  737 ? 0.36344144 0.37625301 0.31905895 -0.05997995 -0.04784807 0.03245264  792  SER   A OG   
11368 H  H    . SER   A  737 ? 0.21293810 0.23511054 0.17896158 -0.06521862 -0.04380884 0.03047864  792  SER   A H    
11369 H  HA   . SER   A  737 ? 0.24787217 0.26696622 0.20745726 -0.06543992 -0.05005328 0.03050066  792  SER   A HA   
11370 H  HB2  . SER   A  737 ? 0.29273373 0.30237573 0.24609199 -0.06319710 -0.04436225 0.03145312  792  SER   A HB2  
11371 H  HB3  . SER   A  737 ? 0.29810929 0.30674341 0.24775732 -0.06362436 -0.04763218 0.03149971  792  SER   A HB3  
11373 N  N    . PHE   A  738 ? 0.25087786 0.26073277 0.20233922 -0.06930459 -0.04761177 0.02910621  793  PHE   A N    
11374 C  CA   . PHE   A  738 ? 0.26007694 0.26527417 0.20822132 -0.07130430 -0.04648411 0.02797621  793  PHE   A CA   
11375 C  C    . PHE   A  738 ? 0.28446108 0.28440240 0.22557813 -0.07073139 -0.04668781 0.02719408  793  PHE   A C    
11376 O  O    . PHE   A  738 ? 0.25601697 0.25604030 0.19435164 -0.06973222 -0.04832456 0.02769905  793  PHE   A O    
11377 C  CB   . PHE   A  738 ? 0.29054123 0.29753280 0.24113661 -0.07458724 -0.04800944 0.02715440  793  PHE   A CB   
11378 C  CG   . PHE   A  738 ? 0.36590642 0.37510243 0.31616855 -0.07597488 -0.05169848 0.02644969  793  PHE   A CG   
11379 C  CD1  . PHE   A  738 ? 0.44243872 0.44656804 0.38599575 -0.07652331 -0.05332386 0.02515384  793  PHE   A CD1  
11380 C  CD2  . PHE   A  738 ? 0.45083880 0.46766341 0.40752399 -0.07661812 -0.05364742 0.02685843  793  PHE   A CD2  
11381 C  CE1  . PHE   A  738 ? 0.48134682 0.48733300 0.42388356 -0.07792041 -0.05724284 0.02443594  793  PHE   A CE1  
11382 C  CE2  . PHE   A  738 ? 0.35925847 0.37876192 0.31608364 -0.07794572 -0.05769100 0.02614003  793  PHE   A CE2  
11383 C  CZ   . PHE   A  738 ? 0.52418494 0.53789324 0.47354174 -0.07867545 -0.05966040 0.02501225  793  PHE   A CZ   
11384 H  H    . PHE   A  738 ? 0.26040119 0.27026042 0.21012601 -0.06864775 -0.04946441 0.02927690  793  PHE   A H    
11385 H  HA   . PHE   A  738 ? 0.26413256 0.26831606 0.21300843 -0.07085708 -0.04436300 0.02824815  793  PHE   A HA   
11386 H  HB2  . PHE   A  738 ? 0.29982042 0.30273920 0.24794659 -0.07565798 -0.04726014 0.02644782  793  PHE   A HB2  
11387 H  HB3  . PHE   A  738 ? 0.29634875 0.30699885 0.25131559 -0.07502320 -0.04723766 0.02773514  793  PHE   A HB3  
11388 H  HD1  . PHE   A  738 ? 0.43017071 0.42981189 0.36979887 -0.07586920 -0.05179290 0.02464034  793  PHE   A HD1  
11389 H  HD2  . PHE   A  738 ? 0.40108109 0.42163822 0.36222619 -0.07618183 -0.05226461 0.02748080  793  PHE   A HD2  
11390 H  HE1  . PHE   A  738 ? 0.48348594 0.48572910 0.42077568 -0.07834989 -0.05827861 0.02340422  793  PHE   A HE1  
11391 H  HE2  . PHE   A  738 ? 0.41132116 0.43685773 0.37332669 -0.07824282 -0.05911950 0.02631168  793  PHE   A HE2  
11392 H  HZ   . PHE   A  738 ? 0.47211766 0.48747349 0.42109880 -0.07963387 -0.06266996 0.02448764  793  PHE   A HZ   
11393 N  N    . ILE   A  739 ? 0.27853292 0.27398783 0.21681175 -0.07117613 -0.04489892 0.02600248  794  ILE   A N    
11394 C  CA   . ILE   A  739 ? 0.27805495 0.26897171 0.21003720 -0.07077572 -0.04437305 0.02455131  794  ILE   A CA   
11395 C  C    . ILE   A  739 ? 0.26708862 0.25408897 0.19747813 -0.07242602 -0.04480791 0.02250539  794  ILE   A C    
11396 O  O    . ILE   A  739 ? 0.20943761 0.19383889 0.14057188 -0.07189037 -0.04302706 0.02198678  794  ILE   A O    
11397 C  CB   . ILE   A  739 ? 0.24399787 0.23366818 0.17477511 -0.06877130 -0.04125372 0.02486127  794  ILE   A CB   
11398 C  CG1  . ILE   A  739 ? 0.24644649 0.23855460 0.17815706 -0.06748471 -0.04101211 0.02700296  794  ILE   A CG1  
11399 C  CG2  . ILE   A  739 ? 0.24427274 0.23033118 0.16909102 -0.06843804 -0.04004164 0.02292020  794  ILE   A CG2  
11400 C  CD1  . ILE   A  739 ? 0.27513510 0.26676822 0.20739487 -0.06626520 -0.03800888 0.02748709  794  ILE   A CD1  
11401 H  H    . ILE   A  739 ? 0.27684096 0.27215341 0.21727827 -0.07162690 -0.04389657 0.02603547  794  ILE   A H    
11402 H  HA   . ILE   A  739 ? 0.27186960 0.26301157 0.20128022 -0.07090155 -0.04591639 0.02457824  794  ILE   A HA   
11403 H  HB   . ILE   A  739 ? 0.24645554 0.23604822 0.17986441 -0.06853631 -0.04008961 0.02486510  794  ILE   A HB   
11404 H  HG12 . ILE   A  739 ? 0.25524223 0.24660727 0.18344471 -0.06754303 -0.04204766 0.02718625  794  ILE   A HG12 
11405 H  HG13 . ILE   A  739 ? 0.24978431 0.24440390 0.18510205 -0.06747504 -0.04198019 0.02785151  794  ILE   A HG13 
11406 H  HG21 . ILE   A  739 ? 0.24957338 0.23513061 0.17094241 -0.06899317 -0.04139287 0.02274761  794  ILE   A HG21 
11407 H  HG22 . ILE   A  739 ? 0.24702999 0.23099321 0.17161395 -0.06868824 -0.03990473 0.02145631  794  ILE   A HG22 
11408 H  HG23 . ILE   A  739 ? 0.24538149 0.23171034 0.16993575 -0.06743766 -0.03806045 0.02323149  794  ILE   A HG23 
11409 H  HD11 . ILE   A  739 ? 0.26692587 0.25693226 0.19623324 -0.06625842 -0.03681972 0.02654349  794  ILE   A HD11 
11410 H  HD12 . ILE   A  739 ? 0.26188880 0.25417739 0.19729900 -0.06611182 -0.03728544 0.02738960  794  ILE   A HD12 
11411 H  HD13 . ILE   A  739 ? 0.26375711 0.25604531 0.19609687 -0.06571937 -0.03809011 0.02878063  794  ILE   A HD13 
11412 N  N    . LEU   A  740 ? 0.20718493 0.19345136 0.13534157 -0.07444489 -0.04763802 0.02138685  795  LEU   A N    
11413 C  CA   . LEU   A  740 ? 0.22423437 0.20583890 0.15038386 -0.07651152 -0.04867863 0.01933454  795  LEU   A CA   
11414 C  C    . LEU   A  740 ? 0.24888840 0.22479123 0.16833609 -0.07509533 -0.04750397 0.01680563  795  LEU   A C    
11415 O  O    . LEU   A  740 ? 0.28666329 0.26252520 0.20124680 -0.07440849 -0.04773180 0.01614877  795  LEU   A O    
11416 C  CB   . LEU   A  740 ? 0.30830497 0.29171526 0.23485556 -0.07962482 -0.05242990 0.01888315  795  LEU   A CB   
11417 C  CG   . LEU   A  740 ? 0.33434236 0.32355934 0.26829728 -0.08174096 -0.05337245 0.02059116  795  LEU   A CG   
11418 C  CD1  . LEU   A  740 ? 0.33577240 0.32923546 0.27124768 -0.08456422 -0.05753999 0.02012560  795  LEU   A CD1  
11419 C  CD2  . LEU   A  740 ? 0.40513393 0.39065570 0.34047580 -0.08387487 -0.05230146 0.02041924  795  LEU   A CD2  
11420 H  H    . LEU   A  740 ? 0.22528172 0.21371791 0.15298332 -0.07455994 -0.04919565 0.02190391  795  LEU   A H    
11421 H  HA   . LEU   A  740 ? 0.23869897 0.21967468 0.16756898 -0.07683027 -0.04773619 0.01980389  795  LEU   A HA   
11422 H  HB2  . LEU   A  740 ? 0.29283524 0.27781647 0.21733782 -0.07903796 -0.05361529 0.01897861  795  LEU   A HB2  
11423 H  HB3  . LEU   A  740 ? 0.29768109 0.27675286 0.22118011 -0.08097506 -0.05326640 0.01712803  795  LEU   A HB3  
11424 H  HG   . LEU   A  740 ? 0.33557826 0.32847166 0.27259377 -0.08004987 -0.05212851 0.02211586  795  LEU   A HG   
11425 H  HD11 . LEU   A  740 ? 0.33303699 0.33200496 0.27412474 -0.08520728 -0.05774963 0.02134016  795  LEU   A HD11 
11426 H  HD12 . LEU   A  740 ? 0.34157744 0.33170319 0.27513027 -0.08697620 -0.05876570 0.01873144  795  LEU   A HD12 
11427 H  HD13 . LEU   A  740 ? 0.33854070 0.33244750 0.27119377 -0.08327357 -0.05875908 0.01996400  795  LEU   A HD13 
11428 H  HD21 . LEU   A  740 ? 0.37658185 0.36038697 0.31178042 -0.08201370 -0.05009580 0.02091970  795  LEU   A HD21 
11429 H  HD22 . LEU   A  740 ? 0.38575301 0.36649406 0.31754714 -0.08524795 -0.05343848 0.01879639  795  LEU   A HD22 
11430 H  HD23 . LEU   A  740 ? 0.37895793 0.36841628 0.31868479 -0.08579570 -0.05275808 0.02142218  795  LEU   A HD23 
11431 N  N    . PRO   A  741 ? 0.30991432 0.28074446 0.22865522 -0.07447906 -0.04621124 0.01527212  796  PRO   A N    
11432 C  CA   . PRO   A  741 ? 0.32192484 0.28748611 0.23481250 -0.07278066 -0.04505872 0.01216034  796  PRO   A CA   
11433 C  C    . PRO   A  741 ? 0.30917174 0.27067760 0.21640615 -0.07506663 -0.04791782 0.00970091  796  PRO   A C    
11434 O  O    . PRO   A  741 ? 0.27641910 0.23654905 0.18493624 -0.07816102 -0.05071336 0.00979393  796  PRO   A O    
11435 C  CB   . PRO   A  741 ? 0.35564268 0.31699094 0.27047023 -0.07128170 -0.04378882 0.01148317  796  PRO   A CB   
11436 C  CG   . PRO   A  741 ? 0.52880710 0.49083453 0.44829696 -0.07387127 -0.04534386 0.01388349  796  PRO   A CG   
11437 C  CD   . PRO   A  741 ? 0.40343449 0.37305057 0.32653987 -0.07523185 -0.04592267 0.01641213  796  PRO   A CD   
11438 H  HA   . PRO   A  741 ? 0.31915238 0.28669924 0.23076154 -0.07115240 -0.04333065 0.01222675  796  PRO   A HA   
11439 H  HB2  . PRO   A  741 ? 0.38462681 0.34097558 0.29599416 -0.07097400 -0.04420214 0.00911365  796  PRO   A HB2  
11440 H  HB3  . PRO   A  741 ? 0.37556002 0.33882397 0.29200035 -0.06906822 -0.04167320 0.01190552  796  PRO   A HB3  
11441 H  HG2  . PRO   A  741 ? 0.45739666 0.41558847 0.37520227 -0.07589075 -0.04712772 0.01293020  796  PRO   A HG2  
11442 H  HG3  . PRO   A  741 ? 0.45004001 0.41145793 0.37173718 -0.07264682 -0.04421456 0.01470126  796  PRO   A HG3  
11443 H  HD2  . PRO   A  741 ? 0.39557618 0.36592263 0.32026893 -0.07774078 -0.04762683 0.01699619  796  PRO   A HD2  
11444 H  HD3  . PRO   A  741 ? 0.38870850 0.36130118 0.31491262 -0.07401404 -0.04444816 0.01800166  796  PRO   A HD3  
11445 N  N    . HIS   A  742 ? 0.32818264 0.28826648 0.22898304 -0.07385766 -0.04710785 0.00757092  797  HIS   A N    
11446 C  CA   . HIS   A  742 ? 0.31511089 0.27092516 0.20883822 -0.07569107 -0.04967047 0.00474885  797  HIS   A CA   
11447 C  C    . HIS   A  742 ? 0.31832892 0.26609060 0.20832552 -0.07461217 -0.04896452 0.00087678  797  HIS   A C    
11448 O  O    . HIS   A  742 ? 0.37850660 0.32406208 0.26376572 -0.07192046 -0.04634015 -0.00186327 797  HIS   A O    
11449 C  CB   . HIS   A  742 ? 0.27528536 0.23324277 0.16285565 -0.07496297 -0.04899964 0.00456755  797  HIS   A CB   
11450 C  CG   . HIS   A  742 ? 0.31314915 0.26694071 0.19234499 -0.07690956 -0.05192024 0.00172956  797  HIS   A CG   
11451 N  ND1  . HIS   A  742 ? 0.29486048 0.24720103 0.16528775 -0.07596200 -0.05050472 -0.00009216 797  HIS   A ND1  
11452 C  CD2  . HIS   A  742 ? 0.27687666 0.22802813 0.15527014 -0.08009273 -0.05620222 0.00057282  797  HIS   A CD2  
11453 C  CE1  . HIS   A  742 ? 0.37451172 0.32266229 0.23833779 -0.07827621 -0.05412641 -0.00262641 797  HIS   A CE1  
11454 N  NE2  . HIS   A  742 ? 0.31873816 0.26611102 0.18743876 -0.08092026 -0.05782066 -0.00235110 797  HIS   A NE2  
11455 H  H    . HIS   A  742 ? 0.31684047 0.27868882 0.21733782 -0.07196257 -0.04478732 0.00782576  797  HIS   A H    
11456 H  HA   . HIS   A  742 ? 0.30916584 0.26585764 0.20458855 -0.07819451 -0.05245993 0.00557836  797  HIS   A HA   
11457 H  HB2  . HIS   A  742 ? 0.28548503 0.24786825 0.17570679 -0.07534236 -0.04966047 0.00720963  797  HIS   A HB2  
11458 H  HB3  . HIS   A  742 ? 0.29047060 0.24819688 0.17668197 -0.07281717 -0.04593310 0.00376169  797  HIS   A HB3  
11460 H  HD2  . HIS   A  742 ? 0.29062769 0.24222118 0.17386122 -0.08165832 -0.05767848 0.00144565  797  HIS   A HD2  
11461 H  HE1  . HIS   A  742 ? 0.34901971 0.29517767 0.20554322 -0.07831057 -0.05410517 -0.00433012 797  HIS   A HE1  
11463 N  N    . ARG   A  743 ? 0.30955228 0.25278604 0.20169476 -0.07670929 -0.05120742 0.00062518  798  ARG   A N    
11464 C  CA   . ARG   A  743 ? 0.37446707 0.30876261 0.26353550 -0.07527632 -0.05086276 -0.00267041 798  ARG   A CA   
11465 C  C    . ARG   A  743 ? 0.38577878 0.31286982 0.26831648 -0.07840031 -0.05438396 -0.00588837 798  ARG   A C    
11466 O  O    . ARG   A  743 ? 0.32583195 0.25511718 0.20945327 -0.08270770 -0.05771061 -0.00451462 798  ARG   A O    
11467 C  CB   . ARG   A  743 ? 0.35568216 0.28771135 0.25058076 -0.07525162 -0.05081417 -0.00055976 798  ARG   A CB   
11468 C  CG   . ARG   A  743 ? 0.35551479 0.29448575 0.25685492 -0.07275993 -0.04799441 0.00265876  798  ARG   A CG   
11469 C  CD   . ARG   A  743 ? 0.45899817 0.39825860 0.35944715 -0.06792675 -0.04465951 0.00069465  798  ARG   A CD   
11470 N  NE   . ARG   A  743 ? 0.62243301 0.55271018 0.51976442 -0.06563038 -0.04493019 -0.00273562 798  ARG   A NE   
11471 C  CZ   . ARG   A  743 ? 0.69076169 0.61828476 0.58361709 -0.06230722 -0.04315230 -0.00692622 798  ARG   A CZ   
11472 N  NH1  . ARG   A  743 ? 0.68335569 0.61687601 0.57430828 -0.06106206 -0.04041176 -0.00790769 798  ARG   A NH1  
11473 N  NH2  . ARG   A  743 ? 0.82289368 0.74109036 0.71275342 -0.06021392 -0.04405859 -0.01025452 798  ARG   A NH2  
11474 H  H    . ARG   A  743 ? 0.32071495 0.26629192 0.21621697 -0.07906619 -0.05296931 0.00253297  798  ARG   A H    
11475 H  HA   . ARG   A  743 ? 0.36114627 0.29513738 0.24815483 -0.07220214 -0.04841827 -0.00434365 798  ARG   A HA   
11476 H  HB2  . ARG   A  743 ? 0.36163872 0.29349172 0.25806910 -0.07864449 -0.05302738 0.00077441  798  ARG   A HB2  
11477 H  HB3  . ARG   A  743 ? 0.36973760 0.29529184 0.26224324 -0.07371614 -0.05068684 -0.00275481 798  ARG   A HB3  
11478 H  HG2  . ARG   A  743 ? 0.36812413 0.31305543 0.27133277 -0.07380309 -0.04796968 0.00452652  798  ARG   A HG2  
11479 H  HG3  . ARG   A  743 ? 0.37199336 0.30953228 0.27639502 -0.07344400 -0.04847451 0.00425077  798  ARG   A HG3  
11480 H  HD2  . ARG   A  743 ? 0.46134704 0.40303522 0.35893488 -0.06751937 -0.04370980 -0.00037963 798  ARG   A HD2  
11481 H  HD3  . ARG   A  743 ? 0.45279503 0.39599684 0.35761404 -0.06662828 -0.04321434 0.00272671  798  ARG   A HD3  
11482 H  HE   . ARG   A  743 ? 0.59216845 0.51845205 0.49053299 -0.06638635 -0.04630964 -0.00204725 798  ARG   A HE   
11483 H  HH11 . ARG   A  743 ? 0.67477965 0.61397016 0.56906331 -0.06029904 -0.03868093 -0.00610171 798  ARG   A HH11 
11484 H  HH12 . ARG   A  743 ? 0.69005138 0.62160283 0.57605958 -0.06116853 -0.04032389 -0.01034300 798  ARG   A HH12 
11485 H  HH21 . ARG   A  743 ? 0.78563440 0.70232105 0.67285830 -0.05763128 -0.04266097 -0.01327918 798  ARG   A HH21 
11486 H  HH22 . ARG   A  743 ? 0.78140664 0.69478160 0.67178017 -0.06139112 -0.04602150 -0.00945071 798  ARG   A HH22 
11487 N  N    . PRO   A  744 ? 0.37690002 0.29552251 0.25293010 -0.07621338 -0.05379553 -0.01044082 799  PRO   A N    
11488 C  CA   . PRO   A  744 ? 0.39338803 0.30349874 0.26218039 -0.07900920 -0.05716601 -0.01417151 799  PRO   A CA   
11489 C  C    . PRO   A  744 ? 0.36703914 0.26893142 0.23716715 -0.08220721 -0.06018259 -0.01406736 799  PRO   A C    
11490 O  O    . PRO   A  744 ? 0.36957529 0.26299322 0.23347121 -0.08467808 -0.06308511 -0.01744626 799  PRO   A O    
11491 C  CB   . PRO   A  744 ? 0.39327580 0.29779875 0.25513166 -0.07431591 -0.05438357 -0.01921666 799  PRO   A CB   
11492 C  CG   . PRO   A  744 ? 0.37488890 0.28158891 0.24269620 -0.06964710 -0.05073346 -0.01799876 799  PRO   A CG   
11493 C  CD   . PRO   A  744 ? 0.38756043 0.30490798 0.26287213 -0.07064173 -0.04974239 -0.01268620 799  PRO   A CD   
11494 H  HA   . PRO   A  744 ? 0.38541907 0.29869625 0.25230515 -0.08146249 -0.05895178 -0.01385405 799  PRO   A HA   
11495 H  HB2  . PRO   A  744 ? 0.40158021 0.29798973 0.25910485 -0.07490650 -0.05606876 -0.02220130 799  PRO   A HB2  
11496 H  HB3  . PRO   A  744 ? 0.39297563 0.30092940 0.25119111 -0.07384820 -0.05335933 -0.02008956 799  PRO   A HB3  
11497 H  HG2  . PRO   A  744 ? 0.38752586 0.28851515 0.25677544 -0.06938715 -0.05177069 -0.01816429 799  PRO   A HG2  
11498 H  HG3  . PRO   A  744 ? 0.38617915 0.29313254 0.25147665 -0.06627624 -0.04807556 -0.02050505 799  PRO   A HG3  
11499 H  HD2  . PRO   A  744 ? 0.37522963 0.29312253 0.25544864 -0.06922810 -0.04883732 -0.01098457 799  PRO   A HD2  
11500 H  HD3  . PRO   A  744 ? 0.37615895 0.29868108 0.25065482 -0.06926277 -0.04760662 -0.01258370 799  PRO   A HD3  
11501 N  N    . ASP   A  745 ? 0.38125569 0.28502202 0.25865003 -0.08215996 -0.05935004 -0.01030594 800  ASP   A N    
11502 C  CA   . ASP   A  745 ? 0.36439103 0.26132864 0.24349940 -0.08588172 -0.06182887 -0.00892980 800  ASP   A CA   
11503 C  C    . ASP   A  745 ? 0.34694630 0.25248566 0.23466682 -0.08777714 -0.06103951 -0.00353927 800  ASP   A C    
11504 O  O    . ASP   A  745 ? 0.30241179 0.21777502 0.19445285 -0.08546116 -0.05865472 -0.00136476 800  ASP   A O    
11505 C  CB   . ASP   A  745 ? 0.37012720 0.25547612 0.24634595 -0.08222188 -0.06121127 -0.01107523 800  ASP   A CB   
11506 C  CG   . ASP   A  745 ? 0.47037023 0.36003223 0.35075724 -0.07616532 -0.05749554 -0.00987554 800  ASP   A CG   
11507 O  OD1  . ASP   A  745 ? 0.39540893 0.29083243 0.28219396 -0.07677495 -0.05664024 -0.00548496 800  ASP   A OD1  
11508 O  OD2  . ASP   A  745 ? 0.52842164 0.41681007 0.40583399 -0.07089715 -0.05525994 -0.01350426 800  ASP   A OD2  
11509 H  H    . ASP   A  745 ? 0.36386970 0.27324364 0.24493138 -0.07979991 -0.05704613 -0.00847048 800  ASP   A H    
11510 H  HA   . ASP   A  745 ? 0.37270936 0.26691306 0.24915048 -0.08971289 -0.06454960 -0.01006901 800  ASP   A HA   
11511 H  HB2  . ASP   A  745 ? 0.39477921 0.27521431 0.27175722 -0.08504242 -0.06292002 -0.00963131 800  ASP   A HB2  
11512 H  HB3  . ASP   A  745 ? 0.40103137 0.28043932 0.27161717 -0.08105843 -0.06176775 -0.01485740 800  ASP   A HB3  
11513 N  N    . ASN   A  746 ? 0.35480928 0.25644618 0.24450326 -0.09246133 -0.06305124 -0.00149327 801  ASN   A N    
11514 C  CA   . ASN   A  746 ? 0.33904514 0.24800679 0.23611265 -0.09433602 -0.06193017 0.00327502  801  ASN   A CA   
11515 C  C    . ASN   A  746 ? 0.31708127 0.21740963 0.21380737 -0.09369608 -0.06145021 0.00489177  801  ASN   A C    
11516 O  O    . ASN   A  746 ? 0.30754358 0.20797914 0.20710842 -0.09809831 -0.06198106 0.00812431  801  ASN   A O    
11517 C  CB   . ASN   A  746 ? 0.37049076 0.28586659 0.27125317 -0.10083862 -0.06421892 0.00492978  801  ASN   A CB   
11518 C  CG   . ASN   A  746 ? 0.42238846 0.34830374 0.32491702 -0.10028681 -0.06462969 0.00448566  801  ASN   A CG   
11519 O  OD1  . ASN   A  746 ? 0.37846923 0.31334496 0.28512770 -0.09703421 -0.06229045 0.00647382  801  ASN   A OD1  
11520 N  ND2  . ASN   A  746 ? 0.37545514 0.29997569 0.27443451 -0.10357986 -0.06799118 0.00192938  801  ASN   A ND2  
11521 H  H    . ASN   A  746 ? 0.36133939 0.25542712 0.24739289 -0.09468446 -0.06505817 -0.00317009 801  ASN   A H    
11522 H  HA   . ASN   A  746 ? 0.33311564 0.24904697 0.23300928 -0.09136894 -0.05986029 0.00432884  801  ASN   A HA   
11523 H  HB2  . ASN   A  746 ? 0.38246810 0.29141021 0.28005290 -0.10414212 -0.06651065 0.00343216  801  ASN   A HB2  
11524 H  HB3  . ASN   A  746 ? 0.36819726 0.28717023 0.27339032 -0.10235370 -0.06331819 0.00783711  801  ASN   A HB3  
11525 H  HD21 . ASN   A  746 ? 0.39860922 0.31544143 0.29332286 -0.10501936 -0.06946383 -0.00013065 801  ASN   A HD21 
11526 H  HD22 . ASN   A  746 ? 0.38726556 0.31833008 0.28798693 -0.10428950 -0.06894059 0.00224764  801  ASN   A HD22 
11527 N  N    . ASP   A  747 ? 0.31773841 0.21089527 0.21086839 -0.08802874 -0.06041405 0.00259723  802  ASP   A N    
11528 C  CA   . ASP   A  747 ? 0.35813802 0.24239394 0.25033778 -0.08610665 -0.06044788 0.00391332  802  ASP   A CA   
11529 C  C    . ASP   A  747 ? 0.35985717 0.25195932 0.25811023 -0.08539132 -0.05833880 0.00848813  802  ASP   A C    
11530 O  O    . ASP   A  747 ? 0.33677429 0.22275725 0.23451966 -0.08625610 -0.05894036 0.01105194  802  ASP   A O    
11531 C  CB   . ASP   A  747 ? 0.47635210 0.35381514 0.36486807 -0.07909458 -0.05968033 0.00007898  802  ASP   A CB   
11532 C  CG   . ASP   A  747 ? 0.50868189 0.37427297 0.38973224 -0.07940656 -0.06201294 -0.00468379 802  ASP   A CG   
11533 O  OD1  . ASP   A  747 ? 0.43930674 0.30031341 0.31764966 -0.08565298 -0.06474313 -0.00469947 802  ASP   A OD1  
11534 O  OD2  . ASP   A  747 ? 0.62547803 0.48656398 0.50359464 -0.07352093 -0.06109270 -0.00854819 802  ASP   A OD2  
11535 H  H    . ASP   A  747 ? 0.32802224 0.22208375 0.21923921 -0.08514714 -0.05969512 0.00012874  802  ASP   A H    
11536 H  HA   . ASP   A  747 ? 0.37739030 0.25447193 0.26712239 -0.08988953 -0.06250144 0.00423157  802  ASP   A HA   
11537 H  HB2  . ASP   A  747 ? 0.44081175 0.32552546 0.33124235 -0.07607815 -0.05764458 -0.00075831 802  ASP   A HB2  
11538 H  HB3  . ASP   A  747 ? 0.45091337 0.32446796 0.33999649 -0.07700594 -0.05961693 0.00142135  802  ASP   A HB3  
11539 N  N    . GLU   A  748 ? 0.37140489 0.27629322 0.27458352 -0.08405493 -0.05607943 0.00951533  803  GLU   A N    
11540 C  CA   . GLU   A  748 ? 0.44098422 0.35400188 0.34972015 -0.08363915 -0.05407602 0.01343182  803  GLU   A CA   
11541 C  C    . GLU   A  748 ? 0.45067984 0.36508372 0.36152875 -0.08993462 -0.05484636 0.01687632  803  GLU   A C    
11542 O  O    . GLU   A  748 ? 0.29915410 0.21421632 0.21178657 -0.09018202 -0.05380503 0.02006434  803  GLU   A O    
11543 C  CB   . GLU   A  748 ? 0.45392269 0.37917355 0.36676031 -0.08139807 -0.05186632 0.01348435  803  GLU   A CB   
11544 C  CG   . GLU   A  748 ? 0.56842840 0.50108558 0.48644626 -0.08024137 -0.04975237 0.01695021  803  GLU   A CG   
11545 C  CD   . GLU   A  748 ? 0.38382912 0.32710135 0.30559742 -0.07801592 -0.04768089 0.01730793  803  GLU   A CD   
11546 O  OE1  . GLU   A  748 ? 0.31893021 0.26454639 0.23919618 -0.07720832 -0.04769554 0.01517138  803  GLU   A OE1  
11547 O  OE2  . GLU   A  748 ? 0.37288904 0.32139960 0.29840764 -0.07717903 -0.04613398 0.01978249  803  GLU   A OE2  
11548 H  H    . GLU   A  748 ? 0.37831396 0.28647184 0.28089988 -0.08330005 -0.05583075 0.00764264  803  GLU   A H    
11549 H  HA   . GLU   A  748 ? 0.42979434 0.33925813 0.33806136 -0.08056993 -0.05360415 0.01378976  803  GLU   A HA   
11550 H  HB2  . GLU   A  748 ? 0.47320288 0.39766952 0.38440430 -0.07794183 -0.05115099 0.01126846  803  GLU   A HB2  
11551 H  HB3  . GLU   A  748 ? 0.47150105 0.40040791 0.38494259 -0.08420382 -0.05262516 0.01335613  803  GLU   A HB3  
11552 H  HG2  . GLU   A  748 ? 0.48841739 0.42215544 0.40787455 -0.08368751 -0.05016743 0.01898140  803  GLU   A HG2  
11553 H  HG3  . GLU   A  748 ? 0.49218118 0.42107356 0.40950748 -0.07764982 -0.04940593 0.01713123  803  GLU   A HG3  
11554 N  N    . SER   A  749 ? 0.34832817 0.26353002 0.25887597 -0.09518573 -0.05665180 0.01610308  804  SER   A N    
11555 C  CA   . SER   A  749 ? 0.33972654 0.25820008 0.25329876 -0.10173992 -0.05707173 0.01899929  804  SER   A CA   
11556 C  C    . SER   A  749 ? 0.39595857 0.30151722 0.30435225 -0.10641177 -0.05942578 0.01907396  804  SER   A C    
11557 O  O    . SER   A  749 ? 0.35912460 0.25937188 0.26428139 -0.10920829 -0.06193408 0.01644496  804  SER   A O    
11558 C  CB   . SER   A  749 ? 0.37397873 0.30288821 0.29171485 -0.10484387 -0.05786236 0.01824297  804  SER   A CB   
11559 O  OG   . SER   A  749 ? 0.33605137 0.27561677 0.25780791 -0.10064679 -0.05606561 0.01835371  804  SER   A OG   
11560 H  H    . SER   A  749 ? 0.36997885 0.28410643 0.27849430 -0.09478285 -0.05761288 0.01363161  804  SER   A H    
11561 H  HA   . SER   A  749 ? 0.35042483 0.27286482 0.26670274 -0.10112927 -0.05532710 0.02144878  804  SER   A HA   
11562 H  HB2  . SER   A  749 ? 0.36369103 0.28846967 0.27829111 -0.10575955 -0.05980894 0.01583609  804  SER   A HB2  
11563 H  HB3  . SER   A  749 ? 0.35795122 0.29015335 0.27855778 -0.10917353 -0.05793145 0.02002084  804  SER   A HB3  
11565 N  N    . CYS   A  750 ? 0.42063269 0.32025620 0.32746768 -0.10753697 -0.05886648 0.02214500  805  CYS   A N    
11566 C  CA   . CYS   A  750 ? 0.41112602 0.29590359 0.31161278 -0.11124752 -0.06125024 0.02249050  805  CYS   A CA   
11567 C  C    . CYS   A  750 ? 0.35507131 0.23982497 0.25600779 -0.12017220 -0.06285045 0.02296676  805  CYS   A C    
11568 O  O    . CYS   A  750 ? 0.34900829 0.22060856 0.24407968 -0.12381330 -0.06539762 0.02233638  805  CYS   A O    
11569 C  CB   . CYS   A  750 ? 0.37778687 0.25612569 0.27577752 -0.11023953 -0.06045943 0.02619068  805  CYS   A CB   
11570 S  SG   . CYS   A  750 ? 0.43565714 0.30999339 0.33194453 -0.09980864 -0.06005041 0.02485103  805  CYS   A SG   
11571 H  H    . CYS   A  750 ? 0.40238556 0.30683714 0.31171268 -0.10602581 -0.05707524 0.02414089  805  CYS   A H    
11572 H  HA   . CYS   A  750 ? 0.40079412 0.27850768 0.29758710 -0.10830331 -0.06262918 0.01972386  805  CYS   A HA   
11573 H  HB2  . CYS   A  750 ? 0.39021465 0.27640313 0.29177505 -0.11216555 -0.05860799 0.02869082  805  CYS   A HB2  
11574 H  HB3  . CYS   A  750 ? 0.40682542 0.27525848 0.30044994 -0.11359522 -0.06211838 0.02694109  805  CYS   A HB3  
11575 N  N    . ASN   A  751 ? 0.32041436 0.21981445 0.22854094 -0.12359112 -0.06146615 0.02402447  806  ASN   A N    
11576 C  CA   . ASN   A  751 ? 0.41306138 0.31549811 0.32355270 -0.13211335 -0.06285422 0.02435012  806  ASN   A CA   
11577 C  C    . ASN   A  751 ? 0.38235247 0.29035205 0.29481363 -0.13260074 -0.06522453 0.02055665  806  ASN   A C    
11578 O  O    . ASN   A  751 ? 0.43738446 0.35217956 0.35407013 -0.13900906 -0.06650048 0.02051772  806  ASN   A O    
11579 C  CB   . ASN   A  751 ? 0.51131481 0.42628551 0.42870411 -0.13567656 -0.05975784 0.02809662  806  ASN   A CB   
11580 C  CG   . ASN   A  751 ? 1.24039841 1.14652121 1.15326214 -0.13761725 -0.05822500 0.03197976  806  ASN   A CG   
11581 O  OD1  . ASN   A  751 ? 1.47341728 1.37215400 1.38185608 -0.13178593 -0.05773399 0.03270286  806  ASN   A OD1  
11582 N  ND2  . ASN   A  751 ? 1.59082282 1.49720967 1.50433147 -0.14610572 -0.05762762 0.03462395  806  ASN   A ND2  
11583 H  H    . ASN   A  751 ? 0.33669862 0.24464889 0.24865147 -0.12049886 -0.05966028 0.02451384  806  ASN   A H    
11584 H  HA   . ASN   A  751 ? 0.41413122 0.30593917 0.31987581 -0.13544179 -0.06432958 0.02469021  806  ASN   A HA   
11585 H  HB2  . ASN   A  751 ? 0.56660903 0.49028665 0.48786861 -0.13154489 -0.05810747 0.02807594  806  ASN   A HB2  
11586 H  HB3  . ASN   A  751 ? 0.58295417 0.50309062 0.50369483 -0.14092180 -0.06041788 0.02800782  806  ASN   A HB3  
11587 H  HD21 . ASN   A  751 ? 1.44282305 1.35470510 1.35988760 -0.15034595 -0.05815756 0.03393525  806  ASN   A HD21 
11588 H  HD22 . ASN   A  751 ? 1.47142458 1.37263238 1.38176429 -0.14759316 -0.05670743 0.03709416  806  ASN   A HD22 
11589 N  N    . SER   A  752 ? 0.40100056 0.30585197 0.31001031 -0.12594013 -0.06590776 0.01730627  807  SER   A N    
11590 C  CA   . SER   A  752 ? 0.41107506 0.32152033 0.32080525 -0.12518261 -0.06785119 0.01389917  807  SER   A CA   
11591 C  C    . SER   A  752 ? 0.41990969 0.32247752 0.32531163 -0.13106202 -0.07192314 0.01102910  807  SER   A C    
11592 O  O    . SER   A  752 ? 0.44295472 0.35121548 0.34929857 -0.13214265 -0.07416426 0.00856187  807  SER   A O    
11593 C  CB   . SER   A  752 ? 0.37637627 0.28512678 0.28264916 -0.11678348 -0.06682222 0.01138430  807  SER   A CB   
11594 O  OG   . SER   A  752 ? 0.34737140 0.24110588 0.24576236 -0.11403339 -0.06774233 0.00893086  807  SER   A OG   
11595 H  H    . SER   A  752 ? 0.39849380 0.29747981 0.30437762 -0.12177663 -0.06513719 0.01722479  807  SER   A H    
11596 H  HA   . SER   A  752 ? 0.39362574 0.31539127 0.30929920 -0.12628101 -0.06714627 0.01508511  807  SER   A HA   
11597 H  HB2  . SER   A  752 ? 0.37013191 0.28363442 0.27680862 -0.11638493 -0.06786896 0.00956350  807  SER   A HB2  
11598 H  HB3  . SER   A  752 ? 0.36399695 0.27801901 0.27329966 -0.11353716 -0.06441776 0.01321411  807  SER   A HB3  
11600 N  N    . SER   A  753 ? 0.37897268 0.26819640 0.27937016 -0.13534394 -0.07323569 0.01148949  808  SER   A N    
11601 C  CA   . SER   A  753 ? 0.43401057 0.31509829 0.33033562 -0.14200202 -0.07723933 0.00895340  808  SER   A CA   
11602 C  C    . SER   A  753 ? 0.39380461 0.28467134 0.29720855 -0.15114570 -0.07798474 0.01125722  808  SER   A C    
11603 O  O    . SER   A  753 ? 0.47996619 0.36665124 0.38163164 -0.15792264 -0.08146556 0.00941037  808  SER   A O    
11604 C  CB   . SER   A  753 ? 0.45449328 0.31527823 0.34153801 -0.14257984 -0.07875240 0.00809678  808  SER   A CB   
11605 O  OG   . SER   A  753 ? 0.53147447 0.38931605 0.41959909 -0.14636494 -0.07714019 0.01273259  808  SER   A OG   
11606 H  H    . SER   A  753 ? 0.40262336 0.28716245 0.30174831 -0.13420740 -0.07181004 0.01344205  808  SER   A H    
11607 H  HA   . SER   A  753 ? 0.41881523 0.30126137 0.31358942 -0.14008765 -0.07874776 0.00589580  808  SER   A HA   
11608 H  HB2  . SER   A  753 ? 0.47927427 0.33397305 0.36297143 -0.14662148 -0.08161083 0.00584362  808  SER   A HB2  
11609 H  HB3  . SER   A  753 ? 0.47059479 0.32626316 0.35402149 -0.13627373 -0.07807664 0.00651929  808  SER   A HB3  
11611 N  N    . GLU   A  754 ? 0.35358202 0.25817510 0.26526970 -0.15122014 -0.07466861 0.01495223  809  GLU   A N    
11612 C  CA   . GLU   A  754 ? 0.38096219 0.29916257 0.30150327 -0.15854861 -0.07473524 0.01664874  809  GLU   A CA   
11613 C  C    . GLU   A  754 ? 0.39595371 0.33095551 0.32407111 -0.15579288 -0.07544815 0.01516585  809  GLU   A C    
11614 O  O    . GLU   A  754 ? 0.38946772 0.32513717 0.31530523 -0.14842486 -0.07548536 0.01331946  809  GLU   A O    
11615 C  CB   . GLU   A  754 ? 0.39668018 0.31973425 0.32136440 -0.16021563 -0.07050834 0.02127661  809  GLU   A CB   
11616 C  CG   . GLU   A  754 ? 0.57158530 0.47755021 0.48804003 -0.16278936 -0.07003012 0.02343718  809  GLU   A CG   
11617 C  CD   . GLU   A  754 ? 0.67609918 0.58611268 0.59497428 -0.16386560 -0.06571642 0.02818918  809  GLU   A CD   
11618 O  OE1  . GLU   A  754 ? 0.82612467 0.74626422 0.75136387 -0.17111240 -0.06416631 0.03030312  809  GLU   A OE1  
11619 O  OE2  . GLU   A  754 ? 0.72935212 0.63300914 0.64387310 -0.15762310 -0.06389564 0.02963945  809  GLU   A OE2  
11620 H  H    . GLU   A  754 ? 0.36257112 0.26820320 0.27452695 -0.14656991 -0.07225782 0.01631910  809  GLU   A H    
11621 H  HA   . GLU   A  754 ? 0.39230984 0.30531973 0.31097633 -0.16444783 -0.07716280 0.01575003  809  GLU   A HA   
11622 H  HB2  . GLU   A  754 ? 0.41096902 0.33951533 0.33769852 -0.15456758 -0.06828972 0.02199130  809  GLU   A HB2  
11623 H  HB3  . GLU   A  754 ? 0.41836721 0.35092929 0.34926918 -0.16527489 -0.07022100 0.02225894  809  GLU   A HB3  
11624 H  HG2  . GLU   A  754 ? 0.55243868 0.45287710 0.46696281 -0.16900942 -0.07213142 0.02298352  809  GLU   A HG2  
11625 H  HG3  . GLU   A  754 ? 0.54327476 0.43973541 0.45387664 -0.15765914 -0.07068828 0.02209899  809  GLU   A HG3  
11626 N  N    . ASP   A  755 ? 0.40045884 0.34935710 0.33783510 -0.16172841 -0.07586039 0.01621341  810  ASP   A N    
11627 C  CA   . ASP   A  755 ? 0.40894502 0.37480965 0.35476393 -0.15919049 -0.07670099 0.01540760  810  ASP   A CA   
11628 C  C    . ASP   A  755 ? 0.47260052 0.44481206 0.42065012 -0.15051322 -0.07289767 0.01702799  810  ASP   A C    
11629 O  O    . ASP   A  755 ? 0.34001070 0.31001639 0.28769213 -0.14900874 -0.06892276 0.01973356  810  ASP   A O    
11630 C  CB   . ASP   A  755 ? 0.40015897 0.38134676 0.35730815 -0.16654105 -0.07679430 0.01676313  810  ASP   A CB   
11631 C  CG   . ASP   A  755 ? 0.47534245 0.47335500 0.44128796 -0.16413321 -0.07908103 0.01540656  810  ASP   A CG   
11632 O  OD1  . ASP   A  755 ? 0.60315126 0.59935093 0.56617069 -0.16418079 -0.08387929 0.01240052  810  ASP   A OD1  
11633 O  OD2  . ASP   A  755 ? 0.51384526 0.52657163 0.48922035 -0.16170077 -0.07612026 0.01732896  810  ASP   A OD2  
11634 H  H    . ASP   A  755 ? 0.40773165 0.35547376 0.34626812 -0.16761033 -0.07569818 0.01747422  810  ASP   A H    
11635 H  HA   . ASP   A  755 ? 0.41935888 0.38284051 0.36209255 -0.15826246 -0.07985479 0.01278017  810  ASP   A HA   
11636 H  HB2  . ASP   A  755 ? 0.42800522 0.40455869 0.38366422 -0.17278308 -0.07890707 0.01604129  810  ASP   A HB2  
11637 H  HB3  . ASP   A  755 ? 0.41567281 0.40052330 0.37602165 -0.16692995 -0.07327390 0.01927150  810  ASP   A HB3  
11638 N  N    . GLU   A  756 ? 0.39911872 0.37917754 0.34925947 -0.14540261 -0.07451768 0.01541513  811  GLU   A N    
11639 C  CA   . GLU   A  756 ? 0.38361865 0.36933213 0.33539319 -0.13739565 -0.07175523 0.01648706  811  GLU   A CA   
11640 C  C    . GLU   A  756 ? 0.36245376 0.35973495 0.32305008 -0.13733907 -0.06777635 0.01958403  811  GLU   A C    
11641 O  O    . GLU   A  756 ? 0.41079813 0.40877560 0.37108710 -0.13157378 -0.06450414 0.02099947  811  GLU   A O    
11642 C  CB   . GLU   A  756 ? 0.33613127 0.32893169 0.28895721 -0.13353249 -0.07492384 0.01454233  811  GLU   A CB   
11643 C  CG   . GLU   A  756 ? 0.39412898 0.37511176 0.33628082 -0.13078257 -0.07732906 0.01154950  811  GLU   A CG   
11644 C  CD   . GLU   A  756 ? 0.42385143 0.39739791 0.36137801 -0.13692750 -0.08167900 0.00873515  811  GLU   A CD   
11645 O  OE1  . GLU   A  756 ? 0.40997821 0.38861352 0.35345465 -0.14397544 -0.08325591 0.00925757  811  GLU   A OE1  
11646 O  OE2  . GLU   A  756 ? 0.50035489 0.46272749 0.42819718 -0.13492565 -0.08323915 0.00588046  811  GLU   A OE2  
11647 H  H    . GLU   A  756 ? 0.41506845 0.39668733 0.36531752 -0.14732537 -0.07774219 0.01358433  811  GLU   A H    
11648 H  HA   . GLU   A  756 ? 0.37476504 0.35146961 0.32048056 -0.13414222 -0.07040735 0.01638405  811  GLU   A HA   
11649 H  HB2  . GLU   A  756 ? 0.35766560 0.35761687 0.31543523 -0.13716958 -0.07731953 0.01407916  811  GLU   A HB2  
11650 H  HB3  . GLU   A  756 ? 0.34808260 0.34665579 0.30382562 -0.12919536 -0.07300881 0.01574403  811  GLU   A HB3  
11651 H  HG2  . GLU   A  756 ? 0.38142443 0.36685199 0.32366654 -0.12731084 -0.07833025 0.01104201  811  GLU   A HG2  
11652 H  HG3  . GLU   A  756 ? 0.38525033 0.35852653 0.32277316 -0.12802616 -0.07500050 0.01179270  811  GLU   A HG3  
11653 N  N    . SER   A  757 ? 0.33795166 0.34456080 0.30638278 -0.14389363 -0.06796698 0.02039367  812  SER   A N    
11654 C  CA   . SER   A  757 ? 0.39873561 0.41663456 0.37537640 -0.14441317 -0.06373718 0.02296381  812  SER   A CA   
11655 C  C    . SER   A  757 ? 0.37973011 0.38869315 0.35119662 -0.14419486 -0.05938921 0.02550127  812  SER   A C    
11656 O  O    . SER   A  757 ? 0.34568733 0.36265010 0.32202184 -0.14303544 -0.05544491 0.02748480  812  SER   A O    
11657 C  CB   . SER   A  757 ? 0.40362668 0.43278360 0.38936782 -0.15259466 -0.06432485 0.02319075  812  SER   A CB   
11658 O  OG   . SER   A  757 ? 0.40892839 0.42732435 0.38945511 -0.16030648 -0.06501549 0.02354506  812  SER   A OG   
11659 H  H    . SER   A  757 ? 0.36473948 0.37115029 0.33356261 -0.14821532 -0.07072087 0.01916733  812  SER   A H    
11660 H  HA   . SER   A  757 ? 0.37313873 0.39820158 0.35327068 -0.13952430 -0.06319059 0.02292564  812  SER   A HA   
11661 H  HB2  . SER   A  757 ? 0.39622205 0.43377155 0.38759637 -0.15245487 -0.06115165 0.02465252  812  SER   A HB2  
11662 H  HB3  . SER   A  757 ? 0.40073824 0.43653864 0.39046633 -0.15268938 -0.06744642 0.02157854  812  SER   A HB3  
11664 N  N    . LYS   A  758 ? 0.36454126 0.35706121 0.32615331 -0.14537820 -0.06036918 0.02529759  813  LYS   A N    
11665 C  CA   . LYS   A  758 ? 0.39872420 0.38132268 0.35461348 -0.14547382 -0.05719274 0.02784168  813  LYS   A CA   
11666 C  C    . LYS   A  758 ? 0.39365143 0.36934316 0.34390789 -0.13698129 -0.05586486 0.02785508  813  LYS   A C    
11667 O  O    . LYS   A  758 ? 0.50220424 0.47136474 0.44845194 -0.13577117 -0.05336443 0.03004385  813  LYS   A O    
11668 C  CB   . LYS   A  758 ? 0.43101734 0.39776221 0.37882775 -0.15132184 -0.05928271 0.02783345  813  LYS   A CB   
11669 C  CG   . LYS   A  758 ? 0.47477227 0.44457954 0.42620254 -0.16119352 -0.06119191 0.02767104  813  LYS   A CG   
11670 C  CD   . LYS   A  758 ? 0.63413626 0.61644995 0.59350437 -0.16645752 -0.05747542 0.03047022  813  LYS   A CD   
11671 C  CE   . LYS   A  758 ? 0.63470578 0.61954415 0.59753263 -0.17706627 -0.05908124 0.03047236  813  LYS   A CE   
11672 N  NZ   . LYS   A  758 ? 0.91230494 0.90329260 0.87877172 -0.18318421 -0.05449188 0.03393413  813  LYS   A NZ   
11673 H  H    . LYS   A  758 ? 0.38200325 0.36910874 0.34018198 -0.14609422 -0.06327715 0.02346544  813  LYS   A H    
11674 H  HA   . LYS   A  758 ? 0.39299446 0.38265729 0.35330904 -0.14750710 -0.05453875 0.02968961  813  LYS   A HA   
11675 H  HB2  . LYS   A  758 ? 0.43737435 0.39641601 0.38021132 -0.14847547 -0.06150438 0.02584120  813  LYS   A HB2  
11676 H  HB3  . LYS   A  758 ? 0.43727869 0.39797860 0.38152534 -0.15132764 -0.05727388 0.02988330  813  LYS   A HB3  
11677 H  HG2  . LYS   A  758 ? 0.49613136 0.47132379 0.45068803 -0.16120668 -0.06372202 0.02549902  813  LYS   A HG2  
11678 H  HG3  . LYS   A  758 ? 0.50855792 0.46637356 0.45368904 -0.16429010 -0.06256086 0.02768935  813  LYS   A HG3  
11679 H  HD2  . LYS   A  758 ? 0.59150571 0.56869829 0.54724884 -0.16606282 -0.05488741 0.03270928  813  LYS   A HD2  
11680 H  HD3  . LYS   A  758 ? 0.57785225 0.57226992 0.54389203 -0.16335465 -0.05639642 0.03008815  813  LYS   A HD3  
11681 H  HE2  . LYS   A  758 ? 0.68663228 0.68145394 0.65587234 -0.17762527 -0.06089233 0.02868030  813  LYS   A HE2  
11682 H  HE3  . LYS   A  758 ? 0.69747931 0.66988230 0.65360969 -0.17961912 -0.06144179 0.02989320  813  LYS   A HE3  
11683 H  HZ1  . LYS   A  758 ? 0.80185270 0.80387223 0.77413410 -0.18039240 -0.05210634 0.03427840  813  LYS   A HZ1  
11684 H  HZ2  . LYS   A  758 ? 0.81476480 0.79564404 0.77458531 -0.18320900 -0.05322561 0.03575058  813  LYS   A HZ2  
11685 H  HZ3  . LYS   A  758 ? 0.81649631 0.81035590 0.78589034 -0.18981563 -0.05529537 0.03388499  813  LYS   A HZ3  
11686 N  N    . TRP   A  759 ? 0.35396025 0.33033150 0.30322301 -0.13134560 -0.05770959 0.02544738  814  TRP   A N    
11687 C  CA   . TRP   A  759 ? 0.33361211 0.30278569 0.27734819 -0.12415367 -0.05646339 0.02524588  814  TRP   A CA   
11688 C  C    . TRP   A  759 ? 0.31580716 0.29223770 0.26179701 -0.11756204 -0.05628137 0.02405963  814  TRP   A C    
11689 O  O    . TRP   A  759 ? 0.27583557 0.25028327 0.21990201 -0.11226367 -0.05411753 0.02472494  814  TRP   A O    
11690 C  CB   . TRP   A  759 ? 0.30727714 0.26068881 0.24192348 -0.12389128 -0.05874345 0.02334444  814  TRP   A CB   
11691 C  CG   . TRP   A  759 ? 0.34694049 0.29843915 0.27948254 -0.12541172 -0.06255347 0.01999256  814  TRP   A CG   
11692 C  CD1  . TRP   A  759 ? 0.42008662 0.37069619 0.35313365 -0.13239913 -0.06547908 0.01899660  814  TRP   A CD1  
11693 C  CD2  . TRP   A  759 ? 0.33442515 0.28480721 0.26355344 -0.12014386 -0.06387562 0.01713927  814  TRP   A CD2  
11694 N  NE1  . TRP   A  759 ? 0.36726066 0.31560901 0.29690814 -0.13154483 -0.06888597 0.01551416  814  TRP   A NE1  
11695 C  CE2  . TRP   A  759 ? 0.35618290 0.30435875 0.28307670 -0.12406391 -0.06781042 0.01437691  814  TRP   A CE2  
11696 C  CE3  . TRP   A  759 ? 0.30068433 0.25136232 0.22792113 -0.11289290 -0.06205025 0.01661630  814  TRP   A CE3  
11697 C  CZ2  . TRP   A  759 ? 0.33660159 0.28250271 0.25863430 -0.12076570 -0.06985036 0.01115809  814  TRP   A CZ2  
11698 C  CZ3  . TRP   A  759 ? 0.45282850 0.40179911 0.37575752 -0.10987310 -0.06373922 0.01357548  814  TRP   A CZ3  
11699 C  CH2  . TRP   A  759 ? 0.34979886 0.29642534 0.26985526 -0.11366379 -0.06755254 0.01090974  814  TRP   A CH2  
11700 H  H    . TRP   A  759 ? 0.35585675 0.33707541 0.30767822 -0.13207580 -0.05974134 0.02398064  814  TRP   A H    
11701 H  HA   . TRP   A  759 ? 0.32702881 0.29572111 0.27080700 -0.12369213 -0.05406087 0.02725385  814  TRP   A HA   
11702 H  HB2  . TRP   A  759 ? 0.32052457 0.27031061 0.25234568 -0.11897529 -0.05775249 0.02311227  814  TRP   A HB2  
11703 H  HB3  . TRP   A  759 ? 0.32911712 0.27653271 0.26160973 -0.12752350 -0.05864742 0.02455407  814  TRP   A HB3  
11704 H  HD1  . TRP   A  759 ? 0.39141357 0.34270287 0.32651493 -0.13737525 -0.06520401 0.02045524  814  TRP   A HD1  
11705 H  HE1  . TRP   A  759 ? 0.38272905 0.33017135 0.31198299 -0.13543157 -0.07134327 0.01423488  814  TRP   A HE1  
11706 H  HE3  . TRP   A  759 ? 0.32966170 0.28173062 0.25830579 -0.11038122 -0.05969323 0.01828176  814  TRP   A HE3  
11707 H  HZ2  . TRP   A  759 ? 0.35276127 0.29723448 0.27297381 -0.12352870 -0.07265200 0.00926844  814  TRP   A HZ2  
11708 H  HZ3  . TRP   A  759 ? 0.37642676 0.32599920 0.29815716 -0.10543853 -0.06230297 0.01329305  814  TRP   A HZ3  
11709 H  HH2  . TRP   A  759 ? 0.36722755 0.31257594 0.28365868 -0.11156645 -0.06856725 0.00887118  814  TRP   A HH2  
11710 N  N    . VAL   A  760 ? 0.26806742 0.25231335 0.21767944 -0.11799115 -0.05879946 0.02242585  815  VAL   A N    
11711 C  CA   . VAL   A  760 ? 0.23830837 0.22647914 0.18777171 -0.11198259 -0.05915986 0.02140822  815  VAL   A CA   
11712 C  C    . VAL   A  760 ? 0.21353067 0.20995821 0.16808182 -0.10791789 -0.05590228 0.02346651  815  VAL   A C    
11713 O  O    . VAL   A  760 ? 0.25856030 0.25301450 0.21039970 -0.10257627 -0.05464133 0.02341966  815  VAL   A O    
11714 C  CB   . VAL   A  760 ? 0.25776041 0.25210589 0.20929629 -0.11314662 -0.06306699 0.01957582  815  VAL   A CB   
11715 C  CG1  . VAL   A  760 ? 0.24817714 0.24689546 0.19949004 -0.10708357 -0.06316897 0.01937631  815  VAL   A CG1  
11716 C  CG2  . VAL   A  760 ? 0.31321007 0.29787529 0.25783658 -0.11625415 -0.06646794 0.01689916  815  VAL   A CG2  
11717 H  H    . VAL   A  760 ? 0.27574867 0.26271024 0.22773848 -0.12219027 -0.06042828 0.02204709  815  VAL   A H    
11718 H  HA   . VAL   A  760 ? 0.24567312 0.22623426 0.18953604 -0.10946263 -0.05908658 0.02045210  815  VAL   A HA   
11719 H  HB   . VAL   A  760 ? 0.25921023 0.26126102 0.21684447 -0.11608914 -0.06344873 0.02028491  815  VAL   A HB   
11720 H  HG11 . VAL   A  760 ? 0.24896100 0.24187717 0.19573750 -0.10398661 -0.06162384 0.01923130  815  VAL   A HG11 
11721 H  HG12 . VAL   A  760 ? 0.24321052 0.24954131 0.20001742 -0.10589425 -0.06198503 0.02073839  815  VAL   A HG12 
11722 H  HG13 . VAL   A  760 ? 0.25255316 0.25210863 0.20256467 -0.10754952 -0.06603145 0.01801309  815  VAL   A HG13 
11723 H  HG21 . VAL   A  760 ? 0.29938653 0.28816056 0.24508479 -0.11708219 -0.06917952 0.01576952  815  VAL   A HG21 
11724 H  HG22 . VAL   A  760 ? 0.30299184 0.28449664 0.24773863 -0.12047391 -0.06659020 0.01717386  815  VAL   A HG22 
11725 H  HG23 . VAL   A  760 ? 0.30035597 0.27771899 0.23917332 -0.11322705 -0.06587747 0.01595409  815  VAL   A HG23 
11726 N  N    . GLU   A  761 ? 0.21268983 0.21891233 0.17477401 -0.11050122 -0.05458556 0.02496772  816  GLU   A N    
11727 C  CA   . GLU   A  761 ? 0.29290777 0.30735385 0.25992575 -0.10651706 -0.05177872 0.02635431  816  GLU   A CA   
11728 C  C    . GLU   A  761 ? 0.34029174 0.34848136 0.30339456 -0.10403000 -0.04832298 0.02785924  816  GLU   A C    
11729 O  O    . GLU   A  761 ? 0.29773131 0.30871618 0.26178637 -0.09933089 -0.04653483 0.02838343  816  GLU   A O    
11730 C  CB   . GLU   A  761 ? 0.31184781 0.33880776 0.28812709 -0.10987549 -0.05078913 0.02714304  816  GLU   A CB   
11731 C  CG   . GLU   A  761 ? 0.36896747 0.40524819 0.35082528 -0.10498762 -0.04866109 0.02773445  816  GLU   A CG   
11732 C  CD   . GLU   A  761 ? 0.41065332 0.46093994 0.40267688 -0.10712454 -0.04821431 0.02765730  816  GLU   A CD   
11733 O  OE1  . GLU   A  761 ? 0.68339837 0.73703235 0.67866194 -0.11308955 -0.04952766 0.02729686  816  GLU   A OE1  
11734 O  OE2  . GLU   A  761 ? 0.53065455 0.58873081 0.52767408 -0.10285816 -0.04663887 0.02774948  816  GLU   A OE2  
11735 H  H    . GLU   A  761 ? 0.23170120 0.23957837 0.19590358 -0.11488726 -0.05536562 0.02498836  816  GLU   A H    
11736 H  HA   . GLU   A  761 ? 0.27736080 0.29372349 0.24435893 -0.10305262 -0.05284834 0.02568261  816  GLU   A HA   
11737 H  HB2  . GLU   A  761 ? 0.32398587 0.35463047 0.30287677 -0.11212993 -0.05334126 0.02614807  816  GLU   A HB2  
11738 H  HB3  . GLU   A  761 ? 0.32303429 0.34822839 0.29897434 -0.11321124 -0.04906637 0.02814553  816  GLU   A HB3  
11739 H  HG2  . GLU   A  761 ? 0.35927784 0.39271653 0.33909464 -0.10365751 -0.04599620 0.02873740  816  GLU   A HG2  
11740 H  HG3  . GLU   A  761 ? 0.35875332 0.39452654 0.33936217 -0.10134505 -0.05019315 0.02708629  816  GLU   A HG3  
11741 N  N    . GLU   A  762 ? 0.28638738 0.28572863 0.24488530 -0.10730588 -0.04780554 0.02856352  817  GLU   A N    
11742 C  CA   . GLU   A  762 ? 0.38469374 0.37673154 0.33854142 -0.10491380 -0.04550340 0.02992252  817  GLU   A CA   
11743 C  C    . GLU   A  762 ? 0.34164858 0.32680449 0.29038978 -0.09951288 -0.04627398 0.02852183  817  GLU   A C    
11744 O  O    . GLU   A  762 ? 0.28349483 0.26791599 0.23124903 -0.09540956 -0.04441098 0.02920818  817  GLU   A O    
11745 C  CB   . GLU   A  762 ? 0.38173115 0.36528999 0.33153450 -0.11006172 -0.04546013 0.03123746  817  GLU   A CB   
11746 C  CG   . GLU   A  762 ? 0.70059317 0.68020421 0.64746821 -0.10902238 -0.04282143 0.03358176  817  GLU   A CG   
11747 C  CD   . GLU   A  762 ? 0.74848109 0.73799080 0.70021206 -0.11015757 -0.03950062 0.03537633  817  GLU   A CD   
11748 O  OE1  . GLU   A  762 ? 0.58954453 0.58942211 0.54784364 -0.11304880 -0.03897858 0.03504856  817  GLU   A OE1  
11749 O  OE2  . GLU   A  762 ? 0.76472884 0.75186765 0.71371782 -0.10793975 -0.03747775 0.03689194  817  GLU   A OE2  
11750 H  H    . GLU   A  762 ? 0.32385793 0.32143605 0.28200567 -0.11120359 -0.04918092 0.02821979  817  GLU   A H    
11751 H  HA   . GLU   A  762 ? 0.34831274 0.34571809 0.30505037 -0.10357937 -0.04343013 0.03095378  817  GLU   A HA   
11752 H  HB2  . GLU   A  762 ? 0.44013569 0.42810175 0.39314646 -0.11434069 -0.04554961 0.03159760  817  GLU   A HB2  
11753 H  HB3  . GLU   A  762 ? 0.44419581 0.42008045 0.38977081 -0.11007253 -0.04732653 0.03013186  817  GLU   A HB3  
11754 H  HG2  . GLU   A  762 ? 0.61610293 0.58825719 0.55907369 -0.11181720 -0.04342368 0.03436944  817  GLU   A HG2  
11755 H  HG3  . GLU   A  762 ? 0.60629165 0.58310044 0.55107003 -0.10465321 -0.04275223 0.03312870  817  GLU   A HG3  
11756 N  N    . LEU   A  763 ? 0.25298575 0.23386955 0.19862098 -0.09953693 -0.04894197 0.02631800  818  LEU   A N    
11757 C  CA   . LEU   A  763 ? 0.25110462 0.22742462 0.19246219 -0.09456712 -0.04915483 0.02469310  818  LEU   A CA   
11758 C  C    . LEU   A  763 ? 0.34895924 0.33322477 0.29355833 -0.09049730 -0.04792674 0.02507868  818  LEU   A C    
11759 O  O    . LEU   A  763 ? 0.28746378 0.27012056 0.23038700 -0.08636338 -0.04629888 0.02514909  818  LEU   A O    
11760 C  CB   . LEU   A  763 ? 0.39266196 0.36402246 0.32986814 -0.09578162 -0.05206708 0.02202978  818  LEU   A CB   
11761 C  CG   . LEU   A  763 ? 0.34970194 0.31669101 0.28192040 -0.09123322 -0.05203199 0.01988638  818  LEU   A CG   
11762 C  CD1  . LEU   A  763 ? 0.40731892 0.36570770 0.33575904 -0.08842643 -0.05053128 0.01957872  818  LEU   A CD1  
11763 C  CD2  . LEU   A  763 ? 0.41926140 0.38307980 0.34739456 -0.09289920 -0.05494323 0.01715695  818  LEU   A CD2  
11764 H  H    . LEU   A  763 ? 0.27618641 0.25712472 0.22224987 -0.10284859 -0.05055371 0.02572587  818  LEU   A H    
11765 H  HA   . LEU   A  763 ? 0.29003122 0.26093125 0.22876154 -0.09314994 -0.04818983 0.02504880  818  LEU   A HA   
11766 H  HB2  . LEU   A  763 ? 0.34916800 0.31464672 0.28410724 -0.09840254 -0.05288109 0.02178434  818  LEU   A HB2  
11767 H  HB3  . LEU   A  763 ? 0.34213951 0.31895593 0.28201461 -0.09747172 -0.05338939 0.02180598  818  LEU   A HB3  
11768 H  HG   . LEU   A  763 ? 0.37255543 0.34475970 0.30667365 -0.08880753 -0.05104613 0.02044773  818  LEU   A HG   
11769 H  HD11 . LEU   A  763 ? 0.38957921 0.34679651 0.31578374 -0.08536043 -0.05002549 0.01817177  818  LEU   A HD11 
11770 H  HD12 . LEU   A  763 ? 0.39637053 0.34845036 0.32222682 -0.09043903 -0.05172524 0.01891284  818  LEU   A HD12 
11771 H  HD13 . LEU   A  763 ? 0.38439941 0.34482187 0.31520352 -0.08769494 -0.04900062 0.02140019  818  LEU   A HD13 
11772 H  HD21 . LEU   A  763 ? 0.39653888 0.36628905 0.32729366 -0.09423967 -0.05617240 0.01743378  818  LEU   A HD21 
11773 H  HD22 . LEU   A  763 ? 0.40491605 0.36328647 0.33112216 -0.09555604 -0.05610565 0.01649271  818  LEU   A HD22 
11774 H  HD23 . LEU   A  763 ? 0.39987779 0.36104262 0.32445467 -0.09003083 -0.05452315 0.01570079  818  LEU   A HD23 
11775 N  N    . MET   A  764 ? 0.35708520 0.34999257 0.30658171 -0.09176452 -0.04895829 0.02529406  819  MET   A N    
11776 C  CA   . MET   A  764 ? 0.34602186 0.34539068 0.29811603 -0.08799207 -0.04849808 0.02565717  819  MET   A CA   
11777 C  C    . MET   A  764 ? 0.31319329 0.31481233 0.26762006 -0.08571125 -0.04534045 0.02733436  819  MET   A C    
11778 O  O    . MET   A  764 ? 0.30370635 0.30459872 0.25666511 -0.08191181 -0.04426257 0.02743908  819  MET   A O    
11779 C  CB   . MET   A  764 ? 0.28978130 0.29794660 0.24727139 -0.08955049 -0.05070535 0.02556233  819  MET   A CB   
11780 C  CG   . MET   A  764 ? 0.37068760 0.37690520 0.32464212 -0.09026007 -0.05437656 0.02376506  819  MET   A CG   
11781 S  SD   . MET   A  764 ? 0.35189793 0.36842477 0.31313306 -0.09372513 -0.05785223 0.02350181  819  MET   A SD   
11782 C  CE   . MET   A  764 ? 0.43024725 0.45587575 0.39749232 -0.08872611 -0.05665297 0.02503363  819  MET   A CE   
11783 H  H    . MET   A  764 ? 0.35290587 0.34758145 0.30420783 -0.09502606 -0.05012752 0.02520061  819  MET   A H    
11784 H  HA   . MET   A  764 ? 0.33169433 0.32780230 0.28013068 -0.08586055 -0.04892819 0.02477646  819  MET   A HA   
11785 H  HB2  . MET   A  764 ? 0.31817633 0.32903725 0.27887294 -0.09261303 -0.05055433 0.02596099  819  MET   A HB2  
11786 H  HB3  . MET   A  764 ? 0.31378117 0.32647401 0.27391869 -0.08705556 -0.05000581 0.02623314  819  MET   A HB3  
11787 H  HG2  . MET   A  764 ? 0.34577757 0.35138515 0.29741359 -0.08728420 -0.05451806 0.02364917  819  MET   A HG2  
11788 H  HG3  . MET   A  764 ? 0.35176182 0.35173714 0.30166548 -0.09182695 -0.05481009 0.02277730  819  MET   A HG3  
11789 H  HE1  . MET   A  764 ? 0.40105754 0.42854905 0.37111247 -0.08866572 -0.05409561 0.02587327  819  MET   A HE1  
11790 H  HE2  . MET   A  764 ? 0.40465289 0.42688772 0.36802173 -0.08574872 -0.05648197 0.02513901  819  MET   A HE2  
11791 H  HE3  . MET   A  764 ? 0.40416545 0.43593997 0.37549365 -0.08910790 -0.05882500 0.02482958  819  MET   A HE3  
11792 N  N    . LYS   A  765 ? 0.28415525 0.28820932 0.24164979 -0.08846163 -0.04386393 0.02857400  820  LYS   A N    
11793 C  CA   . LYS   A  765 ? 0.30633575 0.31256613 0.26539031 -0.08670738 -0.04094418 0.02998054  820  LYS   A CA   
11794 C  C    . LYS   A  765 ? 0.28009519 0.27874526 0.23409484 -0.08393217 -0.03991519 0.03015323  820  LYS   A C    
11795 O  O    . LYS   A  765 ? 0.28543437 0.28573397 0.23996875 -0.08080838 -0.03837208 0.03059787  820  LYS   A O    
11796 C  CB   . LYS   A  765 ? 0.32465893 0.33365864 0.28622520 -0.09094158 -0.03936797 0.03125539  820  LYS   A CB   
11797 C  CG   . LYS   A  765 ? 0.38219571 0.40168941 0.35084182 -0.09308356 -0.03948396 0.03104850  820  LYS   A CG   
11798 C  CD   . LYS   A  765 ? 0.56610096 0.58702368 0.53615052 -0.09879420 -0.03813723 0.03211546  820  LYS   A CD   
11799 C  CE   . LYS   A  765 ? 0.57505667 0.60831851 0.55308717 -0.10023766 -0.03645400 0.03211513  820  LYS   A CE   
11800 N  NZ   . LYS   A  765 ? 0.69815278 0.73217934 0.67638963 -0.10621866 -0.03416745 0.03352118  820  LYS   A NZ   
11801 H  H    . LYS   A  765 ? 0.30066916 0.30496991 0.25899512 -0.09173191 -0.04467461 0.02850579  820  LYS   A H    
11802 H  HA   . LYS   A  765 ? 0.29483515 0.30606067 0.25667372 -0.08459169 -0.04066794 0.02994268  820  LYS   A HA   
11803 H  HB2  . LYS   A  765 ? 0.33878776 0.34258431 0.29756847 -0.09353063 -0.04011799 0.03135851  820  LYS   A HB2  
11804 H  HB3  . LYS   A  765 ? 0.33164477 0.34039429 0.29263693 -0.08980434 -0.03745786 0.03211942  820  LYS   A HB3  
11805 H  HG2  . LYS   A  765 ? 0.39742193 0.42180994 0.36886865 -0.09059013 -0.03823813 0.03113210  820  LYS   A HG2  
11806 H  HG3  . LYS   A  765 ? 0.39937770 0.41999167 0.36890236 -0.09328116 -0.04172968 0.03008568  820  LYS   A HG3  
11807 H  HD2  . LYS   A  765 ? 0.52334362 0.54113418 0.49207082 -0.10165720 -0.03995713 0.03174141  820  LYS   A HD2  
11808 H  HD3  . LYS   A  765 ? 0.52088773 0.53722578 0.48749375 -0.09896709 -0.03656547 0.03317812  820  LYS   A HD3  
11809 H  HE2  . LYS   A  765 ? 0.59163243 0.62794179 0.57100606 -0.09696095 -0.03489842 0.03211576  820  LYS   A HE2  
11810 H  HE3  . LYS   A  765 ? 0.59636945 0.63431752 0.57813913 -0.10060595 -0.03839773 0.03114218  820  LYS   A HE3  
11811 H  HZ1  . LYS   A  765 ? 0.65892231 0.68842107 0.63326424 -0.10580327 -0.03256251 0.03454961  820  LYS   A HZ1  
11812 H  HZ2  . LYS   A  765 ? 0.66287529 0.69348294 0.63968283 -0.10947168 -0.03572343 0.03354151  820  LYS   A HZ2  
11813 H  HZ3  . LYS   A  765 ? 0.65714860 0.69949377 0.64065486 -0.10716002 -0.03283186 0.03333331  820  LYS   A HZ3  
11814 N  N    . MET   A  766 ? 0.31871530 0.30922532 0.26811975 -0.08494461 -0.04101128 0.02956396  821  MET   A N    
11815 C  CA   . MET   A  766 ? 0.30340034 0.28726357 0.24879834 -0.08198921 -0.04047963 0.02933850  821  MET   A CA   
11816 C  C    . MET   A  766 ? 0.31977803 0.30501270 0.26476097 -0.07806814 -0.04027028 0.02815471  821  MET   A C    
11817 O  O    . MET   A  766 ? 0.26785716 0.25203657 0.21219935 -0.07527505 -0.03901898 0.02836783  821  MET   A O    
11818 C  CB   . MET   A  766 ? 0.30632800 0.28124696 0.24721336 -0.08326538 -0.04208828 0.02837354  821  MET   A CB   
11819 C  CG   . MET   A  766 ? 0.40975812 0.37824565 0.34734952 -0.07980932 -0.04181848 0.02790644  821  MET   A CG   
11820 S  SD   . MET   A  766 ? 0.43675351 0.40435052 0.37432382 -0.07932084 -0.04043753 0.03052764  821  MET   A SD   
11821 C  CE   . MET   A  766 ? 0.53132081 0.49177939 0.46577910 -0.07565844 -0.04131902 0.02948437  821  MET   A CE   
11822 H  H    . MET   A  766 ? 0.31020236 0.29932952 0.25916696 -0.08751898 -0.04224845 0.02916166  821  MET   A H    
11823 H  HA   . MET   A  766 ? 0.30810496 0.29225913 0.25384763 -0.08165429 -0.03922739 0.03052889  821  MET   A HA   
11824 H  HB2  . MET   A  766 ? 0.33090392 0.30435544 0.27163756 -0.08627390 -0.04232037 0.02931985  821  MET   A HB2  
11825 H  HB3  . MET   A  766 ? 0.32906616 0.30365092 0.26922518 -0.08359013 -0.04329812 0.02697617  821  MET   A HB3  
11826 H  HG2  . MET   A  766 ? 0.39071876 0.35329205 0.32548487 -0.08037212 -0.04303443 0.02700053  821  MET   A HG2  
11827 H  HG3  . MET   A  766 ? 0.38033339 0.35074306 0.31829670 -0.07715588 -0.04132675 0.02694938  821  MET   A HG3  
11828 H  HE1  . MET   A  766 ? 0.50755179 0.46247035 0.43957299 -0.07654868 -0.04259886 0.02881354  821  MET   A HE1  
11829 H  HE2  . MET   A  766 ? 0.49489191 0.45768398 0.43037647 -0.07319908 -0.04086227 0.02817167  821  MET   A HE2  
11830 H  HE3  . MET   A  766 ? 0.50207925 0.46140718 0.43601891 -0.07498114 -0.04109701 0.03076232  821  MET   A HE3  
11831 N  N    . HIS   A  767 ? 0.26432300 0.25190938 0.20943418 -0.07823811 -0.04162352 0.02703145  822  HIS   A N    
11832 C  CA   . HIS   A  767 ? 0.21813525 0.20651302 0.16176137 -0.07521199 -0.04138458 0.02619241  822  HIS   A CA   
11833 C  C    . HIS   A  767 ? 0.25337154 0.24833202 0.20026511 -0.07403239 -0.04116670 0.02722895  822  HIS   A C    
11834 O  O    . HIS   A  767 ? 0.19606581 0.19185695 0.14136833 -0.07264407 -0.04186170 0.02685799  822  HIS   A O    
11835 C  CB   . HIS   A  767 ? 0.27809954 0.26268914 0.21751350 -0.07574502 -0.04312238 0.02414145  822  HIS   A CB   
11836 C  CG   . HIS   A  767 ? 0.24277264 0.21994850 0.17842698 -0.07540842 -0.04304624 0.02259171  822  HIS   A CG   
11837 N  ND1  . HIS   A  767 ? 0.28785163 0.26029536 0.22222875 -0.07829496 -0.04459213 0.02212417  822  HIS   A ND1  
11838 C  CD2  . HIS   A  767 ? 0.19230451 0.16621882 0.12573643 -0.07245214 -0.04166384 0.02142916  822  HIS   A CD2  
11839 C  CE1  . HIS   A  767 ? 0.19022241 0.15580879 0.12116288 -0.07652986 -0.04434347 0.02065175  822  HIS   A CE1  
11840 N  NE2  . HIS   A  767 ? 0.24191386 0.20879024 0.17263955 -0.07285248 -0.04255888 0.02006074  822  HIS   A NE2  
11841 H  H    . HIS   A  767 ? 0.26716346 0.25576511 0.21302652 -0.08050065 -0.04280742 0.02684761  822  HIS   A H    
11842 H  HA   . HIS   A  767 ? 0.24193199 0.22828567 0.18458907 -0.07344232 -0.04018395 0.02616602  822  HIS   A HA   
11843 H  HB2  . HIS   A  767 ? 0.25608790 0.24210015 0.19632187 -0.07789637 -0.04467778 0.02405086  822  HIS   A HB2  
11844 H  HB3  . HIS   A  767 ? 0.25305277 0.23871039 0.19120836 -0.07415879 -0.04288786 0.02380726  822  HIS   A HB3  
11846 H  HD2  . HIS   A  767 ? 0.21008916 0.18609712 0.14383505 -0.07054608 -0.04039134 0.02147793  822  HIS   A HD2  
11847 H  HE1  . HIS   A  767 ? 0.22770451 0.18813686 0.15671051 -0.07776621 -0.04536268 0.02004393  822  HIS   A HE1  
11849 N  N    . THR   A  768 ? 0.24530333 0.24451138 0.19629185 -0.07445820 -0.04017524 0.02852898  823  THR   A N    
11850 C  CA   . THR   A  768 ? 0.22387701 0.22823484 0.17789723 -0.07244036 -0.03964467 0.02928885  823  THR   A CA   
11851 C  C    . THR   A  768 ? 0.27059773 0.27255815 0.22217058 -0.06959393 -0.03851592 0.02937909  823  THR   A C    
11852 O  O    . THR   A  768 ? 0.32524389 0.32319504 0.27428681 -0.06910131 -0.03751833 0.02897986  823  THR   A O    
11853 C  CB   . THR   A  768 ? 0.26114088 0.26961660 0.21915987 -0.07310636 -0.03801532 0.03018794  823  THR   A CB   
11854 O  OG1  . THR   A  768 ? 0.27430427 0.28780752 0.23559256 -0.07083781 -0.03783140 0.03042641  823  THR   A OG1  
11855 C  CG2  . THR   A  768 ? 0.19232222 0.19705965 0.14826453 -0.07268780 -0.03612482 0.03069987  823  THR   A CG2  
11856 H  H    . THR   A  768 ? 0.24316479 0.24176182 0.19479628 -0.07604799 -0.03979231 0.02889565  823  THR   A H    
11857 H  HA   . THR   A  768 ? 0.24310775 0.24989372 0.19807997 -0.07260361 -0.04115562 0.02908378  823  THR   A HA   
11858 H  HB   . THR   A  768 ? 0.24253842 0.25267208 0.20211458 -0.07544753 -0.03848986 0.03018267  823  THR   A HB   
11860 H  HG21 . THR   A  768 ? 0.21026030 0.21730769 0.16792677 -0.07348230 -0.03507016 0.03124228  823  THR   A HG21 
11861 H  HG22 . THR   A  768 ? 0.20883068 0.21268180 0.16387218 -0.07064187 -0.03563097 0.03065835  823  THR   A HG22 
11862 H  HG23 . THR   A  768 ? 0.21287814 0.21369109 0.16650936 -0.07369294 -0.03653555 0.03049723  823  THR   A HG23 
11863 N  N    . ALA   A  769 ? 0.29842153 0.30278188 0.25079986 -0.06779850 -0.03894325 0.02985675  824  ALA   A N    
11864 C  CA   . ALA   A  769 ? 0.25253904 0.25438693 0.20219901 -0.06587939 -0.03806785 0.03011743  824  ALA   A CA   
11865 C  C    . ALA   A  769 ? 0.23678070 0.24088347 0.18843490 -0.06396081 -0.03815647 0.03101958  824  ALA   A C    
11866 O  O    . ALA   A  769 ? 0.24679250 0.25497976 0.20203425 -0.06355951 -0.03921298 0.03117749  824  ALA   A O    
11867 C  CB   . ALA   A  769 ? 0.32120425 0.32033247 0.26632965 -0.06603490 -0.03910937 0.02958556  824  ALA   A CB   
11868 H  H    . ALA   A  769 ? 0.27887642 0.28647596 0.23362008 -0.06784026 -0.03987511 0.03005557  824  ALA   A H    
11869 H  HA   . ALA   A  769 ? 0.26741877 0.26764649 0.21663223 -0.06576323 -0.03670796 0.02998714  824  ALA   A HA   
11870 H  HB1  . ALA   A  769 ? 0.30013227 0.29783097 0.24343739 -0.06515645 -0.03822893 0.02988479  824  ALA   A HB1  
11871 H  HB2  . ALA   A  769 ? 0.30125552 0.29859671 0.24502143 -0.06694477 -0.03898218 0.02869470  824  ALA   A HB2  
11872 H  HB3  . ALA   A  769 ? 0.30140430 0.30193186 0.24659488 -0.06614817 -0.04081210 0.02978002  824  ALA   A HB3  
11873 N  N    . ARG   A  770 ? 0.20034635 0.20179597 0.14995858 -0.06278927 -0.03697844 0.03142641  825  ARG   A N    
11874 C  CA   . ARG   A  770 ? 0.22920471 0.23029396 0.17888471 -0.06093174 -0.03737602 0.03225996  825  ARG   A CA   
11875 C  C    . ARG   A  770 ? 0.22099172 0.21984133 0.16678467 -0.06063164 -0.03921048 0.03303425  825  ARG   A C    
11876 O  O    . ARG   A  770 ? 0.21050680 0.20723787 0.15246943 -0.06191116 -0.03902029 0.03279142  825  ARG   A O    
11877 C  CB   . ARG   A  770 ? 0.20688322 0.20521504 0.15541025 -0.06054002 -0.03549470 0.03241937  825  ARG   A CB   
11878 C  CG   . ARG   A  770 ? 0.17061934 0.17013013 0.12141738 -0.06094639 -0.03384063 0.03173227  825  ARG   A CG   
11879 C  CD   . ARG   A  770 ? 0.18199202 0.17898798 0.13144377 -0.06097041 -0.03259825 0.03169800  825  ARG   A CD   
11880 N  NE   . ARG   A  770 ? 0.19210467 0.18729079 0.13908517 -0.06194033 -0.03213490 0.03174647  825  ARG   A NE   
11881 C  CZ   . ARG   A  770 ? 0.21095961 0.20405100 0.15617645 -0.06240610 -0.03144264 0.03213314  825  ARG   A CZ   
11882 N  NH1  . ARG   A  770 ? 0.25826678 0.24967784 0.20359094 -0.06200947 -0.03139340 0.03243033  825  ARG   A NH1  
11883 N  NH2  . ARG   A  770 ? 0.25975272 0.25234258 0.20286384 -0.06352322 -0.03061701 0.03206063  825  ARG   A NH2  
11884 H  H    . ARG   A  770 ? 0.21480793 0.21443544 0.16296639 -0.06321302 -0.03595931 0.03112313  825  ARG   A H    
11885 H  HA   . ARG   A  770 ? 0.21664932 0.22045442 0.16931267 -0.06015257 -0.03782930 0.03221186  825  ARG   A HA   
11886 H  HB2  . ARG   A  770 ? 0.20413283 0.20047268 0.15011331 -0.06126038 -0.03505006 0.03249195  825  ARG   A HB2  
11887 H  HB3  . ARG   A  770 ? 0.20427726 0.20175861 0.15273145 -0.05935231 -0.03593355 0.03290183  825  ARG   A HB3  
11888 H  HG2  . ARG   A  770 ? 0.17912784 0.18058538 0.13204275 -0.06027689 -0.03385403 0.03162572  825  ARG   A HG2  
11889 H  HG3  . ARG   A  770 ? 0.17920789 0.17916068 0.13008778 -0.06194903 -0.03369907 0.03138056  825  ARG   A HG3  
11890 H  HD2  . ARG   A  770 ? 0.18389344 0.17990775 0.13318272 -0.06010509 -0.03275950 0.03196177  825  ARG   A HD2  
11891 H  HD3  . ARG   A  770 ? 0.18106085 0.17871474 0.13150235 -0.06123777 -0.03193898 0.03129087  825  ARG   A HD3  
11892 H  HE   . ARG   A  770 ? 0.19488700 0.19050226 0.14150494 -0.06240053 -0.03218341 0.03140902  825  ARG   A HE   
11893 H  HH11 . ARG   A  770 ? 0.24019824 0.23228508 0.18698224 -0.06162385 -0.03123864 0.03196385  825  ARG   A HH11 
11894 H  HH12 . ARG   A  770 ? 0.24520716 0.23444270 0.18876536 -0.06219882 -0.03155258 0.03307448  825  ARG   A HH12 
11895 H  HH21 . ARG   A  770 ? 0.24529108 0.23678882 0.18726569 -0.06422818 -0.02996581 0.03240356  825  ARG   A HH21 
11896 H  HH22 . ARG   A  770 ? 0.24307200 0.23642081 0.18583868 -0.06364491 -0.03061734 0.03158548  825  ARG   A HH22 
11897 N  N    . VAL   A  771 ? 0.26969180 0.26841897 0.21585593 -0.05869349 -0.04089930 0.03395325  826  VAL   A N    
11898 C  CA   . VAL   A  771 ? 0.21170849 0.20714131 0.15303637 -0.05828587 -0.04296390 0.03519754  826  VAL   A CA   
11899 C  C    . VAL   A  771 ? 0.22107571 0.21176857 0.15727955 -0.05973256 -0.04081332 0.03572783  826  VAL   A C    
11900 O  O    . VAL   A  771 ? 0.21186979 0.20016482 0.14281610 -0.06096809 -0.04107729 0.03618554  826  VAL   A O    
11901 C  CB   . VAL   A  771 ? 0.19331264 0.18854505 0.13594037 -0.05539700 -0.04543816 0.03620418  826  VAL   A CB   
11902 C  CG1  . VAL   A  771 ? 0.20616686 0.19611910 0.14216517 -0.05504570 -0.04773489 0.03806911  826  VAL   A CG1  
11903 C  CG2  . VAL   A  771 ? 0.20534080 0.20718637 0.15406020 -0.05412670 -0.04752712 0.03536790  826  VAL   A CG2  
11904 H  H    . VAL   A  771 ? 0.23910397 0.23957166 0.18828447 -0.05749388 -0.04081519 0.03380031  826  VAL   A H    
11905 H  HA   . VAL   A  771 ? 0.22001329 0.21657395 0.16048518 -0.05913047 -0.04411777 0.03488434  826  VAL   A HA   
11906 H  HB   . VAL   A  771 ? 0.20017406 0.19426477 0.14394146 -0.05448139 -0.04425398 0.03617781  826  VAL   A HB   
11907 H  HG11 . VAL   A  771 ? 0.20618975 0.19670533 0.14003123 -0.05624332 -0.04863490 0.03797424  826  VAL   A HG11 
11908 H  HG12 . VAL   A  771 ? 0.20660183 0.19258007 0.13919577 -0.05588037 -0.04624718 0.03872965  826  VAL   A HG12 
11909 H  HG13 . VAL   A  771 ? 0.20796145 0.19779783 0.14503147 -0.05284641 -0.04985838 0.03868822  826  VAL   A HG13 
11910 H  HG21 . VAL   A  771 ? 0.20415156 0.20616019 0.15424892 -0.05177569 -0.04903357 0.03580088  826  VAL   A HG21 
11911 H  HG22 . VAL   A  771 ? 0.19811982 0.20309901 0.15048993 -0.05470686 -0.04586817 0.03436654  826  VAL   A HG22 
11912 H  HG23 . VAL   A  771 ? 0.20286466 0.20568220 0.15040210 -0.05515923 -0.04904994 0.03534613  826  VAL   A HG23 
11913 N  N    . ARG   A  772 ? 0.20345894 0.19335914 0.14125741 -0.05982908 -0.03856196 0.03547232  827  ARG   A N    
11914 C  CA   . ARG   A  772 ? 0.22108135 0.20759249 0.15528278 -0.06141837 -0.03654471 0.03594168  827  ARG   A CA   
11915 C  C    . ARG   A  772 ? 0.21253717 0.20030600 0.14515875 -0.06324408 -0.03488574 0.03484682  827  ARG   A C    
11916 O  O    . ARG   A  772 ? 0.20397431 0.18979123 0.13239214 -0.06473705 -0.03353813 0.03522312  827  ARG   A O    
11917 C  CB   . ARG   A  772 ? 0.27683949 0.26308393 0.21400166 -0.06113476 -0.03508936 0.03552829  827  ARG   A CB   
11918 C  CG   . ARG   A  772 ? 0.28836527 0.27139980 0.22294553 -0.06284785 -0.03349680 0.03611488  827  ARG   A CG   
11919 C  CD   . ARG   A  772 ? 0.37212193 0.34945175 0.30232778 -0.06264335 -0.03483296 0.03804584  827  ARG   A CD   
11920 N  NE   . ARG   A  772 ? 0.34823310 0.32257843 0.27533853 -0.06548835 -0.03294325 0.03879546  827  ARG   A NE   
11921 C  CZ   . ARG   A  772 ? 0.46163988 0.43414807 0.38375384 -0.06771395 -0.03205163 0.03998898  827  ARG   A CZ   
11922 N  NH1  . ARG   A  772 ? 0.44554985 0.41666418 0.36349174 -0.06712333 -0.03364523 0.04105302  827  ARG   A NH1  
11923 N  NH2  . ARG   A  772 ? 0.45903689 0.43118769 0.38007170 -0.07080668 -0.02955180 0.04014131  827  ARG   A NH2  
11924 H  H    . ARG   A  772 ? 0.20880544 0.20056170 0.15001324 -0.05903044 -0.03828711 0.03494656  827  ARG   A H    
11925 H  HA   . ARG   A  772 ? 0.23089258 0.21430437 0.16157255 -0.06140644 -0.03740688 0.03720305  827  ARG   A HA   
11926 H  HB2  . ARG   A  772 ? 0.26351160 0.24927917 0.20187943 -0.05957976 -0.03619041 0.03578019  827  ARG   A HB2  
11927 H  HB3  . ARG   A  772 ? 0.25947201 0.24839514 0.19935323 -0.06131725 -0.03425301 0.03446215  827  ARG   A HB3  
11928 H  HG2  . ARG   A  772 ? 0.29865348 0.28236467 0.23556291 -0.06288034 -0.03269194 0.03542808  827  ARG   A HG2  
11929 H  HG3  . ARG   A  772 ? 0.30110323 0.28490105 0.23433454 -0.06425747 -0.03235262 0.03589092  827  ARG   A HG3  
11930 H  HD2  . ARG   A  772 ? 0.34868696 0.32529095 0.27648839 -0.06224857 -0.03613087 0.03882865  827  ARG   A HD2  
11931 H  HD3  . ARG   A  772 ? 0.34638089 0.32261771 0.27811101 -0.06104148 -0.03576200 0.03798993  827  ARG   A HD3  
11932 H  HE   . ARG   A  772 ? 0.37741405 0.35135594 0.30601922 -0.06594524 -0.03227267 0.03838468  827  ARG   A HE   
11933 H  HH11 . ARG   A  772 ? 0.45349821 0.42204547 0.37011525 -0.06568859 -0.03570241 0.04203095  827  ARG   A HH11 
11934 H  HH12 . ARG   A  772 ? 0.45163703 0.42438313 0.36806339 -0.06806637 -0.03276555 0.04068960  827  ARG   A HH12 
11935 H  HH21 . ARG   A  772 ? 0.46401668 0.43472660 0.38132972 -0.07250464 -0.02873327 0.04107619  827  ARG   A HH21 
11936 H  HH22 . ARG   A  772 ? 0.45579970 0.42940137 0.37986118 -0.07126710 -0.02871811 0.03928739  827  ARG   A HH22 
11937 N  N    . ASP   A  773 ? 0.20848301 0.19934902 0.14426759 -0.06316369 -0.03483627 0.03337338  828  ASP   A N    
11938 C  CA   . ASP   A  773 ? 0.19867900 0.19000641 0.13302423 -0.06422266 -0.03358893 0.03194859  828  ASP   A CA   
11939 C  C    . ASP   A  773 ? 0.24308518 0.23277526 0.17205480 -0.06487509 -0.03466737 0.03203480  828  ASP   A C    
11940 O  O    . ASP   A  773 ? 0.29663965 0.28546503 0.22203225 -0.06581805 -0.03294685 0.03118290  828  ASP   A O    
11941 C  CB   . ASP   A  773 ? 0.23209342 0.22540519 0.16996628 -0.06406716 -0.03389583 0.03061296  828  ASP   A CB   
11942 C  CG   . ASP   A  773 ? 0.31373933 0.30830380 0.25566944 -0.06360251 -0.03294292 0.03051867  828  ASP   A CG   
11943 O  OD1  . ASP   A  773 ? 0.24828194 0.24259348 0.19050361 -0.06365659 -0.03134098 0.03043476  828  ASP   A OD1  
11944 O  OD2  . ASP   A  773 ? 0.29367375 0.28970283 0.23832268 -0.06347465 -0.03375779 0.03048857  828  ASP   A OD2  
11945 H  H    . ASP   A  773 ? 0.20467439 0.19716848 0.14341573 -0.06243508 -0.03553870 0.03320042  828  ASP   A H    
11946 H  HA   . ASP   A  773 ? 0.21341854 0.20455007 0.14756662 -0.06469487 -0.03184395 0.03171446  828  ASP   A HA   
11947 H  HB2  . ASP   A  773 ? 0.23926198 0.23331566 0.17774339 -0.06398035 -0.03549859 0.03080642  828  ASP   A HB2  
11948 H  HB3  . ASP   A  773 ? 0.24004236 0.23288962 0.17658007 -0.06446901 -0.03327239 0.02954124  828  ASP   A HB3  
11949 N  N    . ILE   A  774 ? 0.24703525 0.23665343 0.17542104 -0.06425632 -0.03754233 0.03296272  829  ILE   A N    
11950 C  CA   . ILE   A  774 ? 0.26088858 0.24880657 0.18362814 -0.06486996 -0.03934505 0.03312715  829  ILE   A CA   
11951 C  C    . ILE   A  774 ? 0.25056210 0.23469085 0.16708413 -0.06544086 -0.03866645 0.03491880  829  ILE   A C    
11952 O  O    . ILE   A  774 ? 0.27912173 0.26127234 0.18923734 -0.06673232 -0.03807165 0.03469474  829  ILE   A O    
11953 C  CB   . ILE   A  774 ? 0.23759162 0.22751869 0.16252027 -0.06400090 -0.04312041 0.03350823  829  ILE   A CB   
11954 C  CG1  . ILE   A  774 ? 0.20886160 0.20218295 0.13884652 -0.06464232 -0.04331401 0.03169716  829  ILE   A CG1  
11955 C  CG2  . ILE   A  774 ? 0.33155629 0.31909794 0.24962215 -0.06444197 -0.04582829 0.03418883  829  ILE   A CG2  
11956 C  CD1  . ILE   A  774 ? 0.20396775 0.20136099 0.13877720 -0.06406906 -0.04630351 0.03198775  829  ILE   A CD1  
11957 H  H    . ILE   A  774 ? 0.24498580 0.23587087 0.17654042 -0.06337574 -0.03847612 0.03338924  829  ILE   A H    
11958 H  HA   . ILE   A  774 ? 0.25260359 0.24056761 0.17404090 -0.06563570 -0.03851663 0.03169889  829  ILE   A HA   
11959 H  HB   . ILE   A  774 ? 0.24823989 0.23870727 0.17566279 -0.06276885 -0.04373645 0.03455624  829  ILE   A HB   
11960 H  HG12 . ILE   A  774 ? 0.21577901 0.20800760 0.14300855 -0.06568356 -0.04332192 0.03056347  829  ILE   A HG12 
11961 H  HG13 . ILE   A  774 ? 0.21009400 0.20398635 0.14284508 -0.06453768 -0.04140367 0.03137034  829  ILE   A HG13 
11962 H  HG21 . ILE   A  774 ? 0.30366683 0.28993899 0.21811447 -0.06562421 -0.04472565 0.03312472  829  ILE   A HG21 
11963 H  HG22 . ILE   A  774 ? 0.30448928 0.28965557 0.21970117 -0.06393342 -0.04615550 0.03580001  829  ILE   A HG22 
11964 H  HG23 . ILE   A  774 ? 0.30041847 0.28999674 0.22040960 -0.06408539 -0.04840370 0.03403464  829  ILE   A HG23 
11965 H  HD11 . ILE   A  774 ? 0.20939422 0.20649484 0.14171652 -0.06409697 -0.04860361 0.03227244  829  ILE   A HD11 
11966 H  HD12 . ILE   A  774 ? 0.20316097 0.20169769 0.14075676 -0.06272308 -0.04614978 0.03283129  829  ILE   A HD12 
11967 H  HD13 . ILE   A  774 ? 0.20297849 0.20220459 0.14057055 -0.06505331 -0.04611480 0.03098016  829  ILE   A HD13 
11968 N  N    . GLU   A  775 ? 0.24694076 0.22956374 0.16479234 -0.06469646 -0.03861927 0.03664263  830  GLU   A N    
11969 C  CA   . GLU   A  775 ? 0.28578019 0.26380125 0.19754119 -0.06580510 -0.03789216 0.03867418  830  GLU   A CA   
11970 C  C    . GLU   A  775 ? 0.28748426 0.26585653 0.19678003 -0.06819046 -0.03387406 0.03773046  830  GLU   A C    
11971 O  O    . GLU   A  775 ? 0.27456224 0.25022313 0.17672214 -0.06996614 -0.03293965 0.03865981  830  GLU   A O    
11972 C  CB   . GLU   A  775 ? 0.29032838 0.26600513 0.20442398 -0.06467541 -0.03844601 0.04021465  830  GLU   A CB   
11973 C  CG   . GLU   A  775 ? 0.32217127 0.29718328 0.23774903 -0.06183887 -0.04243852 0.04122839  830  GLU   A CG   
11974 C  CD   . GLU   A  775 ? 0.39597088 0.36688304 0.31218240 -0.06032382 -0.04315222 0.04265519  830  GLU   A CD   
11975 O  OE1  . GLU   A  775 ? 0.37625095 0.34742403 0.29545721 -0.06102509 -0.04066506 0.04187057  830  GLU   A OE1  
11976 O  OE2  . GLU   A  775 ? 0.33595598 0.30303875 0.24955557 -0.05829030 -0.04643193 0.04441487  830  GLU   A OE2  
11977 H  H    . GLU   A  775 ? 0.25147879 0.23561192 0.17372012 -0.06362567 -0.03902566 0.03653591  830  GLU   A H    
11978 H  HA   . GLU   A  775 ? 0.28525931 0.26129311 0.19261222 -0.06575945 -0.03983570 0.03961942  830  GLU   A HA   
11979 H  HB2  . GLU   A  775 ? 0.29005316 0.26800546 0.20870201 -0.06451828 -0.03701993 0.03913293  830  GLU   A HB2  
11980 H  HB3  . GLU   A  775 ? 0.30012694 0.27233374 0.21016936 -0.06598070 -0.03755439 0.04152986  830  GLU   A HB3  
11981 H  HG2  . GLU   A  775 ? 0.33156425 0.30483434 0.24286944 -0.06185106 -0.04431190 0.04216835  830  GLU   A HG2  
11982 H  HG3  . GLU   A  775 ? 0.32284421 0.30187643 0.24321996 -0.06084513 -0.04293638 0.03990318  830  GLU   A HG3  
11983 N  N    . HIS   A  776 ? 0.38211891 0.36411247 0.29724574 -0.06819490 -0.03148285 0.03588718  831  HIS   A N    
11984 C  CA   . HIS   A  776 ? 0.34726042 0.33114058 0.26185399 -0.06989416 -0.02775104 0.03456056  831  HIS   A CA   
11985 C  C    . HIS   A  776 ? 0.33437049 0.31874621 0.24456336 -0.07022186 -0.02713963 0.03287862  831  HIS   A C    
11986 O  O    . HIS   A  776 ? 0.25682822 0.24126767 0.16256422 -0.07192957 -0.02433892 0.03246494  831  HIS   A O    
11987 C  CB   . HIS   A  776 ? 0.37139317 0.35937667 0.29334342 -0.06912377 -0.02622159 0.03263000  831  HIS   A CB   
11988 C  CG   . HIS   A  776 ? 0.34173512 0.32962286 0.26778311 -0.06909261 -0.02632559 0.03360315  831  HIS   A CG   
11989 N  ND1  . HIS   A  776 ? 0.41135490 0.39601356 0.33463722 -0.07064402 -0.02604384 0.03559075  831  HIS   A ND1  
11990 C  CD2  . HIS   A  776 ? 0.46650973 0.45642692 0.39831141 -0.06778552 -0.02688741 0.03277180  831  HIS   A CD2  
11991 C  CE1  . HIS   A  776 ? 0.44083333 0.42568138 0.36846888 -0.07017285 -0.02643493 0.03559507  831  HIS   A CE1  
11992 N  NE2  . HIS   A  776 ? 0.42347765 0.41175914 0.35617214 -0.06842574 -0.02688017 0.03390523  831  HIS   A NE2  
11993 H  H    . HIS   A  776 ? 0.34033909 0.32387298 0.25990689 -0.06704214 -0.03223364 0.03543009  831  HIS   A H    
11994 H  HA   . HIS   A  776 ? 0.35920638 0.34135479 0.27119735 -0.07137018 -0.02661723 0.03586213  831  HIS   A HA   
11995 H  HB2  . HIS   A  776 ? 0.35457408 0.34350812 0.27857840 -0.06787726 -0.02744458 0.03164961  831  HIS   A HB2  
11996 H  HB3  . HIS   A  776 ? 0.35753721 0.34735423 0.27937552 -0.06987325 -0.02398119 0.03148537  831  HIS   A HB3  
11998 H  HD2  . HIS   A  776 ? 0.41879946 0.41044694 0.35300368 -0.06678630 -0.02723909 0.03163721  831  HIS   A HD2  
11999 H  HE1  . HIS   A  776 ? 0.43258029 0.41502577 0.35936329 -0.07108586 -0.02643703 0.03664081  831  HIS   A HE1  
12001 N  N    . LEU   A  777 ? 0.23417445 0.21915287 0.14584883 -0.06877381 -0.02952051 0.03161269  832  LEU   A N    
12002 C  CA   . LEU   A  777 ? 0.29083633 0.27559158 0.19830902 -0.06900404 -0.02927975 0.02946034  832  LEU   A CA   
12003 C  C    . LEU   A  777 ? 0.25108761 0.23245087 0.14955644 -0.07012578 -0.03076196 0.03054812  832  LEU   A C    
12004 O  O    . LEU   A  777 ? 0.33311361 0.31388241 0.22653373 -0.07067955 -0.02983725 0.02853425  832  LEU   A O    
12005 C  CB   . LEU   A  777 ? 0.24358952 0.22942668 0.15546282 -0.06772257 -0.03150303 0.02775707  832  LEU   A CB   
12006 C  CG   . LEU   A  777 ? 0.23795503 0.22615033 0.15605366 -0.06674673 -0.02951673 0.02595263  832  LEU   A CG   
12007 C  CD1  . LEU   A  777 ? 0.26972178 0.25824365 0.19237329 -0.06601889 -0.03184349 0.02554586  832  LEU   A CD1  
12008 C  CD2  . LEU   A  777 ? 0.24042222 0.22882670 0.15624614 -0.06651015 -0.02695910 0.02309551  832  LEU   A CD2  
12009 H  H    . LEU   A  777 ? 0.26202986 0.24751279 0.17720968 -0.06779515 -0.03121723 0.03195931  832  LEU   A H    
12010 H  HA   . LEU   A  777 ? 0.26223409 0.24837175 0.16986582 -0.06933054 -0.02654114 0.02811083  832  LEU   A HA   
12011 H  HB2  . LEU   A  777 ? 0.25071272 0.23662889 0.16465230 -0.06732044 -0.03368569 0.02903262  832  LEU   A HB2  
12012 H  HB3  . LEU   A  777 ? 0.25618255 0.24090433 0.16452828 -0.06800187 -0.03222738 0.02655575  832  LEU   A HB3  
12013 H  HG   . LEU   A  777 ? 0.24134046 0.23068792 0.16189958 -0.06675718 -0.02833770 0.02690417  832  LEU   A HG   
12014 H  HD11 . LEU   A  777 ? 0.25494325 0.24443063 0.18106705 -0.06538045 -0.03081010 0.02490610  832  LEU   A HD11 
12015 H  HD12 . LEU   A  777 ? 0.26070449 0.24799752 0.18125919 -0.06625426 -0.03290781 0.02435338  832  LEU   A HD12 
12016 H  HD13 . LEU   A  777 ? 0.25648379 0.24541527 0.18056723 -0.06603707 -0.03335194 0.02708743  832  LEU   A HD13 
12017 H  HD21 . LEU   A  777 ? 0.24345663 0.23251054 0.15699813 -0.06720863 -0.02489137 0.02332929  832  LEU   A HD21 
12018 H  HD22 . LEU   A  777 ? 0.24452949 0.23118497 0.15702997 -0.06663982 -0.02809859 0.02202985  832  LEU   A HD22 
12019 H  HD23 . LEU   A  777 ? 0.23804784 0.22764251 0.15791428 -0.06551187 -0.02627491 0.02199496  832  LEU   A HD23 
12020 N  N    . THR   A  778 ? 0.23202133 0.21066627 0.12783185 -0.07028347 -0.03315436 0.03358986  833  THR   A N    
12021 C  CA   . THR   A  778 ? 0.26385230 0.23877323 0.15077880 -0.07102919 -0.03561588 0.03496942  833  THR   A CA   
12022 C  C    . THR   A  778 ? 0.30695730 0.27765992 0.18692705 -0.07269958 -0.03461419 0.03804431  833  THR   A C    
12023 O  O    . THR   A  778 ? 0.33543593 0.30250657 0.20606008 -0.07389124 -0.03568471 0.03919138  833  THR   A O    
12024 C  CB   . THR   A  778 ? 0.25155756 0.22628838 0.14062533 -0.06930900 -0.04089541 0.03608487  833  THR   A CB   
12025 O  OG1  . THR   A  778 ? 0.26469666 0.23937058 0.15909362 -0.06791938 -0.04173573 0.03815971  833  THR   A OG1  
12026 C  CG2  . THR   A  778 ? 0.22980568 0.20806433 0.12426384 -0.06858021 -0.04237512 0.03341962  833  THR   A CG2  
12027 H  H    . THR   A  778 ? 0.23998538 0.21880385 0.13935591 -0.06974244 -0.03352249 0.03477674  833  THR   A H    
12028 H  HA   . THR   A  778 ? 0.26613754 0.24119094 0.14966650 -0.07161390 -0.03483444 0.03317806  833  THR   A HA   
12029 H  HB   . THR   A  778 ? 0.26071221 0.23279975 0.14359184 -0.06970577 -0.04289023 0.03720181  833  THR   A HB   
12031 H  HG21 . THR   A  778 ? 0.23410293 0.21312243 0.13054073 -0.06771443 -0.04555444 0.03415364  833  THR   A HG21 
12032 H  HG22 . THR   A  778 ? 0.22883886 0.20920157 0.12869994 -0.06821721 -0.04052419 0.03247515  833  THR   A HG22 
12033 H  HG23 . THR   A  778 ? 0.23828968 0.21583349 0.12869227 -0.06942339 -0.04206898 0.03187212  833  THR   A HG23 
12034 N  N    . GLY   A  779 ? 0.27891654 0.24942353 0.16285199 -0.07299864 -0.03292288 0.03952295  834  GLY   A N    
12035 C  CA   . GLY   A  779 ? 0.26964334 0.23500113 0.14705084 -0.07497055 -0.03233344 0.04276715  834  GLY   A CA   
12036 C  C    . GLY   A  779 ? 0.29087132 0.25081408 0.16477780 -0.07336751 -0.03744801 0.04585738  834  GLY   A C    
12037 O  O    . GLY   A  779 ? 0.29742616 0.25117803 0.16341497 -0.07491069 -0.03798859 0.04895776  834  GLY   A O    
12038 H  H    . GLY   A  779 ? 0.27287182 0.24606702 0.16325338 -0.07213896 -0.03224165 0.03853181  834  GLY   A H    
12039 H  HA2  . GLY   A  779 ? 0.27396435 0.24009182 0.15506814 -0.07561997 -0.03035013 0.04297578  834  GLY   A HA2  
12040 H  HA3  . GLY   A  779 ? 0.28339988 0.24783680 0.15466300 -0.07687704 -0.03042444 0.04274060  834  GLY   A HA3  
12041 N  N    . LEU   A  780 ? 0.27155310 0.23394051 0.15187168 -0.07023986 -0.04111737 0.04505292  835  LEU   A N    
12042 C  CA   . LEU   A  780 ? 0.26186818 0.22080088 0.14163066 -0.06775385 -0.04604878 0.04741033  835  LEU   A CA   
12043 C  C    . LEU   A  780 ? 0.27955899 0.23835751 0.16661714 -0.06586297 -0.04610135 0.04787649  835  LEU   A C    
12044 O  O    . LEU   A  780 ? 0.31662738 0.27994537 0.21109097 -0.06585575 -0.04339954 0.04576900  835  LEU   A O    
12045 C  CB   . LEU   A  780 ? 0.28031006 0.24366274 0.16354701 -0.06564132 -0.04987106 0.04571711  835  LEU   A CB   
12046 C  CG   . LEU   A  780 ? 0.26771837 0.23061870 0.14313662 -0.06739467 -0.05052510 0.04483459  835  LEU   A CG   
12047 C  CD1  . LEU   A  780 ? 0.29612088 0.26387903 0.17611589 -0.06608641 -0.05393576 0.04264798  835  LEU   A CD1  
12048 C  CD2  . LEU   A  780 ? 0.34532195 0.30085909 0.20863543 -0.06824170 -0.05306691 0.04823421  835  LEU   A CD2  
12049 H  H    . LEU   A  780 ? 0.26539370 0.23193994 0.15084946 -0.06959754 -0.04046483 0.04290617  835  LEU   A H    
12050 H  HA   . LEU   A  780 ? 0.28172916 0.23570061 0.15410841 -0.06865709 -0.04703277 0.04959803  835  LEU   A HA   
12051 H  HB2  . LEU   A  780 ? 0.26305586 0.23084119 0.15310377 -0.06512625 -0.04867236 0.04374866  835  LEU   A HB2  
12052 H  HB3  . LEU   A  780 ? 0.27282497 0.23497051 0.15681732 -0.06362285 -0.05328734 0.04705127  835  LEU   A HB3  
12053 H  HG   . LEU   A  780 ? 0.28566509 0.24954194 0.16013141 -0.06915304 -0.04687268 0.04341283  835  LEU   A HG   
12054 H  HD11 . LEU   A  780 ? 0.28930640 0.25674671 0.16459134 -0.06747355 -0.05371305 0.04148699  835  LEU   A HD11 
12055 H  HD12 . LEU   A  780 ? 0.28820580 0.25550616 0.16852149 -0.06445060 -0.05775757 0.04395746  835  LEU   A HD12 
12056 H  HD13 . LEU   A  780 ? 0.27785271 0.24946663 0.16508456 -0.06558400 -0.05259926 0.04104244  835  LEU   A HD13 
12057 H  HD21 . LEU   A  780 ? 0.32676253 0.27920574 0.18643001 -0.06993777 -0.05027162 0.04946913  835  LEU   A HD21 
12058 H  HD22 . LEU   A  780 ? 0.32586479 0.27989995 0.19020607 -0.06617111 -0.05671303 0.04984414  835  LEU   A HD22 
12059 H  HD23 . LEU   A  780 ? 0.32842124 0.28384668 0.18663424 -0.06918811 -0.05386603 0.04748132  835  LEU   A HD23 
12060 N  N    . ASP   A  781 ? 0.32015514 0.27397898 0.20534350 -0.06363172 -0.04987841 0.05032424  836  ASP   A N    
12061 C  CA   . ASP   A  781 ? 0.27774400 0.23089594 0.16937637 -0.06100513 -0.05064826 0.05040040  836  ASP   A CA   
12062 C  C    . ASP   A  781 ? 0.32502824 0.27969056 0.22038558 -0.05659009 -0.05575328 0.05055277  836  ASP   A C    
12063 O  O    . ASP   A  781 ? 0.32177413 0.27159762 0.21105954 -0.05526974 -0.05982549 0.05290521  836  ASP   A O    
12064 C  CB   . ASP   A  781 ? 0.29408491 0.23826222 0.17957340 -0.06253678 -0.04988358 0.05318122  836  ASP   A CB   
12065 C  CG   . ASP   A  781 ? 0.36804634 0.31117052 0.25967318 -0.06103633 -0.04905616 0.05244175  836  ASP   A CG   
12066 O  OD1  . ASP   A  781 ? 0.36023605 0.30879968 0.25806940 -0.06227886 -0.04550954 0.05000551  836  ASP   A OD1  
12067 O  OD2  . ASP   A  781 ? 0.36374798 0.30042824 0.25380051 -0.05836439 -0.05218349 0.05411220  836  ASP   A OD2  
12068 H  H    . ASP   A  781 ? 0.30862433 0.25905758 0.18798819 -0.06356478 -0.05219000 0.05193637  836  ASP   A H    
12069 H  HA   . ASP   A  781 ? 0.28709841 0.24459451 0.18453486 -0.06123885 -0.04830306 0.04844575  836  ASP   A HA   
12070 H  HB2  . ASP   A  781 ? 0.30954954 0.25309253 0.19148111 -0.06576820 -0.04696285 0.05339471  836  ASP   A HB2  
12071 H  HB3  . ASP   A  781 ? 0.31642783 0.25558954 0.19678588 -0.06151238 -0.05290323 0.05530768  836  ASP   A HB3  
12072 N  N    . PHE   A  782 ? 0.28461766 0.24632126 0.18991594 -0.05435176 -0.05558378 0.04807851  837  PHE   A N    
12073 C  CA   . PHE   A  782 ? 0.28172696 0.24773738 0.19270912 -0.05038707 -0.05976823 0.04752690  837  PHE   A CA   
12074 C  C    . PHE   A  782 ? 0.27113229 0.23498857 0.18633837 -0.04645993 -0.06097977 0.04773976  837  PHE   A C    
12075 O  O    . PHE   A  782 ? 0.28391933 0.24312356 0.19805628 -0.04719597 -0.05837102 0.04795802  837  PHE   A O    
12076 C  CB   . PHE   A  782 ? 0.27955592 0.25519872 0.19865747 -0.05088034 -0.05849903 0.04457803  837  PHE   A CB   
12077 C  CG   . PHE   A  782 ? 0.25642526 0.23388341 0.17192787 -0.05433248 -0.05737497 0.04370384  837  PHE   A CG   
12078 C  CD1  . PHE   A  782 ? 0.30022985 0.27900663 0.21284217 -0.05438476 -0.06116545 0.04390237  837  PHE   A CD1  
12079 C  CD2  . PHE   A  782 ? 0.21702316 0.19474116 0.13191572 -0.05730198 -0.05279832 0.04244567  837  PHE   A CD2  
12080 C  CE1  . PHE   A  782 ? 0.29163522 0.27127722 0.20025612 -0.05746543 -0.06010683 0.04263462  837  PHE   A CE1  
12081 C  CE2  . PHE   A  782 ? 0.30322501 0.28197679 0.21452913 -0.05990922 -0.05172568 0.04126012  837  PHE   A CE2  
12082 C  CZ   . PHE   A  782 ? 0.31560028 0.29509154 0.22365025 -0.06002422 -0.05525810 0.04120808  837  PHE   A CZ   
12083 H  H    . PHE   A  782 ? 0.28496948 0.24918365 0.19371399 -0.05541234 -0.05270900 0.04667995  837  PHE   A H    
12084 H  HA   . PHE   A  782 ? 0.28753474 0.25164267 0.19421363 -0.04994199 -0.06280925 0.04884817  837  PHE   A HA   
12085 H  HB2  . PHE   A  782 ? 0.26672292 0.24394986 0.18971144 -0.05110836 -0.05579893 0.04345484  837  PHE   A HB2  
12086 H  HB3  . PHE   A  782 ? 0.27256182 0.25182298 0.19582114 -0.04857673 -0.06117056 0.04418723  837  PHE   A HB3  
12087 H  HD1  . PHE   A  782 ? 0.29130033 0.27043912 0.20477775 -0.05218345 -0.06461877 0.04471331  837  PHE   A HD1  
12088 H  HD2  . PHE   A  782 ? 0.24034107 0.21732873 0.15708674 -0.05739515 -0.05054541 0.04230026  837  PHE   A HD2  
12089 H  HE1  . PHE   A  782 ? 0.30296624 0.28325358 0.20928295 -0.05762696 -0.06286293 0.04260898  837  PHE   A HE1  
12090 H  HE2  . PHE   A  782 ? 0.27644745 0.25560793 0.18787527 -0.06143903 -0.04873915 0.04025071  837  PHE   A HE2  
12091 H  HZ   . PHE   A  782 ? 0.30654591 0.28628850 0.21180423 -0.06173284 -0.05452941 0.04012613  837  PHE   A HZ   
12092 N  N    . TYR   A  783 ? 0.25263575 0.21973859 0.17241831 -0.04221489 -0.06517699 0.04754436  838  TYR   A N    
12093 C  CA   . TYR   A  783 ? 0.27964824 0.24606702 0.20464481 -0.03747649 -0.06653181 0.04700628  838  TYR   A CA   
12094 C  C    . TYR   A  783 ? 0.33442962 0.28867662 0.25209323 -0.03615249 -0.06781202 0.04950403  838  TYR   A C    
12095 O  O    . TYR   A  783 ? 0.33450046 0.28569776 0.25454056 -0.03418990 -0.06651709 0.04859945  838  TYR   A O    
12096 C  CB   . TYR   A  783 ? 0.30972996 0.28236073 0.24295560 -0.03753331 -0.06227560 0.04400040  838  TYR   A CB   
12097 C  CG   . TYR   A  783 ? 0.30223641 0.28609756 0.24283361 -0.03895201 -0.06091029 0.04167845  838  TYR   A CG   
12098 C  CD1  . TYR   A  783 ? 0.38583151 0.37780866 0.33341491 -0.03620118 -0.06390099 0.04062337  838  TYR   A CD1  
12099 C  CD2  . TYR   A  783 ? 0.40354860 0.38978618 0.34443194 -0.04302849 -0.05675091 0.04052842  838  TYR   A CD2  
12100 C  CE1  . TYR   A  783 ? 0.41593695 0.41767374 0.37000728 -0.03828047 -0.06257502 0.03865540  838  TYR   A CE1  
12101 C  CE2  . TYR   A  783 ? 0.37325102 0.36808535 0.31986862 -0.04462012 -0.05569959 0.03869587  838  TYR   A CE2  
12102 C  CZ   . TYR   A  783 ? 0.33394170 0.33630681 0.28694281 -0.04259466 -0.05848780 0.03782390  838  TYR   A CZ   
12103 O  OH   . TYR   A  783 ? 0.28170189 0.29193902 0.24005181 -0.04497135 -0.05721657 0.03614748  838  TYR   A OH   
12104 H  H    . TYR   A  783 ? 0.26369864 0.23385280 0.18352345 -0.04216538 -0.06735918 0.04756378  838  TYR   A H    
12105 H  HA   . TYR   A  783 ? 0.28907585 0.25930941 0.21751115 -0.03468521 -0.06975596 0.04677436  838  TYR   A HA   
12106 H  HB2  . TYR   A  783 ? 0.29994375 0.26899382 0.23014539 -0.04004742 -0.05946233 0.04417351  838  TYR   A HB2  
12107 H  HB3  . TYR   A  783 ? 0.30189589 0.27422404 0.23834999 -0.03414310 -0.06317399 0.04338125  838  TYR   A HB3  
12108 H  HD1  . TYR   A  783 ? 0.37503782 0.36590534 0.32304668 -0.03297251 -0.06701895 0.04128415  838  TYR   A HD1  
12109 H  HD2  . TYR   A  783 ? 0.36758909 0.34929305 0.30450723 -0.04487522 -0.05476562 0.04108296  838  TYR   A HD2  
12110 H  HE1  . TYR   A  783 ? 0.38405952 0.39178568 0.34320229 -0.03678774 -0.06461559 0.03794023  838  TYR   A HE1  
12111 H  HE2  . TYR   A  783 ? 0.35948139 0.35503751 0.30582738 -0.04713632 -0.05314694 0.03804055  838  TYR   A HE2  
12113 N  N    . ARG   A  784 ? 0.30960265 0.25628912 0.21760073 -0.03740059 -0.07054083 0.05268186  839  ARG   A N    
12114 C  CA   . ARG   A  784 ? 0.37077856 0.30438262 0.26969814 -0.03745545 -0.07173349 0.05575541  839  ARG   A CA   
12115 C  C    . ARG   A  784 ? 0.37309688 0.30157256 0.27269018 -0.03111926 -0.07715253 0.05679696  839  ARG   A C    
12116 O  O    . ARG   A  784 ? 0.42705500 0.34432709 0.32114637 -0.03025568 -0.07794865 0.05860398  839  ARG   A O    
12117 C  CB   . ARG   A  784 ? 0.37292892 0.30068094 0.26015443 -0.04190104 -0.07215550 0.05892751  839  ARG   A CB   
12118 C  CG   . ARG   A  784 ? 0.37806338 0.30971909 0.26455230 -0.04762988 -0.06640410 0.05767323  839  ARG   A CG   
12119 C  CD   . ARG   A  784 ? 0.47575760 0.40165216 0.35063171 -0.05222838 -0.06559227 0.06037924  839  ARG   A CD   
12120 N  NE   . ARG   A  784 ? 0.39490157 0.30819517 0.26025343 -0.05346278 -0.06644960 0.06403898  839  ARG   A NE   
12121 C  CZ   . ARG   A  784 ? 0.38588601 0.29426602 0.24687070 -0.05817997 -0.06214131 0.06500068  839  ARG   A CZ   
12122 N  NH1  . ARG   A  784 ? 0.37028855 0.28521806 0.23758991 -0.06083797 -0.05699189 0.06222722  839  ARG   A NH1  
12123 N  NH2  . ARG   A  784 ? 0.37554741 0.27190089 0.22580984 -0.06023345 -0.06333228 0.06893679  839  ARG   A NH2  
12124 H  H    . ARG   A  784 ? 0.32754004 0.27699372 0.23405863 -0.03845457 -0.07178020 0.05300967  839  ARG   A H    
12125 H  HA   . ARG   A  784 ? 0.35570276 0.28720737 0.25503123 -0.03909373 -0.06853682 0.05508961  839  ARG   A HA   
12126 H  HB2  . ARG   A  784 ? 0.37863344 0.30912367 0.26536900 -0.04066804 -0.07519894 0.05929325  839  ARG   A HB2  
12127 H  HB3  . ARG   A  784 ? 0.38666385 0.30525964 0.26722822 -0.04210402 -0.07329809 0.06136182  839  ARG   A HB3  
12128 H  HG2  . ARG   A  784 ? 0.38972276 0.32012847 0.27816400 -0.04859991 -0.06360848 0.05693627  839  ARG   A HG2  
12129 H  HG3  . ARG   A  784 ? 0.38432738 0.32407439 0.27640110 -0.04747584 -0.06570414 0.05552728  839  ARG   A HG3  
12130 H  HD2  . ARG   A  784 ? 0.42127213 0.35064667 0.29689595 -0.05544328 -0.06167680 0.05910131  839  ARG   A HD2  
12131 H  HD3  . ARG   A  784 ? 0.43111897 0.35848805 0.30374080 -0.05144668 -0.06833670 0.06087560  839  ARG   A HD3  
12132 H  HE   . ARG   A  784 ? 0.41725564 0.32576787 0.27952376 -0.05104035 -0.07018899 0.06578995  839  ARG   A HE   
12133 H  HH11 . ARG   A  784 ? 0.36433503 0.28428820 0.23899111 -0.05883939 -0.05660416 0.05998902  839  ARG   A HH11 
12134 H  HH12 . ARG   A  784 ? 0.37269747 0.28705859 0.23681138 -0.06457754 -0.05400313 0.06263806  839  ARG   A HH12 
12135 H  HH21 . ARG   A  784 ? 0.38509634 0.27834380 0.23292580 -0.06357398 -0.06050582 0.06956573  839  ARG   A HH21 
12136 H  HH22 . ARG   A  784 ? 0.39151913 0.28292996 0.23703285 -0.05837305 -0.06703214 0.07098518  839  ARG   A HH22 
12137 N  N    . LYS   A  785 ? 0.42375171 0.36033750 0.33024964 -0.02667791 -0.08105720 0.05558145  840  LYS   A N    
12138 C  CA   . LYS   A  785 ? 0.49567860 0.42893773 0.40443256 -0.01976212 -0.08640901 0.05608674  840  LYS   A CA   
12139 C  C    . LYS   A  785 ? 0.42334142 0.36931729 0.34627846 -0.01501074 -0.08625996 0.05203098  840  LYS   A C    
12140 O  O    . LYS   A  785 ? 0.47549117 0.43192428 0.40487069 -0.01352179 -0.08874886 0.05092374  840  LYS   A O    
12141 C  CB   . LYS   A  785 ? 0.53167945 0.46074808 0.43347746 -0.01809884 -0.09295550 0.05939841  840  LYS   A CB   
12142 C  CG   . LYS   A  785 ? 0.69674110 0.61735886 0.59730089 -0.01103681 -0.09893977 0.06102616  840  LYS   A CG   
12143 C  CD   . LYS   A  785 ? 0.91584802 0.83268785 0.80993140 -0.00863436 -0.10634967 0.06435347  840  LYS   A CD   
12144 C  CE   . LYS   A  785 ? 1.04918110 0.95745903 0.94293332 -0.00084146 -0.11242043 0.06571452  840  LYS   A CE   
12145 N  NZ   . LYS   A  785 ? 1.17581236 1.08040619 1.06332994 0.00208525  -0.12048359 0.06910343  840  LYS   A NZ   
12146 H  H    . LYS   A  785 ? 0.41472411 0.35907406 0.32475159 -0.02793137 -0.08048834 0.05435173  840  LYS   A H    
12147 H  HA   . LYS   A  785 ? 0.47863302 0.40329441 0.38373041 -0.01913175 -0.08596829 0.05694902  840  LYS   A HA   
12148 H  HB2  . LYS   A  785 ? 0.55991119 0.48263547 0.45267141 -0.02209749 -0.09219428 0.06173283  840  LYS   A HB2  
12149 H  HB3  . LYS   A  785 ? 0.54921168 0.48724633 0.45592493 -0.01770505 -0.09425069 0.05817398  840  LYS   A HB3  
12150 H  HG2  . LYS   A  785 ? 0.68879825 0.61604148 0.59870756 -0.00694547 -0.09914269 0.05836547  840  LYS   A HG2  
12151 H  HG3  . LYS   A  785 ? 0.70100397 0.61159134 0.59573603 -0.01186166 -0.09781183 0.06242094  840  LYS   A HG3  
12152 H  HD2  . LYS   A  785 ? 0.89119452 0.80092180 0.77515012 -0.01273419 -0.10603438 0.06708741  840  LYS   A HD2  
12153 H  HD3  . LYS   A  785 ? 0.87952685 0.80646098 0.77946156 -0.00805849 -0.10770468 0.06287819  840  LYS   A HD3  
12154 H  HE2  . LYS   A  785 ? 1.03902709 0.95476949 0.94306147 0.00335440  -0.11233250 0.06271597  840  LYS   A HE2  
12155 H  HE3  . LYS   A  785 ? 1.05141532 0.94877166 0.93875664 -0.00170519 -0.11124291 0.06726148  840  LYS   A HE3  
12156 H  HZ1  . LYS   A  785 ? 1.13326621 1.04803479 1.02661824 0.00254438  -0.12174124 0.06763083  840  LYS   A HZ1  
12157 H  HZ2  . LYS   A  785 ? 1.14570999 1.04261363 1.02283919 -0.00174036 -0.12054259 0.07201494  840  LYS   A HZ2  
12158 H  HZ3  . LYS   A  785 ? 1.14697707 1.04671848 1.03499937 0.00724030  -0.12427571 0.06974407  840  LYS   A HZ3  
12159 N  N    . THR   A  786 ? 0.46967921 0.41478047 0.39717019 -0.01304780 -0.08311636 0.04970400  841  THR   A N    
12160 C  CA   . THR   A  786 ? 0.39572138 0.35197145 0.33583173 -0.00833358 -0.08236043 0.04576414  841  THR   A CA   
12161 C  C    . THR   A  786 ? 0.43795562 0.38632774 0.37854910 -0.00266333 -0.08318771 0.04472468  841  THR   A C    
12162 O  O    . THR   A  786 ? 0.44179577 0.37596619 0.37306494 -0.00344975 -0.08367599 0.04692687  841  THR   A O    
12163 C  CB   . THR   A  786 ? 0.44059914 0.40684599 0.38687935 -0.01264473 -0.07603754 0.04277160  841  THR   A CB   
12164 O  OG1  . THR   A  786 ? 0.31800491 0.27612379 0.25944251 -0.01538345 -0.07183550 0.04254911  841  THR   A OG1  
12165 C  CG2  . THR   A  786 ? 0.36696196 0.33991927 0.31244639 -0.01825773 -0.07506699 0.04346418  841  THR   A CG2  
12166 H  H    . THR   A  786 ? 0.44462812 0.38203868 0.36701906 -0.01489909 -0.08126196 0.05051110  841  THR   A H    
12167 H  HA   . THR   A  786 ? 0.42452931 0.38698071 0.36884335 -0.00588324 -0.08558244 0.04561719  841  THR   A HA   
12168 H  HB   . THR   A  786 ? 0.38566181 0.35969251 0.34008059 -0.00959630 -0.07562108 0.04030772  841  THR   A HB   
12170 H  HG21 . THR   A  786 ? 0.37647790 0.35546407 0.32618493 -0.02042821 -0.07146370 0.04157903  841  THR   A HG21 
12171 H  HG22 . THR   A  786 ? 0.38842702 0.35444561 0.32607904 -0.02135846 -0.07491046 0.04558556  841  THR   A HG22 
12172 H  HG23 . THR   A  786 ? 0.38547876 0.36343578 0.33390757 -0.01654442 -0.07827497 0.04358475  841  THR   A HG23 
12173 N  N    . SER   A  787 ? 0.50566113 0.46370840 0.45735449 0.00274097  -0.08295557 0.04106570  842  SER   A N    
12174 C  CA   . SER   A  787 ? 0.56094599 0.51339918 0.51457572 0.00871623  -0.08308330 0.03890971  842  SER   A CA   
12175 C  C    . SER   A  787 ? 0.42133152 0.37319255 0.37526226 0.00566519  -0.07667327 0.03618938  842  SER   A C    
12176 O  O    . SER   A  787 ? 0.45081168 0.39852786 0.40628594 0.01018384  -0.07600656 0.03366539  842  SER   A O    
12177 C  CB   . SER   A  787 ? 0.54904354 0.51339012 0.51494473 0.01631052  -0.08559874 0.03584210  842  SER   A CB   
12178 O  OG   . SER   A  787 ? 0.51353663 0.49471703 0.48916104 0.01353334  -0.08181272 0.03323810  842  SER   A OG   
12179 H  H    . SER   A  787 ? 0.48862159 0.45728824 0.44693536 0.00264488  -0.08261247 0.03972555  842  SER   A H    
12180 H  HA   . SER   A  787 ? 0.53004837 0.47079062 0.47641805 0.01000505  -0.08603542 0.04122154  842  SER   A HA   
12181 H  HB2  . SER   A  787 ? 0.54875970 0.51012468 0.51646179 0.02050177  -0.08507754 0.03380183  842  SER   A HB2  
12182 H  HB3  . SER   A  787 ? 0.55169225 0.51490551 0.51683187 0.01890373  -0.09044614 0.03768137  842  SER   A HB3  
12184 N  N    . ARG   A  788 ? 0.48508132 0.44022176 0.43691629 -0.00168952 -0.07238536 0.03666959  843  ARG   A N    
12185 C  CA   . ARG   A  788 ? 0.46858275 0.42336389 0.42015541 -0.00507576 -0.06677977 0.03440905  843  ARG   A CA   
12186 C  C    . ARG   A  788 ? 0.44168335 0.38228393 0.38229305 -0.00972526 -0.06599766 0.03690183  843  ARG   A C    
12187 O  O    . ARG   A  788 ? 0.45661253 0.39026159 0.38986045 -0.01240628 -0.06840380 0.04062489  843  ARG   A O    
12188 C  CB   . ARG   A  788 ? 0.39119095 0.35855410 0.34772095 -0.01024260 -0.06249150 0.03320842  843  ARG   A CB   
12189 C  CG   . ARG   A  788 ? 0.43536633 0.41755903 0.40157276 -0.00859175 -0.06337027 0.03194831  843  ARG   A CG   
12190 C  CD   . ARG   A  788 ? 0.36967900 0.35890356 0.34499115 -0.00163123 -0.06400824 0.02866389  843  ARG   A CD   
12191 N  NE   . ARG   A  788 ? 0.49304670 0.48313802 0.47031480 -0.00105235 -0.05922640 0.02528948  843  ARG   A NE   
12192 C  CZ   . ARG   A  788 ? 0.43762869 0.43017292 0.42028835 0.00513733  -0.05873197 0.02190430  843  ARG   A CZ   
12193 N  NH1  . ARG   A  788 ? 0.62095493 0.61527753 0.60845053 0.01198356  -0.06293797 0.02135118  843  ARG   A NH1  
12194 N  NH2  . ARG   A  788 ? 0.43438494 0.42742994 0.41730735 0.00469274  -0.05403421 0.01885311  843  ARG   A NH2  
12195 H  H    . ARG   A  788 ? 0.46136650 0.41905987 0.41183370 -0.00456993 -0.07312516 0.03836971  843  ARG   A H    
12196 H  HA   . ARG   A  788 ? 0.45320576 0.40873682 0.40841368 -0.00116781 -0.06614719 0.03187686  843  ARG   A HA   
12197 H  HB2  . ARG   A  788 ? 0.41463631 0.37897962 0.36618358 -0.01460992 -0.06212005 0.03528623  843  ARG   A HB2  
12198 H  HB3  . ARG   A  788 ? 0.41313550 0.38159472 0.37102664 -0.01090386 -0.05925432 0.03115868  843  ARG   A HB3  
12199 H  HG2  . ARG   A  788 ? 0.40917560 0.39066842 0.37359011 -0.00875303 -0.06655339 0.03401523  843  ARG   A HG2  
12200 H  HG3  . ARG   A  788 ? 0.39902857 0.38730353 0.36733189 -0.01221641 -0.06036654 0.03120798  843  ARG   A HG3  
12201 H  HD2  . ARG   A  788 ? 0.42007911 0.40334859 0.39362952 0.00243818  -0.06747124 0.02941385  843  ARG   A HD2  
12202 H  HD3  . ARG   A  788 ? 0.40568340 0.40502840 0.38739994 -0.00139342 -0.06437732 0.02796618  843  ARG   A HD3  
12203 H  HE   . ARG   A  788 ? 0.44106984 0.43006355 0.41563576 -0.00496858 -0.05650143 0.02537580  843  ARG   A HE   
12204 H  HH11 . ARG   A  788 ? 0.55294317 0.55130225 0.54277414 0.01226916  -0.06560724 0.02269880  843  ARG   A HH11 
12205 H  HH12 . ARG   A  788 ? 0.55972892 0.55118829 0.54813355 0.01639281  -0.06319974 0.01953216  843  ARG   A HH12 
12206 H  HH21 . ARG   A  788 ? 0.43964028 0.43457884 0.42597586 0.00880150  -0.05340559 0.01633663  843  ARG   A HH21 
12207 H  HH22 . ARG   A  788 ? 0.43205407 0.42356929 0.41162679 0.00039278  -0.05162365 0.01927358  843  ARG   A HH22 
12208 N  N    . SER   A  789 ? 0.45371687 0.39056009 0.39319208 -0.01106479 -0.06249082 0.03474461  844  SER   A N    
12209 C  CA   . SER   A  789 ? 0.49365062 0.41898593 0.42420051 -0.01629541 -0.06121150 0.03658353  844  SER   A CA   
12210 C  C    . SER   A  789 ? 0.39784265 0.32796168 0.32657719 -0.02353100 -0.05843863 0.03830628  844  SER   A C    
12211 O  O    . SER   A  789 ? 0.42608446 0.36814603 0.36091036 -0.02475059 -0.05621720 0.03689846  844  SER   A O    
12212 C  CB   . SER   A  789 ? 0.44032973 0.36232209 0.37117019 -0.01597070 -0.05829704 0.03322079  844  SER   A CB   
12213 O  OG   . SER   A  789 ? 0.35995972 0.29294139 0.29565167 -0.01930390 -0.05392670 0.03107584  844  SER   A OG   
12214 H  H    . SER   A  789 ? 0.45477188 0.39671987 0.39925945 -0.00879488 -0.06082371 0.03194550  844  SER   A H    
12215 H  HA   . SER   A  789 ? 0.46789366 0.38401008 0.39300758 -0.01541323 -0.06414610 0.03883839  844  SER   A HA   
12216 H  HB2  . SER   A  789 ? 0.43945286 0.35208291 0.36418691 -0.01859956 -0.05844348 0.03446665  844  SER   A HB2  
12217 H  HB3  . SER   A  789 ? 0.43702096 0.35844243 0.37053621 -0.01086984 -0.05940993 0.03126127  844  SER   A HB3  
12219 N  N    . TYR   A  790 ? 0.32746673 0.24811873 0.24783590 -0.02835903 -0.05843104 0.04122475  845  TYR   A N    
12220 C  CA   . TYR   A  790 ? 0.44961613 0.37468782 0.36824179 -0.03460699 -0.05590316 0.04271103  845  TYR   A CA   
12221 C  C    . TYR   A  790 ? 0.39127707 0.32414997 0.31471491 -0.03750274 -0.05150016 0.03989888  845  TYR   A C    
12222 O  O    . TYR   A  790 ? 0.37500304 0.31652802 0.30130991 -0.04017100 -0.04956834 0.03971165  845  TYR   A O    
12223 C  CB   . TYR   A  790 ? 0.38871676 0.30269873 0.29779246 -0.03911531 -0.05639144 0.04618165  845  TYR   A CB   
12224 C  CG   . TYR   A  790 ? 0.37428591 0.29286522 0.28129512 -0.04520024 -0.05366866 0.04760298  845  TYR   A CG   
12225 C  CD1  . TYR   A  790 ? 0.42311934 0.35022184 0.33232510 -0.04522239 -0.05395439 0.04795744  845  TYR   A CD1  
12226 C  CD2  . TYR   A  790 ? 0.41745138 0.33161110 0.32016584 -0.05090007 -0.05098620 0.04848238  845  TYR   A CD2  
12227 C  CE1  . TYR   A  790 ? 0.40513891 0.33576828 0.31196794 -0.05033696 -0.05139023 0.04887163  845  TYR   A CE1  
12228 C  CE2  . TYR   A  790 ? 0.37600803 0.29498443 0.27739277 -0.05594957 -0.04826558 0.04940112  845  TYR   A CE2  
12229 C  CZ   . TYR   A  790 ? 0.45933512 0.38624191 0.36256775 -0.05541851 -0.04838318 0.04948390  845  TYR   A CZ   
12230 O  OH   . TYR   A  790 ? 0.35849908 0.28934434 0.26004806 -0.06011539 -0.04546125 0.04995375  845  TYR   A OH   
12231 H  H    . TYR   A  790 ? 0.37850773 0.28988397 0.29427022 -0.02774698 -0.05993134 0.04220851  845  TYR   A H    
12232 H  HA   . TYR   A  790 ? 0.39444378 0.32508972 0.31498277 -0.03392543 -0.05692378 0.04331621  845  TYR   A HA   
12233 H  HB2  . TYR   A  790 ? 0.40897912 0.31762037 0.31452388 -0.03704870 -0.05945866 0.04812311  845  TYR   A HB2  
12234 H  HB3  . TYR   A  790 ? 0.40493807 0.31322834 0.31218180 -0.04008809 -0.05557335 0.04559065  845  TYR   A HB3  
12235 H  HD1  . TYR   A  790 ? 0.40495706 0.33559763 0.31740728 -0.04173017 -0.05590449 0.04738707  845  TYR   A HD1  
12236 H  HD2  . TYR   A  790 ? 0.40359408 0.31176621 0.30465353 -0.05131768 -0.05094308 0.04819669  845  TYR   A HD2  
12237 H  HE1  . TYR   A  790 ? 0.41523981 0.35111091 0.32329381 -0.05029530 -0.05164155 0.04882069  845  TYR   A HE1  
12238 H  HE2  . TYR   A  790 ? 0.40369135 0.32065716 0.30305177 -0.05972157 -0.04634344 0.04978253  845  TYR   A HE2  
12240 N  N    . SER   A  791 ? 0.35573828 0.28502405 0.27966475 -0.03669734 -0.05024718 0.03760788  846  SER   A N    
12241 C  CA   . SER   A  791 ? 0.38485974 0.32115075 0.31294295 -0.03868477 -0.04669218 0.03484665  846  SER   A CA   
12242 C  C    . SER   A  791 ? 0.30244851 0.25112808 0.23805673 -0.03637807 -0.04556555 0.03295289  846  SER   A C    
12243 O  O    . SER   A  791 ? 0.31430751 0.27022243 0.25235596 -0.03955638 -0.04312471 0.03246910  846  SER   A O    
12244 C  CB   . SER   A  791 ? 0.38057435 0.31055385 0.30750918 -0.03712063 -0.04619759 0.03225853  846  SER   A CB   
12245 O  OG   . SER   A  791 ? 0.76291877 0.68186778 0.68306315 -0.04072166 -0.04683175 0.03391163  846  SER   A OG   
12246 H  H    . SER   A  791 ? 0.38097939 0.30283257 0.30216193 -0.03484161 -0.05180688 0.03775126  846  SER   A H    
12247 H  HA   . SER   A  791 ? 0.35763323 0.29446399 0.28401247 -0.04288008 -0.04528962 0.03581642  846  SER   A HA   
12248 H  HB2  . SER   A  791 ? 0.45163062 0.38017422 0.37982512 -0.03269224 -0.04762843 0.03124267  846  SER   A HB2  
12249 H  HB3  . SER   A  791 ? 0.44213927 0.37716028 0.37167799 -0.03810086 -0.04404955 0.03036563  846  SER   A HB3  
12251 N  N    . GLU   A  792 ? 0.33595964 0.28695014 0.27546248 -0.03080548 -0.04728477 0.03167470  847  GLU   A N    
12252 C  CA   . GLU   A  792 ? 0.38704675 0.35027993 0.33410251 -0.02895731 -0.04634486 0.03008584  847  GLU   A CA   
12253 C  C    . GLU   A  792 ? 0.35611328 0.32515997 0.30390096 -0.03215220 -0.04677749 0.03221755  847  GLU   A C    
12254 O  O    . GLU   A  792 ? 0.38027084 0.35774556 0.33190367 -0.03437765 -0.04450381 0.03128658  847  GLU   A O    
12255 C  CB   . GLU   A  792 ? 0.36856654 0.33393028 0.32020426 -0.02242129 -0.04859007 0.02864233  847  GLU   A CB   
12256 C  CG   . GLU   A  792 ? 0.48185718 0.46091157 0.44226211 -0.02090016 -0.04660267 0.02620419  847  GLU   A CG   
12257 C  CD   . GLU   A  792 ? 0.55927247 0.54375446 0.52609634 -0.01480894 -0.04922094 0.02512981  847  GLU   A CD   
12258 O  OE1  . GLU   A  792 ? 0.49851030 0.47896352 0.46593472 -0.00964437 -0.04989378 0.02311602  847  GLU   A OE1  
12259 O  OE2  . GLU   A  792 ? 0.58326060 0.57584804 0.55459821 -0.01499650 -0.05085067 0.02610327  847  GLU   A OE2  
12260 H  H    . GLU   A  792 ? 0.34775880 0.29265150 0.28533220 -0.02815847 -0.04908998 0.03176149  847  GLU   A H    
12261 H  HA   . GLU   A  792 ? 0.36153162 0.32825655 0.31038111 -0.03000704 -0.04381494 0.02831488  847  GLU   A HA   
12262 H  HB2  . GLU   A  792 ? 0.40248397 0.36234185 0.35255483 -0.02018576 -0.04864742 0.02737125  847  GLU   A HB2  
12263 H  HB3  . GLU   A  792 ? 0.40086186 0.36401314 0.35123637 -0.02131508 -0.05142009 0.03051940  847  GLU   A HB3  
12264 H  HG2  . GLU   A  792 ? 0.45820749 0.44194138 0.41948235 -0.02408816 -0.04596044 0.02723119  847  GLU   A HG2  
12265 H  HG3  . GLU   A  792 ? 0.46273810 0.44304457 0.42393789 -0.02100805 -0.04404263 0.02415962  847  GLU   A HG3  
12266 N  N    . ILE   A  793 ? 0.32668617 0.29029828 0.26987532 -0.03252267 -0.04976121 0.03508630  848  ILE   A N    
12267 C  CA   . ILE   A  793 ? 0.31667608 0.28420532 0.25892675 -0.03557350 -0.05037121 0.03695150  848  ILE   A CA   
12268 C  C    . ILE   A  793 ? 0.31130517 0.28002605 0.25160909 -0.04102844 -0.04699504 0.03703991  848  ILE   A C    
12269 O  O    . ILE   A  793 ? 0.26695788 0.24260467 0.20983963 -0.04304286 -0.04596420 0.03670326  848  ILE   A O    
12270 C  CB   . ILE   A  793 ? 0.33187008 0.29161000 0.26762927 -0.03494420 -0.05422995 0.04010174  848  ILE   A CB   
12271 C  CG1  . ILE   A  793 ? 0.27668041 0.23783168 0.21595883 -0.02896076 -0.05840109 0.03996203  848  ILE   A CG1  
12272 C  CG2  . ILE   A  793 ? 0.36004797 0.32143146 0.29219568 -0.03896150 -0.05428394 0.04196533  848  ILE   A CG2  
12273 C  CD1  . ILE   A  793 ? 0.29447290 0.26899391 0.24259216 -0.02756408 -0.05878353 0.03819511  848  ILE   A CD1  
12274 H  H    . ILE   A  793 ? 0.34013098 0.29692304 0.28018028 -0.03081531 -0.05151961 0.03586903  848  ILE   A H    
12275 H  HA   . ILE   A  793 ? 0.31462017 0.28930467 0.26176637 -0.03430020 -0.05067405 0.03600612  848  ILE   A HA   
12276 H  HB   . ILE   A  793 ? 0.32890567 0.28086984 0.26005632 -0.03565928 -0.05412467 0.04097842  848  ILE   A HB   
12277 H  HG12 . ILE   A  793 ? 0.29737988 0.25592560 0.23795000 -0.02613019 -0.05838051 0.03875902  848  ILE   A HG12 
12278 H  HG13 . ILE   A  793 ? 0.30191207 0.25771958 0.23639312 -0.02869492 -0.06110972 0.04219126  848  ILE   A HG13 
12279 H  HG21 . ILE   A  793 ? 0.34378237 0.31254789 0.28028119 -0.03917147 -0.05380107 0.04084770  848  ILE   A HG21 
12280 H  HG22 . ILE   A  793 ? 0.34929940 0.30815032 0.27831751 -0.04227947 -0.05209895 0.04237713  848  ILE   A HG22 
12281 H  HG23 . ILE   A  793 ? 0.35560194 0.31310934 0.28399110 -0.03806988 -0.05703025 0.04380751  848  ILE   A HG23 
12282 H  HD11 . ILE   A  793 ? 0.28249037 0.26187086 0.23537815 -0.02708767 -0.05640302 0.03604204  848  ILE   A HD11 
12283 H  HD12 . ILE   A  793 ? 0.28418750 0.26123422 0.23110937 -0.03074536 -0.05832400 0.03893344  848  ILE   A HD12 
12284 H  HD13 . ILE   A  793 ? 0.29095268 0.26628631 0.24085683 -0.02408953 -0.06192309 0.03847952  848  ILE   A HD13 
12285 N  N    . LEU   A  794 ? 0.28652373 0.24851838 0.22257364 -0.04338949 -0.04543066 0.03732846  849  LEU   A N    
12286 C  CA   . LEU   A  794 ? 0.28356683 0.24800991 0.21928704 -0.04785275 -0.04238101 0.03694432  849  LEU   A CA   
12287 C  C    . LEU   A  794 ? 0.26432410 0.23712569 0.20594475 -0.04769896 -0.04023256 0.03455957  849  LEU   A C    
12288 O  O    . LEU   A  794 ? 0.27983585 0.25748038 0.22272037 -0.05024458 -0.03881754 0.03446390  849  LEU   A O    
12289 C  CB   . LEU   A  794 ? 0.26409185 0.22092836 0.19546725 -0.05038122 -0.04130596 0.03729353  849  LEU   A CB   
12290 C  CG   . LEU   A  794 ? 0.30214760 0.25061381 0.22669986 -0.05236948 -0.04259212 0.04008846  849  LEU   A CG   
12291 C  CD1  . LEU   A  794 ? 0.37630832 0.31862539 0.29757935 -0.05599576 -0.04109761 0.04018920  849  LEU   A CD1  
12292 C  CD2  . LEU   A  794 ? 0.31685567 0.26839244 0.23924816 -0.05505935 -0.04219203 0.04178780  849  LEU   A CD2  
12293 H  H    . LEU   A  794 ? 0.29938757 0.25529909 0.23289761 -0.04221142 -0.04642206 0.03771921  849  LEU   A H    
12294 H  HA   . LEU   A  794 ? 0.27605751 0.24156025 0.21017972 -0.04962491 -0.04252656 0.03811859  849  LEU   A HA   
12295 H  HB2  . LEU   A  794 ? 0.27810144 0.23274940 0.21024626 -0.04843455 -0.04153468 0.03610122  849  LEU   A HB2  
12296 H  HB3  . LEU   A  794 ? 0.27143028 0.23112577 0.20377403 -0.05285135 -0.03941258 0.03667244  849  LEU   A HB3  
12297 H  HG   . LEU   A  794 ? 0.31578884 0.26024598 0.23891158 -0.04966631 -0.04481012 0.04078351  849  LEU   A HG   
12298 H  HD11 . LEU   A  794 ? 0.36045802 0.29685807 0.27703980 -0.05739087 -0.04191704 0.04214775  849  LEU   A HD11 
12299 H  HD12 . LEU   A  794 ? 0.34856784 0.29507148 0.27137455 -0.05858086 -0.03915636 0.03962199  849  LEU   A HD12 
12300 H  HD13 . LEU   A  794 ? 0.35496983 0.29514384 0.27725574 -0.05437319 -0.04135603 0.03880659  849  LEU   A HD13 
12301 H  HD21 . LEU   A  794 ? 0.31173301 0.26517507 0.23482725 -0.05296301 -0.04387816 0.04213867  849  LEU   A HD21 
12302 H  HD22 . LEU   A  794 ? 0.30581897 0.26240391 0.23071341 -0.05674200 -0.04025693 0.04073319  849  LEU   A HD22 
12303 H  HD23 . LEU   A  794 ? 0.31769913 0.26412249 0.23532012 -0.05720726 -0.04222739 0.04349114  849  LEU   A HD23 
12304 N  N    . THR   A  795 ? 0.30722439 0.28162360 0.25218147 -0.04454058 -0.04001416 0.03260950  850  THR   A N    
12305 C  CA   . THR   A  795 ? 0.25375241 0.23580936 0.20341693 -0.04465719 -0.03781608 0.03061995  850  THR   A CA   
12306 C  C    . THR   A  795 ? 0.26294297 0.25271869 0.21651636 -0.04495911 -0.03821793 0.03096437  850  THR   A C    
12307 O  O    . THR   A  795 ? 0.23681578 0.23100424 0.19176847 -0.04756921 -0.03658614 0.03068849  850  THR   A O    
12308 C  CB   . THR   A  795 ? 0.33502987 0.31719571 0.28683454 -0.04105620 -0.03727207 0.02832280  850  THR   A CB   
12309 O  OG1  . THR   A  795 ? 0.34465808 0.31838351 0.29194826 -0.04133434 -0.03723560 0.02792077  850  THR   A OG1  
12310 C  CG2  . THR   A  795 ? 0.38656181 0.37618113 0.34210622 -0.04152576 -0.03461739 0.02639727  850  THR   A CG2  
12311 H  H    . THR   A  795 ? 0.29048601 0.26094279 0.23447572 -0.04230307 -0.04116227 0.03249305  850  THR   A H    
12312 H  HA   . THR   A  795 ? 0.27541760 0.25707734 0.22383186 -0.04714622 -0.03639963 0.03049454  850  THR   A HA   
12313 H  HB   . THR   A  795 ? 0.33033919 0.31314838 0.28387749 -0.03819639 -0.03880542 0.02832950  850  THR   A HB   
12315 H  HG21 . THR   A  795 ? 0.37089285 0.36003798 0.32695103 -0.03942128 -0.03391925 0.02473210  850  THR   A HG21 
12316 H  HG22 . THR   A  795 ? 0.36678863 0.35603806 0.32068664 -0.04426884 -0.03352254 0.02664342  850  THR   A HG22 
12317 H  HG23 . THR   A  795 ? 0.36511397 0.36028320 0.32399878 -0.04126115 -0.03473179 0.02655000  850  THR   A HG23 
12318 N  N    . LEU   A  796 ? 0.22719446 0.21801308 0.18227744 -0.04231427 -0.04081672 0.03162115  851  LEU   A N    
12319 C  CA   . LEU   A  796 ? 0.24757180 0.24557573 0.20644809 -0.04269382 -0.04189850 0.03185209  851  LEU   A CA   
12320 C  C    . LEU   A  796 ? 0.26000404 0.25731328 0.21558978 -0.04669719 -0.04171012 0.03315455  851  LEU   A C    
12321 O  O    . LEU   A  796 ? 0.25955802 0.26218230 0.21767384 -0.04875939 -0.04081686 0.03262852  851  LEU   A O    
12322 C  CB   . LEU   A  796 ? 0.26456666 0.26221955 0.22450365 -0.03895851 -0.04561470 0.03259350  851  LEU   A CB   
12323 C  CG   . LEU   A  796 ? 0.27120706 0.27650094 0.23547885 -0.03897357 -0.04770869 0.03271086  851  LEU   A CG   
12324 C  CD1  . LEU   A  796 ? 0.28023970 0.29577214 0.25289229 -0.03801527 -0.04605360 0.03046012  851  LEU   A CD1  
12325 C  CD2  . LEU   A  796 ? 0.30677640 0.30949721 0.26991940 -0.03559046 -0.05219018 0.03406477  851  LEU   A CD2  
12326 H  H    . LEU   A  796 ? 0.24630681 0.23303673 0.19995090 -0.04021451 -0.04219728 0.03191797  851  LEU   A H    
12327 H  HA   . LEU   A  796 ? 0.24404949 0.24747539 0.20689267 -0.04261295 -0.04047808 0.03054723  851  LEU   A HA   
12328 H  HB2  . LEU   A  796 ? 0.26557687 0.26352993 0.22779995 -0.03602328 -0.04560189 0.03148314  851  LEU   A HB2  
12329 H  HB3  . LEU   A  796 ? 0.26821840 0.25970924 0.22337070 -0.03924452 -0.04694242 0.03409662  851  LEU   A HB3  
12330 H  HG   . LEU   A  796 ? 0.27493510 0.28020951 0.23708071 -0.04202421 -0.04734278 0.03337520  851  LEU   A HG   
12331 H  HD11 . LEU   A  796 ? 0.27435362 0.29479119 0.24958131 -0.03916296 -0.04711661 0.03057047  851  LEU   A HD11 
12332 H  HD12 . LEU   A  796 ? 0.27852112 0.29513276 0.25391114 -0.03454956 -0.04673373 0.02961297  851  LEU   A HD12 
12333 H  HD13 . LEU   A  796 ? 0.27272430 0.28873402 0.24523181 -0.03980871 -0.04327467 0.02973470  851  LEU   A HD13 
12334 H  HD21 . LEU   A  796 ? 0.30104545 0.29732215 0.25829375 -0.03673645 -0.05304581 0.03569473  851  LEU   A HD21 
12335 H  HD22 . LEU   A  796 ? 0.30045876 0.30249751 0.26552701 -0.03221919 -0.05271279 0.03336028  851  LEU   A HD22 
12336 H  HD23 . LEU   A  796 ? 0.29660365 0.30466804 0.26280949 -0.03564595 -0.05380693 0.03399103  851  LEU   A HD23 
12337 N  N    . LYS   A  797 ? 0.30506966 0.29533741 0.25464064 -0.04798194 -0.04225005 0.03472950  852  LYS   A N    
12338 C  CA   . LYS   A  797 ? 0.27398425 0.26354682 0.22011876 -0.05136565 -0.04172268 0.03560093  852  LYS   A CA   
12339 C  C    . LYS   A  797 ? 0.25538206 0.24671495 0.20237249 -0.05398388 -0.03876708 0.03455301  852  LYS   A C    
12340 O  O    . LYS   A  797 ? 0.21524021 0.20784616 0.16117674 -0.05615696 -0.03823038 0.03455060  852  LYS   A O    
12341 C  CB   . LYS   A  797 ? 0.28146738 0.26360485 0.22082248 -0.05246316 -0.04235843 0.03750234  852  LYS   A CB   
12342 C  CG   . LYS   A  797 ? 0.35357410 0.33221260 0.28958997 -0.05051585 -0.04586794 0.03929868  852  LYS   A CG   
12343 C  CD   . LYS   A  797 ? 0.42748207 0.39820743 0.35582638 -0.05271865 -0.04554836 0.04135984  852  LYS   A CD   
12344 C  CE   . LYS   A  797 ? 0.61493129 0.58017004 0.53780276 -0.05135364 -0.04901298 0.04371839  852  LYS   A CE   
12345 N  NZ   . LYS   A  797 ? 0.51626778 0.47425854 0.43090162 -0.05474741 -0.04787137 0.04587896  852  LYS   A NZ   
12346 H  H    . LYS   A  797 ? 0.29075742 0.27654868 0.23824939 -0.04676870 -0.04284805 0.03518703  852  LYS   A H    
12347 H  HA   . LYS   A  797 ? 0.27560663 0.26824787 0.22287990 -0.05139300 -0.04297017 0.03565082  852  LYS   A HA   
12348 H  HB2  . LYS   A  797 ? 0.29700434 0.27595294 0.23550013 -0.05245989 -0.04143647 0.03745368  852  LYS   A HB2  
12349 H  HB3  . LYS   A  797 ? 0.29412165 0.27648228 0.23159179 -0.05474344 -0.04129370 0.03764308  852  LYS   A HB3  
12350 H  HG2  . LYS   A  797 ? 0.34937629 0.33108294 0.28586948 -0.05072591 -0.04704610 0.03932246  852  LYS   A HG2  
12351 H  HG3  . LYS   A  797 ? 0.35130641 0.32959765 0.28941041 -0.04780495 -0.04711617 0.03907375  852  LYS   A HG3  
12352 H  HD2  . LYS   A  797 ? 0.44284305 0.41064444 0.37100363 -0.05286796 -0.04443156 0.04121543  852  LYS   A HD2  
12353 H  HD3  . LYS   A  797 ? 0.44010669 0.41202253 0.36694437 -0.05521822 -0.04398160 0.04125714  852  LYS   A HD3  
12354 H  HE2  . LYS   A  797 ? 0.53885865 0.50719130 0.46207434 -0.05099878 -0.05053335 0.04373123  852  LYS   A HE2  
12355 H  HE3  . LYS   A  797 ? 0.54432344 0.50744557 0.46836418 -0.04863816 -0.05063441 0.04386732  852  LYS   A HE3  
12356 H  HZ1  . LYS   A  797 ? 0.54188734 0.50222623 0.45567483 -0.05699869 -0.04620363 0.04550471  852  LYS   A HZ1  
12357 H  HZ2  . LYS   A  797 ? 0.54621774 0.50135428 0.46068650 -0.05534734 -0.04662892 0.04586434  852  LYS   A HZ2  
12358 H  HZ3  . LYS   A  797 ? 0.55093646 0.50495422 0.46140894 -0.05405689 -0.05008944 0.04756740  852  LYS   A HZ3  
12359 N  N    . THR   A  798 ? 0.22810799 0.21900955 0.17653917 -0.05355689 -0.03712826 0.03356446  853  THR   A N    
12360 C  CA   . THR   A  798 ? 0.30187175 0.29457146 0.25117925 -0.05560513 -0.03495226 0.03266262  853  THR   A CA   
12361 C  C    . THR   A  798 ? 0.21578148 0.21403418 0.16906738 -0.05554917 -0.03413768 0.03159988  853  THR   A C    
12362 O  O    . THR   A  798 ? 0.30285370 0.30196908 0.25618136 -0.05722078 -0.03282877 0.03120331  853  THR   A O    
12363 C  CB   . THR   A  798 ? 0.26839960 0.25723964 0.21610534 -0.05590864 -0.03382731 0.03220140  853  THR   A CB   
12364 O  OG1  . THR   A  798 ? 0.31617355 0.30379719 0.26478255 -0.05336715 -0.03412235 0.03134709  853  THR   A OG1  
12365 C  CG2  . THR   A  798 ? 0.25442895 0.23823529 0.19820043 -0.05738570 -0.03407810 0.03340251  853  THR   A CG2  
12366 H  H    . THR   A  798 ? 0.25214085 0.24126735 0.20069666 -0.05186429 -0.03755077 0.03340816  853  THR   A H    
12367 H  HA   . THR   A  798 ? 0.26042017 0.25278923 0.20824097 -0.05718040 -0.03476826 0.03307244  853  THR   A HA   
12368 H  HB   . THR   A  798 ? 0.27600411 0.26641405 0.22445968 -0.05702210 -0.03275273 0.03160340  853  THR   A HB   
12370 H  HG21 . THR   A  798 ? 0.26071715 0.24229991 0.20377648 -0.05792328 -0.03352469 0.03303409  853  THR   A HG21 
12371 H  HG22 . THR   A  798 ? 0.26289120 0.24442236 0.20519635 -0.05634688 -0.03533172 0.03424519  853  THR   A HG22 
12372 H  HG23 . THR   A  798 ? 0.25814027 0.24309561 0.20136230 -0.05894717 -0.03356045 0.03368441  853  THR   A HG23 
12373 N  N    . TYR   A  799 ? 0.31621739 0.31824741 0.27281359 -0.05372211 -0.03496820 0.03122555  854  TYR   A N    
12374 C  CA   . TYR   A  799 ? 0.36668450 0.37470317 0.32725063 -0.05427752 -0.03392785 0.03037227  854  TYR   A CA   
12375 C  C    . TYR   A  799 ? 0.40836382 0.41799152 0.36884549 -0.05706878 -0.03422946 0.03084183  854  TYR   A C    
12376 O  O    . TYR   A  799 ? 0.22435196 0.23278633 0.18333918 -0.05751139 -0.03594417 0.03147183  854  TYR   A O    
12377 C  CB   . TYR   A  799 ? 0.29908168 0.31204021 0.26423967 -0.05164266 -0.03485594 0.02970914  854  TYR   A CB   
12378 C  CG   . TYR   A  799 ? 0.45295793 0.47350657 0.42293766 -0.05289324 -0.03356029 0.02889931  854  TYR   A CG   
12379 C  CD1  . TYR   A  799 ? 0.37154278 0.39455464 0.34262946 -0.05307161 -0.03076728 0.02780116  854  TYR   A CD1  
12380 C  CD2  . TYR   A  799 ? 0.45224968 0.47736612 0.42517132 -0.05437853 -0.03508417 0.02923953  854  TYR   A CD2  
12381 C  CE1  . TYR   A  799 ? 0.41177848 0.44181719 0.38682747 -0.05486840 -0.02914828 0.02729724  854  TYR   A CE1  
12382 C  CE2  . TYR   A  799 ? 0.27062872 0.30297217 0.24825156 -0.05627315 -0.03376783 0.02859731  854  TYR   A CE2  
12383 C  CZ   . TYR   A  799 ? 0.42010909 0.45487204 0.39870057 -0.05664356 -0.03060821 0.02776394  854  TYR   A CZ   
12384 O  OH   . TYR   A  799 ? 0.47453386 0.51615942 0.45706910 -0.05921286 -0.02895697 0.02741722  854  TYR   A OH   
12385 H  H    . TYR   A  799 ? 0.29848462 0.29945838 0.25495407 -0.05211515 -0.03625548 0.03154880  854  TYR   A H    
12386 H  HA   . TYR   A  799 ? 0.35034159 0.35814434 0.31061947 -0.05458061 -0.03239842 0.02979964  854  TYR   A HA   
12387 H  HB2  . TYR   A  799 ? 0.34541917 0.35695660 0.31051332 -0.04963011 -0.03447800 0.02910805  854  TYR   A HB2  
12388 H  HB3  . TYR   A  799 ? 0.34427741 0.35684186 0.30928242 -0.05103999 -0.03680868 0.03036408  854  TYR   A HB3  
12389 H  HD1  . TYR   A  799 ? 0.39835599 0.41819972 0.36719531 -0.05219708 -0.02991689 0.02739324  854  TYR   A HD1  
12390 H  HD2  . TYR   A  799 ? 0.39923698 0.42265743 0.37088558 -0.05428788 -0.03705397 0.02988147  854  TYR   A HD2  
12391 H  HE1  . TYR   A  799 ? 0.40481693 0.43629897 0.37987125 -0.05515503 -0.02706759 0.02664259  854  TYR   A HE1  
12392 H  HE2  . TYR   A  799 ? 0.33687615 0.37219456 0.31654441 -0.05762326 -0.03498210 0.02876553  854  TYR   A HE2  
12394 N  N    . LEU   A  800 ? 0.38161692 0.39300460 0.34281215 -0.05897826 -0.03263079 0.03052009  855  LEU   A N    
12395 C  CA   . LEU   A  800 ? 0.31301817 0.32532287 0.27423468 -0.06164340 -0.03292985 0.03079547  855  LEU   A CA   
12396 C  C    . LEU   A  800 ? 0.38685471 0.40465730 0.35177478 -0.06305169 -0.03194279 0.03051099  855  LEU   A C    
12397 O  O    . LEU   A  800 ? 0.30803424 0.32693046 0.27310747 -0.06328245 -0.02991491 0.03027762  855  LEU   A O    
12398 C  CB   . LEU   A  800 ? 0.27159122 0.27955243 0.22939229 -0.06294923 -0.03214391 0.03100398  855  LEU   A CB   
12399 C  CG   . LEU   A  800 ? 0.33839735 0.34501144 0.29509538 -0.06532886 -0.03267175 0.03115443  855  LEU   A CG   
12400 C  CD1  . LEU   A  800 ? 0.16739917 0.17189258 0.12227756 -0.06543072 -0.03415426 0.03091389  855  LEU   A CD1  
12401 C  CD2  . LEU   A  800 ? 0.36288333 0.36621490 0.31730995 -0.06585260 -0.03181285 0.03133804  855  LEU   A CD2  
12402 H  H    . LEU   A  800 ? 0.36972672 0.38118833 0.33093032 -0.05864821 -0.03138591 0.03012979  855  LEU   A H    
12403 H  HA   . LEU   A  800 ? 0.32993162 0.34205243 0.29088879 -0.06172303 -0.03438576 0.03097265  855  LEU   A HA   
12404 H  HB2  . LEU   A  800 ? 0.29454094 0.29999268 0.25061610 -0.06218560 -0.03245623 0.03106042  855  LEU   A HB2  
12405 H  HB3  . LEU   A  800 ? 0.29464751 0.30269697 0.25235009 -0.06288411 -0.03101159 0.03090448  855  LEU   A HB3  
12406 H  HG   . LEU   A  800 ? 0.28210106 0.29134178 0.24062693 -0.06651344 -0.03265392 0.03121711  855  LEU   A HG   
12407 H  HD11 . LEU   A  800 ? 0.20533922 0.20871043 0.15951492 -0.06680464 -0.03452928 0.03074549  855  LEU   A HD11 
12408 H  HD12 . LEU   A  800 ? 0.20407680 0.20635077 0.15722319 -0.06459557 -0.03385642 0.03084259  855  LEU   A HD12 
12409 H  HD13 . LEU   A  800 ? 0.20456001 0.21094036 0.16048816 -0.06499396 -0.03507165 0.03093467  855  LEU   A HD13 
12410 H  HD21 . LEU   A  800 ? 0.35482958 0.35935187 0.30970258 -0.06619675 -0.03092490 0.03155190  855  LEU   A HD21 
12411 H  HD22 . LEU   A  800 ? 0.35532570 0.35704416 0.30871621 -0.06475730 -0.03172047 0.03116995  855  LEU   A HD22 
12412 H  HD23 . LEU   A  800 ? 0.35478535 0.35633835 0.30820268 -0.06694680 -0.03234189 0.03137463  855  LEU   A HD23 
12413 N  N    . HIS   A  801 ? 0.40494317 0.42653131 0.37270719 -0.06428076 -0.03336034 0.03048071  856  HIS   A N    
12414 C  CA   . HIS   A  801 ? 0.41030553 0.43778822 0.38203123 -0.06661709 -0.03235412 0.03028702  856  HIS   A CA   
12415 C  C    . HIS   A  801 ? 0.35897261 0.38262093 0.32745683 -0.07021400 -0.03172615 0.03099370  856  HIS   A C    
12416 O  O    . HIS   A  801 ? 0.43308264 0.45216551 0.39865685 -0.07120990 -0.03335918 0.03117034  856  HIS   A O    
12417 C  CB   . HIS   A  801 ? 0.42970464 0.46275836 0.40597194 -0.06683721 -0.03463588 0.02991194  856  HIS   A CB   
12418 C  CG   . HIS   A  801 ? 0.61435020 0.65622830 0.59695041 -0.06857208 -0.03355363 0.02936861  856  HIS   A CG   
12419 N  ND1  . HIS   A  801 ? 0.71889067 0.76823980 0.70759034 -0.06571784 -0.03392651 0.02839662  856  HIS   A ND1  
12420 C  CD2  . HIS   A  801 ? 0.68944114 0.73379016 0.67323631 -0.07293271 -0.03223010 0.02966564  856  HIS   A CD2  
12421 C  CE1  . HIS   A  801 ? 0.86548573 0.92286503 0.85961723 -0.06844133 -0.03244063 0.02792064  856  HIS   A CE1  
12422 N  NE2  . HIS   A  801 ? 0.83838719 0.89272088 0.82939547 -0.07318874 -0.03129365 0.02882520  856  HIS   A NE2  
12423 H  H    . HIS   A  801 ? 0.40152031 0.42210799 0.36863446 -0.06389730 -0.03500842 0.03058068  856  HIS   A H    
12424 H  HA   . HIS   A  801 ? 0.40172359 0.43179139 0.37502092 -0.06567484 -0.03070395 0.02990799  856  HIS   A HA   
12425 H  HB2  . HIS   A  801 ? 0.45978016 0.49303752 0.43661466 -0.06415813 -0.03576027 0.02972651  856  HIS   A HB2  
12426 H  HB3  . HIS   A  801 ? 0.46177322 0.49232471 0.43611759 -0.06847598 -0.03605007 0.03015634  856  HIS   A HB3  
12428 H  HD2  . HIS   A  801 ? 0.70320958 0.74312598 0.68350929 -0.07529995 -0.03194632 0.03032482  856  HIS   A HD2  
12429 H  HE1  . HIS   A  801 ? 0.81823063 0.88258439 0.81779808 -0.06717897 -0.03220041 0.02704396  856  HIS   A HE1  
12431 N  N    . THR   A  802 ? 0.49691924 0.52152109 0.46506047 -0.07194838 -0.02938094 0.03137560  857  THR   A N    
12432 C  CA   . THR   A  802 ? 0.55123836 0.56993014 0.51478642 -0.07455244 -0.02911773 0.03239090  857  THR   A CA   
12433 C  C    . THR   A  802 ? 0.43593141 0.45640451 0.40041766 -0.07907588 -0.02864468 0.03311511  857  THR   A C    
12434 O  O    . THR   A  802 ? 0.68133247 0.69575363 0.64206696 -0.08144407 -0.02957119 0.03393652  857  THR   A O    
12435 C  CB   . THR   A  802 ? 0.49291012 0.50865626 0.45297861 -0.07347707 -0.02741358 0.03277199  857  THR   A CB   
12436 O  OG1  . THR   A  802 ? 0.51293999 0.53440225 0.47523040 -0.07405315 -0.02493027 0.03252776  857  THR   A OG1  
12437 C  CG2  . THR   A  802 ? 0.59664249 0.60983479 0.55546457 -0.06993842 -0.02801633 0.03212765  857  THR   A CG2  
12438 H  H    . THR   A  802 ? 0.46818736 0.49683878 0.43862265 -0.07138491 -0.02798588 0.03100308  857  THR   A H    
12439 H  HA   . THR   A  802 ? 0.50458074 0.51930940 0.46616101 -0.07410354 -0.03062363 0.03235046  857  THR   A HA   
12440 H  HB   . THR   A  802 ? 0.52750307 0.53913248 0.48447037 -0.07501525 -0.02763425 0.03358448  857  THR   A HB   
12442 H  HG21 . THR   A  802 ? 0.56238174 0.57347012 0.51881427 -0.06962100 -0.02727141 0.03232542  857  THR   A HG21 
12443 H  HG22 . THR   A  802 ? 0.55812848 0.57452357 0.51941723 -0.06833355 -0.02781175 0.03145719  857  THR   A HG22 
12444 H  HG23 . THR   A  802 ? 0.56116736 0.57149750 0.51895690 -0.06963027 -0.02940652 0.03214319  857  THR   A HG23 
12445 N  N    . TYR   A  803 ? 0.53085482 0.55958599 0.50044447 -0.08030192 -0.02713350 0.03273914  858  TYR   A N    
12446 C  CA   . TYR   A  803 ? 0.76219213 0.79403269 0.73359627 -0.08535182 -0.02641002 0.03341588  858  TYR   A CA   
12447 C  C    . TYR   A  803 ? 1.00949490 1.03766370 0.97608042 -0.08839421 -0.02396769 0.03500678  858  TYR   A C    
12448 O  O    . TYR   A  803 ? 0.59520406 0.62132424 0.56026155 -0.09318713 -0.02392509 0.03623125  858  TYR   A O    
12449 C  CB   . TYR   A  803 ? 0.54420215 0.57195777 0.51470512 -0.08780973 -0.02956181 0.03347227  858  TYR   A CB   
12450 C  CG   . TYR   A  803 ? 0.69106853 0.72233170 0.66527253 -0.08528542 -0.03221273 0.03209053  858  TYR   A CG   
12451 C  CD1  . TYR   A  803 ? 0.55392003 0.59459478 0.53512239 -0.08640293 -0.03289808 0.03128457  858  TYR   A CD1  
12452 C  CD2  . TYR   A  803 ? 0.58006030 0.60569656 0.55076414 -0.08171821 -0.03404082 0.03164184  858  TYR   A CD2  
12453 C  CE1  . TYR   A  803 ? 1.22145927 1.26491582 1.20537353 -0.08382274 -0.03591012 0.03025319  858  TYR   A CE1  
12454 C  CE2  . TYR   A  803 ? 0.55778044 0.58591437 0.53055799 -0.07955471 -0.03650013 0.03072443  858  TYR   A CE2  
12455 C  CZ   . TYR   A  803 ? 1.14872086 1.18530691 1.12774944 -0.08048873 -0.03770711 0.03012392  858  TYR   A CZ   
12456 O  OH   . TYR   A  803 ? 1.04128468 1.07989383 1.02173233 -0.07822684 -0.04073084 0.02945150  858  TYR   A OH   
12457 H  H    . TYR   A  803 ? 0.54471761 0.57737297 0.51687789 -0.07800522 -0.02647351 0.03198212  858  TYR   A H    
12458 H  HA   . TYR   A  803 ? 0.70054942 0.73988497 0.67701316 -0.08538818 -0.02554343 0.03270502  858  TYR   A HA   
12459 H  HB2  . TYR   A  803 ? 0.62062287 0.64117885 0.58642417 -0.08750832 -0.03032353 0.03395227  858  TYR   A HB2  
12460 H  HB3  . TYR   A  803 ? 0.62244016 0.65213037 0.59421813 -0.09156591 -0.02914894 0.03392438  858  TYR   A HB3  
12461 H  HD1  . TYR   A  803 ? 0.70327377 0.74867725 0.68740183 -0.08901118 -0.03139270 0.03147749  858  TYR   A HD1  
12462 H  HD2  . TYR   A  803 ? 0.60259008 0.62280518 0.56937343 -0.08084255 -0.03361133 0.03201775  858  TYR   A HD2  
12463 H  HE1  . TYR   A  803 ? 0.97827983 1.02843392 0.96725672 -0.08442022 -0.03673808 0.02969245  858  TYR   A HE1  
12464 H  HE2  . TYR   A  803 ? 0.66902602 0.69325334 0.63891983 -0.07755409 -0.03743262 0.03055012  858  TYR   A HE2  
12466 N  N    . GLU   A  804 ? 0.91476333 0.94168967 0.87844795 -0.08583273 -0.02212767 0.03503937  859  GLU   A N    
12467 C  CA   . GLU   A  804 ? 0.91128320 0.93327445 0.86870366 -0.08806815 -0.02042397 0.03670024  859  GLU   A CA   
12468 C  C    . GLU   A  804 ? 0.92019176 0.94957680 0.87910938 -0.08931872 -0.01644381 0.03642634  859  GLU   A C    
12469 O  O    . GLU   A  804 ? 0.76535368 0.79729605 0.72422224 -0.09413056 -0.01449016 0.03756656  859  GLU   A O    
12470 C  CB   . GLU   A  804 ? 0.91431224 0.92891282 0.86644018 -0.08445860 -0.02169122 0.03682158  859  GLU   A CB   
12471 C  CG   . GLU   A  804 ? 0.60722744 0.61365199 0.55641031 -0.08399531 -0.02490845 0.03737973  859  GLU   A CG   
12472 C  CD   . GLU   A  804 ? 0.97061348 0.96957314 0.91425765 -0.08757346 -0.02565827 0.03947262  859  GLU   A CD   
12473 O  OE1  . GLU   A  804 ? 0.64136809 0.63746482 0.58004236 -0.08865149 -0.02449319 0.04095882  859  GLU   A OE1  
12474 O  OE2  . GLU   A  804 ? 0.77622515 0.77131045 0.71977878 -0.08916828 -0.02768232 0.03960226  859  GLU   A OE2  
12475 H  H    . GLU   A  804 ? 0.92487794 0.95380801 0.89020991 -0.08263901 -0.02210628 0.03400490  859  GLU   A H    
12476 H  HA   . GLU   A  804 ? 0.91594225 0.93439978 0.87131882 -0.09124093 -0.02113765 0.03790111  859  GLU   A HA   
12477 H  HB2  . GLU   A  804 ? 0.82508278 0.84231359 0.77945161 -0.08139912 -0.02161003 0.03553694  859  GLU   A HB2  
12478 H  HB3  . GLU   A  804 ? 0.83105505 0.84382081 0.77940005 -0.08537179 -0.02041697 0.03768137  859  GLU   A HB3  
12479 H  HG2  . GLU   A  804 ? 0.73641914 0.74448931 0.68866229 -0.08389612 -0.02602563 0.03663956  859  GLU   A HG2  
12480 H  HG3  . GLU   A  804 ? 0.73170853 0.73572212 0.67946839 -0.08120230 -0.02563223 0.03696422  859  GLU   A HG3  
12481 C  C1   . NAG   B  .   ? 0.32343012 0.33266938 0.27513108 -0.07242992 -0.01845525 0.02736745  1    NAG   B C1   
12482 C  C2   . NAG   B  .   ? 0.27547985 0.28347266 0.22212957 -0.07261331 -0.01681310 0.02743292  1    NAG   B C2   
12483 C  C3   . NAG   B  .   ? 0.23621780 0.25017411 0.18474247 -0.07378373 -0.01332332 0.02568920  1    NAG   B C3   
12484 C  C4   . NAG   B  .   ? 0.29422149 0.31097278 0.24487305 -0.07757875 -0.01154237 0.02646251  1    NAG   B C4   
12485 C  C5   . NAG   B  .   ? 0.32707441 0.34475833 0.28312856 -0.07724182 -0.01393487 0.02639750  1    NAG   B C5   
12486 C  C6   . NAG   B  .   ? 0.36394402 0.38332248 0.32176292 -0.08149425 -0.01282828 0.02718254  1    NAG   B C6   
12487 C  C7   . NAG   B  .   ? 0.24674328 0.24829523 0.18773742 -0.06922873 -0.02012434 0.02792112  1    NAG   B C7   
12488 C  C8   . NAG   B  .   ? 0.25193685 0.25277776 0.19248945 -0.06694212 -0.02137618 0.02658739  1    NAG   B C8   
12489 N  N2   . NAG   B  .   ? 0.31318069 0.31946281 0.25872645 -0.06970168 -0.01838755 0.02661750  1    NAG   B N2   
12490 O  O3   . NAG   B  .   ? 0.20939533 0.22148728 0.15175499 -0.07432080 -0.01166594 0.02578050  1    NAG   B O3   
12491 O  O4   . NAG   B  .   ? 0.33863291 0.36311010 0.29305094 -0.07838985 -0.00808256 0.02433966  1    NAG   B O4   
12492 O  O5   . NAG   B  .   ? 0.26018968 0.27116767 0.21316281 -0.07583003 -0.01703027 0.02791649  1    NAG   B O5   
12493 O  O6   . NAG   B  .   ? 0.33075970 0.34353077 0.28166497 -0.08464345 -0.01229564 0.02978547  1    NAG   B O6   
12494 O  O7   . NAG   B  .   ? 0.30666301 0.30457258 0.24420518 -0.07059646 -0.02084150 0.03001245  1    NAG   B O7   
12495 H  H1   . NAG   B  .   ? 0.29095602 0.30348635 0.24641134 -0.07076173 -0.01868206 0.02586504  1    NAG   B H1   
12496 H  H2   . NAG   B  .   ? 0.28531426 0.28969681 0.22792041 -0.07413897 -0.01693183 0.02912734  1    NAG   B H2   
12497 H  H3   . NAG   B  .   ? 0.24270703 0.26006591 0.19531296 -0.07172074 -0.01343282 0.02386337  1    NAG   B H3   
12498 H  H4   . NAG   B  .   ? 0.30242005 0.31518796 0.24836722 -0.07976046 -0.01125599 0.02833023  1    NAG   B H4   
12499 H  H5   . NAG   B  .   ? 0.30824208 0.32992458 0.26874179 -0.07518132 -0.01428731 0.02469360  1    NAG   B H5   
12500 H  H61  . NAG   B  .   ? 0.35027236 0.37550300 0.31141075 -0.08253834 -0.01066285 0.02595362  1    NAG   B H61  
12501 H  H62  . NAG   B  .   ? 0.34288505 0.36216319 0.30343288 -0.08116291 -0.01473068 0.02703627  1    NAG   B H62  
12502 H  H81  . NAG   B  .   ? 0.24963342 0.25290510 0.19289632 -0.06591606 -0.02068952 0.02498414  1    NAG   B H81  
12503 H  H82  . NAG   B  .   ? 0.25347090 0.25287420 0.19014704 -0.06732740 -0.02109337 0.02663628  1    NAG   B H82  
12504 H  H83  . NAG   B  .   ? 0.24810626 0.24733615 0.18936893 -0.06617648 -0.02323339 0.02723507  1    NAG   B H83  
12505 H  HN2  . NAG   B  .   ? 0.28363281 0.29214543 0.23180786 -0.06821489 -0.01833375 0.02515556  1    NAG   B HN2  
12507 H  HO4  . NAG   B  .   ? 0.32355642 0.35107535 0.28184924 -0.07612838 -0.00853930 0.02270953  1    NAG   B HO4  
12509 C  C1   . NAG   B  .   ? 0.57416993 0.59979528 0.52531683 -0.08262837 -0.00465013 0.02531143  2    NAG   B C1   
12510 C  C2   . NAG   B  .   ? 0.58824146 0.62453258 0.54706597 -0.08354063 -0.00134501 0.02269688  2    NAG   B C2   
12511 C  C3   . NAG   B  .   ? 0.64745355 0.68620825 0.60267293 -0.08850765 0.00330506  0.02347862  2    NAG   B C3   
12512 C  C4   . NAG   B  .   ? 0.47555447 0.50839859 0.42049104 -0.08862033 0.00464515  0.02453576  2    NAG   B C4   
12513 C  C5   . NAG   B  .   ? 0.67478001 0.69674414 0.61302507 -0.08730854 0.00023842  0.02730159  2    NAG   B C5   
12514 C  C6   . NAG   B  .   ? 0.68184686 0.69784546 0.61008525 -0.08697969 0.00040682  0.02834067  2    NAG   B C6   
12515 C  C7   . NAG   B  .   ? 0.87613875 0.92045552 0.84963250 -0.08017942 -0.00544736 0.02021990  2    NAG   B C7   
12516 C  C8   . NAG   B  .   ? 0.85143191 0.89643705 0.82985461 -0.08087514 -0.00862287 0.02063958  2    NAG   B C8   
12517 N  N2   . NAG   B  .   ? 0.60821652 0.64796734 0.57448387 -0.08410405 -0.00334189 0.02245198  2    NAG   B N2   
12518 O  O3   . NAG   B  .   ? 0.85329771 0.90354043 0.81632006 -0.08856012 0.00687033  0.02036111  2    NAG   B O3   
12519 O  O4   . NAG   B  .   ? 0.94070566 0.97465342 0.88153982 -0.09428699 0.00863711  0.02613599  2    NAG   B O4   
12520 O  O5   . NAG   B  .   ? 0.51477593 0.53660351 0.45804659 -0.08255321 -0.00335126 0.02582956  2    NAG   B O5   
12521 O  O6   . NAG   B  .   ? 1.15228117 1.17172754 1.08124232 -0.08345162 0.00141869  0.02509776  2    NAG   B O6   
12522 O  O7   . NAG   B  .   ? 1.45838940 1.50535607 1.43373525 -0.07611682 -0.00512853 0.01793882  2    NAG   B O7   
12523 H  H1   . NAG   B  .   ? 0.50600833 0.52831244 0.45550442 -0.08511981 -0.00540997 0.02725197  2    NAG   B H1   
12524 H  H2   . NAG   B  .   ? 0.60263681 0.64181167 0.56349969 -0.08040920 -0.00097797 0.02055294  2    NAG   B H2   
12525 H  H3   . NAG   B  .   ? 0.63578510 0.67208695 0.58995467 -0.09185177 0.00289804  0.02547063  2    NAG   B H3   
12526 H  H4   . NAG   B  .   ? 0.61193442 0.64769459 0.55763602 -0.08592582 0.00570620  0.02224616  2    NAG   B H4   
12527 H  H5   . NAG   B  .   ? 0.60139519 0.62009418 0.53850877 -0.08981134 -0.00064893 0.02940546  2    NAG   B H5   
12528 H  H61  . NAG   B  .   ? 0.78324294 0.79852062 0.70695788 -0.09028460 0.00272275  0.02962973  2    NAG   B H61  
12529 H  H62  . NAG   B  .   ? 0.77245724 0.78249103 0.69778132 -0.08597495 -0.00268656 0.02999817  2    NAG   B H62  
12530 H  H81  . NAG   B  .   ? 0.85612154 0.89774412 0.83176529 -0.08414354 -0.00864154 0.02237815  2    NAG   B H81  
12531 H  H82  . NAG   B  .   ? 0.85574162 0.90796721 0.84055167 -0.08089327 -0.00801764 0.01899840  2    NAG   B H82  
12532 H  H83  . NAG   B  .   ? 0.85413855 0.89566398 0.83197773 -0.07806952 -0.01135259 0.02074491  2    NAG   B H83  
12533 H  HN2  . NAG   B  .   ? 0.66136587 0.69978958 0.62698388 -0.08716588 -0.00334388 0.02384070  2    NAG   B HN2  
12536 C  C1   . BMA   B  .   ? 1.31630218 1.34905434 1.24871707 -0.09589916 0.01208778  0.02637640  3    BMA   B C1   
12537 C  C2   . BMA   B  .   ? 1.40933633 1.44547069 1.34015667 -0.10253940 0.01666187  0.02787636  3    BMA   B C2   
12538 C  C3   . BMA   B  .   ? 1.40817344 1.44264734 1.32857239 -0.10464657 0.02062024  0.02833971  3    BMA   B C3   
12539 C  C4   . BMA   B  .   ? 1.08125222 1.12274384 1.00434196 -0.09997687 0.02296522  0.02365839  3    BMA   B C4   
12540 C  C5   . BMA   B  .   ? 1.20515525 1.24217772 1.13017225 -0.09351324 0.01763107  0.02234830  3    BMA   B C5   
12541 C  C6   . BMA   B  .   ? 1.35727167 1.39919531 1.28467357 -0.08851258 0.01907961  0.01765466  3    BMA   B C6   
12542 O  O2   . BMA   B  .   ? 1.15718842 1.20563066 1.09962308 -0.10323443 0.01941047  0.02495550  3    BMA   B O2   
12543 O  O3   . BMA   B  .   ? 1.20140362 1.23930264 1.11984313 -0.11150012 0.02547600  0.02990726  3    BMA   B O3   
12544 O  O4   . BMA   B  .   ? 0.80414480 0.84317118 0.71617264 -0.10166121 0.02634003  0.02382691  3    BMA   B O4   
12545 O  O5   . BMA   B  .   ? 0.87226743 0.91100836 0.80697322 -0.09192845 0.01417368  0.02238724  3    BMA   B O5   
12546 O  O6   . BMA   B  .   ? 1.38555777 1.43951988 1.32079148 -0.08871473 0.02415059  0.01411817  3    BMA   B O6   
12547 H  H1   . BMA   B  .   ? 1.19911277 1.22400582 1.12443149 -0.09564308 0.00991170  0.02845709  3    BMA   B H1   
12548 H  H2   . BMA   B  .   ? 1.34111691 1.37141562 1.26927280 -0.10508253 0.01479804  0.03070926  3    BMA   B H2   
12549 H  H3   . BMA   B  .   ? 1.30105138 1.32684004 1.21367538 -0.10432684 0.01806940  0.03065299  3    BMA   B H3   
12550 H  H4   . BMA   B  .   ? 1.08621001 1.13666856 1.01722491 -0.09997457 0.02552094  0.02125804  3    BMA   B H4   
12551 H  H5   . BMA   B  .   ? 1.13534212 1.16433728 1.05309153 -0.09361930 0.01515524  0.02462705  3    BMA   B H5   
12552 H  H61  . BMA   B  .   ? 1.33207047 1.36998057 1.25149393 -0.08855672 0.01968318  0.01775948  3    BMA   B H61  
12553 H  H62  . BMA   B  .   ? 1.31777394 1.35823154 1.24901295 -0.08486596 0.01571139  0.01680536  3    BMA   B H62  
12558 S  S    . SCN   C  .   ? 0.82579589 0.76217800 0.61566383 -0.04975912 -0.14862330 0.06669103  901  SCN   A S    
12559 C  C    . SCN   C  .   ? 0.85930610 0.78197813 0.63447124 -0.05171856 -0.14257661 0.07074910  901  SCN   A C    
12560 N  N    . SCN   C  .   ? 0.49092281 0.40400222 0.25598398 -0.05339445 -0.13809092 0.07373063  901  SCN   A N    
12561 S  S    . SCN   D  .   ? 0.98729175 0.99070299 0.90086854 -0.10713774 -0.10348435 0.00630457  902  SCN   A S    
12562 C  C    . SCN   D  .   ? 0.79399276 0.79365492 0.70024937 -0.10130854 -0.10061584 0.00810659  902  SCN   A C    
12563 N  N    . SCN   D  .   ? 0.44538325 0.44243672 0.34618962 -0.09737492 -0.09865621 0.00953924  902  SCN   A N    
12564 S  S    . SCN   E  .   ? 1.18882453 1.10484183 0.88033587 -0.09214285 -0.05501514 -0.00210565 903  SCN   A S    
12565 C  C    . SCN   E  .   ? 0.90003157 0.82041937 0.60367155 -0.08982997 -0.04677809 -0.00584606 903  SCN   A C    
12566 N  N    . SCN   E  .   ? 0.56288290 0.48634112 0.27484486 -0.08798248 -0.04096873 -0.00872315 903  SCN   A N    
12567 ZN ZN   . ZN    F  .   ? 0.32000977 0.27528572 0.22399697 -0.05408362 -0.06762245 0.04488007  904  ZN    A ZN   
12568 ZN ZN   . ZN    G  .   ? 0.28835505 0.26810974 0.21331237 -0.05646262 -0.05920588 0.03556982  905  ZN    A ZN   
12569 CA CA   . CA    H  .   ? 0.29732996 0.29551780 0.20408423 -0.06746112 -0.01044928 0.01480231  906  CA    A CA   
12570 I  I    . IOD   I  .   ? 0.40708697 0.38012701 0.36385447 -0.03254160 -0.06109061 0.02761801  907  IOD   A I    
12571 I  I    . IOD   J  .   ? 0.83716744 0.96055961 0.89221919 -0.02151867 -0.09950651 0.02501865  908  IOD   A I    
12572 C  C1   . A1IG1 K  .   ? 0.35294139 0.38548735 0.33591104 -0.06104683 -0.05843319 0.02001513  909  A1IG1 A C1   
12573 C  C2   . A1IG1 K  .   ? 0.30689824 0.33273083 0.27939939 -0.06435129 -0.06333641 0.02004622  909  A1IG1 A C2   
12574 C  C3   . A1IG1 K  .   ? 0.34678206 0.36302558 0.30866468 -0.06870136 -0.06012660 0.01982374  909  A1IG1 A C3   
12575 C  C4   . A1IG1 K  .   ? 0.44720620 0.45774904 0.40427250 -0.07038703 -0.05628899 0.01987277  909  A1IG1 A C4   
12576 C  C5   . A1IG1 K  .   ? 0.41605836 0.42705446 0.37601623 -0.07035519 -0.05228188 0.02047610  909  A1IG1 A C5   
12577 N  N5   . A1IG1 K  .   ? 0.39265648 0.47494578 0.42208013 -0.07132179 -0.05590559 0.01098165  909  A1IG1 A N5   
12578 C  C10  . A1IG1 K  .   ? 0.41736859 0.43461648 0.37785822 -0.06901523 -0.06481436 0.01908947  909  A1IG1 A C10  
12579 C  C11  . A1IG1 K  .   ? 0.36545098 0.40044099 0.34825411 -0.05820254 -0.06869473 0.01983391  909  A1IG1 A C11  
12580 C  C6   . A1IG1 K  .   ? 0.72124529 0.72704583 0.67716390 -0.07153990 -0.04923300 0.02056124  909  A1IG1 A C6   
12581 C  C7   . A1IG1 K  .   ? 0.75009429 0.75051528 0.69953090 -0.07250326 -0.04990573 0.01970203  909  A1IG1 A C7   
12582 C  C9   . A1IG1 K  .   ? 0.39289010 0.39762184 0.34245956 -0.07183439 -0.05682144 0.01908281  909  A1IG1 A C9   
12583 N  N1   . A1IG1 K  .   ? 0.40953135 0.44059226 0.38893458 -0.06116077 -0.06347845 0.02006577  909  A1IG1 A N1   
12584 N  N2   . A1IG1 K  .   ? 0.25307009 0.27440739 0.22177383 -0.06639482 -0.05928144 0.02030119  909  A1IG1 A N2   
12585 F  F1   . A1IG1 K  .   ? 0.67878097 0.67424953 0.62490010 -0.07296140 -0.04708345 0.01957221  909  A1IG1 A F1   
12586 C  C8   . A1IG1 K  .   ? 0.55399370 0.55369216 0.49994126 -0.07281262 -0.05340330 0.01880592  909  A1IG1 A C8   
12587 S  S1   . A1IG1 K  .   ? 0.57784575 0.60284269 0.54628897 -0.06584197 -0.06879249 0.01923339  909  A1IG1 A S1   
12588 C  C12  . A1IG1 K  .   ? 0.35136575 0.38152736 0.32784325 -0.05597877 -0.07342558 0.02120312  909  A1IG1 A C12  
12589 C  C13  . A1IG1 K  .   ? 0.33170354 0.35180748 0.29650101 -0.05535326 -0.07430425 0.02350412  909  A1IG1 A C13  
12590 C  C14  . A1IG1 K  .   ? 0.44784245 0.46328259 0.40448499 -0.05889832 -0.07416557 0.02333257  909  A1IG1 A C14  
12591 C  C15  . A1IG1 K  .   ? 0.47478858 0.49374855 0.43234557 -0.06031159 -0.07899040 0.02188829  909  A1IG1 A C15  
12592 N  N3   . A1IG1 K  .   ? 0.24086383 0.26248249 0.19894660 -0.06189366 -0.08261752 0.02057648  909  A1IG1 A N3   
12593 N  N4   . A1IG1 K  .   ? 0.41095531 0.44779828 0.39412045 -0.05345620 -0.07833011 0.02033528  909  A1IG1 A N4   
12594 C  C16  . A1IG1 K  .   ? 0.58945161 0.63602453 0.58333594 -0.05454320 -0.07647709 0.01817994  909  A1IG1 A C16  
12595 C  C17  . A1IG1 K  .   ? 0.81199467 0.86960542 0.81708378 -0.05281581 -0.07956486 0.01627998  909  A1IG1 A C17  
12596 C  C18  . A1IG1 K  .   ? 0.80824000 0.87522662 0.82307285 -0.05505783 -0.07594746 0.01423323  909  A1IG1 A C18  
12597 C  C19  . A1IG1 K  .   ? 0.36212134 0.42642158 0.37465370 -0.05891312 -0.06986343 0.01436749  909  A1IG1 A C19  
12598 C  C20  . A1IG1 K  .   ? 0.35482213 0.42897493 0.37710327 -0.06156576 -0.06586708 0.01248558  909  A1IG1 A C20  
12599 C  C21  . A1IG1 K  .   ? 0.30563766 0.37450528 0.32371598 -0.06281570 -0.05952498 0.01342566  909  A1IG1 A C21  
12600 C  C22  . A1IG1 K  .   ? 0.30677667 0.38494235 0.33335769 -0.06553027 -0.05514149 0.01183070  909  A1IG1 A C22  
12601 S  S2   . A1IG1 K  .   ? 0.35941747 0.44671971 0.39297357 -0.07652347 -0.05003342 0.01041517  909  A1IG1 A S2   
12602 C  C23  . A1IG1 K  .   ? 0.28882730 0.39181387 0.33616602 -0.07384854 -0.04843693 0.00792942  909  A1IG1 A C23  
12603 O  O1   . A1IG1 K  .   ? 0.41683203 0.50486875 0.45079744 -0.08262566 -0.05130260 0.01001505  909  A1IG1 A O1   
12604 O  O2   . A1IG1 K  .   ? 0.57155573 0.65002680 0.59728861 -0.07593566 -0.04581859 0.01211246  909  A1IG1 A O2   
12605 C  C24  . A1IG1 K  .   ? 0.27537674 0.36460477 0.31068081 -0.07061539 -0.06171535 0.00962953  909  A1IG1 A C24  
12606 C  C25  . A1IG1 K  .   ? 0.36047539 0.44068164 0.38713086 -0.06733294 -0.06672571 0.01103407  909  A1IG1 A C25  
12607 N  N6   . A1IG1 K  .   ? 0.28506643 0.33862513 0.28719723 -0.06004782 -0.06735138 0.01617987  909  A1IG1 A N6   
12608 N  N7   . A1IG1 K  .   ? 0.38636440 0.43186057 0.37992507 -0.05764703 -0.07065629 0.01792718  909  A1IG1 A N7   
12609 H  H1   . A1IG1 K  .   ? 0.36484557 0.40148345 0.35278016 -0.05874453 -0.05885017 0.01957063  909  A1IG1 A H1   
12610 H  H2   . A1IG1 K  .   ? 0.36365676 0.39848155 0.34884056 -0.06378391 -0.05658047 0.01922315  909  A1IG1 A H2   
12611 H  H3   . A1IG1 K  .   ? 0.36210454 0.38913953 0.33997434 -0.06057889 -0.05671242 0.02117151  909  A1IG1 A H3   
12612 H  H4   . A1IG1 K  .   ? 0.47054082 0.48537242 0.43513995 -0.06936599 -0.05176095 0.02074623  909  A1IG1 A H4   
12613 H  H8   . A1IG1 K  .   ? 0.42612338 0.44025978 0.38193348 -0.07052933 -0.06591573 0.01844857  909  A1IG1 A H8   
12614 H  H5   . A1IG1 K  .   ? 0.62652087 0.63240111 0.58395582 -0.07148700 -0.04686289 0.02108820  909  A1IG1 A H5   
12615 H  H7   . A1IG1 K  .   ? 0.44498640 0.44922996 0.39194474 -0.07202065 -0.05963775 0.01857952  909  A1IG1 A H7   
12616 H  H6   . A1IG1 K  .   ? 0.54782832 0.54358780 0.48881426 -0.07343066 -0.05357083 0.01798316  909  A1IG1 A H6   
12617 H  H9   . A1IG1 K  .   ? 0.36456004 0.38394737 0.32838941 -0.05297088 -0.07802514 0.02429151  909  A1IG1 A H9   
12618 H  H10  . A1IG1 K  .   ? 0.35675448 0.37360308 0.31977558 -0.05472470 -0.07128882 0.02442809  909  A1IG1 A H10  
12619 H  H11  . A1IG1 K  .   ? 0.42248172 0.43195745 0.37178081 -0.05834832 -0.07422163 0.02485597  909  A1IG1 A H11  
12620 H  H12  . A1IG1 K  .   ? 0.41854966 0.43391231 0.37579772 -0.06095789 -0.07062577 0.02263646  909  A1IG1 A H12  
12621 H  H13  . A1IG1 K  .   ? 0.73972636 0.79838639 0.74552608 -0.05028865 -0.08397169 0.01643762  909  A1IG1 A H13  
12622 H  H14  . A1IG1 K  .   ? 0.65024287 0.72563964 0.67327499 -0.05411088 -0.07766365 0.01276921  909  A1IG1 A H14  
12623 H  H15  . A1IG1 K  .   ? 0.34798780 0.42876247 0.37721086 -0.05856014 -0.06657546 0.01144996  909  A1IG1 A H15  
12624 H  H16  . A1IG1 K  .   ? 0.31508121 0.38060290 0.33094734 -0.05934915 -0.05912211 0.01413199  909  A1IG1 A H16  
12625 H  H17  . A1IG1 K  .   ? 0.31661335 0.37902951 0.32819119 -0.06536067 -0.05876996 0.01438623  909  A1IG1 A H17  
12626 H  H19  . A1IG1 K  .   ? 0.32212973 0.40732086 0.35557249 -0.06272882 -0.05557464 0.01058252  909  A1IG1 A H19  
12627 H  H18  . A1IG1 K  .   ? 0.32213029 0.39640808 0.34524927 -0.06627423 -0.05138093 0.01257015  909  A1IG1 A H18  
12628 H  H22  . A1IG1 K  .   ? 0.30526578 0.41541606 0.35840115 -0.07753853 -0.04788985 0.00688334  909  A1IG1 A H22  
12629 H  H20  . A1IG1 K  .   ? 0.30317092 0.40532529 0.34951556 -0.07276502 -0.04475405 0.00811623  909  A1IG1 A H20  
12630 H  H21  . A1IG1 K  .   ? 0.30485713 0.41010994 0.35486892 -0.06975828 -0.05180563 0.00732999  909  A1IG1 A H21  
12631 H  H23  . A1IG1 K  .   ? 0.31852993 0.41037929 0.35568732 -0.07498866 -0.06213065 0.00894383  909  A1IG1 A H23  
12632 H  H24  . A1IG1 K  .   ? 0.31545362 0.41284811 0.35855258 -0.06800622 -0.06208196 0.00841061  909  A1IG1 A H24  
12633 H  H26  . A1IG1 K  .   ? 0.33999199 0.41331929 0.35970470 -0.07001624 -0.06648009 0.01181282  909  A1IG1 A H26  
12634 H  H25  . A1IG1 K  .   ? 0.34058142 0.42547077 0.37102768 -0.06640399 -0.07095145 0.01020791  909  A1IG1 A H25  
12635 S  S    . SCN   L  .   ? 1.01300669 0.89670992 0.91177785 -0.04353618 -0.05437493 0.04306264  910  SCN   A S    
12636 C  C    . SCN   L  .   ? 0.57159513 0.46689758 0.47873873 -0.03712125 -0.05473371 0.04052471  910  SCN   A C    
12637 N  N    . SCN   L  .   ? 0.68992686 0.59381729 0.60325116 -0.03274884 -0.05497773 0.03878034  910  SCN   A N    
12638 I  I    . IOD   M  .   ? 1.00999308 1.00524664 1.00809526 0.00322853  -0.06963255 0.00889311  911  IOD   A I    
12639 S  S    . SCN   N  .   ? 0.62579906 0.62535590 0.57131320 -0.05659696 -0.02277666 0.01597783  912  SCN   A S    
12640 C  C    . SCN   N  .   ? 0.72507334 0.72535580 0.66983318 -0.05942146 -0.02303158 0.01912636  912  SCN   A C    
12641 N  N    . SCN   N  .   ? 0.26130623 0.26172137 0.20556016 -0.06118360 -0.02332663 0.02129928  912  SCN   A N    
12642 S  S    . SCN   O  .   ? 0.81996369 0.72601986 0.73027152 -0.13569517 -0.07025307 -0.00601479 913  SCN   A S    
12643 C  C    . SCN   O  .   ? 0.68630302 0.59913611 0.59666020 -0.12684861 -0.06829653 -0.00543920 913  SCN   A C    
12644 N  N    . SCN   O  .   ? 0.54559064 0.46293291 0.45583957 -0.12072577 -0.06671283 -0.00484811 913  SCN   A N    
12645 S  S    . SCN   P  .   ? 0.92089963 0.86312526 0.83306324 -0.07172767 -0.03469840 0.04448509  914  SCN   A S    
12646 C  C    . SCN   P  .   ? 0.78836894 0.71877092 0.69308329 -0.07383513 -0.03602959 0.04718352  914  SCN   A C    
12647 N  N    . SCN   P  .   ? 0.44088084 0.36178631 0.33955157 -0.07557493 -0.03711838 0.04937814  914  SCN   A N    
12648 S  S    . SCN   Q  .   ? 0.95842904 0.99322224 0.93006849 -0.04140981 -0.11422302 0.02397621  915  SCN   A S    
12649 C  C    . SCN   Q  .   ? 1.04040527 1.07978857 1.01922655 -0.04435460 -0.10590514 0.02205513  915  SCN   A C    
12650 N  N    . SCN   Q  .   ? 0.68185085 0.72442901 0.66549945 -0.04657821 -0.10016251 0.02075689  915  SCN   A N    
12651 S  S    . SCN   R  .   ? 0.90357924 0.94385612 0.86696768 -0.06019952 -0.00965280 0.02195306  916  SCN   A S    
12652 C  C    . SCN   R  .   ? 0.72013134 0.75782639 0.67750829 -0.06523120 -0.00850401 0.02422622  916  SCN   A C    
12653 N  N    . SCN   R  .   ? 0.38824821 0.42374289 0.34102321 -0.06886496 -0.00779388 0.02602369  916  SCN   A N    
12654 S  S    . SCN   S  .   ? 0.96471286 1.08093071 0.91311681 -0.09400703 -0.23082545 0.01129916  917  SCN   A S    
12655 C  C    . SCN   S  .   ? 0.81657487 0.95523256 0.78923714 -0.09681848 -0.23595959 0.00884752  917  SCN   A C    
12656 N  N    . SCN   S  .   ? 0.59815216 0.75371456 0.58862591 -0.09907898 -0.23972943 0.00700008  917  SCN   A N    
12657 S  S    . SCN   T  .   ? 0.82571667 0.92376810 0.86501265 -0.08116281 -0.03123109 0.00987221  918  SCN   A S    
12658 C  C    . SCN   T  .   ? 0.54408908 0.63400471 0.57532763 -0.08738362 -0.02775759 0.01208086  918  SCN   A C    
12659 N  N    . SCN   T  .   ? 0.40940344 0.49308902 0.43476868 -0.09187696 -0.02557963 0.01374776  918  SCN   A N    
12660 S  S    . SCN   U  .   ? 0.71105009 0.82101703 0.74433160 -0.05458112 0.00017601  -0.00406279 919  SCN   A S    
12661 C  C    . SCN   U  .   ? 0.75554574 0.85279137 0.77523899 -0.05880842 0.00117993  -0.00048935 919  SCN   A C    
12662 N  N    . SCN   U  .   ? 0.50204509 0.59039533 0.51213509 -0.06154544 0.00177532  0.00197444  919  SCN   A N    
12663 S  S    . SCN   V  .   ? 0.93032777 0.99133015 0.92795128 -0.07658941 -0.04330758 0.02791007  920  SCN   A S    
12664 C  C    . SCN   V  .   ? 0.49468833 0.56297636 0.49803835 -0.07371113 -0.04728861 0.02715138  920  SCN   A C    
12665 N  N    . SCN   V  .   ? 0.37537318 0.44923726 0.38314787 -0.07140852 -0.05033853 0.02664555  920  SCN   A N    
12666 S  S    . SCN   W  .   ? 1.25712419 1.17392623 0.93388581 -0.10811211 -0.15650639 -0.00555741 921  SCN   A S    
12667 C  C    . SCN   W  .   ? 0.75571239 0.66986799 0.43099111 -0.10507093 -0.14540774 -0.00266897 921  SCN   A C    
12668 N  N    . SCN   W  .   ? 0.62465924 0.53713000 0.29860294 -0.10307994 -0.13768816 -0.00043171 921  SCN   A N    
12669 S  S    . SCN   X  .   ? 0.99067283 1.14921248 1.08731914 -0.07033123 -0.05920327 -0.00166911 922  SCN   A S    
12670 C  C    . SCN   X  .   ? 0.50693411 0.67262042 0.61115623 -0.06185858 -0.05869472 -0.00354894 922  SCN   A C    
12671 N  N    . SCN   X  .   ? 0.45538816 0.62629294 0.56533295 -0.05559665 -0.05817342 -0.00517811 922  SCN   A N    
12672 S  S    . SCN   Y  .   ? 0.70472550 0.71730125 0.67804646 -0.12241741 -0.02230926 0.02735494  923  SCN   A S    
12673 C  C    . SCN   Y  .   ? 0.79257244 0.79981130 0.75904626 -0.12173912 -0.01888783 0.03016532  923  SCN   A C    
12674 N  N    . SCN   Y  .   ? 0.50714195 0.51001942 0.46808088 -0.12112158 -0.01676484 0.03223143  923  SCN   A N    
12675 S  S    . SCN   Z  .   ? 1.14820623 1.16737998 1.13471675 -0.00203195 -0.08716355 0.03634127  924  SCN   A S    
12676 C  C    . SCN   Z  .   ? 0.96053159 0.99569356 0.96024448 0.00135141  -0.09063974 0.03419779  924  SCN   A C    
12677 N  N    . SCN   Z  .   ? 0.41191119 0.45942491 0.42193538 0.00380098  -0.09312966 0.03249842  924  SCN   A N    
12678 S  S    . SCN   AA .   ? 0.89050305 0.81093872 0.81851923 -0.02374721 -0.04157882 0.01465665  925  SCN   A S    
12679 C  C    . SCN   AA .   ? 0.88947642 0.80058551 0.81088758 -0.02883755 -0.04149638 0.01402659  925  SCN   A C    
12680 N  N    . SCN   AA .   ? 0.50788844 0.41243574 0.42472419 -0.03288190 -0.04166088 0.01364636  925  SCN   A N    
12681 S  S    . SCN   BA .   ? 1.06267023 0.96456265 0.97548920 -0.01208224 -0.03424065 -0.00976733 926  SCN   A S    
12682 C  C    . SCN   BA .   ? 0.91728133 0.82758641 0.82886279 -0.01401063 -0.03034216 -0.01295177 926  SCN   A C    
12683 N  N    . SCN   BA .   ? 0.44570994 0.36217955 0.35600978 -0.01565420 -0.02759015 -0.01488945 926  SCN   A N    
12684 S  S    . SCN   CA .   ? 0.92335063 0.84269977 0.73641670 -0.11506908 -0.11828594 -0.03613986 927  SCN   A S    
12685 C  C    . SCN   CA .   ? 0.73186278 0.65943480 0.55560625 -0.11061453 -0.11291069 -0.03039784 927  SCN   A C    
12686 N  N    . SCN   CA .   ? 0.59088600 0.52368373 0.42197520 -0.10744437 -0.10878998 -0.02649214 927  SCN   A N    
12687 S  S    . SCN   DA .   ? 0.96015501 0.98500127 0.90858334 -0.12097646 -0.12402432 -0.01332395 928  SCN   A S    
12688 C  C    . SCN   DA .   ? 0.81705838 0.83259386 0.74962533 -0.11954153 -0.12893899 -0.01496721 928  SCN   A C    
12689 N  N    . SCN   DA .   ? 0.60485238 0.61368620 0.52552903 -0.11884574 -0.13254879 -0.01631260 928  SCN   A N    
12690 S  S    . SCN   EA .   ? 1.04220641 0.95066875 0.73682123 -0.09097512 -0.11913531 0.00308225  929  SCN   A S    
12691 C  C    . SCN   EA .   ? 0.92219770 0.82307184 0.59505075 -0.09190276 -0.11615577 0.00539379  929  SCN   A C    
12692 N  N    . SCN   EA .   ? 0.83764815 0.73293185 0.49402267 -0.09297490 -0.11363207 0.00661091  929  SCN   A N    
12693 S  S    . SCN   FA .   ? 0.96684217 0.88473123 0.71317399 -0.08458062 -0.07404979 -0.01342519 930  SCN   A S    
12694 C  C    . SCN   FA .   ? 0.97955477 0.90285504 0.73231733 -0.08346426 -0.07282405 -0.00663237 930  SCN   A C    
12695 N  N    . SCN   FA .   ? 0.63351250 0.56010449 0.39042142 -0.08276653 -0.07234064 -0.00174379 930  SCN   A N    
12696 S  S    . SCN   GA .   ? 0.97360402 0.87211347 0.92666483 0.02321580  -0.09414145 0.01561687  931  SCN   A S    
12697 C  C    . SCN   GA .   ? 0.89413357 0.78378147 0.83580220 0.01476055  -0.09493425 0.02209517  931  SCN   A C    
12698 N  N    . SCN   GA .   ? 0.60750508 0.49196932 0.54129493 0.00833069  -0.09491357 0.02659617  931  SCN   A N    
12699 S  S    . SCN   HA .   ? 1.04705787 0.93986684 0.91760427 -0.11927980 -0.04100682 0.06671951  932  SCN   A S    
12700 C  C    . SCN   HA .   ? 0.86522204 0.77234262 0.74598777 -0.11314056 -0.03953135 0.06244982  932  SCN   A C    
12701 N  N    . SCN   HA .   ? 0.59412718 0.51120752 0.48204845 -0.10897713 -0.03846290 0.05947321  932  SCN   A N    
12702 S  S    . SCN   IA .   ? 1.08543968 1.09652770 1.04539907 -0.05761448 -0.02827393 0.02876178  933  SCN   A S    
12703 C  C    . SCN   IA .   ? 0.90497351 0.92129833 0.86717391 -0.05958242 -0.02682596 0.02877774  933  SCN   A C    
12704 N  N    . SCN   IA .   ? 0.64303017 0.66299307 0.60666543 -0.06145703 -0.02571001 0.02894220  933  SCN   A N    
12705 S  S    . SCN   JA .   ? 1.21925604 1.16917253 1.10813165 -0.06313989 -0.03659151 -0.00409786 934  SCN   A S    
12706 C  C    . SCN   JA .   ? 0.82502186 0.77428246 0.70464617 -0.06450343 -0.03650455 -0.00612450 934  SCN   A C    
12707 N  N    . SCN   JA .   ? 0.69158876 0.64002395 0.56383735 -0.06549349 -0.03649480 -0.00763504 934  SCN   A N    
12708 S  S    . SCN   KA .   ? 0.91384995 0.76079965 0.79407668 -0.11817755 -0.07250303 0.00892941  935  SCN   A S    
12709 C  C    . SCN   KA .   ? 0.79726684 0.65378249 0.68349147 -0.12666279 -0.07188379 0.01331728  935  SCN   A C    
12710 N  N    . SCN   KA .   ? 0.48277640 0.34699807 0.37373441 -0.13295753 -0.07126895 0.01624366  935  SCN   A N    
12711 S  S    . SCN   LA .   ? 1.00352359 1.20937371 1.11939418 -0.04760711 -0.03974536 0.00810403  936  SCN   A S    
12712 C  C    . SCN   LA .   ? 0.80778641 1.00893807 0.92068708 -0.05135188 -0.04700385 0.01031482  936  SCN   A C    
12713 N  N    . SCN   LA .   ? 0.53441644 0.73131436 0.64419734 -0.05402349 -0.05226687 0.01182294  936  SCN   A N    
12714 S  S    . SCN   MA .   ? 0.94426012 0.99673718 0.94010764 -0.04536022 -0.03270619 0.02382895  937  SCN   A S    
12715 C  C    . SCN   MA .   ? 0.60984874 0.65293282 0.59936506 -0.04558525 -0.03613440 0.02584467  937  SCN   A C    
12716 N  N    . SCN   MA .   ? 0.33181718 0.36827716 0.31644401 -0.04605300 -0.03827119 0.02728869  937  SCN   A N    
12717 S  S    . SCN   NA .   ? 1.07171535 0.97168434 0.77325386 -0.15206015 -0.21672691 -0.07069099 938  SCN   A S    
12718 C  C    . SCN   NA .   ? 0.92730391 0.81644404 0.62526119 -0.14984873 -0.20412600 -0.07250105 938  SCN   A C    
12719 N  N    . SCN   NA .   ? 0.79574537 0.67683500 0.49103063 -0.14828368 -0.19545551 -0.07418496 938  SCN   A N    
12720 C  C1   . GOL   OA .   ? 0.70980769 0.66222477 0.64125121 -0.06702796 -0.03428436 0.02861812  939  GOL   A C1   
12721 O  O1   . GOL   OA .   ? 0.45444500 0.40990204 0.38677815 -0.06596263 -0.03383836 0.03058693  939  GOL   A O1   
12722 C  C2   . GOL   OA .   ? 0.64941734 0.59599179 0.57856238 -0.06330400 -0.03529153 0.02705157  939  GOL   A C2   
12723 O  O2   . GOL   OA .   ? 0.58185869 0.52291900 0.50870895 -0.06117219 -0.03632655 0.02869667  939  GOL   A O2   
12724 C  C3   . GOL   OA .   ? 0.53531343 0.47553888 0.46155652 -0.06487627 -0.03612884 0.02503938  939  GOL   A C3   
12725 O  O3   . GOL   OA .   ? 1.06954253 1.00045919 0.99202389 -0.06221475 -0.03740612 0.02447802  939  GOL   A O3   
12726 H  H11  . GOL   OA .   ? 0.61429900 0.56357116 0.54427308 -0.07001350 -0.03445228 0.02917892  939  GOL   A H11  
12727 H  H12  . GOL   OA .   ? 0.61532956 0.57262325 0.54902393 -0.06733069 -0.03381196 0.02757234  939  GOL   A H12  
12729 H  H2   . GOL   OA .   ? 0.60785151 0.55872375 0.53894389 -0.06100632 -0.03477091 0.02601725  939  GOL   A H2   
12731 H  H31  . GOL   OA .   ? 0.65533590 0.59465599 0.58116198 -0.06851353 -0.03622307 0.02574648  939  GOL   A H31  
12732 H  H32  . GOL   OA .   ? 0.65110254 0.59447789 0.57834244 -0.06418043 -0.03578788 0.02327969  939  GOL   A H32  
12733 H  HO3  . GOL   OA .   ? 0.85605371 0.78380740 0.77721232 -0.06292795 -0.03788684 0.02622398  939  GOL   A HO3  
12734 S  S    . SCN   PA .   ? 1.05908835 1.18435895 1.08773172 -0.04811244 -0.13880326 0.02647814  940  SCN   A S    
12735 C  C    . SCN   PA .   ? 0.71610790 0.82350934 0.72500753 -0.05117831 -0.13824700 0.02809437  940  SCN   A C    
12736 N  N    . SCN   PA .   ? 0.68600285 0.78067470 0.68060565 -0.05315546 -0.13755849 0.02918182  940  SCN   A N    
12737 S  S    . SCN   QA .   ? 1.07279587 1.00870752 0.95227396 -0.11958371 -0.09265462 -0.01060826 941  SCN   A S    
12738 C  C    . SCN   QA .   ? 0.97200668 0.89619225 0.84947479 -0.12358360 -0.09281303 -0.01271885 941  SCN   A C    
12739 N  N    . SCN   QA .   ? 0.81193000 0.72714722 0.68781507 -0.12679379 -0.09326027 -0.01407338 941  SCN   A N    
12740 S  S    . SCN   RA .   ? 1.02894926 0.95371091 0.79303646 -0.11180322 -0.12378567 -0.02325941 942  SCN   A S    
12741 C  C    . SCN   RA .   ? 0.76917028 0.70049387 0.53114069 -0.11142670 -0.13051111 -0.01888358 942  SCN   A C    
12742 N  N    . SCN   RA .   ? 0.57922232 0.51513219 0.33982211 -0.11074654 -0.13547732 -0.01546710 942  SCN   A N    
12743 S  S    . SCN   SA .   ? 1.15940654 1.09102643 1.01774383 -0.12497918 -0.10617670 -0.01891721 943  SCN   A S    
12744 C  C    . SCN   SA .   ? 0.48941517 0.41597831 0.34140670 -0.11803845 -0.09993090 -0.01908096 943  SCN   A C    
12745 N  N    . SCN   SA .   ? 0.96614027 0.89048874 0.81456065 -0.11297812 -0.09522355 -0.01890526 943  SCN   A N    
12746 S  S    . SCN   TA .   ? 0.94319248 0.95044243 0.83975077 -0.09507419 -0.00118256 0.04178811  944  SCN   A S    
12747 C  C    . SCN   TA .   ? 0.63920581 0.64495897 0.54382676 -0.09108253 -0.00571113 0.04085697  944  SCN   A C    
12748 N  N    . SCN   TA .   ? 0.62638336 0.63073105 0.53617513 -0.08836115 -0.00892449 0.04028112  944  SCN   A N    
12749 S  S    . SCN   UA .   ? 0.96564817 0.98380941 0.91588342 -0.07476248 -0.01848881 0.03314634  945  SCN   A S    
12750 C  C    . SCN   UA .   ? 0.77863348 0.79103625 0.72842962 -0.07383138 -0.02195056 0.03375870  945  SCN   A C    
12751 N  N    . SCN   UA .   ? 0.53198397 0.54074717 0.48166615 -0.07305177 -0.02419125 0.03396887  945  SCN   A N    
12752 S  S    . SCN   VA .   ? 1.05439866 1.13086843 1.07203925 -0.05770276 -0.01919500 0.00796483  946  SCN   A S    
12753 C  C    . SCN   VA .   ? 0.47496462 0.56387943 0.50453752 -0.05511841 -0.02020573 0.00503461  946  SCN   A C    
12754 N  N    . SCN   VA .   ? 0.44781190 0.54646766 0.48663348 -0.05293765 -0.02093358 0.00270745  946  SCN   A N    
12755 P  P    . PO4   WA .   ? 1.11126924 1.08003569 1.03698635 -0.04689526 -0.07037319 0.03936274  947  PO4   A P    
12756 O  O1   . PO4   WA .   ? 0.37290162 0.34625429 0.30619907 -0.04694213 -0.06589888 0.03714640  947  PO4   A O1   
12757 O  O2   . PO4   WA .   ? 0.62161183 0.57982397 0.53883159 -0.04662986 -0.07234378 0.04265710  947  PO4   A O2   
12758 O  O3   . PO4   WA .   ? 1.54173899 1.51549029 1.47329473 -0.04328415 -0.07525768 0.03797518  947  PO4   A O3   
12759 O  O4   . PO4   WA .   ? 0.59781748 0.56760782 0.51841992 -0.05082263 -0.06811117 0.03952069  947  PO4   A O4   
12760 S  S    . SCN   XA .   ? 1.19912314 1.08224118 0.93387437 -0.09996150 -0.04473235 0.08069052  948  SCN   A S    
12761 C  C    . SCN   XA .   ? 0.86643052 0.73822683 0.59646600 -0.10220946 -0.04560012 0.08645063  948  SCN   A C    
12762 N  N    . SCN   XA .   ? 0.75879145 0.62186480 0.48507157 -0.10415255 -0.04604346 0.09054926  948  SCN   A N    
12763 C  C1   . GOL   YA .   ? 0.49670193 0.44671625 0.41913718 -0.08195428 -0.04008218 0.04170061  949  GOL   A C1   
12764 O  O1   . GOL   YA .   ? 0.39559692 0.34346074 0.31466308 -0.08734167 -0.03911508 0.04419395  949  GOL   A O1   
12765 C  C2   . GOL   YA .   ? 0.57454860 0.52016592 0.49762297 -0.08095104 -0.04188940 0.03962557  949  GOL   A C2   
12766 O  O2   . GOL   YA .   ? 0.70768702 0.65327710 0.63096273 -0.08585431 -0.04146256 0.03981549  949  GOL   A O2   
12767 C  C3   . GOL   YA .   ? 0.60508746 0.55648673 0.53287876 -0.07697638 -0.04150526 0.03670486  949  GOL   A C3   
12768 O  O3   . GOL   YA .   ? 0.50539827 0.46535626 0.43739516 -0.07871556 -0.03959824 0.03596852  949  GOL   A O3   
12769 H  H11  . GOL   YA .   ? 0.48355168 0.43078393 0.40401864 -0.07950268 -0.04115935 0.04220163  949  GOL   A H11  
12770 H  H12  . GOL   YA .   ? 0.47509700 0.43233532 0.40127501 -0.08130342 -0.03848579 0.04073621  949  GOL   A H12  
12772 H  H2   . GOL   YA .   ? 0.58706445 0.52545035 0.50686383 -0.07968922 -0.04376687 0.04002205  949  GOL   A H2   
12774 H  H31  . GOL   YA .   ? 0.57409185 0.52146280 0.50115818 -0.07583720 -0.04277101 0.03532518  949  GOL   A H31  
12775 H  H32  . GOL   YA .   ? 0.56293178 0.51596487 0.49140361 -0.07422036 -0.04143249 0.03662833  949  GOL   A H32  
12776 H  HO3  . GOL   YA .   ? 0.53458488 0.49349493 0.46633428 -0.08104028 -0.03989122 0.03588703  949  GOL   A HO3  
12777 C  C1   . GOL   ZA .   ? 0.64251834 0.55396378 0.55024248 -0.06533375 -0.04972031 0.00655098  950  GOL   A C1   
12778 O  O1   . GOL   ZA .   ? 0.64572620 0.56744188 0.55885905 -0.06555971 -0.04786884 0.00979470  950  GOL   A O1   
12779 C  C2   . GOL   ZA .   ? 0.68948632 0.59060407 0.59550315 -0.06347203 -0.05160041 0.00708975  950  GOL   A C2   
12780 O  O2   . GOL   ZA .   ? 0.43310213 0.33217299 0.33950287 -0.06812128 -0.05299595 0.01133237  950  GOL   A O2   
12781 C  C3   . GOL   ZA .   ? 0.56890678 0.45797512 0.46896261 -0.06208357 -0.05354040 0.00308470  950  GOL   A C3   
12782 O  O3   . GOL   ZA .   ? 0.87848639 0.75958925 0.77442169 -0.06799652 -0.05621721 0.00388483  950  GOL   A O3   
12783 H  H11  . GOL   ZA .   ? 0.65430194 0.56661165 0.56091702 -0.06250974 -0.04861600 0.00369490  950  GOL   A H11  
12784 H  H12  . GOL   ZA .   ? 0.65682238 0.56673205 0.56268907 -0.06925669 -0.05100286 0.00668248  950  GOL   A H12  
12786 H  H2   . GOL   ZA .   ? 0.58710492 0.49082953 0.49562767 -0.05956736 -0.05053926 0.00708906  950  GOL   A H2   
12788 H  H31  . GOL   ZA .   ? 0.65905255 0.54309177 0.55882692 -0.05850386 -0.05415250 0.00264289  950  GOL   A H31  
12789 H  H32  . GOL   ZA .   ? 0.65695953 0.54850173 0.55608976 -0.06046600 -0.05236567 0.00012452  950  GOL   A H32  
12790 H  HO3  . GOL   ZA .   ? 0.75975811 0.64490426 0.65773314 -0.07120129 -0.05609866 0.00656657  950  GOL   A HO3  
12798 O  O    . HOH   FB .   ? 0.43283382 0.41516080 0.36156711 -0.09206620 -0.02669477 0.04436224  5601 HOH   A O    
12804 O  O    . HOH   FB .   ? 0.40442091 0.38857350 0.31872404 -0.03813811 -0.00964907 -0.00509221 5607 HOH   A O    
12805 O  O    . HOH   FB .   ? 0.27884933 0.27514094 0.22805275 -0.06279912 -0.03029644 0.03010078  5608 HOH   A O    
12821 O  O    . HOH   FB .   ? 0.33121794 0.29281759 0.28497997 -0.02926117 -0.04387857 0.00949502  5624 HOH   A O    
12828 O  O    . HOH   FB .   ? 0.31029576 0.32381970 0.26618585 -0.06454770 -0.01907359 0.02214223  5631 HOH   A O    
12829 O  O    . HOH   FB .   ? 0.37694818 0.35249108 0.31338832 -0.07901128 -0.02620977 0.03539111  5632 HOH   A O    
12837 O  O    . HOH   FB .   ? 0.20227355 0.18800440 0.14467357 -0.06442448 -0.03023538 0.03312198  5640 HOH   A O    
12870 O  O    . HOH   FB .   ? 0.52560705 0.53523868 0.45610490 -0.07535674 -0.01486208 0.03345196  5673 HOH   A O    
12877 O  O    . HOH   FB .   ? 0.27029923 0.29969317 0.24600489 -0.08848511 -0.01810222 0.02503846  5680 HOH   A O    
12887 O  O    . HOH   FB .   ? 0.26425874 0.27051800 0.21066752 -0.09094433 -0.07712585 0.00650683  5690 HOH   A O    
12889 O  O    . HOH   FB .   ? 0.43146288 0.28361914 0.26251096 -0.08064071 -0.06053589 -0.03856131 5692 HOH   A O    
12894 O  O    . HOH   FB .   ? 0.24368870 0.26766181 0.21990794 -0.08529326 -0.02533671 0.02413546  5697 HOH   A O    
12899 O  O    . HOH   FB .   ? 0.35643181 0.42410028 0.35562116 -0.09768378 -0.10539147 0.00056060  5702 HOH   A O    
12924 O  O    . HOH   FB .   ? 0.51845002 0.52597845 0.45486596 -0.05529047 -0.09581153 0.02619315  5727 HOH   A O    
12927 O  O    . HOH   FB .   ? 0.28259334 0.27225757 0.23207206 -0.04676081 -0.02783663 0.02166542  5730 HOH   A O    
12930 O  O    . HOH   FB .   ? 0.27582780 0.27213758 0.22630012 -0.06232697 -0.03164459 0.02954436  5733 HOH   A O    
12931 O  O    . HOH   FB .   ? 0.32110566 0.32895687 0.31547481 -0.01316628 -0.04884767 0.00536632  5734 HOH   A O    
12932 O  O    . HOH   FB .   ? 0.39832759 0.34891987 0.35474363 -0.00671397 -0.04231245 -0.01031488 5735 HOH   A O    
12947 O  O    . HOH   FB .   ? 0.60612512 0.48498821 0.49170837 -0.11432877 -0.07308332 -0.00023231 5750 HOH   A O    
12949 O  O    . HOH   FB .   ? 0.27422506 0.26693052 0.21685515 -0.06656366 -0.02733537 0.03178366  5752 HOH   A O    
12962 O  O    . HOH   FB .   ? 0.31796324 0.23918147 0.22678044 -0.08684386 -0.04866980 0.00487232  5765 HOH   A O    
12970 O  O    . HOH   FB .   ? 0.19152233 0.18791758 0.13988252 -0.06312679 -0.03181452 0.02993133  5773 HOH   A O    
12974 O  O    . HOH   FB .   ? 0.42343238 0.42278564 0.38015750 -0.05027223 -0.03183764 0.02821832  5777 HOH   A O    
12984 O  O    . HOH   FB .   ? 0.29586220 0.28865927 0.22756612 -0.06566086 -0.02750205 0.02805559  5787 HOH   A O    
12985 O  O    . HOH   FB .   ? 0.50188500 0.44430444 0.41859496 -0.09189243 -0.02775017 0.04232243  5788 HOH   A O    
12987 O  O    . HOH   FB .   ? 0.37883794 0.33094817 0.24578308 -0.07307036 -0.04819862 0.04799429  5790 HOH   A O    
12990 O  O    . HOH   FB .   ? 0.39062244 0.46136695 0.38019753 -0.06439228 -0.13394125 0.00989485  5793 HOH   A O    
12998 O  O    . HOH   FB .   ? 0.26216364 0.25451016 0.20213681 -0.06303506 -0.03806634 0.02861143  5801 HOH   A O    
13002 O  O    . HOH   FB .   ? 0.31534427 0.30861190 0.25407481 -0.07241419 -0.02266261 0.03263441  5805 HOH   A O    
13012 O  O    . HOH   FB .   ? 0.37865612 0.44045186 0.37913629 -0.04256111 -0.00978712 -0.00117188 5815 HOH   A O    
13023 O  O    . HOH   FB .   ? 0.54534292 0.51279289 0.52682781 0.02050562  -0.04234790 -0.02552122 5826 HOH   A O    
13024 O  O    . HOH   FB .   ? 0.35767227 0.31859905 0.28169173 -0.07665786 -0.02879867 0.04001978  5827 HOH   A O    
13038 O  O    . HOH   FB .   ? 0.39785683 0.39938331 0.34912908 -0.01716909 -0.01061827 -0.00681730 5841 HOH   A O    
13044 O  O    . HOH   FB .   ? 0.70273924 0.43694371 0.54012042 -0.09787182 -0.08560599 0.02159656  5847 HOH   A O    
13061 O  O    . HOH   FB .   ? 0.44191378 0.42355072 0.41457146 -0.00431286 -0.03375146 -0.01483965 5864 HOH   A O    
13064 O  O    . HOH   FB .   ? 0.68100321 0.47356209 0.54123580 -0.09392390 -0.07575873 0.00765295  5867 HOH   A O    
13131 O  O    . HOH   FB .   ? 0.53658974 0.56133735 0.50436008 -0.03347220 -0.01501402 0.00975674  5934 HOH   A O    
13141 O  O    . HOH   FB .   ? 0.93307233 0.76124370 0.50443327 -0.10070371 -0.09387922 -0.08162571 5944 HOH   A O    
# 
