data_8XYI
# 
_entry.id   8XYI 
# 
_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   8XYI         pdb_00008xyi 10.2210/pdb8xyi/pdb 
WWPDB D_1300044515 ?            ?                   
EMDB  EMD-38774    ?            ?                   
# 
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 2025-02-26 ? 
2 'EM metadata'     1 0 2025-02-26 ? 
3 FSC               1 0 2025-02-26 ? 
4 'Half map'        1 0 2025-02-26 1 
5 'Half map'        1 0 2025-02-26 2 
6 Image             1 0 2025-02-26 ? 
7 'Primary map'     1 0 2025-02-26 ? 
8 'Structure model' 1 1 2025-04-09 ? 
# 
loop_
_pdbx_audit_revision_details.ordinal 
_pdbx_audit_revision_details.revision_ordinal 
_pdbx_audit_revision_details.data_content_type 
_pdbx_audit_revision_details.provider 
_pdbx_audit_revision_details.type 
_pdbx_audit_revision_details.description 
_pdbx_audit_revision_details.details 
1 1 'Structure model' repository 'Initial release' ? ? 
2 2 'EM metadata'     repository 'Initial release' ? ? 
3 3 FSC               repository 'Initial release' ? ? 
4 4 'Half map'        repository 'Initial release' ? ? 
5 5 'Half map'        repository 'Initial release' ? ? 
6 6 Image             repository 'Initial release' ? ? 
7 7 'Primary map'     repository 'Initial release' ? ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1 8 'Structure model' 'Data collection'     
2 8 'Structure model' 'Database references' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 8 'Structure model' citation        
2 8 'Structure model' citation_author 
3 8 'Structure model' em_admin        
# 
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  8 'Structure model' '_citation.country'                 
2  8 'Structure model' '_citation.journal_abbrev'          
3  8 'Structure model' '_citation.journal_id_CSD'          
4  8 'Structure model' '_citation.journal_id_ISSN'         
5  8 'Structure model' '_citation.journal_volume'          
6  8 'Structure model' '_citation.page_first'              
7  8 'Structure model' '_citation.page_last'               
8  8 'Structure model' '_citation.pdbx_database_id_DOI'    
9  8 'Structure model' '_citation.pdbx_database_id_PubMed' 
10 8 'Structure model' '_citation.title'                   
11 8 'Structure model' '_citation.year'                    
12 8 'Structure model' '_em_admin.last_update'             
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  ? 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        8XYI 
_pdbx_database_status.recvd_initial_deposition_date   2024-01-19 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBJ 
_pdbx_database_status.process_site                    PDBJ 
_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 
# 
_pdbx_database_related.db_name        EMDB 
_pdbx_database_related.details        'Structure of CXCR3 in complex with VUF10661 (Receptor-ligand focused map)' 
_pdbx_database_related.db_id          EMD-38774 
_pdbx_database_related.content_type   'associated EM volume' 
# 
loop_
_pdbx_contact_author.id 
_pdbx_contact_author.email 
_pdbx_contact_author.name_first 
_pdbx_contact_author.name_last 
_pdbx_contact_author.name_mi 
_pdbx_contact_author.role 
_pdbx_contact_author.identifier_ORCID 
2 arshukla@iitk.ac.in       Arun  Shukla K 'principal investigator/group leader' 0000-0003-2910-8288 
3 nureki@bs.s.u-tokyo.ac.jp Osamu Nureki ? 'principal investigator/group leader' 0000-0003-1813-7008 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Sano, F.K.'   1 0000-0002-8965-788X 
'Saha, S.'     2 0000-0002-0036-4969 
'Sharma, S.'   3 0009-0005-9109-9054 
'Ganguly, M.'  4 0009-0007-6165-3063 
'Shihoya, W.'  5 0000-0003-4813-5740 
'Nureki, O.'   6 0000-0003-1813-7008 
'Shukla, A.K.' 7 0000-0003-2910-8288 
'Banerjee, R.' 8 0000-0002-7751-2317 
# 
_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            'Nat Commun' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2041-1723 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            16 
_citation.language                  ? 
_citation.page_first                3047 
_citation.page_last                 3047 
_citation.title                     
'Structural visualization of small molecule recognition by CXCR3 uncovers dual-agonism in the CXCR3-CXCR7 system.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1038/s41467-025-58264-w 
_citation.pdbx_database_id_PubMed   40155369 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Saha, S.'        1  ?                   
primary 'Sano, F.K.'      2  0000-0002-8965-788X 
primary 'Sharma, S.'      3  0009-0005-9109-9054 
primary 'Ganguly, M.'     4  ?                   
primary 'Dalal, A.'       5  ?                   
primary 'Mishra, S.'      6  ?                   
primary 'Tiwari, D.'      7  ?                   
primary 'Akasaka, H.'     8  0000-0003-2118-0912 
primary 'Kobayashi, T.A.' 9  0009-0007-4740-006X 
primary 'Roy, N.'         10 ?                   
primary 'Zaidi, N.'       11 ?                   
primary 'Itoh, Y.'        12 0000-0001-7802-5572 
primary 'Leurs, R.'       13 0000-0003-1354-2848 
primary 'Banerjee, R.'    14 0000-0002-7751-2317 
primary 'Shihoya, W.'     15 0000-0003-4813-5740 
primary 'Nureki, O.'      16 0000-0003-1813-7008 
primary 'Shukla, A.K.'    17 0000-0003-2910-8288 
# 
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 'C-X-C chemokine receptor type 3' 46597.906 1 ? ? ? ? 
2 non-polymer syn 
;(3~{S})-~{N}-[(2~{S})-6-azanyl-1-(2,2-diphenylethylamino)-1-oxidanylidene-hexan-2-yl]-2-(4-oxidanylidene-4-phenyl-butanoyl)-3,4-dihydro-1~{H}-isoquinoline-3-carboxamide
;
644.802   1 ? ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        CXC-R3,CXCR-3,CKR-L2 
# 
_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       
;MGKTIIALSYIFCLVFADYKDDDDAANFTPVNGSSGNQSVRLVTSSSLEVLFQGPGSVLEVSDHQVLNDAEVAALLENFS
SSYDYGENESDSCCTSPPCPQDFSLNFDRAFLPALYSLLFLLGLLGNGAVAAVLLSRRTALSSTDTFLLHLAVADTLLVL
TLPLWAVDAAVQWVFGSGLCKVAGALFNINFYAGALLLACISFDRYLNIVHATQLYRRGPPARVTLTCLAVWGLCLLFAL
PDFIFLSAHHDERLNATHCQYNFPQVGRTALRVLQLVAGFLLPLLVMAYCYAHILAVLLVSRGQRRLRAMRLVVVVVVAF
ALCWTPYHLVVLVDILMDLGALARNCGRESRVDVAKSVTSGLGYMHCCLNPLLYAFVGVKFRERMWMLLLRLGCPNQRGL
QRQPSSSRRDSSWSETSEASYSGL
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MGKTIIALSYIFCLVFADYKDDDDAANFTPVNGSSGNQSVRLVTSSSLEVLFQGPGSVLEVSDHQVLNDAEVAALLENFS
SSYDYGENESDSCCTSPPCPQDFSLNFDRAFLPALYSLLFLLGLLGNGAVAAVLLSRRTALSSTDTFLLHLAVADTLLVL
TLPLWAVDAAVQWVFGSGLCKVAGALFNINFYAGALLLACISFDRYLNIVHATQLYRRGPPARVTLTCLAVWGLCLLFAL
PDFIFLSAHHDERLNATHCQYNFPQVGRTALRVLQLVAGFLLPLLVMAYCYAHILAVLLVSRGQRRLRAMRLVVVVVVAF
ALCWTPYHLVVLVDILMDLGALARNCGRESRVDVAKSVTSGLGYMHCCLNPLLYAFVGVKFRERMWMLLLRLGCPNQRGL
QRQPSSSRRDSSWSETSEASYSGL
;
_entity_poly.pdbx_strand_id                 R 
_entity_poly.pdbx_target_identifier         ? 
# 
_pdbx_entity_nonpoly.entity_id   2 
_pdbx_entity_nonpoly.name        
;(3~{S})-~{N}-[(2~{S})-6-azanyl-1-(2,2-diphenylethylamino)-1-oxidanylidene-hexan-2-yl]-2-(4-oxidanylidene-4-phenyl-butanoyl)-3,4-dihydro-1~{H}-isoquinoline-3-carboxamide
;
_pdbx_entity_nonpoly.comp_id     A1LW1 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   GLY n 
1 3   LYS n 
1 4   THR n 
1 5   ILE n 
1 6   ILE n 
1 7   ALA n 
1 8   LEU n 
1 9   SER n 
1 10  TYR n 
1 11  ILE n 
1 12  PHE n 
1 13  CYS n 
1 14  LEU n 
1 15  VAL n 
1 16  PHE n 
1 17  ALA n 
1 18  ASP n 
1 19  TYR n 
1 20  LYS n 
1 21  ASP n 
1 22  ASP n 
1 23  ASP n 
1 24  ASP n 
1 25  ALA n 
1 26  ALA n 
1 27  ASN n 
1 28  PHE n 
1 29  THR n 
1 30  PRO n 
1 31  VAL n 
1 32  ASN n 
1 33  GLY n 
1 34  SER n 
1 35  SER n 
1 36  GLY n 
1 37  ASN n 
1 38  GLN n 
1 39  SER n 
1 40  VAL n 
1 41  ARG n 
1 42  LEU n 
1 43  VAL n 
1 44  THR n 
1 45  SER n 
1 46  SER n 
1 47  SER n 
1 48  LEU n 
1 49  GLU n 
1 50  VAL n 
1 51  LEU n 
1 52  PHE n 
1 53  GLN n 
1 54  GLY n 
1 55  PRO n 
1 56  GLY n 
1 57  SER n 
1 58  VAL n 
1 59  LEU n 
1 60  GLU n 
1 61  VAL n 
1 62  SER n 
1 63  ASP n 
1 64  HIS n 
1 65  GLN n 
1 66  VAL n 
1 67  LEU n 
1 68  ASN n 
1 69  ASP n 
1 70  ALA n 
1 71  GLU n 
1 72  VAL n 
1 73  ALA n 
1 74  ALA n 
1 75  LEU n 
1 76  LEU n 
1 77  GLU n 
1 78  ASN n 
1 79  PHE n 
1 80  SER n 
1 81  SER n 
1 82  SER n 
1 83  TYR n 
1 84  ASP n 
1 85  TYR n 
1 86  GLY n 
1 87  GLU n 
1 88  ASN n 
1 89  GLU n 
1 90  SER n 
1 91  ASP n 
1 92  SER n 
1 93  CYS n 
1 94  CYS n 
1 95  THR n 
1 96  SER n 
1 97  PRO n 
1 98  PRO n 
1 99  CYS n 
1 100 PRO n 
1 101 GLN n 
1 102 ASP n 
1 103 PHE n 
1 104 SER n 
1 105 LEU n 
1 106 ASN n 
1 107 PHE n 
1 108 ASP n 
1 109 ARG n 
1 110 ALA n 
1 111 PHE n 
1 112 LEU n 
1 113 PRO n 
1 114 ALA n 
1 115 LEU n 
1 116 TYR n 
1 117 SER n 
1 118 LEU n 
1 119 LEU n 
1 120 PHE n 
1 121 LEU n 
1 122 LEU n 
1 123 GLY n 
1 124 LEU n 
1 125 LEU n 
1 126 GLY n 
1 127 ASN n 
1 128 GLY n 
1 129 ALA n 
1 130 VAL n 
1 131 ALA n 
1 132 ALA n 
1 133 VAL n 
1 134 LEU n 
1 135 LEU n 
1 136 SER n 
1 137 ARG n 
1 138 ARG n 
1 139 THR n 
1 140 ALA n 
1 141 LEU n 
1 142 SER n 
1 143 SER n 
1 144 THR n 
1 145 ASP n 
1 146 THR n 
1 147 PHE n 
1 148 LEU n 
1 149 LEU n 
1 150 HIS n 
1 151 LEU n 
1 152 ALA n 
1 153 VAL n 
1 154 ALA n 
1 155 ASP n 
1 156 THR n 
1 157 LEU n 
1 158 LEU n 
1 159 VAL n 
1 160 LEU n 
1 161 THR n 
1 162 LEU n 
1 163 PRO n 
1 164 LEU n 
1 165 TRP n 
1 166 ALA n 
1 167 VAL n 
1 168 ASP n 
1 169 ALA n 
1 170 ALA n 
1 171 VAL n 
1 172 GLN n 
1 173 TRP n 
1 174 VAL n 
1 175 PHE n 
1 176 GLY n 
1 177 SER n 
1 178 GLY n 
1 179 LEU n 
1 180 CYS n 
1 181 LYS n 
1 182 VAL n 
1 183 ALA n 
1 184 GLY n 
1 185 ALA n 
1 186 LEU n 
1 187 PHE n 
1 188 ASN n 
1 189 ILE n 
1 190 ASN n 
1 191 PHE n 
1 192 TYR n 
1 193 ALA n 
1 194 GLY n 
1 195 ALA n 
1 196 LEU n 
1 197 LEU n 
1 198 LEU n 
1 199 ALA n 
1 200 CYS n 
1 201 ILE n 
1 202 SER n 
1 203 PHE n 
1 204 ASP n 
1 205 ARG n 
1 206 TYR n 
1 207 LEU n 
1 208 ASN n 
1 209 ILE n 
1 210 VAL n 
1 211 HIS n 
1 212 ALA n 
1 213 THR n 
1 214 GLN n 
1 215 LEU n 
1 216 TYR n 
1 217 ARG n 
1 218 ARG n 
1 219 GLY n 
1 220 PRO n 
1 221 PRO n 
1 222 ALA n 
1 223 ARG n 
1 224 VAL n 
1 225 THR n 
1 226 LEU n 
1 227 THR n 
1 228 CYS n 
1 229 LEU n 
1 230 ALA n 
1 231 VAL n 
1 232 TRP n 
1 233 GLY n 
1 234 LEU n 
1 235 CYS n 
1 236 LEU n 
1 237 LEU n 
1 238 PHE n 
1 239 ALA n 
1 240 LEU n 
1 241 PRO n 
1 242 ASP n 
1 243 PHE n 
1 244 ILE n 
1 245 PHE n 
1 246 LEU n 
1 247 SER n 
1 248 ALA n 
1 249 HIS n 
1 250 HIS n 
1 251 ASP n 
1 252 GLU n 
1 253 ARG n 
1 254 LEU n 
1 255 ASN n 
1 256 ALA n 
1 257 THR n 
1 258 HIS n 
1 259 CYS n 
1 260 GLN n 
1 261 TYR n 
1 262 ASN n 
1 263 PHE n 
1 264 PRO n 
1 265 GLN n 
1 266 VAL n 
1 267 GLY n 
1 268 ARG n 
1 269 THR n 
1 270 ALA n 
1 271 LEU n 
1 272 ARG n 
1 273 VAL n 
1 274 LEU n 
1 275 GLN n 
1 276 LEU n 
1 277 VAL n 
1 278 ALA n 
1 279 GLY n 
1 280 PHE n 
1 281 LEU n 
1 282 LEU n 
1 283 PRO n 
1 284 LEU n 
1 285 LEU n 
1 286 VAL n 
1 287 MET n 
1 288 ALA n 
1 289 TYR n 
1 290 CYS n 
1 291 TYR n 
1 292 ALA n 
1 293 HIS n 
1 294 ILE n 
1 295 LEU n 
1 296 ALA n 
1 297 VAL n 
1 298 LEU n 
1 299 LEU n 
1 300 VAL n 
1 301 SER n 
1 302 ARG n 
1 303 GLY n 
1 304 GLN n 
1 305 ARG n 
1 306 ARG n 
1 307 LEU n 
1 308 ARG n 
1 309 ALA n 
1 310 MET n 
1 311 ARG n 
1 312 LEU n 
1 313 VAL n 
1 314 VAL n 
1 315 VAL n 
1 316 VAL n 
1 317 VAL n 
1 318 VAL n 
1 319 ALA n 
1 320 PHE n 
1 321 ALA n 
1 322 LEU n 
1 323 CYS n 
1 324 TRP n 
1 325 THR n 
1 326 PRO n 
1 327 TYR n 
1 328 HIS n 
1 329 LEU n 
1 330 VAL n 
1 331 VAL n 
1 332 LEU n 
1 333 VAL n 
1 334 ASP n 
1 335 ILE n 
1 336 LEU n 
1 337 MET n 
1 338 ASP n 
1 339 LEU n 
1 340 GLY n 
1 341 ALA n 
1 342 LEU n 
1 343 ALA n 
1 344 ARG n 
1 345 ASN n 
1 346 CYS n 
1 347 GLY n 
1 348 ARG n 
1 349 GLU n 
1 350 SER n 
1 351 ARG n 
1 352 VAL n 
1 353 ASP n 
1 354 VAL n 
1 355 ALA n 
1 356 LYS n 
1 357 SER n 
1 358 VAL n 
1 359 THR n 
1 360 SER n 
1 361 GLY n 
1 362 LEU n 
1 363 GLY n 
1 364 TYR n 
1 365 MET n 
1 366 HIS n 
1 367 CYS n 
1 368 CYS n 
1 369 LEU n 
1 370 ASN n 
1 371 PRO n 
1 372 LEU n 
1 373 LEU n 
1 374 TYR n 
1 375 ALA n 
1 376 PHE n 
1 377 VAL n 
1 378 GLY n 
1 379 VAL n 
1 380 LYS n 
1 381 PHE n 
1 382 ARG n 
1 383 GLU n 
1 384 ARG n 
1 385 MET n 
1 386 TRP n 
1 387 MET n 
1 388 LEU n 
1 389 LEU n 
1 390 LEU n 
1 391 ARG n 
1 392 LEU n 
1 393 GLY n 
1 394 CYS n 
1 395 PRO n 
1 396 ASN n 
1 397 GLN n 
1 398 ARG n 
1 399 GLY n 
1 400 LEU n 
1 401 GLN n 
1 402 ARG n 
1 403 GLN n 
1 404 PRO n 
1 405 SER n 
1 406 SER n 
1 407 SER n 
1 408 ARG n 
1 409 ARG n 
1 410 ASP n 
1 411 SER n 
1 412 SER n 
1 413 TRP n 
1 414 SER n 
1 415 GLU n 
1 416 THR n 
1 417 SER n 
1 418 GLU n 
1 419 ALA n 
1 420 SER n 
1 421 TYR n 
1 422 SER n 
1 423 GLY n 
1 424 LEU 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                   424 
_entity_src_gen.gene_src_common_name               human 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 CXCR3 
_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      'Homo sapiens' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     9606 
_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      'Spodoptera frugiperda' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     7108 
_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                   ? 
# 
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 
A1LW1 non-polymer         . 
;(3~{S})-~{N}-[(2~{S})-6-azanyl-1-(2,2-diphenylethylamino)-1-oxidanylidene-hexan-2-yl]-2-(4-oxidanylidene-4-phenyl-butanoyl)-3,4-dihydro-1~{H}-isoquinoline-3-carboxamide
;
? 'C40 H44 N4 O4'  644.802 
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 
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  
HIS   'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 
ILE   'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2'    131.173 
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 
PHE   'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2'    165.189 
PRO   'L-peptide linking' y PROLINE ? 'C5 H9 N O2'     115.130 
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 
# 
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   MET 1   -55 ?   ?   ?   R . n 
A 1 2   GLY 2   -54 ?   ?   ?   R . n 
A 1 3   LYS 3   -53 ?   ?   ?   R . n 
A 1 4   THR 4   -52 ?   ?   ?   R . n 
A 1 5   ILE 5   -51 ?   ?   ?   R . n 
A 1 6   ILE 6   -50 ?   ?   ?   R . n 
A 1 7   ALA 7   -49 ?   ?   ?   R . n 
A 1 8   LEU 8   -48 ?   ?   ?   R . n 
A 1 9   SER 9   -47 ?   ?   ?   R . n 
A 1 10  TYR 10  -46 ?   ?   ?   R . n 
A 1 11  ILE 11  -45 ?   ?   ?   R . n 
A 1 12  PHE 12  -44 ?   ?   ?   R . n 
A 1 13  CYS 13  -43 ?   ?   ?   R . n 
A 1 14  LEU 14  -42 ?   ?   ?   R . n 
A 1 15  VAL 15  -41 ?   ?   ?   R . n 
A 1 16  PHE 16  -40 ?   ?   ?   R . n 
A 1 17  ALA 17  -39 ?   ?   ?   R . n 
A 1 18  ASP 18  -38 ?   ?   ?   R . n 
A 1 19  TYR 19  -37 ?   ?   ?   R . n 
A 1 20  LYS 20  -36 ?   ?   ?   R . n 
A 1 21  ASP 21  -35 ?   ?   ?   R . n 
A 1 22  ASP 22  -34 ?   ?   ?   R . n 
A 1 23  ASP 23  -33 ?   ?   ?   R . n 
A 1 24  ASP 24  -32 ?   ?   ?   R . n 
A 1 25  ALA 25  -31 ?   ?   ?   R . n 
A 1 26  ALA 26  -30 ?   ?   ?   R . n 
A 1 27  ASN 27  -29 ?   ?   ?   R . n 
A 1 28  PHE 28  -28 ?   ?   ?   R . n 
A 1 29  THR 29  -27 ?   ?   ?   R . n 
A 1 30  PRO 30  -26 ?   ?   ?   R . n 
A 1 31  VAL 31  -25 ?   ?   ?   R . n 
A 1 32  ASN 32  -24 ?   ?   ?   R . n 
A 1 33  GLY 33  -23 ?   ?   ?   R . n 
A 1 34  SER 34  -22 ?   ?   ?   R . n 
A 1 35  SER 35  -21 ?   ?   ?   R . n 
A 1 36  GLY 36  -20 ?   ?   ?   R . n 
A 1 37  ASN 37  -19 ?   ?   ?   R . n 
A 1 38  GLN 38  -18 ?   ?   ?   R . n 
A 1 39  SER 39  -17 ?   ?   ?   R . n 
A 1 40  VAL 40  -16 ?   ?   ?   R . n 
A 1 41  ARG 41  -15 ?   ?   ?   R . n 
A 1 42  LEU 42  -14 ?   ?   ?   R . n 
A 1 43  VAL 43  -13 ?   ?   ?   R . n 
A 1 44  THR 44  -12 ?   ?   ?   R . n 
A 1 45  SER 45  -11 ?   ?   ?   R . n 
A 1 46  SER 46  -10 ?   ?   ?   R . n 
A 1 47  SER 47  -9  ?   ?   ?   R . n 
A 1 48  LEU 48  -8  ?   ?   ?   R . n 
A 1 49  GLU 49  -7  ?   ?   ?   R . n 
A 1 50  VAL 50  -6  ?   ?   ?   R . n 
A 1 51  LEU 51  -5  ?   ?   ?   R . n 
A 1 52  PHE 52  -4  ?   ?   ?   R . n 
A 1 53  GLN 53  -3  ?   ?   ?   R . n 
A 1 54  GLY 54  -2  ?   ?   ?   R . n 
A 1 55  PRO 55  -1  ?   ?   ?   R . n 
A 1 56  GLY 56  0   ?   ?   ?   R . n 
A 1 57  SER 57  1   ?   ?   ?   R . n 
A 1 58  VAL 58  2   ?   ?   ?   R . n 
A 1 59  LEU 59  3   ?   ?   ?   R . n 
A 1 60  GLU 60  4   ?   ?   ?   R . n 
A 1 61  VAL 61  5   ?   ?   ?   R . n 
A 1 62  SER 62  6   ?   ?   ?   R . n 
A 1 63  ASP 63  7   ?   ?   ?   R . n 
A 1 64  HIS 64  8   ?   ?   ?   R . n 
A 1 65  GLN 65  9   ?   ?   ?   R . n 
A 1 66  VAL 66  10  ?   ?   ?   R . n 
A 1 67  LEU 67  11  ?   ?   ?   R . n 
A 1 68  ASN 68  12  ?   ?   ?   R . n 
A 1 69  ASP 69  13  ?   ?   ?   R . n 
A 1 70  ALA 70  14  ?   ?   ?   R . n 
A 1 71  GLU 71  15  ?   ?   ?   R . n 
A 1 72  VAL 72  16  ?   ?   ?   R . n 
A 1 73  ALA 73  17  ?   ?   ?   R . n 
A 1 74  ALA 74  18  ?   ?   ?   R . n 
A 1 75  LEU 75  19  ?   ?   ?   R . n 
A 1 76  LEU 76  20  ?   ?   ?   R . n 
A 1 77  GLU 77  21  ?   ?   ?   R . n 
A 1 78  ASN 78  22  ?   ?   ?   R . n 
A 1 79  PHE 79  23  ?   ?   ?   R . n 
A 1 80  SER 80  24  ?   ?   ?   R . n 
A 1 81  SER 81  25  ?   ?   ?   R . n 
A 1 82  SER 82  26  ?   ?   ?   R . n 
A 1 83  TYR 83  27  ?   ?   ?   R . n 
A 1 84  ASP 84  28  ?   ?   ?   R . n 
A 1 85  TYR 85  29  ?   ?   ?   R . n 
A 1 86  GLY 86  30  ?   ?   ?   R . n 
A 1 87  GLU 87  31  ?   ?   ?   R . n 
A 1 88  ASN 88  32  ?   ?   ?   R . n 
A 1 89  GLU 89  33  ?   ?   ?   R . n 
A 1 90  SER 90  34  ?   ?   ?   R . n 
A 1 91  ASP 91  35  ?   ?   ?   R . n 
A 1 92  SER 92  36  ?   ?   ?   R . n 
A 1 93  CYS 93  37  ?   ?   ?   R . n 
A 1 94  CYS 94  38  ?   ?   ?   R . n 
A 1 95  THR 95  39  ?   ?   ?   R . n 
A 1 96  SER 96  40  ?   ?   ?   R . n 
A 1 97  PRO 97  41  ?   ?   ?   R . n 
A 1 98  PRO 98  42  ?   ?   ?   R . n 
A 1 99  CYS 99  43  ?   ?   ?   R . n 
A 1 100 PRO 100 44  ?   ?   ?   R . n 
A 1 101 GLN 101 45  ?   ?   ?   R . n 
A 1 102 ASP 102 46  46  ASP ASP R . n 
A 1 103 PHE 103 47  47  PHE PHE R . n 
A 1 104 SER 104 48  48  SER SER R . n 
A 1 105 LEU 105 49  49  LEU LEU R . n 
A 1 106 ASN 106 50  50  ASN ASN R . n 
A 1 107 PHE 107 51  51  PHE PHE R . n 
A 1 108 ASP 108 52  52  ASP ASP R . n 
A 1 109 ARG 109 53  53  ARG ARG R . n 
A 1 110 ALA 110 54  54  ALA ALA R . n 
A 1 111 PHE 111 55  55  PHE PHE R . n 
A 1 112 LEU 112 56  56  LEU LEU R . n 
A 1 113 PRO 113 57  57  PRO PRO R . n 
A 1 114 ALA 114 58  58  ALA ALA R . n 
A 1 115 LEU 115 59  59  LEU LEU R . n 
A 1 116 TYR 116 60  60  TYR TYR R . n 
A 1 117 SER 117 61  61  SER SER R . n 
A 1 118 LEU 118 62  62  LEU LEU R . n 
A 1 119 LEU 119 63  63  LEU LEU R . n 
A 1 120 PHE 120 64  64  PHE PHE R . n 
A 1 121 LEU 121 65  65  LEU LEU R . n 
A 1 122 LEU 122 66  66  LEU LEU R . n 
A 1 123 GLY 123 67  67  GLY GLY R . n 
A 1 124 LEU 124 68  68  LEU LEU R . n 
A 1 125 LEU 125 69  69  LEU LEU R . n 
A 1 126 GLY 126 70  70  GLY GLY R . n 
A 1 127 ASN 127 71  71  ASN ASN R . n 
A 1 128 GLY 128 72  72  GLY GLY R . n 
A 1 129 ALA 129 73  73  ALA ALA R . n 
A 1 130 VAL 130 74  74  VAL VAL R . n 
A 1 131 ALA 131 75  75  ALA ALA R . n 
A 1 132 ALA 132 76  76  ALA ALA R . n 
A 1 133 VAL 133 77  77  VAL VAL R . n 
A 1 134 LEU 134 78  78  LEU LEU R . n 
A 1 135 LEU 135 79  79  LEU LEU R . n 
A 1 136 SER 136 80  80  SER SER R . n 
A 1 137 ARG 137 81  81  ARG ARG R . n 
A 1 138 ARG 138 82  82  ARG ARG R . n 
A 1 139 THR 139 83  83  THR THR R . n 
A 1 140 ALA 140 84  84  ALA ALA R . n 
A 1 141 LEU 141 85  85  LEU LEU R . n 
A 1 142 SER 142 86  86  SER SER R . n 
A 1 143 SER 143 87  87  SER SER R . n 
A 1 144 THR 144 88  88  THR THR R . n 
A 1 145 ASP 145 89  89  ASP ASP R . n 
A 1 146 THR 146 90  90  THR THR R . n 
A 1 147 PHE 147 91  91  PHE PHE R . n 
A 1 148 LEU 148 92  92  LEU LEU R . n 
A 1 149 LEU 149 93  93  LEU LEU R . n 
A 1 150 HIS 150 94  94  HIS HIS R . n 
A 1 151 LEU 151 95  95  LEU LEU R . n 
A 1 152 ALA 152 96  96  ALA ALA R . n 
A 1 153 VAL 153 97  97  VAL VAL R . n 
A 1 154 ALA 154 98  98  ALA ALA R . n 
A 1 155 ASP 155 99  99  ASP ASP R . n 
A 1 156 THR 156 100 100 THR THR R . n 
A 1 157 LEU 157 101 101 LEU LEU R . n 
A 1 158 LEU 158 102 102 LEU LEU R . n 
A 1 159 VAL 159 103 103 VAL VAL R . n 
A 1 160 LEU 160 104 104 LEU LEU R . n 
A 1 161 THR 161 105 105 THR THR R . n 
A 1 162 LEU 162 106 106 LEU LEU R . n 
A 1 163 PRO 163 107 107 PRO PRO R . n 
A 1 164 LEU 164 108 108 LEU LEU R . n 
A 1 165 TRP 165 109 109 TRP TRP R . n 
A 1 166 ALA 166 110 110 ALA ALA R . n 
A 1 167 VAL 167 111 111 VAL VAL R . n 
A 1 168 ASP 168 112 112 ASP ASP R . n 
A 1 169 ALA 169 113 113 ALA ALA R . n 
A 1 170 ALA 170 114 114 ALA ALA R . n 
A 1 171 VAL 171 115 115 VAL VAL R . n 
A 1 172 GLN 172 116 116 GLN GLN R . n 
A 1 173 TRP 173 117 117 TRP TRP R . n 
A 1 174 VAL 174 118 118 VAL VAL R . n 
A 1 175 PHE 175 119 119 PHE PHE R . n 
A 1 176 GLY 176 120 120 GLY GLY R . n 
A 1 177 SER 177 121 121 SER SER R . n 
A 1 178 GLY 178 122 122 GLY GLY R . n 
A 1 179 LEU 179 123 123 LEU LEU R . n 
A 1 180 CYS 180 124 124 CYS CYS R . n 
A 1 181 LYS 181 125 125 LYS LYS R . n 
A 1 182 VAL 182 126 126 VAL VAL R . n 
A 1 183 ALA 183 127 127 ALA ALA R . n 
A 1 184 GLY 184 128 128 GLY GLY R . n 
A 1 185 ALA 185 129 129 ALA ALA R . n 
A 1 186 LEU 186 130 130 LEU LEU R . n 
A 1 187 PHE 187 131 131 PHE PHE R . n 
A 1 188 ASN 188 132 132 ASN ASN R . n 
A 1 189 ILE 189 133 133 ILE ILE R . n 
A 1 190 ASN 190 134 134 ASN ASN R . n 
A 1 191 PHE 191 135 135 PHE PHE R . n 
A 1 192 TYR 192 136 136 TYR TYR R . n 
A 1 193 ALA 193 137 137 ALA ALA R . n 
A 1 194 GLY 194 138 138 GLY GLY R . n 
A 1 195 ALA 195 139 139 ALA ALA R . n 
A 1 196 LEU 196 140 140 LEU LEU R . n 
A 1 197 LEU 197 141 141 LEU LEU R . n 
A 1 198 LEU 198 142 142 LEU LEU R . n 
A 1 199 ALA 199 143 143 ALA ALA R . n 
A 1 200 CYS 200 144 144 CYS CYS R . n 
A 1 201 ILE 201 145 145 ILE ILE R . n 
A 1 202 SER 202 146 146 SER SER R . n 
A 1 203 PHE 203 147 147 PHE PHE R . n 
A 1 204 ASP 204 148 148 ASP ASP R . n 
A 1 205 ARG 205 149 149 ARG ARG R . n 
A 1 206 TYR 206 150 150 TYR TYR R . n 
A 1 207 LEU 207 151 151 LEU LEU R . n 
A 1 208 ASN 208 152 152 ASN ASN R . n 
A 1 209 ILE 209 153 153 ILE ILE R . n 
A 1 210 VAL 210 154 154 VAL VAL R . n 
A 1 211 HIS 211 155 155 HIS HIS R . n 
A 1 212 ALA 212 156 156 ALA ALA R . n 
A 1 213 THR 213 157 157 THR THR R . n 
A 1 214 GLN 214 158 158 GLN GLN R . n 
A 1 215 LEU 215 159 159 LEU LEU R . n 
A 1 216 TYR 216 160 160 TYR TYR R . n 
A 1 217 ARG 217 161 161 ARG ARG R . n 
A 1 218 ARG 218 162 162 ARG ARG R . n 
A 1 219 GLY 219 163 163 GLY GLY R . n 
A 1 220 PRO 220 164 164 PRO PRO R . n 
A 1 221 PRO 221 165 165 PRO PRO R . n 
A 1 222 ALA 222 166 166 ALA ALA R . n 
A 1 223 ARG 223 167 167 ARG ARG R . n 
A 1 224 VAL 224 168 168 VAL VAL R . n 
A 1 225 THR 225 169 169 THR THR R . n 
A 1 226 LEU 226 170 170 LEU LEU R . n 
A 1 227 THR 227 171 171 THR THR R . n 
A 1 228 CYS 228 172 172 CYS CYS R . n 
A 1 229 LEU 229 173 173 LEU LEU R . n 
A 1 230 ALA 230 174 174 ALA ALA R . n 
A 1 231 VAL 231 175 175 VAL VAL R . n 
A 1 232 TRP 232 176 176 TRP TRP R . n 
A 1 233 GLY 233 177 177 GLY GLY R . n 
A 1 234 LEU 234 178 178 LEU LEU R . n 
A 1 235 CYS 235 179 179 CYS CYS R . n 
A 1 236 LEU 236 180 180 LEU LEU R . n 
A 1 237 LEU 237 181 181 LEU LEU R . n 
A 1 238 PHE 238 182 182 PHE PHE R . n 
A 1 239 ALA 239 183 183 ALA ALA R . n 
A 1 240 LEU 240 184 184 LEU LEU R . n 
A 1 241 PRO 241 185 185 PRO PRO R . n 
A 1 242 ASP 242 186 186 ASP ASP R . n 
A 1 243 PHE 243 187 187 PHE PHE R . n 
A 1 244 ILE 244 188 188 ILE ILE R . n 
A 1 245 PHE 245 189 189 PHE PHE R . n 
A 1 246 LEU 246 190 190 LEU LEU R . n 
A 1 247 SER 247 191 191 SER SER R . n 
A 1 248 ALA 248 192 192 ALA ALA R . n 
A 1 249 HIS 249 193 193 HIS HIS R . n 
A 1 250 HIS 250 194 194 HIS HIS R . n 
A 1 251 ASP 251 195 195 ASP ASP R . n 
A 1 252 GLU 252 196 196 GLU GLU R . n 
A 1 253 ARG 253 197 197 ARG ARG R . n 
A 1 254 LEU 254 198 198 LEU LEU R . n 
A 1 255 ASN 255 199 199 ASN ASN R . n 
A 1 256 ALA 256 200 200 ALA ALA R . n 
A 1 257 THR 257 201 201 THR THR R . n 
A 1 258 HIS 258 202 202 HIS HIS R . n 
A 1 259 CYS 259 203 203 CYS CYS R . n 
A 1 260 GLN 260 204 204 GLN GLN R . n 
A 1 261 TYR 261 205 205 TYR TYR R . n 
A 1 262 ASN 262 206 206 ASN ASN R . n 
A 1 263 PHE 263 207 207 PHE PHE R . n 
A 1 264 PRO 264 208 208 PRO PRO R . n 
A 1 265 GLN 265 209 209 GLN GLN R . n 
A 1 266 VAL 266 210 210 VAL VAL R . n 
A 1 267 GLY 267 211 211 GLY GLY R . n 
A 1 268 ARG 268 212 212 ARG ARG R . n 
A 1 269 THR 269 213 213 THR THR R . n 
A 1 270 ALA 270 214 214 ALA ALA R . n 
A 1 271 LEU 271 215 215 LEU LEU R . n 
A 1 272 ARG 272 216 216 ARG ARG R . n 
A 1 273 VAL 273 217 217 VAL VAL R . n 
A 1 274 LEU 274 218 218 LEU LEU R . n 
A 1 275 GLN 275 219 219 GLN GLN R . n 
A 1 276 LEU 276 220 220 LEU LEU R . n 
A 1 277 VAL 277 221 221 VAL VAL R . n 
A 1 278 ALA 278 222 222 ALA ALA R . n 
A 1 279 GLY 279 223 223 GLY GLY R . n 
A 1 280 PHE 280 224 224 PHE PHE R . n 
A 1 281 LEU 281 225 225 LEU LEU R . n 
A 1 282 LEU 282 226 226 LEU LEU R . n 
A 1 283 PRO 283 227 227 PRO PRO R . n 
A 1 284 LEU 284 228 228 LEU LEU R . n 
A 1 285 LEU 285 229 229 LEU LEU R . n 
A 1 286 VAL 286 230 230 VAL VAL R . n 
A 1 287 MET 287 231 231 MET MET R . n 
A 1 288 ALA 288 232 232 ALA ALA R . n 
A 1 289 TYR 289 233 233 TYR TYR R . n 
A 1 290 CYS 290 234 234 CYS CYS R . n 
A 1 291 TYR 291 235 235 TYR TYR R . n 
A 1 292 ALA 292 236 236 ALA ALA R . n 
A 1 293 HIS 293 237 237 HIS HIS R . n 
A 1 294 ILE 294 238 238 ILE ILE R . n 
A 1 295 LEU 295 239 239 LEU LEU R . n 
A 1 296 ALA 296 240 240 ALA ALA R . n 
A 1 297 VAL 297 241 241 VAL VAL R . n 
A 1 298 LEU 298 242 242 LEU LEU R . n 
A 1 299 LEU 299 243 243 LEU LEU R . n 
A 1 300 VAL 300 244 244 VAL VAL R . n 
A 1 301 SER 301 245 245 SER SER R . n 
A 1 302 ARG 302 246 246 ARG ARG R . n 
A 1 303 GLY 303 247 247 GLY GLY R . n 
A 1 304 GLN 304 248 248 GLN GLN R . n 
A 1 305 ARG 305 249 249 ARG ARG R . n 
A 1 306 ARG 306 250 250 ARG ARG R . n 
A 1 307 LEU 307 251 251 LEU LEU R . n 
A 1 308 ARG 308 252 252 ARG ARG R . n 
A 1 309 ALA 309 253 253 ALA ALA R . n 
A 1 310 MET 310 254 254 MET MET R . n 
A 1 311 ARG 311 255 255 ARG ARG R . n 
A 1 312 LEU 312 256 256 LEU LEU R . n 
A 1 313 VAL 313 257 257 VAL VAL R . n 
A 1 314 VAL 314 258 258 VAL VAL R . n 
A 1 315 VAL 315 259 259 VAL VAL R . n 
A 1 316 VAL 316 260 260 VAL VAL R . n 
A 1 317 VAL 317 261 261 VAL VAL R . n 
A 1 318 VAL 318 262 262 VAL VAL R . n 
A 1 319 ALA 319 263 263 ALA ALA R . n 
A 1 320 PHE 320 264 264 PHE PHE R . n 
A 1 321 ALA 321 265 265 ALA ALA R . n 
A 1 322 LEU 322 266 266 LEU LEU R . n 
A 1 323 CYS 323 267 267 CYS CYS R . n 
A 1 324 TRP 324 268 268 TRP TRP R . n 
A 1 325 THR 325 269 269 THR THR R . n 
A 1 326 PRO 326 270 270 PRO PRO R . n 
A 1 327 TYR 327 271 271 TYR TYR R . n 
A 1 328 HIS 328 272 272 HIS HIS R . n 
A 1 329 LEU 329 273 273 LEU LEU R . n 
A 1 330 VAL 330 274 274 VAL VAL R . n 
A 1 331 VAL 331 275 275 VAL VAL R . n 
A 1 332 LEU 332 276 276 LEU LEU R . n 
A 1 333 VAL 333 277 277 VAL VAL R . n 
A 1 334 ASP 334 278 278 ASP ASP R . n 
A 1 335 ILE 335 279 279 ILE ILE R . n 
A 1 336 LEU 336 280 280 LEU LEU R . n 
A 1 337 MET 337 281 281 MET MET R . n 
A 1 338 ASP 338 282 282 ASP ASP R . n 
A 1 339 LEU 339 283 283 LEU LEU R . n 
A 1 340 GLY 340 284 284 GLY GLY R . n 
A 1 341 ALA 341 285 285 ALA ALA R . n 
A 1 342 LEU 342 286 286 LEU LEU R . n 
A 1 343 ALA 343 287 287 ALA ALA R . n 
A 1 344 ARG 344 288 288 ARG ARG R . n 
A 1 345 ASN 345 289 289 ASN ASN R . n 
A 1 346 CYS 346 290 290 CYS CYS R . n 
A 1 347 GLY 347 291 291 GLY GLY R . n 
A 1 348 ARG 348 292 292 ARG ARG R . n 
A 1 349 GLU 349 293 293 GLU GLU R . n 
A 1 350 SER 350 294 294 SER SER R . n 
A 1 351 ARG 351 295 295 ARG ARG R . n 
A 1 352 VAL 352 296 296 VAL VAL R . n 
A 1 353 ASP 353 297 297 ASP ASP R . n 
A 1 354 VAL 354 298 298 VAL VAL R . n 
A 1 355 ALA 355 299 299 ALA ALA R . n 
A 1 356 LYS 356 300 300 LYS LYS R . n 
A 1 357 SER 357 301 301 SER SER R . n 
A 1 358 VAL 358 302 302 VAL VAL R . n 
A 1 359 THR 359 303 303 THR THR R . n 
A 1 360 SER 360 304 304 SER SER R . n 
A 1 361 GLY 361 305 305 GLY GLY R . n 
A 1 362 LEU 362 306 306 LEU LEU R . n 
A 1 363 GLY 363 307 307 GLY GLY R . n 
A 1 364 TYR 364 308 308 TYR TYR R . n 
A 1 365 MET 365 309 309 MET MET R . n 
A 1 366 HIS 366 310 310 HIS HIS R . n 
A 1 367 CYS 367 311 311 CYS CYS R . n 
A 1 368 CYS 368 312 312 CYS CYS R . n 
A 1 369 LEU 369 313 313 LEU LEU R . n 
A 1 370 ASN 370 314 314 ASN ASN R . n 
A 1 371 PRO 371 315 315 PRO PRO R . n 
A 1 372 LEU 372 316 316 LEU LEU R . n 
A 1 373 LEU 373 317 317 LEU LEU R . n 
A 1 374 TYR 374 318 318 TYR TYR R . n 
A 1 375 ALA 375 319 319 ALA ALA R . n 
A 1 376 PHE 376 320 320 PHE PHE R . n 
A 1 377 VAL 377 321 321 VAL VAL R . n 
A 1 378 GLY 378 322 322 GLY GLY R . n 
A 1 379 VAL 379 323 323 VAL VAL R . n 
A 1 380 LYS 380 324 324 LYS LYS R . n 
A 1 381 PHE 381 325 325 PHE PHE R . n 
A 1 382 ARG 382 326 326 ARG ARG R . n 
A 1 383 GLU 383 327 327 GLU GLU R . n 
A 1 384 ARG 384 328 328 ARG ARG R . n 
A 1 385 MET 385 329 329 MET MET R . n 
A 1 386 TRP 386 330 330 TRP TRP R . n 
A 1 387 MET 387 331 331 MET MET R . n 
A 1 388 LEU 388 332 332 LEU LEU R . n 
A 1 389 LEU 389 333 333 LEU LEU R . n 
A 1 390 LEU 390 334 334 LEU LEU R . n 
A 1 391 ARG 391 335 335 ARG ARG R . n 
A 1 392 LEU 392 336 ?   ?   ?   R . n 
A 1 393 GLY 393 337 ?   ?   ?   R . n 
A 1 394 CYS 394 338 ?   ?   ?   R . n 
A 1 395 PRO 395 339 ?   ?   ?   R . n 
A 1 396 ASN 396 340 ?   ?   ?   R . n 
A 1 397 GLN 397 341 ?   ?   ?   R . n 
A 1 398 ARG 398 342 ?   ?   ?   R . n 
A 1 399 GLY 399 343 ?   ?   ?   R . n 
A 1 400 LEU 400 344 ?   ?   ?   R . n 
A 1 401 GLN 401 345 ?   ?   ?   R . n 
A 1 402 ARG 402 346 ?   ?   ?   R . n 
A 1 403 GLN 403 347 ?   ?   ?   R . n 
A 1 404 PRO 404 348 ?   ?   ?   R . n 
A 1 405 SER 405 349 ?   ?   ?   R . n 
A 1 406 SER 406 350 ?   ?   ?   R . n 
A 1 407 SER 407 351 ?   ?   ?   R . n 
A 1 408 ARG 408 352 ?   ?   ?   R . n 
A 1 409 ARG 409 353 ?   ?   ?   R . n 
A 1 410 ASP 410 354 ?   ?   ?   R . n 
A 1 411 SER 411 355 ?   ?   ?   R . n 
A 1 412 SER 412 356 ?   ?   ?   R . n 
A 1 413 TRP 413 357 ?   ?   ?   R . n 
A 1 414 SER 414 358 ?   ?   ?   R . n 
A 1 415 GLU 415 359 ?   ?   ?   R . n 
A 1 416 THR 416 360 ?   ?   ?   R . n 
A 1 417 SER 417 361 ?   ?   ?   R . n 
A 1 418 GLU 418 362 ?   ?   ?   R . n 
A 1 419 ALA 419 363 ?   ?   ?   R . n 
A 1 420 SER 420 364 ?   ?   ?   R . n 
A 1 421 TYR 421 365 ?   ?   ?   R . n 
A 1 422 SER 422 366 ?   ?   ?   R . n 
A 1 423 GLY 423 367 ?   ?   ?   R . n 
A 1 424 LEU 424 368 ?   ?   ?   R . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        A1LW1 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   A1LW1 
_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        ? 
# 
_pdbx_nonpoly_scheme.asym_id         B 
_pdbx_nonpoly_scheme.entity_id       2 
_pdbx_nonpoly_scheme.mon_id          A1LW1 
_pdbx_nonpoly_scheme.ndb_seq_num     1 
_pdbx_nonpoly_scheme.pdb_seq_num     401 
_pdbx_nonpoly_scheme.auth_seq_num    401 
_pdbx_nonpoly_scheme.pdb_mon_id      A1LW1 
_pdbx_nonpoly_scheme.auth_mon_id     LIG 
_pdbx_nonpoly_scheme.pdb_strand_id   R 
_pdbx_nonpoly_scheme.pdb_ins_code    . 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.00 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8XYI 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     1.00 
_cell.length_a_esd                 ? 
_cell.length_b                     1.00 
_cell.length_b_esd                 ? 
_cell.length_c                     1.00 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        ? 
_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                         8XYI 
_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                   8XYI 
_exptl.crystals_number            ? 
_exptl.details                    ? 
_exptl.method                     'ELECTRON MICROSCOPY' 
_exptl.method_details             ? 
# 
_refine.pdbx_refine_id                           'ELECTRON MICROSCOPY' 
_refine.entry_id                                 8XYI 
_refine.pdbx_diffrn_id                           ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.ls_number_reflns_obs                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.ls_d_res_low                             ? 
_refine.ls_d_res_high                            . 
_refine.ls_percent_reflns_obs                    ? 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_R_work                       ? 
_refine.ls_R_factor_R_free                       ? 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_percent_reflns_R_free                 ? 
_refine.ls_number_reflns_R_free                  ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_restraints                     ? 
_refine.occupancy_min                            ? 
_refine.occupancy_max                            ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.B_iso_mean                               ? 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.solvent_model_details                    ? 
_refine.solvent_model_param_ksol                 ? 
_refine.solvent_model_param_bsol                 ? 
_refine.pdbx_solvent_vdw_probe_radii             ? 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             ? 
_refine.pdbx_ls_cross_valid_method               ? 
_refine.details                                  ? 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_method_to_determine_struct          ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.overall_SU_ML                            ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.overall_SU_B                             ? 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
# 
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 
'ELECTRON MICROSCOPY' ? 0.003 ? 2371 ? f_bond_d           ? ? 
'ELECTRON MICROSCOPY' ? 0.549 ? 3231 ? f_angle_d          ? ? 
'ELECTRON MICROSCOPY' ? 4.774 ? 367  ? f_dihedral_angle_d ? ? 
'ELECTRON MICROSCOPY' ? 0.034 ? 384  ? f_chiral_restr     ? ? 
'ELECTRON MICROSCOPY' ? 0.006 ? 405  ? f_plane_restr      ? ? 
# 
_struct.entry_id                     8XYI 
_struct.title                        'Structure of CXCR3 in complex with VUF10661 (Receptor-ligand focused map)' 
_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        8XYI 
_struct_keywords.text            'GPCR, Arrestin, SIGNALING PROTEIN' 
_struct_keywords.pdbx_keywords   'SIGNALING PROTEIN' 
# 
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 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    CXCR3_HUMAN 
_struct_ref.pdbx_db_accession          P49682 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;VLEVSDHQVLNDAEVAALLENFSSSYDYGENESDSCCTSPPCPQDFSLNFDRAFLPALYSLLFLLGLLGNGAVAAVLLSR
RTALSSTDTFLLHLAVADTLLVLTLPLWAVDAAVQWVFGSGLCKVAGALFNINFYAGALLLACISFDRYLNIVHATQLYR
RGPPARVTLTCLAVWGLCLLFALPDFIFLSAHHDERLNATHCQYNFPQVGRTALRVLQLVAGFLLPLLVMAYCYAHILAV
LLVSRGQRRLRAMRLVVVVVVAFALCWTPYHLVVLVDILMDLGALARNCGRESRVDVAKSVTSGLGYMHCCLNPLLYAFV
GVKFRERMWMLLLRLGCPNQRGLQRQPSSSRRDSSWSETSEASYSGL
;
_struct_ref.pdbx_align_begin           2 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              8XYI 
_struct_ref_seq.pdbx_strand_id                R 
_struct_ref_seq.seq_align_beg                 58 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 424 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P49682 
_struct_ref_seq.db_align_beg                  2 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  368 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       2 
_struct_ref_seq.pdbx_auth_seq_align_end       368 
# 
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 8XYI MET R 1  ? UNP P49682 ? ? 'initiating methionine' -55 1  
1 8XYI GLY R 2  ? UNP P49682 ? ? 'expression tag'        -54 2  
1 8XYI LYS R 3  ? UNP P49682 ? ? 'expression tag'        -53 3  
1 8XYI THR R 4  ? UNP P49682 ? ? 'expression tag'        -52 4  
1 8XYI ILE R 5  ? UNP P49682 ? ? 'expression tag'        -51 5  
1 8XYI ILE R 6  ? UNP P49682 ? ? 'expression tag'        -50 6  
1 8XYI ALA R 7  ? UNP P49682 ? ? 'expression tag'        -49 7  
1 8XYI LEU R 8  ? UNP P49682 ? ? 'expression tag'        -48 8  
1 8XYI SER R 9  ? UNP P49682 ? ? 'expression tag'        -47 9  
1 8XYI TYR R 10 ? UNP P49682 ? ? 'expression tag'        -46 10 
1 8XYI ILE R 11 ? UNP P49682 ? ? 'expression tag'        -45 11 
1 8XYI PHE R 12 ? UNP P49682 ? ? 'expression tag'        -44 12 
1 8XYI CYS R 13 ? UNP P49682 ? ? 'expression tag'        -43 13 
1 8XYI LEU R 14 ? UNP P49682 ? ? 'expression tag'        -42 14 
1 8XYI VAL R 15 ? UNP P49682 ? ? 'expression tag'        -41 15 
1 8XYI PHE R 16 ? UNP P49682 ? ? 'expression tag'        -40 16 
1 8XYI ALA R 17 ? UNP P49682 ? ? 'expression tag'        -39 17 
1 8XYI ASP R 18 ? UNP P49682 ? ? 'expression tag'        -38 18 
1 8XYI TYR R 19 ? UNP P49682 ? ? 'expression tag'        -37 19 
1 8XYI LYS R 20 ? UNP P49682 ? ? 'expression tag'        -36 20 
1 8XYI ASP R 21 ? UNP P49682 ? ? 'expression tag'        -35 21 
1 8XYI ASP R 22 ? UNP P49682 ? ? 'expression tag'        -34 22 
1 8XYI ASP R 23 ? UNP P49682 ? ? 'expression tag'        -33 23 
1 8XYI ASP R 24 ? UNP P49682 ? ? 'expression tag'        -32 24 
1 8XYI ALA R 25 ? UNP P49682 ? ? 'expression tag'        -31 25 
1 8XYI ALA R 26 ? UNP P49682 ? ? 'expression tag'        -30 26 
1 8XYI ASN R 27 ? UNP P49682 ? ? 'expression tag'        -29 27 
1 8XYI PHE R 28 ? UNP P49682 ? ? 'expression tag'        -28 28 
1 8XYI THR R 29 ? UNP P49682 ? ? 'expression tag'        -27 29 
1 8XYI PRO R 30 ? UNP P49682 ? ? 'expression tag'        -26 30 
1 8XYI VAL R 31 ? UNP P49682 ? ? 'expression tag'        -25 31 
1 8XYI ASN R 32 ? UNP P49682 ? ? 'expression tag'        -24 32 
1 8XYI GLY R 33 ? UNP P49682 ? ? 'expression tag'        -23 33 
1 8XYI SER R 34 ? UNP P49682 ? ? 'expression tag'        -22 34 
1 8XYI SER R 35 ? UNP P49682 ? ? 'expression tag'        -21 35 
1 8XYI GLY R 36 ? UNP P49682 ? ? 'expression tag'        -20 36 
1 8XYI ASN R 37 ? UNP P49682 ? ? 'expression tag'        -19 37 
1 8XYI GLN R 38 ? UNP P49682 ? ? 'expression tag'        -18 38 
1 8XYI SER R 39 ? UNP P49682 ? ? 'expression tag'        -17 39 
1 8XYI VAL R 40 ? UNP P49682 ? ? 'expression tag'        -16 40 
1 8XYI ARG R 41 ? UNP P49682 ? ? 'expression tag'        -15 41 
1 8XYI LEU R 42 ? UNP P49682 ? ? 'expression tag'        -14 42 
1 8XYI VAL R 43 ? UNP P49682 ? ? 'expression tag'        -13 43 
1 8XYI THR R 44 ? UNP P49682 ? ? 'expression tag'        -12 44 
1 8XYI SER R 45 ? UNP P49682 ? ? 'expression tag'        -11 45 
1 8XYI SER R 46 ? UNP P49682 ? ? 'expression tag'        -10 46 
1 8XYI SER R 47 ? UNP P49682 ? ? 'expression tag'        -9  47 
1 8XYI LEU R 48 ? UNP P49682 ? ? 'expression tag'        -8  48 
1 8XYI GLU R 49 ? UNP P49682 ? ? 'expression tag'        -7  49 
1 8XYI VAL R 50 ? UNP P49682 ? ? 'expression tag'        -6  50 
1 8XYI LEU R 51 ? UNP P49682 ? ? 'expression tag'        -5  51 
1 8XYI PHE R 52 ? UNP P49682 ? ? 'expression tag'        -4  52 
1 8XYI GLN R 53 ? UNP P49682 ? ? 'expression tag'        -3  53 
1 8XYI GLY R 54 ? UNP P49682 ? ? 'expression tag'        -2  54 
1 8XYI PRO R 55 ? UNP P49682 ? ? 'expression tag'        -1  55 
1 8XYI GLY R 56 ? UNP P49682 ? ? 'expression tag'        0   56 
1 8XYI SER R 57 ? UNP P49682 ? ? 'expression tag'        1   57 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'electron microscopy' 
_pdbx_struct_assembly_auth_evidence.details                'not applicable' 
# 
_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]         1.0 
_pdbx_struct_oper_list.matrix[1][2]         0.0 
_pdbx_struct_oper_list.matrix[1][3]         0.0 
_pdbx_struct_oper_list.vector[1]            0.0 
_pdbx_struct_oper_list.matrix[2][1]         0.0 
_pdbx_struct_oper_list.matrix[2][2]         1.0 
_pdbx_struct_oper_list.matrix[2][3]         0.0 
_pdbx_struct_oper_list.vector[2]            0.0 
_pdbx_struct_oper_list.matrix[3][1]         0.0 
_pdbx_struct_oper_list.matrix[3][2]         0.0 
_pdbx_struct_oper_list.matrix[3][3]         1.0 
_pdbx_struct_oper_list.vector[3]            0.0 
# 
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 ASP A 102 ? SER A 136 ? ASP R 46  SER R 80  1 ? 35 
HELX_P HELX_P2  AA2 SER A 142 ? THR A 161 ? SER R 86  THR R 105 1 ? 20 
HELX_P HELX_P3  AA3 THR A 161 ? VAL A 171 ? THR R 105 VAL R 115 1 ? 11 
HELX_P HELX_P4  AA4 PHE A 175 ? VAL A 210 ? PHE R 119 VAL R 154 1 ? 36 
HELX_P HELX_P5  AA5 VAL A 224 ? LEU A 246 ? VAL R 168 LEU R 190 1 ? 23 
HELX_P HELX_P6  AA6 PRO A 264 ? PHE A 280 ? PRO R 208 PHE R 224 1 ? 17 
HELX_P HELX_P7  AA7 PHE A 280 ? VAL A 300 ? PHE R 224 VAL R 244 1 ? 21 
HELX_P HELX_P8  AA8 ARG A 305 ? LEU A 339 ? ARG R 249 LEU R 283 1 ? 35 
HELX_P HELX_P9  AA9 ASN A 345 ? ALA A 375 ? ASN R 289 ALA R 319 1 ? 31 
HELX_P HELX_P10 AB1 GLY A 378 ? ARG A 391 ? GLY R 322 ARG R 335 1 ? 14 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
_struct_conn.id                            disulf1 
_struct_conn.conn_type_id                  disulf 
_struct_conn.pdbx_leaving_atom_flag        ? 
_struct_conn.pdbx_PDB_id                   ? 
_struct_conn.ptnr1_label_asym_id           A 
_struct_conn.ptnr1_label_comp_id           CYS 
_struct_conn.ptnr1_label_seq_id            180 
_struct_conn.ptnr1_label_atom_id           SG 
_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                1_555 
_struct_conn.ptnr2_label_asym_id           A 
_struct_conn.ptnr2_label_comp_id           CYS 
_struct_conn.ptnr2_label_seq_id            259 
_struct_conn.ptnr2_label_atom_id           SG 
_struct_conn.pdbx_ptnr2_label_alt_id       ? 
_struct_conn.pdbx_ptnr2_PDB_ins_code       ? 
_struct_conn.ptnr1_auth_asym_id            R 
_struct_conn.ptnr1_auth_comp_id            CYS 
_struct_conn.ptnr1_auth_seq_id             124 
_struct_conn.ptnr2_auth_asym_id            R 
_struct_conn.ptnr2_auth_comp_id            CYS 
_struct_conn.ptnr2_auth_seq_id             203 
_struct_conn.ptnr2_symmetry                1_555 
_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               2.028 
_struct_conn.pdbx_value_order              ? 
_struct_conn.pdbx_role                     ? 
# 
_struct_conn_type.id          disulf 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
_pdbx_modification_feature.ordinal                            1 
_pdbx_modification_feature.label_comp_id                      CYS 
_pdbx_modification_feature.label_asym_id                      A 
_pdbx_modification_feature.label_seq_id                       180 
_pdbx_modification_feature.label_alt_id                       ? 
_pdbx_modification_feature.modified_residue_label_comp_id     CYS 
_pdbx_modification_feature.modified_residue_label_asym_id     A 
_pdbx_modification_feature.modified_residue_label_seq_id      259 
_pdbx_modification_feature.modified_residue_label_alt_id      ? 
_pdbx_modification_feature.auth_comp_id                       CYS 
_pdbx_modification_feature.auth_asym_id                       R 
_pdbx_modification_feature.auth_seq_id                        124 
_pdbx_modification_feature.PDB_ins_code                       ? 
_pdbx_modification_feature.symmetry                           1_555 
_pdbx_modification_feature.modified_residue_auth_comp_id      CYS 
_pdbx_modification_feature.modified_residue_auth_asym_id      R 
_pdbx_modification_feature.modified_residue_auth_seq_id       203 
_pdbx_modification_feature.modified_residue_PDB_ins_code      ? 
_pdbx_modification_feature.modified_residue_symmetry          1_555 
_pdbx_modification_feature.comp_id_linking_atom               SG 
_pdbx_modification_feature.modified_residue_id_linking_atom   SG 
_pdbx_modification_feature.modified_residue_id                . 
_pdbx_modification_feature.ref_pcm_id                         . 
_pdbx_modification_feature.ref_comp_id                        . 
_pdbx_modification_feature.type                               None 
_pdbx_modification_feature.category                           'Disulfide bridge' 
# 
_struct_sheet.id               AA1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   2 
_struct_sheet.details          ? 
# 
_struct_sheet_order.sheet_id     AA1 
_struct_sheet_order.range_id_1   1 
_struct_sheet_order.range_id_2   2 
_struct_sheet_order.offset       ? 
_struct_sheet_order.sense        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 SER A 247 ? HIS A 250 ? SER R 191 HIS R 194 
AA1 2 THR A 257 ? GLN A 260 ? THR R 201 GLN R 204 
# 
_pdbx_struct_sheet_hbond.sheet_id                AA1 
_pdbx_struct_sheet_hbond.range_id_1              1 
_pdbx_struct_sheet_hbond.range_id_2              2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id   N 
_pdbx_struct_sheet_hbond.range_1_label_comp_id   SER 
_pdbx_struct_sheet_hbond.range_1_label_asym_id   A 
_pdbx_struct_sheet_hbond.range_1_label_seq_id    247 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code    ? 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id    N 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id    SER 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id    R 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id     191 
_pdbx_struct_sheet_hbond.range_2_label_atom_id   O 
_pdbx_struct_sheet_hbond.range_2_label_comp_id   GLN 
_pdbx_struct_sheet_hbond.range_2_label_asym_id   A 
_pdbx_struct_sheet_hbond.range_2_label_seq_id    260 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code    ? 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id    O 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id    GLN 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id    R 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id     204 
# 
_pdbx_entry_details.entry_id                   8XYI 
_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_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 GLN R 116 ? ? 179.93 163.21 
2 1 HIS R 155 ? ? -90.38 57.29  
# 
_em_3d_fitting.id                1 
_em_3d_fitting.entry_id          8XYI 
_em_3d_fitting.method            ? 
_em_3d_fitting.target_criteria   ? 
_em_3d_fitting.details           ? 
_em_3d_fitting.overall_b_value   ? 
_em_3d_fitting.ref_space         REAL 
_em_3d_fitting.ref_protocol      'FLEXIBLE FIT' 
# 
_em_3d_fitting_list.id                            1 
_em_3d_fitting_list.3d_fitting_id                 1 
_em_3d_fitting_list.pdb_entry_id                  . 
_em_3d_fitting_list.pdb_chain_id                  . 
_em_3d_fitting_list.pdb_chain_residue_range       . 
_em_3d_fitting_list.details                       ? 
_em_3d_fitting_list.chain_id                      ? 
_em_3d_fitting_list.chain_residue_range           ? 
_em_3d_fitting_list.source_name                   AlphaFold 
_em_3d_fitting_list.type                          'in silico model' 
_em_3d_fitting_list.accession_code                ? 
_em_3d_fitting_list.initial_refinement_model_id   ? 
# 
_em_3d_reconstruction.entry_id                    8XYI 
_em_3d_reconstruction.id                          1 
_em_3d_reconstruction.method                      ? 
_em_3d_reconstruction.algorithm                   ? 
_em_3d_reconstruction.citation_id                 ? 
_em_3d_reconstruction.details                     ? 
_em_3d_reconstruction.resolution                  3.16 
_em_3d_reconstruction.resolution_method           'FSC 0.143 CUT-OFF' 
_em_3d_reconstruction.magnification_calibration   ? 
_em_3d_reconstruction.nominal_pixel_size          ? 
_em_3d_reconstruction.actual_pixel_size           ? 
_em_3d_reconstruction.num_particles               116462 
_em_3d_reconstruction.euler_angles_details        ? 
_em_3d_reconstruction.num_class_averages          ? 
_em_3d_reconstruction.refinement_type             ? 
_em_3d_reconstruction.image_processing_id         1 
_em_3d_reconstruction.symmetry_type               POINT 
# 
_em_buffer.id            1 
_em_buffer.specimen_id   1 
_em_buffer.name          ? 
_em_buffer.details       ? 
_em_buffer.pH            7.4 
# 
_em_entity_assembly.id                   1 
_em_entity_assembly.parent_id            0 
_em_entity_assembly.source               RECOMBINANT 
_em_entity_assembly.type                 COMPLEX 
_em_entity_assembly.name                 'Structure of CXCR3 in complex with VUF10661' 
_em_entity_assembly.details              ? 
_em_entity_assembly.synonym              ? 
_em_entity_assembly.oligomeric_details   ? 
_em_entity_assembly.entity_id_list       1 
# 
_em_imaging.entry_id                        8XYI 
_em_imaging.id                              1 
_em_imaging.astigmatism                     ? 
_em_imaging.electron_beam_tilt_params       ? 
_em_imaging.residual_tilt                   ? 
_em_imaging.microscope_model                'FEI TITAN KRIOS' 
_em_imaging.specimen_holder_type            ? 
_em_imaging.specimen_holder_model           'FEI TITAN KRIOS AUTOGRID HOLDER' 
_em_imaging.details                         ? 
_em_imaging.date                            ? 
_em_imaging.accelerating_voltage            300 
_em_imaging.illumination_mode               'FLOOD BEAM' 
_em_imaging.mode                            'BRIGHT FIELD' 
_em_imaging.nominal_cs                      ? 
_em_imaging.nominal_defocus_min             800 
_em_imaging.nominal_defocus_max             1600 
_em_imaging.calibrated_defocus_min          ? 
_em_imaging.calibrated_defocus_max          ? 
_em_imaging.tilt_angle_min                  ? 
_em_imaging.tilt_angle_max                  ? 
_em_imaging.nominal_magnification           ? 
_em_imaging.calibrated_magnification        ? 
_em_imaging.electron_source                 'FIELD EMISSION GUN' 
_em_imaging.citation_id                     ? 
_em_imaging.temperature                     ? 
_em_imaging.detector_distance               ? 
_em_imaging.recording_temperature_minimum   ? 
_em_imaging.recording_temperature_maximum   ? 
_em_imaging.alignment_procedure             ? 
_em_imaging.c2_aperture_diameter            ? 
_em_imaging.specimen_id                     1 
_em_imaging.cryogen                         NITROGEN 
# 
_em_vitrification.entry_id              8XYI 
_em_vitrification.id                    1 
_em_vitrification.specimen_id           1 
_em_vitrification.cryogen_name          ETHANE 
_em_vitrification.humidity              ? 
_em_vitrification.temp                  ? 
_em_vitrification.chamber_temperature   ? 
_em_vitrification.instrument            ? 
_em_vitrification.method                ? 
_em_vitrification.time_resolved_state   ? 
_em_vitrification.citation_id           ? 
_em_vitrification.details               ? 
# 
_em_experiment.entry_id                8XYI 
_em_experiment.id                      1 
_em_experiment.reconstruction_method   'SINGLE PARTICLE' 
_em_experiment.aggregation_state       PARTICLE 
_em_experiment.entity_assembly_id      1 
# 
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 R MET -55 ? A MET 1   
2   1 Y 1 R GLY -54 ? A GLY 2   
3   1 Y 1 R LYS -53 ? A LYS 3   
4   1 Y 1 R THR -52 ? A THR 4   
5   1 Y 1 R ILE -51 ? A ILE 5   
6   1 Y 1 R ILE -50 ? A ILE 6   
7   1 Y 1 R ALA -49 ? A ALA 7   
8   1 Y 1 R LEU -48 ? A LEU 8   
9   1 Y 1 R SER -47 ? A SER 9   
10  1 Y 1 R TYR -46 ? A TYR 10  
11  1 Y 1 R ILE -45 ? A ILE 11  
12  1 Y 1 R PHE -44 ? A PHE 12  
13  1 Y 1 R CYS -43 ? A CYS 13  
14  1 Y 1 R LEU -42 ? A LEU 14  
15  1 Y 1 R VAL -41 ? A VAL 15  
16  1 Y 1 R PHE -40 ? A PHE 16  
17  1 Y 1 R ALA -39 ? A ALA 17  
18  1 Y 1 R ASP -38 ? A ASP 18  
19  1 Y 1 R TYR -37 ? A TYR 19  
20  1 Y 1 R LYS -36 ? A LYS 20  
21  1 Y 1 R ASP -35 ? A ASP 21  
22  1 Y 1 R ASP -34 ? A ASP 22  
23  1 Y 1 R ASP -33 ? A ASP 23  
24  1 Y 1 R ASP -32 ? A ASP 24  
25  1 Y 1 R ALA -31 ? A ALA 25  
26  1 Y 1 R ALA -30 ? A ALA 26  
27  1 Y 1 R ASN -29 ? A ASN 27  
28  1 Y 1 R PHE -28 ? A PHE 28  
29  1 Y 1 R THR -27 ? A THR 29  
30  1 Y 1 R PRO -26 ? A PRO 30  
31  1 Y 1 R VAL -25 ? A VAL 31  
32  1 Y 1 R ASN -24 ? A ASN 32  
33  1 Y 1 R GLY -23 ? A GLY 33  
34  1 Y 1 R SER -22 ? A SER 34  
35  1 Y 1 R SER -21 ? A SER 35  
36  1 Y 1 R GLY -20 ? A GLY 36  
37  1 Y 1 R ASN -19 ? A ASN 37  
38  1 Y 1 R GLN -18 ? A GLN 38  
39  1 Y 1 R SER -17 ? A SER 39  
40  1 Y 1 R VAL -16 ? A VAL 40  
41  1 Y 1 R ARG -15 ? A ARG 41  
42  1 Y 1 R LEU -14 ? A LEU 42  
43  1 Y 1 R VAL -13 ? A VAL 43  
44  1 Y 1 R THR -12 ? A THR 44  
45  1 Y 1 R SER -11 ? A SER 45  
46  1 Y 1 R SER -10 ? A SER 46  
47  1 Y 1 R SER -9  ? A SER 47  
48  1 Y 1 R LEU -8  ? A LEU 48  
49  1 Y 1 R GLU -7  ? A GLU 49  
50  1 Y 1 R VAL -6  ? A VAL 50  
51  1 Y 1 R LEU -5  ? A LEU 51  
52  1 Y 1 R PHE -4  ? A PHE 52  
53  1 Y 1 R GLN -3  ? A GLN 53  
54  1 Y 1 R GLY -2  ? A GLY 54  
55  1 Y 1 R PRO -1  ? A PRO 55  
56  1 Y 1 R GLY 0   ? A GLY 56  
57  1 Y 1 R SER 1   ? A SER 57  
58  1 Y 1 R VAL 2   ? A VAL 58  
59  1 Y 1 R LEU 3   ? A LEU 59  
60  1 Y 1 R GLU 4   ? A GLU 60  
61  1 Y 1 R VAL 5   ? A VAL 61  
62  1 Y 1 R SER 6   ? A SER 62  
63  1 Y 1 R ASP 7   ? A ASP 63  
64  1 Y 1 R HIS 8   ? A HIS 64  
65  1 Y 1 R GLN 9   ? A GLN 65  
66  1 Y 1 R VAL 10  ? A VAL 66  
67  1 Y 1 R LEU 11  ? A LEU 67  
68  1 Y 1 R ASN 12  ? A ASN 68  
69  1 Y 1 R ASP 13  ? A ASP 69  
70  1 Y 1 R ALA 14  ? A ALA 70  
71  1 Y 1 R GLU 15  ? A GLU 71  
72  1 Y 1 R VAL 16  ? A VAL 72  
73  1 Y 1 R ALA 17  ? A ALA 73  
74  1 Y 1 R ALA 18  ? A ALA 74  
75  1 Y 1 R LEU 19  ? A LEU 75  
76  1 Y 1 R LEU 20  ? A LEU 76  
77  1 Y 1 R GLU 21  ? A GLU 77  
78  1 Y 1 R ASN 22  ? A ASN 78  
79  1 Y 1 R PHE 23  ? A PHE 79  
80  1 Y 1 R SER 24  ? A SER 80  
81  1 Y 1 R SER 25  ? A SER 81  
82  1 Y 1 R SER 26  ? A SER 82  
83  1 Y 1 R TYR 27  ? A TYR 83  
84  1 Y 1 R ASP 28  ? A ASP 84  
85  1 Y 1 R TYR 29  ? A TYR 85  
86  1 Y 1 R GLY 30  ? A GLY 86  
87  1 Y 1 R GLU 31  ? A GLU 87  
88  1 Y 1 R ASN 32  ? A ASN 88  
89  1 Y 1 R GLU 33  ? A GLU 89  
90  1 Y 1 R SER 34  ? A SER 90  
91  1 Y 1 R ASP 35  ? A ASP 91  
92  1 Y 1 R SER 36  ? A SER 92  
93  1 Y 1 R CYS 37  ? A CYS 93  
94  1 Y 1 R CYS 38  ? A CYS 94  
95  1 Y 1 R THR 39  ? A THR 95  
96  1 Y 1 R SER 40  ? A SER 96  
97  1 Y 1 R PRO 41  ? A PRO 97  
98  1 Y 1 R PRO 42  ? A PRO 98  
99  1 Y 1 R CYS 43  ? A CYS 99  
100 1 Y 1 R PRO 44  ? A PRO 100 
101 1 Y 1 R GLN 45  ? A GLN 101 
102 1 Y 1 R LEU 336 ? A LEU 392 
103 1 Y 1 R GLY 337 ? A GLY 393 
104 1 Y 1 R CYS 338 ? A CYS 394 
105 1 Y 1 R PRO 339 ? A PRO 395 
106 1 Y 1 R ASN 340 ? A ASN 396 
107 1 Y 1 R GLN 341 ? A GLN 397 
108 1 Y 1 R ARG 342 ? A ARG 398 
109 1 Y 1 R GLY 343 ? A GLY 399 
110 1 Y 1 R LEU 344 ? A LEU 400 
111 1 Y 1 R GLN 345 ? A GLN 401 
112 1 Y 1 R ARG 346 ? A ARG 402 
113 1 Y 1 R GLN 347 ? A GLN 403 
114 1 Y 1 R PRO 348 ? A PRO 404 
115 1 Y 1 R SER 349 ? A SER 405 
116 1 Y 1 R SER 350 ? A SER 406 
117 1 Y 1 R SER 351 ? A SER 407 
118 1 Y 1 R ARG 352 ? A ARG 408 
119 1 Y 1 R ARG 353 ? A ARG 409 
120 1 Y 1 R ASP 354 ? A ASP 410 
121 1 Y 1 R SER 355 ? A SER 411 
122 1 Y 1 R SER 356 ? A SER 412 
123 1 Y 1 R TRP 357 ? A TRP 413 
124 1 Y 1 R SER 358 ? A SER 414 
125 1 Y 1 R GLU 359 ? A GLU 415 
126 1 Y 1 R THR 360 ? A THR 416 
127 1 Y 1 R SER 361 ? A SER 417 
128 1 Y 1 R GLU 362 ? A GLU 418 
129 1 Y 1 R ALA 363 ? A ALA 419 
130 1 Y 1 R SER 364 ? A SER 420 
131 1 Y 1 R TYR 365 ? A TYR 421 
132 1 Y 1 R SER 366 ? A SER 422 
133 1 Y 1 R GLY 367 ? A GLY 423 
134 1 Y 1 R LEU 368 ? A LEU 424 
# 
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 
A1LW1 N3   N N N 1   
A1LW1 C4   C N N 2   
A1LW1 C5   C Y N 3   
A1LW1 C6   C Y N 4   
A1LW1 C7   C Y N 5   
A1LW1 C8   C Y N 6   
A1LW1 C10  C Y N 7   
A1LW1 C13  C N N 8   
A1LW1 C15  C N N 9   
A1LW1 C17  C Y N 10  
A1LW1 C20  C Y N 11  
A1LW1 C21  C Y N 12  
A1LW1 C22  C Y N 13  
A1LW1 C26  C N S 14  
A1LW1 C28  C N N 15  
A1LW1 C1   C N N 16  
A1LW1 C11  C N N 17  
A1LW1 C14  C N N 18  
A1LW1 C18  C Y N 19  
A1LW1 C19  C Y N 20  
A1LW1 C2   C N S 21  
A1LW1 C23  C N N 22  
A1LW1 C27  C N N 23  
A1LW1 C29  C N N 24  
A1LW1 C30  C N N 25  
A1LW1 C32  C N N 26  
A1LW1 C35  C N N 27  
A1LW1 C36  C N N 28  
A1LW1 C37  C Y N 29  
A1LW1 C38  C Y N 30  
A1LW1 C39  C Y N 31  
A1LW1 C40  C Y N 32  
A1LW1 C41  C Y N 33  
A1LW1 C42  C Y N 34  
A1LW1 C43  C Y N 35  
A1LW1 C44  C Y N 36  
A1LW1 C45  C Y N 37  
A1LW1 C46  C Y N 38  
A1LW1 C47  C Y N 39  
A1LW1 C48  C Y N 40  
A1LW1 C9   C Y N 41  
A1LW1 N25  N N N 42  
A1LW1 N31  N N N 43  
A1LW1 N34  N N N 44  
A1LW1 O12  O N N 45  
A1LW1 O16  O N N 46  
A1LW1 O24  O N N 47  
A1LW1 O33  O N N 48  
A1LW1 H1   H N N 49  
A1LW1 H2   H N N 50  
A1LW1 H3   H N N 51  
A1LW1 H4   H N N 52  
A1LW1 H5   H N N 53  
A1LW1 H6   H N N 54  
A1LW1 H7   H N N 55  
A1LW1 H8   H N N 56  
A1LW1 H9   H N N 57  
A1LW1 H10  H N N 58  
A1LW1 H11  H N N 59  
A1LW1 H12  H N N 60  
A1LW1 H13  H N N 61  
A1LW1 H14  H N N 62  
A1LW1 H15  H N N 63  
A1LW1 H16  H N N 64  
A1LW1 H17  H N N 65  
A1LW1 H18  H N N 66  
A1LW1 H19  H N N 67  
A1LW1 H20  H N N 68  
A1LW1 H21  H N N 69  
A1LW1 H22  H N N 70  
A1LW1 H23  H N N 71  
A1LW1 H24  H N N 72  
A1LW1 H25  H N N 73  
A1LW1 H26  H N N 74  
A1LW1 H27  H N N 75  
A1LW1 H28  H N N 76  
A1LW1 H29  H N N 77  
A1LW1 H30  H N N 78  
A1LW1 H31  H N N 79  
A1LW1 H32  H N N 80  
A1LW1 H33  H N N 81  
A1LW1 H34  H N N 82  
A1LW1 H35  H N N 83  
A1LW1 H36  H N N 84  
A1LW1 H37  H N N 85  
A1LW1 H38  H N N 86  
A1LW1 H39  H N N 87  
A1LW1 H40  H N N 88  
A1LW1 H41  H N N 89  
A1LW1 H42  H N N 90  
A1LW1 H44  H N N 91  
A1LW1 H45  H N N 92  
ALA   N    N N N 93  
ALA   CA   C N S 94  
ALA   C    C N N 95  
ALA   O    O N N 96  
ALA   CB   C N N 97  
ALA   OXT  O N N 98  
ALA   H    H N N 99  
ALA   H2   H N N 100 
ALA   HA   H N N 101 
ALA   HB1  H N N 102 
ALA   HB2  H N N 103 
ALA   HB3  H N N 104 
ALA   HXT  H N N 105 
ARG   N    N N N 106 
ARG   CA   C N S 107 
ARG   C    C N N 108 
ARG   O    O N N 109 
ARG   CB   C N N 110 
ARG   CG   C N N 111 
ARG   CD   C N N 112 
ARG   NE   N N N 113 
ARG   CZ   C N N 114 
ARG   NH1  N N N 115 
ARG   NH2  N N N 116 
ARG   OXT  O N N 117 
ARG   H    H N N 118 
ARG   H2   H N N 119 
ARG   HA   H N N 120 
ARG   HB2  H N N 121 
ARG   HB3  H N N 122 
ARG   HG2  H N N 123 
ARG   HG3  H N N 124 
ARG   HD2  H N N 125 
ARG   HD3  H N N 126 
ARG   HE   H N N 127 
ARG   HH11 H N N 128 
ARG   HH12 H N N 129 
ARG   HH21 H N N 130 
ARG   HH22 H N N 131 
ARG   HXT  H N N 132 
ASN   N    N N N 133 
ASN   CA   C N S 134 
ASN   C    C N N 135 
ASN   O    O N N 136 
ASN   CB   C N N 137 
ASN   CG   C N N 138 
ASN   OD1  O N N 139 
ASN   ND2  N N N 140 
ASN   OXT  O N N 141 
ASN   H    H N N 142 
ASN   H2   H N N 143 
ASN   HA   H N N 144 
ASN   HB2  H N N 145 
ASN   HB3  H N N 146 
ASN   HD21 H N N 147 
ASN   HD22 H N N 148 
ASN   HXT  H N N 149 
ASP   N    N N N 150 
ASP   CA   C N S 151 
ASP   C    C N N 152 
ASP   O    O N N 153 
ASP   CB   C N N 154 
ASP   CG   C N N 155 
ASP   OD1  O N N 156 
ASP   OD2  O N N 157 
ASP   OXT  O N N 158 
ASP   H    H N N 159 
ASP   H2   H N N 160 
ASP   HA   H N N 161 
ASP   HB2  H N N 162 
ASP   HB3  H N N 163 
ASP   HD2  H N N 164 
ASP   HXT  H N N 165 
CYS   N    N N N 166 
CYS   CA   C N R 167 
CYS   C    C N N 168 
CYS   O    O N N 169 
CYS   CB   C N N 170 
CYS   SG   S N N 171 
CYS   OXT  O N N 172 
CYS   H    H N N 173 
CYS   H2   H N N 174 
CYS   HA   H N N 175 
CYS   HB2  H N N 176 
CYS   HB3  H N N 177 
CYS   HG   H N N 178 
CYS   HXT  H N N 179 
GLN   N    N N N 180 
GLN   CA   C N S 181 
GLN   C    C N N 182 
GLN   O    O N N 183 
GLN   CB   C N N 184 
GLN   CG   C N N 185 
GLN   CD   C N N 186 
GLN   OE1  O N N 187 
GLN   NE2  N N N 188 
GLN   OXT  O N N 189 
GLN   H    H N N 190 
GLN   H2   H N N 191 
GLN   HA   H N N 192 
GLN   HB2  H N N 193 
GLN   HB3  H N N 194 
GLN   HG2  H N N 195 
GLN   HG3  H N N 196 
GLN   HE21 H N N 197 
GLN   HE22 H N N 198 
GLN   HXT  H N N 199 
GLU   N    N N N 200 
GLU   CA   C N S 201 
GLU   C    C N N 202 
GLU   O    O N N 203 
GLU   CB   C N N 204 
GLU   CG   C N N 205 
GLU   CD   C N N 206 
GLU   OE1  O N N 207 
GLU   OE2  O N N 208 
GLU   OXT  O N N 209 
GLU   H    H N N 210 
GLU   H2   H N N 211 
GLU   HA   H N N 212 
GLU   HB2  H N N 213 
GLU   HB3  H N N 214 
GLU   HG2  H N N 215 
GLU   HG3  H N N 216 
GLU   HE2  H N N 217 
GLU   HXT  H N N 218 
GLY   N    N N N 219 
GLY   CA   C N N 220 
GLY   C    C N N 221 
GLY   O    O N N 222 
GLY   OXT  O N N 223 
GLY   H    H N N 224 
GLY   H2   H N N 225 
GLY   HA2  H N N 226 
GLY   HA3  H N N 227 
GLY   HXT  H N N 228 
HIS   N    N N N 229 
HIS   CA   C N S 230 
HIS   C    C N N 231 
HIS   O    O N N 232 
HIS   CB   C N N 233 
HIS   CG   C Y N 234 
HIS   ND1  N Y N 235 
HIS   CD2  C Y N 236 
HIS   CE1  C Y N 237 
HIS   NE2  N Y N 238 
HIS   OXT  O N N 239 
HIS   H    H N N 240 
HIS   H2   H N N 241 
HIS   HA   H N N 242 
HIS   HB2  H N N 243 
HIS   HB3  H N N 244 
HIS   HD1  H N N 245 
HIS   HD2  H N N 246 
HIS   HE1  H N N 247 
HIS   HE2  H N N 248 
HIS   HXT  H N N 249 
ILE   N    N N N 250 
ILE   CA   C N S 251 
ILE   C    C N N 252 
ILE   O    O N N 253 
ILE   CB   C N S 254 
ILE   CG1  C N N 255 
ILE   CG2  C N N 256 
ILE   CD1  C N N 257 
ILE   OXT  O N N 258 
ILE   H    H N N 259 
ILE   H2   H N N 260 
ILE   HA   H N N 261 
ILE   HB   H N N 262 
ILE   HG12 H N N 263 
ILE   HG13 H N N 264 
ILE   HG21 H N N 265 
ILE   HG22 H N N 266 
ILE   HG23 H N N 267 
ILE   HD11 H N N 268 
ILE   HD12 H N N 269 
ILE   HD13 H N N 270 
ILE   HXT  H N N 271 
LEU   N    N N N 272 
LEU   CA   C N S 273 
LEU   C    C N N 274 
LEU   O    O N N 275 
LEU   CB   C N N 276 
LEU   CG   C N N 277 
LEU   CD1  C N N 278 
LEU   CD2  C N N 279 
LEU   OXT  O N N 280 
LEU   H    H N N 281 
LEU   H2   H N N 282 
LEU   HA   H N N 283 
LEU   HB2  H N N 284 
LEU   HB3  H N N 285 
LEU   HG   H N N 286 
LEU   HD11 H N N 287 
LEU   HD12 H N N 288 
LEU   HD13 H N N 289 
LEU   HD21 H N N 290 
LEU   HD22 H N N 291 
LEU   HD23 H N N 292 
LEU   HXT  H N N 293 
LYS   N    N N N 294 
LYS   CA   C N S 295 
LYS   C    C N N 296 
LYS   O    O N N 297 
LYS   CB   C N N 298 
LYS   CG   C N N 299 
LYS   CD   C N N 300 
LYS   CE   C N N 301 
LYS   NZ   N N N 302 
LYS   OXT  O N N 303 
LYS   H    H N N 304 
LYS   H2   H N N 305 
LYS   HA   H N N 306 
LYS   HB2  H N N 307 
LYS   HB3  H N N 308 
LYS   HG2  H N N 309 
LYS   HG3  H N N 310 
LYS   HD2  H N N 311 
LYS   HD3  H N N 312 
LYS   HE2  H N N 313 
LYS   HE3  H N N 314 
LYS   HZ1  H N N 315 
LYS   HZ2  H N N 316 
LYS   HZ3  H N N 317 
LYS   HXT  H N N 318 
MET   N    N N N 319 
MET   CA   C N S 320 
MET   C    C N N 321 
MET   O    O N N 322 
MET   CB   C N N 323 
MET   CG   C N N 324 
MET   SD   S N N 325 
MET   CE   C N N 326 
MET   OXT  O N N 327 
MET   H    H N N 328 
MET   H2   H N N 329 
MET   HA   H N N 330 
MET   HB2  H N N 331 
MET   HB3  H N N 332 
MET   HG2  H N N 333 
MET   HG3  H N N 334 
MET   HE1  H N N 335 
MET   HE2  H N N 336 
MET   HE3  H N N 337 
MET   HXT  H N N 338 
PHE   N    N N N 339 
PHE   CA   C N S 340 
PHE   C    C N N 341 
PHE   O    O N N 342 
PHE   CB   C N N 343 
PHE   CG   C Y N 344 
PHE   CD1  C Y N 345 
PHE   CD2  C Y N 346 
PHE   CE1  C Y N 347 
PHE   CE2  C Y N 348 
PHE   CZ   C Y N 349 
PHE   OXT  O N N 350 
PHE   H    H N N 351 
PHE   H2   H N N 352 
PHE   HA   H N N 353 
PHE   HB2  H N N 354 
PHE   HB3  H N N 355 
PHE   HD1  H N N 356 
PHE   HD2  H N N 357 
PHE   HE1  H N N 358 
PHE   HE2  H N N 359 
PHE   HZ   H N N 360 
PHE   HXT  H N N 361 
PRO   N    N N N 362 
PRO   CA   C N S 363 
PRO   C    C N N 364 
PRO   O    O N N 365 
PRO   CB   C N N 366 
PRO   CG   C N N 367 
PRO   CD   C N N 368 
PRO   OXT  O N N 369 
PRO   H    H N N 370 
PRO   HA   H N N 371 
PRO   HB2  H N N 372 
PRO   HB3  H N N 373 
PRO   HG2  H N N 374 
PRO   HG3  H N N 375 
PRO   HD2  H N N 376 
PRO   HD3  H N N 377 
PRO   HXT  H N N 378 
SER   N    N N N 379 
SER   CA   C N S 380 
SER   C    C N N 381 
SER   O    O N N 382 
SER   CB   C N N 383 
SER   OG   O N N 384 
SER   OXT  O N N 385 
SER   H    H N N 386 
SER   H2   H N N 387 
SER   HA   H N N 388 
SER   HB2  H N N 389 
SER   HB3  H N N 390 
SER   HG   H N N 391 
SER   HXT  H N N 392 
THR   N    N N N 393 
THR   CA   C N S 394 
THR   C    C N N 395 
THR   O    O N N 396 
THR   CB   C N R 397 
THR   OG1  O N N 398 
THR   CG2  C N N 399 
THR   OXT  O N N 400 
THR   H    H N N 401 
THR   H2   H N N 402 
THR   HA   H N N 403 
THR   HB   H N N 404 
THR   HG1  H N N 405 
THR   HG21 H N N 406 
THR   HG22 H N N 407 
THR   HG23 H N N 408 
THR   HXT  H N N 409 
TRP   N    N N N 410 
TRP   CA   C N S 411 
TRP   C    C N N 412 
TRP   O    O N N 413 
TRP   CB   C N N 414 
TRP   CG   C Y N 415 
TRP   CD1  C Y N 416 
TRP   CD2  C Y N 417 
TRP   NE1  N Y N 418 
TRP   CE2  C Y N 419 
TRP   CE3  C Y N 420 
TRP   CZ2  C Y N 421 
TRP   CZ3  C Y N 422 
TRP   CH2  C Y N 423 
TRP   OXT  O N N 424 
TRP   H    H N N 425 
TRP   H2   H N N 426 
TRP   HA   H N N 427 
TRP   HB2  H N N 428 
TRP   HB3  H N N 429 
TRP   HD1  H N N 430 
TRP   HE1  H N N 431 
TRP   HE3  H N N 432 
TRP   HZ2  H N N 433 
TRP   HZ3  H N N 434 
TRP   HH2  H N N 435 
TRP   HXT  H N N 436 
TYR   N    N N N 437 
TYR   CA   C N S 438 
TYR   C    C N N 439 
TYR   O    O N N 440 
TYR   CB   C N N 441 
TYR   CG   C Y N 442 
TYR   CD1  C Y N 443 
TYR   CD2  C Y N 444 
TYR   CE1  C Y N 445 
TYR   CE2  C Y N 446 
TYR   CZ   C Y N 447 
TYR   OH   O N N 448 
TYR   OXT  O N N 449 
TYR   H    H N N 450 
TYR   H2   H N N 451 
TYR   HA   H N N 452 
TYR   HB2  H N N 453 
TYR   HB3  H N N 454 
TYR   HD1  H N N 455 
TYR   HD2  H N N 456 
TYR   HE1  H N N 457 
TYR   HE2  H N N 458 
TYR   HH   H N N 459 
TYR   HXT  H N N 460 
VAL   N    N N N 461 
VAL   CA   C N S 462 
VAL   C    C N N 463 
VAL   O    O N N 464 
VAL   CB   C N N 465 
VAL   CG1  C N N 466 
VAL   CG2  C N N 467 
VAL   OXT  O N N 468 
VAL   H    H N N 469 
VAL   H2   H N N 470 
VAL   HA   H N N 471 
VAL   HB   H N N 472 
VAL   HG11 H N N 473 
VAL   HG12 H N N 474 
VAL   HG13 H N N 475 
VAL   HG21 H N N 476 
VAL   HG22 H N N 477 
VAL   HG23 H N N 478 
VAL   HXT  H N N 479 
# 
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 
A1LW1 N31 C30  sing N N 1   
A1LW1 C30 C29  sing N N 2   
A1LW1 C8  C9   doub Y N 3   
A1LW1 C8  C7   sing Y N 4   
A1LW1 C29 C28  sing N N 5   
A1LW1 C28 C27  sing N N 6   
A1LW1 C9  C10  sing Y N 7   
A1LW1 C7  C6   doub Y N 8   
A1LW1 C10 C5   doub Y N 9   
A1LW1 C10 C1   sing N N 10  
A1LW1 C27 C26  sing N N 11  
A1LW1 C6  C5   sing Y N 12  
A1LW1 C26 N25  sing N N 13  
A1LW1 C26 C32  sing N N 14  
A1LW1 O24 C23  doub N N 15  
A1LW1 C5  C4   sing N N 16  
A1LW1 C1  C2   sing N N 17  
A1LW1 N25 C23  sing N N 18  
A1LW1 O33 C32  doub N N 19  
A1LW1 C23 C2   sing N N 20  
A1LW1 C32 N34  sing N N 21  
A1LW1 C2  N3   sing N N 22  
A1LW1 C4  N3   sing N N 23  
A1LW1 N34 C35  sing N N 24  
A1LW1 N3  C11  sing N N 25  
A1LW1 C45 C46  doub Y N 26  
A1LW1 C45 C44  sing Y N 27  
A1LW1 C46 C47  sing Y N 28  
A1LW1 C44 C43  doub Y N 29  
A1LW1 C47 C48  doub Y N 30  
A1LW1 C43 C48  sing Y N 31  
A1LW1 C43 C36  sing N N 32  
A1LW1 O16 C15  doub N N 33  
A1LW1 C35 C36  sing N N 34  
A1LW1 C36 C37  sing N N 35  
A1LW1 C11 O12  doub N N 36  
A1LW1 C11 C13  sing N N 37  
A1LW1 C14 C15  sing N N 38  
A1LW1 C14 C13  sing N N 39  
A1LW1 C15 C17  sing N N 40  
A1LW1 C22 C17  doub Y N 41  
A1LW1 C22 C21  sing Y N 42  
A1LW1 C37 C38  doub Y N 43  
A1LW1 C37 C42  sing Y N 44  
A1LW1 C17 C18  sing Y N 45  
A1LW1 C38 C39  sing Y N 46  
A1LW1 C21 C20  doub Y N 47  
A1LW1 C42 C41  doub Y N 48  
A1LW1 C18 C19  doub Y N 49  
A1LW1 C39 C40  doub Y N 50  
A1LW1 C20 C19  sing Y N 51  
A1LW1 C41 C40  sing Y N 52  
A1LW1 C4  H1   sing N N 53  
A1LW1 C4  H2   sing N N 54  
A1LW1 C6  H3   sing N N 55  
A1LW1 C7  H4   sing N N 56  
A1LW1 C8  H5   sing N N 57  
A1LW1 C13 H6   sing N N 58  
A1LW1 C13 H7   sing N N 59  
A1LW1 C20 H8   sing N N 60  
A1LW1 C21 H9   sing N N 61  
A1LW1 C22 H10  sing N N 62  
A1LW1 C26 H11  sing N N 63  
A1LW1 C28 H12  sing N N 64  
A1LW1 C28 H13  sing N N 65  
A1LW1 C1  H14  sing N N 66  
A1LW1 C1  H15  sing N N 67  
A1LW1 C14 H16  sing N N 68  
A1LW1 C14 H17  sing N N 69  
A1LW1 C18 H18  sing N N 70  
A1LW1 C19 H19  sing N N 71  
A1LW1 C2  H20  sing N N 72  
A1LW1 C27 H21  sing N N 73  
A1LW1 C27 H22  sing N N 74  
A1LW1 C29 H23  sing N N 75  
A1LW1 C29 H24  sing N N 76  
A1LW1 C30 H25  sing N N 77  
A1LW1 C30 H26  sing N N 78  
A1LW1 C35 H27  sing N N 79  
A1LW1 C35 H28  sing N N 80  
A1LW1 C36 H29  sing N N 81  
A1LW1 C38 H30  sing N N 82  
A1LW1 C39 H31  sing N N 83  
A1LW1 C40 H32  sing N N 84  
A1LW1 C41 H33  sing N N 85  
A1LW1 C42 H34  sing N N 86  
A1LW1 C44 H35  sing N N 87  
A1LW1 C45 H36  sing N N 88  
A1LW1 C46 H37  sing N N 89  
A1LW1 C47 H38  sing N N 90  
A1LW1 C48 H39  sing N N 91  
A1LW1 C9  H40  sing N N 92  
A1LW1 N25 H41  sing N N 93  
A1LW1 N31 H42  sing N N 94  
A1LW1 N31 H44  sing N N 95  
A1LW1 N34 H45  sing N N 96  
ALA   N   CA   sing N N 97  
ALA   N   H    sing N N 98  
ALA   N   H2   sing N N 99  
ALA   CA  C    sing N N 100 
ALA   CA  CB   sing N N 101 
ALA   CA  HA   sing N N 102 
ALA   C   O    doub N N 103 
ALA   C   OXT  sing N N 104 
ALA   CB  HB1  sing N N 105 
ALA   CB  HB2  sing N N 106 
ALA   CB  HB3  sing N N 107 
ALA   OXT HXT  sing N N 108 
ARG   N   CA   sing N N 109 
ARG   N   H    sing N N 110 
ARG   N   H2   sing N N 111 
ARG   CA  C    sing N N 112 
ARG   CA  CB   sing N N 113 
ARG   CA  HA   sing N N 114 
ARG   C   O    doub N N 115 
ARG   C   OXT  sing N N 116 
ARG   CB  CG   sing N N 117 
ARG   CB  HB2  sing N N 118 
ARG   CB  HB3  sing N N 119 
ARG   CG  CD   sing N N 120 
ARG   CG  HG2  sing N N 121 
ARG   CG  HG3  sing N N 122 
ARG   CD  NE   sing N N 123 
ARG   CD  HD2  sing N N 124 
ARG   CD  HD3  sing N N 125 
ARG   NE  CZ   sing N N 126 
ARG   NE  HE   sing N N 127 
ARG   CZ  NH1  sing N N 128 
ARG   CZ  NH2  doub N N 129 
ARG   NH1 HH11 sing N N 130 
ARG   NH1 HH12 sing N N 131 
ARG   NH2 HH21 sing N N 132 
ARG   NH2 HH22 sing N N 133 
ARG   OXT HXT  sing N N 134 
ASN   N   CA   sing N N 135 
ASN   N   H    sing N N 136 
ASN   N   H2   sing N N 137 
ASN   CA  C    sing N N 138 
ASN   CA  CB   sing N N 139 
ASN   CA  HA   sing N N 140 
ASN   C   O    doub N N 141 
ASN   C   OXT  sing N N 142 
ASN   CB  CG   sing N N 143 
ASN   CB  HB2  sing N N 144 
ASN   CB  HB3  sing N N 145 
ASN   CG  OD1  doub N N 146 
ASN   CG  ND2  sing N N 147 
ASN   ND2 HD21 sing N N 148 
ASN   ND2 HD22 sing N N 149 
ASN   OXT HXT  sing N N 150 
ASP   N   CA   sing N N 151 
ASP   N   H    sing N N 152 
ASP   N   H2   sing N N 153 
ASP   CA  C    sing N N 154 
ASP   CA  CB   sing N N 155 
ASP   CA  HA   sing N N 156 
ASP   C   O    doub N N 157 
ASP   C   OXT  sing N N 158 
ASP   CB  CG   sing N N 159 
ASP   CB  HB2  sing N N 160 
ASP   CB  HB3  sing N N 161 
ASP   CG  OD1  doub N N 162 
ASP   CG  OD2  sing N N 163 
ASP   OD2 HD2  sing N N 164 
ASP   OXT HXT  sing N N 165 
CYS   N   CA   sing N N 166 
CYS   N   H    sing N N 167 
CYS   N   H2   sing N N 168 
CYS   CA  C    sing N N 169 
CYS   CA  CB   sing N N 170 
CYS   CA  HA   sing N N 171 
CYS   C   O    doub N N 172 
CYS   C   OXT  sing N N 173 
CYS   CB  SG   sing N N 174 
CYS   CB  HB2  sing N N 175 
CYS   CB  HB3  sing N N 176 
CYS   SG  HG   sing N N 177 
CYS   OXT HXT  sing N N 178 
GLN   N   CA   sing N N 179 
GLN   N   H    sing N N 180 
GLN   N   H2   sing N N 181 
GLN   CA  C    sing N N 182 
GLN   CA  CB   sing N N 183 
GLN   CA  HA   sing N N 184 
GLN   C   O    doub N N 185 
GLN   C   OXT  sing N N 186 
GLN   CB  CG   sing N N 187 
GLN   CB  HB2  sing N N 188 
GLN   CB  HB3  sing N N 189 
GLN   CG  CD   sing N N 190 
GLN   CG  HG2  sing N N 191 
GLN   CG  HG3  sing N N 192 
GLN   CD  OE1  doub N N 193 
GLN   CD  NE2  sing N N 194 
GLN   NE2 HE21 sing N N 195 
GLN   NE2 HE22 sing N N 196 
GLN   OXT HXT  sing N N 197 
GLU   N   CA   sing N N 198 
GLU   N   H    sing N N 199 
GLU   N   H2   sing N N 200 
GLU   CA  C    sing N N 201 
GLU   CA  CB   sing N N 202 
GLU   CA  HA   sing N N 203 
GLU   C   O    doub N N 204 
GLU   C   OXT  sing N N 205 
GLU   CB  CG   sing N N 206 
GLU   CB  HB2  sing N N 207 
GLU   CB  HB3  sing N N 208 
GLU   CG  CD   sing N N 209 
GLU   CG  HG2  sing N N 210 
GLU   CG  HG3  sing N N 211 
GLU   CD  OE1  doub N N 212 
GLU   CD  OE2  sing N N 213 
GLU   OE2 HE2  sing N N 214 
GLU   OXT HXT  sing N N 215 
GLY   N   CA   sing N N 216 
GLY   N   H    sing N N 217 
GLY   N   H2   sing N N 218 
GLY   CA  C    sing N N 219 
GLY   CA  HA2  sing N N 220 
GLY   CA  HA3  sing N N 221 
GLY   C   O    doub N N 222 
GLY   C   OXT  sing N N 223 
GLY   OXT HXT  sing N N 224 
HIS   N   CA   sing N N 225 
HIS   N   H    sing N N 226 
HIS   N   H2   sing N N 227 
HIS   CA  C    sing N N 228 
HIS   CA  CB   sing N N 229 
HIS   CA  HA   sing N N 230 
HIS   C   O    doub N N 231 
HIS   C   OXT  sing N N 232 
HIS   CB  CG   sing N N 233 
HIS   CB  HB2  sing N N 234 
HIS   CB  HB3  sing N N 235 
HIS   CG  ND1  sing Y N 236 
HIS   CG  CD2  doub Y N 237 
HIS   ND1 CE1  doub Y N 238 
HIS   ND1 HD1  sing N N 239 
HIS   CD2 NE2  sing Y N 240 
HIS   CD2 HD2  sing N N 241 
HIS   CE1 NE2  sing Y N 242 
HIS   CE1 HE1  sing N N 243 
HIS   NE2 HE2  sing N N 244 
HIS   OXT HXT  sing N N 245 
ILE   N   CA   sing N N 246 
ILE   N   H    sing N N 247 
ILE   N   H2   sing N N 248 
ILE   CA  C    sing N N 249 
ILE   CA  CB   sing N N 250 
ILE   CA  HA   sing N N 251 
ILE   C   O    doub N N 252 
ILE   C   OXT  sing N N 253 
ILE   CB  CG1  sing N N 254 
ILE   CB  CG2  sing N N 255 
ILE   CB  HB   sing N N 256 
ILE   CG1 CD1  sing N N 257 
ILE   CG1 HG12 sing N N 258 
ILE   CG1 HG13 sing N N 259 
ILE   CG2 HG21 sing N N 260 
ILE   CG2 HG22 sing N N 261 
ILE   CG2 HG23 sing N N 262 
ILE   CD1 HD11 sing N N 263 
ILE   CD1 HD12 sing N N 264 
ILE   CD1 HD13 sing N N 265 
ILE   OXT HXT  sing N N 266 
LEU   N   CA   sing N N 267 
LEU   N   H    sing N N 268 
LEU   N   H2   sing N N 269 
LEU   CA  C    sing N N 270 
LEU   CA  CB   sing N N 271 
LEU   CA  HA   sing N N 272 
LEU   C   O    doub N N 273 
LEU   C   OXT  sing N N 274 
LEU   CB  CG   sing N N 275 
LEU   CB  HB2  sing N N 276 
LEU   CB  HB3  sing N N 277 
LEU   CG  CD1  sing N N 278 
LEU   CG  CD2  sing N N 279 
LEU   CG  HG   sing N N 280 
LEU   CD1 HD11 sing N N 281 
LEU   CD1 HD12 sing N N 282 
LEU   CD1 HD13 sing N N 283 
LEU   CD2 HD21 sing N N 284 
LEU   CD2 HD22 sing N N 285 
LEU   CD2 HD23 sing N N 286 
LEU   OXT HXT  sing N N 287 
LYS   N   CA   sing N N 288 
LYS   N   H    sing N N 289 
LYS   N   H2   sing N N 290 
LYS   CA  C    sing N N 291 
LYS   CA  CB   sing N N 292 
LYS   CA  HA   sing N N 293 
LYS   C   O    doub N N 294 
LYS   C   OXT  sing N N 295 
LYS   CB  CG   sing N N 296 
LYS   CB  HB2  sing N N 297 
LYS   CB  HB3  sing N N 298 
LYS   CG  CD   sing N N 299 
LYS   CG  HG2  sing N N 300 
LYS   CG  HG3  sing N N 301 
LYS   CD  CE   sing N N 302 
LYS   CD  HD2  sing N N 303 
LYS   CD  HD3  sing N N 304 
LYS   CE  NZ   sing N N 305 
LYS   CE  HE2  sing N N 306 
LYS   CE  HE3  sing N N 307 
LYS   NZ  HZ1  sing N N 308 
LYS   NZ  HZ2  sing N N 309 
LYS   NZ  HZ3  sing N N 310 
LYS   OXT HXT  sing N N 311 
MET   N   CA   sing N N 312 
MET   N   H    sing N N 313 
MET   N   H2   sing N N 314 
MET   CA  C    sing N N 315 
MET   CA  CB   sing N N 316 
MET   CA  HA   sing N N 317 
MET   C   O    doub N N 318 
MET   C   OXT  sing N N 319 
MET   CB  CG   sing N N 320 
MET   CB  HB2  sing N N 321 
MET   CB  HB3  sing N N 322 
MET   CG  SD   sing N N 323 
MET   CG  HG2  sing N N 324 
MET   CG  HG3  sing N N 325 
MET   SD  CE   sing N N 326 
MET   CE  HE1  sing N N 327 
MET   CE  HE2  sing N N 328 
MET   CE  HE3  sing N N 329 
MET   OXT HXT  sing N N 330 
PHE   N   CA   sing N N 331 
PHE   N   H    sing N N 332 
PHE   N   H2   sing N N 333 
PHE   CA  C    sing N N 334 
PHE   CA  CB   sing N N 335 
PHE   CA  HA   sing N N 336 
PHE   C   O    doub N N 337 
PHE   C   OXT  sing N N 338 
PHE   CB  CG   sing N N 339 
PHE   CB  HB2  sing N N 340 
PHE   CB  HB3  sing N N 341 
PHE   CG  CD1  doub Y N 342 
PHE   CG  CD2  sing Y N 343 
PHE   CD1 CE1  sing Y N 344 
PHE   CD1 HD1  sing N N 345 
PHE   CD2 CE2  doub Y N 346 
PHE   CD2 HD2  sing N N 347 
PHE   CE1 CZ   doub Y N 348 
PHE   CE1 HE1  sing N N 349 
PHE   CE2 CZ   sing Y N 350 
PHE   CE2 HE2  sing N N 351 
PHE   CZ  HZ   sing N N 352 
PHE   OXT HXT  sing N N 353 
PRO   N   CA   sing N N 354 
PRO   N   CD   sing N N 355 
PRO   N   H    sing N N 356 
PRO   CA  C    sing N N 357 
PRO   CA  CB   sing N N 358 
PRO   CA  HA   sing N N 359 
PRO   C   O    doub N N 360 
PRO   C   OXT  sing N N 361 
PRO   CB  CG   sing N N 362 
PRO   CB  HB2  sing N N 363 
PRO   CB  HB3  sing N N 364 
PRO   CG  CD   sing N N 365 
PRO   CG  HG2  sing N N 366 
PRO   CG  HG3  sing N N 367 
PRO   CD  HD2  sing N N 368 
PRO   CD  HD3  sing N N 369 
PRO   OXT HXT  sing N N 370 
SER   N   CA   sing N N 371 
SER   N   H    sing N N 372 
SER   N   H2   sing N N 373 
SER   CA  C    sing N N 374 
SER   CA  CB   sing N N 375 
SER   CA  HA   sing N N 376 
SER   C   O    doub N N 377 
SER   C   OXT  sing N N 378 
SER   CB  OG   sing N N 379 
SER   CB  HB2  sing N N 380 
SER   CB  HB3  sing N N 381 
SER   OG  HG   sing N N 382 
SER   OXT HXT  sing N N 383 
THR   N   CA   sing N N 384 
THR   N   H    sing N N 385 
THR   N   H2   sing N N 386 
THR   CA  C    sing N N 387 
THR   CA  CB   sing N N 388 
THR   CA  HA   sing N N 389 
THR   C   O    doub N N 390 
THR   C   OXT  sing N N 391 
THR   CB  OG1  sing N N 392 
THR   CB  CG2  sing N N 393 
THR   CB  HB   sing N N 394 
THR   OG1 HG1  sing N N 395 
THR   CG2 HG21 sing N N 396 
THR   CG2 HG22 sing N N 397 
THR   CG2 HG23 sing N N 398 
THR   OXT HXT  sing N N 399 
TRP   N   CA   sing N N 400 
TRP   N   H    sing N N 401 
TRP   N   H2   sing N N 402 
TRP   CA  C    sing N N 403 
TRP   CA  CB   sing N N 404 
TRP   CA  HA   sing N N 405 
TRP   C   O    doub N N 406 
TRP   C   OXT  sing N N 407 
TRP   CB  CG   sing N N 408 
TRP   CB  HB2  sing N N 409 
TRP   CB  HB3  sing N N 410 
TRP   CG  CD1  doub Y N 411 
TRP   CG  CD2  sing Y N 412 
TRP   CD1 NE1  sing Y N 413 
TRP   CD1 HD1  sing N N 414 
TRP   CD2 CE2  doub Y N 415 
TRP   CD2 CE3  sing Y N 416 
TRP   NE1 CE2  sing Y N 417 
TRP   NE1 HE1  sing N N 418 
TRP   CE2 CZ2  sing Y N 419 
TRP   CE3 CZ3  doub Y N 420 
TRP   CE3 HE3  sing N N 421 
TRP   CZ2 CH2  doub Y N 422 
TRP   CZ2 HZ2  sing N N 423 
TRP   CZ3 CH2  sing Y N 424 
TRP   CZ3 HZ3  sing N N 425 
TRP   CH2 HH2  sing N N 426 
TRP   OXT HXT  sing N N 427 
TYR   N   CA   sing N N 428 
TYR   N   H    sing N N 429 
TYR   N   H2   sing N N 430 
TYR   CA  C    sing N N 431 
TYR   CA  CB   sing N N 432 
TYR   CA  HA   sing N N 433 
TYR   C   O    doub N N 434 
TYR   C   OXT  sing N N 435 
TYR   CB  CG   sing N N 436 
TYR   CB  HB2  sing N N 437 
TYR   CB  HB3  sing N N 438 
TYR   CG  CD1  doub Y N 439 
TYR   CG  CD2  sing Y N 440 
TYR   CD1 CE1  sing Y N 441 
TYR   CD1 HD1  sing N N 442 
TYR   CD2 CE2  doub Y N 443 
TYR   CD2 HD2  sing N N 444 
TYR   CE1 CZ   doub Y N 445 
TYR   CE1 HE1  sing N N 446 
TYR   CE2 CZ   sing Y N 447 
TYR   CE2 HE2  sing N N 448 
TYR   CZ  OH   sing N N 449 
TYR   OH  HH   sing N N 450 
TYR   OXT HXT  sing N N 451 
VAL   N   CA   sing N N 452 
VAL   N   H    sing N N 453 
VAL   N   H2   sing N N 454 
VAL   CA  C    sing N N 455 
VAL   CA  CB   sing N N 456 
VAL   CA  HA   sing N N 457 
VAL   C   O    doub N N 458 
VAL   C   OXT  sing N N 459 
VAL   CB  CG1  sing N N 460 
VAL   CB  CG2  sing N N 461 
VAL   CB  HB   sing N N 462 
VAL   CG1 HG11 sing N N 463 
VAL   CG1 HG12 sing N N 464 
VAL   CG1 HG13 sing N N 465 
VAL   CG2 HG21 sing N N 466 
VAL   CG2 HG22 sing N N 467 
VAL   CG2 HG23 sing N N 468 
VAL   OXT HXT  sing N N 469 
# 
_em_admin.current_status     REL 
_em_admin.deposition_date    2024-01-19 
_em_admin.deposition_site    PDBJ 
_em_admin.entry_id           8XYI 
_em_admin.last_update        2025-04-09 
_em_admin.map_release_date   2025-02-26 
_em_admin.title              'Structure of CXCR3 in complex with VUF10661 (Receptor-ligand focused map)' 
# 
_em_ctf_correction.details                  ? 
_em_ctf_correction.em_image_processing_id   1 
_em_ctf_correction.id                       1 
_em_ctf_correction.type                     NONE 
# 
_em_entity_assembly_naturalsource.cell                 ? 
_em_entity_assembly_naturalsource.cellular_location    ? 
_em_entity_assembly_naturalsource.entity_assembly_id   1 
_em_entity_assembly_naturalsource.id                   2 
_em_entity_assembly_naturalsource.ncbi_tax_id          9606 
_em_entity_assembly_naturalsource.organism             'Homo sapiens' 
_em_entity_assembly_naturalsource.organelle            ? 
_em_entity_assembly_naturalsource.organ                ? 
_em_entity_assembly_naturalsource.strain               ? 
_em_entity_assembly_naturalsource.tissue               ? 
_em_entity_assembly_naturalsource.details              ? 
# 
_em_entity_assembly_recombinant.cell                 ? 
_em_entity_assembly_recombinant.entity_assembly_id   1 
_em_entity_assembly_recombinant.id                   2 
_em_entity_assembly_recombinant.ncbi_tax_id          7108 
_em_entity_assembly_recombinant.organism             'Spodoptera frugiperda' 
_em_entity_assembly_recombinant.plasmid              ? 
_em_entity_assembly_recombinant.strain               ? 
# 
_em_image_processing.details              ? 
_em_image_processing.id                   1 
_em_image_processing.image_recording_id   1 
# 
_em_image_recording.average_exposure_time               ? 
_em_image_recording.avg_electron_dose_per_subtomogram   ? 
_em_image_recording.avg_electron_dose_per_image         50.1 
_em_image_recording.details                             ? 
_em_image_recording.detector_mode                       ? 
_em_image_recording.film_or_detector_model              'GATAN K3 (6k x 4k)' 
_em_image_recording.id                                  1 
_em_image_recording.imaging_id                          1 
_em_image_recording.num_diffraction_images              ? 
_em_image_recording.num_grids_imaged                    ? 
_em_image_recording.num_real_images                     ? 
# 
loop_
_em_software.category 
_em_software.details 
_em_software.id 
_em_software.image_processing_id 
_em_software.fitting_id 
_em_software.imaging_id 
_em_software.name 
_em_software.version 
'PARTICLE SELECTION'            ? 1  1 ? ? ?         ?   
'IMAGE ACQUISITION'             ? 2  ? ? 1 ?         ?   
MASKING                         ? 3  ? ? ? ?         ?   
'CTF CORRECTION'                ? 4  1 ? ? ?         ?   
'LAYERLINE INDEXING'            ? 5  ? ? ? ?         ?   
'DIFFRACTION INDEXING'          ? 6  ? ? ? ?         ?   
'MODEL FITTING'                 ? 7  ? 1 ? Coot      ?   
OTHER                           ? 8  ? ? ? ?         ?   
'INITIAL EULER ASSIGNMENT'      ? 9  1 ? ? ?         ?   
'FINAL EULER ASSIGNMENT'        ? 10 1 ? ? ?         ?   
CLASSIFICATION                  ? 11 1 ? ? cryoSPARC 4.4 
RECONSTRUCTION                  ? 12 1 ? ? cryoSPARC 4.4 
'VOLUME SELECTION'              ? 13 1 1 1 ?         ?   
'SERIES ALIGNMENT'              ? 14 1 1 1 ?         ?   
'MOLECULAR REPLACEMENT'         ? 15 1 1 1 ?         ?   
'LATTICE DISTORTION CORRECTION' ? 16 1 1 1 ?         ?   
'SYMMETRY DETERMINATION'        ? 17 1 1 1 ?         ?   
'CRYSTALLOGRAPHY MERGING'       ? 18 1 1 1 ?         ?   
'MODEL REFINEMENT'              ? 19 ? 1 ? PHENIX    ?   
# 
_em_specimen.concentration           ? 
_em_specimen.details                 ? 
_em_specimen.embedding_applied       NO 
_em_specimen.experiment_id           1 
_em_specimen.id                      1 
_em_specimen.shadowing_applied       NO 
_em_specimen.staining_applied        NO 
_em_specimen.vitrification_applied   YES 
# 
_pdbx_audit_support.funding_organization   'Science and Engineering Research Board (SERB)' 
_pdbx_audit_support.country                India 
_pdbx_audit_support.grant_number           IPA/2020/000405 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.type             'in silico model' 
_pdbx_initial_refinement_model.source_name      AlphaFold 
_pdbx_initial_refinement_model.accession_code   ? 
# 
_atom_sites.entry_id                    8XYI 
_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]   1.000000 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   1.000000 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_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]   1.000000 
_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 
C 
N 
O 
S 
# 
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   1    N N   . ASP   A 1 102 ? 139.500 119.364 71.556  1.00 135.51 ? 46  ASP   R N   1 
ATOM   2    C CA  . ASP   A 1 102 ? 140.402 119.274 72.740  1.00 136.54 ? 46  ASP   R CA  1 
ATOM   3    C C   . ASP   A 1 102 ? 140.367 120.562 73.560  1.00 134.81 ? 46  ASP   R C   1 
ATOM   4    O O   . ASP   A 1 102 ? 141.014 120.659 74.602  1.00 135.98 ? 46  ASP   R O   1 
ATOM   5    C CB  . ASP   A 1 102 ? 141.835 118.975 72.293  1.00 136.91 ? 46  ASP   R CB  1 
ATOM   6    C CG  . ASP   A 1 102 ? 142.614 118.182 73.323  1.00 135.70 ? 46  ASP   R CG  1 
ATOM   7    O OD1 . ASP   A 1 102 ? 142.791 118.682 74.453  1.00 136.40 ? 46  ASP   R OD1 1 
ATOM   8    O OD2 . ASP   A 1 102 ? 143.054 117.059 73.000  1.00 134.95 ? 46  ASP   R OD2 1 
ATOM   9    N N   . PHE   A 1 103 ? 139.603 121.548 73.088  1.00 125.50 ? 47  PHE   R N   1 
ATOM   10   C CA  . PHE   A 1 103 ? 139.555 122.841 73.764  1.00 127.73 ? 47  PHE   R CA  1 
ATOM   11   C C   . PHE   A 1 103 ? 139.036 122.694 75.190  1.00 128.25 ? 47  PHE   R C   1 
ATOM   12   O O   . PHE   A 1 103 ? 139.602 123.257 76.135  1.00 127.27 ? 47  PHE   R O   1 
ATOM   13   C CB  . PHE   A 1 103 ? 138.679 123.809 72.966  1.00 126.41 ? 47  PHE   R CB  1 
ATOM   14   C CG  . PHE   A 1 103 ? 138.065 124.898 73.799  1.00 127.45 ? 47  PHE   R CG  1 
ATOM   15   C CD1 . PHE   A 1 103 ? 138.861 125.834 74.437  1.00 127.89 ? 47  PHE   R CD1 1 
ATOM   16   C CD2 . PHE   A 1 103 ? 136.691 124.986 73.944  1.00 126.68 ? 47  PHE   R CD2 1 
ATOM   17   C CE1 . PHE   A 1 103 ? 138.297 126.836 75.203  1.00 127.00 ? 47  PHE   R CE1 1 
ATOM   18   C CE2 . PHE   A 1 103 ? 136.123 125.987 74.709  1.00 127.02 ? 47  PHE   R CE2 1 
ATOM   19   C CZ  . PHE   A 1 103 ? 136.927 126.912 75.339  1.00 126.15 ? 47  PHE   R CZ  1 
ATOM   20   N N   . SER   A 1 104 ? 137.954 121.934 75.363  1.00 126.11 ? 48  SER   R N   1 
ATOM   21   C CA  . SER   A 1 104 ? 137.372 121.767 76.690  1.00 124.51 ? 48  SER   R CA  1 
ATOM   22   C C   . SER   A 1 104 ? 138.355 121.093 77.638  1.00 126.73 ? 48  SER   R C   1 
ATOM   23   O O   . SER   A 1 104 ? 138.487 121.487 78.802  1.00 128.29 ? 48  SER   R O   1 
ATOM   24   C CB  . SER   A 1 104 ? 136.078 120.960 76.591  1.00 122.66 ? 48  SER   R CB  1 
ATOM   25   O OG  . SER   A 1 104 ? 136.276 119.773 75.845  1.00 121.83 ? 48  SER   R OG  1 
ATOM   26   N N   . LEU   A 1 105 ? 139.056 120.066 77.153  1.00 133.11 ? 49  LEU   R N   1 
ATOM   27   C CA  . LEU   A 1 105 ? 139.993 119.345 78.008  1.00 130.86 ? 49  LEU   R CA  1 
ATOM   28   C C   . LEU   A 1 105 ? 141.128 120.253 78.466  1.00 128.75 ? 49  LEU   R C   1 
ATOM   29   O O   . LEU   A 1 105 ? 141.491 120.264 79.648  1.00 126.89 ? 49  LEU   R O   1 
ATOM   30   C CB  . LEU   A 1 105 ? 140.540 118.124 77.268  1.00 130.51 ? 49  LEU   R CB  1 
ATOM   31   C CG  . LEU   A 1 105 ? 139.503 117.250 76.558  1.00 130.50 ? 49  LEU   R CG  1 
ATOM   32   C CD1 . LEU   A 1 105 ? 140.138 115.955 76.077  1.00 127.03 ? 49  LEU   R CD1 1 
ATOM   33   C CD2 . LEU   A 1 105 ? 138.320 116.959 77.469  1.00 130.30 ? 49  LEU   R CD2 1 
ATOM   34   N N   . ASN   A 1 106 ? 141.700 121.029 77.543  1.00 131.06 ? 50  ASN   R N   1 
ATOM   35   C CA  . ASN   A 1 106 ? 142.786 121.932 77.913  1.00 130.16 ? 50  ASN   R CA  1 
ATOM   36   C C   . ASN   A 1 106 ? 142.299 123.013 78.868  1.00 128.97 ? 50  ASN   R C   1 
ATOM   37   O O   . ASN   A 1 106 ? 143.010 123.391 79.809  1.00 126.77 ? 50  ASN   R O   1 
ATOM   38   C CB  . ASN   A 1 106 ? 143.398 122.560 76.661  1.00 129.01 ? 50  ASN   R CB  1 
ATOM   39   C CG  . ASN   A 1 106 ? 143.896 121.525 75.674  1.00 129.67 ? 50  ASN   R CG  1 
ATOM   40   O OD1 . ASN   A 1 106 ? 143.536 121.548 74.498  1.00 131.59 ? 50  ASN   R OD1 1 
ATOM   41   N ND2 . ASN   A 1 106 ? 144.726 120.604 76.150  1.00 128.80 ? 50  ASN   R ND2 1 
ATOM   42   N N   . PHE   A 1 107 ? 141.092 123.533 78.635  1.00 122.34 ? 51  PHE   R N   1 
ATOM   43   C CA  . PHE   A 1 107 ? 140.538 124.530 79.542  1.00 121.65 ? 51  PHE   R CA  1 
ATOM   44   C C   . PHE   A 1 107 ? 140.391 123.953 80.942  1.00 116.73 ? 51  PHE   R C   1 
ATOM   45   O O   . PHE   A 1 107 ? 140.737 124.600 81.935  1.00 116.25 ? 51  PHE   R O   1 
ATOM   46   C CB  . PHE   A 1 107 ? 139.193 125.033 79.016  1.00 121.84 ? 51  PHE   R CB  1 
ATOM   47   C CG  . PHE   A 1 107 ? 138.482 125.963 79.960  1.00 121.37 ? 51  PHE   R CG  1 
ATOM   48   C CD1 . PHE   A 1 107 ? 137.759 125.469 81.035  1.00 120.41 ? 51  PHE   R CD1 1 
ATOM   49   C CD2 . PHE   A 1 107 ? 138.544 127.332 79.776  1.00 119.50 ? 51  PHE   R CD2 1 
ATOM   50   C CE1 . PHE   A 1 107 ? 137.111 126.322 81.900  1.00 120.75 ? 51  PHE   R CE1 1 
ATOM   51   C CE2 . PHE   A 1 107 ? 137.897 128.189 80.640  1.00 122.56 ? 51  PHE   R CE2 1 
ATOM   52   C CZ  . PHE   A 1 107 ? 137.179 127.683 81.703  1.00 123.59 ? 51  PHE   R CZ  1 
ATOM   53   N N   . ASP   A 1 108 ? 139.880 122.726 81.039  1.00 119.08 ? 52  ASP   R N   1 
ATOM   54   C CA  . ASP   A 1 108 ? 139.781 122.079 82.341  1.00 120.17 ? 52  ASP   R CA  1 
ATOM   55   C C   . ASP   A 1 108 ? 141.157 121.935 82.975  1.00 120.27 ? 52  ASP   R C   1 
ATOM   56   O O   . ASP   A 1 108 ? 141.347 122.265 84.152  1.00 115.50 ? 52  ASP   R O   1 
ATOM   57   C CB  . ASP   A 1 108 ? 139.115 120.711 82.195  1.00 123.67 ? 52  ASP   R CB  1 
ATOM   58   C CG  . ASP   A 1 108 ? 137.754 120.794 81.534  1.00 125.79 ? 52  ASP   R CG  1 
ATOM   59   O OD1 . ASP   A 1 108 ? 137.317 121.919 81.218  1.00 126.86 ? 52  ASP   R OD1 1 
ATOM   60   O OD2 . ASP   A 1 108 ? 137.122 119.736 81.326  1.00 121.99 ? 52  ASP   R OD2 1 
ATOM   61   N N   . ARG   A 1 109 ? 142.138 121.484 82.193  1.00 130.77 ? 53  ARG   R N   1 
ATOM   62   C CA  . ARG   A 1 109 ? 143.482 121.261 82.716  1.00 131.64 ? 53  ARG   R CA  1 
ATOM   63   C C   . ARG   A 1 109 ? 144.064 122.538 83.309  1.00 129.63 ? 53  ARG   R C   1 
ATOM   64   O O   . ARG   A 1 109 ? 144.633 122.526 84.406  1.00 126.28 ? 53  ARG   R O   1 
ATOM   65   C CB  . ARG   A 1 109 ? 144.390 120.727 81.604  1.00 128.46 ? 53  ARG   R CB  1 
ATOM   66   C CG  . ARG   A 1 109 ? 144.025 119.335 81.101  1.00 125.92 ? 53  ARG   R CG  1 
ATOM   67   C CD  . ARG   A 1 109 ? 145.252 118.451 80.921  1.00 125.20 ? 53  ARG   R CD  1 
ATOM   68   N NE  . ARG   A 1 109 ? 146.090 118.399 82.111  1.00 126.93 ? 53  ARG   R NE  1 
ATOM   69   C CZ  . ARG   A 1 109 ? 147.190 117.666 82.219  1.00 130.08 ? 53  ARG   R CZ  1 
ATOM   70   N NH1 . ARG   A 1 109 ? 147.612 116.900 81.227  1.00 128.16 ? 53  ARG   R NH1 1 
ATOM   71   N NH2 . ARG   A 1 109 ? 147.885 117.704 83.353  1.00 130.31 ? 53  ARG   R NH2 1 
ATOM   72   N N   . ALA   A 1 110 ? 143.927 123.656 82.597  1.00 118.41 ? 54  ALA   R N   1 
ATOM   73   C CA  . ALA   A 1 110 ? 144.589 124.900 82.973  1.00 112.41 ? 54  ALA   R CA  1 
ATOM   74   C C   . ALA   A 1 110 ? 143.757 125.747 83.932  1.00 114.08 ? 54  ALA   R C   1 
ATOM   75   O O   . ALA   A 1 110 ? 144.187 126.839 84.319  1.00 114.41 ? 54  ALA   R O   1 
ATOM   76   C CB  . ALA   A 1 110 ? 144.932 125.707 81.722  1.00 111.80 ? 54  ALA   R CB  1 
ATOM   77   N N   . PHE   A 1 111 ? 142.578 125.268 84.333  1.00 114.94 ? 55  PHE   R N   1 
ATOM   78   C CA  . PHE   A 1 111 ? 141.676 126.074 85.153  1.00 116.91 ? 55  PHE   R CA  1 
ATOM   79   C C   . PHE   A 1 111 ? 141.180 125.380 86.414  1.00 114.78 ? 55  PHE   R C   1 
ATOM   80   O O   . PHE   A 1 111 ? 140.918 126.072 87.403  1.00 114.22 ? 55  PHE   R O   1 
ATOM   81   C CB  . PHE   A 1 111 ? 140.463 126.513 84.315  1.00 119.69 ? 55  PHE   R CB  1 
ATOM   82   C CG  . PHE   A 1 111 ? 139.299 127.005 85.127  1.00 117.36 ? 55  PHE   R CG  1 
ATOM   83   C CD1 . PHE   A 1 111 ? 139.401 128.155 85.888  1.00 116.30 ? 55  PHE   R CD1 1 
ATOM   84   C CD2 . PHE   A 1 111 ? 138.095 126.324 85.114  1.00 113.03 ? 55  PHE   R CD2 1 
ATOM   85   C CE1 . PHE   A 1 111 ? 138.327 128.607 86.628  1.00 114.77 ? 55  PHE   R CE1 1 
ATOM   86   C CE2 . PHE   A 1 111 ? 137.022 126.771 85.854  1.00 111.90 ? 55  PHE   R CE2 1 
ATOM   87   C CZ  . PHE   A 1 111 ? 137.137 127.913 86.610  1.00 112.50 ? 55  PHE   R CZ  1 
ATOM   88   N N   . LEU   A 1 112 ? 141.051 124.056 86.436  1.00 107.82 ? 56  LEU   R N   1 
ATOM   89   C CA  . LEU   A 1 112 ? 140.485 123.356 87.581  1.00 108.50 ? 56  LEU   R CA  1 
ATOM   90   C C   . LEU   A 1 112 ? 141.485 123.210 88.724  1.00 110.45 ? 56  LEU   R C   1 
ATOM   91   O O   . LEU   A 1 112 ? 141.111 123.385 89.892  1.00 110.37 ? 56  LEU   R O   1 
ATOM   92   C CB  . LEU   A 1 112 ? 139.978 121.983 87.142  1.00 108.02 ? 56  LEU   R CB  1 
ATOM   93   C CG  . LEU   A 1 112 ? 138.524 121.948 86.670  1.00 109.26 ? 56  LEU   R CG  1 
ATOM   94   C CD1 . LEU   A 1 112 ? 138.182 123.165 85.834  1.00 110.83 ? 56  LEU   R CD1 1 
ATOM   95   C CD2 . LEU   A 1 112 ? 138.264 120.685 85.877  1.00 109.67 ? 56  LEU   R CD2 1 
ATOM   96   N N   . PRO   A 1 113 ? 142.752 122.879 88.447  1.00 106.12 ? 57  PRO   R N   1 
ATOM   97   C CA  . PRO   A 1 113 ? 143.711 122.689 89.544  1.00 102.77 ? 57  PRO   R CA  1 
ATOM   98   C C   . PRO   A 1 113 ? 143.772 123.865 90.506  1.00 103.93 ? 57  PRO   R C   1 
ATOM   99   O O   . PRO   A 1 113 ? 143.553 123.695 91.709  1.00 103.11 ? 57  PRO   R O   1 
ATOM   100  C CB  . PRO   A 1 113 ? 145.040 122.499 88.805  1.00 101.39 ? 57  PRO   R CB  1 
ATOM   101  C CG  . PRO   A 1 113 ? 144.648 121.892 87.514  1.00 101.46 ? 57  PRO   R CG  1 
ATOM   102  C CD  . PRO   A 1 113 ? 143.359 122.566 87.141  1.00 102.60 ? 57  PRO   R CD  1 
ATOM   103  N N   . ALA   A 1 114 ? 144.070 125.059 89.989  1.00 97.73  ? 58  ALA   R N   1 
ATOM   104  C CA  . ALA   A 1 114 ? 144.249 126.216 90.860  1.00 94.29  ? 58  ALA   R CA  1 
ATOM   105  C C   . ALA   A 1 114 ? 142.956 126.583 91.576  1.00 96.17  ? 58  ALA   R C   1 
ATOM   106  O O   . ALA   A 1 114 ? 142.971 126.903 92.772  1.00 98.79  ? 58  ALA   R O   1 
ATOM   107  C CB  . ALA   A 1 114 ? 144.764 127.403 90.048  1.00 95.31  ? 58  ALA   R CB  1 
ATOM   108  N N   . LEU   A 1 115 ? 141.830 126.564 90.861  1.00 100.05 ? 59  LEU   R N   1 
ATOM   109  C CA  . LEU   A 1 115 ? 140.565 126.920 91.491  1.00 100.71 ? 59  LEU   R CA  1 
ATOM   110  C C   . LEU   A 1 115 ? 140.241 125.969 92.632  1.00 101.11 ? 59  LEU   R C   1 
ATOM   111  O O   . LEU   A 1 115 ? 139.861 126.408 93.724  1.00 104.73 ? 59  LEU   R O   1 
ATOM   112  C CB  . LEU   A 1 115 ? 139.440 126.918 90.454  1.00 99.04  ? 59  LEU   R CB  1 
ATOM   113  C CG  . LEU   A 1 115 ? 138.009 126.825 90.997  1.00 101.32 ? 59  LEU   R CG  1 
ATOM   114  C CD1 . LEU   A 1 115 ? 137.703 128.000 91.911  1.00 103.57 ? 59  LEU   R CD1 1 
ATOM   115  C CD2 . LEU   A 1 115 ? 137.007 126.763 89.857  1.00 98.90  ? 59  LEU   R CD2 1 
ATOM   116  N N   . TYR   A 1 116 ? 140.396 124.665 92.404  1.00 99.04  ? 60  TYR   R N   1 
ATOM   117  C CA  . TYR   A 1 116 ? 140.098 123.707 93.459  1.00 99.75  ? 60  TYR   R CA  1 
ATOM   118  C C   . TYR   A 1 116 ? 141.097 123.815 94.602  1.00 103.04 ? 60  TYR   R C   1 
ATOM   119  O O   . TYR   A 1 116 ? 140.727 123.610 95.760  1.00 103.50 ? 60  TYR   R O   1 
ATOM   120  C CB  . TYR   A 1 116 ? 140.070 122.287 92.894  1.00 99.13  ? 60  TYR   R CB  1 
ATOM   121  C CG  . TYR   A 1 116 ? 138.914 122.013 91.948  1.00 100.59 ? 60  TYR   R CG  1 
ATOM   122  C CD1 . TYR   A 1 116 ? 138.005 123.007 91.612  1.00 104.96 ? 60  TYR   R CD1 1 
ATOM   123  C CD2 . TYR   A 1 116 ? 138.731 120.754 91.395  1.00 100.86 ? 60  TYR   R CD2 1 
ATOM   124  C CE1 . TYR   A 1 116 ? 136.954 122.755 90.752  1.00 104.35 ? 60  TYR   R CE1 1 
ATOM   125  C CE2 . TYR   A 1 116 ? 137.682 120.495 90.535  1.00 101.60 ? 60  TYR   R CE2 1 
ATOM   126  C CZ  . TYR   A 1 116 ? 136.798 121.499 90.218  1.00 100.65 ? 60  TYR   R CZ  1 
ATOM   127  O OH  . TYR   A 1 116 ? 135.752 121.246 89.363  1.00 100.09 ? 60  TYR   R OH  1 
ATOM   128  N N   . SER   A 1 117 ? 142.355 124.152 94.310  1.00 103.88 ? 61  SER   R N   1 
ATOM   129  C CA  . SER   A 1 117 ? 143.328 124.346 95.380  1.00 102.31 ? 61  SER   R CA  1 
ATOM   130  C C   . SER   A 1 117 ? 142.929 125.510 96.277  1.00 102.04 ? 61  SER   R C   1 
ATOM   131  O O   . SER   A 1 117 ? 142.953 125.399 97.511  1.00 102.21 ? 61  SER   R O   1 
ATOM   132  C CB  . SER   A 1 117 ? 144.714 124.582 94.783  1.00 102.56 ? 61  SER   R CB  1 
ATOM   133  O OG  . SER   A 1 117 ? 145.599 125.113 95.752  1.00 106.94 ? 61  SER   R OG  1 
ATOM   134  N N   . LEU   A 1 118 ? 142.568 126.642 95.672  1.00 101.24 ? 62  LEU   R N   1 
ATOM   135  C CA  . LEU   A 1 118 ? 142.151 127.790 96.467  1.00 98.51  ? 62  LEU   R CA  1 
ATOM   136  C C   . LEU   A 1 118 ? 140.881 127.486 97.246  1.00 95.53  ? 62  LEU   R C   1 
ATOM   137  O O   . LEU   A 1 118 ? 140.759 127.878 98.414  1.00 97.66  ? 62  LEU   R O   1 
ATOM   138  C CB  . LEU   A 1 118 ? 141.943 129.011 95.575  1.00 97.21  ? 62  LEU   R CB  1 
ATOM   139  C CG  . LEU   A 1 118 ? 141.981 130.336 96.335  1.00 96.79  ? 62  LEU   R CG  1 
ATOM   140  C CD1 . LEU   A 1 118 ? 143.419 130.775 96.556  1.00 95.65  ? 62  LEU   R CD1 1 
ATOM   141  C CD2 . LEU   A 1 118 ? 141.194 131.407 95.603  1.00 101.87 ? 62  LEU   R CD2 1 
ATOM   142  N N   . LEU   A 1 119 ? 139.926 126.796 96.620  1.00 97.43  ? 63  LEU   R N   1 
ATOM   143  C CA  . LEU   A 1 119 ? 138.713 126.412 97.332  1.00 100.32 ? 63  LEU   R CA  1 
ATOM   144  C C   . LEU   A 1 119 ? 139.047 125.528 98.524  1.00 100.82 ? 63  LEU   R C   1 
ATOM   145  O O   . LEU   A 1 119 ? 138.501 125.712 99.615  1.00 97.71  ? 63  LEU   R O   1 
ATOM   146  C CB  . LEU   A 1 119 ? 137.749 125.694 96.388  1.00 101.93 ? 63  LEU   R CB  1 
ATOM   147  C CG  . LEU   A 1 119 ? 136.890 126.567 95.473  1.00 97.00  ? 63  LEU   R CG  1 
ATOM   148  C CD1 . LEU   A 1 119 ? 136.051 125.696 94.557  1.00 96.00  ? 63  LEU   R CD1 1 
ATOM   149  C CD2 . LEU   A 1 119 ? 136.002 127.496 96.280  1.00 96.95  ? 63  LEU   R CD2 1 
ATOM   150  N N   . PHE   A 1 120 ? 139.942 124.559 98.334  1.00 102.18 ? 64  PHE   R N   1 
ATOM   151  C CA  . PHE   A 1 120 ? 140.343 123.690 99.432  1.00 101.00 ? 64  PHE   R CA  1 
ATOM   152  C C   . PHE   A 1 120 ? 140.943 124.488 100.578 1.00 99.54  ? 64  PHE   R C   1 
ATOM   153  O O   . PHE   A 1 120 ? 140.517 124.335 101.729 1.00 99.53  ? 64  PHE   R O   1 
ATOM   154  C CB  . PHE   A 1 120 ? 141.337 122.645 98.916  1.00 102.51 ? 64  PHE   R CB  1 
ATOM   155  C CG  . PHE   A 1 120 ? 141.826 121.687 99.966  1.00 99.85  ? 64  PHE   R CG  1 
ATOM   156  C CD1 . PHE   A 1 120 ? 142.810 122.059 100.863 1.00 97.81  ? 64  PHE   R CD1 1 
ATOM   157  C CD2 . PHE   A 1 120 ? 141.308 120.410 100.046 1.00 99.67  ? 64  PHE   R CD2 1 
ATOM   158  C CE1 . PHE   A 1 120 ? 143.263 121.178 101.819 1.00 97.64  ? 64  PHE   R CE1 1 
ATOM   159  C CE2 . PHE   A 1 120 ? 141.758 119.526 101.003 1.00 100.89 ? 64  PHE   R CE2 1 
ATOM   160  C CZ  . PHE   A 1 120 ? 142.735 119.911 101.889 1.00 99.12  ? 64  PHE   R CZ  1 
ATOM   161  N N   . LEU   A 1 121 ? 141.919 125.349 100.289 1.00 97.89  ? 65  LEU   R N   1 
ATOM   162  C CA  . LEU   A 1 121 ? 142.540 126.123 101.359 1.00 97.63  ? 65  LEU   R CA  1 
ATOM   163  C C   . LEU   A 1 121 ? 141.513 126.978 102.091 1.00 96.72  ? 65  LEU   R C   1 
ATOM   164  O O   . LEU   A 1 121 ? 141.412 126.924 103.324 1.00 95.93  ? 65  LEU   R O   1 
ATOM   165  C CB  . LEU   A 1 121 ? 143.658 127.007 100.803 1.00 101.01 ? 65  LEU   R CB  1 
ATOM   166  C CG  . LEU   A 1 121 ? 144.860 126.327 100.148 1.00 99.54  ? 65  LEU   R CG  1 
ATOM   167  C CD1 . LEU   A 1 121 ? 146.049 127.272 100.142 1.00 98.73  ? 65  LEU   R CD1 1 
ATOM   168  C CD2 . LEU   A 1 121 ? 145.222 125.034 100.856 1.00 97.22  ? 65  LEU   R CD2 1 
ATOM   169  N N   . LEU   A 1 122 ? 140.730 127.762 101.350 1.00 97.29  ? 66  LEU   R N   1 
ATOM   170  C CA  . LEU   A 1 122 ? 139.793 128.675 101.988 1.00 95.87  ? 66  LEU   R CA  1 
ATOM   171  C C   . LEU   A 1 122 ? 138.679 127.950 102.732 1.00 98.11  ? 66  LEU   R C   1 
ATOM   172  O O   . LEU   A 1 122 ? 138.292 128.399 103.815 1.00 102.93 ? 66  LEU   R O   1 
ATOM   173  C CB  . LEU   A 1 122 ? 139.196 129.623 100.946 1.00 97.72  ? 66  LEU   R CB  1 
ATOM   174  C CG  . LEU   A 1 122 ? 138.918 131.046 101.439 1.00 99.76  ? 66  LEU   R CG  1 
ATOM   175  C CD1 . LEU   A 1 122 ? 138.632 131.972 100.267 1.00 98.65  ? 66  LEU   R CD1 1 
ATOM   176  C CD2 . LEU   A 1 122 ? 137.769 131.071 102.434 1.00 99.68  ? 66  LEU   R CD2 1 
ATOM   177  N N   . GLY   A 1 123 ? 138.165 126.842 102.201 1.00 96.53  ? 67  GLY   R N   1 
ATOM   178  C CA  . GLY   A 1 123 ? 137.150 126.077 102.888 1.00 97.46  ? 67  GLY   R CA  1 
ATOM   179  C C   . GLY   A 1 123 ? 137.673 125.432 104.151 1.00 97.21  ? 67  GLY   R C   1 
ATOM   180  O O   . GLY   A 1 123 ? 137.008 125.483 105.188 1.00 96.86  ? 67  GLY   R O   1 
ATOM   181  N N   . LEU   A 1 124 ? 138.862 124.833 104.096 1.00 95.76  ? 68  LEU   R N   1 
ATOM   182  C CA  . LEU   A 1 124 ? 139.461 124.282 105.301 1.00 95.23  ? 68  LEU   R CA  1 
ATOM   183  C C   . LEU   A 1 124 ? 139.740 125.342 106.352 1.00 96.68  ? 68  LEU   R C   1 
ATOM   184  O O   . LEU   A 1 124 ? 139.633 125.050 107.548 1.00 100.13 ? 68  LEU   R O   1 
ATOM   185  C CB  . LEU   A 1 124 ? 140.766 123.556 104.969 1.00 95.70  ? 68  LEU   R CB  1 
ATOM   186  C CG  . LEU   A 1 124 ? 140.664 122.061 104.668 1.00 98.24  ? 68  LEU   R CG  1 
ATOM   187  C CD1 . LEU   A 1 124 ? 140.450 121.279 105.950 1.00 98.07  ? 68  LEU   R CD1 1 
ATOM   188  C CD2 . LEU   A 1 124 ? 139.549 121.780 103.683 1.00 98.49  ? 68  LEU   R CD2 1 
ATOM   189  N N   . LEU   A 1 125 ? 140.087 126.560 105.942 1.00 94.75  ? 69  LEU   R N   1 
ATOM   190  C CA  . LEU   A 1 125 ? 140.356 127.615 106.907 1.00 95.41  ? 69  LEU   R CA  1 
ATOM   191  C C   . LEU   A 1 125 ? 139.094 128.282 107.438 1.00 94.27  ? 69  LEU   R C   1 
ATOM   192  O O   . LEU   A 1 125 ? 139.127 128.839 108.541 1.00 95.87  ? 69  LEU   R O   1 
ATOM   193  C CB  . LEU   A 1 125 ? 141.263 128.677 106.285 1.00 99.30  ? 69  LEU   R CB  1 
ATOM   194  C CG  . LEU   A 1 125 ? 142.755 128.487 106.559 1.00 103.53 ? 69  LEU   R CG  1 
ATOM   195  C CD1 . LEU   A 1 125 ? 143.246 127.156 106.002 1.00 101.66 ? 69  LEU   R CD1 1 
ATOM   196  C CD2 . LEU   A 1 125 ? 143.544 129.645 105.976 1.00 101.49 ? 69  LEU   R CD2 1 
ATOM   197  N N   . GLY   A 1 126 ? 137.994 128.252 106.691 1.00 87.48  ? 70  GLY   R N   1 
ATOM   198  C CA  . GLY   A 1 126 ? 136.765 128.865 107.158 1.00 86.86  ? 70  GLY   R CA  1 
ATOM   199  C C   . GLY   A 1 126 ? 135.825 127.921 107.881 1.00 87.97  ? 70  GLY   R C   1 
ATOM   200  O O   . GLY   A 1 126 ? 135.424 128.185 109.020 1.00 93.99  ? 70  GLY   R O   1 
ATOM   201  N N   . ASN   A 1 127 ? 135.458 126.814 107.233 1.00 77.52  ? 71  ASN   R N   1 
ATOM   202  C CA  . ASN   A 1 127 ? 134.540 125.877 107.863 1.00 74.86  ? 71  ASN   R CA  1 
ATOM   203  C C   . ASN   A 1 127 ? 135.187 125.190 109.053 1.00 81.39  ? 71  ASN   R C   1 
ATOM   204  O O   . ASN   A 1 127 ? 134.514 124.918 110.052 1.00 84.82  ? 71  ASN   R O   1 
ATOM   205  C CB  . ASN   A 1 127 ? 134.058 124.846 106.846 1.00 78.78  ? 71  ASN   R CB  1 
ATOM   206  C CG  . ASN   A 1 127 ? 133.430 125.483 105.626 1.00 86.57  ? 71  ASN   R CG  1 
ATOM   207  O OD1 . ASN   A 1 127 ? 132.208 125.532 105.498 1.00 89.37  ? 71  ASN   R OD1 1 
ATOM   208  N ND2 . ASN   A 1 127 ? 134.262 125.961 104.712 1.00 86.98  ? 71  ASN   R ND2 1 
ATOM   209  N N   . GLY   A 1 128 ? 136.485 124.900 108.970 1.00 77.71  ? 72  GLY   R N   1 
ATOM   210  C CA  . GLY   A 1 128 ? 137.182 124.377 110.131 1.00 77.62  ? 72  GLY   R CA  1 
ATOM   211  C C   . GLY   A 1 128 ? 137.159 125.348 111.295 1.00 81.69  ? 72  GLY   R C   1 
ATOM   212  O O   . GLY   A 1 128 ? 136.970 124.949 112.446 1.00 84.60  ? 72  GLY   R O   1 
ATOM   213  N N   . ALA   A 1 129 ? 137.346 126.637 111.010 1.00 78.95  ? 73  ALA   R N   1 
ATOM   214  C CA  . ALA   A 1 129 ? 137.270 127.644 112.062 1.00 75.03  ? 73  ALA   R CA  1 
ATOM   215  C C   . ALA   A 1 129 ? 135.880 127.691 112.676 1.00 70.68  ? 73  ALA   R C   1 
ATOM   216  O O   . ALA   A 1 129 ? 135.740 127.795 113.899 1.00 73.70  ? 73  ALA   R O   1 
ATOM   217  C CB  . ALA   A 1 129 ? 137.655 129.012 111.504 1.00 77.78  ? 73  ALA   R CB  1 
ATOM   218  N N   . VAL   A 1 130 ? 134.840 127.619 111.844 1.00 68.51  ? 74  VAL   R N   1 
ATOM   219  C CA  . VAL   A 1 130 ? 133.472 127.616 112.361 1.00 65.38  ? 74  VAL   R CA  1 
ATOM   220  C C   . VAL   A 1 130 ? 133.257 126.409 113.265 1.00 69.71  ? 74  VAL   R C   1 
ATOM   221  O O   . VAL   A 1 130 ? 132.710 126.519 114.371 1.00 79.12  ? 74  VAL   R O   1 
ATOM   222  C CB  . VAL   A 1 130 ? 132.459 127.631 111.204 1.00 64.09  ? 74  VAL   R CB  1 
ATOM   223  C CG1 . VAL   A 1 130 ? 131.118 127.092 111.662 1.00 61.51  ? 74  VAL   R CG1 1 
ATOM   224  C CG2 . VAL   A 1 130 ? 132.306 129.031 110.650 1.00 69.30  ? 74  VAL   R CG2 1 
ATOM   225  N N   . ALA   A 1 131 ? 133.689 125.236 112.803 1.00 68.78  ? 75  ALA   R N   1 
ATOM   226  C CA  . ALA   A 1 131 ? 133.503 124.018 113.581 1.00 69.26  ? 75  ALA   R CA  1 
ATOM   227  C C   . ALA   A 1 131 ? 134.229 124.106 114.915 1.00 70.87  ? 75  ALA   R C   1 
ATOM   228  O O   . ALA   A 1 131 ? 133.688 123.720 115.955 1.00 74.21  ? 75  ALA   R O   1 
ATOM   229  C CB  . ALA   A 1 131 ? 133.992 122.811 112.782 1.00 69.81  ? 75  ALA   R CB  1 
ATOM   230  N N   . ALA   A 1 132 ? 135.465 124.607 114.903 1.00 66.30  ? 76  ALA   R N   1 
ATOM   231  C CA  . ALA   A 1 132 ? 136.228 124.721 116.141 1.00 62.78  ? 76  ALA   R CA  1 
ATOM   232  C C   . ALA   A 1 132 ? 135.576 125.712 117.094 1.00 61.85  ? 76  ALA   R C   1 
ATOM   233  O O   . ALA   A 1 132 ? 135.456 125.453 118.297 1.00 73.96  ? 76  ALA   R O   1 
ATOM   234  C CB  . ALA   A 1 132 ? 137.664 125.138 115.831 1.00 63.28  ? 76  ALA   R CB  1 
ATOM   235  N N   . VAL   A 1 133 ? 135.142 126.858 116.570 1.00 60.19  ? 77  VAL   R N   1 
ATOM   236  C CA  . VAL   A 1 133 ? 134.508 127.870 117.408 1.00 57.18  ? 77  VAL   R CA  1 
ATOM   237  C C   . VAL   A 1 133 ? 133.268 127.294 118.072 1.00 61.15  ? 77  VAL   R C   1 
ATOM   238  O O   . VAL   A 1 133 ? 132.991 127.554 119.248 1.00 69.83  ? 77  VAL   R O   1 
ATOM   239  C CB  . VAL   A 1 133 ? 134.174 129.119 116.575 1.00 59.94  ? 77  VAL   R CB  1 
ATOM   240  C CG1 . VAL   A 1 133 ? 133.164 129.987 117.296 1.00 60.00  ? 77  VAL   R CG1 1 
ATOM   241  C CG2 . VAL   A 1 133 ? 135.433 129.904 116.280 1.00 63.75  ? 77  VAL   R CG2 1 
ATOM   242  N N   . LEU   A 1 134 ? 132.497 126.505 117.325 1.00 63.67  ? 78  LEU   R N   1 
ATOM   243  C CA  . LEU   A 1 134 ? 131.272 125.949 117.887 1.00 63.04  ? 78  LEU   R CA  1 
ATOM   244  C C   . LEU   A 1 134 ? 131.574 124.841 118.892 1.00 64.50  ? 78  LEU   R C   1 
ATOM   245  O O   . LEU   A 1 134 ? 130.961 124.780 119.963 1.00 70.43  ? 78  LEU   R O   1 
ATOM   246  C CB  . LEU   A 1 134 ? 130.370 125.442 116.765 1.00 63.08  ? 78  LEU   R CB  1 
ATOM   247  C CG  . LEU   A 1 134 ? 129.726 126.556 115.939 1.00 61.18  ? 78  LEU   R CG  1 
ATOM   248  C CD1 . LEU   A 1 134 ? 129.165 126.013 114.646 1.00 66.50  ? 78  LEU   R CD1 1 
ATOM   249  C CD2 . LEU   A 1 134 ? 128.641 127.253 116.733 1.00 63.83  ? 78  LEU   R CD2 1 
ATOM   250  N N   . LEU   A 1 135 ? 132.523 123.961 118.575 1.00 62.69  ? 79  LEU   R N   1 
ATOM   251  C CA  . LEU   A 1 135 ? 132.837 122.832 119.444 1.00 55.95  ? 79  LEU   R CA  1 
ATOM   252  C C   . LEU   A 1 135 ? 133.588 123.272 120.693 1.00 64.28  ? 79  LEU   R C   1 
ATOM   253  O O   . LEU   A 1 135 ? 133.727 122.494 121.640 1.00 71.99  ? 79  LEU   R O   1 
ATOM   254  C CB  . LEU   A 1 135 ? 133.657 121.787 118.689 1.00 47.39  ? 79  LEU   R CB  1 
ATOM   255  C CG  . LEU   A 1 135 ? 132.901 121.019 117.606 1.00 55.80  ? 79  LEU   R CG  1 
ATOM   256  C CD1 . LEU   A 1 135 ? 133.865 120.360 116.645 1.00 61.99  ? 79  LEU   R CD1 1 
ATOM   257  C CD2 . LEU   A 1 135 ? 131.990 119.986 118.227 1.00 65.95  ? 79  LEU   R CD2 1 
ATOM   258  N N   . SER   A 1 136 ? 134.081 124.508 120.712 1.00 78.20  ? 80  SER   R N   1 
ATOM   259  C CA  . SER   A 1 136 ? 134.734 125.037 121.901 1.00 73.85  ? 80  SER   R CA  1 
ATOM   260  C C   . SER   A 1 136 ? 133.749 125.412 122.997 1.00 73.63  ? 80  SER   R C   1 
ATOM   261  O O   . SER   A 1 136 ? 134.177 125.848 124.070 1.00 74.13  ? 80  SER   R O   1 
ATOM   262  C CB  . SER   A 1 136 ? 135.570 126.267 121.542 1.00 73.40  ? 80  SER   R CB  1 
ATOM   263  O OG  . SER   A 1 136 ? 136.537 125.956 120.556 1.00 79.09  ? 80  SER   R OG  1 
ATOM   264  N N   . ARG   A 1 137 ? 132.452 125.250 122.757 1.00 87.75  ? 81  ARG   R N   1 
ATOM   265  C CA  . ARG   A 1 137 ? 131.418 125.695 123.682 1.00 92.37  ? 81  ARG   R CA  1 
ATOM   266  C C   . ARG   A 1 137 ? 131.223 124.661 124.781 1.00 95.12  ? 81  ARG   R C   1 
ATOM   267  O O   . ARG   A 1 137 ? 130.933 123.495 124.497 1.00 96.43  ? 81  ARG   R O   1 
ATOM   268  C CB  . ARG   A 1 137 ? 130.106 125.919 122.936 1.00 93.23  ? 81  ARG   R CB  1 
ATOM   269  C CG  . ARG   A 1 137 ? 130.128 127.090 121.972 1.00 89.05  ? 81  ARG   R CG  1 
ATOM   270  C CD  . ARG   A 1 137 ? 129.537 128.342 122.593 1.00 91.99  ? 81  ARG   R CD  1 
ATOM   271  N NE  . ARG   A 1 137 ? 128.222 128.092 123.175 1.00 99.77  ? 81  ARG   R NE  1 
ATOM   272  C CZ  . ARG   A 1 137 ? 127.929 128.176 124.466 1.00 99.91  ? 81  ARG   R CZ  1 
ATOM   273  N NH1 . ARG   A 1 137 ? 128.836 128.525 125.366 1.00 96.83  ? 81  ARG   R NH1 1 
ATOM   274  N NH2 . ARG   A 1 137 ? 126.691 127.904 124.867 1.00 97.77  ? 81  ARG   R NH2 1 
ATOM   275  N N   . ARG   A 1 138 ? 131.375 125.089 126.036 1.00 98.04  ? 82  ARG   R N   1 
ATOM   276  C CA  . ARG   A 1 138 ? 131.116 124.185 127.151 1.00 94.40  ? 82  ARG   R CA  1 
ATOM   277  C C   . ARG   A 1 138 ? 129.623 123.984 127.368 1.00 93.22  ? 82  ARG   R C   1 
ATOM   278  O O   . ARG   A 1 138 ? 129.168 122.854 127.575 1.00 96.80  ? 82  ARG   R O   1 
ATOM   279  C CB  . ARG   A 1 138 ? 131.775 124.713 128.424 1.00 95.19  ? 82  ARG   R CB  1 
ATOM   280  C CG  . ARG   A 1 138 ? 133.126 125.360 128.200 1.00 98.33  ? 82  ARG   R CG  1 
ATOM   281  C CD  . ARG   A 1 138 ? 133.980 125.280 129.451 1.00 98.69  ? 82  ARG   R CD  1 
ATOM   282  N NE  . ARG   A 1 138 ? 135.031 126.290 129.463 1.00 100.80 ? 82  ARG   R NE  1 
ATOM   283  C CZ  . ARG   A 1 138 ? 136.306 126.060 129.176 1.00 102.13 ? 82  ARG   R CZ  1 
ATOM   284  N NH1 . ARG   A 1 138 ? 136.732 124.859 128.814 1.00 100.07 ? 82  ARG   R NH1 1 
ATOM   285  N NH2 . ARG   A 1 138 ? 137.178 127.062 129.249 1.00 101.19 ? 82  ARG   R NH2 1 
ATOM   286  N N   . THR   A 1 139 ? 128.843 125.058 127.314 1.00 94.36  ? 83  THR   R N   1 
ATOM   287  C CA  . THR   A 1 139 ? 127.416 124.974 127.591 1.00 99.03  ? 83  THR   R CA  1 
ATOM   288  C C   . THR   A 1 139 ? 126.688 124.435 126.360 1.00 98.98  ? 83  THR   R C   1 
ATOM   289  O O   . THR   A 1 139 ? 127.300 124.025 125.370 1.00 93.21  ? 83  THR   R O   1 
ATOM   290  C CB  . THR   A 1 139 ? 126.876 126.334 128.027 1.00 98.74  ? 83  THR   R CB  1 
ATOM   291  O OG1 . THR   A 1 139 ? 127.363 127.353 127.147 1.00 103.33 ? 83  THR   R OG1 1 
ATOM   292  C CG2 . THR   A 1 139 ? 127.307 126.647 129.450 1.00 98.63  ? 83  THR   R CG2 1 
ATOM   293  N N   . ALA   A 1 140 ? 125.359 124.429 126.414 1.00 94.94  ? 84  ALA   R N   1 
ATOM   294  C CA  . ALA   A 1 140 ? 124.560 123.871 125.338 1.00 94.02  ? 84  ALA   R CA  1 
ATOM   295  C C   . ALA   A 1 140 ? 124.686 124.733 124.084 1.00 92.11  ? 84  ALA   R C   1 
ATOM   296  O O   . ALA   A 1 140 ? 125.267 125.822 124.093 1.00 91.31  ? 84  ALA   R O   1 
ATOM   297  C CB  . ALA   A 1 140 ? 123.103 123.749 125.772 1.00 92.77  ? 84  ALA   R CB  1 
ATOM   298  N N   . LEU   A 1 141 ? 124.133 124.225 122.985 1.00 84.07  ? 85  LEU   R N   1 
ATOM   299  C CA  . LEU   A 1 141 ? 124.135 124.913 121.705 1.00 84.32  ? 85  LEU   R CA  1 
ATOM   300  C C   . LEU   A 1 141 ? 122.703 125.023 121.202 1.00 86.90  ? 85  LEU   R C   1 
ATOM   301  O O   . LEU   A 1 141 ? 121.929 124.066 121.282 1.00 89.57  ? 85  LEU   R O   1 
ATOM   302  C CB  . LEU   A 1 141 ? 124.995 124.166 120.675 1.00 79.38  ? 85  LEU   R CB  1 
ATOM   303  C CG  . LEU   A 1 141 ? 126.452 124.591 120.484 1.00 78.45  ? 85  LEU   R CG  1 
ATOM   304  C CD1 . LEU   A 1 141 ? 127.023 123.939 119.237 1.00 75.64  ? 85  LEU   R CD1 1 
ATOM   305  C CD2 . LEU   A 1 141 ? 126.602 126.100 120.410 1.00 79.41  ? 85  LEU   R CD2 1 
ATOM   306  N N   . SER   A 1 142 ? 122.355 126.195 120.679 1.00 79.07  ? 86  SER   R N   1 
ATOM   307  C CA  . SER   A 1 142 ? 120.999 126.429 120.210 1.00 71.68  ? 86  SER   R CA  1 
ATOM   308  C C   . SER   A 1 142 ? 120.740 125.637 118.930 1.00 71.42  ? 86  SER   R C   1 
ATOM   309  O O   . SER   A 1 142 ? 121.628 124.981 118.381 1.00 75.91  ? 86  SER   R O   1 
ATOM   310  C CB  . SER   A 1 142 ? 120.761 127.920 119.989 1.00 76.60  ? 86  SER   R CB  1 
ATOM   311  O OG  . SER   A 1 142 ? 121.285 128.340 118.743 1.00 82.61  ? 86  SER   R OG  1 
ATOM   312  N N   . SER   A 1 143 ? 119.499 125.700 118.447 1.00 74.29  ? 87  SER   R N   1 
ATOM   313  C CA  . SER   A 1 143 ? 119.114 124.908 117.283 1.00 78.19  ? 87  SER   R CA  1 
ATOM   314  C C   . SER   A 1 143 ? 119.916 125.311 116.052 1.00 77.04  ? 87  SER   R C   1 
ATOM   315  O O   . SER   A 1 143 ? 120.531 124.466 115.385 1.00 83.19  ? 87  SER   R O   1 
ATOM   316  C CB  . SER   A 1 143 ? 117.619 125.078 117.024 1.00 78.79  ? 87  SER   R CB  1 
ATOM   317  O OG  . SER   A 1 143 ? 116.868 124.831 118.198 1.00 83.59  ? 87  SER   R OG  1 
ATOM   318  N N   . THR   A 1 144 ? 119.924 126.605 115.736 1.00 72.15  ? 88  THR   R N   1 
ATOM   319  C CA  . THR   A 1 144 ? 120.657 127.059 114.564 1.00 72.36  ? 88  THR   R CA  1 
ATOM   320  C C   . THR   A 1 144 ? 122.152 126.838 114.727 1.00 73.18  ? 88  THR   R C   1 
ATOM   321  O O   . THR   A 1 144 ? 122.851 126.615 113.736 1.00 74.34  ? 88  THR   R O   1 
ATOM   322  C CB  . THR   A 1 144 ? 120.364 128.532 114.293 1.00 71.96  ? 88  THR   R CB  1 
ATOM   323  O OG1 . THR   A 1 144 ? 118.951 128.758 114.362 1.00 73.00  ? 88  THR   R OG1 1 
ATOM   324  C CG2 . THR   A 1 144 ? 120.868 128.926 112.918 1.00 67.89  ? 88  THR   R CG2 1 
ATOM   325  N N   . ASP   A 1 145 ? 122.658 126.876 115.960 1.00 74.67  ? 89  ASP   R N   1 
ATOM   326  C CA  . ASP   A 1 145 ? 124.065 126.570 116.184 1.00 72.44  ? 89  ASP   R CA  1 
ATOM   327  C C   . ASP   A 1 145 ? 124.378 125.134 115.789 1.00 72.34  ? 89  ASP   R C   1 
ATOM   328  O O   . ASP   A 1 145 ? 125.386 124.867 115.126 1.00 74.76  ? 89  ASP   R O   1 
ATOM   329  C CB  . ASP   A 1 145 ? 124.427 126.809 117.647 1.00 82.58  ? 89  ASP   R CB  1 
ATOM   330  C CG  . ASP   A 1 145 ? 123.992 128.172 118.139 1.00 91.78  ? 89  ASP   R CG  1 
ATOM   331  O OD1 . ASP   A 1 145 ? 123.413 128.935 117.338 1.00 89.17  ? 89  ASP   R OD1 1 
ATOM   332  O OD2 . ASP   A 1 145 ? 124.224 128.480 119.327 1.00 91.29  ? 89  ASP   R OD2 1 
ATOM   333  N N   . THR   A 1 146 ? 123.522 124.192 116.186 1.00 68.16  ? 90  THR   R N   1 
ATOM   334  C CA  . THR   A 1 146 ? 123.740 122.796 115.825 1.00 60.69  ? 90  THR   R CA  1 
ATOM   335  C C   . THR   A 1 146 ? 123.645 122.596 114.319 1.00 63.53  ? 90  THR   R C   1 
ATOM   336  O O   . THR   A 1 146 ? 124.459 121.876 113.721 1.00 71.92  ? 90  THR   R O   1 
ATOM   337  C CB  . THR   A 1 146 ? 122.727 121.914 116.546 1.00 54.97  ? 90  THR   R CB  1 
ATOM   338  O OG1 . THR   A 1 146 ? 123.045 121.861 117.940 1.00 60.54  ? 90  THR   R OG1 1 
ATOM   339  C CG2 . THR   A 1 146 ? 122.740 120.517 115.973 1.00 62.84  ? 90  THR   R CG2 1 
ATOM   340  N N   . PHE   A 1 147 ? 122.653 123.220 113.686 1.00 63.01  ? 91  PHE   R N   1 
ATOM   341  C CA  . PHE   A 1 147 ? 122.546 123.095 112.239 1.00 56.46  ? 91  PHE   R CA  1 
ATOM   342  C C   . PHE   A 1 147 ? 123.766 123.677 111.542 1.00 61.87  ? 91  PHE   R C   1 
ATOM   343  O O   . PHE   A 1 147 ? 124.257 123.097 110.569 1.00 68.24  ? 91  PHE   R O   1 
ATOM   344  C CB  . PHE   A 1 147 ? 121.274 123.775 111.747 1.00 62.05  ? 91  PHE   R CB  1 
ATOM   345  C CG  . PHE   A 1 147 ? 120.025 123.020 112.073 1.00 64.62  ? 91  PHE   R CG  1 
ATOM   346  C CD1 . PHE   A 1 147 ? 119.796 121.772 111.534 1.00 60.22  ? 91  PHE   R CD1 1 
ATOM   347  C CD2 . PHE   A 1 147 ? 119.083 123.557 112.925 1.00 62.77  ? 91  PHE   R CD2 1 
ATOM   348  C CE1 . PHE   A 1 147 ? 118.651 121.080 111.836 1.00 64.00  ? 91  PHE   R CE1 1 
ATOM   349  C CE2 . PHE   A 1 147 ? 117.938 122.867 113.229 1.00 61.78  ? 91  PHE   R CE2 1 
ATOM   350  C CZ  . PHE   A 1 147 ? 117.721 121.630 112.686 1.00 60.84  ? 91  PHE   R CZ  1 
ATOM   351  N N   . LEU   A 1 148 ? 124.272 124.812 112.023 1.00 65.12  ? 92  LEU   R N   1 
ATOM   352  C CA  . LEU   A 1 148 ? 125.478 125.390 111.447 1.00 63.82  ? 92  LEU   R CA  1 
ATOM   353  C C   . LEU   A 1 148 ? 126.676 124.475 111.646 1.00 65.06  ? 92  LEU   R C   1 
ATOM   354  O O   . LEU   A 1 148 ? 127.529 124.364 110.762 1.00 64.55  ? 92  LEU   R O   1 
ATOM   355  C CB  . LEU   A 1 148 ? 125.744 126.760 112.066 1.00 61.91  ? 92  LEU   R CB  1 
ATOM   356  C CG  . LEU   A 1 148 ? 126.900 127.553 111.464 1.00 62.36  ? 92  LEU   R CG  1 
ATOM   357  C CD1 . LEU   A 1 148 ? 126.653 127.840 109.995 1.00 64.11  ? 92  LEU   R CD1 1 
ATOM   358  C CD2 . LEU   A 1 148 ? 127.097 128.839 112.238 1.00 67.92  ? 92  LEU   R CD2 1 
ATOM   359  N N   . LEU   A 1 149 ? 126.770 123.827 112.806 1.00 58.40  ? 93  LEU   R N   1 
ATOM   360  C CA  . LEU   A 1 149 ? 127.853 122.878 113.037 1.00 50.62  ? 93  LEU   R CA  1 
ATOM   361  C C   . LEU   A 1 149 ? 127.828 121.762 112.002 1.00 60.26  ? 93  LEU   R C   1 
ATOM   362  O O   . LEU   A 1 149 ? 128.855 121.434 111.389 1.00 70.87  ? 93  LEU   R O   1 
ATOM   363  C CB  . LEU   A 1 149 ? 127.736 122.299 114.444 1.00 48.67  ? 93  LEU   R CB  1 
ATOM   364  C CG  . LEU   A 1 149 ? 128.763 121.244 114.840 1.00 54.18  ? 93  LEU   R CG  1 
ATOM   365  C CD1 . LEU   A 1 149 ? 130.160 121.662 114.435 1.00 57.80  ? 93  LEU   R CD1 1 
ATOM   366  C CD2 . LEU   A 1 149 ? 128.688 120.994 116.330 1.00 56.77  ? 93  LEU   R CD2 1 
ATOM   367  N N   . HIS   A 1 150 ? 126.657 121.164 111.793 1.00 57.17  ? 94  HIS   R N   1 
ATOM   368  C CA  . HIS   A 1 150 ? 126.562 120.073 110.829 1.00 55.08  ? 94  HIS   R CA  1 
ATOM   369  C C   . HIS   A 1 150 ? 126.838 120.567 109.412 1.00 61.96  ? 94  HIS   R C   1 
ATOM   370  O O   . HIS   A 1 150 ? 127.490 119.880 108.616 1.00 66.27  ? 94  HIS   R O   1 
ATOM   371  C CB  . HIS   A 1 150 ? 125.194 119.407 110.935 1.00 55.34  ? 94  HIS   R CB  1 
ATOM   372  C CG  . HIS   A 1 150 ? 125.058 118.526 112.136 1.00 55.55  ? 94  HIS   R CG  1 
ATOM   373  N ND1 . HIS   A 1 150 ? 124.249 118.842 113.204 1.00 61.22  ? 94  HIS   R ND1 1 
ATOM   374  C CD2 . HIS   A 1 150 ? 125.639 117.343 112.441 1.00 60.80  ? 94  HIS   R CD2 1 
ATOM   375  C CE1 . HIS   A 1 150 ? 124.336 117.890 114.115 1.00 63.53  ? 94  HIS   R CE1 1 
ATOM   376  N NE2 . HIS   A 1 150 ? 125.172 116.968 113.675 1.00 63.21  ? 94  HIS   R NE2 1 
ATOM   377  N N   . LEU   A 1 151 ? 126.361 121.769 109.082 1.00 64.80  ? 95  LEU   R N   1 
ATOM   378  C CA  . LEU   A 1 151 ? 126.651 122.345 107.773 1.00 60.47  ? 95  LEU   R CA  1 
ATOM   379  C C   . LEU   A 1 151 ? 128.148 122.545 107.583 1.00 64.44  ? 95  LEU   R C   1 
ATOM   380  O O   . LEU   A 1 151 ? 128.684 122.298 106.496 1.00 73.52  ? 95  LEU   R O   1 
ATOM   381  C CB  . LEU   A 1 151 ? 125.913 123.673 107.619 1.00 60.22  ? 95  LEU   R CB  1 
ATOM   382  C CG  . LEU   A 1 151 ? 125.839 124.268 106.215 1.00 66.60  ? 95  LEU   R CG  1 
ATOM   383  C CD1 . LEU   A 1 151 ? 125.004 123.394 105.306 1.00 72.80  ? 95  LEU   R CD1 1 
ATOM   384  C CD2 . LEU   A 1 151 ? 125.269 125.671 106.271 1.00 60.93  ? 95  LEU   R CD2 1 
ATOM   385  N N   . ALA   A 1 152 ? 128.835 123.008 108.625 1.00 61.97  ? 96  ALA   R N   1 
ATOM   386  C CA  . ALA   A 1 152 ? 130.275 123.205 108.546 1.00 63.50  ? 96  ALA   R CA  1 
ATOM   387  C C   . ALA   A 1 152 ? 130.987 121.883 108.309 1.00 64.66  ? 96  ALA   R C   1 
ATOM   388  O O   . ALA   A 1 152 ? 131.916 121.798 107.500 1.00 65.57  ? 96  ALA   R O   1 
ATOM   389  C CB  . ALA   A 1 152 ? 130.778 123.869 109.827 1.00 68.14  ? 96  ALA   R CB  1 
ATOM   390  N N   . VAL   A 1 153 ? 130.560 120.831 109.009 1.00 68.13  ? 97  VAL   R N   1 
ATOM   391  C CA  . VAL   A 1 153 ? 131.171 119.518 108.799 1.00 69.52  ? 97  VAL   R CA  1 
ATOM   392  C C   . VAL   A 1 153 ? 130.966 119.066 107.357 1.00 71.84  ? 97  VAL   R C   1 
ATOM   393  O O   . VAL   A 1 153 ? 131.890 118.561 106.700 1.00 74.05  ? 97  VAL   R O   1 
ATOM   394  C CB  . VAL   A 1 153 ? 130.601 118.493 109.795 1.00 66.20  ? 97  VAL   R CB  1 
ATOM   395  C CG1 . VAL   A 1 153 ? 131.113 117.104 109.466 1.00 69.53  ? 97  VAL   R CG1 1 
ATOM   396  C CG2 . VAL   A 1 153 ? 130.970 118.873 111.217 1.00 65.68  ? 97  VAL   R CG2 1 
ATOM   397  N N   . ALA   A 1 154 ? 129.745 119.233 106.846 1.00 73.08  ? 98  ALA   R N   1 
ATOM   398  C CA  . ALA   A 1 154 ? 129.451 118.804 105.483 1.00 72.95  ? 98  ALA   R CA  1 
ATOM   399  C C   . ALA   A 1 154 ? 130.314 119.551 104.476 1.00 76.98  ? 98  ALA   R C   1 
ATOM   400  O O   . ALA   A 1 154 ? 130.902 118.946 103.570 1.00 78.29  ? 98  ALA   R O   1 
ATOM   401  C CB  . ALA   A 1 154 ? 127.969 119.015 105.178 1.00 70.24  ? 98  ALA   R CB  1 
ATOM   402  N N   . ASP   A 1 155 ? 130.404 120.874 104.620 1.00 92.93  ? 99  ASP   R N   1 
ATOM   403  C CA  . ASP   A 1 155 ? 131.225 121.656 103.703 1.00 92.91  ? 99  ASP   R CA  1 
ATOM   404  C C   . ASP   A 1 155 ? 132.689 121.255 103.805 1.00 93.24  ? 99  ASP   R C   1 
ATOM   405  O O   . ASP   A 1 155 ? 133.395 121.192 102.791 1.00 93.43  ? 99  ASP   R O   1 
ATOM   406  C CB  . ASP   A 1 155 ? 131.062 123.147 103.988 1.00 93.40  ? 99  ASP   R CB  1 
ATOM   407  C CG  . ASP   A 1 155 ? 129.623 123.600 103.906 1.00 94.61  ? 99  ASP   R CG  1 
ATOM   408  O OD1 . ASP   A 1 155 ? 128.948 123.257 102.913 1.00 94.19  ? 99  ASP   R OD1 1 
ATOM   409  O OD2 . ASP   A 1 155 ? 129.167 124.307 104.827 1.00 96.04  ? 99  ASP   R OD2 1 
ATOM   410  N N   . THR   A 1 156 ? 133.168 120.990 105.021 1.00 83.02  ? 100 THR   R N   1 
ATOM   411  C CA  . THR   A 1 156 ? 134.551 120.570 105.195 1.00 75.03  ? 100 THR   R CA  1 
ATOM   412  C C   . THR   A 1 156 ? 134.828 119.294 104.419 1.00 79.00  ? 100 THR   R C   1 
ATOM   413  O O   . THR   A 1 156 ? 135.827 119.196 103.702 1.00 87.21  ? 100 THR   R O   1 
ATOM   414  C CB  . THR   A 1 156 ? 134.856 120.367 106.677 1.00 77.85  ? 100 THR   R CB  1 
ATOM   415  O OG1 . THR   A 1 156 ? 134.361 121.482 107.425 1.00 85.32  ? 100 THR   R OG1 1 
ATOM   416  C CG2 . THR   A 1 156 ? 136.350 120.231 106.897 1.00 78.82  ? 100 THR   R CG2 1 
ATOM   417  N N   . LEU   A 1 157 ? 133.944 118.302 104.540 1.00 81.52  ? 101 LEU   R N   1 
ATOM   418  C CA  . LEU   A 1 157 ? 134.157 117.056 103.805 1.00 83.02  ? 101 LEU   R CA  1 
ATOM   419  C C   . LEU   A 1 157 ? 134.097 117.285 102.298 1.00 82.44  ? 101 LEU   R C   1 
ATOM   420  O O   . LEU   A 1 157 ? 134.923 116.749 101.539 1.00 82.96  ? 101 LEU   R O   1 
ATOM   421  C CB  . LEU   A 1 157 ? 133.122 116.014 104.226 1.00 81.34  ? 101 LEU   R CB  1 
ATOM   422  C CG  . LEU   A 1 157 ? 133.138 115.564 105.690 1.00 85.14  ? 101 LEU   R CG  1 
ATOM   423  C CD1 . LEU   A 1 157 ? 132.294 114.312 105.858 1.00 87.43  ? 101 LEU   R CD1 1 
ATOM   424  C CD2 . LEU   A 1 157 ? 134.552 115.319 106.187 1.00 83.66  ? 101 LEU   R CD2 1 
ATOM   425  N N   . LEU   A 1 158 ? 133.125 118.078 101.843 1.00 84.19  ? 102 LEU   R N   1 
ATOM   426  C CA  . LEU   A 1 158 ? 132.972 118.299 100.410 1.00 83.30  ? 102 LEU   R CA  1 
ATOM   427  C C   . LEU   A 1 158 ? 134.209 118.963 99.823  1.00 82.65  ? 102 LEU   R C   1 
ATOM   428  O O   . LEU   A 1 158 ? 134.674 118.579 98.745  1.00 85.08  ? 102 LEU   R O   1 
ATOM   429  C CB  . LEU   A 1 158 ? 131.728 119.143 100.137 1.00 87.43  ? 102 LEU   R CB  1 
ATOM   430  C CG  . LEU   A 1 158 ? 131.311 119.249 98.670  1.00 87.46  ? 102 LEU   R CG  1 
ATOM   431  C CD1 . LEU   A 1 158 ? 130.711 117.946 98.190  1.00 86.18  ? 102 LEU   R CD1 1 
ATOM   432  C CD2 . LEU   A 1 158 ? 130.329 120.382 98.474  1.00 85.63  ? 102 LEU   R CD2 1 
ATOM   433  N N   . VAL   A 1 159 ? 134.756 119.964 100.514 1.00 87.52  ? 103 VAL   R N   1 
ATOM   434  C CA  . VAL   A 1 159 ? 135.973 120.602 100.023 1.00 88.95  ? 103 VAL   R CA  1 
ATOM   435  C C   . VAL   A 1 159 ? 137.165 119.667 100.169 1.00 92.95  ? 103 VAL   R C   1 
ATOM   436  O O   . VAL   A 1 159 ? 138.098 119.713 99.360  1.00 92.66  ? 103 VAL   R O   1 
ATOM   437  C CB  . VAL   A 1 159 ? 136.216 121.940 100.744 1.00 93.07  ? 103 VAL   R CB  1 
ATOM   438  C CG1 . VAL   A 1 159 ? 135.039 122.877 100.531 1.00 92.22  ? 103 VAL   R CG1 1 
ATOM   439  C CG2 . VAL   A 1 159 ? 136.473 121.721 102.224 1.00 95.66  ? 103 VAL   R CG2 1 
ATOM   440  N N   . LEU   A 1 160 ? 137.162 118.807 101.189 1.00 93.73  ? 104 LEU   R N   1 
ATOM   441  C CA  . LEU   A 1 160 ? 138.269 117.877 101.376 1.00 86.26  ? 104 LEU   R CA  1 
ATOM   442  C C   . LEU   A 1 160 ? 138.404 116.955 100.176 1.00 89.09  ? 104 LEU   R C   1 
ATOM   443  O O   . LEU   A 1 160 ? 139.516 116.648 99.735  1.00 95.47  ? 104 LEU   R O   1 
ATOM   444  C CB  . LEU   A 1 160 ? 138.058 117.065 102.654 1.00 85.60  ? 104 LEU   R CB  1 
ATOM   445  C CG  . LEU   A 1 160 ? 139.293 116.447 103.312 1.00 88.07  ? 104 LEU   R CG  1 
ATOM   446  C CD1 . LEU   A 1 160 ? 138.900 115.785 104.621 1.00 91.83  ? 104 LEU   R CD1 1 
ATOM   447  C CD2 . LEU   A 1 160 ? 139.972 115.446 102.398 1.00 89.75  ? 104 LEU   R CD2 1 
ATOM   448  N N   . THR   A 1 161 ? 137.282 116.493 99.638  1.00 90.01  ? 105 THR   R N   1 
ATOM   449  C CA  . THR   A 1 161 ? 137.356 115.599 98.484  1.00 85.95  ? 105 THR   R CA  1 
ATOM   450  C C   . THR   A 1 161 ? 137.749 116.309 97.190  1.00 81.05  ? 105 THR   R C   1 
ATOM   451  O O   . THR   A 1 161 ? 137.923 115.636 96.170  1.00 77.04  ? 105 THR   R O   1 
ATOM   452  C CB  . THR   A 1 161 ? 136.027 114.873 98.270  1.00 88.47  ? 105 THR   R CB  1 
ATOM   453  O OG1 . THR   A 1 161 ? 135.051 115.790 97.763  1.00 92.67  ? 105 THR   R OG1 1 
ATOM   454  C CG2 . THR   A 1 161 ? 135.533 114.255 99.567  1.00 88.01  ? 105 THR   R CG2 1 
ATOM   455  N N   . LEU   A 1 162 ? 137.887 117.641 97.194  1.00 92.42  ? 106 LEU   R N   1 
ATOM   456  C CA  . LEU   A 1 162 ? 138.118 118.358 95.939  1.00 96.18  ? 106 LEU   R CA  1 
ATOM   457  C C   . LEU   A 1 162 ? 139.446 118.006 95.280  1.00 97.73  ? 106 LEU   R C   1 
ATOM   458  O O   . LEU   A 1 162 ? 139.456 117.744 94.064  1.00 99.53  ? 106 LEU   R O   1 
ATOM   459  C CB  . LEU   A 1 162 ? 138.007 119.867 96.175  1.00 95.90  ? 106 LEU   R CB  1 
ATOM   460  C CG  . LEU   A 1 162 ? 136.599 120.466 96.175  1.00 96.26  ? 106 LEU   R CG  1 
ATOM   461  C CD1 . LEU   A 1 162 ? 136.660 121.948 96.495  1.00 94.58  ? 106 LEU   R CD1 1 
ATOM   462  C CD2 . LEU   A 1 162 ? 135.908 120.246 94.838  1.00 91.01  ? 106 LEU   R CD2 1 
ATOM   463  N N   . PRO   A 1 163 ? 140.583 118.000 95.979  1.00 90.13  ? 107 PRO   R N   1 
ATOM   464  C CA  . PRO   A 1 163 ? 141.863 117.807 95.278  1.00 86.80  ? 107 PRO   R CA  1 
ATOM   465  C C   . PRO   A 1 163 ? 141.947 116.509 94.496  1.00 92.47  ? 107 PRO   R C   1 
ATOM   466  O O   . PRO   A 1 163 ? 142.602 116.473 93.446  1.00 91.01  ? 107 PRO   R O   1 
ATOM   467  C CB  . PRO   A 1 163 ? 142.886 117.853 96.418  1.00 90.09  ? 107 PRO   R CB  1 
ATOM   468  C CG  . PRO   A 1 163 ? 142.227 118.686 97.453  1.00 89.74  ? 107 PRO   R CG  1 
ATOM   469  C CD  . PRO   A 1 163 ? 140.795 118.261 97.409  1.00 88.78  ? 107 PRO   R CD  1 
ATOM   470  N N   . LEU   A 1 164 ? 141.307 115.438 94.969  1.00 98.17  ? 108 LEU   R N   1 
ATOM   471  C CA  . LEU   A 1 164 ? 141.270 114.213 94.177  1.00 95.76  ? 108 LEU   R CA  1 
ATOM   472  C C   . LEU   A 1 164 ? 140.589 114.460 92.840  1.00 94.35  ? 108 LEU   R C   1 
ATOM   473  O O   . LEU   A 1 164 ? 141.067 114.002 91.796  1.00 98.07  ? 108 LEU   R O   1 
ATOM   474  C CB  . LEU   A 1 164 ? 140.553 113.103 94.944  1.00 91.25  ? 108 LEU   R CB  1 
ATOM   475  C CG  . LEU   A 1 164 ? 140.884 112.937 96.428  1.00 93.36  ? 108 LEU   R CG  1 
ATOM   476  C CD1 . LEU   A 1 164 ? 140.279 111.651 96.956  1.00 92.73  ? 108 LEU   R CD1 1 
ATOM   477  C CD2 . LEU   A 1 164 ? 142.386 112.949 96.661  1.00 96.88  ? 108 LEU   R CD2 1 
ATOM   478  N N   . TRP   A 1 165 ? 139.481 115.199 92.848  1.00 90.45  ? 109 TRP   R N   1 
ATOM   479  C CA  . TRP   A 1 165 ? 138.805 115.535 91.605  1.00 89.37  ? 109 TRP   R CA  1 
ATOM   480  C C   . TRP   A 1 165 ? 139.644 116.459 90.736  1.00 95.09  ? 109 TRP   R C   1 
ATOM   481  O O   . TRP   A 1 165 ? 139.588 116.358 89.507  1.00 95.79  ? 109 TRP   R O   1 
ATOM   482  C CB  . TRP   A 1 165 ? 137.458 116.180 91.913  1.00 92.35  ? 109 TRP   R CB  1 
ATOM   483  C CG  . TRP   A 1 165 ? 136.550 115.280 92.682  1.00 94.09  ? 109 TRP   R CG  1 
ATOM   484  C CD1 . TRP   A 1 165 ? 135.924 115.561 93.858  1.00 96.05  ? 109 TRP   R CD1 1 
ATOM   485  C CD2 . TRP   A 1 165 ? 136.178 113.943 92.340  1.00 90.59  ? 109 TRP   R CD2 1 
ATOM   486  N NE1 . TRP   A 1 165 ? 135.178 114.485 94.267  1.00 92.47  ? 109 TRP   R NE1 1 
ATOM   487  C CE2 . TRP   A 1 165 ? 135.319 113.478 93.351  1.00 91.15  ? 109 TRP   R CE2 1 
ATOM   488  C CE3 . TRP   A 1 165 ? 136.486 113.096 91.276  1.00 89.99  ? 109 TRP   R CE3 1 
ATOM   489  C CZ2 . TRP   A 1 165 ? 134.766 112.205 93.327  1.00 92.38  ? 109 TRP   R CZ2 1 
ATOM   490  C CZ3 . TRP   A 1 165 ? 135.937 111.838 91.255  1.00 90.15  ? 109 TRP   R CZ3 1 
ATOM   491  C CH2 . TRP   A 1 165 ? 135.086 111.401 92.272  1.00 89.80  ? 109 TRP   R CH2 1 
ATOM   492  N N   . ALA   A 1 166 ? 140.417 117.357 91.344  1.00 98.65  ? 110 ALA   R N   1 
ATOM   493  C CA  . ALA   A 1 166 ? 141.333 118.179 90.563  1.00 95.22  ? 110 ALA   R CA  1 
ATOM   494  C C   . ALA   A 1 166 ? 142.361 117.318 89.845  1.00 91.96  ? 110 ALA   R C   1 
ATOM   495  O O   . ALA   A 1 166 ? 142.645 117.536 88.662  1.00 92.12  ? 110 ALA   R O   1 
ATOM   496  C CB  . ALA   A 1 166 ? 142.030 119.193 91.467  1.00 98.78  ? 110 ALA   R CB  1 
ATOM   497  N N   . VAL   A 1 167 ? 142.921 116.331 90.546  1.00 93.44  ? 111 VAL   R N   1 
ATOM   498  C CA  . VAL   A 1 167 ? 143.857 115.404 89.911  1.00 93.95  ? 111 VAL   R CA  1 
ATOM   499  C C   . VAL   A 1 167 ? 143.163 114.661 88.781  1.00 94.37  ? 111 VAL   R C   1 
ATOM   500  O O   . VAL   A 1 167 ? 143.729 114.460 87.700  1.00 95.53  ? 111 VAL   R O   1 
ATOM   501  C CB  . VAL   A 1 167 ? 144.436 114.427 90.949  1.00 95.00  ? 111 VAL   R CB  1 
ATOM   502  C CG1 . VAL   A 1 167 ? 145.304 113.385 90.264  1.00 93.25  ? 111 VAL   R CG1 1 
ATOM   503  C CG2 . VAL   A 1 167 ? 145.235 115.178 91.996  1.00 98.98  ? 111 VAL   R CG2 1 
ATOM   504  N N   . ASP   A 1 168 ? 141.924 114.233 89.023  1.00 109.08 ? 112 ASP   R N   1 
ATOM   505  C CA  . ASP   A 1 168 ? 141.154 113.546 87.990  1.00 108.10 ? 112 ASP   R CA  1 
ATOM   506  C C   . ASP   A 1 168 ? 141.035 114.405 86.740  1.00 110.70 ? 112 ASP   R C   1 
ATOM   507  O O   . ASP   A 1 168 ? 141.241 113.927 85.618  1.00 109.23 ? 112 ASP   R O   1 
ATOM   508  C CB  . ASP   A 1 168 ? 139.768 113.194 88.528  1.00 105.25 ? 112 ASP   R CB  1 
ATOM   509  C CG  . ASP   A 1 168 ? 138.967 112.349 87.562  1.00 109.52 ? 112 ASP   R CG  1 
ATOM   510  O OD1 . ASP   A 1 168 ? 138.733 112.803 86.422  1.00 109.99 ? 112 ASP   R OD1 1 
ATOM   511  O OD2 . ASP   A 1 168 ? 138.563 111.231 87.943  1.00 115.21 ? 112 ASP   R OD2 1 
ATOM   512  N N   . ALA   A 1 169 ? 140.692 115.679 86.917  1.00 105.21 ? 113 ALA   R N   1 
ATOM   513  C CA  . ALA   A 1 169 ? 140.568 116.585 85.781  1.00 102.90 ? 113 ALA   R CA  1 
ATOM   514  C C   . ALA   A 1 169 ? 141.907 116.763 85.081  1.00 100.98 ? 113 ALA   R C   1 
ATOM   515  O O   . ALA   A 1 169 ? 141.976 116.835 83.849  1.00 97.63  ? 113 ALA   R O   1 
ATOM   516  C CB  . ALA   A 1 169 ? 140.025 117.933 86.246  1.00 100.70 ? 113 ALA   R CB  1 
ATOM   517  N N   . ALA   A 1 170 ? 142.986 116.835 85.857  1.00 111.88 ? 114 ALA   R N   1 
ATOM   518  C CA  . ALA   A 1 170 ? 144.293 117.113 85.279  1.00 110.14 ? 114 ALA   R CA  1 
ATOM   519  C C   . ALA   A 1 170 ? 144.759 115.979 84.376  1.00 113.00 ? 114 ALA   R C   1 
ATOM   520  O O   . ALA   A 1 170 ? 144.922 116.169 83.167  1.00 113.89 ? 114 ALA   R O   1 
ATOM   521  C CB  . ALA   A 1 170 ? 145.312 117.361 86.391  1.00 111.16 ? 114 ALA   R CB  1 
ATOM   522  N N   . VAL   A 1 171 ? 144.962 114.787 84.939  1.00 115.21 ? 115 VAL   R N   1 
ATOM   523  C CA  . VAL   A 1 171 ? 145.573 113.692 84.193  1.00 115.21 ? 115 VAL   R CA  1 
ATOM   524  C C   . VAL   A 1 171 ? 144.624 112.505 84.097  1.00 114.03 ? 115 VAL   R C   1 
ATOM   525  O O   . VAL   A 1 171 ? 144.150 112.165 83.007  1.00 114.17 ? 115 VAL   R O   1 
ATOM   526  C CB  . VAL   A 1 171 ? 146.898 113.268 84.852  1.00 113.08 ? 115 VAL   R CB  1 
ATOM   527  C CG1 . VAL   A 1 171 ? 147.606 112.217 84.007  1.00 112.91 ? 115 VAL   R CG1 1 
ATOM   528  C CG2 . VAL   A 1 171 ? 147.791 114.475 85.075  1.00 111.96 ? 115 VAL   R CG2 1 
ATOM   529  N N   . GLN   A 1 172 ? 144.329 111.877 85.233  1.00 109.51 ? 116 GLN   R N   1 
ATOM   530  C CA  . GLN   A 1 172 ? 143.483 110.693 85.253  1.00 107.54 ? 116 GLN   R CA  1 
ATOM   531  C C   . GLN   A 1 172 ? 143.331 110.205 86.685  1.00 105.91 ? 116 GLN   R C   1 
ATOM   532  O O   . GLN   A 1 172 ? 144.107 110.574 87.568  1.00 110.20 ? 116 GLN   R O   1 
ATOM   533  C CB  . GLN   A 1 172 ? 144.060 109.564 84.391  1.00 106.27 ? 116 GLN   R CB  1 
ATOM   534  C CG  . GLN   A 1 172 ? 145.273 108.892 85.000  1.00 106.57 ? 116 GLN   R CG  1 
ATOM   535  C CD  . GLN   A 1 172 ? 146.086 108.123 83.980  1.00 111.74 ? 116 GLN   R CD  1 
ATOM   536  O OE1 . GLN   A 1 172 ? 145.579 107.217 83.321  1.00 111.35 ? 116 GLN   R OE1 1 
ATOM   537  N NE2 . GLN   A 1 172 ? 147.358 108.479 83.849  1.00 114.71 ? 116 GLN   R NE2 1 
ATOM   538  N N   . TRP   A 1 173 ? 142.327 109.361 86.901  1.00 94.93  ? 117 TRP   R N   1 
ATOM   539  C CA  . TRP   A 1 173 ? 142.197 108.662 88.171  1.00 93.98  ? 117 TRP   R CA  1 
ATOM   540  C C   . TRP   A 1 173 ? 143.296 107.620 88.296  1.00 98.58  ? 117 TRP   R C   1 
ATOM   541  O O   . TRP   A 1 173 ? 143.480 106.792 87.400  1.00 103.90 ? 117 TRP   R O   1 
ATOM   542  C CB  . TRP   A 1 173 ? 140.827 107.997 88.268  1.00 96.63  ? 117 TRP   R CB  1 
ATOM   543  C CG  . TRP   A 1 173 ? 140.383 107.750 89.669  1.00 93.04  ? 117 TRP   R CG  1 
ATOM   544  C CD1 . TRP   A 1 173 ? 140.411 106.566 90.336  1.00 96.48  ? 117 TRP   R CD1 1 
ATOM   545  C CD2 . TRP   A 1 173 ? 139.839 108.710 90.577  1.00 90.74  ? 117 TRP   R CD2 1 
ATOM   546  N NE1 . TRP   A 1 173 ? 139.919 106.727 91.606  1.00 95.79  ? 117 TRP   R NE1 1 
ATOM   547  C CE2 . TRP   A 1 173 ? 139.561 108.037 91.778  1.00 91.46  ? 117 TRP   R CE2 1 
ATOM   548  C CE3 . TRP   A 1 173 ? 139.560 110.074 90.490  1.00 94.26  ? 117 TRP   R CE3 1 
ATOM   549  C CZ2 . TRP   A 1 173 ? 139.019 108.679 92.883  1.00 92.86  ? 117 TRP   R CZ2 1 
ATOM   550  C CZ3 . TRP   A 1 173 ? 139.023 110.708 91.586  1.00 93.16  ? 117 TRP   R CZ3 1 
ATOM   551  C CH2 . TRP   A 1 173 ? 138.758 110.013 92.767  1.00 90.69  ? 117 TRP   R CH2 1 
ATOM   552  N N   . VAL   A 1 174 ? 144.033 107.665 89.401  1.00 99.31  ? 118 VAL   R N   1 
ATOM   553  C CA  . VAL   A 1 174 ? 145.129 106.738 89.636  1.00 97.97  ? 118 VAL   R CA  1 
ATOM   554  C C   . VAL   A 1 174 ? 145.054 106.122 91.032  1.00 98.79  ? 118 VAL   R C   1 
ATOM   555  O O   . VAL   A 1 174 ? 146.061 105.676 91.565  1.00 101.51 ? 118 VAL   R O   1 
ATOM   556  C CB  . VAL   A 1 174 ? 146.488 107.424 89.402  1.00 96.04  ? 118 VAL   R CB  1 
ATOM   557  C CG1 . VAL   A 1 174 ? 146.675 107.727 87.928  1.00 95.08  ? 118 VAL   R CG1 1 
ATOM   558  C CG2 . VAL   A 1 174 ? 146.589 108.699 90.225  1.00 95.07  ? 118 VAL   R CG2 1 
ATOM   559  N N   . PHE   A 1 175 ? 143.864 106.094 91.632  1.00 99.87  ? 119 PHE   R N   1 
ATOM   560  C CA  . PHE   A 1 175 ? 143.679 105.488 92.941  1.00 100.75 ? 119 PHE   R CA  1 
ATOM   561  C C   . PHE   A 1 175 ? 142.816 104.236 92.915  1.00 105.08 ? 119 PHE   R C   1 
ATOM   562  O O   . PHE   A 1 175 ? 142.503 103.702 93.983  1.00 110.42 ? 119 PHE   R O   1 
ATOM   563  C CB  . PHE   A 1 175 ? 143.059 106.498 93.918  1.00 98.88  ? 119 PHE   R CB  1 
ATOM   564  C CG  . PHE   A 1 175 ? 143.529 107.904 93.717  1.00 95.70  ? 119 PHE   R CG  1 
ATOM   565  C CD1 . PHE   A 1 175 ? 144.876 108.203 93.716  1.00 100.90 ? 119 PHE   R CD1 1 
ATOM   566  C CD2 . PHE   A 1 175 ? 142.622 108.933 93.553  1.00 97.00  ? 119 PHE   R CD2 1 
ATOM   567  C CE1 . PHE   A 1 175 ? 145.309 109.499 93.536  1.00 106.67 ? 119 PHE   R CE1 1 
ATOM   568  C CE2 . PHE   A 1 175 ? 143.049 110.229 93.374  1.00 99.85  ? 119 PHE   R CE2 1 
ATOM   569  C CZ  . PHE   A 1 175 ? 144.393 110.512 93.365  1.00 102.94 ? 119 PHE   R CZ  1 
ATOM   570  N N   . GLY   A 1 176 ? 142.420 103.756 91.742  1.00 106.18 ? 120 GLY   R N   1 
ATOM   571  C CA  . GLY   A 1 176 ? 141.584 102.580 91.636  1.00 103.98 ? 120 GLY   R CA  1 
ATOM   572  C C   . GLY   A 1 176 ? 140.110 102.911 91.789  1.00 108.07 ? 120 GLY   R C   1 
ATOM   573  O O   . GLY   A 1 176 ? 139.708 104.055 92.014  1.00 108.30 ? 120 GLY   R O   1 
ATOM   574  N N   . SER   A 1 177 ? 139.288 101.867 91.662  1.00 103.49 ? 121 SER   R N   1 
ATOM   575  C CA  . SER   A 1 177 ? 137.843 102.053 91.733  1.00 97.73  ? 121 SER   R CA  1 
ATOM   576  C C   . SER   A 1 177 ? 137.362 102.248 93.165  1.00 96.17  ? 121 SER   R C   1 
ATOM   577  O O   . SER   A 1 177 ? 136.349 102.921 93.392  1.00 100.46 ? 121 SER   R O   1 
ATOM   578  C CB  . SER   A 1 177 ? 137.134 100.860 91.095  1.00 95.02  ? 121 SER   R CB  1 
ATOM   579  O OG  . SER   A 1 177 ? 137.754 99.643  91.467  1.00 98.67  ? 121 SER   R OG  1 
ATOM   580  N N   . GLY   A 1 178 ? 138.055 101.665 94.143  1.00 82.05  ? 122 GLY   R N   1 
ATOM   581  C CA  . GLY   A 1 178 ? 137.600 101.790 95.518  1.00 85.07  ? 122 GLY   R CA  1 
ATOM   582  C C   . GLY   A 1 178 ? 137.533 103.235 95.970  1.00 86.15  ? 122 GLY   R C   1 
ATOM   583  O O   . GLY   A 1 178 ? 136.529 103.683 96.535  1.00 88.60  ? 122 GLY   R O   1 
ATOM   584  N N   . LEU   A 1 179 ? 138.596 103.992 95.710  1.00 91.62  ? 123 LEU   R N   1 
ATOM   585  C CA  . LEU   A 1 179 ? 138.589 105.396 96.098  1.00 99.18  ? 123 LEU   R CA  1 
ATOM   586  C C   . LEU   A 1 179 ? 137.628 106.196 95.230  1.00 102.85 ? 123 LEU   R C   1 
ATOM   587  O O   . LEU   A 1 179 ? 137.061 107.192 95.685  1.00 103.90 ? 123 LEU   R O   1 
ATOM   588  C CB  . LEU   A 1 179 ? 140.003 105.969 96.037  1.00 98.30  ? 123 LEU   R CB  1 
ATOM   589  C CG  . LEU   A 1 179 ? 140.711 105.925 97.394  1.00 98.54  ? 123 LEU   R CG  1 
ATOM   590  C CD1 . LEU   A 1 179 ? 142.214 106.028 97.240  1.00 98.28  ? 123 LEU   R CD1 1 
ATOM   591  C CD2 . LEU   A 1 179 ? 140.193 107.029 98.303  1.00 96.34  ? 123 LEU   R CD2 1 
ATOM   592  N N   . CYS   A 1 180 ? 137.411 105.766 93.986  1.00 97.40  ? 124 CYS   R N   1 
ATOM   593  C CA  . CYS   A 1 180 ? 136.367 106.364 93.163  1.00 96.61  ? 124 CYS   R CA  1 
ATOM   594  C C   . CYS   A 1 180 ? 135.024 106.304 93.881  1.00 95.96  ? 124 CYS   R C   1 
ATOM   595  O O   . CYS   A 1 180 ? 134.350 107.326 94.066  1.00 94.36  ? 124 CYS   R O   1 
ATOM   596  C CB  . CYS   A 1 180 ? 136.309 105.633 91.816  1.00 97.22  ? 124 CYS   R CB  1 
ATOM   597  S SG  . CYS   A 1 180 ? 135.119 106.230 90.580  1.00 111.54 ? 124 CYS   R SG  1 
ATOM   598  N N   . LYS   A 1 181 ? 134.644 105.104 94.324  1.00 95.81  ? 125 LYS   R N   1 
ATOM   599  C CA  . LYS   A 1 181 ? 133.364 104.934 95.005  1.00 93.13  ? 125 LYS   R CA  1 
ATOM   600  C C   . LYS   A 1 181 ? 133.321 105.734 96.298  1.00 88.28  ? 125 LYS   R C   1 
ATOM   601  O O   . LYS   A 1 181 ? 132.323 106.401 96.599  1.00 85.66  ? 125 LYS   R O   1 
ATOM   602  C CB  . LYS   A 1 181 ? 133.112 103.453 95.286  1.00 90.74  ? 125 LYS   R CB  1 
ATOM   603  C CG  . LYS   A 1 181 ? 132.797 102.638 94.046  1.00 90.69  ? 125 LYS   R CG  1 
ATOM   604  C CD  . LYS   A 1 181 ? 132.759 101.151 94.343  1.00 90.86  ? 125 LYS   R CD  1 
ATOM   605  C CE  . LYS   A 1 181 ? 132.473 100.349 93.083  1.00 90.59  ? 125 LYS   R CE  1 
ATOM   606  N NZ  . LYS   A 1 181 ? 132.532 98.881  93.316  1.00 94.28  ? 125 LYS   R NZ  1 
ATOM   607  N N   . VAL   A 1 182 ? 134.400 105.680 97.081  1.00 86.23  ? 126 VAL   R N   1 
ATOM   608  C CA  . VAL   A 1 182 ? 134.403 106.367 98.371  1.00 84.18  ? 126 VAL   R CA  1 
ATOM   609  C C   . VAL   A 1 182 ? 134.248 107.869 98.172  1.00 89.08  ? 126 VAL   R C   1 
ATOM   610  O O   . VAL   A 1 182 ? 133.436 108.525 98.841  1.00 94.19  ? 126 VAL   R O   1 
ATOM   611  C CB  . VAL   A 1 182 ? 135.683 106.031 99.152  1.00 86.01  ? 126 VAL   R CB  1 
ATOM   612  C CG1 . VAL   A 1 182 ? 135.758 106.859 100.419 1.00 93.98  ? 126 VAL   R CG1 1 
ATOM   613  C CG2 . VAL   A 1 182 ? 135.721 104.552 99.480  1.00 89.71  ? 126 VAL   R CG2 1 
ATOM   614  N N   . ALA   A 1 183 ? 135.024 108.439 97.248  1.00 84.01  ? 127 ALA   R N   1 
ATOM   615  C CA  . ALA   A 1 183 ? 134.960 109.873 97.006  1.00 83.00  ? 127 ALA   R CA  1 
ATOM   616  C C   . ALA   A 1 183 ? 133.592 110.282 96.482  1.00 90.63  ? 127 ALA   R C   1 
ATOM   617  O O   . ALA   A 1 183 ? 133.041 111.302 96.908  1.00 95.56  ? 127 ALA   R O   1 
ATOM   618  C CB  . ALA   A 1 183 ? 136.056 110.284 96.026  1.00 84.63  ? 127 ALA   R CB  1 
ATOM   619  N N   . GLY   A 1 184 ? 133.026 109.505 95.557  1.00 87.17  ? 128 GLY   R N   1 
ATOM   620  C CA  . GLY   A 1 184 ? 131.712 109.852 95.041  1.00 86.02  ? 128 GLY   R CA  1 
ATOM   621  C C   . GLY   A 1 184 ? 130.649 109.828 96.119  1.00 81.89  ? 128 GLY   R C   1 
ATOM   622  O O   . GLY   A 1 184 ? 129.799 110.724 96.201  1.00 82.48  ? 128 GLY   R O   1 
ATOM   623  N N   . ALA   A 1 185 ? 130.678 108.797 96.963  1.00 77.95  ? 129 ALA   R N   1 
ATOM   624  C CA  . ALA   A 1 185 ? 129.715 108.719 98.051  1.00 73.41  ? 129 ALA   R CA  1 
ATOM   625  C C   . ALA   A 1 185 ? 129.854 109.917 98.976  1.00 72.30  ? 129 ALA   R C   1 
ATOM   626  O O   . ALA   A 1 185 ? 128.860 110.552 99.343  1.00 80.33  ? 129 ALA   R O   1 
ATOM   627  C CB  . ALA   A 1 185 ? 129.903 107.416 98.825  1.00 80.14  ? 129 ALA   R CB  1 
ATOM   628  N N   . LEU   A 1 186 ? 131.088 110.247 99.359  1.00 79.06  ? 130 LEU   R N   1 
ATOM   629  C CA  . LEU   A 1 186 ? 131.306 111.392 100.234 1.00 78.87  ? 130 LEU   R CA  1 
ATOM   630  C C   . LEU   A 1 186 ? 130.745 112.660 99.604  1.00 80.32  ? 130 LEU   R C   1 
ATOM   631  O O   . LEU   A 1 186 ? 130.027 113.433 100.250 1.00 84.17  ? 130 LEU   R O   1 
ATOM   632  C CB  . LEU   A 1 186 ? 132.801 111.549 100.522 1.00 84.26  ? 130 LEU   R CB  1 
ATOM   633  C CG  . LEU   A 1 186 ? 133.301 111.145 101.910 1.00 87.13  ? 130 LEU   R CG  1 
ATOM   634  C CD1 . LEU   A 1 186 ? 134.807 111.312 101.974 1.00 85.52  ? 130 LEU   R CD1 1 
ATOM   635  C CD2 . LEU   A 1 186 ? 132.641 111.960 103.009 1.00 84.91  ? 130 LEU   R CD2 1 
ATOM   636  N N   . PHE   A 1 187 ? 131.054 112.876 98.327  1.00 84.54  ? 131 PHE   R N   1 
ATOM   637  C CA  . PHE   A 1 187 ? 130.623 114.073 97.619  1.00 83.87  ? 131 PHE   R CA  1 
ATOM   638  C C   . PHE   A 1 187 ? 129.108 114.209 97.631  1.00 89.71  ? 131 PHE   R C   1 
ATOM   639  O O   . PHE   A 1 187 ? 128.577 115.252 98.030  1.00 93.48  ? 131 PHE   R O   1 
ATOM   640  C CB  . PHE   A 1 187 ? 131.124 114.038 96.176  1.00 85.03  ? 131 PHE   R CB  1 
ATOM   641  C CG  . PHE   A 1 187 ? 131.257 115.391 95.550  1.00 88.84  ? 131 PHE   R CG  1 
ATOM   642  C CD1 . PHE   A 1 187 ? 132.337 116.200 95.847  1.00 89.10  ? 131 PHE   R CD1 1 
ATOM   643  C CD2 . PHE   A 1 187 ? 130.302 115.855 94.666  1.00 86.40  ? 131 PHE   R CD2 1 
ATOM   644  C CE1 . PHE   A 1 187 ? 132.462 117.445 95.274  1.00 84.83  ? 131 PHE   R CE1 1 
ATOM   645  C CE2 . PHE   A 1 187 ? 130.423 117.099 94.091  1.00 88.31  ? 131 PHE   R CE2 1 
ATOM   646  C CZ  . PHE   A 1 187 ? 131.505 117.894 94.396  1.00 87.15  ? 131 PHE   R CZ  1 
ATOM   647  N N   . ASN   A 1 188 ? 128.400 113.165 97.199  1.00 82.33  ? 132 ASN   R N   1 
ATOM   648  C CA  . ASN   A 1 188 ? 126.948 113.274 97.096  1.00 78.38  ? 132 ASN   R CA  1 
ATOM   649  C C   . ASN   A 1 188 ? 126.306 113.395 98.472  1.00 78.45  ? 132 ASN   R C   1 
ATOM   650  O O   . ASN   A 1 188 ? 125.391 114.207 98.675  1.00 87.41  ? 132 ASN   R O   1 
ATOM   651  C CB  . ASN   A 1 188 ? 126.382 112.079 96.337  1.00 77.58  ? 132 ASN   R CB  1 
ATOM   652  C CG  . ASN   A 1 188 ? 126.478 112.251 94.839  1.00 79.83  ? 132 ASN   R CG  1 
ATOM   653  O OD1 . ASN   A 1 188 ? 127.557 112.481 94.299  1.00 85.47  ? 132 ASN   R OD1 1 
ATOM   654  N ND2 . ASN   A 1 188 ? 125.347 112.136 94.157  1.00 79.29  ? 132 ASN   R ND2 1 
ATOM   655  N N   . ILE   A 1 189 ? 126.766 112.591 99.434  1.00 70.14  ? 133 ILE   R N   1 
ATOM   656  C CA  . ILE   A 1 189 ? 126.212 112.672 100.780 1.00 67.50  ? 133 ILE   R CA  1 
ATOM   657  C C   . ILE   A 1 189 ? 126.332 114.094 101.300 1.00 70.87  ? 133 ILE   R C   1 
ATOM   658  O O   . ILE   A 1 189 ? 125.367 114.673 101.811 1.00 79.54  ? 133 ILE   R O   1 
ATOM   659  C CB  . ILE   A 1 189 ? 126.917 111.673 101.715 1.00 71.53  ? 133 ILE   R CB  1 
ATOM   660  C CG1 . ILE   A 1 189 ? 126.503 110.242 101.368 1.00 76.94  ? 133 ILE   R CG1 1 
ATOM   661  C CG2 . ILE   A 1 189 ? 126.600 112.002 103.171 1.00 71.13  ? 133 ILE   R CG2 1 
ATOM   662  C CD1 . ILE   A 1 189 ? 127.061 109.186 102.298 1.00 76.48  ? 133 ILE   R CD1 1 
ATOM   663  N N   . ASN   A 1 190 ? 127.517 114.689 101.156 1.00 76.41  ? 134 ASN   R N   1 
ATOM   664  C CA  . ASN   A 1 190 ? 127.740 116.009 101.729 1.00 74.64  ? 134 ASN   R CA  1 
ATOM   665  C C   . ASN   A 1 190 ? 126.965 117.082 100.978 1.00 79.84  ? 134 ASN   R C   1 
ATOM   666  O O   . ASN   A 1 190 ? 126.474 118.035 101.589 1.00 82.84  ? 134 ASN   R O   1 
ATOM   667  C CB  . ASN   A 1 190 ? 129.231 116.317 101.739 1.00 77.39  ? 134 ASN   R CB  1 
ATOM   668  C CG  . ASN   A 1 190 ? 129.979 115.483 102.750 1.00 81.31  ? 134 ASN   R CG  1 
ATOM   669  O OD1 . ASN   A 1 190 ? 129.652 115.484 103.935 1.00 81.61  ? 134 ASN   R OD1 1 
ATOM   670  N ND2 . ASN   A 1 190 ? 130.983 114.755 102.288 1.00 84.36  ? 134 ASN   R ND2 1 
ATOM   671  N N   . PHE   A 1 191 ? 126.831 116.949 99.658  1.00 84.75  ? 135 PHE   R N   1 
ATOM   672  C CA  . PHE   A 1 191 ? 126.063 117.933 98.902  1.00 82.83  ? 135 PHE   R CA  1 
ATOM   673  C C   . PHE   A 1 191 ? 124.601 117.939 99.338  1.00 85.60  ? 135 PHE   R C   1 
ATOM   674  O O   . PHE   A 1 191 ? 124.021 118.997 99.630  1.00 87.95  ? 135 PHE   R O   1 
ATOM   675  C CB  . PHE   A 1 191 ? 126.187 117.638 97.408  1.00 83.15  ? 135 PHE   R CB  1 
ATOM   676  C CG  . PHE   A 1 191 ? 125.131 118.290 96.570  1.00 90.07  ? 135 PHE   R CG  1 
ATOM   677  C CD1 . PHE   A 1 191 ? 125.034 119.666 96.504  1.00 90.25  ? 135 PHE   R CD1 1 
ATOM   678  C CD2 . PHE   A 1 191 ? 124.242 117.526 95.839  1.00 87.61  ? 135 PHE   R CD2 1 
ATOM   679  C CE1 . PHE   A 1 191 ? 124.065 120.266 95.729  1.00 90.09  ? 135 PHE   R CE1 1 
ATOM   680  C CE2 . PHE   A 1 191 ? 123.273 118.121 95.063  1.00 86.84  ? 135 PHE   R CE2 1 
ATOM   681  C CZ  . PHE   A 1 191 ? 123.184 119.491 95.008  1.00 89.97  ? 135 PHE   R CZ  1 
ATOM   682  N N   . TYR   A 1 192 ? 123.989 116.754 99.400  1.00 75.71  ? 136 TYR   R N   1 
ATOM   683  C CA  . TYR   A 1 192 ? 122.595 116.680 99.826  1.00 66.33  ? 136 TYR   R CA  1 
ATOM   684  C C   . TYR   A 1 192 ? 122.442 117.150 101.265 1.00 68.88  ? 136 TYR   R C   1 
ATOM   685  O O   . TYR   A 1 192 ? 121.469 117.833 101.608 1.00 73.91  ? 136 TYR   R O   1 
ATOM   686  C CB  . TYR   A 1 192 ? 122.070 115.256 99.663  1.00 68.34  ? 136 TYR   R CB  1 
ATOM   687  C CG  . TYR   A 1 192 ? 121.889 114.848 98.223  1.00 76.55  ? 136 TYR   R CG  1 
ATOM   688  C CD1 . TYR   A 1 192 ? 121.055 115.564 97.381  1.00 80.38  ? 136 TYR   R CD1 1 
ATOM   689  C CD2 . TYR   A 1 192 ? 122.553 113.750 97.706  1.00 82.71  ? 136 TYR   R CD2 1 
ATOM   690  C CE1 . TYR   A 1 192 ? 120.888 115.198 96.066  1.00 79.57  ? 136 TYR   R CE1 1 
ATOM   691  C CE2 . TYR   A 1 192 ? 122.392 113.377 96.392  1.00 81.19  ? 136 TYR   R CE2 1 
ATOM   692  C CZ  . TYR   A 1 192 ? 121.559 114.104 95.576  1.00 80.02  ? 136 TYR   R CZ  1 
ATOM   693  O OH  . TYR   A 1 192 ? 121.396 113.733 94.264  1.00 84.68  ? 136 TYR   R OH  1 
ATOM   694  N N   . ALA   A 1 193 ? 123.393 116.788 102.129 1.00 68.36  ? 137 ALA   R N   1 
ATOM   695  C CA  . ALA   A 1 193 ? 123.331 117.239 103.511 1.00 64.55  ? 137 ALA   R CA  1 
ATOM   696  C C   . ALA   A 1 193 ? 123.385 118.754 103.588 1.00 69.82  ? 137 ALA   R C   1 
ATOM   697  O O   . ALA   A 1 193 ? 122.648 119.365 104.365 1.00 74.66  ? 137 ALA   R O   1 
ATOM   698  C CB  . ALA   A 1 193 ? 124.472 116.624 104.317 1.00 69.52  ? 137 ALA   R CB  1 
ATOM   699  N N   . GLY   A 1 194 ? 124.245 119.382 102.788 1.00 70.49  ? 138 GLY   R N   1 
ATOM   700  C CA  . GLY   A 1 194 ? 124.319 120.832 102.803 1.00 64.34  ? 138 GLY   R CA  1 
ATOM   701  C C   . GLY   A 1 194 ? 123.015 121.474 102.378 1.00 65.54  ? 138 GLY   R C   1 
ATOM   702  O O   . GLY   A 1 194 ? 122.525 122.406 103.021 1.00 72.90  ? 138 GLY   R O   1 
ATOM   703  N N   . ALA   A 1 195 ? 122.428 120.976 101.288 1.00 63.53  ? 139 ALA   R N   1 
ATOM   704  C CA  . ALA   A 1 195 ? 121.165 121.547 100.826 1.00 63.08  ? 139 ALA   R CA  1 
ATOM   705  C C   . ALA   A 1 195 ? 120.076 121.407 101.886 1.00 61.78  ? 139 ALA   R C   1 
ATOM   706  O O   . ALA   A 1 195 ? 119.400 122.384 102.245 1.00 60.15  ? 139 ALA   R O   1 
ATOM   707  C CB  . ALA   A 1 195 ? 120.735 120.878 99.523  1.00 70.75  ? 139 ALA   R CB  1 
ATOM   708  N N   . LEU   A 1 196 ? 119.897 120.192 102.410 1.00 60.38  ? 140 LEU   R N   1 
ATOM   709  C CA  . LEU   A 1 196 ? 118.840 119.972 103.389 1.00 60.58  ? 140 LEU   R CA  1 
ATOM   710  C C   . LEU   A 1 196 ? 119.113 120.721 104.684 1.00 63.79  ? 140 LEU   R C   1 
ATOM   711  O O   . LEU   A 1 196 ? 118.173 121.121 105.376 1.00 69.69  ? 140 LEU   R O   1 
ATOM   712  C CB  . LEU   A 1 196 ? 118.674 118.478 103.662 1.00 57.83  ? 140 LEU   R CB  1 
ATOM   713  C CG  . LEU   A 1 196 ? 118.342 117.585 102.462 1.00 63.13  ? 140 LEU   R CG  1 
ATOM   714  C CD1 . LEU   A 1 196 ? 117.606 116.342 102.924 1.00 66.02  ? 140 LEU   R CD1 1 
ATOM   715  C CD2 . LEU   A 1 196 ? 117.527 118.319 101.411 1.00 58.73  ? 140 LEU   R CD2 1 
ATOM   716  N N   . LEU   A 1 197 ? 120.382 120.945 105.024 1.00 63.41  ? 141 LEU   R N   1 
ATOM   717  C CA  . LEU   A 1 197 ? 120.695 121.680 106.241 1.00 57.96  ? 141 LEU   R CA  1 
ATOM   718  C C   . LEU   A 1 197 ? 120.405 123.163 106.074 1.00 62.26  ? 141 LEU   R C   1 
ATOM   719  O O   . LEU   A 1 197 ? 119.957 123.820 107.018 1.00 62.70  ? 141 LEU   R O   1 
ATOM   720  C CB  . LEU   A 1 197 ? 122.155 121.452 106.626 1.00 53.70  ? 141 LEU   R CB  1 
ATOM   721  C CG  . LEU   A 1 197 ? 122.447 120.142 107.360 1.00 61.56  ? 141 LEU   R CG  1 
ATOM   722  C CD1 . LEU   A 1 197 ? 123.939 119.947 107.511 1.00 61.68  ? 141 LEU   R CD1 1 
ATOM   723  C CD2 . LEU   A 1 197 ? 121.768 120.106 108.717 1.00 63.81  ? 141 LEU   R CD2 1 
ATOM   724  N N   . LEU   A 1 198 ? 120.651 123.713 104.884 1.00 68.50  ? 142 LEU   R N   1 
ATOM   725  C CA  . LEU   A 1 198 ? 120.220 125.083 104.626 1.00 55.86  ? 142 LEU   R CA  1 
ATOM   726  C C   . LEU   A 1 198 ? 118.706 125.200 104.732 1.00 61.45  ? 142 LEU   R C   1 
ATOM   727  O O   . LEU   A 1 198 ? 118.187 126.155 105.327 1.00 65.59  ? 142 LEU   R O   1 
ATOM   728  C CB  . LEU   A 1 198 ? 120.692 125.538 103.248 1.00 50.20  ? 142 LEU   R CB  1 
ATOM   729  C CG  . LEU   A 1 198 ? 122.200 125.682 103.073 1.00 54.56  ? 142 LEU   R CG  1 
ATOM   730  C CD1 . LEU   A 1 198 ? 122.535 125.977 101.627 1.00 63.01  ? 142 LEU   R CD1 1 
ATOM   731  C CD2 . LEU   A 1 198 ? 122.736 126.770 103.973 1.00 64.13  ? 142 LEU   R CD2 1 
ATOM   732  N N   . ALA   A 1 199 ? 117.980 124.232 104.171 1.00 62.26  ? 143 ALA   R N   1 
ATOM   733  C CA  . ALA   A 1 199 ? 116.525 124.261 104.291 1.00 51.90  ? 143 ALA   R CA  1 
ATOM   734  C C   . ALA   A 1 199 ? 116.094 124.195 105.752 1.00 57.56  ? 143 ALA   R C   1 
ATOM   735  O O   . ALA   A 1 199 ? 115.177 124.910 106.171 1.00 63.99  ? 143 ALA   R O   1 
ATOM   736  C CB  . ALA   A 1 199 ? 115.907 123.112 103.500 1.00 59.27  ? 143 ALA   R CB  1 
ATOM   737  N N   . CYS   A 1 200 ? 116.743 123.337 106.542 1.00 56.03  ? 144 CYS   R N   1 
ATOM   738  C CA  . CYS   A 1 200 ? 116.392 123.212 107.953 1.00 58.32  ? 144 CYS   R CA  1 
ATOM   739  C C   . CYS   A 1 200 ? 116.701 124.492 108.718 1.00 56.37  ? 144 CYS   R C   1 
ATOM   740  O O   . CYS   A 1 200 ? 115.947 124.880 109.615 1.00 52.52  ? 144 CYS   R O   1 
ATOM   741  C CB  . CYS   A 1 200 ? 117.129 122.028 108.572 1.00 63.33  ? 144 CYS   R CB  1 
ATOM   742  S SG  . CYS   A 1 200 ? 116.602 120.424 107.945 1.00 73.71  ? 144 CYS   R SG  1 
ATOM   743  N N   . ILE   A 1 201 ? 117.814 125.151 108.394 1.00 53.63  ? 145 ILE   R N   1 
ATOM   744  C CA  . ILE   A 1 201 ? 118.134 126.427 109.027 1.00 52.13  ? 145 ILE   R CA  1 
ATOM   745  C C   . ILE   A 1 201 ? 117.046 127.445 108.725 1.00 61.11  ? 145 ILE   R C   1 
ATOM   746  O O   . ILE   A 1 201 ? 116.593 128.182 109.609 1.00 74.04  ? 145 ILE   R O   1 
ATOM   747  C CB  . ILE   A 1 201 ? 119.511 126.927 108.559 1.00 50.18  ? 145 ILE   R CB  1 
ATOM   748  C CG1 . ILE   A 1 201 ? 120.618 126.295 109.397 1.00 51.87  ? 145 ILE   R CG1 1 
ATOM   749  C CG2 . ILE   A 1 201 ? 119.581 128.440 108.643 1.00 61.81  ? 145 ILE   R CG2 1 
ATOM   750  C CD1 . ILE   A 1 201 ? 122.008 126.601 108.903 1.00 51.09  ? 145 ILE   R CD1 1 
ATOM   751  N N   . SER   A 1 202 ? 116.619 127.510 107.464 1.00 64.86  ? 146 SER   R N   1 
ATOM   752  C CA  . SER   A 1 202 ? 115.562 128.449 107.104 1.00 47.91  ? 146 SER   R CA  1 
ATOM   753  C C   . SER   A 1 202 ? 114.280 128.140 107.862 1.00 38.65  ? 146 SER   R C   1 
ATOM   754  O O   . SER   A 1 202 ? 113.597 129.048 108.346 1.00 38.47  ? 146 SER   R O   1 
ATOM   755  C CB  . SER   A 1 202 ? 115.321 128.415 105.598 1.00 58.25  ? 146 SER   R CB  1 
ATOM   756  O OG  . SER   A 1 202 ? 116.498 128.775 104.899 1.00 65.03  ? 146 SER   R OG  1 
ATOM   757  N N   . PHE   A 1 203 ? 113.934 126.857 107.975 1.00 47.78  ? 147 PHE   R N   1 
ATOM   758  C CA  . PHE   A 1 203 ? 112.714 126.497 108.691 1.00 48.68  ? 147 PHE   R CA  1 
ATOM   759  C C   . PHE   A 1 203 ? 112.810 126.851 110.168 1.00 52.04  ? 147 PHE   R C   1 
ATOM   760  O O   . PHE   A 1 203 ? 111.830 127.299 110.768 1.00 59.42  ? 147 PHE   R O   1 
ATOM   761  C CB  . PHE   A 1 203 ? 112.409 125.012 108.524 1.00 50.12  ? 147 PHE   R CB  1 
ATOM   762  C CG  . PHE   A 1 203 ? 111.020 124.643 108.946 1.00 55.42  ? 147 PHE   R CG  1 
ATOM   763  C CD1 . PHE   A 1 203 ? 109.923 125.168 108.292 1.00 55.27  ? 147 PHE   R CD1 1 
ATOM   764  C CD2 . PHE   A 1 203 ? 110.809 123.787 110.007 1.00 54.96  ? 147 PHE   R CD2 1 
ATOM   765  C CE1 . PHE   A 1 203 ? 108.649 124.839 108.680 1.00 42.15  ? 147 PHE   R CE1 1 
ATOM   766  C CE2 . PHE   A 1 203 ? 109.535 123.456 110.398 1.00 58.10  ? 147 PHE   R CE2 1 
ATOM   767  C CZ  . PHE   A 1 203 ? 108.455 123.983 109.734 1.00 49.70  ? 147 PHE   R CZ  1 
ATOM   768  N N   . ASP   A 1 204 ? 113.971 126.631 110.780 1.00 60.33  ? 148 ASP   R N   1 
ATOM   769  C CA  . ASP   A 1 204 ? 114.142 127.006 112.180 1.00 63.45  ? 148 ASP   R CA  1 
ATOM   770  C C   . ASP   A 1 204 ? 114.006 128.509 112.369 1.00 60.41  ? 148 ASP   R C   1 
ATOM   771  O O   . ASP   A 1 204 ? 113.386 128.966 113.336 1.00 57.33  ? 148 ASP   R O   1 
ATOM   772  C CB  . ASP   A 1 204 ? 115.497 126.532 112.690 1.00 63.57  ? 148 ASP   R CB  1 
ATOM   773  C CG  . ASP   A 1 204 ? 115.529 126.391 114.188 1.00 69.48  ? 148 ASP   R CG  1 
ATOM   774  O OD1 . ASP   A 1 204 ? 114.545 125.884 114.764 1.00 72.11  ? 148 ASP   R OD1 1 
ATOM   775  O OD2 . ASP   A 1 204 ? 116.539 126.798 114.792 1.00 74.09  ? 148 ASP   R OD2 1 
ATOM   776  N N   . ARG   A 1 205 ? 114.588 129.293 111.462 1.00 50.73  ? 149 ARG   R N   1 
ATOM   777  C CA  . ARG   A 1 205 ? 114.441 130.741 111.545 1.00 34.96  ? 149 ARG   R CA  1 
ATOM   778  C C   . ARG   A 1 205 ? 112.977 131.143 111.420 1.00 47.20  ? 149 ARG   R C   1 
ATOM   779  O O   . ARG   A 1 205 ? 112.483 131.984 112.179 1.00 53.23  ? 149 ARG   R O   1 
ATOM   780  C CB  . ARG   A 1 205 ? 115.281 131.406 110.459 1.00 41.55  ? 149 ARG   R CB  1 
ATOM   781  C CG  . ARG   A 1 205 ? 116.760 131.127 110.585 1.00 49.31  ? 149 ARG   R CG  1 
ATOM   782  C CD  . ARG   A 1 205 ? 117.580 132.365 110.343 1.00 54.44  ? 149 ARG   R CD  1 
ATOM   783  N NE  . ARG   A 1 205 ? 119.008 132.074 110.365 1.00 56.64  ? 149 ARG   R NE  1 
ATOM   784  C CZ  . ARG   A 1 205 ? 119.829 132.198 109.332 1.00 56.17  ? 149 ARG   R CZ  1 
ATOM   785  N NH1 . ARG   A 1 205 ? 119.399 132.580 108.141 1.00 53.35  ? 149 ARG   R NH1 1 
ATOM   786  N NH2 . ARG   A 1 205 ? 121.120 131.933 109.498 1.00 58.05  ? 149 ARG   R NH2 1 
ATOM   787  N N   . TYR   A 1 206 ? 112.262 130.536 110.471 1.00 47.62  ? 150 TYR   R N   1 
ATOM   788  C CA  . TYR   A 1 206 ? 110.844 130.841 110.307 1.00 33.22  ? 150 TYR   R CA  1 
ATOM   789  C C   . TYR   A 1 206 ? 110.051 130.488 111.553 1.00 42.63  ? 150 TYR   R C   1 
ATOM   790  O O   . TYR   A 1 206 ? 109.187 131.260 111.975 1.00 64.42  ? 150 TYR   R O   1 
ATOM   791  C CB  . TYR   A 1 206 ? 110.277 130.092 109.103 1.00 41.12  ? 150 TYR   R CB  1 
ATOM   792  C CG  . TYR   A 1 206 ? 108.769 129.991 109.095 1.00 37.13  ? 150 TYR   R CG  1 
ATOM   793  C CD1 . TYR   A 1 206 ? 107.995 130.979 108.518 1.00 45.33  ? 150 TYR   R CD1 1 
ATOM   794  C CD2 . TYR   A 1 206 ? 108.121 128.905 109.657 1.00 44.66  ? 150 TYR   R CD2 1 
ATOM   795  C CE1 . TYR   A 1 206 ? 106.624 130.894 108.508 1.00 42.64  ? 150 TYR   R CE1 1 
ATOM   796  C CE2 . TYR   A 1 206 ? 106.749 128.813 109.651 1.00 39.30  ? 150 TYR   R CE2 1 
ATOM   797  C CZ  . TYR   A 1 206 ? 106.006 129.810 109.075 1.00 36.52  ? 150 TYR   R CZ  1 
ATOM   798  O OH  . TYR   A 1 206 ? 104.636 129.728 109.064 1.00 45.42  ? 150 TYR   R OH  1 
ATOM   799  N N   . LEU   A 1 207 ? 110.320 129.328 112.149 1.00 41.51  ? 151 LEU   R N   1 
ATOM   800  C CA  . LEU   A 1 207 ? 109.615 128.943 113.363 1.00 41.97  ? 151 LEU   R CA  1 
ATOM   801  C C   . LEU   A 1 207 ? 109.903 129.904 114.504 1.00 49.34  ? 151 LEU   R C   1 
ATOM   802  O O   . LEU   A 1 207 ? 108.989 130.263 115.252 1.00 58.97  ? 151 LEU   R O   1 
ATOM   803  C CB  . LEU   A 1 207 ? 110.003 127.522 113.772 1.00 42.96  ? 151 LEU   R CB  1 
ATOM   804  C CG  . LEU   A 1 207 ? 109.237 126.337 113.183 1.00 42.63  ? 151 LEU   R CG  1 
ATOM   805  C CD1 . LEU   A 1 207 ? 109.491 125.103 114.021 1.00 51.67  ? 151 LEU   R CD1 1 
ATOM   806  C CD2 . LEU   A 1 207 ? 107.748 126.599 113.087 1.00 56.46  ? 151 LEU   R CD2 1 
ATOM   807  N N   . ASN   A 1 208 ? 111.157 130.331 114.658 1.00 41.41  ? 152 ASN   R N   1 
ATOM   808  C CA  . ASN   A 1 208 ? 111.506 131.182 115.788 1.00 42.99  ? 152 ASN   R CA  1 
ATOM   809  C C   . ASN   A 1 208 ? 110.998 132.608 115.624 1.00 41.06  ? 152 ASN   R C   1 
ATOM   810  O O   . ASN   A 1 208 ? 110.632 133.241 116.617 1.00 52.95  ? 152 ASN   R O   1 
ATOM   811  C CB  . ASN   A 1 208 ? 113.020 131.191 115.991 1.00 60.58  ? 152 ASN   R CB  1 
ATOM   812  C CG  . ASN   A 1 208 ? 113.518 129.967 116.734 1.00 62.60  ? 152 ASN   R CG  1 
ATOM   813  O OD1 . ASN   A 1 208 ? 112.775 129.333 117.478 1.00 64.11  ? 152 ASN   R OD1 1 
ATOM   814  N ND2 . ASN   A 1 208 ? 114.787 129.639 116.544 1.00 58.63  ? 152 ASN   R ND2 1 
ATOM   815  N N   . ILE   A 1 209 ? 110.960 133.130 114.400 1.00 28.30  ? 153 ILE   R N   1 
ATOM   816  C CA  . ILE   A 1 209 ? 110.562 134.520 114.206 1.00 14.60  ? 153 ILE   R CA  1 
ATOM   817  C C   . ILE   A 1 209 ? 109.066 134.670 113.937 1.00 28.33  ? 153 ILE   R C   1 
ATOM   818  O O   . ILE   A 1 209 ? 108.421 135.538 114.530 1.00 36.77  ? 153 ILE   R O   1 
ATOM   819  C CB  . ILE   A 1 209 ? 111.380 135.153 113.073 1.00 13.72  ? 153 ILE   R CB  1 
ATOM   820  C CG1 . ILE   A 1 209 ? 112.874 135.017 113.359 1.00 34.90  ? 153 ILE   R CG1 1 
ATOM   821  C CG2 . ILE   A 1 209 ? 111.001 136.610 112.909 1.00 25.98  ? 153 ILE   R CG2 1 
ATOM   822  C CD1 . ILE   A 1 209 ? 113.752 135.431 112.211 1.00 40.94  ? 153 ILE   R CD1 1 
ATOM   823  N N   . VAL   A 1 210 ? 108.493 133.855 113.059 1.00 40.47  ? 154 VAL   R N   1 
ATOM   824  C CA  . VAL   A 1 210 ? 107.083 133.997 112.709 1.00 20.70  ? 154 VAL   R CA  1 
ATOM   825  C C   . VAL   A 1 210 ? 106.183 133.485 113.820 1.00 45.13  ? 154 VAL   R C   1 
ATOM   826  O O   . VAL   A 1 210 ? 105.352 134.227 114.348 1.00 56.64  ? 154 VAL   R O   1 
ATOM   827  C CB  . VAL   A 1 210 ? 106.786 133.275 111.382 1.00 22.15  ? 154 VAL   R CB  1 
ATOM   828  C CG1 . VAL   A 1 210 ? 105.317 133.381 111.052 1.00 31.45  ? 154 VAL   R CG1 1 
ATOM   829  C CG2 . VAL   A 1 210 ? 107.615 133.864 110.273 1.00 50.96  ? 154 VAL   R CG2 1 
ATOM   830  N N   . HIS   A 1 211 ? 106.325 132.212 114.188 1.00 53.17  ? 155 HIS   R N   1 
ATOM   831  C CA  . HIS   A 1 211 ? 105.548 131.622 115.276 1.00 54.17  ? 155 HIS   R CA  1 
ATOM   832  C C   . HIS   A 1 211 ? 106.330 131.811 116.570 1.00 51.09  ? 155 HIS   R C   1 
ATOM   833  O O   . HIS   A 1 211 ? 106.645 130.864 117.285 1.00 56.26  ? 155 HIS   R O   1 
ATOM   834  C CB  . HIS   A 1 211 ? 105.269 130.152 115.003 1.00 47.09  ? 155 HIS   R CB  1 
ATOM   835  C CG  . HIS   A 1 211 ? 104.476 129.908 113.762 1.00 45.59  ? 155 HIS   R CG  1 
ATOM   836  N ND1 . HIS   A 1 211 ? 103.199 130.395 113.588 1.00 55.32  ? 155 HIS   R ND1 1 
ATOM   837  C CD2 . HIS   A 1 211 ? 104.780 129.231 112.632 1.00 39.99  ? 155 HIS   R CD2 1 
ATOM   838  C CE1 . HIS   A 1 211 ? 102.750 130.025 112.403 1.00 60.06  ? 155 HIS   R CE1 1 
ATOM   839  N NE2 . HIS   A 1 211 ? 103.690 129.319 111.802 1.00 55.67  ? 155 HIS   R NE2 1 
ATOM   840  N N   . ALA   A 1 212 ? 106.632 133.066 116.877 1.00 47.97  ? 156 ALA   R N   1 
ATOM   841  C CA  . ALA   A 1 212 ? 107.474 133.391 118.015 1.00 44.52  ? 156 ALA   R CA  1 
ATOM   842  C C   . ALA   A 1 212 ? 106.787 133.198 119.352 1.00 63.50  ? 156 ALA   R C   1 
ATOM   843  O O   . ALA   A 1 212 ? 107.461 132.899 120.337 1.00 70.31  ? 156 ALA   R O   1 
ATOM   844  C CB  . ALA   A 1 212 ? 107.959 134.840 117.920 1.00 52.21  ? 156 ALA   R CB  1 
ATOM   845  N N   . THR   A 1 213 ? 105.468 133.362 119.414 1.00 87.76  ? 157 THR   R N   1 
ATOM   846  C CA  . THR   A 1 213 ? 104.735 133.288 120.669 1.00 88.12  ? 157 THR   R CA  1 
ATOM   847  C C   . THR   A 1 213 ? 104.202 131.891 120.965 1.00 87.31  ? 157 THR   R C   1 
ATOM   848  O O   . THR   A 1 213 ? 103.713 131.650 122.072 1.00 89.10  ? 157 THR   R O   1 
ATOM   849  C CB  . THR   A 1 213 ? 103.579 134.291 120.658 1.00 92.14  ? 157 THR   R CB  1 
ATOM   850  O OG1 . THR   A 1 213 ? 104.018 135.523 120.073 1.00 95.17  ? 157 THR   R OG1 1 
ATOM   851  C CG2 . THR   A 1 213 ? 103.091 134.558 122.071 1.00 88.69  ? 157 THR   R CG2 1 
ATOM   852  N N   . GLN   A 1 214 ? 104.293 130.964 120.010 1.00 86.79  ? 158 GLN   R N   1 
ATOM   853  C CA  . GLN   A 1 214 ? 103.836 129.597 120.215 1.00 89.99  ? 158 GLN   R CA  1 
ATOM   854  C C   . GLN   A 1 214 ? 104.961 128.608 120.475 1.00 84.60  ? 158 GLN   R C   1 
ATOM   855  O O   . GLN   A 1 214 ? 104.676 127.464 120.843 1.00 87.37  ? 158 GLN   R O   1 
ATOM   856  C CB  . GLN   A 1 214 ? 103.020 129.112 119.005 1.00 88.66  ? 158 GLN   R CB  1 
ATOM   857  C CG  . GLN   A 1 214 ? 102.008 130.123 118.487 1.00 92.31  ? 158 GLN   R CG  1 
ATOM   858  C CD  . GLN   A 1 214 ? 100.887 130.381 119.477 1.00 94.23  ? 158 GLN   R CD  1 
ATOM   859  O OE1 . GLN   A 1 214 ? 100.790 129.715 120.509 1.00 92.11  ? 158 GLN   R OE1 1 
ATOM   860  N NE2 . GLN   A 1 214 ? 100.033 131.350 119.168 1.00 93.99  ? 158 GLN   R NE2 1 
ATOM   861  N N   . LEU   A 1 215 ? 106.220 129.005 120.295 1.00 64.31  ? 159 LEU   R N   1 
ATOM   862  C CA  . LEU   A 1 215 ? 107.359 128.142 120.576 1.00 64.87  ? 159 LEU   R CA  1 
ATOM   863  C C   . LEU   A 1 215 ? 108.213 128.674 121.717 1.00 76.42  ? 159 LEU   R C   1 
ATOM   864  O O   . LEU   A 1 215 ? 109.336 128.198 121.910 1.00 80.66  ? 159 LEU   R O   1 
ATOM   865  C CB  . LEU   A 1 215 ? 108.221 127.978 119.323 1.00 64.23  ? 159 LEU   R CB  1 
ATOM   866  C CG  . LEU   A 1 215 ? 107.463 127.757 118.016 1.00 69.23  ? 159 LEU   R CG  1 
ATOM   867  C CD1 . LEU   A 1 215 ? 108.446 127.600 116.883 1.00 64.26  ? 159 LEU   R CD1 1 
ATOM   868  C CD2 . LEU   A 1 215 ? 106.545 126.552 118.091 1.00 73.95  ? 159 LEU   R CD2 1 
ATOM   869  N N   . TYR   A 1 216 ? 107.712 129.645 122.475 1.00 119.25 ? 160 TYR   R N   1 
ATOM   870  C CA  . TYR   A 1 216 ? 108.507 130.277 123.518 1.00 122.65 ? 160 TYR   R CA  1 
ATOM   871  C C   . TYR   A 1 216 ? 108.996 129.246 124.525 1.00 123.29 ? 160 TYR   R C   1 
ATOM   872  O O   . TYR   A 1 216 ? 108.251 128.349 124.928 1.00 122.89 ? 160 TYR   R O   1 
ATOM   873  C CB  . TYR   A 1 216 ? 107.676 131.349 124.223 1.00 119.28 ? 160 TYR   R CB  1 
ATOM   874  C CG  . TYR   A 1 216 ? 108.416 132.068 125.326 1.00 120.12 ? 160 TYR   R CG  1 
ATOM   875  C CD1 . TYR   A 1 216 ? 109.539 132.834 125.049 1.00 120.91 ? 160 TYR   R CD1 1 
ATOM   876  C CD2 . TYR   A 1 216 ? 107.992 131.982 126.644 1.00 119.78 ? 160 TYR   R CD2 1 
ATOM   877  C CE1 . TYR   A 1 216 ? 110.218 133.494 126.053 1.00 121.35 ? 160 TYR   R CE1 1 
ATOM   878  C CE2 . TYR   A 1 216 ? 108.665 132.638 127.655 1.00 120.02 ? 160 TYR   R CE2 1 
ATOM   879  C CZ  . TYR   A 1 216 ? 109.777 133.393 127.354 1.00 120.70 ? 160 TYR   R CZ  1 
ATOM   880  O OH  . TYR   A 1 216 ? 110.452 134.048 128.356 1.00 120.98 ? 160 TYR   R OH  1 
ATOM   881  N N   . ARG   A 1 217 ? 110.258 129.379 124.926 1.00 122.53 ? 161 ARG   R N   1 
ATOM   882  C CA  . ARG   A 1 217 ? 110.860 128.517 125.930 1.00 121.07 ? 161 ARG   R CA  1 
ATOM   883  C C   . ARG   A 1 217 ? 111.708 129.363 126.869 1.00 124.10 ? 161 ARG   R C   1 
ATOM   884  O O   . ARG   A 1 217 ? 112.395 130.290 126.430 1.00 122.39 ? 161 ARG   R O   1 
ATOM   885  C CB  . ARG   A 1 217 ? 111.714 127.426 125.281 1.00 118.36 ? 161 ARG   R CB  1 
ATOM   886  C CG  . ARG   A 1 217 ? 111.124 126.860 123.994 1.00 118.75 ? 161 ARG   R CG  1 
ATOM   887  C CD  . ARG   A 1 217 ? 111.752 125.527 123.606 1.00 121.78 ? 161 ARG   R CD  1 
ATOM   888  N NE  . ARG   A 1 217 ? 111.711 124.556 124.693 1.00 122.55 ? 161 ARG   R NE  1 
ATOM   889  C CZ  . ARG   A 1 217 ? 111.980 123.265 124.555 1.00 121.96 ? 161 ARG   R CZ  1 
ATOM   890  N NH1 . ARG   A 1 217 ? 112.322 122.750 123.386 1.00 122.46 ? 161 ARG   R NH1 1 
ATOM   891  N NH2 . ARG   A 1 217 ? 111.909 122.471 125.620 1.00 121.62 ? 161 ARG   R NH2 1 
ATOM   892  N N   . ARG   A 1 218 ? 111.660 129.040 128.162 1.00 145.87 ? 162 ARG   R N   1 
ATOM   893  C CA  . ARG   A 1 218 ? 112.344 129.818 129.196 1.00 145.92 ? 162 ARG   R CA  1 
ATOM   894  C C   . ARG   A 1 218 ? 113.786 129.331 129.284 1.00 146.03 ? 162 ARG   R C   1 
ATOM   895  O O   . ARG   A 1 218 ? 114.201 128.748 130.289 1.00 145.10 ? 162 ARG   R O   1 
ATOM   896  C CB  . ARG   A 1 218 ? 111.621 129.692 130.534 1.00 144.84 ? 162 ARG   R CB  1 
ATOM   897  C CG  . ARG   A 1 218 ? 112.265 130.464 131.688 1.00 144.09 ? 162 ARG   R CG  1 
ATOM   898  C CD  . ARG   A 1 218 ? 112.385 131.954 131.396 1.00 144.47 ? 162 ARG   R CD  1 
ATOM   899  N NE  . ARG   A 1 218 ? 113.050 132.666 132.484 1.00 146.33 ? 162 ARG   R NE  1 
ATOM   900  C CZ  . ARG   A 1 218 ? 114.234 133.261 132.396 1.00 146.16 ? 162 ARG   R CZ  1 
ATOM   901  N NH1 . ARG   A 1 218 ? 114.941 133.248 131.277 1.00 146.31 ? 162 ARG   R NH1 1 
ATOM   902  N NH2 . ARG   A 1 218 ? 114.726 133.884 133.464 1.00 146.03 ? 162 ARG   R NH2 1 
ATOM   903  N N   . GLY   A 1 219 ? 114.543 129.561 128.215 1.00 148.72 ? 163 GLY   R N   1 
ATOM   904  C CA  . GLY   A 1 219 ? 115.948 129.238 128.171 1.00 148.32 ? 163 GLY   R CA  1 
ATOM   905  C C   . GLY   A 1 219 ? 116.303 127.787 128.446 1.00 149.25 ? 163 GLY   R C   1 
ATOM   906  O O   . GLY   A 1 219 ? 117.232 127.507 129.210 1.00 149.61 ? 163 GLY   R O   1 
ATOM   907  N N   . PRO   A 1 220 ? 115.589 126.834 127.849 1.00 135.43 ? 164 PRO   R N   1 
ATOM   908  C CA  . PRO   A 1 220 ? 116.073 125.462 127.850 1.00 130.74 ? 164 PRO   R CA  1 
ATOM   909  C C   . PRO   A 1 220 ? 116.824 125.168 126.566 1.00 129.88 ? 164 PRO   R C   1 
ATOM   910  O O   . PRO   A 1 220 ? 116.768 125.959 125.612 1.00 129.95 ? 164 PRO   R O   1 
ATOM   911  C CB  . PRO   A 1 220 ? 114.781 124.644 127.937 1.00 130.13 ? 164 PRO   R CB  1 
ATOM   912  C CG  . PRO   A 1 220 ? 113.785 125.475 127.172 1.00 133.30 ? 164 PRO   R CG  1 
ATOM   913  C CD  . PRO   A 1 220 ? 114.321 126.907 127.098 1.00 133.87 ? 164 PRO   R CD  1 
ATOM   914  N N   . PRO   A 1 221 ? 117.535 124.053 126.495 1.00 121.32 ? 165 PRO   R N   1 
ATOM   915  C CA  . PRO   A 1 221 ? 118.084 123.625 125.206 1.00 121.30 ? 165 PRO   R CA  1 
ATOM   916  C C   . PRO   A 1 221 ? 117.060 122.844 124.400 1.00 121.15 ? 165 PRO   R C   1 
ATOM   917  O O   . PRO   A 1 221 ? 116.700 121.723 124.773 1.00 122.70 ? 165 PRO   R O   1 
ATOM   918  C CB  . PRO   A 1 221 ? 119.273 122.751 125.611 1.00 120.72 ? 165 PRO   R CB  1 
ATOM   919  C CG  . PRO   A 1 221 ? 118.869 122.165 126.935 1.00 121.04 ? 165 PRO   R CG  1 
ATOM   920  C CD  . PRO   A 1 221 ? 117.862 123.105 127.574 1.00 120.10 ? 165 PRO   R CD  1 
ATOM   921  N N   . ALA   A 1 222 ? 116.580 123.418 123.299 1.00 108.54 ? 166 ALA   R N   1 
ATOM   922  C CA  . ALA   A 1 222 ? 115.617 122.727 122.453 1.00 107.93 ? 166 ALA   R CA  1 
ATOM   923  C C   . ALA   A 1 222 ? 116.346 121.771 121.521 1.00 110.17 ? 166 ALA   R C   1 
ATOM   924  O O   . ALA   A 1 222 ? 116.640 122.120 120.374 1.00 108.20 ? 166 ALA   R O   1 
ATOM   925  C CB  . ALA   A 1 222 ? 114.783 123.726 121.652 1.00 108.10 ? 166 ALA   R CB  1 
ATOM   926  N N   . ARG   A 1 223 ? 116.643 120.568 122.005 1.00 104.32 ? 167 ARG   R N   1 
ATOM   927  C CA  . ARG   A 1 223 ? 117.458 119.638 121.237 1.00 100.91 ? 167 ARG   R CA  1 
ATOM   928  C C   . ARG   A 1 223 ? 116.800 119.327 119.901 1.00 98.96  ? 167 ARG   R C   1 
ATOM   929  O O   . ARG   A 1 223 ? 115.602 119.038 119.829 1.00 100.64 ? 167 ARG   R O   1 
ATOM   930  C CB  . ARG   A 1 223 ? 117.679 118.352 122.032 1.00 99.74  ? 167 ARG   R CB  1 
ATOM   931  C CG  . ARG   A 1 223 ? 118.426 118.549 123.348 1.00 99.11  ? 167 ARG   R CG  1 
ATOM   932  C CD  . ARG   A 1 223 ? 119.665 119.417 123.179 1.00 103.14 ? 167 ARG   R CD  1 
ATOM   933  N NE  . ARG   A 1 223 ? 120.546 119.364 124.340 1.00 109.25 ? 167 ARG   R NE  1 
ATOM   934  C CZ  . ARG   A 1 223 ? 121.666 120.064 124.464 1.00 108.55 ? 167 ARG   R CZ  1 
ATOM   935  N NH1 . ARG   A 1 223 ? 122.075 120.888 123.513 1.00 105.20 ? 167 ARG   R NH1 1 
ATOM   936  N NH2 . ARG   A 1 223 ? 122.392 119.936 125.570 1.00 105.03 ? 167 ARG   R NH2 1 
ATOM   937  N N   . VAL   A 1 224 ? 117.597 119.386 118.837 1.00 78.96  ? 168 VAL   R N   1 
ATOM   938  C CA  . VAL   A 1 224 ? 117.120 119.204 117.475 1.00 77.92  ? 168 VAL   R CA  1 
ATOM   939  C C   . VAL   A 1 224 ? 117.876 118.084 116.763 1.00 76.90  ? 168 VAL   R C   1 
ATOM   940  O O   . VAL   A 1 224 ? 117.863 118.006 115.542 1.00 79.96  ? 168 VAL   R O   1 
ATOM   941  C CB  . VAL   A 1 224 ? 117.210 120.526 116.688 1.00 76.71  ? 168 VAL   R CB  1 
ATOM   942  C CG1 . VAL   A 1 224 ? 118.622 120.749 116.180 1.00 74.42  ? 168 VAL   R CG1 1 
ATOM   943  C CG2 . VAL   A 1 224 ? 116.218 120.531 115.544 1.00 83.92  ? 168 VAL   R CG2 1 
ATOM   944  N N   . THR   A 1 225 ? 118.534 117.205 117.520 1.00 75.99  ? 169 THR   R N   1 
ATOM   945  C CA  . THR   A 1 225 ? 119.330 116.148 116.909 1.00 81.74  ? 169 THR   R CA  1 
ATOM   946  C C   . THR   A 1 225 ? 118.489 115.190 116.076 1.00 84.63  ? 169 THR   R C   1 
ATOM   947  O O   . THR   A 1 225 ? 119.027 114.535 115.175 1.00 84.79  ? 169 THR   R O   1 
ATOM   948  C CB  . THR   A 1 225 ? 120.077 115.367 117.988 1.00 82.56  ? 169 THR   R CB  1 
ATOM   949  O OG1 . THR   A 1 225 ? 120.768 116.280 118.849 1.00 82.65  ? 169 THR   R OG1 1 
ATOM   950  C CG2 . THR   A 1 225 ? 121.077 114.412 117.359 1.00 82.29  ? 169 THR   R CG2 1 
ATOM   951  N N   . LEU   A 1 226 ? 117.190 115.091 116.353 1.00 82.97  ? 170 LEU   R N   1 
ATOM   952  C CA  . LEU   A 1 226 ? 116.340 114.193 115.580 1.00 79.32  ? 170 LEU   R CA  1 
ATOM   953  C C   . LEU   A 1 226 ? 116.364 114.564 114.104 1.00 79.98  ? 170 LEU   R C   1 
ATOM   954  O O   . LEU   A 1 226 ? 116.548 113.703 113.234 1.00 80.25  ? 170 LEU   R O   1 
ATOM   955  C CB  . LEU   A 1 226 ? 114.913 114.234 116.128 1.00 81.35  ? 170 LEU   R CB  1 
ATOM   956  C CG  . LEU   A 1 226 ? 113.967 113.128 115.658 1.00 83.32  ? 170 LEU   R CG  1 
ATOM   957  C CD1 . LEU   A 1 226 ? 114.365 111.788 116.254 1.00 81.37  ? 170 LEU   R CD1 1 
ATOM   958  C CD2 . LEU   A 1 226 ? 112.529 113.467 116.016 1.00 82.56  ? 170 LEU   R CD2 1 
ATOM   959  N N   . THR   A 1 227 ? 116.202 115.853 113.801 1.00 72.40  ? 171 THR   R N   1 
ATOM   960  C CA  . THR   A 1 227 ? 116.181 116.274 112.405 1.00 74.14  ? 171 THR   R CA  1 
ATOM   961  C C   . THR   A 1 227 ? 117.548 116.119 111.757 1.00 78.16  ? 171 THR   R C   1 
ATOM   962  O O   . THR   A 1 227 ? 117.634 115.807 110.567 1.00 80.10  ? 171 THR   R O   1 
ATOM   963  C CB  . THR   A 1 227 ? 115.705 117.720 112.285 1.00 75.06  ? 171 THR   R CB  1 
ATOM   964  O OG1 . THR   A 1 227 ? 116.782 118.607 112.596 1.00 80.54  ? 171 THR   R OG1 1 
ATOM   965  C CG2 . THR   A 1 227 ? 114.536 117.991 113.221 1.00 78.72  ? 171 THR   R CG2 1 
ATOM   966  N N   . CYS   A 1 228 ? 118.628 116.336 112.510 1.00 78.57  ? 172 CYS   R N   1 
ATOM   967  C CA  . CYS   A 1 228 ? 119.961 116.130 111.951 1.00 74.46  ? 172 CYS   R CA  1 
ATOM   968  C C   . CYS   A 1 228 ? 120.176 114.671 111.572 1.00 76.67  ? 172 CYS   R C   1 
ATOM   969  O O   . CYS   A 1 228 ? 120.699 114.372 110.489 1.00 81.58  ? 172 CYS   R O   1 
ATOM   970  C CB  . CYS   A 1 228 ? 121.020 116.586 112.949 1.00 70.87  ? 172 CYS   R CB  1 
ATOM   971  S SG  . CYS   A 1 228 ? 120.891 118.326 113.392 1.00 84.45  ? 172 CYS   R SG  1 
ATOM   972  N N   . LEU   A 1 229 ? 119.777 113.748 112.448 1.00 83.44  ? 173 LEU   R N   1 
ATOM   973  C CA  . LEU   A 1 229 ? 119.892 112.334 112.111 1.00 85.90  ? 173 LEU   R CA  1 
ATOM   974  C C   . LEU   A 1 229 ? 119.018 111.985 110.915 1.00 82.74  ? 173 LEU   R C   1 
ATOM   975  O O   . LEU   A 1 229 ? 119.429 111.207 110.047 1.00 84.25  ? 173 LEU   R O   1 
ATOM   976  C CB  . LEU   A 1 229 ? 119.523 111.470 113.317 1.00 85.84  ? 173 LEU   R CB  1 
ATOM   977  C CG  . LEU   A 1 229 ? 120.532 111.400 114.469 1.00 89.37  ? 173 LEU   R CG  1 
ATOM   978  C CD1 . LEU   A 1 229 ? 120.190 110.240 115.390 1.00 88.87  ? 173 LEU   R CD1 1 
ATOM   979  C CD2 . LEU   A 1 229 ? 121.968 111.278 113.972 1.00 84.65  ? 173 LEU   R CD2 1 
ATOM   980  N N   . ALA   A 1 230 ? 117.809 112.545 110.850 1.00 69.39  ? 174 ALA   R N   1 
ATOM   981  C CA  . ALA   A 1 230 ? 116.948 112.296 109.699 1.00 72.25  ? 174 ALA   R CA  1 
ATOM   982  C C   . ALA   A 1 230 ? 117.610 112.773 108.414 1.00 71.00  ? 174 ALA   R C   1 
ATOM   983  O O   . ALA   A 1 230 ? 117.597 112.075 107.394 1.00 76.78  ? 174 ALA   R O   1 
ATOM   984  C CB  . ALA   A 1 230 ? 115.601 112.989 109.893 1.00 70.93  ? 174 ALA   R CB  1 
ATOM   985  N N   . VAL   A 1 231 ? 118.203 113.966 108.450 1.00 66.93  ? 175 VAL   R N   1 
ATOM   986  C CA  . VAL   A 1 231 ? 118.861 114.521 107.270 1.00 69.11  ? 175 VAL   R CA  1 
ATOM   987  C C   . VAL   A 1 231 ? 119.992 113.607 106.822 1.00 75.25  ? 175 VAL   R C   1 
ATOM   988  O O   . VAL   A 1 231 ? 120.120 113.274 105.639 1.00 78.60  ? 175 VAL   R O   1 
ATOM   989  C CB  . VAL   A 1 231 ? 119.379 115.939 107.560 1.00 59.05  ? 175 VAL   R CB  1 
ATOM   990  C CG1 . VAL   A 1 231 ? 120.328 116.388 106.466 1.00 64.81  ? 175 VAL   R CG1 1 
ATOM   991  C CG2 . VAL   A 1 231 ? 118.223 116.908 107.693 1.00 63.32  ? 175 VAL   R CG2 1 
ATOM   992  N N   . TRP   A 1 232 ? 120.838 113.195 107.766 1.00 75.39  ? 176 TRP   R N   1 
ATOM   993  C CA  . TRP   A 1 232 ? 121.982 112.369 107.393 1.00 74.24  ? 176 TRP   R CA  1 
ATOM   994  C C   . TRP   A 1 232 ? 121.543 111.008 106.865 1.00 77.33  ? 176 TRP   R C   1 
ATOM   995  O O   . TRP   A 1 232 ? 122.115 110.504 105.887 1.00 81.22  ? 176 TRP   R O   1 
ATOM   996  C CB  . TRP   A 1 232 ? 122.920 112.214 108.585 1.00 72.43  ? 176 TRP   R CB  1 
ATOM   997  C CG  . TRP   A 1 232 ? 123.778 113.421 108.809 1.00 70.27  ? 176 TRP   R CG  1 
ATOM   998  C CD1 . TRP   A 1 232 ? 123.727 114.275 109.869 1.00 75.53  ? 176 TRP   R CD1 1 
ATOM   999  C CD2 . TRP   A 1 232 ? 124.811 113.912 107.949 1.00 71.65  ? 176 TRP   R CD2 1 
ATOM   1000 N NE1 . TRP   A 1 232 ? 124.664 115.266 109.725 1.00 73.94  ? 176 TRP   R NE1 1 
ATOM   1001 C CE2 . TRP   A 1 232 ? 125.343 115.066 108.554 1.00 74.05  ? 176 TRP   R CE2 1 
ATOM   1002 C CE3 . TRP   A 1 232 ? 125.337 113.489 106.728 1.00 74.45  ? 176 TRP   R CE3 1 
ATOM   1003 C CZ2 . TRP   A 1 232 ? 126.375 115.799 107.981 1.00 75.11  ? 176 TRP   R CZ2 1 
ATOM   1004 C CZ3 . TRP   A 1 232 ? 126.361 114.218 106.160 1.00 74.28  ? 176 TRP   R CZ3 1 
ATOM   1005 C CH2 . TRP   A 1 232 ? 126.870 115.360 106.786 1.00 73.48  ? 176 TRP   R CH2 1 
ATOM   1006 N N   . GLY   A 1 233 ? 120.532 110.398 107.484 1.00 79.65  ? 177 GLY   R N   1 
ATOM   1007 C CA  . GLY   A 1 233 ? 120.035 109.129 106.978 1.00 79.46  ? 177 GLY   R CA  1 
ATOM   1008 C C   . GLY   A 1 233 ? 119.464 109.257 105.579 1.00 80.36  ? 177 GLY   R C   1 
ATOM   1009 O O   . GLY   A 1 233 ? 119.706 108.411 104.713 1.00 88.30  ? 177 GLY   R O   1 
ATOM   1010 N N   . LEU   A 1 234 ? 118.701 110.322 105.337 1.00 77.68  ? 178 LEU   R N   1 
ATOM   1011 C CA  . LEU   A 1 234 ? 118.142 110.531 104.009 1.00 79.89  ? 178 LEU   R CA  1 
ATOM   1012 C C   . LEU   A 1 234 ? 119.242 110.756 102.982 1.00 86.03  ? 178 LEU   R C   1 
ATOM   1013 O O   . LEU   A 1 234 ? 119.142 110.277 101.846 1.00 88.41  ? 178 LEU   R O   1 
ATOM   1014 C CB  . LEU   A 1 234 ? 117.175 111.713 104.037 1.00 79.18  ? 178 LEU   R CB  1 
ATOM   1015 C CG  . LEU   A 1 234 ? 115.880 111.546 103.244 1.00 84.07  ? 178 LEU   R CG  1 
ATOM   1016 C CD1 . LEU   A 1 234 ? 115.004 110.484 103.881 1.00 86.04  ? 178 LEU   R CD1 1 
ATOM   1017 C CD2 . LEU   A 1 234 ? 115.134 112.862 103.161 1.00 81.89  ? 178 LEU   R CD2 1 
ATOM   1018 N N   . CYS   A 1 235 ? 120.300 111.476 103.360 1.00 85.79  ? 179 CYS   R N   1 
ATOM   1019 C CA  . CYS   A 1 235 ? 121.421 111.674 102.446 1.00 82.93  ? 179 CYS   R CA  1 
ATOM   1020 C C   . CYS   A 1 235 ? 122.100 110.354 102.111 1.00 82.30  ? 179 CYS   R C   1 
ATOM   1021 O O   . CYS   A 1 235 ? 122.457 110.111 100.954 1.00 86.41  ? 179 CYS   R O   1 
ATOM   1022 C CB  . CYS   A 1 235 ? 122.420 112.651 103.055 1.00 85.36  ? 179 CYS   R CB  1 
ATOM   1023 S SG  . CYS   A 1 235 ? 121.711 114.258 103.436 1.00 97.85  ? 179 CYS   R SG  1 
ATOM   1024 N N   . LEU   A 1 236 ? 122.296 109.490 103.109 1.00 83.97  ? 180 LEU   R N   1 
ATOM   1025 C CA  . LEU   A 1 236 ? 122.859 108.170 102.833 1.00 85.57  ? 180 LEU   R CA  1 
ATOM   1026 C C   . LEU   A 1 236 ? 121.962 107.388 101.881 1.00 83.98  ? 180 LEU   R C   1 
ATOM   1027 O O   . LEU   A 1 236 ? 122.440 106.723 100.950 1.00 84.38  ? 180 LEU   R O   1 
ATOM   1028 C CB  . LEU   A 1 236 ? 123.054 107.398 104.137 1.00 82.15  ? 180 LEU   R CB  1 
ATOM   1029 C CG  . LEU   A 1 236 ? 124.459 107.396 104.737 1.00 85.78  ? 180 LEU   R CG  1 
ATOM   1030 C CD1 . LEU   A 1 236 ? 124.430 106.762 106.115 1.00 87.45  ? 180 LEU   R CD1 1 
ATOM   1031 C CD2 . LEU   A 1 236 ? 125.437 106.656 103.834 1.00 84.52  ? 180 LEU   R CD2 1 
ATOM   1032 N N   . LEU   A 1 237 ? 120.651 107.454 102.107 1.00 89.26  ? 181 LEU   R N   1 
ATOM   1033 C CA  . LEU   A 1 237 ? 119.713 106.750 101.242 1.00 89.96  ? 181 LEU   R CA  1 
ATOM   1034 C C   . LEU   A 1 237 ? 119.829 107.244 99.804  1.00 92.42  ? 181 LEU   R C   1 
ATOM   1035 O O   . LEU   A 1 237 ? 119.828 106.448 98.859  1.00 90.92  ? 181 LEU   R O   1 
ATOM   1036 C CB  . LEU   A 1 237 ? 118.291 106.935 101.772 1.00 93.30  ? 181 LEU   R CB  1 
ATOM   1037 C CG  . LEU   A 1 237 ? 117.236 105.925 101.319 1.00 97.54  ? 181 LEU   R CG  1 
ATOM   1038 C CD1 . LEU   A 1 237 ? 116.435 105.432 102.511 1.00 94.62  ? 181 LEU   R CD1 1 
ATOM   1039 C CD2 . LEU   A 1 237 ? 116.315 106.540 100.277 1.00 92.83  ? 181 LEU   R CD2 1 
ATOM   1040 N N   . PHE   A 1 238 ? 119.937 108.562 99.621  1.00 91.68  ? 182 PHE   R N   1 
ATOM   1041 C CA  . PHE   A 1 238 ? 120.089 109.119 98.280  1.00 90.08  ? 182 PHE   R CA  1 
ATOM   1042 C C   . PHE   A 1 238 ? 121.431 108.772 97.650  1.00 91.93  ? 182 PHE   R C   1 
ATOM   1043 O O   . PHE   A 1 238 ? 121.508 108.637 96.425  1.00 86.25  ? 182 PHE   R O   1 
ATOM   1044 C CB  . PHE   A 1 238 ? 119.928 110.640 98.309  1.00 86.35  ? 182 PHE   R CB  1 
ATOM   1045 C CG  . PHE   A 1 238 ? 118.562 111.100 98.722  1.00 88.30  ? 182 PHE   R CG  1 
ATOM   1046 C CD1 . PHE   A 1 238 ? 117.432 110.611 98.092  1.00 88.35  ? 182 PHE   R CD1 1 
ATOM   1047 C CD2 . PHE   A 1 238 ? 118.409 112.030 99.734  1.00 88.31  ? 182 PHE   R CD2 1 
ATOM   1048 C CE1 . PHE   A 1 238 ? 116.174 111.035 98.472  1.00 90.84  ? 182 PHE   R CE1 1 
ATOM   1049 C CE2 . PHE   A 1 238 ? 117.157 112.457 100.118 1.00 88.44  ? 182 PHE   R CE2 1 
ATOM   1050 C CZ  . PHE   A 1 238 ? 116.037 111.960 99.486  1.00 92.21  ? 182 PHE   R CZ  1 
ATOM   1051 N N   . ALA   A 1 239 ? 122.491 108.651 98.446  1.00 100.83 ? 183 ALA   R N   1 
ATOM   1052 C CA  . ALA   A 1 239 ? 123.815 108.362 97.914  1.00 95.34  ? 183 ALA   R CA  1 
ATOM   1053 C C   . ALA   A 1 239 ? 124.040 106.885 97.629  1.00 94.88  ? 183 ALA   R C   1 
ATOM   1054 O O   . ALA   A 1 239 ? 125.010 106.549 96.942  1.00 95.58  ? 183 ALA   R O   1 
ATOM   1055 C CB  . ALA   A 1 239 ? 124.893 108.854 98.883  1.00 89.88  ? 183 ALA   R CB  1 
ATOM   1056 N N   . LEU   A 1 240 ? 123.189 106.004 98.152  1.00 98.40  ? 184 LEU   R N   1 
ATOM   1057 C CA  . LEU   A 1 240 ? 123.306 104.577 97.850  1.00 98.33  ? 184 LEU   R CA  1 
ATOM   1058 C C   . LEU   A 1 240 ? 123.697 104.272 96.406  1.00 98.95  ? 184 LEU   R C   1 
ATOM   1059 O O   . LEU   A 1 240 ? 124.622 103.465 96.203  1.00 99.50  ? 184 LEU   R O   1 
ATOM   1060 C CB  . LEU   A 1 240 ? 121.980 103.874 98.170  1.00 92.89  ? 184 LEU   R CB  1 
ATOM   1061 C CG  . LEU   A 1 240 ? 121.872 103.141 99.506  1.00 97.34  ? 184 LEU   R CG  1 
ATOM   1062 C CD1 . LEU   A 1 240 ? 120.510 102.483 99.619  1.00 96.36  ? 184 LEU   R CD1 1 
ATOM   1063 C CD2 . LEU   A 1 240 ? 122.978 102.111 99.663  1.00 95.21  ? 184 LEU   R CD2 1 
ATOM   1064 N N   . PRO   A 1 241 ? 123.053 104.841 95.383  1.00 99.49  ? 185 PRO   R N   1 
ATOM   1065 C CA  . PRO   A 1 241 ? 123.443 104.490 94.008  1.00 94.54  ? 185 PRO   R CA  1 
ATOM   1066 C C   . PRO   A 1 241 ? 124.905 104.756 93.711  1.00 98.17  ? 185 PRO   R C   1 
ATOM   1067 O O   . PRO   A 1 241 ? 125.508 104.035 92.909  1.00 99.50  ? 185 PRO   R O   1 
ATOM   1068 C CB  . PRO   A 1 241 ? 122.515 105.362 93.149  1.00 97.52  ? 185 PRO   R CB  1 
ATOM   1069 C CG  . PRO   A 1 241 ? 121.974 106.399 94.081  1.00 103.59 ? 185 PRO   R CG  1 
ATOM   1070 C CD  . PRO   A 1 241 ? 121.875 105.717 95.396  1.00 100.57 ? 185 PRO   R CD  1 
ATOM   1071 N N   . ASP   A 1 242 ? 125.495 105.783 94.322  1.00 101.50 ? 186 ASP   R N   1 
ATOM   1072 C CA  . ASP   A 1 242 ? 126.927 106.005 94.157  1.00 97.73  ? 186 ASP   R CA  1 
ATOM   1073 C C   . ASP   A 1 242 ? 127.721 104.836 94.717  1.00 99.20  ? 186 ASP   R C   1 
ATOM   1074 O O   . ASP   A 1 242 ? 128.665 104.350 94.085  1.00 100.44 ? 186 ASP   R O   1 
ATOM   1075 C CB  . ASP   A 1 242 ? 127.338 107.304 94.840  1.00 98.13  ? 186 ASP   R CB  1 
ATOM   1076 C CG  . ASP   A 1 242 ? 126.521 108.480 94.376  1.00 105.10 ? 186 ASP   R CG  1 
ATOM   1077 O OD1 . ASP   A 1 242 ? 125.720 108.315 93.435  1.00 107.36 ? 186 ASP   R OD1 1 
ATOM   1078 O OD2 . ASP   A 1 242 ? 126.677 109.568 94.957  1.00 107.74 ? 186 ASP   R OD2 1 
ATOM   1079 N N   . PHE   A 1 243 ? 127.348 104.368 95.909  1.00 92.02  ? 187 PHE   R N   1 
ATOM   1080 C CA  . PHE   A 1 243 ? 127.990 103.185 96.465  1.00 91.03  ? 187 PHE   R CA  1 
ATOM   1081 C C   . PHE   A 1 243 ? 127.863 102.005 95.515  1.00 93.84  ? 187 PHE   R C   1 
ATOM   1082 O O   . PHE   A 1 243 ? 128.774 101.177 95.412  1.00 96.69  ? 187 PHE   R O   1 
ATOM   1083 C CB  . PHE   A 1 243 ? 127.370 102.834 97.819  1.00 88.31  ? 187 PHE   R CB  1 
ATOM   1084 C CG  . PHE   A 1 243 ? 127.933 103.613 98.973  1.00 88.04  ? 187 PHE   R CG  1 
ATOM   1085 C CD1 . PHE   A 1 243 ? 129.295 103.647 99.209  1.00 88.58  ? 187 PHE   R CD1 1 
ATOM   1086 C CD2 . PHE   A 1 243 ? 127.094 104.300 99.830  1.00 89.82  ? 187 PHE   R CD2 1 
ATOM   1087 C CE1 . PHE   A 1 243 ? 129.807 104.358 100.271 1.00 93.03  ? 187 PHE   R CE1 1 
ATOM   1088 C CE2 . PHE   A 1 243 ? 127.601 105.012 100.894 1.00 91.59  ? 187 PHE   R CE2 1 
ATOM   1089 C CZ  . PHE   A 1 243 ? 128.959 105.041 101.115 1.00 93.03  ? 187 PHE   R CZ  1 
ATOM   1090 N N   . ILE   A 1 244 ? 126.740 101.914 94.808  1.00 95.35  ? 188 ILE   R N   1 
ATOM   1091 C CA  . ILE   A 1 244 ? 126.479 100.739 93.982  1.00 92.61  ? 188 ILE   R CA  1 
ATOM   1092 C C   . ILE   A 1 244 ? 127.286 100.785 92.689  1.00 92.36  ? 188 ILE   R C   1 
ATOM   1093 O O   . ILE   A 1 244 ? 128.032 99.853  92.371  1.00 94.11  ? 188 ILE   R O   1 
ATOM   1094 C CB  . ILE   A 1 244 ? 124.973 100.609 93.695  1.00 93.67  ? 188 ILE   R CB  1 
ATOM   1095 C CG1 . ILE   A 1 244 ? 124.213 100.332 94.994  1.00 96.04  ? 188 ILE   R CG1 1 
ATOM   1096 C CG2 . ILE   A 1 244 ? 124.723 99.505  92.679  1.00 92.61  ? 188 ILE   R CG2 1 
ATOM   1097 C CD1 . ILE   A 1 244 ? 122.717 100.499 94.879  1.00 96.28  ? 188 ILE   R CD1 1 
ATOM   1098 N N   . PHE   A 1 245 ? 127.156 101.873 91.929  1.00 97.52  ? 189 PHE   R N   1 
ATOM   1099 C CA  . PHE   A 1 245 ? 127.536 101.865 90.520  1.00 99.02  ? 189 PHE   R CA  1 
ATOM   1100 C C   . PHE   A 1 245 ? 128.902 102.480 90.238  1.00 98.52  ? 189 PHE   R C   1 
ATOM   1101 O O   . PHE   A 1 245 ? 129.607 102.012 89.337  1.00 94.67  ? 189 PHE   R O   1 
ATOM   1102 C CB  . PHE   A 1 245 ? 126.478 102.605 89.700  1.00 98.48  ? 189 PHE   R CB  1 
ATOM   1103 C CG  . PHE   A 1 245 ? 125.206 101.834 89.524  1.00 96.16  ? 189 PHE   R CG  1 
ATOM   1104 C CD1 . PHE   A 1 245 ? 125.135 100.789 88.623  1.00 92.34  ? 189 PHE   R CD1 1 
ATOM   1105 C CD2 . PHE   A 1 245 ? 124.083 102.151 90.262  1.00 98.85  ? 189 PHE   R CD2 1 
ATOM   1106 C CE1 . PHE   A 1 245 ? 123.968 100.078 88.460  1.00 94.61  ? 189 PHE   R CE1 1 
ATOM   1107 C CE2 . PHE   A 1 245 ? 122.912 101.444 90.101  1.00 97.88  ? 189 PHE   R CE2 1 
ATOM   1108 C CZ  . PHE   A 1 245 ? 122.855 100.406 89.199  1.00 98.12  ? 189 PHE   R CZ  1 
ATOM   1109 N N   . LEU   A 1 246 ? 129.296 103.516 90.974  1.00 96.53  ? 190 LEU   R N   1 
ATOM   1110 C CA  . LEU   A 1 246 ? 130.474 104.291 90.604  1.00 94.95  ? 190 LEU   R CA  1 
ATOM   1111 C C   . LEU   A 1 246 ? 131.697 103.398 90.441  1.00 94.40  ? 190 LEU   R C   1 
ATOM   1112 O O   . LEU   A 1 246 ? 131.982 102.550 91.290  1.00 95.61  ? 190 LEU   R O   1 
ATOM   1113 C CB  . LEU   A 1 246 ? 130.744 105.366 91.657  1.00 89.52  ? 190 LEU   R CB  1 
ATOM   1114 C CG  . LEU   A 1 246 ? 131.321 106.678 91.126  1.00 93.64  ? 190 LEU   R CG  1 
ATOM   1115 C CD1 . LEU   A 1 246 ? 130.406 107.312 90.096  1.00 97.20  ? 190 LEU   R CD1 1 
ATOM   1116 C CD2 . LEU   A 1 246 ? 131.564 107.635 92.267  1.00 93.53  ? 190 LEU   R CD2 1 
ATOM   1117 N N   . SER   A 1 247 ? 132.416 103.598 89.344  1.00 88.73  ? 191 SER   R N   1 
ATOM   1118 C CA  . SER   A 1 247 ? 133.587 102.794 89.013  1.00 89.15  ? 191 SER   R CA  1 
ATOM   1119 C C   . SER   A 1 247 ? 134.583 103.691 88.287  1.00 85.22  ? 191 SER   R C   1 
ATOM   1120 O O   . SER   A 1 247 ? 134.360 104.897 88.146  1.00 91.78  ? 191 SER   R O   1 
ATOM   1121 C CB  . SER   A 1 247 ? 133.176 101.568 88.182  1.00 94.94  ? 191 SER   R CB  1 
ATOM   1122 O OG  . SER   A 1 247 ? 134.301 100.769 87.863  1.00 96.00  ? 191 SER   R OG  1 
ATOM   1123 N N   . ALA   A 1 248 ? 135.683 103.104 87.815  1.00 88.50  ? 192 ALA   R N   1 
ATOM   1124 C CA  . ALA   A 1 248 ? 136.730 103.836 87.105  1.00 93.54  ? 192 ALA   R CA  1 
ATOM   1125 C C   . ALA   A 1 248 ? 136.954 103.169 85.747  1.00 96.16  ? 192 ALA   R C   1 
ATOM   1126 O O   . ALA   A 1 248 ? 137.811 102.298 85.594  1.00 99.89  ? 192 ALA   R O   1 
ATOM   1127 C CB  . ALA   A 1 248 ? 138.017 103.884 87.922  1.00 96.92  ? 192 ALA   R CB  1 
ATOM   1128 N N   . HIS   A 1 249 ? 136.179 103.594 84.756  1.00 118.16 ? 193 HIS   R N   1 
ATOM   1129 C CA  . HIS   A 1 249 ? 136.289 103.024 83.423  1.00 121.58 ? 193 HIS   R CA  1 
ATOM   1130 C C   . HIS   A 1 249 ? 137.584 103.473 82.752  1.00 123.59 ? 193 HIS   R C   1 
ATOM   1131 O O   . HIS   A 1 249 ? 138.108 104.559 83.011  1.00 124.88 ? 193 HIS   R O   1 
ATOM   1132 C CB  . HIS   A 1 249 ? 135.085 103.430 82.574  1.00 122.14 ? 193 HIS   R CB  1 
ATOM   1133 C CG  . HIS   A 1 249 ? 135.232 103.099 81.123  1.00 127.10 ? 193 HIS   R CG  1 
ATOM   1134 N ND1 . HIS   A 1 249 ? 135.442 101.815 80.670  1.00 129.19 ? 193 HIS   R ND1 1 
ATOM   1135 C CD2 . HIS   A 1 249 ? 135.200 103.886 80.022  1.00 127.34 ? 193 HIS   R CD2 1 
ATOM   1136 C CE1 . HIS   A 1 249 ? 135.534 101.825 79.352  1.00 127.84 ? 193 HIS   R CE1 1 
ATOM   1137 N NE2 . HIS   A 1 249 ? 135.389 103.069 78.934  1.00 129.44 ? 193 HIS   R NE2 1 
ATOM   1138 N N   . HIS   A 1 250 ? 138.102 102.616 81.875  1.00 135.81 ? 194 HIS   R N   1 
ATOM   1139 C CA  . HIS   A 1 250 ? 139.302 102.900 81.092  1.00 137.37 ? 194 HIS   R CA  1 
ATOM   1140 C C   . HIS   A 1 250 ? 138.862 103.183 79.658  1.00 138.33 ? 194 HIS   R C   1 
ATOM   1141 O O   . HIS   A 1 250 ? 138.739 102.280 78.831  1.00 136.77 ? 194 HIS   R O   1 
ATOM   1142 C CB  . HIS   A 1 250 ? 140.294 101.732 81.163  1.00 138.05 ? 194 HIS   R CB  1 
ATOM   1143 C CG  . HIS   A 1 250 ? 141.593 101.999 80.469  1.00 139.37 ? 194 HIS   R CG  1 
ATOM   1144 N ND1 . HIS   A 1 250 ? 142.472 102.975 80.885  1.00 138.84 ? 194 HIS   R ND1 1 
ATOM   1145 C CD2 . HIS   A 1 250 ? 142.160 101.419 79.385  1.00 137.76 ? 194 HIS   R CD2 1 
ATOM   1146 C CE1 . HIS   A 1 250 ? 143.526 102.984 80.089  1.00 137.86 ? 194 HIS   R CE1 1 
ATOM   1147 N NE2 . HIS   A 1 250 ? 143.362 102.049 79.170  1.00 137.40 ? 194 HIS   R NE2 1 
ATOM   1148 N N   . ASP   A 1 251 ? 138.629 104.461 79.366  1.00 144.82 ? 195 ASP   R N   1 
ATOM   1149 C CA  . ASP   A 1 251 ? 138.155 104.873 78.051  1.00 143.87 ? 195 ASP   R CA  1 
ATOM   1150 C C   . ASP   A 1 251 ? 139.115 104.427 76.959  1.00 143.99 ? 195 ASP   R C   1 
ATOM   1151 O O   . ASP   A 1 251 ? 140.333 104.573 77.085  1.00 143.46 ? 195 ASP   R O   1 
ATOM   1152 C CB  . ASP   A 1 251 ? 137.990 106.395 78.009  1.00 144.10 ? 195 ASP   R CB  1 
ATOM   1153 C CG  . ASP   A 1 251 ? 136.803 106.877 78.818  1.00 144.84 ? 195 ASP   R CG  1 
ATOM   1154 O OD1 . ASP   A 1 251 ? 135.671 106.433 78.535  1.00 144.28 ? 195 ASP   R OD1 1 
ATOM   1155 O OD2 . ASP   A 1 251 ? 137.001 107.701 79.735  1.00 145.14 ? 195 ASP   R OD2 1 
ATOM   1156 N N   . GLU   A 1 252 ? 138.554 103.875 75.884  1.00 147.70 ? 196 GLU   R N   1 
ATOM   1157 C CA  . GLU   A 1 252 ? 139.317 103.509 74.701  1.00 148.46 ? 196 GLU   R CA  1 
ATOM   1158 C C   . GLU   A 1 252 ? 139.328 104.618 73.657  1.00 149.45 ? 196 GLU   R C   1 
ATOM   1159 O O   . GLU   A 1 252 ? 140.015 104.492 72.639  1.00 147.57 ? 196 GLU   R O   1 
ATOM   1160 C CB  . GLU   A 1 252 ? 138.755 102.225 74.089  1.00 147.57 ? 196 GLU   R CB  1 
ATOM   1161 C CG  . GLU   A 1 252 ? 139.818 101.243 73.618  1.00 146.21 ? 196 GLU   R CG  1 
ATOM   1162 C CD  . GLU   A 1 252 ? 140.503 101.688 72.342  1.00 147.52 ? 196 GLU   R CD  1 
ATOM   1163 O OE1 . GLU   A 1 252 ? 141.751 101.697 72.309  1.00 148.54 ? 196 GLU   R OE1 1 
ATOM   1164 O OE2 . GLU   A 1 252 ? 139.794 102.030 71.373  1.00 147.74 ? 196 GLU   R OE2 1 
ATOM   1165 N N   . ARG   A 1 253 ? 138.588 105.701 73.889  1.00 154.45 ? 197 ARG   R N   1 
ATOM   1166 C CA  . ARG   A 1 253 ? 138.543 106.838 72.979  1.00 153.26 ? 197 ARG   R CA  1 
ATOM   1167 C C   . ARG   A 1 253 ? 139.550 107.919 73.345  1.00 153.42 ? 197 ARG   R C   1 
ATOM   1168 O O   . ARG   A 1 253 ? 140.123 108.553 72.453  1.00 151.42 ? 197 ARG   R O   1 
ATOM   1169 C CB  . ARG   A 1 253 ? 137.132 107.438 72.961  1.00 151.88 ? 197 ARG   R CB  1 
ATOM   1170 C CG  . ARG   A 1 253 ? 136.919 108.519 71.910  1.00 151.58 ? 197 ARG   R CG  1 
ATOM   1171 C CD  . ARG   A 1 253 ? 135.608 109.261 72.131  1.00 151.94 ? 197 ARG   R CD  1 
ATOM   1172 N NE  . ARG   A 1 253 ? 135.691 110.217 73.229  1.00 153.76 ? 197 ARG   R NE  1 
ATOM   1173 C CZ  . ARG   A 1 253 ? 134.682 110.973 73.642  1.00 152.55 ? 197 ARG   R CZ  1 
ATOM   1174 N NH1 . ARG   A 1 253 ? 133.489 110.905 73.076  1.00 151.89 ? 197 ARG   R NH1 1 
ATOM   1175 N NH2 . ARG   A 1 253 ? 134.876 111.819 74.650  1.00 151.73 ? 197 ARG   R NH2 1 
ATOM   1176 N N   . LEU   A 1 254 ? 139.779 108.139 74.638  1.00 153.25 ? 198 LEU   R N   1 
ATOM   1177 C CA  . LEU   A 1 254 ? 140.749 109.112 75.115  1.00 151.85 ? 198 LEU   R CA  1 
ATOM   1178 C C   . LEU   A 1 254 ? 141.941 108.465 75.805  1.00 151.42 ? 198 LEU   R C   1 
ATOM   1179 O O   . LEU   A 1 254 ? 142.920 109.158 76.101  1.00 151.91 ? 198 LEU   R O   1 
ATOM   1180 C CB  . LEU   A 1 254 ? 140.077 110.097 76.080  1.00 148.93 ? 198 LEU   R CB  1 
ATOM   1181 C CG  . LEU   A 1 254 ? 138.700 110.617 75.664  1.00 149.00 ? 198 LEU   R CG  1 
ATOM   1182 C CD1 . LEU   A 1 254 ? 138.154 111.568 76.715  1.00 149.85 ? 198 LEU   R CD1 1 
ATOM   1183 C CD2 . LEU   A 1 254 ? 138.766 111.297 74.304  1.00 149.57 ? 198 LEU   R CD2 1 
ATOM   1184 N N   . ASN   A 1 255 ? 141.886 107.161 76.071  1.00 151.80 ? 199 ASN   R N   1 
ATOM   1185 C CA  . ASN   A 1 255 ? 142.939 106.460 76.804  1.00 152.12 ? 199 ASN   R CA  1 
ATOM   1186 C C   . ASN   A 1 255 ? 143.110 107.020 78.212  1.00 152.21 ? 199 ASN   R C   1 
ATOM   1187 O O   . ASN   A 1 255 ? 144.182 106.896 78.812  1.00 151.23 ? 199 ASN   R O   1 
ATOM   1188 C CB  . ASN   A 1 255 ? 144.270 106.513 76.047  1.00 152.25 ? 199 ASN   R CB  1 
ATOM   1189 C CG  . ASN   A 1 255 ? 145.213 105.395 76.445  1.00 151.28 ? 199 ASN   R CG  1 
ATOM   1190 O OD1 . ASN   A 1 255 ? 144.905 104.591 77.325  1.00 151.00 ? 199 ASN   R OD1 1 
ATOM   1191 N ND2 . ASN   A 1 255 ? 146.372 105.339 75.798  1.00 149.88 ? 199 ASN   R ND2 1 
ATOM   1192 N N   . ALA   A 1 256 ? 142.060 107.633 78.748  1.00 140.74 ? 200 ALA   R N   1 
ATOM   1193 C CA  . ALA   A 1 256 ? 142.096 108.224 80.076  1.00 139.31 ? 200 ALA   R CA  1 
ATOM   1194 C C   . ALA   A 1 256 ? 141.444 107.260 81.071  1.00 137.91 ? 200 ALA   R C   1 
ATOM   1195 O O   . ALA   A 1 256 ? 141.056 106.145 80.713  1.00 138.42 ? 200 ALA   R O   1 
ATOM   1196 C CB  . ALA   A 1 256 ? 141.416 109.597 80.048  1.00 134.97 ? 200 ALA   R CB  1 
ATOM   1197 N N   . THR   A 1 257 ? 141.317 107.678 82.328  1.00 119.72 ? 201 THR   R N   1 
ATOM   1198 C CA  . THR   A 1 257 ? 140.722 106.847 83.365  1.00 117.12 ? 201 THR   R CA  1 
ATOM   1199 C C   . THR   A 1 257 ? 140.110 107.732 84.441  1.00 119.21 ? 201 THR   R C   1 
ATOM   1200 O O   . THR   A 1 257 ? 140.832 108.284 85.276  1.00 123.88 ? 201 THR   R O   1 
ATOM   1201 C CB  . THR   A 1 257 ? 141.769 105.915 83.979  1.00 116.43 ? 201 THR   R CB  1 
ATOM   1202 O OG1 . THR   A 1 257 ? 142.375 105.125 82.949  1.00 116.50 ? 201 THR   R OG1 1 
ATOM   1203 C CG2 . THR   A 1 257 ? 141.132 104.997 85.010  1.00 117.69 ? 201 THR   R CG2 1 
ATOM   1204 N N   . HIS   A 1 258 ? 138.788 107.867 84.439  1.00 110.75 ? 202 HIS   R N   1 
ATOM   1205 C CA  . HIS   A 1 258 ? 138.098 108.814 85.298  1.00 111.57 ? 202 HIS   R CA  1 
ATOM   1206 C C   . HIS   A 1 258 ? 137.048 108.110 86.150  1.00 109.81 ? 202 HIS   R C   1 
ATOM   1207 O O   . HIS   A 1 258 ? 136.719 106.941 85.942  1.00 114.42 ? 202 HIS   R O   1 
ATOM   1208 C CB  . HIS   A 1 258 ? 137.452 109.923 84.461  1.00 112.83 ? 202 HIS   R CB  1 
ATOM   1209 C CG  . HIS   A 1 258 ? 138.437 110.742 83.687  1.00 113.30 ? 202 HIS   R CG  1 
ATOM   1210 N ND1 . HIS   A 1 258 ? 139.375 111.547 84.297  1.00 112.28 ? 202 HIS   R ND1 1 
ATOM   1211 C CD2 . HIS   A 1 258 ? 138.639 110.874 82.355  1.00 113.27 ? 202 HIS   R CD2 1 
ATOM   1212 C CE1 . HIS   A 1 258 ? 140.107 112.145 83.375  1.00 111.47 ? 202 HIS   R CE1 1 
ATOM   1213 N NE2 . HIS   A 1 258 ? 139.681 111.753 82.187  1.00 115.93 ? 202 HIS   R NE2 1 
ATOM   1214 N N   . CYS   A 1 259 ? 136.532 108.852 87.127  1.00 101.23 ? 203 CYS   R N   1 
ATOM   1215 C CA  . CYS   A 1 259 ? 135.515 108.366 88.059  1.00 102.52 ? 203 CYS   R CA  1 
ATOM   1216 C C   . CYS   A 1 259 ? 134.145 108.695 87.477  1.00 104.37 ? 203 CYS   R C   1 
ATOM   1217 O O   . CYS   A 1 259 ? 133.657 109.819 87.612  1.00 109.52 ? 203 CYS   R O   1 
ATOM   1218 C CB  . CYS   A 1 259 ? 135.715 109.013 89.425  1.00 104.70 ? 203 CYS   R CB  1 
ATOM   1219 S SG  . CYS   A 1 259 ? 134.941 108.229 90.870  1.00 124.13 ? 203 CYS   R SG  1 
ATOM   1220 N N   . GLN   A 1 260 ? 133.519 107.716 86.825  1.00 101.13 ? 204 GLN   R N   1 
ATOM   1221 C CA  . GLN   A 1 260 ? 132.242 107.917 86.156  1.00 100.54 ? 204 GLN   R CA  1 
ATOM   1222 C C   . GLN   A 1 260 ? 131.286 106.782 86.493  1.00 103.81 ? 204 GLN   R C   1 
ATOM   1223 O O   . GLN   A 1 260 ? 131.700 105.676 86.848  1.00 107.97 ? 204 GLN   R O   1 
ATOM   1224 C CB  . GLN   A 1 260 ? 132.416 108.007 84.634  1.00 101.56 ? 204 GLN   R CB  1 
ATOM   1225 C CG  . GLN   A 1 260 ? 133.072 106.784 84.010  1.00 104.29 ? 204 GLN   R CG  1 
ATOM   1226 C CD  . GLN   A 1 260 ? 132.785 106.661 82.526  1.00 106.02 ? 204 GLN   R CD  1 
ATOM   1227 O OE1 . GLN   A 1 260 ? 131.637 106.496 82.116  1.00 106.65 ? 204 GLN   R OE1 1 
ATOM   1228 N NE2 . GLN   A 1 260 ? 133.831 106.735 81.714  1.00 108.81 ? 204 GLN   R NE2 1 
ATOM   1229 N N   . TYR   A 1 261 ? 129.991 107.071 86.371  1.00 94.21  ? 205 TYR   R N   1 
ATOM   1230 C CA  . TYR   A 1 261 ? 128.952 106.070 86.567  1.00 92.24  ? 205 TYR   R CA  1 
ATOM   1231 C C   . TYR   A 1 261 ? 128.868 105.162 85.348  1.00 93.79  ? 205 TYR   R C   1 
ATOM   1232 O O   . TYR   A 1 261 ? 129.151 105.586 84.224  1.00 97.06  ? 205 TYR   R O   1 
ATOM   1233 C CB  . TYR   A 1 261 ? 127.584 106.720 86.796  1.00 94.02  ? 205 TYR   R CB  1 
ATOM   1234 C CG  . TYR   A 1 261 ? 127.471 107.597 88.023  1.00 93.21  ? 205 TYR   R CG  1 
ATOM   1235 C CD1 . TYR   A 1 261 ? 128.219 108.756 88.150  1.00 94.55  ? 205 TYR   R CD1 1 
ATOM   1236 C CD2 . TYR   A 1 261 ? 126.598 107.270 89.050  1.00 90.55  ? 205 TYR   R CD2 1 
ATOM   1237 C CE1 . TYR   A 1 261 ? 128.108 109.557 89.266  1.00 91.74  ? 205 TYR   R CE1 1 
ATOM   1238 C CE2 . TYR   A 1 261 ? 126.482 108.064 90.169  1.00 89.78  ? 205 TYR   R CE2 1 
ATOM   1239 C CZ  . TYR   A 1 261 ? 127.238 109.206 90.272  1.00 89.87  ? 205 TYR   R CZ  1 
ATOM   1240 O OH  . TYR   A 1 261 ? 127.126 110.002 91.386  1.00 89.86  ? 205 TYR   R OH  1 
ATOM   1241 N N   . ASN   A 1 262 ? 128.475 103.910 85.577  1.00 100.83 ? 206 ASN   R N   1 
ATOM   1242 C CA  . ASN   A 1 262 ? 128.121 102.993 84.503  1.00 102.52 ? 206 ASN   R CA  1 
ATOM   1243 C C   . ASN   A 1 262 ? 126.623 102.722 84.464  1.00 102.80 ? 206 ASN   R C   1 
ATOM   1244 O O   . ASN   A 1 262 ? 126.200 101.667 83.980  1.00 100.51 ? 206 ASN   R O   1 
ATOM   1245 C CB  . ASN   A 1 262 ? 128.902 101.683 84.639  1.00 105.91 ? 206 ASN   R CB  1 
ATOM   1246 C CG  . ASN   A 1 262 ? 128.489 100.878 85.849  1.00 108.41 ? 206 ASN   R CG  1 
ATOM   1247 O OD1 . ASN   A 1 262 ? 128.634 101.327 86.984  1.00 109.62 ? 206 ASN   R OD1 1 
ATOM   1248 N ND2 . ASN   A 1 262 ? 127.979 99.675  85.613  1.00 106.76 ? 206 ASN   R ND2 1 
ATOM   1249 N N   . PHE   A 1 263 ? 125.816 103.653 84.969  1.00 112.25 ? 207 PHE   R N   1 
ATOM   1250 C CA  . PHE   A 1 263 ? 124.361 103.584 84.933  1.00 113.96 ? 207 PHE   R CA  1 
ATOM   1251 C C   . PHE   A 1 263 ? 123.859 103.325 83.519  1.00 115.42 ? 207 PHE   R C   1 
ATOM   1252 O O   . PHE   A 1 263 ? 124.580 103.582 82.547  1.00 114.89 ? 207 PHE   R O   1 
ATOM   1253 C CB  . PHE   A 1 263 ? 123.754 104.897 85.434  1.00 111.71 ? 207 PHE   R CB  1 
ATOM   1254 C CG  . PHE   A 1 263 ? 123.266 104.849 86.848  1.00 110.25 ? 207 PHE   R CG  1 
ATOM   1255 C CD1 . PHE   A 1 263 ? 122.117 104.153 87.177  1.00 109.95 ? 207 PHE   R CD1 1 
ATOM   1256 C CD2 . PHE   A 1 263 ? 123.941 105.526 87.845  1.00 111.58 ? 207 PHE   R CD2 1 
ATOM   1257 C CE1 . PHE   A 1 263 ? 121.663 104.119 88.478  1.00 111.44 ? 207 PHE   R CE1 1 
ATOM   1258 C CE2 . PHE   A 1 263 ? 123.490 105.496 89.146  1.00 113.21 ? 207 PHE   R CE2 1 
ATOM   1259 C CZ  . PHE   A 1 263 ? 122.350 104.794 89.462  1.00 113.56 ? 207 PHE   R CZ  1 
ATOM   1260 N N   . PRO   A 1 264 ? 122.641 102.814 83.360  1.00 118.86 ? 208 PRO   R N   1 
ATOM   1261 C CA  . PRO   A 1 264 ? 121.945 102.956 82.077  1.00 117.39 ? 208 PRO   R CA  1 
ATOM   1262 C C   . PRO   A 1 264 ? 121.521 104.403 81.864  1.00 120.17 ? 208 PRO   R C   1 
ATOM   1263 O O   . PRO   A 1 264 ? 121.437 105.203 82.797  1.00 121.08 ? 208 PRO   R O   1 
ATOM   1264 C CB  . PRO   A 1 264 ? 120.735 102.025 82.214  1.00 114.77 ? 208 PRO   R CB  1 
ATOM   1265 C CG  . PRO   A 1 264 ? 121.076 101.109 83.350  1.00 114.20 ? 208 PRO   R CG  1 
ATOM   1266 C CD  . PRO   A 1 264 ? 121.911 101.927 84.278  1.00 116.04 ? 208 PRO   R CD  1 
ATOM   1267 N N   . GLN   A 1 265 ? 121.251 104.737 80.601  1.00 124.30 ? 209 GLN   R N   1 
ATOM   1268 C CA  . GLN   A 1 265 ? 120.920 106.118 80.258  1.00 124.20 ? 209 GLN   R CA  1 
ATOM   1269 C C   . GLN   A 1 265 ? 119.715 106.608 81.053  1.00 122.62 ? 209 GLN   R C   1 
ATOM   1270 O O   . GLN   A 1 265 ? 119.717 107.728 81.587  1.00 120.77 ? 209 GLN   R O   1 
ATOM   1271 C CB  . GLN   A 1 265 ? 120.660 106.228 78.755  1.00 124.74 ? 209 GLN   R CB  1 
ATOM   1272 C CG  . GLN   A 1 265 ? 121.830 105.774 77.895  1.00 125.73 ? 209 GLN   R CG  1 
ATOM   1273 C CD  . GLN   A 1 265 ? 121.477 105.688 76.424  1.00 126.74 ? 209 GLN   R CD  1 
ATOM   1274 O OE1 . GLN   A 1 265 ? 120.311 105.536 76.061  1.00 128.32 ? 209 GLN   R OE1 1 
ATOM   1275 N NE2 . GLN   A 1 265 ? 122.487 105.784 75.568  1.00 124.77 ? 209 GLN   R NE2 1 
ATOM   1276 N N   . VAL   A 1 266 ? 118.676 105.777 81.149  1.00 110.30 ? 210 VAL   R N   1 
ATOM   1277 C CA  . VAL   A 1 266 ? 117.516 106.134 81.957  1.00 111.85 ? 210 VAL   R CA  1 
ATOM   1278 C C   . VAL   A 1 266 ? 117.944 106.396 83.389  1.00 111.63 ? 210 VAL   R C   1 
ATOM   1279 O O   . VAL   A 1 266 ? 117.436 107.313 84.043  1.00 109.58 ? 210 VAL   R O   1 
ATOM   1280 C CB  . VAL   A 1 266 ? 116.447 105.025 81.884  1.00 109.67 ? 210 VAL   R CB  1 
ATOM   1281 C CG1 . VAL   A 1 266 ? 115.254 105.377 82.761  1.00 111.60 ? 210 VAL   R CG1 1 
ATOM   1282 C CG2 . VAL   A 1 266 ? 116.013 104.793 80.447  1.00 107.73 ? 210 VAL   R CG2 1 
ATOM   1283 N N   . GLY   A 1 267 ? 118.880 105.597 83.901  1.00 116.17 ? 211 GLY   R N   1 
ATOM   1284 C CA  . GLY   A 1 267 ? 119.382 105.833 85.242  1.00 115.10 ? 211 GLY   R CA  1 
ATOM   1285 C C   . GLY   A 1 267 ? 120.073 107.175 85.375  1.00 113.96 ? 211 GLY   R C   1 
ATOM   1286 O O   . GLY   A 1 267 ? 119.901 107.874 86.377  1.00 115.79 ? 211 GLY   R O   1 
ATOM   1287 N N   . ARG   A 1 268 ? 120.875 107.550 84.377  1.00 114.35 ? 212 ARG   R N   1 
ATOM   1288 C CA  . ARG   A 1 268 ? 121.545 108.845 84.425  1.00 116.88 ? 212 ARG   R CA  1 
ATOM   1289 C C   . ARG   A 1 268 ? 120.525 109.974 84.471  1.00 116.90 ? 212 ARG   R C   1 
ATOM   1290 O O   . ARG   A 1 268 ? 120.635 110.901 85.286  1.00 117.29 ? 212 ARG   R O   1 
ATOM   1291 C CB  . ARG   A 1 268 ? 122.468 109.005 83.217  1.00 117.71 ? 212 ARG   R CB  1 
ATOM   1292 C CG  . ARG   A 1 268 ? 123.700 109.856 83.491  1.00 118.42 ? 212 ARG   R CG  1 
ATOM   1293 C CD  . ARG   A 1 268 ? 124.579 110.017 82.256  1.00 119.35 ? 212 ARG   R CD  1 
ATOM   1294 N NE  . ARG   A 1 268 ? 124.641 108.801 81.451  1.00 121.71 ? 212 ARG   R NE  1 
ATOM   1295 C CZ  . ARG   A 1 268 ? 124.653 108.769 80.124  1.00 119.87 ? 212 ARG   R CZ  1 
ATOM   1296 N NH1 . ARG   A 1 268 ? 124.640 109.877 79.400  1.00 117.95 ? 212 ARG   R NH1 1 
ATOM   1297 N NH2 . ARG   A 1 268 ? 124.683 107.592 79.505  1.00 119.53 ? 212 ARG   R NH2 1 
ATOM   1298 N N   . THR   A 1 269 ? 119.508 109.904 83.610  1.00 109.83 ? 213 THR   R N   1 
ATOM   1299 C CA  . THR   A 1 269 ? 118.480 110.939 83.620  1.00 108.13 ? 213 THR   R CA  1 
ATOM   1300 C C   . THR   A 1 269 ? 117.737 110.970 84.949  1.00 108.05 ? 213 THR   R C   1 
ATOM   1301 O O   . THR   A 1 269 ? 117.443 112.051 85.471  1.00 107.57 ? 213 THR   R O   1 
ATOM   1302 C CB  . THR   A 1 269 ? 117.502 110.721 82.467  1.00 106.29 ? 213 THR   R CB  1 
ATOM   1303 O OG1 . THR   A 1 269 ? 118.187 110.886 81.219  1.00 109.09 ? 213 THR   R OG1 1 
ATOM   1304 C CG2 . THR   A 1 269 ? 116.358 111.712 82.542  1.00 109.38 ? 213 THR   R CG2 1 
ATOM   1305 N N   . ALA   A 1 270 ? 117.425 109.801 85.510  1.00 105.94 ? 214 ALA   R N   1 
ATOM   1306 C CA  . ALA   A 1 270 ? 116.704 109.756 86.777  1.00 105.44 ? 214 ALA   R CA  1 
ATOM   1307 C C   . ALA   A 1 270 ? 117.531 110.367 87.899  1.00 104.48 ? 214 ALA   R C   1 
ATOM   1308 O O   . ALA   A 1 270 ? 117.006 111.107 88.739  1.00 106.76 ? 214 ALA   R O   1 
ATOM   1309 C CB  . ALA   A 1 270 ? 116.327 108.313 87.112  1.00 108.40 ? 214 ALA   R CB  1 
ATOM   1310 N N   . LEU   A 1 271 ? 118.826 110.053 87.942  1.00 99.98  ? 215 LEU   R N   1 
ATOM   1311 C CA  . LEU   A 1 271 ? 119.683 110.647 88.960  1.00 102.31 ? 215 LEU   R CA  1 
ATOM   1312 C C   . LEU   A 1 271 ? 119.779 112.154 88.788  1.00 103.80 ? 215 LEU   R C   1 
ATOM   1313 O O   . LEU   A 1 271 ? 119.787 112.890 89.780  1.00 100.55 ? 215 LEU   R O   1 
ATOM   1314 C CB  . LEU   A 1 271 ? 121.075 110.019 88.922  1.00 102.63 ? 215 LEU   R CB  1 
ATOM   1315 C CG  . LEU   A 1 271 ? 121.325 108.933 89.970  1.00 103.04 ? 215 LEU   R CG  1 
ATOM   1316 C CD1 . LEU   A 1 271 ? 120.519 107.683 89.659  1.00 102.16 ? 215 LEU   R CD1 1 
ATOM   1317 C CD2 . LEU   A 1 271 ? 122.806 108.614 90.064  1.00 100.70 ? 215 LEU   R CD2 1 
ATOM   1318 N N   . ARG   A 1 272 ? 119.853 112.635 87.545  1.00 111.97 ? 216 ARG   R N   1 
ATOM   1319 C CA  . ARG   A 1 272 ? 119.886 114.077 87.322  1.00 110.27 ? 216 ARG   R CA  1 
ATOM   1320 C C   . ARG   A 1 272 ? 118.602 114.730 87.822  1.00 107.72 ? 216 ARG   R C   1 
ATOM   1321 O O   . ARG   A 1 272 ? 118.635 115.788 88.465  1.00 107.33 ? 216 ARG   R O   1 
ATOM   1322 C CB  . ARG   A 1 272 ? 120.094 114.372 85.837  1.00 107.10 ? 216 ARG   R CB  1 
ATOM   1323 C CG  . ARG   A 1 272 ? 121.440 113.915 85.306  1.00 105.19 ? 216 ARG   R CG  1 
ATOM   1324 C CD  . ARG   A 1 272 ? 122.433 115.053 85.199  1.00 106.25 ? 216 ARG   R CD  1 
ATOM   1325 N NE  . ARG   A 1 272 ? 123.768 114.631 85.604  1.00 110.10 ? 216 ARG   R NE  1 
ATOM   1326 C CZ  . ARG   A 1 272 ? 124.898 115.076 85.070  1.00 112.52 ? 216 ARG   R CZ  1 
ATOM   1327 N NH1 . ARG   A 1 272 ? 124.901 115.978 84.102  1.00 112.45 ? 216 ARG   R NH1 1 
ATOM   1328 N NH2 . ARG   A 1 272 ? 126.056 114.603 85.518  1.00 112.09 ? 216 ARG   R NH2 1 
ATOM   1329 N N   . VAL   A 1 273 ? 117.457 114.106 87.538  1.00 95.32  ? 217 VAL   R N   1 
ATOM   1330 C CA  . VAL   A 1 273 ? 116.181 114.637 87.994  1.00 92.94  ? 217 VAL   R CA  1 
ATOM   1331 C C   . VAL   A 1 273 ? 116.102 114.656 89.511  1.00 96.39  ? 217 VAL   R C   1 
ATOM   1332 O O   . VAL   A 1 273 ? 115.602 115.624 90.090  1.00 98.68  ? 217 VAL   R O   1 
ATOM   1333 C CB  . VAL   A 1 273 ? 115.018 113.823 87.396  1.00 94.76  ? 217 VAL   R CB  1 
ATOM   1334 C CG1 . VAL   A 1 273 ? 113.721 114.114 88.139  1.00 95.14  ? 217 VAL   R CG1 1 
ATOM   1335 C CG2 . VAL   A 1 273 ? 114.869 114.131 85.917  1.00 96.92  ? 217 VAL   R CG2 1 
ATOM   1336 N N   . LEU   A 1 274 ? 116.561 113.595 90.175  1.00 94.02  ? 218 LEU   R N   1 
ATOM   1337 C CA  . LEU   A 1 274 ? 116.571 113.597 91.633  1.00 93.01  ? 218 LEU   R CA  1 
ATOM   1338 C C   . LEU   A 1 274 ? 117.486 114.685 92.175  1.00 93.61  ? 218 LEU   R C   1 
ATOM   1339 O O   . LEU   A 1 274 ? 117.138 115.361 93.148  1.00 94.08  ? 218 LEU   R O   1 
ATOM   1340 C CB  . LEU   A 1 274 ? 117.002 112.231 92.167  1.00 95.15  ? 218 LEU   R CB  1 
ATOM   1341 C CG  . LEU   A 1 274 ? 117.066 112.117 93.693  1.00 94.03  ? 218 LEU   R CG  1 
ATOM   1342 C CD1 . LEU   A 1 274 ? 115.672 111.977 94.274  1.00 92.49  ? 218 LEU   R CD1 1 
ATOM   1343 C CD2 . LEU   A 1 274 ? 117.940 110.950 94.113  1.00 93.51  ? 218 LEU   R CD2 1 
ATOM   1344 N N   . GLN   A 1 275 ? 118.663 114.861 91.574  1.00 96.63  ? 219 GLN   R N   1 
ATOM   1345 C CA  . GLN   A 1 275 ? 119.536 115.959 91.970  1.00 94.63  ? 219 GLN   R CA  1 
ATOM   1346 C C   . GLN   A 1 275 ? 118.786 117.280 91.905  1.00 95.16  ? 219 GLN   R C   1 
ATOM   1347 O O   . GLN   A 1 275 ? 118.747 118.041 92.878  1.00 92.39  ? 219 GLN   R O   1 
ATOM   1348 C CB  . GLN   A 1 275 ? 120.767 116.004 91.064  1.00 98.58  ? 219 GLN   R CB  1 
ATOM   1349 C CG  . GLN   A 1 275 ? 121.696 114.808 91.200  1.00 101.28 ? 219 GLN   R CG  1 
ATOM   1350 C CD  . GLN   A 1 275 ? 123.138 115.202 91.464  1.00 101.78 ? 219 GLN   R CD  1 
ATOM   1351 O OE1 . GLN   A 1 275 ? 123.430 116.342 91.824  1.00 100.50 ? 219 GLN   R OE1 1 
ATOM   1352 N NE2 . GLN   A 1 275 ? 124.050 114.255 91.281  1.00 96.94  ? 219 GLN   R NE2 1 
ATOM   1353 N N   . LEU   A 1 276 ? 118.153 117.550 90.764  1.00 95.02  ? 220 LEU   R N   1 
ATOM   1354 C CA  . LEU   A 1 276 ? 117.449 118.814 90.584  1.00 90.92  ? 220 LEU   R CA  1 
ATOM   1355 C C   . LEU   A 1 276 ? 116.343 118.984 91.619  1.00 91.52  ? 220 LEU   R C   1 
ATOM   1356 O O   . LEU   A 1 276 ? 116.208 120.049 92.231  1.00 89.76  ? 220 LEU   R O   1 
ATOM   1357 C CB  . LEU   A 1 276 ? 116.878 118.885 89.166  1.00 88.63  ? 220 LEU   R CB  1 
ATOM   1358 C CG  . LEU   A 1 276 ? 116.010 120.092 88.812  1.00 88.27  ? 220 LEU   R CG  1 
ATOM   1359 C CD1 . LEU   A 1 276 ? 116.640 121.384 89.292  1.00 92.83  ? 220 LEU   R CD1 1 
ATOM   1360 C CD2 . LEU   A 1 276 ? 115.774 120.140 87.315  1.00 87.83  ? 220 LEU   R CD2 1 
ATOM   1361 N N   . VAL   A 1 277 ? 115.546 117.936 91.834  1.00 95.01  ? 221 VAL   R N   1 
ATOM   1362 C CA  . VAL   A 1 277 ? 114.363 118.068 92.680  1.00 92.09  ? 221 VAL   R CA  1 
ATOM   1363 C C   . VAL   A 1 277 ? 114.747 118.202 94.148  1.00 88.39  ? 221 VAL   R C   1 
ATOM   1364 O O   . VAL   A 1 277 ? 114.243 119.083 94.853  1.00 82.82  ? 221 VAL   R O   1 
ATOM   1365 C CB  . VAL   A 1 277 ? 113.414 116.879 92.458  1.00 88.17  ? 221 VAL   R CB  1 
ATOM   1366 C CG1 . VAL   A 1 277 ? 112.309 116.889 93.498  1.00 85.45  ? 221 VAL   R CG1 1 
ATOM   1367 C CG2 . VAL   A 1 277 ? 112.830 116.923 91.058  1.00 91.97  ? 221 VAL   R CG2 1 
ATOM   1368 N N   . ALA   A 1 278 ? 115.632 117.336 94.638  1.00 88.78  ? 222 ALA   R N   1 
ATOM   1369 C CA  . ALA   A 1 278 ? 115.928 117.277 96.062  1.00 85.81  ? 222 ALA   R CA  1 
ATOM   1370 C C   . ALA   A 1 278 ? 117.024 118.236 96.496  1.00 87.69  ? 222 ALA   R C   1 
ATOM   1371 O O   . ALA   A 1 278 ? 117.048 118.635 97.664  1.00 91.57  ? 222 ALA   R O   1 
ATOM   1372 C CB  . ALA   A 1 278 ? 116.333 115.854 96.459  1.00 90.52  ? 222 ALA   R CB  1 
ATOM   1373 N N   . GLY   A 1 279 ? 117.932 118.612 95.601  1.00 79.94  ? 223 GLY   R N   1 
ATOM   1374 C CA  . GLY   A 1 279 ? 119.019 119.491 95.972  1.00 78.30  ? 223 GLY   R CA  1 
ATOM   1375 C C   . GLY   A 1 279 ? 118.733 120.952 95.703  1.00 80.73  ? 223 GLY   R C   1 
ATOM   1376 O O   . GLY   A 1 279 ? 119.260 121.823 96.400  1.00 82.71  ? 223 GLY   R O   1 
ATOM   1377 N N   . PHE   A 1 280 ? 117.908 121.241 94.697  1.00 83.84  ? 224 PHE   R N   1 
ATOM   1378 C CA  . PHE   A 1 280 ? 117.657 122.625 94.316  1.00 87.08  ? 224 PHE   R CA  1 
ATOM   1379 C C   . PHE   A 1 280 ? 116.211 123.048 94.539  1.00 84.44  ? 224 PHE   R C   1 
ATOM   1380 O O   . PHE   A 1 280 ? 115.951 123.999 95.281  1.00 86.09  ? 224 PHE   R O   1 
ATOM   1381 C CB  . PHE   A 1 280 ? 118.029 122.836 92.849  1.00 86.43  ? 224 PHE   R CB  1 
ATOM   1382 C CG  . PHE   A 1 280 ? 117.915 124.259 92.395  1.00 84.76  ? 224 PHE   R CG  1 
ATOM   1383 C CD1 . PHE   A 1 280 ? 118.701 125.245 92.962  1.00 81.34  ? 224 PHE   R CD1 1 
ATOM   1384 C CD2 . PHE   A 1 280 ? 117.023 124.611 91.401  1.00 81.06  ? 224 PHE   R CD2 1 
ATOM   1385 C CE1 . PHE   A 1 280 ? 118.597 126.554 92.546  1.00 76.91  ? 224 PHE   R CE1 1 
ATOM   1386 C CE2 . PHE   A 1 280 ? 116.917 125.918 90.982  1.00 81.92  ? 224 PHE   R CE2 1 
ATOM   1387 C CZ  . PHE   A 1 280 ? 117.705 126.890 91.555  1.00 80.88  ? 224 PHE   R CZ  1 
ATOM   1388 N N   . LEU   A 1 281 ? 115.259 122.350 93.918  1.00 84.87  ? 225 LEU   R N   1 
ATOM   1389 C CA  . LEU   A 1 281 ? 113.888 122.850 93.914  1.00 83.81  ? 225 LEU   R CA  1 
ATOM   1390 C C   . LEU   A 1 281 ? 113.282 122.837 95.310  1.00 85.71  ? 225 LEU   R C   1 
ATOM   1391 O O   . LEU   A 1 281 ? 112.737 123.847 95.763  1.00 91.68  ? 225 LEU   R O   1 
ATOM   1392 C CB  . LEU   A 1 281 ? 113.024 122.037 92.952  1.00 83.99  ? 225 LEU   R CB  1 
ATOM   1393 C CG  . LEU   A 1 281 ? 113.237 122.316 91.463  1.00 87.21  ? 225 LEU   R CG  1 
ATOM   1394 C CD1 . LEU   A 1 281 ? 112.325 121.436 90.630  1.00 89.99  ? 225 LEU   R CD1 1 
ATOM   1395 C CD2 . LEU   A 1 281 ? 113.010 123.780 91.134  1.00 86.28  ? 225 LEU   R CD2 1 
ATOM   1396 N N   . LEU   A 1 282 ? 113.356 121.703 96.008  1.00 80.27  ? 226 LEU   R N   1 
ATOM   1397 C CA  . LEU   A 1 282 ? 112.742 121.642 97.334  1.00 82.11  ? 226 LEU   R CA  1 
ATOM   1398 C C   . LEU   A 1 282 ? 113.436 122.576 98.317  1.00 76.70  ? 226 LEU   R C   1 
ATOM   1399 O O   . LEU   A 1 282 ? 112.740 123.346 99.006  1.00 81.51  ? 226 LEU   R O   1 
ATOM   1400 C CB  . LEU   A 1 282 ? 112.716 120.192 97.824  1.00 84.09  ? 226 LEU   R CB  1 
ATOM   1401 C CG  . LEU   A 1 282 ? 112.170 119.947 99.230  1.00 86.09  ? 226 LEU   R CG  1 
ATOM   1402 C CD1 . LEU   A 1 282 ? 111.324 118.686 99.254  1.00 83.82  ? 226 LEU   R CD1 1 
ATOM   1403 C CD2 . LEU   A 1 282 ? 113.304 119.843 100.236 1.00 86.20  ? 226 LEU   R CD2 1 
ATOM   1404 N N   . PRO   A 1 283 ? 114.766 122.566 98.450  1.00 63.32  ? 227 PRO   R N   1 
ATOM   1405 C CA  . PRO   A 1 283 ? 115.399 123.554 99.336  1.00 71.97  ? 227 PRO   R CA  1 
ATOM   1406 C C   . PRO   A 1 283 ? 115.082 124.982 98.943  1.00 73.67  ? 227 PRO   R C   1 
ATOM   1407 O O   . PRO   A 1 283 ? 114.839 125.822 99.816  1.00 72.05  ? 227 PRO   R O   1 
ATOM   1408 C CB  . PRO   A 1 283 ? 116.892 123.236 99.192  1.00 75.65  ? 227 PRO   R CB  1 
ATOM   1409 C CG  . PRO   A 1 283 ? 116.930 121.816 98.808  1.00 79.44  ? 227 PRO   R CG  1 
ATOM   1410 C CD  . PRO   A 1 283 ? 115.758 121.630 97.898  1.00 74.54  ? 227 PRO   R CD  1 
ATOM   1411 N N   . LEU   A 1 284 ? 115.070 125.282 97.644  1.00 72.91  ? 228 LEU   R N   1 
ATOM   1412 C CA  . LEU   A 1 284 ? 114.806 126.651 97.220  1.00 70.52  ? 228 LEU   R CA  1 
ATOM   1413 C C   . LEU   A 1 284 ? 113.397 127.078 97.594  1.00 71.74  ? 228 LEU   R C   1 
ATOM   1414 O O   . LEU   A 1 284 ? 113.188 128.201 98.056  1.00 76.26  ? 228 LEU   R O   1 
ATOM   1415 C CB  . LEU   A 1 284 ? 115.021 126.796 95.717  1.00 70.95  ? 228 LEU   R CB  1 
ATOM   1416 C CG  . LEU   A 1 284 ? 114.951 128.236 95.209  1.00 71.15  ? 228 LEU   R CG  1 
ATOM   1417 C CD1 . LEU   A 1 284 ? 116.033 129.085 95.850  1.00 67.39  ? 228 LEU   R CD1 1 
ATOM   1418 C CD2 . LEU   A 1 284 ? 115.067 128.278 93.698  1.00 72.19  ? 228 LEU   R CD2 1 
ATOM   1419 N N   . LEU   A 1 285 ? 112.415 126.199 97.401  1.00 62.68  ? 229 LEU   R N   1 
ATOM   1420 C CA  . LEU   A 1 285 ? 111.040 126.550 97.737  1.00 59.19  ? 229 LEU   R CA  1 
ATOM   1421 C C   . LEU   A 1 285 ? 110.871 126.730 99.239  1.00 63.97  ? 229 LEU   R C   1 
ATOM   1422 O O   . LEU   A 1 285 ? 110.205 127.670 99.690  1.00 63.15  ? 229 LEU   R O   1 
ATOM   1423 C CB  . LEU   A 1 285 ? 110.083 125.485 97.208  1.00 61.80  ? 229 LEU   R CB  1 
ATOM   1424 C CG  . LEU   A 1 285 ? 109.981 125.401 95.684  1.00 72.27  ? 229 LEU   R CG  1 
ATOM   1425 C CD1 . LEU   A 1 285 ? 109.084 124.245 95.275  1.00 75.15  ? 229 LEU   R CD1 1 
ATOM   1426 C CD2 . LEU   A 1 285 ? 109.472 126.707 95.101  1.00 70.17  ? 229 LEU   R CD2 1 
ATOM   1427 N N   . VAL   A 1 286 ? 111.464 125.839 100.036 1.00 63.99  ? 230 VAL   R N   1 
ATOM   1428 C CA  . VAL   A 1 286 ? 111.346 125.979 101.485 1.00 62.21  ? 230 VAL   R CA  1 
ATOM   1429 C C   . VAL   A 1 286 ? 112.002 127.277 101.942 1.00 67.27  ? 230 VAL   R C   1 
ATOM   1430 O O   . VAL   A 1 286 ? 111.442 128.027 102.751 1.00 71.04  ? 230 VAL   R O   1 
ATOM   1431 C CB  . VAL   A 1 286 ? 111.946 124.757 102.200 1.00 63.29  ? 230 VAL   R CB  1 
ATOM   1432 C CG1 . VAL   A 1 286 ? 111.925 124.963 103.699 1.00 61.09  ? 230 VAL   R CG1 1 
ATOM   1433 C CG2 . VAL   A 1 286 ? 111.174 123.505 101.837 1.00 69.32  ? 230 VAL   R CG2 1 
ATOM   1434 N N   . MET   A 1 287 ? 113.196 127.567 101.420 1.00 66.57  ? 231 MET   R N   1 
ATOM   1435 C CA  . MET   A 1 287 ? 113.879 128.805 101.772 1.00 63.31  ? 231 MET   R CA  1 
ATOM   1436 C C   . MET   A 1 287 ? 113.049 130.014 101.373 1.00 63.62  ? 231 MET   R C   1 
ATOM   1437 O O   . MET   A 1 287 ? 112.915 130.972 102.140 1.00 67.42  ? 231 MET   R O   1 
ATOM   1438 C CB  . MET   A 1 287 ? 115.244 128.863 101.088 1.00 66.24  ? 231 MET   R CB  1 
ATOM   1439 C CG  . MET   A 1 287 ? 116.293 127.944 101.671 1.00 63.38  ? 231 MET   R CG  1 
ATOM   1440 S SD  . MET   A 1 287 ? 117.940 128.650 101.506 1.00 75.96  ? 231 MET   R SD  1 
ATOM   1441 C CE  . MET   A 1 287 ? 118.833 127.259 100.825 1.00 78.30  ? 231 MET   R CE  1 
ATOM   1442 N N   . ALA   A 1 288 ? 112.488 129.991 100.166 1.00 53.60  ? 232 ALA   R N   1 
ATOM   1443 C CA  . ALA   A 1 288 ? 111.708 131.122 99.686  1.00 53.78  ? 232 ALA   R CA  1 
ATOM   1444 C C   . ALA   A 1 288 ? 110.506 131.365 100.583 1.00 56.99  ? 232 ALA   R C   1 
ATOM   1445 O O   . ALA   A 1 288 ? 110.273 132.487 101.035 1.00 69.83  ? 232 ALA   R O   1 
ATOM   1446 C CB  . ALA   A 1 288 ? 111.267 130.877 98.244  1.00 63.60  ? 232 ALA   R CB  1 
ATOM   1447 N N   . TYR   A 1 289 ? 109.731 130.317 100.862 1.00 50.33  ? 233 TYR   R N   1 
ATOM   1448 C CA  . TYR   A 1 289 ? 108.578 130.463 101.740 1.00 53.85  ? 233 TYR   R CA  1 
ATOM   1449 C C   . TYR   A 1 289 ? 108.981 131.030 103.095 1.00 56.50  ? 233 TYR   R C   1 
ATOM   1450 O O   . TYR   A 1 289 ? 108.431 132.040 103.560 1.00 59.86  ? 233 TYR   R O   1 
ATOM   1451 C CB  . TYR   A 1 289 ? 107.895 129.107 101.920 1.00 54.16  ? 233 TYR   R CB  1 
ATOM   1452 C CG  . TYR   A 1 289 ? 106.569 129.184 102.630 1.00 48.20  ? 233 TYR   R CG  1 
ATOM   1453 C CD1 . TYR   A 1 289 ? 105.409 129.485 101.939 1.00 61.00  ? 233 TYR   R CD1 1 
ATOM   1454 C CD2 . TYR   A 1 289 ? 106.479 128.959 103.990 1.00 40.16  ? 233 TYR   R CD2 1 
ATOM   1455 C CE1 . TYR   A 1 289 ? 104.198 129.556 102.584 1.00 58.12  ? 233 TYR   R CE1 1 
ATOM   1456 C CE2 . TYR   A 1 289 ? 105.273 129.030 104.643 1.00 40.58  ? 233 TYR   R CE2 1 
ATOM   1457 C CZ  . TYR   A 1 289 ? 104.136 129.329 103.935 1.00 52.68  ? 233 TYR   R CZ  1 
ATOM   1458 O OH  . TYR   A 1 289 ? 102.927 129.400 104.582 1.00 64.43  ? 233 TYR   R OH  1 
ATOM   1459 N N   . CYS   A 1 290 ? 109.965 130.393 103.731 1.00 47.63  ? 234 CYS   R N   1 
ATOM   1460 C CA  . CYS   A 1 290 ? 110.330 130.770 105.090 1.00 41.50  ? 234 CYS   R CA  1 
ATOM   1461 C C   . CYS   A 1 290 ? 110.840 132.203 105.147 1.00 47.32  ? 234 CYS   R C   1 
ATOM   1462 O O   . CYS   A 1 290 ? 110.447 132.980 106.023 1.00 56.87  ? 234 CYS   R O   1 
ATOM   1463 C CB  . CYS   A 1 290 ? 111.375 129.794 105.621 1.00 52.48  ? 234 CYS   R CB  1 
ATOM   1464 S SG  . CYS   A 1 290 ? 110.783 128.093 105.699 1.00 68.95  ? 234 CYS   R SG  1 
ATOM   1465 N N   . TYR   A 1 291 ? 111.701 132.585 104.204 1.00 44.21  ? 235 TYR   R N   1 
ATOM   1466 C CA  . TYR   A 1 291 ? 112.296 133.911 104.267 1.00 44.51  ? 235 TYR   R CA  1 
ATOM   1467 C C   . TYR   A 1 291 ? 111.326 134.989 103.807 1.00 50.98  ? 235 TYR   R C   1 
ATOM   1468 O O   . TYR   A 1 291 ? 111.384 136.118 104.304 1.00 62.17  ? 235 TYR   R O   1 
ATOM   1469 C CB  . TYR   A 1 291 ? 113.581 133.940 103.445 1.00 42.68  ? 235 TYR   R CB  1 
ATOM   1470 C CG  . TYR   A 1 291 ? 114.748 133.293 104.155 1.00 43.88  ? 235 TYR   R CG  1 
ATOM   1471 C CD1 . TYR   A 1 291 ? 115.057 133.620 105.466 1.00 45.02  ? 235 TYR   R CD1 1 
ATOM   1472 C CD2 . TYR   A 1 291 ? 115.536 132.353 103.518 1.00 49.68  ? 235 TYR   R CD2 1 
ATOM   1473 C CE1 . TYR   A 1 291 ? 116.111 133.034 106.117 1.00 41.52  ? 235 TYR   R CE1 1 
ATOM   1474 C CE2 . TYR   A 1 291 ? 116.594 131.762 104.163 1.00 55.73  ? 235 TYR   R CE2 1 
ATOM   1475 C CZ  . TYR   A 1 291 ? 116.877 132.107 105.462 1.00 50.83  ? 235 TYR   R CZ  1 
ATOM   1476 O OH  . TYR   A 1 291 ? 117.935 131.520 106.111 1.00 61.85  ? 235 TYR   R OH  1 
ATOM   1477 N N   . ALA   A 1 292 ? 110.415 134.673 102.887 1.00 33.47  ? 236 ALA   R N   1 
ATOM   1478 C CA  . ALA   A 1 292 ? 109.371 135.629 102.550 1.00 30.55  ? 236 ALA   R CA  1 
ATOM   1479 C C   . ALA   A 1 292 ? 108.488 135.907 103.754 1.00 42.04  ? 236 ALA   R C   1 
ATOM   1480 O O   . ALA   A 1 292 ? 108.126 137.060 104.012 1.00 59.13  ? 236 ALA   R O   1 
ATOM   1481 C CB  . ALA   A 1 292 ? 108.536 135.111 101.384 1.00 46.75  ? 236 ALA   R CB  1 
ATOM   1482 N N   . HIS   A 1 293 ? 108.141 134.870 104.519 1.00 46.17  ? 237 HIS   R N   1 
ATOM   1483 C CA  . HIS   A 1 293 ? 107.346 135.114 105.718 1.00 48.51  ? 237 HIS   R CA  1 
ATOM   1484 C C   . HIS   A 1 293 ? 108.147 135.850 106.787 1.00 51.99  ? 237 HIS   R C   1 
ATOM   1485 O O   . HIS   A 1 293 ? 107.592 136.683 107.513 1.00 44.03  ? 237 HIS   R O   1 
ATOM   1486 C CB  . HIS   A 1 293 ? 106.794 133.802 106.261 1.00 37.29  ? 237 HIS   R CB  1 
ATOM   1487 C CG  . HIS   A 1 293 ? 105.435 133.471 105.736 1.00 41.88  ? 237 HIS   R CG  1 
ATOM   1488 N ND1 . HIS   A 1 293 ? 104.318 134.211 106.051 1.00 39.89  ? 237 HIS   R ND1 1 
ATOM   1489 C CD2 . HIS   A 1 293 ? 105.013 132.489 104.907 1.00 48.04  ? 237 HIS   R CD2 1 
ATOM   1490 C CE1 . HIS   A 1 293 ? 103.265 133.696 105.444 1.00 42.38  ? 237 HIS   R CE1 1 
ATOM   1491 N NE2 . HIS   A 1 293 ? 103.660 132.650 104.743 1.00 47.51  ? 237 HIS   R NE2 1 
ATOM   1492 N N   . ILE   A 1 294 ? 109.447 135.575 106.895 1.00 44.75  ? 238 ILE   R N   1 
ATOM   1493 C CA  . ILE   A 1 294 ? 110.274 136.324 107.835 1.00 30.55  ? 238 ILE   R CA  1 
ATOM   1494 C C   . ILE   A 1 294 ? 110.279 137.802 107.473 1.00 41.17  ? 238 ILE   R C   1 
ATOM   1495 O O   . ILE   A 1 294 ? 110.151 138.669 108.341 1.00 60.09  ? 238 ILE   R O   1 
ATOM   1496 C CB  . ILE   A 1 294 ? 111.701 135.753 107.879 1.00 38.84  ? 238 ILE   R CB  1 
ATOM   1497 C CG1 . ILE   A 1 294 ? 111.719 134.450 108.675 1.00 44.95  ? 238 ILE   R CG1 1 
ATOM   1498 C CG2 . ILE   A 1 294 ? 112.652 136.767 108.489 1.00 43.85  ? 238 ILE   R CG2 1 
ATOM   1499 C CD1 . ILE   A 1 294 ? 113.025 133.711 108.605 1.00 48.24  ? 238 ILE   R CD1 1 
ATOM   1500 N N   . LEU   A 1 295 ? 110.438 138.114 106.187 1.00 39.44  ? 239 LEU   R N   1 
ATOM   1501 C CA  . LEU   A 1 295 ? 110.385 139.510 105.767 1.00 37.21  ? 239 LEU   R CA  1 
ATOM   1502 C C   . LEU   A 1 295 ? 109.022 140.119 106.061 1.00 38.92  ? 239 LEU   R C   1 
ATOM   1503 O O   . LEU   A 1 295 ? 108.932 141.256 106.536 1.00 43.95  ? 239 LEU   R O   1 
ATOM   1504 C CB  . LEU   A 1 295 ? 110.706 139.631 104.280 1.00 39.53  ? 239 LEU   R CB  1 
ATOM   1505 C CG  . LEU   A 1 295 ? 112.121 140.095 103.948 1.00 47.85  ? 239 LEU   R CG  1 
ATOM   1506 C CD1 . LEU   A 1 295 ? 113.146 139.096 104.432 1.00 58.11  ? 239 LEU   R CD1 1 
ATOM   1507 C CD2 . LEU   A 1 295 ? 112.253 140.313 102.460 1.00 52.92  ? 239 LEU   R CD2 1 
ATOM   1508 N N   . ALA   A 1 296 ? 107.949 139.378 105.790 1.00 43.92  ? 240 ALA   R N   1 
ATOM   1509 C CA  . ALA   A 1 296 ? 106.612 139.906 106.031 1.00 43.52  ? 240 ALA   R CA  1 
ATOM   1510 C C   . ALA   A 1 296 ? 106.421 140.243 107.504 1.00 44.73  ? 240 ALA   R C   1 
ATOM   1511 O O   . ALA   A 1 296 ? 105.774 141.236 107.852 1.00 48.85  ? 240 ALA   R O   1 
ATOM   1512 C CB  . ALA   A 1 296 ? 105.561 138.900 105.563 1.00 49.80  ? 240 ALA   R CB  1 
ATOM   1513 N N   . VAL   A 1 297 ? 106.966 139.408 108.390 1.00 54.39  ? 241 VAL   R N   1 
ATOM   1514 C CA  . VAL   A 1 297 ? 106.881 139.691 109.818 1.00 55.05  ? 241 VAL   R CA  1 
ATOM   1515 C C   . VAL   A 1 297 ? 107.758 140.869 110.206 1.00 57.42  ? 241 VAL   R C   1 
ATOM   1516 O O   . VAL   A 1 297 ? 107.360 141.687 111.040 1.00 57.67  ? 241 VAL   R O   1 
ATOM   1517 C CB  . VAL   A 1 297 ? 107.257 138.440 110.638 1.00 46.37  ? 241 VAL   R CB  1 
ATOM   1518 C CG1 . VAL   A 1 297 ? 107.804 138.829 112.000 1.00 46.37  ? 241 VAL   R CG1 1 
ATOM   1519 C CG2 . VAL   A 1 297 ? 106.051 137.542 110.794 1.00 59.78  ? 241 VAL   R CG2 1 
ATOM   1520 N N   . LEU   A 1 298 ? 108.954 140.971 109.632 1.00 64.05  ? 242 LEU   R N   1 
ATOM   1521 C CA  . LEU   A 1 298 ? 109.911 141.990 110.041 1.00 53.63  ? 242 LEU   R CA  1 
ATOM   1522 C C   . LEU   A 1 298 ? 109.516 143.384 109.570 1.00 64.53  ? 242 LEU   R C   1 
ATOM   1523 O O   . LEU   A 1 298 ? 109.756 144.363 110.283 1.00 73.06  ? 242 LEU   R O   1 
ATOM   1524 C CB  . LEU   A 1 298 ? 111.304 141.632 109.519 1.00 51.06  ? 242 LEU   R CB  1 
ATOM   1525 C CG  . LEU   A 1 298 ? 112.286 141.063 110.543 1.00 49.80  ? 242 LEU   R CG  1 
ATOM   1526 C CD1 . LEU   A 1 298 ? 111.686 139.916 111.323 1.00 51.28  ? 242 LEU   R CD1 1 
ATOM   1527 C CD2 . LEU   A 1 298 ? 113.543 140.603 109.841 1.00 59.34  ? 242 LEU   R CD2 1 
ATOM   1528 N N   . LEU   A 1 299 ? 108.910 143.504 108.386 1.00 61.72  ? 243 LEU   R N   1 
ATOM   1529 C CA  . LEU   A 1 299 ? 108.471 144.814 107.919 1.00 51.79  ? 243 LEU   R CA  1 
ATOM   1530 C C   . LEU   A 1 299 ? 107.447 145.444 108.849 1.00 60.76  ? 243 LEU   R C   1 
ATOM   1531 O O   . LEU   A 1 299 ? 107.341 146.674 108.891 1.00 69.00  ? 243 LEU   R O   1 
ATOM   1532 C CB  . LEU   A 1 299 ? 107.865 144.718 106.521 1.00 50.91  ? 243 LEU   R CB  1 
ATOM   1533 C CG  . LEU   A 1 299 ? 108.721 144.160 105.389 1.00 53.12  ? 243 LEU   R CG  1 
ATOM   1534 C CD1 . LEU   A 1 299 ? 108.254 144.728 104.069 1.00 63.52  ? 243 LEU   R CD1 1 
ATOM   1535 C CD2 . LEU   A 1 299 ? 110.184 144.458 105.606 1.00 61.90  ? 243 LEU   R CD2 1 
ATOM   1536 N N   . VAL   A 1 300 ? 106.693 144.638 109.592 1.00 71.15  ? 244 VAL   R N   1 
ATOM   1537 C CA  . VAL   A 1 300 ? 105.634 145.149 110.452 1.00 69.94  ? 244 VAL   R CA  1 
ATOM   1538 C C   . VAL   A 1 300 ? 106.055 145.002 111.907 1.00 76.74  ? 244 VAL   R C   1 
ATOM   1539 O O   . VAL   A 1 300 ? 105.219 145.033 112.816 1.00 78.50  ? 244 VAL   R O   1 
ATOM   1540 C CB  . VAL   A 1 300 ? 104.305 144.421 110.179 1.00 73.56  ? 244 VAL   R CB  1 
ATOM   1541 C CG1 . VAL   A 1 300 ? 103.151 145.120 110.886 1.00 74.34  ? 244 VAL   R CG1 1 
ATOM   1542 C CG2 . VAL   A 1 300 ? 104.047 144.330 108.683 1.00 69.23  ? 244 VAL   R CG2 1 
ATOM   1543 N N   . SER   A 1 301 ? 107.357 144.840 112.141 1.00 91.98  ? 245 SER   R N   1 
ATOM   1544 C CA  . SER   A 1 301 ? 107.884 144.781 113.497 1.00 93.31  ? 245 SER   R CA  1 
ATOM   1545 C C   . SER   A 1 301 ? 108.360 146.161 113.932 1.00 95.73  ? 245 SER   R C   1 
ATOM   1546 O O   . SER   A 1 301 ? 108.264 147.125 113.166 1.00 91.94  ? 245 SER   R O   1 
ATOM   1547 C CB  . SER   A 1 301 ? 109.027 143.770 113.587 1.00 88.42  ? 245 SER   R CB  1 
ATOM   1548 O OG  . SER   A 1 301 ? 110.214 144.298 113.023 1.00 91.27  ? 245 SER   R OG  1 
ATOM   1549 N N   . ARG   A 1 302 ? 108.881 146.264 115.153 1.00 113.35 ? 246 ARG   R N   1 
ATOM   1550 C CA  . ARG   A 1 302 ? 109.320 147.547 115.697 1.00 110.89 ? 246 ARG   R CA  1 
ATOM   1551 C C   . ARG   A 1 302 ? 110.690 147.348 116.327 1.00 111.13 ? 246 ARG   R C   1 
ATOM   1552 O O   . ARG   A 1 302 ? 110.811 146.663 117.347 1.00 114.06 ? 246 ARG   R O   1 
ATOM   1553 C CB  . ARG   A 1 302 ? 108.319 148.079 116.719 1.00 112.40 ? 246 ARG   R CB  1 
ATOM   1554 C CG  . ARG   A 1 302 ? 108.466 149.563 117.020 1.00 112.03 ? 246 ARG   R CG  1 
ATOM   1555 C CD  . ARG   A 1 302 ? 107.994 149.898 118.427 1.00 113.06 ? 246 ARG   R CD  1 
ATOM   1556 N NE  . ARG   A 1 302 ? 106.782 149.169 118.788 1.00 112.20 ? 246 ARG   R NE  1 
ATOM   1557 C CZ  . ARG   A 1 302 ? 105.588 149.718 118.979 1.00 112.86 ? 246 ARG   R CZ  1 
ATOM   1558 N NH1 . ARG   A 1 302 ? 105.387 151.019 118.840 1.00 114.50 ? 246 ARG   R NH1 1 
ATOM   1559 N NH2 . ARG   A 1 302 ? 104.565 148.938 119.319 1.00 112.35 ? 246 ARG   R NH2 1 
ATOM   1560 N N   . GLY   A 1 303 ? 111.711 147.943 115.726 1.00 111.86 ? 247 GLY   R N   1 
ATOM   1561 C CA  . GLY   A 1 303 ? 113.055 147.832 116.254 1.00 115.45 ? 247 GLY   R CA  1 
ATOM   1562 C C   . GLY   A 1 303 ? 114.058 148.437 115.297 1.00 116.95 ? 247 GLY   R C   1 
ATOM   1563 O O   . GLY   A 1 303 ? 113.718 148.885 114.198 1.00 114.87 ? 247 GLY   R O   1 
ATOM   1564 N N   . GLN   A 1 304 ? 115.312 148.445 115.747 1.00 125.36 ? 248 GLN   R N   1 
ATOM   1565 C CA  . GLN   A 1 304 ? 116.428 148.939 114.951 1.00 124.86 ? 248 GLN   R CA  1 
ATOM   1566 C C   . GLN   A 1 304 ? 117.300 147.811 114.418 1.00 123.40 ? 248 GLN   R C   1 
ATOM   1567 O O   . GLN   A 1 304 ? 118.143 148.049 113.547 1.00 122.74 ? 248 GLN   R O   1 
ATOM   1568 C CB  . GLN   A 1 304 ? 117.279 149.908 115.776 1.00 123.25 ? 248 GLN   R CB  1 
ATOM   1569 C CG  . GLN   A 1 304 ? 116.497 151.044 116.419 1.00 123.94 ? 248 GLN   R CG  1 
ATOM   1570 C CD  . GLN   A 1 304 ? 116.121 152.130 115.429 1.00 125.51 ? 248 GLN   R CD  1 
ATOM   1571 O OE1 . GLN   A 1 304 ? 115.302 151.916 114.535 1.00 126.47 ? 248 GLN   R OE1 1 
ATOM   1572 N NE2 . GLN   A 1 304 ? 116.721 153.304 115.585 1.00 124.21 ? 248 GLN   R NE2 1 
ATOM   1573 N N   . ARG   A 1 305 ? 117.120 146.591 114.921 1.00 115.72 ? 249 ARG   R N   1 
ATOM   1574 C CA  . ARG   A 1 305 ? 117.861 145.433 114.440 1.00 115.46 ? 249 ARG   R CA  1 
ATOM   1575 C C   . ARG   A 1 305 ? 117.202 144.763 113.246 1.00 110.79 ? 249 ARG   R C   1 
ATOM   1576 O O   . ARG   A 1 305 ? 117.816 143.895 112.620 1.00 108.66 ? 249 ARG   R O   1 
ATOM   1577 C CB  . ARG   A 1 305 ? 118.016 144.394 115.558 1.00 115.81 ? 249 ARG   R CB  1 
ATOM   1578 C CG  . ARG   A 1 305 ? 118.377 144.961 116.933 1.00 115.17 ? 249 ARG   R CG  1 
ATOM   1579 C CD  . ARG   A 1 305 ? 117.940 144.028 118.054 1.00 113.58 ? 249 ARG   R CD  1 
ATOM   1580 N NE  . ARG   A 1 305 ? 119.064 143.287 118.619 1.00 115.36 ? 249 ARG   R NE  1 
ATOM   1581 C CZ  . ARG   A 1 305 ? 119.111 141.968 118.763 1.00 116.50 ? 249 ARG   R CZ  1 
ATOM   1582 N NH1 . ARG   A 1 305 ? 118.105 141.190 118.396 1.00 115.71 ? 249 ARG   R NH1 1 
ATOM   1583 N NH2 . ARG   A 1 305 ? 120.197 141.414 119.293 1.00 116.46 ? 249 ARG   R NH2 1 
ATOM   1584 N N   . ARG   A 1 306 ? 115.965 145.141 112.922 1.00 92.06  ? 250 ARG   R N   1 
ATOM   1585 C CA  . ARG   A 1 306 ? 115.252 144.491 111.831 1.00 88.30  ? 250 ARG   R CA  1 
ATOM   1586 C C   . ARG   A 1 306 ? 115.928 144.732 110.488 1.00 90.16  ? 250 ARG   R C   1 
ATOM   1587 O O   . ARG   A 1 306 ? 115.924 143.847 109.628 1.00 91.61  ? 250 ARG   R O   1 
ATOM   1588 C CB  . ARG   A 1 306 ? 113.805 144.985 111.794 1.00 88.65  ? 250 ARG   R CB  1 
ATOM   1589 C CG  . ARG   A 1 306 ? 113.680 146.457 111.458 1.00 88.01  ? 250 ARG   R CG  1 
ATOM   1590 C CD  . ARG   A 1 306 ? 112.555 147.135 112.219 1.00 90.35  ? 250 ARG   R CD  1 
ATOM   1591 N NE  . ARG   A 1 306 ? 111.234 146.724 111.760 1.00 92.12  ? 250 ARG   R NE  1 
ATOM   1592 C CZ  . ARG   A 1 306 ? 110.463 147.432 110.945 1.00 94.52  ? 250 ARG   R CZ  1 
ATOM   1593 N NH1 . ARG   A 1 306 ? 110.875 148.571 110.414 1.00 95.97  ? 250 ARG   R NH1 1 
ATOM   1594 N NH2 . ARG   A 1 306 ? 109.247 146.984 110.653 1.00 92.73  ? 250 ARG   R NH2 1 
ATOM   1595 N N   . LEU   A 1 307 ? 116.502 145.919 110.280 1.00 82.27  ? 251 LEU   R N   1 
ATOM   1596 C CA  . LEU   A 1 307 ? 117.061 146.250 108.972 1.00 78.82  ? 251 LEU   R CA  1 
ATOM   1597 C C   . LEU   A 1 307 ? 118.164 145.278 108.575 1.00 84.89  ? 251 LEU   R C   1 
ATOM   1598 O O   . LEU   A 1 307 ? 118.171 144.751 107.453 1.00 85.67  ? 251 LEU   R O   1 
ATOM   1599 C CB  . LEU   A 1 307 ? 117.594 147.681 108.977 1.00 81.78  ? 251 LEU   R CB  1 
ATOM   1600 C CG  . LEU   A 1 307 ? 116.583 148.814 108.789 1.00 87.93  ? 251 LEU   R CG  1 
ATOM   1601 C CD1 . LEU   A 1 307 ? 116.006 148.771 107.386 1.00 86.82  ? 251 LEU   R CD1 1 
ATOM   1602 C CD2 . LEU   A 1 307 ? 115.477 148.749 109.821 1.00 86.54  ? 251 LEU   R CD2 1 
ATOM   1603 N N   . ARG   A 1 308 ? 119.119 145.042 109.475 1.00 92.31  ? 252 ARG   R N   1 
ATOM   1604 C CA  . ARG   A 1 308 ? 120.190 144.106 109.162 1.00 90.90  ? 252 ARG   R CA  1 
ATOM   1605 C C   . ARG   A 1 308 ? 119.632 142.714 108.919 1.00 91.36  ? 252 ARG   R C   1 
ATOM   1606 O O   . ARG   A 1 308 ? 120.124 141.986 108.054 1.00 93.45  ? 252 ARG   R O   1 
ATOM   1607 C CB  . ARG   A 1 308 ? 121.223 144.080 110.286 1.00 84.53  ? 252 ARG   R CB  1 
ATOM   1608 C CG  . ARG   A 1 308 ? 122.014 145.361 110.419 1.00 85.61  ? 252 ARG   R CG  1 
ATOM   1609 C CD  . ARG   A 1 308 ? 122.941 145.312 111.616 1.00 93.54  ? 252 ARG   R CD  1 
ATOM   1610 N NE  . ARG   A 1 308 ? 123.994 144.317 111.438 1.00 93.96  ? 252 ARG   R NE  1 
ATOM   1611 C CZ  . ARG   A 1 308 ? 125.297 144.569 111.448 1.00 92.93  ? 252 ARG   R CZ  1 
ATOM   1612 N NH1 . ARG   A 1 308 ? 125.771 145.793 111.620 1.00 93.41  ? 252 ARG   R NH1 1 
ATOM   1613 N NH2 . ARG   A 1 308 ? 126.151 143.563 111.280 1.00 86.10  ? 252 ARG   R NH2 1 
ATOM   1614 N N   . ALA   A 1 309 ? 118.604 142.324 109.672 1.00 62.35  ? 253 ALA   R N   1 
ATOM   1615 C CA  . ALA   A 1 309 ? 118.003 141.014 109.462 1.00 49.56  ? 253 ALA   R CA  1 
ATOM   1616 C C   . ALA   A 1 309 ? 117.427 140.902 108.058 1.00 63.47  ? 253 ALA   R C   1 
ATOM   1617 O O   . ALA   A 1 309 ? 117.633 139.899 107.366 1.00 76.13  ? 253 ALA   R O   1 
ATOM   1618 C CB  . ALA   A 1 309 ? 116.922 140.763 110.509 1.00 64.36  ? 253 ALA   R CB  1 
ATOM   1619 N N   . MET   A 1 310 ? 116.700 141.930 107.618 1.00 68.83  ? 254 MET   R N   1 
ATOM   1620 C CA  . MET   A 1 310 ? 116.126 141.906 106.277 1.00 72.57  ? 254 MET   R CA  1 
ATOM   1621 C C   . MET   A 1 310 ? 117.218 141.812 105.224 1.00 70.37  ? 254 MET   R C   1 
ATOM   1622 O O   . MET   A 1 310 ? 117.131 141.005 104.287 1.00 68.48  ? 254 MET   R O   1 
ATOM   1623 C CB  . MET   A 1 310 ? 115.290 143.161 106.043 1.00 67.07  ? 254 MET   R CB  1 
ATOM   1624 C CG  . MET   A 1 310 ? 113.937 143.168 106.713 1.00 64.99  ? 254 MET   R CG  1 
ATOM   1625 S SD  . MET   A 1 310 ? 113.224 144.818 106.649 1.00 94.23  ? 254 MET   R SD  1 
ATOM   1626 C CE  . MET   A 1 310 ? 112.428 144.914 108.245 1.00 78.64  ? 254 MET   R CE  1 
ATOM   1627 N N   . ARG   A 1 311 ? 118.255 142.638 105.360 1.00 67.08  ? 255 ARG   R N   1 
ATOM   1628 C CA  . ARG   A 1 311 ? 119.325 142.627 104.372 1.00 68.64  ? 255 ARG   R CA  1 
ATOM   1629 C C   . ARG   A 1 311 ? 120.021 141.274 104.342 1.00 69.22  ? 255 ARG   R C   1 
ATOM   1630 O O   . ARG   A 1 311 ? 120.339 140.754 103.267 1.00 67.49  ? 255 ARG   R O   1 
ATOM   1631 C CB  . ARG   A 1 311 ? 120.315 143.751 104.667 1.00 66.06  ? 255 ARG   R CB  1 
ATOM   1632 C CG  . ARG   A 1 311 ? 119.800 145.119 104.262 1.00 68.01  ? 255 ARG   R CG  1 
ATOM   1633 C CD  . ARG   A 1 311 ? 120.578 146.239 104.917 1.00 67.42  ? 255 ARG   R CD  1 
ATOM   1634 N NE  . ARG   A 1 311 ? 120.429 147.492 104.189 1.00 70.24  ? 255 ARG   R NE  1 
ATOM   1635 C CZ  . ARG   A 1 311 ? 120.840 148.672 104.631 1.00 74.60  ? 255 ARG   R CZ  1 
ATOM   1636 N NH1 . ARG   A 1 311 ? 121.420 148.805 105.812 1.00 77.20  ? 255 ARG   R NH1 1 
ATOM   1637 N NH2 . ARG   A 1 311 ? 120.665 149.747 103.868 1.00 73.91  ? 255 ARG   R NH2 1 
ATOM   1638 N N   . LEU   A 1 312 ? 120.249 140.679 105.514 1.00 62.53  ? 256 LEU   R N   1 
ATOM   1639 C CA  . LEU   A 1 312 ? 120.896 139.375 105.574 1.00 55.89  ? 256 LEU   R CA  1 
ATOM   1640 C C   . LEU   A 1 312 ? 120.036 138.306 104.920 1.00 64.33  ? 256 LEU   R C   1 
ATOM   1641 O O   . LEU   A 1 312 ? 120.543 137.440 104.201 1.00 64.85  ? 256 LEU   R O   1 
ATOM   1642 C CB  . LEU   A 1 312 ? 121.188 139.005 107.025 1.00 52.11  ? 256 LEU   R CB  1 
ATOM   1643 C CG  . LEU   A 1 312 ? 122.647 139.133 107.444 1.00 51.71  ? 256 LEU   R CG  1 
ATOM   1644 C CD1 . LEU   A 1 312 ? 122.757 139.037 108.949 1.00 67.11  ? 256 LEU   R CD1 1 
ATOM   1645 C CD2 . LEU   A 1 312 ? 123.488 138.064 106.771 1.00 53.89  ? 256 LEU   R CD2 1 
ATOM   1646 N N   . VAL   A 1 313 ? 118.727 138.339 105.170 1.00 60.44  ? 257 VAL   R N   1 
ATOM   1647 C CA  . VAL   A 1 313 ? 117.842 137.345 104.573 1.00 53.05  ? 257 VAL   R CA  1 
ATOM   1648 C C   . VAL   A 1 313 ? 117.890 137.448 103.055 1.00 62.28  ? 257 VAL   R C   1 
ATOM   1649 O O   . VAL   A 1 313 ? 118.033 136.441 102.343 1.00 72.13  ? 257 VAL   R O   1 
ATOM   1650 C CB  . VAL   A 1 313 ? 116.409 137.522 105.104 1.00 42.03  ? 257 VAL   R CB  1 
ATOM   1651 C CG1 . VAL   A 1 313 ? 115.422 136.806 104.209 1.00 54.18  ? 257 VAL   R CG1 1 
ATOM   1652 C CG2 . VAL   A 1 313 ? 116.308 137.012 106.524 1.00 47.21  ? 257 VAL   R CG2 1 
ATOM   1653 N N   . VAL   A 1 314 ? 117.777 138.672 102.536 1.00 60.27  ? 258 VAL   R N   1 
ATOM   1654 C CA  . VAL   A 1 314 ? 117.799 138.852 101.089 1.00 54.21  ? 258 VAL   R CA  1 
ATOM   1655 C C   . VAL   A 1 314 ? 119.129 138.377 100.524 1.00 61.25  ? 258 VAL   R C   1 
ATOM   1656 O O   . VAL   A 1 314 ? 119.174 137.702 99.489  1.00 64.96  ? 258 VAL   R O   1 
ATOM   1657 C CB  . VAL   A 1 314 ? 117.516 140.320 100.724 1.00 51.87  ? 258 VAL   R CB  1 
ATOM   1658 C CG1 . VAL   A 1 314 ? 118.134 140.672 99.384  1.00 56.93  ? 258 VAL   R CG1 1 
ATOM   1659 C CG2 . VAL   A 1 314 ? 116.025 140.573 100.700 1.00 57.17  ? 258 VAL   R CG2 1 
ATOM   1660 N N   . VAL   A 1 315 ? 120.231 138.715 101.195 1.00 56.60  ? 259 VAL   R N   1 
ATOM   1661 C CA  . VAL   A 1 315 ? 121.547 138.324 100.704 1.00 49.03  ? 259 VAL   R CA  1 
ATOM   1662 C C   . VAL   A 1 315 ? 121.677 136.810 100.682 1.00 52.42  ? 259 VAL   R C   1 
ATOM   1663 O O   . VAL   A 1 315 ? 122.224 136.237 99.738  1.00 63.81  ? 259 VAL   R O   1 
ATOM   1664 C CB  . VAL   A 1 315 ? 122.652 138.970 101.557 1.00 52.53  ? 259 VAL   R CB  1 
ATOM   1665 C CG1 . VAL   A 1 315 ? 123.971 138.244 101.357 1.00 53.69  ? 259 VAL   R CG1 1 
ATOM   1666 C CG2 . VAL   A 1 315 ? 122.791 140.436 101.205 1.00 60.28  ? 259 VAL   R CG2 1 
ATOM   1667 N N   . VAL   A 1 316 ? 121.186 136.137 101.723 1.00 56.70  ? 260 VAL   R N   1 
ATOM   1668 C CA  . VAL   A 1 316 ? 121.299 134.682 101.793 1.00 63.57  ? 260 VAL   R CA  1 
ATOM   1669 C C   . VAL   A 1 316 ? 120.541 134.041 100.638 1.00 60.86  ? 260 VAL   R C   1 
ATOM   1670 O O   . VAL   A 1 316 ? 121.062 133.173 99.922  1.00 60.88  ? 260 VAL   R O   1 
ATOM   1671 C CB  . VAL   A 1 316 ? 120.784 134.171 103.149 1.00 52.27  ? 260 VAL   R CB  1 
ATOM   1672 C CG1 . VAL   A 1 316 ? 120.377 132.715 103.053 1.00 57.73  ? 260 VAL   R CG1 1 
ATOM   1673 C CG2 . VAL   A 1 316 ? 121.837 134.365 104.222 1.00 50.21  ? 260 VAL   R CG2 1 
ATOM   1674 N N   . VAL   A 1 317 ? 119.290 134.461 100.445 1.00 58.89  ? 261 VAL   R N   1 
ATOM   1675 C CA  . VAL   A 1 317 ? 118.481 133.868 99.382  1.00 59.40  ? 261 VAL   R CA  1 
ATOM   1676 C C   . VAL   A 1 317 ? 119.127 134.122 98.026  1.00 67.53  ? 261 VAL   R C   1 
ATOM   1677 O O   . VAL   A 1 317 ? 119.239 133.216 97.187  1.00 72.86  ? 261 VAL   R O   1 
ATOM   1678 C CB  . VAL   A 1 317 ? 117.041 134.407 99.434  1.00 54.70  ? 261 VAL   R CB  1 
ATOM   1679 C CG1 . VAL   A 1 317 ? 116.206 133.793 98.330  1.00 59.29  ? 261 VAL   R CG1 1 
ATOM   1680 C CG2 . VAL   A 1 317 ? 116.415 134.111 100.779 1.00 56.66  ? 261 VAL   R CG2 1 
ATOM   1681 N N   . VAL   A 1 318 ? 119.575 135.358 97.795  1.00 67.32  ? 262 VAL   R N   1 
ATOM   1682 C CA  . VAL   A 1 318 ? 120.157 135.702 96.504  1.00 63.32  ? 262 VAL   R CA  1 
ATOM   1683 C C   . VAL   A 1 318 ? 121.450 134.934 96.280  1.00 67.33  ? 262 VAL   R C   1 
ATOM   1684 O O   . VAL   A 1 318 ? 121.748 134.513 95.160  1.00 70.02  ? 262 VAL   R O   1 
ATOM   1685 C CB  . VAL   A 1 318 ? 120.375 137.221 96.408  1.00 63.86  ? 262 VAL   R CB  1 
ATOM   1686 C CG1 . VAL   A 1 318 ? 121.296 137.553 95.254  1.00 67.41  ? 262 VAL   R CG1 1 
ATOM   1687 C CG2 . VAL   A 1 318 ? 119.046 137.928 96.245  1.00 71.78  ? 262 VAL   R CG2 1 
ATOM   1688 N N   . ALA   A 1 319 ? 122.244 134.747 97.332  1.00 70.42  ? 263 ALA   R N   1 
ATOM   1689 C CA  . ALA   A 1 319 ? 123.498 134.021 97.211  1.00 67.60  ? 263 ALA   R CA  1 
ATOM   1690 C C   . ALA   A 1 319 ? 123.225 132.587 96.801  1.00 67.33  ? 263 ALA   R C   1 
ATOM   1691 O O   . ALA   A 1 319 ? 123.836 132.083 95.854  1.00 70.32  ? 263 ALA   R O   1 
ATOM   1692 C CB  . ALA   A 1 319 ? 124.276 134.059 98.526  1.00 62.99  ? 263 ALA   R CB  1 
ATOM   1693 N N   . PHE   A 1 320 ? 122.302 131.920 97.497  1.00 73.94  ? 264 PHE   R N   1 
ATOM   1694 C CA  . PHE   A 1 320 ? 121.975 130.547 97.135  1.00 68.43  ? 264 PHE   R CA  1 
ATOM   1695 C C   . PHE   A 1 320 ? 121.522 130.465 95.682  1.00 69.44  ? 264 PHE   R C   1 
ATOM   1696 O O   . PHE   A 1 320 ? 122.025 129.645 94.900  1.00 77.03  ? 264 PHE   R O   1 
ATOM   1697 C CB  . PHE   A 1 320 ? 120.891 129.993 98.062  1.00 67.62  ? 264 PHE   R CB  1 
ATOM   1698 C CG  . PHE   A 1 320 ? 120.567 128.547 97.813  1.00 72.61  ? 264 PHE   R CG  1 
ATOM   1699 C CD1 . PHE   A 1 320 ? 121.365 127.544 98.329  1.00 76.35  ? 264 PHE   R CD1 1 
ATOM   1700 C CD2 . PHE   A 1 320 ? 119.467 128.191 97.056  1.00 73.88  ? 264 PHE   R CD2 1 
ATOM   1701 C CE1 . PHE   A 1 320 ? 121.068 126.217 98.099  1.00 72.91  ? 264 PHE   R CE1 1 
ATOM   1702 C CE2 . PHE   A 1 320 ? 119.169 126.865 96.824  1.00 69.35  ? 264 PHE   R CE2 1 
ATOM   1703 C CZ  . PHE   A 1 320 ? 119.970 125.880 97.346  1.00 67.23  ? 264 PHE   R CZ  1 
ATOM   1704 N N   . ALA   A 1 321 ? 120.572 131.324 95.306  1.00 65.63  ? 265 ALA   R N   1 
ATOM   1705 C CA  . ALA   A 1 321 ? 120.031 131.283 93.952  1.00 65.51  ? 265 ALA   R CA  1 
ATOM   1706 C C   . ALA   A 1 321 ? 121.124 131.511 92.913  1.00 69.39  ? 265 ALA   R C   1 
ATOM   1707 O O   . ALA   A 1 321 ? 121.287 130.721 91.979  1.00 72.61  ? 265 ALA   R O   1 
ATOM   1708 C CB  . ALA   A 1 321 ? 118.919 132.322 93.808  1.00 68.24  ? 265 ALA   R CB  1 
ATOM   1709 N N   . LEU   A 1 322 ? 121.896 132.587 93.067  1.00 66.43  ? 266 LEU   R N   1 
ATOM   1710 C CA  . LEU   A 1 322 ? 122.920 132.916 92.083  1.00 59.43  ? 266 LEU   R CA  1 
ATOM   1711 C C   . LEU   A 1 322 ? 123.960 131.812 91.979  1.00 68.83  ? 266 LEU   R C   1 
ATOM   1712 O O   . LEU   A 1 322 ? 124.416 131.474 90.882  1.00 69.92  ? 266 LEU   R O   1 
ATOM   1713 C CB  . LEU   A 1 322 ? 123.593 134.238 92.450  1.00 57.22  ? 266 LEU   R CB  1 
ATOM   1714 C CG  . LEU   A 1 322 ? 122.765 135.510 92.281  1.00 69.45  ? 266 LEU   R CG  1 
ATOM   1715 C CD1 . LEU   A 1 322 ? 123.600 136.720 92.651  1.00 70.87  ? 266 LEU   R CD1 1 
ATOM   1716 C CD2 . LEU   A 1 322 ? 122.235 135.642 90.862  1.00 72.67  ? 266 LEU   R CD2 1 
ATOM   1717 N N   . CYS   A 1 323 ? 124.362 131.244 93.115  1.00 86.46  ? 267 CYS   R N   1 
ATOM   1718 C CA  . CYS   A 1 323 ? 125.424 130.248 93.085  1.00 84.24  ? 267 CYS   R CA  1 
ATOM   1719 C C   . CYS   A 1 323 ? 124.956 128.949 92.444  1.00 86.57  ? 267 CYS   R C   1 
ATOM   1720 O O   . CYS   A 1 323 ? 125.717 128.315 91.705  1.00 91.37  ? 267 CYS   R O   1 
ATOM   1721 C CB  . CYS   A 1 323 ? 125.941 129.992 94.497  1.00 80.84  ? 267 CYS   R CB  1 
ATOM   1722 S SG  . CYS   A 1 323 ? 126.887 131.364 95.187  1.00 93.39  ? 267 CYS   R SG  1 
ATOM   1723 N N   . TRP   A 1 324 ? 123.717 128.529 92.700  1.00 83.37  ? 268 TRP   R N   1 
ATOM   1724 C CA  . TRP   A 1 324 ? 123.319 127.193 92.274  1.00 78.74  ? 268 TRP   R CA  1 
ATOM   1725 C C   . TRP   A 1 324 ? 122.507 127.157 90.986  1.00 82.24  ? 268 TRP   R C   1 
ATOM   1726 O O   . TRP   A 1 324 ? 122.595 126.169 90.253  1.00 87.87  ? 268 TRP   R O   1 
ATOM   1727 C CB  . TRP   A 1 324 ? 122.531 126.499 93.387  1.00 82.06  ? 268 TRP   R CB  1 
ATOM   1728 C CG  . TRP   A 1 324 ? 123.417 125.763 94.346  1.00 85.44  ? 268 TRP   R CG  1 
ATOM   1729 C CD1 . TRP   A 1 324 ? 123.458 125.909 95.700  1.00 81.88  ? 268 TRP   R CD1 1 
ATOM   1730 C CD2 . TRP   A 1 324 ? 124.401 124.773 94.020  1.00 86.68  ? 268 TRP   R CD2 1 
ATOM   1731 N NE1 . TRP   A 1 324 ? 124.400 125.069 96.239  1.00 83.86  ? 268 TRP   R NE1 1 
ATOM   1732 C CE2 . TRP   A 1 324 ? 124.993 124.361 95.227  1.00 90.13  ? 268 TRP   R CE2 1 
ATOM   1733 C CE3 . TRP   A 1 324 ? 124.835 124.193 92.825  1.00 79.64  ? 268 TRP   R CE3 1 
ATOM   1734 C CZ2 . TRP   A 1 324 ? 125.995 123.397 95.274  1.00 88.74  ? 268 TRP   R CZ2 1 
ATOM   1735 C CZ3 . TRP   A 1 324 ? 125.829 123.237 92.874  1.00 77.90  ? 268 TRP   R CZ3 1 
ATOM   1736 C CH2 . TRP   A 1 324 ? 126.398 122.849 94.088  1.00 81.06  ? 268 TRP   R CH2 1 
ATOM   1737 N N   . THR   A 1 325 ? 121.725 128.189 90.674  1.00 81.65  ? 269 THR   R N   1 
ATOM   1738 C CA  . THR   A 1 325 ? 120.934 128.166 89.446  1.00 80.43  ? 269 THR   R CA  1 
ATOM   1739 C C   . THR   A 1 325 ? 121.782 127.966 88.197  1.00 81.63  ? 269 THR   R C   1 
ATOM   1740 O O   . THR   A 1 325 ? 121.359 127.211 87.305  1.00 88.36  ? 269 THR   R O   1 
ATOM   1741 C CB  . THR   A 1 325 ? 120.111 129.453 89.349  1.00 79.39  ? 269 THR   R CB  1 
ATOM   1742 O OG1 . THR   A 1 325 ? 119.199 129.521 90.451  1.00 79.52  ? 269 THR   R OG1 1 
ATOM   1743 C CG2 . THR   A 1 325 ? 119.328 129.495 88.049  1.00 81.20  ? 269 THR   R CG2 1 
ATOM   1744 N N   . PRO   A 1 326 ? 122.944 128.604 88.045  1.00 74.99  ? 270 PRO   R N   1 
ATOM   1745 C CA  . PRO   A 1 326 ? 123.691 128.475 86.788  1.00 79.62  ? 270 PRO   R CA  1 
ATOM   1746 C C   . PRO   A 1 326 ? 124.047 127.039 86.437  1.00 86.76  ? 270 PRO   R C   1 
ATOM   1747 O O   . PRO   A 1 326 ? 124.117 126.688 85.255  1.00 89.91  ? 270 PRO   R O   1 
ATOM   1748 C CB  . PRO   A 1 326 ? 124.948 129.312 87.049  1.00 80.52  ? 270 PRO   R CB  1 
ATOM   1749 C CG  . PRO   A 1 326 ? 124.518 130.306 88.053  1.00 81.74  ? 270 PRO   R CG  1 
ATOM   1750 C CD  . PRO   A 1 326 ? 123.599 129.550 88.960  1.00 79.95  ? 270 PRO   R CD  1 
ATOM   1751 N N   . TYR   A 1 327 ? 124.286 126.201 87.443  1.00 92.02  ? 271 TYR   R N   1 
ATOM   1752 C CA  . TYR   A 1 327 ? 124.606 124.804 87.180  1.00 90.08  ? 271 TYR   R CA  1 
ATOM   1753 C C   . TYR   A 1 327 ? 123.366 123.973 86.881  1.00 89.67  ? 271 TYR   R C   1 
ATOM   1754 O O   . TYR   A 1 327 ? 123.380 123.147 85.963  1.00 91.18  ? 271 TYR   R O   1 
ATOM   1755 C CB  . TYR   A 1 327 ? 125.349 124.193 88.369  1.00 86.73  ? 271 TYR   R CB  1 
ATOM   1756 C CG  . TYR   A 1 327 ? 125.364 122.685 88.341  1.00 81.18  ? 271 TYR   R CG  1 
ATOM   1757 C CD1 . TYR   A 1 327 ? 126.061 122.000 87.360  1.00 86.22  ? 271 TYR   R CD1 1 
ATOM   1758 C CD2 . TYR   A 1 327 ? 124.674 121.948 89.286  1.00 84.66  ? 271 TYR   R CD2 1 
ATOM   1759 C CE1 . TYR   A 1 327 ? 126.074 120.625 87.325  1.00 87.68  ? 271 TYR   R CE1 1 
ATOM   1760 C CE2 . TYR   A 1 327 ? 124.682 120.572 89.259  1.00 91.73  ? 271 TYR   R CE2 1 
ATOM   1761 C CZ  . TYR   A 1 327 ? 125.382 119.916 88.276  1.00 91.42  ? 271 TYR   R CZ  1 
ATOM   1762 O OH  . TYR   A 1 327 ? 125.391 118.543 88.245  1.00 92.43  ? 271 TYR   R OH  1 
ATOM   1763 N N   . HIS   A 1 328 ? 122.290 124.172 87.641  1.00 81.60  ? 272 HIS   R N   1 
ATOM   1764 C CA  . HIS   A 1 328 ? 121.096 123.360 87.443  1.00 77.18  ? 272 HIS   R CA  1 
ATOM   1765 C C   . HIS   A 1 328 ? 120.412 123.696 86.125  1.00 83.68  ? 272 HIS   R C   1 
ATOM   1766 O O   . HIS   A 1 328 ? 119.830 122.817 85.483  1.00 90.37  ? 272 HIS   R O   1 
ATOM   1767 C CB  . HIS   A 1 328 ? 120.143 123.546 88.617  1.00 74.40  ? 272 HIS   R CB  1 
ATOM   1768 C CG  . HIS   A 1 328 ? 120.652 122.959 89.894  1.00 76.97  ? 272 HIS   R CG  1 
ATOM   1769 N ND1 . HIS   A 1 328 ? 121.012 121.634 90.010  1.00 79.49  ? 272 HIS   R ND1 1 
ATOM   1770 C CD2 . HIS   A 1 328 ? 120.877 123.517 91.106  1.00 82.68  ? 272 HIS   R CD2 1 
ATOM   1771 C CE1 . HIS   A 1 328 ? 121.428 121.400 91.241  1.00 82.52  ? 272 HIS   R CE1 1 
ATOM   1772 N NE2 . HIS   A 1 328 ? 121.356 122.525 91.927  1.00 80.26  ? 272 HIS   R NE2 1 
ATOM   1773 N N   . LEU   A 1 329 ? 120.476 124.957 85.697  1.00 87.41  ? 273 LEU   R N   1 
ATOM   1774 C CA  . LEU   A 1 329 ? 119.933 125.306 84.389  1.00 88.14  ? 273 LEU   R CA  1 
ATOM   1775 C C   . LEU   A 1 329 ? 120.686 124.583 83.278  1.00 93.27  ? 273 LEU   R C   1 
ATOM   1776 O O   . LEU   A 1 329 ? 120.077 124.068 82.331  1.00 100.02 ? 273 LEU   R O   1 
ATOM   1777 C CB  . LEU   A 1 329 ? 119.990 126.820 84.192  1.00 83.69  ? 273 LEU   R CB  1 
ATOM   1778 C CG  . LEU   A 1 329 ? 119.816 127.341 82.765  1.00 89.85  ? 273 LEU   R CG  1 
ATOM   1779 C CD1 . LEU   A 1 329 ? 118.473 126.914 82.200  1.00 91.04  ? 273 LEU   R CD1 1 
ATOM   1780 C CD2 . LEU   A 1 329 ? 119.952 128.853 82.740  1.00 91.72  ? 273 LEU   R CD2 1 
ATOM   1781 N N   . VAL   A 1 330 ? 122.015 124.522 83.379  1.00 89.23  ? 274 VAL   R N   1 
ATOM   1782 C CA  . VAL   A 1 330 ? 122.794 123.803 82.377  1.00 88.66  ? 274 VAL   R CA  1 
ATOM   1783 C C   . VAL   A 1 330 ? 122.508 122.311 82.446  1.00 96.12  ? 274 VAL   R C   1 
ATOM   1784 O O   . VAL   A 1 330 ? 122.493 121.625 81.417  1.00 97.69  ? 274 VAL   R O   1 
ATOM   1785 C CB  . VAL   A 1 330 ? 124.293 124.098 82.556  1.00 87.02  ? 274 VAL   R CB  1 
ATOM   1786 C CG1 . VAL   A 1 330 ? 125.121 123.164 81.692  1.00 90.91  ? 274 VAL   R CG1 1 
ATOM   1787 C CG2 . VAL   A 1 330 ? 124.583 125.546 82.213  1.00 92.50  ? 274 VAL   R CG2 1 
ATOM   1788 N N   . VAL   A 1 331 ? 122.288 121.779 83.648  1.00 94.59  ? 275 VAL   R N   1 
ATOM   1789 C CA  . VAL   A 1 331 ? 121.927 120.370 83.773  1.00 89.35  ? 275 VAL   R CA  1 
ATOM   1790 C C   . VAL   A 1 331 ? 120.593 120.106 83.088  1.00 84.79  ? 275 VAL   R C   1 
ATOM   1791 O O   . VAL   A 1 331 ? 120.405 119.075 82.436  1.00 92.11  ? 275 VAL   R O   1 
ATOM   1792 C CB  . VAL   A 1 331 ? 121.894 119.951 85.252  1.00 89.00  ? 275 VAL   R CB  1 
ATOM   1793 C CG1 . VAL   A 1 331 ? 121.081 118.678 85.429  1.00 92.46  ? 275 VAL   R CG1 1 
ATOM   1794 C CG2 . VAL   A 1 331 ? 123.301 119.753 85.767  1.00 88.82  ? 275 VAL   R CG2 1 
ATOM   1795 N N   . LEU   A 1 332 ? 119.641 121.024 83.244  1.00 85.35  ? 276 LEU   R N   1 
ATOM   1796 C CA  . LEU   A 1 332 ? 118.370 120.899 82.542  1.00 94.01  ? 276 LEU   R CA  1 
ATOM   1797 C C   . LEU   A 1 332 ? 118.557 120.955 81.034  1.00 95.02  ? 276 LEU   R C   1 
ATOM   1798 O O   . LEU   A 1 332 ? 117.891 120.213 80.306  1.00 97.08  ? 276 LEU   R O   1 
ATOM   1799 C CB  . LEU   A 1 332 ? 117.413 122.003 82.992  1.00 94.53  ? 276 LEU   R CB  1 
ATOM   1800 C CG  . LEU   A 1 332 ? 115.936 121.791 82.662  1.00 92.36  ? 276 LEU   R CG  1 
ATOM   1801 C CD1 . LEU   A 1 332 ? 115.277 120.910 83.708  1.00 92.75  ? 276 LEU   R CD1 1 
ATOM   1802 C CD2 . LEU   A 1 332 ? 115.218 123.124 82.552  1.00 93.55  ? 276 LEU   R CD2 1 
ATOM   1803 N N   . VAL   A 1 333 ? 119.447 121.819 80.552  1.00 107.03 ? 277 VAL   R N   1 
ATOM   1804 C CA  . VAL   A 1 333 ? 119.745 121.853 79.123  1.00 110.65 ? 277 VAL   R CA  1 
ATOM   1805 C C   . VAL   A 1 333 ? 120.315 120.516 78.663  1.00 110.88 ? 277 VAL   R C   1 
ATOM   1806 O O   . VAL   A 1 333 ? 119.961 120.008 77.593  1.00 111.52 ? 277 VAL   R O   1 
ATOM   1807 C CB  . VAL   A 1 333 ? 120.702 123.016 78.808  1.00 109.90 ? 277 VAL   R CB  1 
ATOM   1808 C CG1 . VAL   A 1 333 ? 121.311 122.849 77.422  1.00 108.48 ? 277 VAL   R CG1 1 
ATOM   1809 C CG2 . VAL   A 1 333 ? 119.972 124.340 78.915  1.00 109.50 ? 277 VAL   R CG2 1 
ATOM   1810 N N   . ASP   A 1 334 ? 121.216 119.934 79.452  1.00 114.11 ? 278 ASP   R N   1 
ATOM   1811 C CA  . ASP   A 1 334 ? 121.789 118.640 79.098  1.00 116.09 ? 278 ASP   R CA  1 
ATOM   1812 C C   . ASP   A 1 334 ? 120.728 117.544 79.091  1.00 117.11 ? 278 ASP   R C   1 
ATOM   1813 O O   . ASP   A 1 334 ? 120.743 116.668 78.220  1.00 118.02 ? 278 ASP   R O   1 
ATOM   1814 C CB  . ASP   A 1 334 ? 122.919 118.289 80.066  1.00 118.25 ? 278 ASP   R CB  1 
ATOM   1815 C CG  . ASP   A 1 334 ? 123.670 117.037 79.657  1.00 120.34 ? 278 ASP   R CG  1 
ATOM   1816 O OD1 . ASP   A 1 334 ? 124.126 116.969 78.497  1.00 118.77 ? 278 ASP   R OD1 1 
ATOM   1817 O OD2 . ASP   A 1 334 ? 123.812 116.126 80.499  1.00 118.65 ? 278 ASP   R OD2 1 
ATOM   1818 N N   . ILE   A 1 335 ? 119.807 117.571 80.056  1.00 107.35 ? 279 ILE   R N   1 
ATOM   1819 C CA  . ILE   A 1 335 ? 118.703 116.614 80.058  1.00 101.80 ? 279 ILE   R CA  1 
ATOM   1820 C C   . ILE   A 1 335 ? 117.872 116.775 78.796  1.00 104.29 ? 279 ILE   R C   1 
ATOM   1821 O O   . ILE   A 1 335 ? 117.470 115.790 78.165  1.00 107.95 ? 279 ILE   R O   1 
ATOM   1822 C CB  . ILE   A 1 335 ? 117.837 116.791 81.318  1.00 104.20 ? 279 ILE   R CB  1 
ATOM   1823 C CG1 . ILE   A 1 335 ? 118.584 116.304 82.556  1.00 107.79 ? 279 ILE   R CG1 1 
ATOM   1824 C CG2 . ILE   A 1 335 ? 116.517 116.053 81.162  1.00 103.68 ? 279 ILE   R CG2 1 
ATOM   1825 C CD1 . ILE   A 1 335 ? 117.940 116.736 83.855  1.00 107.04 ? 279 ILE   R CD1 1 
ATOM   1826 N N   . LEU   A 1 336 ? 117.584 118.021 78.421  1.00 119.06 ? 280 LEU   R N   1 
ATOM   1827 C CA  . LEU   A 1 336 ? 116.796 118.270 77.219  1.00 121.12 ? 280 LEU   R CA  1 
ATOM   1828 C C   . LEU   A 1 336 ? 117.505 117.724 75.987  1.00 119.21 ? 280 LEU   R C   1 
ATOM   1829 O O   . LEU   A 1 336 ? 116.876 117.130 75.105  1.00 118.75 ? 280 LEU   R O   1 
ATOM   1830 C CB  . LEU   A 1 336 ? 116.527 119.768 77.075  1.00 118.07 ? 280 LEU   R CB  1 
ATOM   1831 C CG  . LEU   A 1 336 ? 115.592 120.360 78.134  1.00 117.59 ? 280 LEU   R CG  1 
ATOM   1832 C CD1 . LEU   A 1 336 ? 115.756 121.864 78.220  1.00 116.41 ? 280 LEU   R CD1 1 
ATOM   1833 C CD2 . LEU   A 1 336 ? 114.146 120.001 77.840  1.00 117.47 ? 280 LEU   R CD2 1 
ATOM   1834 N N   . MET   A 1 337 ? 118.822 117.916 75.912  1.00 133.68 ? 281 MET   R N   1 
ATOM   1835 C CA  . MET   A 1 337 ? 119.586 117.340 74.810  1.00 135.19 ? 281 MET   R CA  1 
ATOM   1836 C C   . MET   A 1 337 ? 119.504 115.818 74.808  1.00 134.76 ? 281 MET   R C   1 
ATOM   1837 O O   . MET   A 1 337 ? 119.288 115.209 73.754  1.00 133.20 ? 281 MET   R O   1 
ATOM   1838 C CB  . MET   A 1 337 ? 121.047 117.782 74.895  1.00 137.91 ? 281 MET   R CB  1 
ATOM   1839 C CG  . MET   A 1 337 ? 121.387 119.002 74.055  1.00 139.03 ? 281 MET   R CG  1 
ATOM   1840 S SD  . MET   A 1 337 ? 123.129 119.456 74.170  1.00 143.44 ? 281 MET   R SD  1 
ATOM   1841 C CE  . MET   A 1 337 ? 123.727 118.919 72.570  1.00 133.82 ? 281 MET   R CE  1 
ATOM   1842 N N   . ASP   A 1 338 ? 119.670 115.191 75.974  1.00 137.99 ? 282 ASP   R N   1 
ATOM   1843 C CA  . ASP   A 1 338 ? 119.701 113.733 76.048  1.00 137.32 ? 282 ASP   R CA  1 
ATOM   1844 C C   . ASP   A 1 338 ? 118.353 113.115 75.698  1.00 137.19 ? 282 ASP   R C   1 
ATOM   1845 O O   . ASP   A 1 338 ? 118.301 112.077 75.029  1.00 136.00 ? 282 ASP   R O   1 
ATOM   1846 C CB  . ASP   A 1 338 ? 120.135 113.290 77.446  1.00 137.43 ? 282 ASP   R CB  1 
ATOM   1847 C CG  . ASP   A 1 338 ? 121.479 113.862 77.848  1.00 138.74 ? 282 ASP   R CG  1 
ATOM   1848 O OD1 . ASP   A 1 338 ? 122.096 114.568 77.022  1.00 140.19 ? 282 ASP   R OD1 1 
ATOM   1849 O OD2 . ASP   A 1 338 ? 121.918 113.608 78.989  1.00 136.93 ? 282 ASP   R OD2 1 
ATOM   1850 N N   . LEU   A 1 339 ? 117.256 113.728 76.139  1.00 131.24 ? 283 LEU   R N   1 
ATOM   1851 C CA  . LEU   A 1 339 ? 115.927 113.187 75.888  1.00 128.34 ? 283 LEU   R CA  1 
ATOM   1852 C C   . LEU   A 1 339 ? 115.427 113.469 74.478  1.00 128.41 ? 283 LEU   R C   1 
ATOM   1853 O O   . LEU   A 1 339 ? 114.303 113.074 74.149  1.00 127.23 ? 283 LEU   R O   1 
ATOM   1854 C CB  . LEU   A 1 339 ? 114.926 113.745 76.903  1.00 127.94 ? 283 LEU   R CB  1 
ATOM   1855 C CG  . LEU   A 1 339 ? 115.126 113.308 78.356  1.00 127.97 ? 283 LEU   R CG  1 
ATOM   1856 C CD1 . LEU   A 1 339 ? 114.248 114.131 79.286  1.00 124.98 ? 283 LEU   R CD1 1 
ATOM   1857 C CD2 . LEU   A 1 339 ? 114.837 111.825 78.519  1.00 126.61 ? 283 LEU   R CD2 1 
ATOM   1858 N N   . GLY   A 1 340 ? 116.219 114.136 73.646  1.00 135.32 ? 284 GLY   R N   1 
ATOM   1859 C CA  . GLY   A 1 340 ? 115.852 114.383 72.269  1.00 134.08 ? 284 GLY   R CA  1 
ATOM   1860 C C   . GLY   A 1 340 ? 115.239 115.736 71.987  1.00 135.14 ? 284 GLY   R C   1 
ATOM   1861 O O   . GLY   A 1 340 ? 114.749 115.950 70.873  1.00 135.11 ? 284 GLY   R O   1 
ATOM   1862 N N   . ALA   A 1 341 ? 115.249 116.655 72.954  1.00 135.61 ? 285 ALA   R N   1 
ATOM   1863 C CA  . ALA   A 1 341 ? 114.688 117.981 72.729  1.00 135.41 ? 285 ALA   R CA  1 
ATOM   1864 C C   . ALA   A 1 341 ? 115.622 118.889 71.941  1.00 134.54 ? 285 ALA   R C   1 
ATOM   1865 O O   . ALA   A 1 341 ? 115.205 119.987 71.556  1.00 133.25 ? 285 ALA   R O   1 
ATOM   1866 C CB  . ALA   A 1 341 ? 114.345 118.636 74.068  1.00 133.98 ? 285 ALA   R CB  1 
ATOM   1867 N N   . LEU   A 1 342 ? 116.860 118.467 71.694  1.00 139.27 ? 286 LEU   R N   1 
ATOM   1868 C CA  . LEU   A 1 342 ? 117.820 119.283 70.967  1.00 139.69 ? 286 LEU   R CA  1 
ATOM   1869 C C   . LEU   A 1 342 ? 118.697 118.371 70.121  1.00 140.69 ? 286 LEU   R C   1 
ATOM   1870 O O   . LEU   A 1 342 ? 118.683 117.147 70.270  1.00 141.46 ? 286 LEU   R O   1 
ATOM   1871 C CB  . LEU   A 1 342 ? 118.666 120.132 71.924  1.00 139.67 ? 286 LEU   R CB  1 
ATOM   1872 C CG  . LEU   A 1 342 ? 117.918 121.264 72.636  1.00 140.76 ? 286 LEU   R CG  1 
ATOM   1873 C CD1 . LEU   A 1 342 ? 118.657 121.706 73.890  1.00 140.51 ? 286 LEU   R CD1 1 
ATOM   1874 C CD2 . LEU   A 1 342 ? 117.712 122.441 71.697  1.00 139.20 ? 286 LEU   R CD2 1 
ATOM   1875 N N   . ALA   A 1 343 ? 119.464 118.985 69.222  1.00 142.79 ? 287 ALA   R N   1 
ATOM   1876 C CA  . ALA   A 1 343 ? 120.326 118.271 68.287  1.00 142.73 ? 287 ALA   R CA  1 
ATOM   1877 C C   . ALA   A 1 343 ? 121.756 118.292 68.810  1.00 141.93 ? 287 ALA   R C   1 
ATOM   1878 O O   . ALA   A 1 343 ? 122.252 119.343 69.230  1.00 140.60 ? 287 ALA   R O   1 
ATOM   1879 C CB  . ALA   A 1 343 ? 120.256 118.894 66.893  1.00 141.50 ? 287 ALA   R CB  1 
ATOM   1880 N N   . ARG   A 1 344 ? 122.412 117.134 68.780  1.00 142.49 ? 288 ARG   R N   1 
ATOM   1881 C CA  . ARG   A 1 344 ? 123.765 117.007 69.305  1.00 141.93 ? 288 ARG   R CA  1 
ATOM   1882 C C   . ARG   A 1 344 ? 124.796 117.396 68.252  1.00 142.38 ? 288 ARG   R C   1 
ATOM   1883 O O   . ARG   A 1 344 ? 124.610 117.136 67.059  1.00 141.41 ? 288 ARG   R O   1 
ATOM   1884 C CB  . ARG   A 1 344 ? 124.020 115.575 69.773  1.00 140.28 ? 288 ARG   R CB  1 
ATOM   1885 C CG  . ARG   A 1 344 ? 123.281 115.183 71.043  1.00 138.06 ? 288 ARG   R CG  1 
ATOM   1886 C CD  . ARG   A 1 344 ? 123.949 113.992 71.718  1.00 139.26 ? 288 ARG   R CD  1 
ATOM   1887 N NE  . ARG   A 1 344 ? 123.738 113.983 73.161  1.00 140.25 ? 288 ARG   R NE  1 
ATOM   1888 C CZ  . ARG   A 1 344 ? 123.050 113.064 73.827  1.00 140.75 ? 288 ARG   R CZ  1 
ATOM   1889 N NH1 . ARG   A 1 344 ? 122.460 112.052 73.211  1.00 141.54 ? 288 ARG   R NH1 1 
ATOM   1890 N NH2 . ARG   A 1 344 ? 122.949 113.164 75.149  1.00 142.90 ? 288 ARG   R NH2 1 
ATOM   1891 N N   . ASN   A 1 345 ? 125.883 118.021 68.701  1.00 144.26 ? 289 ASN   R N   1 
ATOM   1892 C CA  . ASN   A 1 345 ? 127.027 118.318 67.853  1.00 143.15 ? 289 ASN   R CA  1 
ATOM   1893 C C   . ASN   A 1 345 ? 128.253 118.519 68.734  1.00 141.94 ? 289 ASN   R C   1 
ATOM   1894 O O   . ASN   A 1 345 ? 128.144 118.772 69.937  1.00 140.41 ? 289 ASN   R O   1 
ATOM   1895 C CB  . ASN   A 1 345 ? 126.783 119.553 66.977  1.00 142.13 ? 289 ASN   R CB  1 
ATOM   1896 C CG  . ASN   A 1 345 ? 126.358 120.762 67.781  1.00 142.11 ? 289 ASN   R CG  1 
ATOM   1897 O OD1 . ASN   A 1 345 ? 127.157 121.661 68.044  1.00 140.14 ? 289 ASN   R OD1 1 
ATOM   1898 N ND2 . ASN   A 1 345 ? 125.088 120.795 68.169  1.00 143.04 ? 289 ASN   R ND2 1 
ATOM   1899 N N   . CYS   A 1 346 ? 129.431 118.403 68.118  1.00 144.25 ? 290 CYS   R N   1 
ATOM   1900 C CA  . CYS   A 1 346 ? 130.675 118.478 68.879  1.00 144.22 ? 290 CYS   R CA  1 
ATOM   1901 C C   . CYS   A 1 346 ? 130.821 119.831 69.565  1.00 143.51 ? 290 CYS   R C   1 
ATOM   1902 O O   . CYS   A 1 346 ? 131.186 119.908 70.745  1.00 143.76 ? 290 CYS   R O   1 
ATOM   1903 C CB  . CYS   A 1 346 ? 131.866 118.209 67.958  1.00 144.70 ? 290 CYS   R CB  1 
ATOM   1904 S SG  . CYS   A 1 346 ? 132.017 116.491 67.409  1.00 143.69 ? 290 CYS   R SG  1 
ATOM   1905 N N   . GLY   A 1 347 ? 130.542 120.914 68.837  1.00 134.22 ? 291 GLY   R N   1 
ATOM   1906 C CA  . GLY   A 1 347 ? 130.660 122.235 69.432  1.00 132.89 ? 291 GLY   R CA  1 
ATOM   1907 C C   . GLY   A 1 347 ? 129.749 122.409 70.630  1.00 133.67 ? 291 GLY   R C   1 
ATOM   1908 O O   . GLY   A 1 347 ? 130.166 122.923 71.672  1.00 131.19 ? 291 GLY   R O   1 
ATOM   1909 N N   . ARG   A 1 348 ? 128.494 121.977 70.503  1.00 137.95 ? 292 ARG   R N   1 
ATOM   1910 C CA  . ARG   A 1 348 ? 127.576 122.059 71.631  1.00 138.55 ? 292 ARG   R CA  1 
ATOM   1911 C C   . ARG   A 1 348 ? 128.049 121.185 72.784  1.00 136.14 ? 292 ARG   R C   1 
ATOM   1912 O O   . ARG   A 1 348 ? 127.913 121.565 73.951  1.00 135.31 ? 292 ARG   R O   1 
ATOM   1913 C CB  . ARG   A 1 348 ? 126.166 121.663 71.195  1.00 139.40 ? 292 ARG   R CB  1 
ATOM   1914 C CG  . ARG   A 1 348 ? 125.060 122.265 72.054  1.00 138.78 ? 292 ARG   R CG  1 
ATOM   1915 C CD  . ARG   A 1 348 ? 124.335 123.389 71.328  1.00 138.52 ? 292 ARG   R CD  1 
ATOM   1916 N NE  . ARG   A 1 348 ? 123.339 122.888 70.388  1.00 138.51 ? 292 ARG   R NE  1 
ATOM   1917 C CZ  . ARG   A 1 348 ? 122.073 122.635 70.693  1.00 137.93 ? 292 ARG   R CZ  1 
ATOM   1918 N NH1 . ARG   A 1 348 ? 121.602 122.824 71.915  1.00 137.41 ? 292 ARG   R NH1 1 
ATOM   1919 N NH2 . ARG   A 1 348 ? 121.257 122.179 69.747  1.00 137.71 ? 292 ARG   R NH2 1 
ATOM   1920 N N   . GLU   A 1 349 ? 128.600 120.008 72.482  1.00 125.04 ? 293 GLU   R N   1 
ATOM   1921 C CA  . GLU   A 1 349 ? 129.105 119.144 73.543  1.00 124.02 ? 293 GLU   R CA  1 
ATOM   1922 C C   . GLU   A 1 349 ? 130.209 119.842 74.325  1.00 125.18 ? 293 GLU   R C   1 
ATOM   1923 O O   . GLU   A 1 349 ? 130.220 119.824 75.562  1.00 127.09 ? 293 GLU   R O   1 
ATOM   1924 C CB  . GLU   A 1 349 ? 129.611 117.827 72.949  1.00 124.91 ? 293 GLU   R CB  1 
ATOM   1925 C CG  . GLU   A 1 349 ? 130.272 116.878 73.955  1.00 123.96 ? 293 GLU   R CG  1 
ATOM   1926 C CD  . GLU   A 1 349 ? 131.332 115.991 73.326  1.00 124.71 ? 293 GLU   R CD  1 
ATOM   1927 O OE1 . GLU   A 1 349 ? 131.520 116.058 72.093  1.00 124.60 ? 293 GLU   R OE1 1 
ATOM   1928 O OE2 . GLU   A 1 349 ? 131.979 115.224 74.068  1.00 124.61 ? 293 GLU   R OE2 1 
ATOM   1929 N N   . SER   A 1 350 ? 131.155 120.461 73.616  1.00 125.01 ? 294 SER   R N   1 
ATOM   1930 C CA  . SER   A 1 350 ? 132.239 121.165 74.293  1.00 123.29 ? 294 SER   R CA  1 
ATOM   1931 C C   . SER   A 1 350 ? 131.721 122.355 75.089  1.00 122.83 ? 294 SER   R C   1 
ATOM   1932 O O   . SER   A 1 350 ? 132.182 122.601 76.214  1.00 122.61 ? 294 SER   R O   1 
ATOM   1933 C CB  . SER   A 1 350 ? 133.281 121.619 73.273  1.00 122.43 ? 294 SER   R CB  1 
ATOM   1934 O OG  . SER   A 1 350 ? 133.831 120.510 72.583  1.00 121.80 ? 294 SER   R OG  1 
ATOM   1935 N N   . ARG   A 1 351 ? 130.772 123.105 74.526  1.00 116.51 ? 295 ARG   R N   1 
ATOM   1936 C CA  . ARG   A 1 351 ? 130.180 124.214 75.264  1.00 116.02 ? 295 ARG   R CA  1 
ATOM   1937 C C   . ARG   A 1 351 ? 129.539 123.719 76.552  1.00 116.00 ? 295 ARG   R C   1 
ATOM   1938 O O   . ARG   A 1 351 ? 129.724 124.313 77.620  1.00 115.55 ? 295 ARG   R O   1 
ATOM   1939 C CB  . ARG   A 1 351 ? 129.150 124.933 74.393  1.00 116.07 ? 295 ARG   R CB  1 
ATOM   1940 C CG  . ARG   A 1 351 ? 129.741 125.655 73.193  1.00 116.57 ? 295 ARG   R CG  1 
ATOM   1941 C CD  . ARG   A 1 351 ? 128.654 126.224 72.293  1.00 118.00 ? 295 ARG   R CD  1 
ATOM   1942 N NE  . ARG   A 1 351 ? 128.461 127.654 72.513  1.00 121.97 ? 295 ARG   R NE  1 
ATOM   1943 C CZ  . ARG   A 1 351 ? 127.285 128.256 72.645  1.00 121.04 ? 295 ARG   R CZ  1 
ATOM   1944 N NH1 . ARG   A 1 351 ? 126.146 127.587 72.559  1.00 121.19 ? 295 ARG   R NH1 1 
ATOM   1945 N NH2 . ARG   A 1 351 ? 127.251 129.567 72.863  1.00 118.63 ? 295 ARG   R NH2 1 
ATOM   1946 N N   . VAL   A 1 352 ? 128.789 122.619 76.471  1.00 108.85 ? 296 VAL   R N   1 
ATOM   1947 C CA  . VAL   A 1 352 ? 128.126 122.076 77.652  1.00 106.64 ? 296 VAL   R CA  1 
ATOM   1948 C C   . VAL   A 1 352 ? 129.155 121.642 78.682  1.00 105.95 ? 296 VAL   R C   1 
ATOM   1949 O O   . VAL   A 1 352 ? 128.991 121.882 79.881  1.00 104.33 ? 296 VAL   R O   1 
ATOM   1950 C CB  . VAL   A 1 352 ? 127.198 120.913 77.256  1.00 105.83 ? 296 VAL   R CB  1 
ATOM   1951 C CG1 . VAL   A 1 352 ? 126.837 120.081 78.474  1.00 105.50 ? 296 VAL   R CG1 1 
ATOM   1952 C CG2 . VAL   A 1 352 ? 125.944 121.443 76.583  1.00 106.96 ? 296 VAL   R CG2 1 
ATOM   1953 N N   . ASP   A 1 353 ? 130.224 120.984 78.235  1.00 113.62 ? 297 ASP   R N   1 
ATOM   1954 C CA  . ASP   A 1 353 ? 131.241 120.518 79.172  1.00 112.35 ? 297 ASP   R CA  1 
ATOM   1955 C C   . ASP   A 1 353 ? 131.885 121.685 79.912  1.00 112.42 ? 297 ASP   R C   1 
ATOM   1956 O O   . ASP   A 1 353 ? 131.999 121.669 81.146  1.00 112.93 ? 297 ASP   R O   1 
ATOM   1957 C CB  . ASP   A 1 353 ? 132.300 119.705 78.430  1.00 114.29 ? 297 ASP   R CB  1 
ATOM   1958 C CG  . ASP   A 1 353 ? 133.139 118.855 79.361  1.00 115.73 ? 297 ASP   R CG  1 
ATOM   1959 O OD1 . ASP   A 1 353 ? 132.560 118.008 80.075  1.00 116.00 ? 297 ASP   R OD1 1 
ATOM   1960 O OD2 . ASP   A 1 353 ? 134.375 119.035 79.380  1.00 113.49 ? 297 ASP   R OD2 1 
ATOM   1961 N N   . VAL   A 1 354 ? 132.310 122.713 79.175  1.00 104.96 ? 298 VAL   R N   1 
ATOM   1962 C CA  . VAL   A 1 354 ? 132.964 123.840 79.832  1.00 101.11 ? 298 VAL   R CA  1 
ATOM   1963 C C   . VAL   A 1 354 ? 131.983 124.577 80.733  1.00 101.68 ? 298 VAL   R C   1 
ATOM   1964 O O   . VAL   A 1 354 ? 132.349 125.023 81.830  1.00 105.76 ? 298 VAL   R O   1 
ATOM   1965 C CB  . VAL   A 1 354 ? 133.593 124.782 78.791  1.00 102.17 ? 298 VAL   R CB  1 
ATOM   1966 C CG1 . VAL   A 1 354 ? 134.286 125.940 79.481  1.00 105.67 ? 298 VAL   R CG1 1 
ATOM   1967 C CG2 . VAL   A 1 354 ? 134.581 124.025 77.921  1.00 103.35 ? 298 VAL   R CG2 1 
ATOM   1968 N N   . ALA   A 1 355 ? 130.730 124.724 80.298  1.00 97.73  ? 299 ALA   R N   1 
ATOM   1969 C CA  . ALA   A 1 355 ? 129.737 125.392 81.127  1.00 99.88  ? 299 ALA   R CA  1 
ATOM   1970 C C   . ALA   A 1 355 ? 129.505 124.623 82.418  1.00 100.57 ? 299 ALA   R C   1 
ATOM   1971 O O   . ALA   A 1 355 ? 129.387 125.217 83.493  1.00 102.73 ? 299 ALA   R O   1 
ATOM   1972 C CB  . ALA   A 1 355 ? 128.432 125.551 80.351  1.00 103.36 ? 299 ALA   R CB  1 
ATOM   1973 N N   . LYS   A 1 356 ? 129.431 123.293 82.330  1.00 97.37  ? 300 LYS   R N   1 
ATOM   1974 C CA  . LYS   A 1 356 ? 129.271 122.486 83.532  1.00 96.52  ? 300 LYS   R CA  1 
ATOM   1975 C C   . LYS   A 1 356 ? 130.459 122.660 84.462  1.00 95.76  ? 300 LYS   R C   1 
ATOM   1976 O O   . LYS   A 1 356 ? 130.289 122.799 85.677  1.00 96.13  ? 300 LYS   R O   1 
ATOM   1977 C CB  . LYS   A 1 356 ? 129.102 121.014 83.165  1.00 93.82  ? 300 LYS   R CB  1 
ATOM   1978 C CG  . LYS   A 1 356 ? 127.718 120.647 82.673  1.00 95.94  ? 300 LYS   R CG  1 
ATOM   1979 C CD  . LYS   A 1 356 ? 127.265 119.323 83.257  1.00 94.63  ? 300 LYS   R CD  1 
ATOM   1980 C CE  . LYS   A 1 356 ? 126.144 118.715 82.436  1.00 97.58  ? 300 LYS   R CE  1 
ATOM   1981 N NZ  . LYS   A 1 356 ? 126.660 117.850 81.339  1.00 99.03  ? 300 LYS   R NZ  1 
ATOM   1982 N N   . SER   A 1 357 ? 131.672 122.664 83.911  1.00 90.85  ? 301 SER   R N   1 
ATOM   1983 C CA  . SER   A 1 357 ? 132.854 122.861 84.742  1.00 89.78  ? 301 SER   R CA  1 
ATOM   1984 C C   . SER   A 1 357 ? 132.774 124.183 85.499  1.00 92.87  ? 301 SER   R C   1 
ATOM   1985 O O   . SER   A 1 357 ? 132.914 124.231 86.729  1.00 98.57  ? 301 SER   R O   1 
ATOM   1986 C CB  . SER   A 1 357 ? 134.108 122.813 83.870  1.00 92.85  ? 301 SER   R CB  1 
ATOM   1987 O OG  . SER   A 1 357 ? 133.963 121.859 82.834  1.00 99.36  ? 301 SER   R OG  1 
ATOM   1988 N N   . VAL   A 1 358 ? 132.529 125.272 84.768  1.00 81.74  ? 302 VAL   R N   1 
ATOM   1989 C CA  . VAL   A 1 358 ? 132.531 126.595 85.386  1.00 74.30  ? 302 VAL   R CA  1 
ATOM   1990 C C   . VAL   A 1 358 ? 131.406 126.713 86.406  1.00 80.39  ? 302 VAL   R C   1 
ATOM   1991 O O   . VAL   A 1 358 ? 131.596 127.247 87.506  1.00 83.35  ? 302 VAL   R O   1 
ATOM   1992 C CB  . VAL   A 1 358 ? 132.430 127.686 84.306  1.00 72.61  ? 302 VAL   R CB  1 
ATOM   1993 C CG1 . VAL   A 1 358 ? 132.326 129.053 84.948  1.00 80.16  ? 302 VAL   R CG1 1 
ATOM   1994 C CG2 . VAL   A 1 358 ? 133.627 127.624 83.377  1.00 76.01  ? 302 VAL   R CG2 1 
ATOM   1995 N N   . THR   A 1 359 ? 130.214 126.227 86.058  1.00 93.21  ? 303 THR   R N   1 
ATOM   1996 C CA  . THR   A 1 359 ? 129.079 126.347 86.962  1.00 93.09  ? 303 THR   R CA  1 
ATOM   1997 C C   . THR   A 1 359 ? 129.278 125.503 88.212  1.00 93.18  ? 303 THR   R C   1 
ATOM   1998 O O   . THR   A 1 359 ? 128.875 125.908 89.305  1.00 92.59  ? 303 THR   R O   1 
ATOM   1999 C CB  . THR   A 1 359 ? 127.793 125.947 86.243  1.00 93.29  ? 303 THR   R CB  1 
ATOM   2000 O OG1 . THR   A 1 359 ? 127.938 124.632 85.693  1.00 98.81  ? 303 THR   R OG1 1 
ATOM   2001 C CG2 . THR   A 1 359 ? 127.475 126.930 85.128  1.00 90.15  ? 303 THR   R CG2 1 
ATOM   2002 N N   . SER   A 1 360 ? 129.892 124.327 88.079  1.00 92.71  ? 304 SER   R N   1 
ATOM   2003 C CA  . SER   A 1 360 ? 130.197 123.525 89.257  1.00 91.93  ? 304 SER   R CA  1 
ATOM   2004 C C   . SER   A 1 360 ? 131.204 124.232 90.153  1.00 93.46  ? 304 SER   R C   1 
ATOM   2005 O O   . SER   A 1 360 ? 131.085 124.197 91.385  1.00 101.36 ? 304 SER   R O   1 
ATOM   2006 C CB  . SER   A 1 360 ? 130.727 122.160 88.830  1.00 95.95  ? 304 SER   R CB  1 
ATOM   2007 O OG  . SER   A 1 360 ? 132.036 122.275 88.307  1.00 96.34  ? 304 SER   R OG  1 
ATOM   2008 N N   . GLY   A 1 361 ? 132.213 124.861 89.556  1.00 90.93  ? 305 GLY   R N   1 
ATOM   2009 C CA  . GLY   A 1 361 ? 133.151 125.636 90.346  1.00 92.78  ? 305 GLY   R CA  1 
ATOM   2010 C C   . GLY   A 1 361 ? 132.436 126.719 91.127  1.00 95.12  ? 305 GLY   R C   1 
ATOM   2011 O O   . GLY   A 1 361 ? 132.653 126.894 92.333  1.00 96.61  ? 305 GLY   R O   1 
ATOM   2012 N N   . LEU   A 1 362 ? 131.551 127.442 90.440  1.00 90.66  ? 306 LEU   R N   1 
ATOM   2013 C CA  . LEU   A 1 362 ? 130.785 128.489 91.107  1.00 89.27  ? 306 LEU   R CA  1 
ATOM   2014 C C   . LEU   A 1 362 ? 129.922 127.910 92.220  1.00 94.57  ? 306 LEU   R C   1 
ATOM   2015 O O   . LEU   A 1 362 ? 129.776 128.517 93.286  1.00 93.71  ? 306 LEU   R O   1 
ATOM   2016 C CB  . LEU   A 1 362 ? 129.922 129.237 90.090  1.00 83.61  ? 306 LEU   R CB  1 
ATOM   2017 C CG  . LEU   A 1 362 ? 128.937 130.252 90.669  1.00 86.08  ? 306 LEU   R CG  1 
ATOM   2018 C CD1 . LEU   A 1 362 ? 129.648 131.243 91.570  1.00 84.20  ? 306 LEU   R CD1 1 
ATOM   2019 C CD2 . LEU   A 1 362 ? 128.210 130.979 89.554  1.00 90.21  ? 306 LEU   R CD2 1 
ATOM   2020 N N   . GLY   A 1 363 ? 129.340 126.733 91.989  1.00 97.92  ? 307 GLY   R N   1 
ATOM   2021 C CA  . GLY   A 1 363 ? 128.495 126.123 92.999  1.00 93.51  ? 307 GLY   R CA  1 
ATOM   2022 C C   . GLY   A 1 363 ? 129.258 125.751 94.255  1.00 92.58  ? 307 GLY   R C   1 
ATOM   2023 O O   . GLY   A 1 363 ? 128.807 126.026 95.368  1.00 97.73  ? 307 GLY   R O   1 
ATOM   2024 N N   . TYR   A 1 364 ? 130.421 125.125 94.099  1.00 90.32  ? 308 TYR   R N   1 
ATOM   2025 C CA  . TYR   A 1 364 ? 131.238 124.824 95.268  1.00 89.21  ? 308 TYR   R CA  1 
ATOM   2026 C C   . TYR   A 1 364 ? 131.787 126.083 95.923  1.00 95.64  ? 308 TYR   R C   1 
ATOM   2027 O O   . TYR   A 1 364 ? 132.095 126.064 97.123  1.00 101.33 ? 308 TYR   R O   1 
ATOM   2028 C CB  . TYR   A 1 364 ? 132.385 123.881 94.898  1.00 90.59  ? 308 TYR   R CB  1 
ATOM   2029 C CG  . TYR   A 1 364 ? 131.966 122.745 93.994  1.00 95.44  ? 308 TYR   R CG  1 
ATOM   2030 C CD1 . TYR   A 1 364 ? 130.813 122.018 94.251  1.00 95.17  ? 308 TYR   R CD1 1 
ATOM   2031 C CD2 . TYR   A 1 364 ? 132.724 122.399 92.885  1.00 97.11  ? 308 TYR   R CD2 1 
ATOM   2032 C CE1 . TYR   A 1 364 ? 130.424 120.984 93.426  1.00 94.82  ? 308 TYR   R CE1 1 
ATOM   2033 C CE2 . TYR   A 1 364 ? 132.342 121.366 92.056  1.00 96.95  ? 308 TYR   R CE2 1 
ATOM   2034 C CZ  . TYR   A 1 364 ? 131.193 120.663 92.331  1.00 96.09  ? 308 TYR   R CZ  1 
ATOM   2035 O OH  . TYR   A 1 364 ? 130.813 119.633 91.507  1.00 92.43  ? 308 TYR   R OH  1 
ATOM   2036 N N   . MET   A 1 365 ? 131.896 127.185 95.179  1.00 93.24  ? 309 MET   R N   1 
ATOM   2037 C CA  . MET   A 1 365 ? 132.204 128.449 95.832  1.00 92.55  ? 309 MET   R CA  1 
ATOM   2038 C C   . MET   A 1 365 ? 131.156 128.814 96.876  1.00 91.24  ? 309 MET   R C   1 
ATOM   2039 O O   . MET   A 1 365 ? 131.480 129.510 97.841  1.00 91.78  ? 309 MET   R O   1 
ATOM   2040 C CB  . MET   A 1 365 ? 132.326 129.574 94.804  1.00 95.77  ? 309 MET   R CB  1 
ATOM   2041 C CG  . MET   A 1 365 ? 133.430 130.570 95.133  1.00 96.68  ? 309 MET   R CG  1 
ATOM   2042 S SD  . MET   A 1 365 ? 133.366 132.086 94.160  1.00 103.73 ? 309 MET   R SD  1 
ATOM   2043 C CE  . MET   A 1 365 ? 133.199 131.427 92.505  1.00 99.07  ? 309 MET   R CE  1 
ATOM   2044 N N   . HIS   A 1 366 ? 129.914 128.352 96.722  1.00 89.49  ? 310 HIS   R N   1 
ATOM   2045 C CA  . HIS   A 1 366 ? 128.904 128.618 97.741  1.00 89.89  ? 310 HIS   R CA  1 
ATOM   2046 C C   . HIS   A 1 366 ? 129.198 127.886 99.041  1.00 88.59  ? 310 HIS   R C   1 
ATOM   2047 O O   . HIS   A 1 366 ? 129.039 128.463 100.123 1.00 90.63  ? 310 HIS   R O   1 
ATOM   2048 C CB  . HIS   A 1 366 ? 127.520 128.224 97.233  1.00 88.32  ? 310 HIS   R CB  1 
ATOM   2049 C CG  . HIS   A 1 366 ? 126.438 128.390 98.252  1.00 88.51  ? 310 HIS   R CG  1 
ATOM   2050 N ND1 . HIS   A 1 366 ? 125.549 127.385 98.565  1.00 93.60  ? 310 HIS   R ND1 1 
ATOM   2051 C CD2 . HIS   A 1 366 ? 126.106 129.443 99.035  1.00 89.96  ? 310 HIS   R CD2 1 
ATOM   2052 C CE1 . HIS   A 1 366 ? 124.714 127.813 99.493  1.00 94.52  ? 310 HIS   R CE1 1 
ATOM   2053 N NE2 . HIS   A 1 366 ? 125.030 129.059 99.796  1.00 88.61  ? 310 HIS   R NE2 1 
ATOM   2054 N N   . CYS   A 1 367 ? 129.600 126.618 98.966  1.00 90.92  ? 311 CYS   R N   1 
ATOM   2055 C CA  . CYS   A 1 367 ? 130.026 125.920 100.170 1.00 92.78  ? 311 CYS   R CA  1 
ATOM   2056 C C   . CYS   A 1 367 ? 131.301 126.519 100.737 1.00 92.74  ? 311 CYS   R C   1 
ATOM   2057 O O   . CYS   A 1 367 ? 131.556 126.389 101.939 1.00 92.62  ? 311 CYS   R O   1 
ATOM   2058 C CB  . CYS   A 1 367 ? 130.219 124.434 99.875  1.00 88.97  ? 311 CYS   R CB  1 
ATOM   2059 S SG  . CYS   A 1 367 ? 128.668 123.572 99.542  1.00 102.25 ? 311 CYS   R SG  1 
ATOM   2060 N N   . CYS   A 1 368 ? 132.108 127.165 99.897  1.00 98.12  ? 312 CYS   R N   1 
ATOM   2061 C CA  . CYS   A 1 368 ? 133.237 127.932 100.414 1.00 98.98  ? 312 CYS   R CA  1 
ATOM   2062 C C   . CYS   A 1 368 ? 132.776 129.173 101.176 1.00 97.55  ? 312 CYS   R C   1 
ATOM   2063 O O   . CYS   A 1 368 ? 133.366 129.529 102.200 1.00 93.91  ? 312 CYS   R O   1 
ATOM   2064 C CB  . CYS   A 1 368 ? 134.165 128.334 99.272  1.00 101.77 ? 312 CYS   R CB  1 
ATOM   2065 S SG  . CYS   A 1 368 ? 135.671 129.170 99.808  1.00 121.70 ? 312 CYS   R SG  1 
ATOM   2066 N N   . LEU   A 1 369 ? 131.738 129.847 100.683 1.00 90.46  ? 313 LEU   R N   1 
ATOM   2067 C CA  . LEU   A 1 369 ? 131.245 131.085 101.279 1.00 87.90  ? 313 LEU   R CA  1 
ATOM   2068 C C   . LEU   A 1 369 ? 130.304 130.867 102.456 1.00 84.20  ? 313 LEU   R C   1 
ATOM   2069 O O   . LEU   A 1 369 ? 129.995 131.833 103.161 1.00 79.32  ? 313 LEU   R O   1 
ATOM   2070 C CB  . LEU   A 1 369 ? 130.509 131.928 100.231 1.00 87.64  ? 313 LEU   R CB  1 
ATOM   2071 C CG  . LEU   A 1 369 ? 131.291 132.478 99.037  1.00 88.84  ? 313 LEU   R CG  1 
ATOM   2072 C CD1 . LEU   A 1 369 ? 130.599 133.720 98.502  1.00 86.10  ? 313 LEU   R CD1 1 
ATOM   2073 C CD2 . LEU   A 1 369 ? 132.737 132.782 99.399  1.00 86.75  ? 313 LEU   R CD2 1 
ATOM   2074 N N   . ASN   A 1 370 ? 129.834 129.643 102.679 1.00 89.28  ? 314 ASN   R N   1 
ATOM   2075 C CA  . ASN   A 1 370 ? 128.892 129.415 103.773 1.00 91.50  ? 314 ASN   R CA  1 
ATOM   2076 C C   . ASN   A 1 370 ? 129.344 130.038 105.087 1.00 86.29  ? 314 ASN   R C   1 
ATOM   2077 O O   . ASN   A 1 370 ? 128.505 130.658 105.762 1.00 80.18  ? 314 ASN   R O   1 
ATOM   2078 C CB  . ASN   A 1 370 ? 128.656 127.911 103.956 1.00 89.79  ? 314 ASN   R CB  1 
ATOM   2079 C CG  . ASN   A 1 370 ? 127.547 127.378 103.069 1.00 87.10  ? 314 ASN   R CG  1 
ATOM   2080 O OD1 . ASN   A 1 370 ? 126.887 128.132 102.356 1.00 85.83  ? 314 ASN   R OD1 1 
ATOM   2081 N ND2 . ASN   A 1 370 ? 127.334 126.069 103.112 1.00 86.12  ? 314 ASN   R ND2 1 
ATOM   2082 N N   . PRO   A 1 371 ? 130.604 129.920 105.510 1.00 77.72  ? 315 PRO   R N   1 
ATOM   2083 C CA  . PRO   A 1 371 ? 131.003 130.562 106.772 1.00 71.25  ? 315 PRO   R CA  1 
ATOM   2084 C C   . PRO   A 1 371 ? 130.790 132.062 106.780 1.00 78.55  ? 315 PRO   R C   1 
ATOM   2085 O O   . PRO   A 1 371 ? 130.461 132.629 107.828 1.00 78.41  ? 315 PRO   R O   1 
ATOM   2086 C CB  . PRO   A 1 371 ? 132.492 130.209 106.888 1.00 70.75  ? 315 PRO   R CB  1 
ATOM   2087 C CG  . PRO   A 1 371 ? 132.668 129.006 106.041 1.00 75.57  ? 315 PRO   R CG  1 
ATOM   2088 C CD  . PRO   A 1 371 ? 131.714 129.171 104.904 1.00 78.51  ? 315 PRO   R CD  1 
ATOM   2089 N N   . LEU   A 1 372 ? 130.966 132.725 105.642 1.00 84.20  ? 316 LEU   R N   1 
ATOM   2090 C CA  . LEU   A 1 372 ? 130.888 134.176 105.571 1.00 78.90  ? 316 LEU   R CA  1 
ATOM   2091 C C   . LEU   A 1 372 ? 129.461 134.702 105.621 1.00 80.71  ? 316 LEU   R C   1 
ATOM   2092 O O   . LEU   A 1 372 ? 129.270 135.905 105.818 1.00 79.79  ? 316 LEU   R O   1 
ATOM   2093 C CB  . LEU   A 1 372 ? 131.568 134.665 104.289 1.00 77.44  ? 316 LEU   R CB  1 
ATOM   2094 C CG  . LEU   A 1 372 ? 132.202 136.056 104.322 1.00 81.74  ? 316 LEU   R CG  1 
ATOM   2095 C CD1 . LEU   A 1 372 ? 133.270 136.162 103.248 1.00 86.02  ? 316 LEU   R CD1 1 
ATOM   2096 C CD2 . LEU   A 1 372 ? 131.161 137.153 104.150 1.00 81.31  ? 316 LEU   R CD2 1 
ATOM   2097 N N   . LEU   A 1 373 ? 128.458 133.839 105.464 1.00 73.10  ? 317 LEU   R N   1 
ATOM   2098 C CA  . LEU   A 1 373 ? 127.061 134.256 105.466 1.00 71.66  ? 317 LEU   R CA  1 
ATOM   2099 C C   . LEU   A 1 373 ? 126.358 133.775 106.730 1.00 73.04  ? 317 LEU   R C   1 
ATOM   2100 O O   . LEU   A 1 373 ? 125.775 134.580 107.457 1.00 72.24  ? 317 LEU   R O   1 
ATOM   2101 C CB  . LEU   A 1 373 ? 126.346 133.730 104.221 1.00 65.09  ? 317 LEU   R CB  1 
ATOM   2102 C CG  . LEU   A 1 373 ? 126.595 134.463 102.905 1.00 66.80  ? 317 LEU   R CG  1 
ATOM   2103 C CD1 . LEU   A 1 373 ? 125.917 133.725 101.768 1.00 68.86  ? 317 LEU   R CD1 1 
ATOM   2104 C CD2 . LEU   A 1 373 ? 126.103 135.898 102.977 1.00 68.84  ? 317 LEU   R CD2 1 
ATOM   2105 N N   . TYR   A 1 374 ? 126.401 132.478 107.014 1.00 69.49  ? 318 TYR   R N   1 
ATOM   2106 C CA  . TYR   A 1 374 ? 125.627 131.918 108.111 1.00 68.54  ? 318 TYR   R CA  1 
ATOM   2107 C C   . TYR   A 1 374 ? 126.347 131.980 109.448 1.00 68.34  ? 318 TYR   R C   1 
ATOM   2108 O O   . TYR   A 1 374 ? 125.684 131.841 110.482 1.00 63.27  ? 318 TYR   R O   1 
ATOM   2109 C CB  . TYR   A 1 374 ? 125.274 130.467 107.794 1.00 68.11  ? 318 TYR   R CB  1 
ATOM   2110 C CG  . TYR   A 1 374 ? 124.109 130.323 106.851 1.00 60.80  ? 318 TYR   R CG  1 
ATOM   2111 C CD1 . TYR   A 1 374 ? 122.810 130.312 107.323 1.00 56.20  ? 318 TYR   R CD1 1 
ATOM   2112 C CD2 . TYR   A 1 374 ? 124.310 130.205 105.487 1.00 60.06  ? 318 TYR   R CD2 1 
ATOM   2113 C CE1 . TYR   A 1 374 ? 121.744 130.183 106.467 1.00 62.36  ? 318 TYR   R CE1 1 
ATOM   2114 C CE2 . TYR   A 1 374 ? 123.251 130.076 104.622 1.00 64.57  ? 318 TYR   R CE2 1 
ATOM   2115 C CZ  . TYR   A 1 374 ? 121.970 130.066 105.118 1.00 70.03  ? 318 TYR   R CZ  1 
ATOM   2116 O OH  . TYR   A 1 374 ? 120.903 129.938 104.263 1.00 77.22  ? 318 TYR   R OH  1 
ATOM   2117 N N   . ALA   A 1 375 ? 127.663 132.192 109.466 1.00 69.90  ? 319 ALA   R N   1 
ATOM   2118 C CA  . ALA   A 1 375 ? 128.420 132.050 110.702 1.00 65.07  ? 319 ALA   R CA  1 
ATOM   2119 C C   . ALA   A 1 375 ? 128.999 133.368 111.199 1.00 67.37  ? 319 ALA   R C   1 
ATOM   2120 O O   . ALA   A 1 375 ? 128.713 133.783 112.324 1.00 73.38  ? 319 ALA   R O   1 
ATOM   2121 C CB  . ALA   A 1 375 ? 129.548 131.036 110.506 1.00 65.78  ? 319 ALA   R CB  1 
ATOM   2122 N N   . PHE   A 1 376 ? 129.797 134.043 110.375 1.00 66.07  ? 320 PHE   R N   1 
ATOM   2123 C CA  . PHE   A 1 376 ? 130.561 135.187 110.857 1.00 64.97  ? 320 PHE   R CA  1 
ATOM   2124 C C   . PHE   A 1 376 ? 129.756 136.474 110.928 1.00 65.70  ? 320 PHE   R C   1 
ATOM   2125 O O   . PHE   A 1 376 ? 130.243 137.451 111.504 1.00 69.93  ? 320 PHE   R O   1 
ATOM   2126 C CB  . PHE   A 1 376 ? 131.784 135.424 109.974 1.00 62.21  ? 320 PHE   R CB  1 
ATOM   2127 C CG  . PHE   A 1 376 ? 132.925 134.497 110.261 1.00 72.86  ? 320 PHE   R CG  1 
ATOM   2128 C CD1 . PHE   A 1 376 ? 132.754 133.127 110.211 1.00 74.89  ? 320 PHE   R CD1 1 
ATOM   2129 C CD2 . PHE   A 1 376 ? 134.165 134.996 110.602 1.00 71.86  ? 320 PHE   R CD2 1 
ATOM   2130 C CE1 . PHE   A 1 376 ? 133.803 132.275 110.478 1.00 66.51  ? 320 PHE   R CE1 1 
ATOM   2131 C CE2 . PHE   A 1 376 ? 135.215 134.147 110.871 1.00 71.64  ? 320 PHE   R CE2 1 
ATOM   2132 C CZ  . PHE   A 1 376 ? 135.032 132.786 110.809 1.00 64.96  ? 320 PHE   R CZ  1 
ATOM   2133 N N   . VAL   A 1 377 ? 128.548 136.515 110.363 1.00 62.35  ? 321 VAL   R N   1 
ATOM   2134 C CA  . VAL   A 1 377 ? 127.788 137.761 110.357 1.00 56.80  ? 321 VAL   R CA  1 
ATOM   2135 C C   . VAL   A 1 377 ? 127.025 137.991 111.649 1.00 56.16  ? 321 VAL   R C   1 
ATOM   2136 O O   . VAL   A 1 377 ? 126.673 139.137 111.950 1.00 62.87  ? 321 VAL   R O   1 
ATOM   2137 C CB  . VAL   A 1 377 ? 126.792 137.801 109.184 1.00 55.58  ? 321 VAL   R CB  1 
ATOM   2138 C CG1 . VAL   A 1 377 ? 126.324 139.220 108.953 1.00 65.54  ? 321 VAL   R CG1 1 
ATOM   2139 C CG2 . VAL   A 1 377 ? 127.429 137.243 107.928 1.00 60.30  ? 321 VAL   R CG2 1 
ATOM   2140 N N   . GLY   A 1 378 ? 126.769 136.944 112.427 1.00 60.48  ? 322 GLY   R N   1 
ATOM   2141 C CA  . GLY   A 1 378 ? 126.012 137.053 113.662 1.00 62.01  ? 322 GLY   R CA  1 
ATOM   2142 C C   . GLY   A 1 378 ? 126.914 137.490 114.803 1.00 57.29  ? 322 GLY   R C   1 
ATOM   2143 O O   . GLY   A 1 378 ? 128.043 137.019 114.929 1.00 63.14  ? 322 GLY   R O   1 
ATOM   2144 N N   . VAL   A 1 379 ? 126.390 138.391 115.635 1.00 57.48  ? 323 VAL   R N   1 
ATOM   2145 C CA  . VAL   A 1 379 ? 127.179 138.918 116.743 1.00 54.02  ? 323 VAL   R CA  1 
ATOM   2146 C C   . VAL   A 1 379 ? 127.540 137.805 117.715 1.00 64.29  ? 323 VAL   R C   1 
ATOM   2147 O O   . VAL   A 1 379 ? 128.629 137.801 118.301 1.00 66.09  ? 323 VAL   R O   1 
ATOM   2148 C CB  . VAL   A 1 379 ? 126.418 140.055 117.445 1.00 56.73  ? 323 VAL   R CB  1 
ATOM   2149 C CG1 . VAL   A 1 379 ? 127.087 140.408 118.758 1.00 60.02  ? 323 VAL   R CG1 1 
ATOM   2150 C CG2 . VAL   A 1 379 ? 126.341 141.268 116.540 1.00 63.16  ? 323 VAL   R CG2 1 
ATOM   2151 N N   . LYS   A 1 380 ? 126.629 136.853 117.917 1.00 73.98  ? 324 LYS   R N   1 
ATOM   2152 C CA  . LYS   A 1 380 ? 126.916 135.738 118.814 1.00 61.75  ? 324 LYS   R CA  1 
ATOM   2153 C C   . LYS   A 1 380 ? 128.166 134.994 118.372 1.00 69.07  ? 324 LYS   R C   1 
ATOM   2154 O O   . LYS   A 1 380 ? 129.065 134.722 119.180 1.00 82.84  ? 324 LYS   R O   1 
ATOM   2155 C CB  . LYS   A 1 380 ? 125.724 134.784 118.862 1.00 59.04  ? 324 LYS   R CB  1 
ATOM   2156 C CG  . LYS   A 1 380 ? 125.141 134.599 120.244 1.00 69.17  ? 324 LYS   R CG  1 
ATOM   2157 C CD  . LYS   A 1 380 ? 124.141 133.460 120.273 1.00 68.37  ? 324 LYS   R CD  1 
ATOM   2158 C CE  . LYS   A 1 380 ? 123.197 133.585 121.453 1.00 71.06  ? 324 LYS   R CE  1 
ATOM   2159 N NZ  . LYS   A 1 380 ? 122.089 132.596 121.385 1.00 75.49  ? 324 LYS   R NZ  1 
ATOM   2160 N N   . PHE   A 1 381 ? 128.246 134.660 117.085 1.00 66.20  ? 325 PHE   R N   1 
ATOM   2161 C CA  . PHE   A 1 381 ? 129.382 133.885 116.607 1.00 61.35  ? 325 PHE   R CA  1 
ATOM   2162 C C   . PHE   A 1 381 ? 130.670 134.688 116.670 1.00 66.64  ? 325 PHE   R C   1 
ATOM   2163 O O   . PHE   A 1 381 ? 131.733 134.132 116.953 1.00 79.45  ? 325 PHE   R O   1 
ATOM   2164 C CB  . PHE   A 1 381 ? 129.145 133.402 115.185 1.00 56.24  ? 325 PHE   R CB  1 
ATOM   2165 C CG  . PHE   A 1 381 ? 130.238 132.523 114.676 1.00 50.26  ? 325 PHE   R CG  1 
ATOM   2166 C CD1 . PHE   A 1 381 ? 130.262 131.181 114.986 1.00 62.21  ? 325 PHE   R CD1 1 
ATOM   2167 C CD2 . PHE   A 1 381 ? 131.262 133.046 113.919 1.00 63.98  ? 325 PHE   R CD2 1 
ATOM   2168 C CE1 . PHE   A 1 381 ? 131.271 130.375 114.531 1.00 66.43  ? 325 PHE   R CE1 1 
ATOM   2169 C CE2 . PHE   A 1 381 ? 132.274 132.243 113.462 1.00 69.97  ? 325 PHE   R CE2 1 
ATOM   2170 C CZ  . PHE   A 1 381 ? 132.278 130.907 113.769 1.00 70.50  ? 325 PHE   R CZ  1 
ATOM   2171 N N   . ARG   A 1 382 ? 130.612 135.990 116.386 1.00 60.70  ? 326 ARG   R N   1 
ATOM   2172 C CA  . ARG   A 1 382 ? 131.827 136.793 116.475 1.00 60.96  ? 326 ARG   R CA  1 
ATOM   2173 C C   . ARG   A 1 382 ? 132.295 136.929 117.918 1.00 63.69  ? 326 ARG   R C   1 
ATOM   2174 O O   . ARG   A 1 382 ? 133.502 136.930 118.185 1.00 74.88  ? 326 ARG   R O   1 
ATOM   2175 C CB  . ARG   A 1 382 ? 131.612 138.167 115.844 1.00 63.16  ? 326 ARG   R CB  1 
ATOM   2176 C CG  . ARG   A 1 382 ? 131.763 138.163 114.336 1.00 62.03  ? 326 ARG   R CG  1 
ATOM   2177 C CD  . ARG   A 1 382 ? 131.884 139.564 113.764 1.00 61.69  ? 326 ARG   R CD  1 
ATOM   2178 N NE  . ARG   A 1 382 ? 130.631 140.042 113.196 1.00 63.27  ? 326 ARG   R NE  1 
ATOM   2179 C CZ  . ARG   A 1 382 ? 129.728 140.755 113.854 1.00 67.81  ? 326 ARG   R CZ  1 
ATOM   2180 N NH1 . ARG   A 1 382 ? 129.912 141.117 115.113 1.00 70.91  ? 326 ARG   R NH1 1 
ATOM   2181 N NH2 . ARG   A 1 382 ? 128.614 141.121 113.230 1.00 67.69  ? 326 ARG   R NH2 1 
ATOM   2182 N N   . GLU   A 1 383 ? 131.363 137.041 118.865 1.00 63.61  ? 327 GLU   R N   1 
ATOM   2183 C CA  . GLU   A 1 383 ? 131.749 137.052 120.273 1.00 66.73  ? 327 GLU   R CA  1 
ATOM   2184 C C   . GLU   A 1 383 ? 132.400 135.733 120.668 1.00 68.64  ? 327 GLU   R C   1 
ATOM   2185 O O   . GLU   A 1 383 ? 133.413 135.710 121.380 1.00 78.37  ? 327 GLU   R O   1 
ATOM   2186 C CB  . GLU   A 1 383 ? 130.530 137.336 121.148 1.00 72.48  ? 327 GLU   R CB  1 
ATOM   2187 C CG  . GLU   A 1 383 ? 130.051 138.776 121.086 1.00 76.36  ? 327 GLU   R CG  1 
ATOM   2188 C CD  . GLU   A 1 383 ? 128.878 139.041 122.009 1.00 79.73  ? 327 GLU   R CD  1 
ATOM   2189 O OE1 . GLU   A 1 383 ? 128.408 138.088 122.664 1.00 83.46  ? 327 GLU   R OE1 1 
ATOM   2190 O OE2 . GLU   A 1 383 ? 128.426 140.204 122.080 1.00 75.45  ? 327 GLU   R OE2 1 
ATOM   2191 N N   . ARG   A 1 384 ? 131.836 134.617 120.209 1.00 75.66  ? 328 ARG   R N   1 
ATOM   2192 C CA  . ARG   A 1 384 ? 132.451 133.328 120.506 1.00 81.53  ? 328 ARG   R CA  1 
ATOM   2193 C C   . ARG   A 1 384 ? 133.834 133.225 119.872 1.00 84.62  ? 328 ARG   R C   1 
ATOM   2194 O O   . ARG   A 1 384 ? 134.771 132.705 120.487 1.00 92.66  ? 328 ARG   R O   1 
ATOM   2195 C CB  . ARG   A 1 384 ? 131.549 132.188 120.035 1.00 84.37  ? 328 ARG   R CB  1 
ATOM   2196 C CG  . ARG   A 1 384 ? 131.117 131.279 121.171 1.00 85.41  ? 328 ARG   R CG  1 
ATOM   2197 C CD  . ARG   A 1 384 ? 130.048 131.955 122.016 1.00 90.69  ? 328 ARG   R CD  1 
ATOM   2198 N NE  . ARG   A 1 384 ? 128.749 131.930 121.353 1.00 89.31  ? 328 ARG   R NE  1 
ATOM   2199 C CZ  . ARG   A 1 384 ? 127.672 131.307 121.813 1.00 88.58  ? 328 ARG   R CZ  1 
ATOM   2200 N NH1 . ARG   A 1 384 ? 127.640 130.768 123.020 1.00 89.78  ? 328 ARG   R NH1 1 
ATOM   2201 N NH2 . ARG   A 1 384 ? 126.588 131.237 121.047 1.00 89.48  ? 328 ARG   R NH2 1 
ATOM   2202 N N   . MET   A 1 385 ? 133.981 133.716 118.642 1.00 78.69  ? 329 MET   R N   1 
ATOM   2203 C CA  . MET   A 1 385 ? 135.276 133.687 117.974 1.00 72.63  ? 329 MET   R CA  1 
ATOM   2204 C C   . MET   A 1 385 ? 136.302 134.492 118.752 1.00 72.60  ? 329 MET   R C   1 
ATOM   2205 O O   . MET   A 1 385 ? 137.446 134.063 118.923 1.00 88.48  ? 329 MET   R O   1 
ATOM   2206 C CB  . MET   A 1 385 ? 135.135 134.228 116.550 1.00 77.45  ? 329 MET   R CB  1 
ATOM   2207 C CG  . MET   A 1 385 ? 136.447 134.442 115.813 1.00 76.05  ? 329 MET   R CG  1 
ATOM   2208 S SD  . MET   A 1 385 ? 137.205 132.902 115.282 1.00 101.56 ? 329 MET   R SD  1 
ATOM   2209 C CE  . MET   A 1 385 ? 136.206 132.532 113.850 1.00 84.98  ? 329 MET   R CE  1 
ATOM   2210 N N   . TRP   A 1 386 ? 135.918 135.680 119.210 1.00 84.99  ? 330 TRP   R N   1 
ATOM   2211 C CA  . TRP   A 1 386 ? 136.851 136.502 119.969 1.00 90.82  ? 330 TRP   R CA  1 
ATOM   2212 C C   . TRP   A 1 386 ? 137.251 135.807 121.263 1.00 88.15  ? 330 TRP   R C   1 
ATOM   2213 O O   . TRP   A 1 386 ? 138.436 135.761 121.618 1.00 93.20  ? 330 TRP   R O   1 
ATOM   2214 C CB  . TRP   A 1 386 ? 136.235 137.872 120.246 1.00 94.70  ? 330 TRP   R CB  1 
ATOM   2215 C CG  . TRP   A 1 386 ? 136.668 138.939 119.277 1.00 96.33  ? 330 TRP   R CG  1 
ATOM   2216 C CD1 . TRP   A 1 386 ? 137.034 140.219 119.581 1.00 95.93  ? 330 TRP   R CD1 1 
ATOM   2217 C CD2 . TRP   A 1 386 ? 136.790 138.816 117.853 1.00 96.39  ? 330 TRP   R CD2 1 
ATOM   2218 N NE1 . TRP   A 1 386 ? 137.370 140.900 118.436 1.00 97.71  ? 330 TRP   R NE1 1 
ATOM   2219 C CE2 . TRP   A 1 386 ? 137.229 140.061 117.363 1.00 98.65  ? 330 TRP   R CE2 1 
ATOM   2220 C CE3 . TRP   A 1 386 ? 136.570 137.776 116.946 1.00 92.25  ? 330 TRP   R CE3 1 
ATOM   2221 C CZ2 . TRP   A 1 386 ? 137.451 140.294 116.007 1.00 98.20  ? 330 TRP   R CZ2 1 
ATOM   2222 C CZ3 . TRP   A 1 386 ? 136.791 138.009 115.601 1.00 90.58  ? 330 TRP   R CZ3 1 
ATOM   2223 C CH2 . TRP   A 1 386 ? 137.226 139.257 115.145 1.00 93.37  ? 330 TRP   R CH2 1 
ATOM   2224 N N   . MET   A 1 387 ? 136.278 135.232 121.973 1.00 81.34  ? 331 MET   R N   1 
ATOM   2225 C CA  . MET   A 1 387 ? 136.606 134.529 123.209 1.00 79.95  ? 331 MET   R CA  1 
ATOM   2226 C C   . MET   A 1 387 ? 137.573 133.386 122.938 1.00 82.85  ? 331 MET   R C   1 
ATOM   2227 O O   . MET   A 1 387 ? 138.536 133.181 123.685 1.00 85.82  ? 331 MET   R O   1 
ATOM   2228 C CB  . MET   A 1 387 ? 135.337 134.005 123.880 1.00 87.22  ? 331 MET   R CB  1 
ATOM   2229 C CG  . MET   A 1 387 ? 134.813 134.903 124.991 1.00 93.91  ? 331 MET   R CG  1 
ATOM   2230 S SD  . MET   A 1 387 ? 133.517 134.150 126.001 1.00 108.82 ? 331 MET   R SD  1 
ATOM   2231 C CE  . MET   A 1 387 ? 132.511 133.339 124.761 1.00 91.08  ? 331 MET   R CE  1 
ATOM   2232 N N   . LEU   A 1 388 ? 137.335 132.630 121.865 1.00 79.43  ? 332 LEU   R N   1 
ATOM   2233 C CA  . LEU   A 1 388 ? 138.216 131.511 121.545 1.00 76.69  ? 332 LEU   R CA  1 
ATOM   2234 C C   . LEU   A 1 388 ? 139.622 131.989 121.210 1.00 75.75  ? 332 LEU   R C   1 
ATOM   2235 O O   . LEU   A 1 388 ? 140.607 131.434 121.709 1.00 77.70  ? 332 LEU   R O   1 
ATOM   2236 C CB  . LEU   A 1 388 ? 137.643 130.705 120.382 1.00 71.04  ? 332 LEU   R CB  1 
ATOM   2237 C CG  . LEU   A 1 388 ? 138.519 129.543 119.918 1.00 76.58  ? 332 LEU   R CG  1 
ATOM   2238 C CD1 . LEU   A 1 388 ? 138.760 128.562 121.053 1.00 77.12  ? 332 LEU   R CD1 1 
ATOM   2239 C CD2 . LEU   A 1 388 ? 137.891 128.842 118.737 1.00 82.44  ? 332 LEU   R CD2 1 
ATOM   2240 N N   . LEU   A 1 389 ? 139.740 133.014 120.366 1.00 85.18  ? 333 LEU   R N   1 
ATOM   2241 C CA  . LEU   A 1 389 ? 141.063 133.508 120.001 1.00 81.87  ? 333 LEU   R CA  1 
ATOM   2242 C C   . LEU   A 1 389 ? 141.812 134.009 121.227 1.00 88.56  ? 333 LEU   R C   1 
ATOM   2243 O O   . LEU   A 1 389 ? 143.032 133.838 121.330 1.00 90.11  ? 333 LEU   R O   1 
ATOM   2244 C CB  . LEU   A 1 389 ? 140.949 134.615 118.952 1.00 85.22  ? 333 LEU   R CB  1 
ATOM   2245 C CG  . LEU   A 1 389 ? 140.387 134.255 117.573 1.00 81.36  ? 333 LEU   R CG  1 
ATOM   2246 C CD1 . LEU   A 1 389 ? 140.996 135.154 116.516 1.00 80.05  ? 333 LEU   R CD1 1 
ATOM   2247 C CD2 . LEU   A 1 389 ? 140.625 132.797 117.222 1.00 81.44  ? 333 LEU   R CD2 1 
ATOM   2248 N N   . LEU   A 1 390 ? 141.103 134.633 122.170 1.00 106.09 ? 334 LEU   R N   1 
ATOM   2249 C CA  . LEU   A 1 390 ? 141.751 135.038 123.414 1.00 106.66 ? 334 LEU   R CA  1 
ATOM   2250 C C   . LEU   A 1 390 ? 142.267 133.824 124.177 1.00 105.25 ? 334 LEU   R C   1 
ATOM   2251 O O   . LEU   A 1 390 ? 143.366 133.853 124.742 1.00 105.37 ? 334 LEU   R O   1 
ATOM   2252 C CB  . LEU   A 1 390 ? 140.782 135.848 124.279 1.00 102.33 ? 334 LEU   R CB  1 
ATOM   2253 C CG  . LEU   A 1 390 ? 140.353 137.227 123.766 1.00 103.81 ? 334 LEU   R CG  1 
ATOM   2254 C CD1 . LEU   A 1 390 ? 139.795 138.059 124.909 1.00 103.10 ? 334 LEU   R CD1 1 
ATOM   2255 C CD2 . LEU   A 1 390 ? 141.496 137.964 123.080 1.00 102.09 ? 334 LEU   R CD2 1 
ATOM   2256 N N   . ARG   A 1 391 ? 141.489 132.746 124.202 1.00 86.75  ? 335 ARG   R N   1 
ATOM   2257 C CA  . ARG   A 1 391 ? 141.902 131.514 124.863 1.00 81.16  ? 335 ARG   R CA  1 
ATOM   2258 C C   . ARG   A 1 391 ? 143.099 130.902 124.145 1.00 83.76  ? 335 ARG   R C   1 
ATOM   2259 O O   . ARG   A 1 391 ? 143.820 130.080 124.709 1.00 86.24  ? 335 ARG   R O   1 
ATOM   2260 C CB  . ARG   A 1 391 ? 140.745 130.516 124.906 1.00 83.49  ? 335 ARG   R CB  1 
ATOM   2261 C CG  . ARG   A 1 391 ? 141.042 129.243 125.680 1.00 88.09  ? 335 ARG   R CG  1 
ATOM   2262 C CD  . ARG   A 1 391 ? 139.879 128.268 125.598 1.00 88.70  ? 335 ARG   R CD  1 
ATOM   2263 N NE  . ARG   A 1 391 ? 138.686 128.778 126.260 1.00 86.97  ? 335 ARG   R NE  1 
ATOM   2264 C CZ  . ARG   A 1 391 ? 137.505 128.175 126.245 1.00 83.80  ? 335 ARG   R CZ  1 
ATOM   2265 N NH1 . ARG   A 1 391 ? 137.320 127.034 125.603 1.00 83.73  ? 335 ARG   R NH1 1 
ATOM   2266 N NH2 . ARG   A 1 391 ? 136.483 128.733 126.887 1.00 85.07  ? 335 ARG   R NH2 1 
HETATM 2267 N N3  . A1LW1 B 2 .   ? 134.659 117.745 88.379  1.00 96.86  ? 401 A1LW1 R N3  1 
HETATM 2268 C C4  . A1LW1 B 2 .   ? 135.507 116.642 87.915  1.00 95.55  ? 401 A1LW1 R C4  1 
HETATM 2269 C C5  . A1LW1 B 2 .   ? 135.972 116.772 86.486  1.00 94.24  ? 401 A1LW1 R C5  1 
HETATM 2270 C C6  . A1LW1 B 2 .   ? 136.516 115.669 85.831  1.00 93.31  ? 401 A1LW1 R C6  1 
HETATM 2271 C C7  . A1LW1 B 2 .   ? 136.961 115.770 84.525  1.00 97.79  ? 401 A1LW1 R C7  1 
HETATM 2272 C C8  . A1LW1 B 2 .   ? 136.870 116.969 83.857  1.00 97.96  ? 401 A1LW1 R C8  1 
HETATM 2273 C C10 . A1LW1 B 2 .   ? 135.879 117.993 85.806  1.00 97.31  ? 401 A1LW1 R C10 1 
HETATM 2274 C C13 . A1LW1 B 2 .   ? 134.002 116.505 90.393  1.00 96.53  ? 401 A1LW1 R C13 1 
HETATM 2275 C C15 . A1LW1 B 2 .   ? 133.082 114.236 89.836  1.00 103.93 ? 401 A1LW1 R C15 1 
HETATM 2276 C C17 . A1LW1 B 2 .   ? 132.210 113.433 90.740  1.00 101.09 ? 401 A1LW1 R C17 1 
HETATM 2277 C C20 . A1LW1 B 2 .   ? 130.553 111.904 92.374  1.00 100.36 ? 401 A1LW1 R C20 1 
HETATM 2278 C C21 . A1LW1 B 2 .   ? 131.338 111.293 91.419  1.00 96.48  ? 401 A1LW1 R C21 1 
HETATM 2279 C C22 . A1LW1 B 2 .   ? 132.164 112.049 90.604  1.00 94.44  ? 401 A1LW1 R C22 1 
HETATM 2280 C C26 . A1LW1 B 2 .   ? 131.274 116.844 86.074  1.00 93.91  ? 401 A1LW1 R C26 1 
HETATM 2281 C C28 . A1LW1 B 2 .   ? 131.768 114.908 84.474  1.00 97.44  ? 401 A1LW1 R C28 1 
HETATM 2282 C C1  . A1LW1 B 2 .   ? 135.300 119.198 86.502  1.00 99.40  ? 401 A1LW1 R C1  1 
HETATM 2283 C C11 . A1LW1 B 2 .   ? 134.262 117.807 89.669  1.00 96.38  ? 401 A1LW1 R C11 1 
HETATM 2284 C C14 . A1LW1 B 2 .   ? 132.871 115.727 89.753  1.00 101.72 ? 401 A1LW1 R C14 1 
HETATM 2285 C C18 . A1LW1 B 2 .   ? 131.414 114.040 91.708  1.00 99.38  ? 401 A1LW1 R C18 1 
HETATM 2286 C C19 . A1LW1 B 2 .   ? 130.591 113.275 92.517  1.00 98.54  ? 401 A1LW1 R C19 1 
HETATM 2287 C C2  . A1LW1 B 2 .   ? 134.203 118.823 87.490  1.00 98.71  ? 401 A1LW1 R C2  1 
HETATM 2288 C C23 . A1LW1 B 2 .   ? 132.893 118.519 86.764  1.00 100.42 ? 401 A1LW1 R C23 1 
HETATM 2289 C C27 . A1LW1 B 2 .   ? 131.198 115.338 85.821  1.00 92.11  ? 401 A1LW1 R C27 1 
HETATM 2290 C C29 . A1LW1 B 2 .   ? 133.251 115.180 84.310  1.00 100.38 ? 401 A1LW1 R C29 1 
HETATM 2291 C C30 . A1LW1 B 2 .   ? 133.796 114.661 83.000  1.00 100.11 ? 401 A1LW1 R C30 1 
HETATM 2292 C C32 . A1LW1 B 2 .   ? 130.167 117.289 87.030  1.00 100.02 ? 401 A1LW1 R C32 1 
HETATM 2293 C C35 . A1LW1 B 2 .   ? 129.630 117.892 89.364  1.00 98.06  ? 401 A1LW1 R C35 1 
HETATM 2294 C C36 . A1LW1 B 2 .   ? 128.264 117.197 89.372  1.00 95.15  ? 401 A1LW1 R C36 1 
HETATM 2295 C C37 . A1LW1 B 2 .   ? 127.549 117.527 90.674  1.00 96.34  ? 401 A1LW1 R C37 1 
HETATM 2296 C C38 . A1LW1 B 2 .   ? 127.002 118.786 90.882  1.00 100.59 ? 401 A1LW1 R C38 1 
HETATM 2297 C C39 . A1LW1 B 2 .   ? 126.358 119.089 92.069  1.00 101.94 ? 401 A1LW1 R C39 1 
HETATM 2298 C C40 . A1LW1 B 2 .   ? 126.253 118.141 93.063  1.00 102.10 ? 401 A1LW1 R C40 1 
HETATM 2299 C C41 . A1LW1 B 2 .   ? 126.792 116.887 92.871  1.00 96.25  ? 401 A1LW1 R C41 1 
HETATM 2300 C C42 . A1LW1 B 2 .   ? 127.437 116.580 91.685  1.00 95.28  ? 401 A1LW1 R C42 1 
HETATM 2301 C C43 . A1LW1 B 2 .   ? 128.233 115.701 89.086  1.00 95.86  ? 401 A1LW1 R C43 1 
HETATM 2302 C C44 . A1LW1 B 2 .   ? 127.036 115.081 88.753  1.00 97.22  ? 401 A1LW1 R C44 1 
HETATM 2303 C C45 . A1LW1 B 2 .   ? 126.991 113.720 88.506  1.00 100.37 ? 401 A1LW1 R C45 1 
HETATM 2304 C C46 . A1LW1 B 2 .   ? 128.138 112.961 88.589  1.00 100.38 ? 401 A1LW1 R C46 1 
HETATM 2305 C C47 . A1LW1 B 2 .   ? 129.332 113.563 88.919  1.00 100.14 ? 401 A1LW1 R C47 1 
HETATM 2306 C C48 . A1LW1 B 2 .   ? 129.381 114.924 89.167  1.00 99.86  ? 401 A1LW1 R C48 1 
HETATM 2307 C C9  . A1LW1 B 2 .   ? 136.332 118.075 84.492  1.00 96.65  ? 401 A1LW1 R C9  1 
HETATM 2308 N N25 . A1LW1 B 2 .   ? 132.568 117.231 86.611  1.00 99.13  ? 401 A1LW1 R N25 1 
HETATM 2309 N N31 . A1LW1 B 2 .   ? 133.104 115.274 81.839  1.00 100.27 ? 401 A1LW1 R N31 1 
HETATM 2310 N N34 . A1LW1 B 2 .   ? 130.529 117.455 88.304  1.00 103.43 ? 401 A1LW1 R N34 1 
HETATM 2311 O O12 . A1LW1 B 2 .   ? 134.115 118.879 90.233  1.00 95.18  ? 401 A1LW1 R O12 1 
HETATM 2312 O O16 . A1LW1 B 2 .   ? 133.949 113.701 89.169  1.00 101.32 ? 401 A1LW1 R O16 1 
HETATM 2313 O O24 . A1LW1 B 2 .   ? 132.192 119.435 86.346  1.00 103.31 ? 401 A1LW1 R O24 1 
HETATM 2314 O O33 . A1LW1 B 2 .   ? 129.024 117.473 86.624  1.00 100.82 ? 401 A1LW1 R O33 1 
# 
