data_9GL8
# 
_entry.id   9GL8 
# 
_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   9GL8         pdb_00009gl8 10.2210/pdb9gl8/pdb 
WWPDB D_1292141241 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-05-14 
_pdbx_audit_revision_history.part_number         ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9GL8 
_pdbx_database_status.recvd_initial_deposition_date   2024-08-27 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           N 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              brendan@scorpiontx.com 
_pdbx_contact_author.name_first         Brendan 
_pdbx_contact_author.name_last          Hilbert 
_pdbx_contact_author.name_mi            J. 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0001-9353-1799 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Hilbert, B.J.'    1 0000-0001-9353-1799 
'Brooijmans, N.'   2 0000-0003-3514-4189 
'Milgram, B.C.'    3 0009-0008-5824-4645 
'Pagliarini, R.A.' 4 0000-0001-8920-8198 
# 
_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                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     'EGFR Exon20 insertion mutant NPG bound with STX-721' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Milgram, B.C.'    1  0009-0008-5824-4645 
primary 'Pagliarini, R.A.' 2  0000-0001-8920-8198 
primary 'Borrelli, D.R.'   3  0009-0004-2136-4740 
primary 'OHearn, E.'       4  0009-0003-4113-4259 
primary 'Huff, M.R.'       5  0009-0003-9351-5854 
primary 'Ladd, B.'         6  0009-0007-4322-0360 
primary 'Brooijmans, N.'   7  0000-0003-3514-4189 
primary 'Henderson, J.A.'  8  0000-0001-6675-7944 
primary 'Hilbert, B.J.'    9  0000-0001-9353-1799 
primary 'Wang, W.'         10 0000-0003-2591-8582 
primary 'Ito, T.'          11 0000-0002-7933-5393 
primary 'Jonsson, P.'      12 0000-0002-1537-0624 
primary 'Jackson, E.L.'    13 0000-0002-7100-8021 
primary 'Guzman-Perez, A.' 14 0009-0007-7187-5559 
# 
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 'Epidermal growth factor receptor' 38677.609 1   2.7.10.1 V948R ? D770_N771insNPG 
2 non-polymer syn 'SODIUM ION' 22.990    2   ?        ?     ? ?               
3 non-polymer syn GLYCEROL 92.094    1   ?        ?     ? ?               
4 non-polymer syn 1,2-ETHANEDIOL 62.068    1   ?        ?     ? ?               
5 non-polymer syn 
;(2R,3S)-3-[(3-chloranyl-2-methoxy-phenyl)amino]-2-[3-[2-[(2R)-1-[(E)-4-(dimethylamino)but-2-enoyl]-2-methyl-pyrrolidin-2-yl]ethynyl]pyridin-4-yl]-1,2,3,5,6,7-hexahydropyrrolo[3,2-c]pyridin-4-one
;
589.128   1   ?        ?     ? ?               
6 water       nat water 18.015    374 ?        ?     ? ?               
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'Proto-oncogene c-ErbB-1,Receptor tyrosine-protein kinase erbB-1' 
# 
_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       
;MSGEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPG
NPHVCRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQH
VKITDFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKG
ERLPQPPICTIDVYMIMRKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLPSPTDSNFYRALMDEEDMDDV
VDADEYLIPQQGHHHHHH
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MSGEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPG
NPHVCRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQH
VKITDFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKG
ERLPQPPICTIDVYMIMRKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLPSPTDSNFYRALMDEEDMDDV
VDADEYLIPQQGHHHHHH
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'SODIUM ION' NA    
3 GLYCEROL GOL   
4 1,2-ETHANEDIOL EDO   
5 
;(2R,3S)-3-[(3-chloranyl-2-methoxy-phenyl)amino]-2-[3-[2-[(2R)-1-[(E)-4-(dimethylamino)but-2-enoyl]-2-methyl-pyrrolidin-2-yl]ethynyl]pyridin-4-yl]-1,2,3,5,6,7-hexahydropyrrolo[3,2-c]pyridin-4-one
;
A1IMT 
6 water HOH   
# 
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   SER n 
1 3   GLY n 
1 4   GLU n 
1 5   ALA n 
1 6   PRO n 
1 7   ASN n 
1 8   GLN n 
1 9   ALA n 
1 10  LEU n 
1 11  LEU n 
1 12  ARG n 
1 13  ILE n 
1 14  LEU n 
1 15  LYS n 
1 16  GLU n 
1 17  THR n 
1 18  GLU n 
1 19  PHE n 
1 20  LYS n 
1 21  LYS n 
1 22  ILE n 
1 23  LYS n 
1 24  VAL n 
1 25  LEU n 
1 26  GLY n 
1 27  SER n 
1 28  GLY n 
1 29  ALA n 
1 30  PHE n 
1 31  GLY n 
1 32  THR n 
1 33  VAL n 
1 34  TYR n 
1 35  LYS n 
1 36  GLY n 
1 37  LEU n 
1 38  TRP n 
1 39  ILE n 
1 40  PRO n 
1 41  GLU n 
1 42  GLY n 
1 43  GLU n 
1 44  LYS n 
1 45  VAL n 
1 46  LYS n 
1 47  ILE n 
1 48  PRO n 
1 49  VAL n 
1 50  ALA n 
1 51  ILE n 
1 52  LYS n 
1 53  GLU n 
1 54  LEU n 
1 55  ARG n 
1 56  GLU n 
1 57  ALA n 
1 58  THR n 
1 59  SER n 
1 60  PRO n 
1 61  LYS n 
1 62  ALA n 
1 63  ASN n 
1 64  LYS n 
1 65  GLU n 
1 66  ILE n 
1 67  LEU n 
1 68  ASP n 
1 69  GLU n 
1 70  ALA n 
1 71  TYR n 
1 72  VAL n 
1 73  MET n 
1 74  ALA n 
1 75  SER n 
1 76  VAL n 
1 77  ASP n 
1 78  ASN n 
1 79  PRO n 
1 80  GLY n 
1 81  ASN n 
1 82  PRO n 
1 83  HIS n 
1 84  VAL n 
1 85  CYS n 
1 86  ARG n 
1 87  LEU n 
1 88  LEU n 
1 89  GLY n 
1 90  ILE n 
1 91  CYS n 
1 92  LEU n 
1 93  THR n 
1 94  SER n 
1 95  THR n 
1 96  VAL n 
1 97  GLN n 
1 98  LEU n 
1 99  ILE n 
1 100 THR n 
1 101 GLN n 
1 102 LEU n 
1 103 MET n 
1 104 PRO n 
1 105 PHE n 
1 106 GLY n 
1 107 CYS n 
1 108 LEU n 
1 109 LEU n 
1 110 ASP n 
1 111 TYR n 
1 112 VAL n 
1 113 ARG n 
1 114 GLU n 
1 115 HIS n 
1 116 LYS n 
1 117 ASP n 
1 118 ASN n 
1 119 ILE n 
1 120 GLY n 
1 121 SER n 
1 122 GLN n 
1 123 TYR n 
1 124 LEU n 
1 125 LEU n 
1 126 ASN n 
1 127 TRP n 
1 128 CYS n 
1 129 VAL n 
1 130 GLN n 
1 131 ILE n 
1 132 ALA n 
1 133 LYS n 
1 134 GLY n 
1 135 MET n 
1 136 ASN n 
1 137 TYR n 
1 138 LEU n 
1 139 GLU n 
1 140 ASP n 
1 141 ARG n 
1 142 ARG n 
1 143 LEU n 
1 144 VAL n 
1 145 HIS n 
1 146 ARG n 
1 147 ASP n 
1 148 LEU n 
1 149 ALA n 
1 150 ALA n 
1 151 ARG n 
1 152 ASN n 
1 153 VAL n 
1 154 LEU n 
1 155 VAL n 
1 156 LYS n 
1 157 THR n 
1 158 PRO n 
1 159 GLN n 
1 160 HIS n 
1 161 VAL n 
1 162 LYS n 
1 163 ILE n 
1 164 THR n 
1 165 ASP n 
1 166 PHE n 
1 167 GLY n 
1 168 LEU n 
1 169 ALA n 
1 170 LYS n 
1 171 LEU n 
1 172 LEU n 
1 173 GLY n 
1 174 ALA n 
1 175 GLU n 
1 176 GLU n 
1 177 LYS n 
1 178 GLU n 
1 179 TYR n 
1 180 HIS n 
1 181 ALA n 
1 182 GLU n 
1 183 GLY n 
1 184 GLY n 
1 185 LYS n 
1 186 VAL n 
1 187 PRO n 
1 188 ILE n 
1 189 LYS n 
1 190 TRP n 
1 191 MET n 
1 192 ALA n 
1 193 LEU n 
1 194 GLU n 
1 195 SER n 
1 196 ILE n 
1 197 LEU n 
1 198 HIS n 
1 199 ARG n 
1 200 ILE n 
1 201 TYR n 
1 202 THR n 
1 203 HIS n 
1 204 GLN n 
1 205 SER n 
1 206 ASP n 
1 207 VAL n 
1 208 TRP n 
1 209 SER n 
1 210 TYR n 
1 211 GLY n 
1 212 VAL n 
1 213 THR n 
1 214 VAL n 
1 215 TRP n 
1 216 GLU n 
1 217 LEU n 
1 218 MET n 
1 219 THR n 
1 220 PHE n 
1 221 GLY n 
1 222 SER n 
1 223 LYS n 
1 224 PRO n 
1 225 TYR n 
1 226 ASP n 
1 227 GLY n 
1 228 ILE n 
1 229 PRO n 
1 230 ALA n 
1 231 SER n 
1 232 GLU n 
1 233 ILE n 
1 234 SER n 
1 235 SER n 
1 236 ILE n 
1 237 LEU n 
1 238 GLU n 
1 239 LYS n 
1 240 GLY n 
1 241 GLU n 
1 242 ARG n 
1 243 LEU n 
1 244 PRO n 
1 245 GLN n 
1 246 PRO n 
1 247 PRO n 
1 248 ILE n 
1 249 CYS n 
1 250 THR n 
1 251 ILE n 
1 252 ASP n 
1 253 VAL n 
1 254 TYR n 
1 255 MET n 
1 256 ILE n 
1 257 MET n 
1 258 ARG n 
1 259 LYS n 
1 260 CYS n 
1 261 TRP n 
1 262 MET n 
1 263 ILE n 
1 264 ASP n 
1 265 ALA n 
1 266 ASP n 
1 267 SER n 
1 268 ARG n 
1 269 PRO n 
1 270 LYS n 
1 271 PHE n 
1 272 ARG n 
1 273 GLU n 
1 274 LEU n 
1 275 ILE n 
1 276 ILE n 
1 277 GLU n 
1 278 PHE n 
1 279 SER n 
1 280 LYS n 
1 281 MET n 
1 282 ALA n 
1 283 ARG n 
1 284 ASP n 
1 285 PRO n 
1 286 GLN n 
1 287 ARG n 
1 288 TYR n 
1 289 LEU n 
1 290 VAL n 
1 291 ILE n 
1 292 GLN n 
1 293 GLY n 
1 294 ASP n 
1 295 GLU n 
1 296 ARG n 
1 297 MET n 
1 298 HIS n 
1 299 LEU n 
1 300 PRO n 
1 301 SER n 
1 302 PRO n 
1 303 THR n 
1 304 ASP n 
1 305 SER n 
1 306 ASN n 
1 307 PHE n 
1 308 TYR n 
1 309 ARG n 
1 310 ALA n 
1 311 LEU n 
1 312 MET n 
1 313 ASP n 
1 314 GLU n 
1 315 GLU n 
1 316 ASP n 
1 317 MET n 
1 318 ASP n 
1 319 ASP n 
1 320 VAL n 
1 321 VAL n 
1 322 ASP n 
1 323 ALA n 
1 324 ASP n 
1 325 GLU n 
1 326 TYR n 
1 327 LEU n 
1 328 ILE n 
1 329 PRO n 
1 330 GLN n 
1 331 GLN n 
1 332 GLY n 
1 333 HIS n 
1 334 HIS n 
1 335 HIS n 
1 336 HIS n 
1 337 HIS n 
1 338 HIS 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                   338 
_entity_src_gen.gene_src_common_name               human 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'EGFR, ERBB, ERBB1, HER1' 
_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 
A1IMT non-polymer         . 
;(2R,3S)-3-[(3-chloranyl-2-methoxy-phenyl)amino]-2-[3-[2-[(2R)-1-[(E)-4-(dimethylamino)but-2-enoyl]-2-methyl-pyrrolidin-2-yl]ethynyl]pyridin-4-yl]-1,2,3,5,6,7-hexahydropyrrolo[3,2-c]pyridin-4-one
;
?                               'C32 H37 Cl N6 O3' 589.128 
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 
EDO   non-polymer         . 1,2-ETHANEDIOL 'ETHYLENE GLYCOL'               'C2 H6 O2'         62.068  
GLN   'L-peptide linking' y GLUTAMINE ?                               'C5 H10 N2 O3'     146.144 
GLU   'L-peptide linking' y 'GLUTAMIC ACID' ?                               'C5 H9 N O4'       147.129 
GLY   'peptide linking'   y GLYCINE ?                               'C2 H5 N O2'       75.067  
GOL   non-polymer         . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3'         92.094  
HIS   'L-peptide linking' y HISTIDINE ?                               'C6 H10 N3 O2 1'   156.162 
HOH   non-polymer         . WATER ?                               'H2 O'             18.015  
ILE   'L-peptide linking' y ISOLEUCINE ?                               'C6 H13 N O2'      131.173 
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 
NA    non-polymer         . 'SODIUM ION' ?                               'Na 1'             22.990  
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   694  ?    ?   ?   A . n 
A 1 2   SER 2   695  ?    ?   ?   A . n 
A 1 3   GLY 3   696  ?    ?   ?   A . n 
A 1 4   GLU 4   697  ?    ?   ?   A . n 
A 1 5   ALA 5   698  ?    ?   ?   A . n 
A 1 6   PRO 6   699  ?    ?   ?   A . n 
A 1 7   ASN 7   700  ?    ?   ?   A . n 
A 1 8   GLN 8   701  701  GLN GLN A . n 
A 1 9   ALA 9   702  702  ALA ALA A . n 
A 1 10  LEU 10  703  703  LEU LEU A . n 
A 1 11  LEU 11  704  704  LEU LEU A . n 
A 1 12  ARG 12  705  705  ARG ARG A . n 
A 1 13  ILE 13  706  706  ILE ILE A . n 
A 1 14  LEU 14  707  707  LEU LEU A . n 
A 1 15  LYS 15  708  708  LYS LYS A . n 
A 1 16  GLU 16  709  709  GLU GLU A . n 
A 1 17  THR 17  710  710  THR THR A . n 
A 1 18  GLU 18  711  711  GLU GLU A . n 
A 1 19  PHE 19  712  712  PHE PHE A . n 
A 1 20  LYS 20  713  713  LYS LYS A . n 
A 1 21  LYS 21  714  714  LYS LYS A . n 
A 1 22  ILE 22  715  715  ILE ILE A . n 
A 1 23  LYS 23  716  716  LYS LYS A . n 
A 1 24  VAL 24  717  717  VAL VAL A . n 
A 1 25  LEU 25  718  718  LEU LEU A . n 
A 1 26  GLY 26  719  719  GLY GLY A . n 
A 1 27  SER 27  720  720  SER SER A . n 
A 1 28  GLY 28  721  721  GLY GLY A . n 
A 1 29  ALA 29  722  722  ALA ALA A . n 
A 1 30  PHE 30  723  723  PHE PHE A . n 
A 1 31  GLY 31  724  724  GLY GLY A . n 
A 1 32  THR 32  725  725  THR THR A . n 
A 1 33  VAL 33  726  726  VAL VAL A . n 
A 1 34  TYR 34  727  727  TYR TYR A . n 
A 1 35  LYS 35  728  728  LYS LYS A . n 
A 1 36  GLY 36  729  729  GLY GLY A . n 
A 1 37  LEU 37  730  730  LEU LEU A . n 
A 1 38  TRP 38  731  731  TRP TRP A . n 
A 1 39  ILE 39  732  732  ILE ILE A . n 
A 1 40  PRO 40  733  733  PRO PRO A . n 
A 1 41  GLU 41  734  734  GLU GLU A . n 
A 1 42  GLY 42  735  735  GLY GLY A . n 
A 1 43  GLU 43  736  736  GLU GLU A . n 
A 1 44  LYS 44  737  737  LYS LYS A . n 
A 1 45  VAL 45  738  738  VAL VAL A . n 
A 1 46  LYS 46  739  739  LYS LYS A . n 
A 1 47  ILE 47  740  740  ILE ILE A . n 
A 1 48  PRO 48  741  741  PRO PRO A . n 
A 1 49  VAL 49  742  742  VAL VAL A . n 
A 1 50  ALA 50  743  743  ALA ALA A . n 
A 1 51  ILE 51  744  744  ILE ILE A . n 
A 1 52  LYS 52  745  745  LYS LYS A . n 
A 1 53  GLU 53  746  746  GLU GLU A . n 
A 1 54  LEU 54  747  747  LEU LEU A . n 
A 1 55  ARG 55  748  748  ARG ARG A . n 
A 1 56  GLU 56  749  749  GLU GLU A . n 
A 1 57  ALA 57  750  ?    ?   ?   A . n 
A 1 58  THR 58  751  ?    ?   ?   A . n 
A 1 59  SER 59  752  ?    ?   ?   A . n 
A 1 60  PRO 60  753  ?    ?   ?   A . n 
A 1 61  LYS 61  754  ?    ?   ?   A . n 
A 1 62  ALA 62  755  755  ALA ALA A . n 
A 1 63  ASN 63  756  756  ASN ASN A . n 
A 1 64  LYS 64  757  757  LYS LYS A . n 
A 1 65  GLU 65  758  758  GLU GLU A . n 
A 1 66  ILE 66  759  759  ILE ILE A . n 
A 1 67  LEU 67  760  760  LEU LEU A . n 
A 1 68  ASP 68  761  761  ASP ASP A . n 
A 1 69  GLU 69  762  762  GLU GLU A . n 
A 1 70  ALA 70  763  763  ALA ALA A . n 
A 1 71  TYR 71  764  764  TYR TYR A . n 
A 1 72  VAL 72  765  765  VAL VAL A . n 
A 1 73  MET 73  766  766  MET MET A . n 
A 1 74  ALA 74  767  767  ALA ALA A . n 
A 1 75  SER 75  768  768  SER SER A . n 
A 1 76  VAL 76  769  769  VAL VAL A . n 
A 1 77  ASP 77  770  770  ASP ASP A . n 
A 1 78  ASN 78  770  770  ASN ASN A A n 
A 1 79  PRO 79  770  770  PRO PRO A B n 
A 1 80  GLY 80  770  770  GLY GLY A C n 
A 1 81  ASN 81  771  771  ASN ASN A . n 
A 1 82  PRO 82  772  772  PRO PRO A . n 
A 1 83  HIS 83  773  773  HIS HIS A . n 
A 1 84  VAL 84  774  774  VAL VAL A . n 
A 1 85  CYS 85  775  775  CYS CYS A . n 
A 1 86  ARG 86  776  776  ARG ARG A . n 
A 1 87  LEU 87  777  777  LEU LEU A . n 
A 1 88  LEU 88  778  778  LEU LEU A . n 
A 1 89  GLY 89  779  779  GLY GLY A . n 
A 1 90  ILE 90  780  780  ILE ILE A . n 
A 1 91  CYS 91  781  781  CYS CYS A . n 
A 1 92  LEU 92  782  782  LEU LEU A . n 
A 1 93  THR 93  783  783  THR THR A . n 
A 1 94  SER 94  784  784  SER SER A . n 
A 1 95  THR 95  785  785  THR THR A . n 
A 1 96  VAL 96  786  786  VAL VAL A . n 
A 1 97  GLN 97  787  787  GLN GLN A . n 
A 1 98  LEU 98  788  788  LEU LEU A . n 
A 1 99  ILE 99  789  789  ILE ILE A . n 
A 1 100 THR 100 790  790  THR THR A . n 
A 1 101 GLN 101 791  791  GLN GLN A . n 
A 1 102 LEU 102 792  792  LEU LEU A . n 
A 1 103 MET 103 793  793  MET MET A . n 
A 1 104 PRO 104 794  794  PRO PRO A . n 
A 1 105 PHE 105 795  795  PHE PHE A . n 
A 1 106 GLY 106 796  796  GLY GLY A . n 
A 1 107 CYS 107 797  797  CYS CYS A . n 
A 1 108 LEU 108 798  798  LEU LEU A . n 
A 1 109 LEU 109 799  799  LEU LEU A . n 
A 1 110 ASP 110 800  800  ASP ASP A . n 
A 1 111 TYR 111 801  801  TYR TYR A . n 
A 1 112 VAL 112 802  802  VAL VAL A . n 
A 1 113 ARG 113 803  803  ARG ARG A . n 
A 1 114 GLU 114 804  804  GLU GLU A . n 
A 1 115 HIS 115 805  805  HIS HIS A . n 
A 1 116 LYS 116 806  806  LYS LYS A . n 
A 1 117 ASP 117 807  807  ASP ASP A . n 
A 1 118 ASN 118 808  808  ASN ASN A . n 
A 1 119 ILE 119 809  809  ILE ILE A . n 
A 1 120 GLY 120 810  810  GLY GLY A . n 
A 1 121 SER 121 811  811  SER SER A . n 
A 1 122 GLN 122 812  812  GLN GLN A . n 
A 1 123 TYR 123 813  813  TYR TYR A . n 
A 1 124 LEU 124 814  814  LEU LEU A . n 
A 1 125 LEU 125 815  815  LEU LEU A . n 
A 1 126 ASN 126 816  816  ASN ASN A . n 
A 1 127 TRP 127 817  817  TRP TRP A . n 
A 1 128 CYS 128 818  818  CYS CYS A . n 
A 1 129 VAL 129 819  819  VAL VAL A . n 
A 1 130 GLN 130 820  820  GLN GLN A . n 
A 1 131 ILE 131 821  821  ILE ILE A . n 
A 1 132 ALA 132 822  822  ALA ALA A . n 
A 1 133 LYS 133 823  823  LYS LYS A . n 
A 1 134 GLY 134 824  824  GLY GLY A . n 
A 1 135 MET 135 825  825  MET MET A . n 
A 1 136 ASN 136 826  826  ASN ASN A . n 
A 1 137 TYR 137 827  827  TYR TYR A . n 
A 1 138 LEU 138 828  828  LEU LEU A . n 
A 1 139 GLU 139 829  829  GLU GLU A . n 
A 1 140 ASP 140 830  830  ASP ASP A . n 
A 1 141 ARG 141 831  831  ARG ARG A . n 
A 1 142 ARG 142 832  832  ARG ARG A . n 
A 1 143 LEU 143 833  833  LEU LEU A . n 
A 1 144 VAL 144 834  834  VAL VAL A . n 
A 1 145 HIS 145 835  835  HIS HIS A . n 
A 1 146 ARG 146 836  836  ARG ARG A . n 
A 1 147 ASP 147 837  837  ASP ASP A . n 
A 1 148 LEU 148 838  838  LEU LEU A . n 
A 1 149 ALA 149 839  839  ALA ALA A . n 
A 1 150 ALA 150 840  840  ALA ALA A . n 
A 1 151 ARG 151 841  841  ARG ARG A . n 
A 1 152 ASN 152 842  842  ASN ASN A . n 
A 1 153 VAL 153 843  843  VAL VAL A . n 
A 1 154 LEU 154 844  844  LEU LEU A . n 
A 1 155 VAL 155 845  845  VAL VAL A . n 
A 1 156 LYS 156 846  846  LYS LYS A . n 
A 1 157 THR 157 847  847  THR THR A . n 
A 1 158 PRO 158 848  848  PRO PRO A . n 
A 1 159 GLN 159 849  849  GLN GLN A . n 
A 1 160 HIS 160 850  850  HIS HIS A . n 
A 1 161 VAL 161 851  851  VAL VAL A . n 
A 1 162 LYS 162 852  852  LYS LYS A . n 
A 1 163 ILE 163 853  853  ILE ILE A . n 
A 1 164 THR 164 854  854  THR THR A . n 
A 1 165 ASP 165 855  855  ASP ASP A . n 
A 1 166 PHE 166 856  856  PHE PHE A . n 
A 1 167 GLY 167 857  857  GLY GLY A . n 
A 1 168 LEU 168 858  858  LEU LEU A . n 
A 1 169 ALA 169 859  859  ALA ALA A . n 
A 1 170 LYS 170 860  860  LYS LYS A . n 
A 1 171 LEU 171 861  861  LEU LEU A . n 
A 1 172 LEU 172 862  862  LEU LEU A . n 
A 1 173 GLY 173 863  863  GLY GLY A . n 
A 1 174 ALA 174 864  864  ALA ALA A . n 
A 1 175 GLU 175 865  865  GLU GLU A . n 
A 1 176 GLU 176 866  866  GLU GLU A . n 
A 1 177 LYS 177 867  867  LYS LYS A . n 
A 1 178 GLU 178 868  868  GLU GLU A . n 
A 1 179 TYR 179 869  869  TYR TYR A . n 
A 1 180 HIS 180 870  870  HIS HIS A . n 
A 1 181 ALA 181 871  871  ALA ALA A . n 
A 1 182 GLU 182 872  872  GLU GLU A . n 
A 1 183 GLY 183 873  873  GLY GLY A . n 
A 1 184 GLY 184 874  874  GLY GLY A . n 
A 1 185 LYS 185 875  875  LYS LYS A . n 
A 1 186 VAL 186 876  876  VAL VAL A . n 
A 1 187 PRO 187 877  877  PRO PRO A . n 
A 1 188 ILE 188 878  878  ILE ILE A . n 
A 1 189 LYS 189 879  879  LYS LYS A . n 
A 1 190 TRP 190 880  880  TRP TRP A . n 
A 1 191 MET 191 881  881  MET MET A . n 
A 1 192 ALA 192 882  882  ALA ALA A . n 
A 1 193 LEU 193 883  883  LEU LEU A . n 
A 1 194 GLU 194 884  884  GLU GLU A . n 
A 1 195 SER 195 885  885  SER SER A . n 
A 1 196 ILE 196 886  886  ILE ILE A . n 
A 1 197 LEU 197 887  887  LEU LEU A . n 
A 1 198 HIS 198 888  888  HIS HIS A . n 
A 1 199 ARG 199 889  889  ARG ARG A . n 
A 1 200 ILE 200 890  890  ILE ILE A . n 
A 1 201 TYR 201 891  891  TYR TYR A . n 
A 1 202 THR 202 892  892  THR THR A . n 
A 1 203 HIS 203 893  893  HIS HIS A . n 
A 1 204 GLN 204 894  894  GLN GLN A . n 
A 1 205 SER 205 895  895  SER SER A . n 
A 1 206 ASP 206 896  896  ASP ASP A . n 
A 1 207 VAL 207 897  897  VAL VAL A . n 
A 1 208 TRP 208 898  898  TRP TRP A . n 
A 1 209 SER 209 899  899  SER SER A . n 
A 1 210 TYR 210 900  900  TYR TYR A . n 
A 1 211 GLY 211 901  901  GLY GLY A . n 
A 1 212 VAL 212 902  902  VAL VAL A . n 
A 1 213 THR 213 903  903  THR THR A . n 
A 1 214 VAL 214 904  904  VAL VAL A . n 
A 1 215 TRP 215 905  905  TRP TRP A . n 
A 1 216 GLU 216 906  906  GLU GLU A . n 
A 1 217 LEU 217 907  907  LEU LEU A . n 
A 1 218 MET 218 908  908  MET MET A . n 
A 1 219 THR 219 909  909  THR THR A . n 
A 1 220 PHE 220 910  910  PHE PHE A . n 
A 1 221 GLY 221 911  911  GLY GLY A . n 
A 1 222 SER 222 912  912  SER SER A . n 
A 1 223 LYS 223 913  913  LYS LYS A . n 
A 1 224 PRO 224 914  914  PRO PRO A . n 
A 1 225 TYR 225 915  915  TYR TYR A . n 
A 1 226 ASP 226 916  916  ASP ASP A . n 
A 1 227 GLY 227 917  917  GLY GLY A . n 
A 1 228 ILE 228 918  918  ILE ILE A . n 
A 1 229 PRO 229 919  919  PRO PRO A . n 
A 1 230 ALA 230 920  920  ALA ALA A . n 
A 1 231 SER 231 921  921  SER SER A . n 
A 1 232 GLU 232 922  922  GLU GLU A . n 
A 1 233 ILE 233 923  923  ILE ILE A . n 
A 1 234 SER 234 924  924  SER SER A . n 
A 1 235 SER 235 925  925  SER SER A . n 
A 1 236 ILE 236 926  926  ILE ILE A . n 
A 1 237 LEU 237 927  927  LEU LEU A . n 
A 1 238 GLU 238 928  928  GLU GLU A . n 
A 1 239 LYS 239 929  929  LYS LYS A . n 
A 1 240 GLY 240 930  930  GLY GLY A . n 
A 1 241 GLU 241 931  931  GLU GLU A . n 
A 1 242 ARG 242 932  932  ARG ARG A . n 
A 1 243 LEU 243 933  933  LEU LEU A . n 
A 1 244 PRO 244 934  934  PRO PRO A . n 
A 1 245 GLN 245 935  935  GLN GLN A . n 
A 1 246 PRO 246 936  936  PRO PRO A . n 
A 1 247 PRO 247 937  937  PRO PRO A . n 
A 1 248 ILE 248 938  938  ILE ILE A . n 
A 1 249 CYS 249 939  939  CYS CYS A . n 
A 1 250 THR 250 940  940  THR THR A . n 
A 1 251 ILE 251 941  941  ILE ILE A . n 
A 1 252 ASP 252 942  942  ASP ASP A . n 
A 1 253 VAL 253 943  943  VAL VAL A . n 
A 1 254 TYR 254 944  944  TYR TYR A . n 
A 1 255 MET 255 945  945  MET MET A . n 
A 1 256 ILE 256 946  946  ILE ILE A . n 
A 1 257 MET 257 947  947  MET MET A . n 
A 1 258 ARG 258 948  948  ARG ARG A . n 
A 1 259 LYS 259 949  949  LYS LYS A . n 
A 1 260 CYS 260 950  950  CYS CYS A . n 
A 1 261 TRP 261 951  951  TRP TRP A . n 
A 1 262 MET 262 952  952  MET MET A . n 
A 1 263 ILE 263 953  953  ILE ILE A . n 
A 1 264 ASP 264 954  954  ASP ASP A . n 
A 1 265 ALA 265 955  955  ALA ALA A . n 
A 1 266 ASP 266 956  956  ASP ASP A . n 
A 1 267 SER 267 957  957  SER SER A . n 
A 1 268 ARG 268 958  958  ARG ARG A . n 
A 1 269 PRO 269 959  959  PRO PRO A . n 
A 1 270 LYS 270 960  960  LYS LYS A . n 
A 1 271 PHE 271 961  961  PHE PHE A . n 
A 1 272 ARG 272 962  962  ARG ARG A . n 
A 1 273 GLU 273 963  963  GLU GLU A . n 
A 1 274 LEU 274 964  964  LEU LEU A . n 
A 1 275 ILE 275 965  965  ILE ILE A . n 
A 1 276 ILE 276 966  966  ILE ILE A . n 
A 1 277 GLU 277 967  967  GLU GLU A . n 
A 1 278 PHE 278 968  968  PHE PHE A . n 
A 1 279 SER 279 969  969  SER SER A . n 
A 1 280 LYS 280 970  970  LYS LYS A . n 
A 1 281 MET 281 971  971  MET MET A . n 
A 1 282 ALA 282 972  972  ALA ALA A . n 
A 1 283 ARG 283 973  973  ARG ARG A . n 
A 1 284 ASP 284 974  974  ASP ASP A . n 
A 1 285 PRO 285 975  975  PRO PRO A . n 
A 1 286 GLN 286 976  976  GLN GLN A . n 
A 1 287 ARG 287 977  977  ARG ARG A . n 
A 1 288 TYR 288 978  978  TYR TYR A . n 
A 1 289 LEU 289 979  979  LEU LEU A . n 
A 1 290 VAL 290 980  980  VAL VAL A . n 
A 1 291 ILE 291 981  981  ILE ILE A . n 
A 1 292 GLN 292 982  982  GLN GLN A . n 
A 1 293 GLY 293 983  983  GLY GLY A . n 
A 1 294 ASP 294 984  984  ASP ASP A . n 
A 1 295 GLU 295 985  985  GLU GLU A . n 
A 1 296 ARG 296 986  986  ARG ARG A . n 
A 1 297 MET 297 987  987  MET MET A . n 
A 1 298 HIS 298 988  988  HIS HIS A . n 
A 1 299 LEU 299 989  989  LEU LEU A . n 
A 1 300 PRO 300 990  990  PRO PRO A . n 
A 1 301 SER 301 991  991  SER SER A . n 
A 1 302 PRO 302 992  992  PRO PRO A . n 
A 1 303 THR 303 993  993  THR THR A . n 
A 1 304 ASP 304 994  994  ASP ASP A . n 
A 1 305 SER 305 995  995  SER SER A . n 
A 1 306 ASN 306 996  996  ASN ASN A . n 
A 1 307 PHE 307 997  997  PHE PHE A . n 
A 1 308 TYR 308 998  998  TYR TYR A . n 
A 1 309 ARG 309 999  999  ARG ARG A . n 
A 1 310 ALA 310 1000 1000 ALA ALA A . n 
A 1 311 LEU 311 1001 1001 LEU LEU A . n 
A 1 312 MET 312 1002 1002 MET MET A . n 
A 1 313 ASP 313 1003 ?    ?   ?   A . n 
A 1 314 GLU 314 1004 ?    ?   ?   A . n 
A 1 315 GLU 315 1005 ?    ?   ?   A . n 
A 1 316 ASP 316 1006 ?    ?   ?   A . n 
A 1 317 MET 317 1007 ?    ?   ?   A . n 
A 1 318 ASP 318 1008 ?    ?   ?   A . n 
A 1 319 ASP 319 1009 ?    ?   ?   A . n 
A 1 320 VAL 320 1010 ?    ?   ?   A . n 
A 1 321 VAL 321 1011 ?    ?   ?   A . n 
A 1 322 ASP 322 1012 ?    ?   ?   A . n 
A 1 323 ALA 323 1013 ?    ?   ?   A . n 
A 1 324 ASP 324 1014 1014 ASP ASP A . n 
A 1 325 GLU 325 1015 1015 GLU GLU A . n 
A 1 326 TYR 326 1016 1016 TYR TYR A . n 
A 1 327 LEU 327 1017 1017 LEU LEU A . n 
A 1 328 ILE 328 1018 1018 ILE ILE A . n 
A 1 329 PRO 329 1019 1019 PRO PRO A . n 
A 1 330 GLN 330 1020 1020 GLN GLN A . n 
A 1 331 GLN 331 1021 1021 GLN GLN A . n 
A 1 332 GLY 332 1022 ?    ?   ?   A . n 
A 1 333 HIS 333 1023 ?    ?   ?   A . n 
A 1 334 HIS 334 1024 ?    ?   ?   A . n 
A 1 335 HIS 335 1025 ?    ?   ?   A . n 
A 1 336 HIS 336 1026 ?    ?   ?   A . n 
A 1 337 HIS 337 1027 ?    ?   ?   A . n 
A 1 338 HIS 338 1028 ?    ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        A1IMT 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   A1IMT 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
B 2 NA    1   1101 1031 NA    NA  A . 
C 2 NA    1   1102 1032 NA    NA  A . 
D 3 GOL   1   1103 1041 GOL   GOL A . 
E 4 EDO   1   1104 1052 EDO   EDO A . 
F 5 A1IMT 1   1105 2001 A1IMT LIG A . 
G 6 HOH   1   1201 147  HOH   HOH A . 
G 6 HOH   2   1202 283  HOH   HOH A . 
G 6 HOH   3   1203 190  HOH   HOH A . 
G 6 HOH   4   1204 192  HOH   HOH A . 
G 6 HOH   5   1205 279  HOH   HOH A . 
G 6 HOH   6   1206 91   HOH   HOH A . 
G 6 HOH   7   1207 145  HOH   HOH A . 
G 6 HOH   8   1208 286  HOH   HOH A . 
G 6 HOH   9   1209 136  HOH   HOH A . 
G 6 HOH   10  1210 309  HOH   HOH A . 
G 6 HOH   11  1211 38   HOH   HOH A . 
G 6 HOH   12  1212 312  HOH   HOH A . 
G 6 HOH   13  1213 270  HOH   HOH A . 
G 6 HOH   14  1214 202  HOH   HOH A . 
G 6 HOH   15  1215 51   HOH   HOH A . 
G 6 HOH   16  1216 74   HOH   HOH A . 
G 6 HOH   17  1217 60   HOH   HOH A . 
G 6 HOH   18  1218 135  HOH   HOH A . 
G 6 HOH   19  1219 346  HOH   HOH A . 
G 6 HOH   20  1220 43   HOH   HOH A . 
G 6 HOH   21  1221 36   HOH   HOH A . 
G 6 HOH   22  1222 113  HOH   HOH A . 
G 6 HOH   23  1223 12   HOH   HOH A . 
G 6 HOH   24  1224 109  HOH   HOH A . 
G 6 HOH   25  1225 193  HOH   HOH A . 
G 6 HOH   26  1226 140  HOH   HOH A . 
G 6 HOH   27  1227 54   HOH   HOH A . 
G 6 HOH   28  1228 72   HOH   HOH A . 
G 6 HOH   29  1229 200  HOH   HOH A . 
G 6 HOH   30  1230 15   HOH   HOH A . 
G 6 HOH   31  1231 354  HOH   HOH A . 
G 6 HOH   32  1232 129  HOH   HOH A . 
G 6 HOH   33  1233 297  HOH   HOH A . 
G 6 HOH   34  1234 93   HOH   HOH A . 
G 6 HOH   35  1235 10   HOH   HOH A . 
G 6 HOH   36  1236 183  HOH   HOH A . 
G 6 HOH   37  1237 361  HOH   HOH A . 
G 6 HOH   38  1238 232  HOH   HOH A . 
G 6 HOH   39  1239 199  HOH   HOH A . 
G 6 HOH   40  1240 98   HOH   HOH A . 
G 6 HOH   41  1241 347  HOH   HOH A . 
G 6 HOH   42  1242 23   HOH   HOH A . 
G 6 HOH   43  1243 168  HOH   HOH A . 
G 6 HOH   44  1244 47   HOH   HOH A . 
G 6 HOH   45  1245 116  HOH   HOH A . 
G 6 HOH   46  1246 32   HOH   HOH A . 
G 6 HOH   47  1247 42   HOH   HOH A . 
G 6 HOH   48  1248 88   HOH   HOH A . 
G 6 HOH   49  1249 76   HOH   HOH A . 
G 6 HOH   50  1250 253  HOH   HOH A . 
G 6 HOH   51  1251 262  HOH   HOH A . 
G 6 HOH   52  1252 26   HOH   HOH A . 
G 6 HOH   53  1253 231  HOH   HOH A . 
G 6 HOH   54  1254 158  HOH   HOH A . 
G 6 HOH   55  1255 276  HOH   HOH A . 
G 6 HOH   56  1256 311  HOH   HOH A . 
G 6 HOH   57  1257 39   HOH   HOH A . 
G 6 HOH   58  1258 230  HOH   HOH A . 
G 6 HOH   59  1259 65   HOH   HOH A . 
G 6 HOH   60  1260 101  HOH   HOH A . 
G 6 HOH   61  1261 27   HOH   HOH A . 
G 6 HOH   62  1262 122  HOH   HOH A . 
G 6 HOH   63  1263 285  HOH   HOH A . 
G 6 HOH   64  1264 22   HOH   HOH A . 
G 6 HOH   65  1265 18   HOH   HOH A . 
G 6 HOH   66  1266 164  HOH   HOH A . 
G 6 HOH   67  1267 112  HOH   HOH A . 
G 6 HOH   68  1268 332  HOH   HOH A . 
G 6 HOH   69  1269 251  HOH   HOH A . 
G 6 HOH   70  1270 20   HOH   HOH A . 
G 6 HOH   71  1271 49   HOH   HOH A . 
G 6 HOH   72  1272 240  HOH   HOH A . 
G 6 HOH   73  1273 50   HOH   HOH A . 
G 6 HOH   74  1274 102  HOH   HOH A . 
G 6 HOH   75  1275 152  HOH   HOH A . 
G 6 HOH   76  1276 96   HOH   HOH A . 
G 6 HOH   77  1277 7    HOH   HOH A . 
G 6 HOH   78  1278 245  HOH   HOH A . 
G 6 HOH   79  1279 288  HOH   HOH A . 
G 6 HOH   80  1280 3    HOH   HOH A . 
G 6 HOH   81  1281 128  HOH   HOH A . 
G 6 HOH   82  1282 173  HOH   HOH A . 
G 6 HOH   83  1283 148  HOH   HOH A . 
G 6 HOH   84  1284 198  HOH   HOH A . 
G 6 HOH   85  1285 67   HOH   HOH A . 
G 6 HOH   86  1286 123  HOH   HOH A . 
G 6 HOH   87  1287 110  HOH   HOH A . 
G 6 HOH   88  1288 99   HOH   HOH A . 
G 6 HOH   89  1289 143  HOH   HOH A . 
G 6 HOH   90  1290 206  HOH   HOH A . 
G 6 HOH   91  1291 307  HOH   HOH A . 
G 6 HOH   92  1292 14   HOH   HOH A . 
G 6 HOH   93  1293 127  HOH   HOH A . 
G 6 HOH   94  1294 61   HOH   HOH A . 
G 6 HOH   95  1295 48   HOH   HOH A . 
G 6 HOH   96  1296 296  HOH   HOH A . 
G 6 HOH   97  1297 357  HOH   HOH A . 
G 6 HOH   98  1298 70   HOH   HOH A . 
G 6 HOH   99  1299 225  HOH   HOH A . 
G 6 HOH   100 1300 8    HOH   HOH A . 
G 6 HOH   101 1301 107  HOH   HOH A . 
G 6 HOH   102 1302 139  HOH   HOH A . 
G 6 HOH   103 1303 305  HOH   HOH A . 
G 6 HOH   104 1304 13   HOH   HOH A . 
G 6 HOH   105 1305 138  HOH   HOH A . 
G 6 HOH   106 1306 205  HOH   HOH A . 
G 6 HOH   107 1307 313  HOH   HOH A . 
G 6 HOH   108 1308 356  HOH   HOH A . 
G 6 HOH   109 1309 255  HOH   HOH A . 
G 6 HOH   110 1310 78   HOH   HOH A . 
G 6 HOH   111 1311 248  HOH   HOH A . 
G 6 HOH   112 1312 325  HOH   HOH A . 
G 6 HOH   113 1313 314  HOH   HOH A . 
G 6 HOH   114 1314 333  HOH   HOH A . 
G 6 HOH   115 1315 21   HOH   HOH A . 
G 6 HOH   116 1316 52   HOH   HOH A . 
G 6 HOH   117 1317 59   HOH   HOH A . 
G 6 HOH   118 1318 82   HOH   HOH A . 
G 6 HOH   119 1319 167  HOH   HOH A . 
G 6 HOH   120 1320 56   HOH   HOH A . 
G 6 HOH   121 1321 81   HOH   HOH A . 
G 6 HOH   122 1322 44   HOH   HOH A . 
G 6 HOH   123 1323 374  HOH   HOH A . 
G 6 HOH   124 1324 277  HOH   HOH A . 
G 6 HOH   125 1325 77   HOH   HOH A . 
G 6 HOH   126 1326 182  HOH   HOH A . 
G 6 HOH   127 1327 30   HOH   HOH A . 
G 6 HOH   128 1328 57   HOH   HOH A . 
G 6 HOH   129 1329 310  HOH   HOH A . 
G 6 HOH   130 1330 226  HOH   HOH A . 
G 6 HOH   131 1331 235  HOH   HOH A . 
G 6 HOH   132 1332 359  HOH   HOH A . 
G 6 HOH   133 1333 66   HOH   HOH A . 
G 6 HOH   134 1334 6    HOH   HOH A . 
G 6 HOH   135 1335 315  HOH   HOH A . 
G 6 HOH   136 1336 229  HOH   HOH A . 
G 6 HOH   137 1337 104  HOH   HOH A . 
G 6 HOH   138 1338 372  HOH   HOH A . 
G 6 HOH   139 1339 294  HOH   HOH A . 
G 6 HOH   140 1340 111  HOH   HOH A . 
G 6 HOH   141 1341 216  HOH   HOH A . 
G 6 HOH   142 1342 153  HOH   HOH A . 
G 6 HOH   143 1343 242  HOH   HOH A . 
G 6 HOH   144 1344 220  HOH   HOH A . 
G 6 HOH   145 1345 160  HOH   HOH A . 
G 6 HOH   146 1346 126  HOH   HOH A . 
G 6 HOH   147 1347 132  HOH   HOH A . 
G 6 HOH   148 1348 4    HOH   HOH A . 
G 6 HOH   149 1349 236  HOH   HOH A . 
G 6 HOH   150 1350 196  HOH   HOH A . 
G 6 HOH   151 1351 5    HOH   HOH A . 
G 6 HOH   152 1352 208  HOH   HOH A . 
G 6 HOH   153 1353 234  HOH   HOH A . 
G 6 HOH   154 1354 151  HOH   HOH A . 
G 6 HOH   155 1355 1    HOH   HOH A . 
G 6 HOH   156 1356 121  HOH   HOH A . 
G 6 HOH   157 1357 239  HOH   HOH A . 
G 6 HOH   158 1358 290  HOH   HOH A . 
G 6 HOH   159 1359 117  HOH   HOH A . 
G 6 HOH   160 1360 87   HOH   HOH A . 
G 6 HOH   161 1361 97   HOH   HOH A . 
G 6 HOH   162 1362 319  HOH   HOH A . 
G 6 HOH   163 1363 364  HOH   HOH A . 
G 6 HOH   164 1364 68   HOH   HOH A . 
G 6 HOH   165 1365 266  HOH   HOH A . 
G 6 HOH   166 1366 2    HOH   HOH A . 
G 6 HOH   167 1367 33   HOH   HOH A . 
G 6 HOH   168 1368 130  HOH   HOH A . 
G 6 HOH   169 1369 203  HOH   HOH A . 
G 6 HOH   170 1370 259  HOH   HOH A . 
G 6 HOH   171 1371 244  HOH   HOH A . 
G 6 HOH   172 1372 64   HOH   HOH A . 
G 6 HOH   173 1373 124  HOH   HOH A . 
G 6 HOH   174 1374 169  HOH   HOH A . 
G 6 HOH   175 1375 95   HOH   HOH A . 
G 6 HOH   176 1376 336  HOH   HOH A . 
G 6 HOH   177 1377 41   HOH   HOH A . 
G 6 HOH   178 1378 34   HOH   HOH A . 
G 6 HOH   179 1379 25   HOH   HOH A . 
G 6 HOH   180 1380 141  HOH   HOH A . 
G 6 HOH   181 1381 252  HOH   HOH A . 
G 6 HOH   182 1382 260  HOH   HOH A . 
G 6 HOH   183 1383 349  HOH   HOH A . 
G 6 HOH   184 1384 150  HOH   HOH A . 
G 6 HOH   185 1385 250  HOH   HOH A . 
G 6 HOH   186 1386 326  HOH   HOH A . 
G 6 HOH   187 1387 53   HOH   HOH A . 
G 6 HOH   188 1388 115  HOH   HOH A . 
G 6 HOH   189 1389 114  HOH   HOH A . 
G 6 HOH   190 1390 58   HOH   HOH A . 
G 6 HOH   191 1391 85   HOH   HOH A . 
G 6 HOH   192 1392 268  HOH   HOH A . 
G 6 HOH   193 1393 119  HOH   HOH A . 
G 6 HOH   194 1394 55   HOH   HOH A . 
G 6 HOH   195 1395 28   HOH   HOH A . 
G 6 HOH   196 1396 178  HOH   HOH A . 
G 6 HOH   197 1397 16   HOH   HOH A . 
G 6 HOH   198 1398 11   HOH   HOH A . 
G 6 HOH   199 1399 331  HOH   HOH A . 
G 6 HOH   200 1400 343  HOH   HOH A . 
G 6 HOH   201 1401 241  HOH   HOH A . 
G 6 HOH   202 1402 303  HOH   HOH A . 
G 6 HOH   203 1403 263  HOH   HOH A . 
G 6 HOH   204 1404 181  HOH   HOH A . 
G 6 HOH   205 1405 106  HOH   HOH A . 
G 6 HOH   206 1406 281  HOH   HOH A . 
G 6 HOH   207 1407 320  HOH   HOH A . 
G 6 HOH   208 1408 71   HOH   HOH A . 
G 6 HOH   209 1409 271  HOH   HOH A . 
G 6 HOH   210 1410 17   HOH   HOH A . 
G 6 HOH   211 1411 210  HOH   HOH A . 
G 6 HOH   212 1412 163  HOH   HOH A . 
G 6 HOH   213 1413 300  HOH   HOH A . 
G 6 HOH   214 1414 120  HOH   HOH A . 
G 6 HOH   215 1415 334  HOH   HOH A . 
G 6 HOH   216 1416 171  HOH   HOH A . 
G 6 HOH   217 1417 341  HOH   HOH A . 
G 6 HOH   218 1418 86   HOH   HOH A . 
G 6 HOH   219 1419 280  HOH   HOH A . 
G 6 HOH   220 1420 254  HOH   HOH A . 
G 6 HOH   221 1421 40   HOH   HOH A . 
G 6 HOH   222 1422 342  HOH   HOH A . 
G 6 HOH   223 1423 90   HOH   HOH A . 
G 6 HOH   224 1424 185  HOH   HOH A . 
G 6 HOH   225 1425 258  HOH   HOH A . 
G 6 HOH   226 1426 298  HOH   HOH A . 
G 6 HOH   227 1427 355  HOH   HOH A . 
G 6 HOH   228 1428 350  HOH   HOH A . 
G 6 HOH   229 1429 63   HOH   HOH A . 
G 6 HOH   230 1430 299  HOH   HOH A . 
G 6 HOH   231 1431 275  HOH   HOH A . 
G 6 HOH   232 1432 339  HOH   HOH A . 
G 6 HOH   233 1433 29   HOH   HOH A . 
G 6 HOH   234 1434 269  HOH   HOH A . 
G 6 HOH   235 1435 289  HOH   HOH A . 
G 6 HOH   236 1436 371  HOH   HOH A . 
G 6 HOH   237 1437 362  HOH   HOH A . 
G 6 HOH   238 1438 188  HOH   HOH A . 
G 6 HOH   239 1439 172  HOH   HOH A . 
G 6 HOH   240 1440 133  HOH   HOH A . 
G 6 HOH   241 1441 365  HOH   HOH A . 
G 6 HOH   242 1442 184  HOH   HOH A . 
G 6 HOH   243 1443 256  HOH   HOH A . 
G 6 HOH   244 1444 165  HOH   HOH A . 
G 6 HOH   245 1445 272  HOH   HOH A . 
G 6 HOH   246 1446 177  HOH   HOH A . 
G 6 HOH   247 1447 155  HOH   HOH A . 
G 6 HOH   248 1448 243  HOH   HOH A . 
G 6 HOH   249 1449 134  HOH   HOH A . 
G 6 HOH   250 1450 176  HOH   HOH A . 
G 6 HOH   251 1451 317  HOH   HOH A . 
G 6 HOH   252 1452 170  HOH   HOH A . 
G 6 HOH   253 1453 103  HOH   HOH A . 
G 6 HOH   254 1454 108  HOH   HOH A . 
G 6 HOH   255 1455 31   HOH   HOH A . 
G 6 HOH   256 1456 89   HOH   HOH A . 
G 6 HOH   257 1457 191  HOH   HOH A . 
G 6 HOH   258 1458 324  HOH   HOH A . 
G 6 HOH   259 1459 125  HOH   HOH A . 
G 6 HOH   260 1460 348  HOH   HOH A . 
G 6 HOH   261 1461 318  HOH   HOH A . 
G 6 HOH   262 1462 195  HOH   HOH A . 
G 6 HOH   263 1463 293  HOH   HOH A . 
G 6 HOH   264 1464 228  HOH   HOH A . 
G 6 HOH   265 1465 142  HOH   HOH A . 
G 6 HOH   266 1466 180  HOH   HOH A . 
G 6 HOH   267 1467 24   HOH   HOH A . 
G 6 HOH   268 1468 84   HOH   HOH A . 
G 6 HOH   269 1469 187  HOH   HOH A . 
G 6 HOH   270 1470 322  HOH   HOH A . 
G 6 HOH   271 1471 264  HOH   HOH A . 
G 6 HOH   272 1472 237  HOH   HOH A . 
G 6 HOH   273 1473 367  HOH   HOH A . 
G 6 HOH   274 1474 287  HOH   HOH A . 
G 6 HOH   275 1475 217  HOH   HOH A . 
G 6 HOH   276 1476 149  HOH   HOH A . 
G 6 HOH   277 1477 218  HOH   HOH A . 
G 6 HOH   278 1478 162  HOH   HOH A . 
G 6 HOH   279 1479 369  HOH   HOH A . 
G 6 HOH   280 1480 323  HOH   HOH A . 
G 6 HOH   281 1481 304  HOH   HOH A . 
G 6 HOH   282 1482 75   HOH   HOH A . 
G 6 HOH   283 1483 118  HOH   HOH A . 
G 6 HOH   284 1484 73   HOH   HOH A . 
G 6 HOH   285 1485 175  HOH   HOH A . 
G 6 HOH   286 1486 157  HOH   HOH A . 
G 6 HOH   287 1487 174  HOH   HOH A . 
G 6 HOH   288 1488 360  HOH   HOH A . 
G 6 HOH   289 1489 328  HOH   HOH A . 
G 6 HOH   290 1490 146  HOH   HOH A . 
G 6 HOH   291 1491 159  HOH   HOH A . 
G 6 HOH   292 1492 100  HOH   HOH A . 
G 6 HOH   293 1493 345  HOH   HOH A . 
G 6 HOH   294 1494 204  HOH   HOH A . 
G 6 HOH   295 1495 83   HOH   HOH A . 
G 6 HOH   296 1496 224  HOH   HOH A . 
G 6 HOH   297 1497 316  HOH   HOH A . 
G 6 HOH   298 1498 327  HOH   HOH A . 
G 6 HOH   299 1499 207  HOH   HOH A . 
G 6 HOH   300 1500 306  HOH   HOH A . 
G 6 HOH   301 1501 94   HOH   HOH A . 
G 6 HOH   302 1502 247  HOH   HOH A . 
G 6 HOH   303 1503 329  HOH   HOH A . 
G 6 HOH   304 1504 278  HOH   HOH A . 
G 6 HOH   305 1505 221  HOH   HOH A . 
G 6 HOH   306 1506 161  HOH   HOH A . 
G 6 HOH   307 1507 274  HOH   HOH A . 
G 6 HOH   308 1508 19   HOH   HOH A . 
G 6 HOH   309 1509 335  HOH   HOH A . 
G 6 HOH   310 1510 308  HOH   HOH A . 
G 6 HOH   311 1511 9    HOH   HOH A . 
G 6 HOH   312 1512 219  HOH   HOH A . 
G 6 HOH   313 1513 238  HOH   HOH A . 
G 6 HOH   314 1514 62   HOH   HOH A . 
G 6 HOH   315 1515 37   HOH   HOH A . 
G 6 HOH   316 1516 340  HOH   HOH A . 
G 6 HOH   317 1517 197  HOH   HOH A . 
G 6 HOH   318 1518 214  HOH   HOH A . 
G 6 HOH   319 1519 154  HOH   HOH A . 
G 6 HOH   320 1520 35   HOH   HOH A . 
G 6 HOH   321 1521 105  HOH   HOH A . 
G 6 HOH   322 1522 131  HOH   HOH A . 
G 6 HOH   323 1523 201  HOH   HOH A . 
G 6 HOH   324 1524 284  HOH   HOH A . 
G 6 HOH   325 1525 295  HOH   HOH A . 
G 6 HOH   326 1526 215  HOH   HOH A . 
G 6 HOH   327 1527 46   HOH   HOH A . 
G 6 HOH   328 1528 265  HOH   HOH A . 
G 6 HOH   329 1529 291  HOH   HOH A . 
G 6 HOH   330 1530 233  HOH   HOH A . 
G 6 HOH   331 1531 156  HOH   HOH A . 
G 6 HOH   332 1532 189  HOH   HOH A . 
G 6 HOH   333 1533 337  HOH   HOH A . 
G 6 HOH   334 1534 166  HOH   HOH A . 
G 6 HOH   335 1535 209  HOH   HOH A . 
G 6 HOH   336 1536 212  HOH   HOH A . 
G 6 HOH   337 1537 213  HOH   HOH A . 
G 6 HOH   338 1538 194  HOH   HOH A . 
G 6 HOH   339 1539 79   HOH   HOH A . 
G 6 HOH   340 1540 179  HOH   HOH A . 
G 6 HOH   341 1541 45   HOH   HOH A . 
G 6 HOH   342 1542 301  HOH   HOH A . 
G 6 HOH   343 1543 211  HOH   HOH A . 
G 6 HOH   344 1544 353  HOH   HOH A . 
G 6 HOH   345 1545 92   HOH   HOH A . 
G 6 HOH   346 1546 351  HOH   HOH A . 
G 6 HOH   347 1547 358  HOH   HOH A . 
G 6 HOH   348 1548 366  HOH   HOH A . 
G 6 HOH   349 1549 330  HOH   HOH A . 
G 6 HOH   350 1550 344  HOH   HOH A . 
G 6 HOH   351 1551 373  HOH   HOH A . 
G 6 HOH   352 1552 223  HOH   HOH A . 
G 6 HOH   353 1553 186  HOH   HOH A . 
G 6 HOH   354 1554 227  HOH   HOH A . 
G 6 HOH   355 1555 222  HOH   HOH A . 
G 6 HOH   356 1556 321  HOH   HOH A . 
G 6 HOH   357 1557 80   HOH   HOH A . 
G 6 HOH   358 1558 352  HOH   HOH A . 
G 6 HOH   359 1559 267  HOH   HOH A . 
G 6 HOH   360 1560 261  HOH   HOH A . 
G 6 HOH   361 1561 302  HOH   HOH A . 
G 6 HOH   362 1562 273  HOH   HOH A . 
G 6 HOH   363 1563 282  HOH   HOH A . 
G 6 HOH   364 1564 69   HOH   HOH A . 
G 6 HOH   365 1565 338  HOH   HOH A . 
G 6 HOH   366 1566 246  HOH   HOH A . 
G 6 HOH   367 1567 257  HOH   HOH A . 
G 6 HOH   368 1568 363  HOH   HOH A . 
G 6 HOH   369 1569 292  HOH   HOH A . 
G 6 HOH   370 1570 249  HOH   HOH A . 
G 6 HOH   371 1571 137  HOH   HOH A . 
G 6 HOH   372 1572 370  HOH   HOH A . 
G 6 HOH   373 1573 368  HOH   HOH A . 
G 6 HOH   374 1574 144  HOH   HOH A . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement        ? ? ? ? ? ? ? ? ? ? ? BUSTER    ? ? ? 2.11.8           1 
? 'data processing' ? ? ? ? ? ? ? ? ? ? ? autoPROC  ? ? ? '1.1.7 20230222' 2 
? 'data reduction'  ? ? ? ? ? ? ? ? ? ? ? XDS       ? ? ? 'Jan 10, 2022'   3 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? Aimless   ? ? ? 0.7.9            4 
? 'data scaling'    ? ? ? ? ? ? ? ? ? ? ? STARANISO ? ? ? 2.3.92           5 
? phasing           ? ? ? ? ? ? ? ? ? ? ? PHASER    ? ? ? .                6 
# 
_cell.angle_alpha                  90 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9GL8 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     40.291 
_cell.length_a_esd                 ? 
_cell.length_b                     106.741 
_cell.length_b_esd                 ? 
_cell.length_c                     175.21 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_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                         9GL8 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                20 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'C 2 2 21' 
_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                   9GL8 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.44 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          49.49 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              6.5 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '0.2 M Potassium Chloride, 0.1 Magnesium Acetate, 0.05 M MES-NaOH pH 6.5, 10% w/v PEG 8000' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS3 2M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-05-17 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.965459 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'ESRF BEAMLINE MASSIF-1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.965459 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   MASSIF-1 
_diffrn_source.pdbx_synchrotron_site       ESRF 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9GL8 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.63 
_reflns.d_resolution_low                               34.626 
_reflns.details                                        ? 
_reflns.limit_h_max                                    ? 
_reflns.limit_h_min                                    ? 
_reflns.limit_k_max                                    ? 
_reflns.limit_k_min                                    ? 
_reflns.limit_l_max                                    ? 
_reflns.limit_l_min                                    ? 
_reflns.number_all                                     ? 
_reflns.number_obs                                     35208 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           92.6 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                13.09 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          13.48 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.1038 
_reflns.pdbx_Rpim_I_all                                0.0286 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.998 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.0997 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
loop_
_reflns_shell.d_res_high 
_reflns_shell.d_res_low 
_reflns_shell.meanI_over_sigI_all 
_reflns_shell.meanI_over_sigI_obs 
_reflns_shell.number_measured_all 
_reflns_shell.number_measured_obs 
_reflns_shell.number_possible 
_reflns_shell.number_unique_all 
_reflns_shell.number_unique_obs 
_reflns_shell.percent_possible_obs 
_reflns_shell.Rmerge_F_all 
_reflns_shell.Rmerge_F_obs 
_reflns_shell.meanI_over_sigI_gt 
_reflns_shell.meanI_over_uI_all 
_reflns_shell.meanI_over_uI_gt 
_reflns_shell.number_measured_gt 
_reflns_shell.number_unique_gt 
_reflns_shell.percent_possible_gt 
_reflns_shell.Rmerge_F_gt 
_reflns_shell.Rmerge_I_gt 
_reflns_shell.pdbx_redundancy 
_reflns_shell.pdbx_chi_squared 
_reflns_shell.pdbx_netI_over_sigmaI_all 
_reflns_shell.pdbx_netI_over_sigmaI_obs 
_reflns_shell.pdbx_Rrim_I_all 
_reflns_shell.pdbx_Rpim_I_all 
_reflns_shell.pdbx_rejects 
_reflns_shell.pdbx_ordinal 
_reflns_shell.pdbx_diffrn_id 
_reflns_shell.pdbx_CC_half 
_reflns_shell.pdbx_CC_star 
_reflns_shell.pdbx_R_split 
_reflns_shell.percent_possible_all 
_reflns_shell.Rmerge_I_all 
_reflns_shell.Rmerge_I_obs 
_reflns_shell.pdbx_Rsym_value 
_reflns_shell.pdbx_percent_possible_ellipsoidal 
_reflns_shell.pdbx_percent_possible_spherical 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous 
_reflns_shell.pdbx_percent_possible_spherical_anomalous 
_reflns_shell.pdbx_redundancy_anomalous 
_reflns_shell.pdbx_CC_half_anomalous 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous 
_reflns_shell.pdbx_percent_possible_anomalous 
3.968 34.626 ? 35.12 ? ? ? ? 3521 ? ? ? ? ? ? ? ? ? ? ? 12.47 ? ? ? 0.0621 0.0176 ? 1  1 0.997 ? ? 100.0 ? 0.0594 ? ? ? ? ? ? ? ? 
? 
3.126 3.968  ? 30.64 ? ? ? ? 3521 ? ? ? ? ? ? ? ? ? ? ? 13.26 ? ? ? 0.0675 0.0184 ? 2  1 0.998 ? ? 100.0 ? 0.0649 ? ? ? ? ? ? ? ? 
? 
2.721 3.126  ? 21.63 ? ? ? ? 3520 ? ? ? ? ? ? ? ? ? ? ? 13.23 ? ? ? 0.1004 0.0274 ? 3  1 0.998 ? ? 100.0 ? 0.0966 ? ? ? ? ? ? ? ? 
? 
2.468 2.721  ? 14.92 ? ? ? ? 3521 ? ? ? ? ? ? ? ? ? ? ? 13.29 ? ? ? 0.1520 0.0412 ? 4  1 0.996 ? ? 100.0 ? 0.1462 ? ? ? ? ? ? ? ? 
? 
2.287 2.468  ? 10.92 ? ? ? ? 3521 ? ? ? ? ? ? ? ? ? ? ? 13.20 ? ? ? 0.2139 0.0583 ? 5  1 0.993 ? ? 100.0 ? 0.2057 ? ? ? ? ? ? ? ? 
? 
2.150 2.287  ? 8.17  ? ? ? ? 3521 ? ? ? ? ? ? ? ? ? ? ? 13.48 ? ? ? 0.3056 0.0821 ? 6  1 0.987 ? ? 100.0 ? 0.2942 ? ? ? ? ? ? ? ? 
? 
2.039 2.150  ? 5.30  ? ? ? ? 3521 ? ? ? ? ? ? ? ? ? ? ? 13.29 ? ? ? 0.4794 0.1299 ? 7  1 0.978 ? ? 100.0 ? 0.4612 ? ? ? ? ? ? ? ? 
? 
1.948 2.039  ? 3.55  ? ? ? ? 3520 ? ? ? ? ? ? ? ? ? ? ? 13.36 ? ? ? 0.7541 0.2038 ? 8  1 0.951 ? ? 98.8  ? 0.7257 ? ? ? ? ? ? ? ? 
? 
1.852 1.948  ? 2.60  ? ? ? ? 3521 ? ? ? ? ? ? ? ? ? ? ? 13.65 ? ? ? 1.0877 0.2927 ? 9  1 0.918 ? ? 81.7  ? 1.0472 ? ? ? ? ? ? ? ? 
? 
1.632 1.852  ? 1.98  ? ? ? ? 3521 ? ? ? ? ? ? ? ? ? ? ? 11.68 ? ? ? 1.2378 0.3564 ? 10 1 0.815 ? ? 63.5  ? 1.1833 ? ? ? ? ? ? ? ? 
? 
# 
_refine.aniso_B[1][1]                            0.091 
_refine.aniso_B[1][2]                            0 
_refine.aniso_B[1][3]                            0 
_refine.aniso_B[2][2]                            1.2626 
_refine.aniso_B[2][3]                            0 
_refine.aniso_B[3][3]                            -1.3536 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               33.15 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.954 
_refine.correlation_coeff_Fo_to_Fc_free          0.931 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9GL8 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.632 
_refine.ls_d_res_low                             34.626 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     35208 
_refine.ls_number_reflns_R_free                  1671 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    74 
_refine.ls_percent_reflns_R_free                 ? 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1885 
_refine.ls_R_factor_R_free                       0.2244 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1867 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    ? 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             ? 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             ? 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   0.117 
_refine.pdbx_overall_SU_R_free_Blow_DPI          0.123 
_refine.pdbx_overall_SU_R_Blow_DPI               0.131 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            ? 
_refine.overall_SU_R_Cruickshank_DPI             0.16 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_analyze.entry_id                        9GL8 
_refine_analyze.pdbx_refine_id                  'X-RAY DIFFRACTION' 
_refine_analyze.Luzzati_coordinate_error_free   ? 
_refine_analyze.Luzzati_coordinate_error_obs    0.23 
_refine_analyze.Luzzati_d_res_low_free          ? 
_refine_analyze.Luzzati_d_res_low_obs           ? 
_refine_analyze.Luzzati_sigma_a_free            ? 
_refine_analyze.Luzzati_sigma_a_free_details    ? 
_refine_analyze.Luzzati_sigma_a_obs             ? 
_refine_analyze.Luzzati_sigma_a_obs_details     ? 
_refine_analyze.number_disordered_residues      ? 
_refine_analyze.occupancy_sum_hydrogen          ? 
_refine_analyze.occupancy_sum_non_hydrogen      ? 
_refine_analyze.RG_d_res_high                   ? 
_refine_analyze.RG_d_res_low                    ? 
_refine_analyze.RG_free                         ? 
_refine_analyze.RG_work                         ? 
_refine_analyze.RG_free_work_ratio              ? 
_refine_analyze.pdbx_Luzzati_d_res_high_obs     ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.632 
_refine_hist.d_res_low                        34.626 
_refine_hist.number_atoms_solvent             374 
_refine_hist.number_atoms_total               2910 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        2482 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         54 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.01  ? 5222 ? t_bond_d                  2  HARMONIC     
'X-RAY DIFFRACTION' ? 1     ? 9459 ? t_angle_deg               2  HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 1566 ? t_dihedral_angle_d        2  SINUSOIDAL   
'X-RAY DIFFRACTION' ? ?     ? 799  ? t_gen_planes              5  HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 2646 ? t_it                      10 HARMONIC     
'X-RAY DIFFRACTION' ? ?     ? 0    ? t_nbd                     5  SEMIHARMONIC 
'X-RAY DIFFRACTION' ? ?     ? 332  ? t_chiral_improper_torsion 5  SEMIHARMONIC 
'X-RAY DIFFRACTION' ? ?     ? 4794 ? t_ideal_dist_contact      4  SEMIHARMONIC 
'X-RAY DIFFRACTION' ? 3.42  ? ?    ? t_omega_torsion           ?  ?            
'X-RAY DIFFRACTION' ? 14.93 ? ?    ? t_other_torsion           ?  ?            
# 
_refine_ls_shell.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_ls_shell.d_res_high                       1.632 
_refine_ls_shell.d_res_low                        1.72 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                ? 
_refine_ls_shell.number_reflns_R_free             32 
_refine_ls_shell.number_reflns_R_work             ? 
_refine_ls_shell.percent_reflns_obs               10.68 
_refine_ls_shell.percent_reflns_R_free            ? 
_refine_ls_shell.R_factor_all                     ? 
_refine_ls_shell.R_factor_obs                     ? 
_refine_ls_shell.R_factor_R_free_error            ? 
_refine_ls_shell.R_factor_R_work                  0.275 
_refine_ls_shell.redundancy_reflns_all            ? 
_refine_ls_shell.redundancy_reflns_obs            ? 
_refine_ls_shell.wR_factor_all                    ? 
_refine_ls_shell.wR_factor_obs                    ? 
_refine_ls_shell.wR_factor_R_free                 ? 
_refine_ls_shell.wR_factor_R_work                 ? 
_refine_ls_shell.pdbx_R_complete                  ? 
_refine_ls_shell.pdbx_total_number_of_bins_used   ? 
_refine_ls_shell.pdbx_phase_error                 ? 
_refine_ls_shell.pdbx_fsc_work                    ? 
_refine_ls_shell.pdbx_fsc_free                    ? 
_refine_ls_shell.R_factor_R_free                  0.292 
# 
_struct.entry_id                     9GL8 
_struct.title                        'EGFR Exon20 insertion mutant NPG bound with STX-721' 
_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        9GL8 
_struct_keywords.text            'Kinase, Inhibitor, TRANSFERASE' 
_struct_keywords.pdbx_keywords   TRANSFERASE 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 2 ? 
D N N 3 ? 
E N N 4 ? 
F N N 5 ? 
G N N 6 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    EGFR_HUMAN 
_struct_ref.pdbx_db_accession          P00533 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;SGEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKELREATSPKANKEILDEAYVMASVDNPHV
CRLLGICLTSTVQLITQLMPFGCLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQHVKIT
DFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKGERLP
QPPICTIDVYMIMVKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLPSPTDSNFYRALMDEEDMDDVVDAD
EYLIPQQG
;
_struct_ref.pdbx_align_begin           695 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9GL8 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 2 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 332 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P00533 
_struct_ref_seq.db_align_beg                  695 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  1022 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       695 
_struct_ref_seq.pdbx_auth_seq_align_end       1022 
# 
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 9GL8 MET A 1   ? UNP P00533 ?   ?   'initiating methionine' 694  1  
1 9GL8 ASN A 78  A UNP P00533 ?   ?   insertion               770  2  
1 9GL8 PRO A 79  B UNP P00533 ?   ?   insertion               770  3  
1 9GL8 GLY A 80  C UNP P00533 ?   ?   insertion               770  4  
1 9GL8 ARG A 258 ? UNP P00533 VAL 948 'engineered mutation'   948  5  
1 9GL8 HIS A 333 ? UNP P00533 ?   ?   'expression tag'        1023 6  
1 9GL8 HIS A 334 ? UNP P00533 ?   ?   'expression tag'        1024 7  
1 9GL8 HIS A 335 ? UNP P00533 ?   ?   'expression tag'        1025 8  
1 9GL8 HIS A 336 ? UNP P00533 ?   ?   'expression tag'        1026 9  
1 9GL8 HIS A 337 ? UNP P00533 ?   ?   'expression tag'        1027 10 
1 9GL8 HIS A 338 ? UNP P00533 ?   ?   'expression tag'        1028 11 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 610   ? 
1 MORE         -15   ? 
1 'SSA (A^2)'  15060 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F,G 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 LYS A 15  ? THR A 17  ? LYS A 708 THR A 710  5 ? 3  
HELX_P HELX_P2  AA2 ASN A 63  ? VAL A 76  ? ASN A 756 VAL A 769  1 ? 14 
HELX_P HELX_P3  AA3 CYS A 107 ? HIS A 115 ? CYS A 797 HIS A 805  1 ? 9  
HELX_P HELX_P4  AA4 LYS A 116 ? ILE A 119 ? LYS A 806 ILE A 809  5 ? 4  
HELX_P HELX_P5  AA5 GLY A 120 ? ARG A 141 ? GLY A 810 ARG A 831  1 ? 22 
HELX_P HELX_P6  AA6 ALA A 149 ? ARG A 151 ? ALA A 839 ARG A 841  5 ? 3  
HELX_P HELX_P7  AA7 PRO A 187 ? MET A 191 ? PRO A 877 MET A 881  5 ? 5  
HELX_P HELX_P8  AA8 ALA A 192 ? ARG A 199 ? ALA A 882 ARG A 889  1 ? 8  
HELX_P HELX_P9  AA9 THR A 202 ? THR A 219 ? THR A 892 THR A 909  1 ? 18 
HELX_P HELX_P10 AB1 PRO A 229 ? SER A 231 ? PRO A 919 SER A 921  5 ? 3  
HELX_P HELX_P11 AB2 GLU A 232 ? LYS A 239 ? GLU A 922 LYS A 929  1 ? 8  
HELX_P HELX_P12 AB3 THR A 250 ? TRP A 261 ? THR A 940 TRP A 951  1 ? 12 
HELX_P HELX_P13 AB4 ASP A 264 ? ARG A 268 ? ASP A 954 ARG A 958  5 ? 5  
HELX_P HELX_P14 AB5 LYS A 270 ? ARG A 283 ? LYS A 960 ARG A 973  1 ? 14 
HELX_P HELX_P15 AB6 ASP A 284 ? LEU A 289 ? ASP A 974 LEU A 979  1 ? 6  
HELX_P HELX_P16 AB7 GLY A 293 ? MET A 297 ? GLY A 983 MET A 987  5 ? 5  
HELX_P HELX_P17 AB8 ASN A 306 ? LEU A 311 ? ASN A 996 LEU A 1001 1 ? 6  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
covale1  covale none ? A CYS 107 SG ? ? ? 1_555 F A1IMT . C23 ? ? A CYS 797  A A1IMT 1105 1_555 ? ? ? ? ? ? ? 1.877 ? ? 
metalc1  metalc ?    ? B NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1101 A HOH   1211 1_555 ? ? ? ? ? ? ? 2.245 ? ? 
metalc2  metalc ?    ? B NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1101 A HOH   1221 1_555 ? ? ? ? ? ? ? 2.233 ? ? 
metalc3  metalc ?    ? B NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1101 A HOH   1257 1_555 ? ? ? ? ? ? ? 2.234 ? ? 
metalc4  metalc ?    ? B NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1101 A HOH   1279 1_555 ? ? ? ? ? ? ? 2.239 ? ? 
metalc5  metalc ?    ? B NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1101 A HOH   1302 1_555 ? ? ? ? ? ? ? 2.235 ? ? 
metalc6  metalc ?    ? B NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1101 A HOH   1515 1_555 ? ? ? ? ? ? ? 2.388 ? ? 
metalc7  metalc ?    ? C NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1102 A HOH   1203 1_555 ? ? ? ? ? ? ? 2.237 ? ? 
metalc8  metalc ?    ? C NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1102 A HOH   1299 1_555 ? ? ? ? ? ? ? 2.335 ? ? 
metalc9  metalc ?    ? C NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1102 A HOH   1319 1_555 ? ? ? ? ? ? ? 2.238 ? ? 
metalc10 metalc ?    ? C NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1102 A HOH   1330 1_555 ? ? ? ? ? ? ? 2.318 ? ? 
metalc11 metalc ?    ? C NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1102 A HOH   1464 1_555 ? ? ? ? ? ? ? 2.239 ? ? 
metalc12 metalc ?    ? C NA  .   NA ? ? ? 1_555 G HOH   . O   ? ? A NA  1102 A HOH   1554 1_555 ? ? ? ? ? ? ? 2.238 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
covale ? ? 
metalc ? ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  O ? G HOH . ? A HOH 1211 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1221 ? 1_555 75.2  ? 
2  O ? G HOH . ? A HOH 1211 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1257 ? 1_555 90.3  ? 
3  O ? G HOH . ? A HOH 1221 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1257 ? 1_555 81.4  ? 
4  O ? G HOH . ? A HOH 1211 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1279 ? 1_555 92.7  ? 
5  O ? G HOH . ? A HOH 1221 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1279 ? 1_555 166.9 ? 
6  O ? G HOH . ? A HOH 1257 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1279 ? 1_555 94.0  ? 
7  O ? G HOH . ? A HOH 1211 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1302 ? 1_555 98.8  ? 
8  O ? G HOH . ? A HOH 1221 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1302 ? 1_555 92.3  ? 
9  O ? G HOH . ? A HOH 1257 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1302 ? 1_555 167.4 ? 
10 O ? G HOH . ? A HOH 1279 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1302 ? 1_555 94.4  ? 
11 O ? G HOH . ? A HOH 1211 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1515 ? 1_555 159.7 ? 
12 O ? G HOH . ? A HOH 1221 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1515 ? 1_555 84.5  ? 
13 O ? G HOH . ? A HOH 1257 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1515 ? 1_555 85.2  ? 
14 O ? G HOH . ? A HOH 1279 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1515 ? 1_555 107.4 ? 
15 O ? G HOH . ? A HOH 1302 ? 1_555 NA ? B NA . ? A NA 1101 ? 1_555 O ? G HOH . ? A HOH 1515 ? 1_555 83.3  ? 
16 O ? G HOH . ? A HOH 1203 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1299 ? 1_555 82.5  ? 
17 O ? G HOH . ? A HOH 1203 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1319 ? 1_555 96.2  ? 
18 O ? G HOH . ? A HOH 1299 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1319 ? 1_555 169.4 ? 
19 O ? G HOH . ? A HOH 1203 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1330 ? 1_555 87.7  ? 
20 O ? G HOH . ? A HOH 1299 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1330 ? 1_555 81.1  ? 
21 O ? G HOH . ? A HOH 1319 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1330 ? 1_555 88.3  ? 
22 O ? G HOH . ? A HOH 1203 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1464 ? 1_555 77.7  ? 
23 O ? G HOH . ? A HOH 1299 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1464 ? 1_555 97.3  ? 
24 O ? G HOH . ? A HOH 1319 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1464 ? 1_555 92.7  ? 
25 O ? G HOH . ? A HOH 1330 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1464 ? 1_555 165.4 ? 
26 O ? G HOH . ? A HOH 1203 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1554 ? 1_555 175.7 ? 
27 O ? G HOH . ? A HOH 1299 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1554 ? 1_555 94.3  ? 
28 O ? G HOH . ? A HOH 1319 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1554 ? 1_555 86.5  ? 
29 O ? G HOH . ? A HOH 1330 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1554 ? 1_555 89.0  ? 
30 O ? G HOH . ? A HOH 1464 ? 1_555 NA ? C NA . ? A NA 1102 ? 1_555 O ? G HOH . ? A HOH 1554 ? 1_555 105.6 ? 
# 
_pdbx_modification_feature.ordinal                            1 
_pdbx_modification_feature.label_comp_id                      A1IMT 
_pdbx_modification_feature.label_asym_id                      F 
_pdbx_modification_feature.label_seq_id                       . 
_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      107 
_pdbx_modification_feature.modified_residue_label_alt_id      ? 
_pdbx_modification_feature.auth_comp_id                       A1IMT 
_pdbx_modification_feature.auth_asym_id                       A 
_pdbx_modification_feature.auth_seq_id                        1105 
_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      A 
_pdbx_modification_feature.modified_residue_auth_seq_id       797 
_pdbx_modification_feature.modified_residue_PDB_ins_code      ? 
_pdbx_modification_feature.modified_residue_symmetry          1_555 
_pdbx_modification_feature.comp_id_linking_atom               C23 
_pdbx_modification_feature.modified_residue_id_linking_atom   SG 
_pdbx_modification_feature.modified_residue_id                CYS 
_pdbx_modification_feature.ref_pcm_id                         1 
_pdbx_modification_feature.ref_comp_id                        A1IMT 
_pdbx_modification_feature.type                               None 
_pdbx_modification_feature.category                           'Covalent chemical modification' 
# 
_struct_mon_prot_cis.pdbx_id                1 
_struct_mon_prot_cis.label_comp_id          ASN 
_struct_mon_prot_cis.label_seq_id           78 
_struct_mon_prot_cis.label_asym_id          A 
_struct_mon_prot_cis.label_alt_id           . 
_struct_mon_prot_cis.pdbx_PDB_ins_code      A 
_struct_mon_prot_cis.auth_comp_id           ASN 
_struct_mon_prot_cis.auth_seq_id            770 
_struct_mon_prot_cis.auth_asym_id           A 
_struct_mon_prot_cis.pdbx_label_comp_id_2   PRO 
_struct_mon_prot_cis.pdbx_label_seq_id_2    79 
_struct_mon_prot_cis.pdbx_label_asym_id_2   A 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2    B 
_struct_mon_prot_cis.pdbx_auth_comp_id_2    PRO 
_struct_mon_prot_cis.pdbx_auth_seq_id_2     770 
_struct_mon_prot_cis.pdbx_auth_asym_id_2    A 
_struct_mon_prot_cis.pdbx_PDB_model_num     1 
_struct_mon_prot_cis.pdbx_omega_angle       -5.53 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 2 ? 
AA3 ? 2 ? 
AA4 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA4 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 PHE A 19  ? GLY A 28  ? PHE A 712 GLY A 721 
AA1 2 GLY A 31  ? TRP A 38  ? GLY A 724 TRP A 731 
AA1 3 ILE A 47  ? GLU A 53  ? ILE A 740 GLU A 746 
AA1 4 VAL A 96  ? GLN A 101 ? VAL A 786 GLN A 791 
AA1 5 GLY A 89  ? LEU A 92  ? GLY A 779 LEU A 782 
AA2 1 LEU A 143 ? VAL A 144 ? LEU A 833 VAL A 834 
AA2 2 LYS A 170 ? LEU A 171 ? LYS A 860 LEU A 861 
AA3 1 VAL A 153 ? THR A 157 ? VAL A 843 THR A 847 
AA3 2 HIS A 160 ? ILE A 163 ? HIS A 850 ILE A 853 
AA4 1 TYR A 179 ? HIS A 180 ? TYR A 869 HIS A 870 
AA4 2 ILE A 200 ? TYR A 201 ? ILE A 890 TYR A 891 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 N LEU A 25  ? N LEU A 718 O VAL A 33  ? O VAL A 726 
AA1 2 3 N TRP A 38  ? N TRP A 731 O ILE A 47  ? O ILE A 740 
AA1 3 4 N ALA A 50  ? N ALA A 743 O THR A 100 ? O THR A 790 
AA1 4 5 O ILE A 99  ? O ILE A 789 N GLY A 89  ? N GLY A 779 
AA2 1 2 N VAL A 144 ? N VAL A 834 O LYS A 170 ? O LYS A 860 
AA3 1 2 N LEU A 154 ? N LEU A 844 O LYS A 162 ? O LYS A 852 
AA4 1 2 N TYR A 179 ? N TYR A 869 O TYR A 201 ? O TYR A 891 
# 
_pdbx_entry_details.entry_id                   9GL8 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   Y 
# 
_pdbx_validate_close_contact.id               1 
_pdbx_validate_close_contact.PDB_model_num    1 
_pdbx_validate_close_contact.auth_atom_id_1   OE2 
_pdbx_validate_close_contact.auth_asym_id_1   A 
_pdbx_validate_close_contact.auth_comp_id_1   GLU 
_pdbx_validate_close_contact.auth_seq_id_1    746 
_pdbx_validate_close_contact.PDB_ins_code_1   ? 
_pdbx_validate_close_contact.label_alt_id_1   ? 
_pdbx_validate_close_contact.auth_atom_id_2   HE21 
_pdbx_validate_close_contact.auth_asym_id_2   A 
_pdbx_validate_close_contact.auth_comp_id_2   GLN 
_pdbx_validate_close_contact.auth_seq_id_2    787 
_pdbx_validate_close_contact.PDB_ins_code_2   ? 
_pdbx_validate_close_contact.label_alt_id_2   ? 
_pdbx_validate_close_contact.dist             1.45 
# 
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 THR A 783 ? ? -122.21 -145.13 
2 1 ARG A 836 ? ? 69.12   -2.54   
3 1 ASP A 837 ? ? -142.14 38.07   
4 1 ASP A 855 ? ? 64.10   87.88   
5 1 GLU A 872 ? ? -95.73  -146.75 
# 
_pdbx_refine_tls.id               1 
_pdbx_refine_tls.pdbx_refine_id   'X-RAY DIFFRACTION' 
_pdbx_refine_tls.details          ? 
_pdbx_refine_tls.method           ? 
_pdbx_refine_tls.origin_x         1.8356 
_pdbx_refine_tls.origin_y         14.6036 
_pdbx_refine_tls.origin_z         -19.2087 
_pdbx_refine_tls.T[1][1]          0.0082 
_pdbx_refine_tls.T[1][1]_esd      ? 
_pdbx_refine_tls.T[1][2]          0.006 
_pdbx_refine_tls.T[1][2]_esd      ? 
_pdbx_refine_tls.T[1][3]          -0.0015 
_pdbx_refine_tls.T[1][3]_esd      ? 
_pdbx_refine_tls.T[2][2]          -0.0191 
_pdbx_refine_tls.T[2][2]_esd      ? 
_pdbx_refine_tls.T[2][3]          0.0165 
_pdbx_refine_tls.T[2][3]_esd      ? 
_pdbx_refine_tls.T[3][3]          -0.0137 
_pdbx_refine_tls.T[3][3]_esd      ? 
_pdbx_refine_tls.L[1][1]          0.0611 
_pdbx_refine_tls.L[1][1]_esd      ? 
_pdbx_refine_tls.L[1][2]          -0.243 
_pdbx_refine_tls.L[1][2]_esd      ? 
_pdbx_refine_tls.L[1][3]          0.0653 
_pdbx_refine_tls.L[1][3]_esd      ? 
_pdbx_refine_tls.L[2][2]          0.5763 
_pdbx_refine_tls.L[2][2]_esd      ? 
_pdbx_refine_tls.L[2][3]          0.0265 
_pdbx_refine_tls.L[2][3]_esd      ? 
_pdbx_refine_tls.L[3][3]          1.5544 
_pdbx_refine_tls.L[3][3]_esd      ? 
_pdbx_refine_tls.S[1][1]          -0.11 
_pdbx_refine_tls.S[1][1]_esd      ? 
_pdbx_refine_tls.S[1][2]          0.1857 
_pdbx_refine_tls.S[1][2]_esd      ? 
_pdbx_refine_tls.S[1][3]          -0.0131 
_pdbx_refine_tls.S[1][3]_esd      ? 
_pdbx_refine_tls.S[2][1]          0.1857 
_pdbx_refine_tls.S[2][1]_esd      ? 
_pdbx_refine_tls.S[2][2]          0.0336 
_pdbx_refine_tls.S[2][2]_esd      ? 
_pdbx_refine_tls.S[2][3]          0.0345 
_pdbx_refine_tls.S[2][3]_esd      ? 
_pdbx_refine_tls.S[3][1]          -0.0131 
_pdbx_refine_tls.S[3][1]_esd      ? 
_pdbx_refine_tls.S[3][2]          0.0345 
_pdbx_refine_tls.S[3][2]_esd      ? 
_pdbx_refine_tls.S[3][3]          0.0764 
_pdbx_refine_tls.S[3][3]_esd      ? 
# 
loop_
_pdbx_refine_tls_group.id 
_pdbx_refine_tls_group.pdbx_refine_id 
_pdbx_refine_tls_group.refine_tls_id 
_pdbx_refine_tls_group.beg_label_asym_id 
_pdbx_refine_tls_group.beg_label_seq_id 
_pdbx_refine_tls_group.beg_auth_asym_id 
_pdbx_refine_tls_group.beg_auth_seq_id 
_pdbx_refine_tls_group.beg_PDB_ins_code 
_pdbx_refine_tls_group.end_label_asym_id 
_pdbx_refine_tls_group.end_label_seq_id 
_pdbx_refine_tls_group.end_auth_asym_id 
_pdbx_refine_tls_group.end_auth_seq_id 
_pdbx_refine_tls_group.end_PDB_ins_code 
_pdbx_refine_tls_group.selection 
_pdbx_refine_tls_group.selection_details 
1 'X-RAY DIFFRACTION' 1 ? ? A 701  ? ? ? A 1021 ? ? '{ A|* }' 
2 'X-RAY DIFFRACTION' 1 ? ? A 1031 ? ? ? A 2001 ? ? '{ A|* }' 
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? A HOH 1572 ? 5.82 . 
2 1 O ? A HOH 1573 ? 6.85 . 
3 1 O ? A HOH 1574 ? 7.15 . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 A MET 694  ? A MET 1   
2  1 Y 1 A SER 695  ? A SER 2   
3  1 Y 1 A GLY 696  ? A GLY 3   
4  1 Y 1 A GLU 697  ? A GLU 4   
5  1 Y 1 A ALA 698  ? A ALA 5   
6  1 Y 1 A PRO 699  ? A PRO 6   
7  1 Y 1 A ASN 700  ? A ASN 7   
8  1 Y 1 A ALA 750  ? A ALA 57  
9  1 Y 1 A THR 751  ? A THR 58  
10 1 Y 1 A SER 752  ? A SER 59  
11 1 Y 1 A PRO 753  ? A PRO 60  
12 1 Y 1 A LYS 754  ? A LYS 61  
13 1 Y 1 A ASP 1003 ? A ASP 313 
14 1 Y 1 A GLU 1004 ? A GLU 314 
15 1 Y 1 A GLU 1005 ? A GLU 315 
16 1 Y 1 A ASP 1006 ? A ASP 316 
17 1 Y 1 A MET 1007 ? A MET 317 
18 1 Y 1 A ASP 1008 ? A ASP 318 
19 1 Y 1 A ASP 1009 ? A ASP 319 
20 1 Y 1 A VAL 1010 ? A VAL 320 
21 1 Y 1 A VAL 1011 ? A VAL 321 
22 1 Y 1 A ASP 1012 ? A ASP 322 
23 1 Y 1 A ALA 1013 ? A ALA 323 
24 1 Y 1 A GLY 1022 ? A GLY 332 
25 1 Y 1 A HIS 1023 ? A HIS 333 
26 1 Y 1 A HIS 1024 ? A HIS 334 
27 1 Y 1 A HIS 1025 ? A HIS 335 
28 1 Y 1 A HIS 1026 ? A HIS 336 
29 1 Y 1 A HIS 1027 ? A HIS 337 
30 1 Y 1 A HIS 1028 ? A HIS 338 
# 
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 
A1IMT N1   N  N N 1   
A1IMT N3   N  N N 2   
A1IMT C4   C  Y N 3   
A1IMT C5   C  Y N 4   
A1IMT C6   C  Y N 5   
A1IMT C7   C  Y N 6   
A1IMT C8   C  N S 7   
A1IMT C10  C  Y N 8   
A1IMT C13  C  Y N 9   
A1IMT C15  C  N N 10  
A1IMT C17  C  N R 11  
A1IMT C20  C  N N 12  
A1IMT C21  C  N N 13  
A1IMT C22  C  N N 14  
A1IMT C24  C  N N 15  
A1IMT C26  C  N N 16  
A1IMT C28  C  N N 17  
A1IMT C1   C  N N 18  
A1IMT O1   O  N N 19  
A1IMT C2   C  Y N 20  
A1IMT C3   C  Y N 21  
A1IMT C9   C  N R 22  
A1IMT C11  C  Y N 23  
A1IMT C12  C  Y N 24  
A1IMT N2   N  Y N 25  
A1IMT C14  C  Y N 26  
A1IMT C16  C  N N 27  
A1IMT C18  C  N N 28  
A1IMT C19  C  N N 29  
A1IMT O2   O  N N 30  
A1IMT C23  C  N N 31  
A1IMT N4   N  N N 32  
A1IMT C25  C  N N 33  
A1IMT C27  C  N N 34  
A1IMT N5   N  N N 35  
A1IMT C29  C  N N 36  
A1IMT C30  C  N N 37  
A1IMT O3   O  N N 38  
A1IMT N6   N  N N 39  
A1IMT C31  C  N N 40  
A1IMT C32  C  N N 41  
A1IMT CL1  CL N N 42  
A1IMT H1   H  N N 43  
A1IMT H2   H  N N 44  
A1IMT H3   H  N N 45  
A1IMT H4   H  N N 46  
A1IMT H5   H  N N 47  
A1IMT H6   H  N N 48  
A1IMT H7   H  N N 49  
A1IMT H8   H  N N 50  
A1IMT H11  H  N N 51  
A1IMT H12  H  N N 52  
A1IMT H13  H  N N 53  
A1IMT H14  H  N N 54  
A1IMT H15  H  N N 55  
A1IMT H16  H  N N 56  
A1IMT H17  H  N N 57  
A1IMT H18  H  N N 58  
A1IMT H19  H  N N 59  
A1IMT H20  H  N N 60  
A1IMT H21  H  N N 61  
A1IMT H22  H  N N 62  
A1IMT H23  H  N N 63  
A1IMT H24  H  N N 64  
A1IMT H25  H  N N 65  
A1IMT H29  H  N N 66  
A1IMT H30  H  N N 67  
A1IMT H31  H  N N 68  
A1IMT H32  H  N N 69  
A1IMT H33  H  N N 70  
A1IMT H34  H  N N 71  
A1IMT H35  H  N N 72  
A1IMT H36  H  N N 73  
A1IMT H37  H  N N 74  
A1IMT H38  H  N N 75  
A1IMT H39  H  N N 76  
A1IMT H40  H  N N 77  
A1IMT H9   H  N N 78  
A1IMT H10  H  N N 79  
ALA   N    N  N N 80  
ALA   CA   C  N S 81  
ALA   C    C  N N 82  
ALA   O    O  N N 83  
ALA   CB   C  N N 84  
ALA   OXT  O  N N 85  
ALA   H    H  N N 86  
ALA   H2   H  N N 87  
ALA   HA   H  N N 88  
ALA   HB1  H  N N 89  
ALA   HB2  H  N N 90  
ALA   HB3  H  N N 91  
ALA   HXT  H  N N 92  
ARG   N    N  N N 93  
ARG   CA   C  N S 94  
ARG   C    C  N N 95  
ARG   O    O  N N 96  
ARG   CB   C  N N 97  
ARG   CG   C  N N 98  
ARG   CD   C  N N 99  
ARG   NE   N  N N 100 
ARG   CZ   C  N N 101 
ARG   NH1  N  N N 102 
ARG   NH2  N  N N 103 
ARG   OXT  O  N N 104 
ARG   H    H  N N 105 
ARG   H2   H  N N 106 
ARG   HA   H  N N 107 
ARG   HB2  H  N N 108 
ARG   HB3  H  N N 109 
ARG   HG2  H  N N 110 
ARG   HG3  H  N N 111 
ARG   HD2  H  N N 112 
ARG   HD3  H  N N 113 
ARG   HE   H  N N 114 
ARG   HH11 H  N N 115 
ARG   HH12 H  N N 116 
ARG   HH21 H  N N 117 
ARG   HH22 H  N N 118 
ARG   HXT  H  N N 119 
ASN   N    N  N N 120 
ASN   CA   C  N S 121 
ASN   C    C  N N 122 
ASN   O    O  N N 123 
ASN   CB   C  N N 124 
ASN   CG   C  N N 125 
ASN   OD1  O  N N 126 
ASN   ND2  N  N N 127 
ASN   OXT  O  N N 128 
ASN   H    H  N N 129 
ASN   H2   H  N N 130 
ASN   HA   H  N N 131 
ASN   HB2  H  N N 132 
ASN   HB3  H  N N 133 
ASN   HD21 H  N N 134 
ASN   HD22 H  N N 135 
ASN   HXT  H  N N 136 
ASP   N    N  N N 137 
ASP   CA   C  N S 138 
ASP   C    C  N N 139 
ASP   O    O  N N 140 
ASP   CB   C  N N 141 
ASP   CG   C  N N 142 
ASP   OD1  O  N N 143 
ASP   OD2  O  N N 144 
ASP   OXT  O  N N 145 
ASP   H    H  N N 146 
ASP   H2   H  N N 147 
ASP   HA   H  N N 148 
ASP   HB2  H  N N 149 
ASP   HB3  H  N N 150 
ASP   HD2  H  N N 151 
ASP   HXT  H  N N 152 
CYS   N    N  N N 153 
CYS   CA   C  N R 154 
CYS   C    C  N N 155 
CYS   O    O  N N 156 
CYS   CB   C  N N 157 
CYS   SG   S  N N 158 
CYS   OXT  O  N N 159 
CYS   H    H  N N 160 
CYS   H2   H  N N 161 
CYS   HA   H  N N 162 
CYS   HB2  H  N N 163 
CYS   HB3  H  N N 164 
CYS   HG   H  N N 165 
CYS   HXT  H  N N 166 
EDO   C1   C  N N 167 
EDO   O1   O  N N 168 
EDO   C2   C  N N 169 
EDO   O2   O  N N 170 
EDO   H11  H  N N 171 
EDO   H12  H  N N 172 
EDO   HO1  H  N N 173 
EDO   H21  H  N N 174 
EDO   H22  H  N N 175 
EDO   HO2  H  N N 176 
GLN   N    N  N N 177 
GLN   CA   C  N S 178 
GLN   C    C  N N 179 
GLN   O    O  N N 180 
GLN   CB   C  N N 181 
GLN   CG   C  N N 182 
GLN   CD   C  N N 183 
GLN   OE1  O  N N 184 
GLN   NE2  N  N N 185 
GLN   OXT  O  N N 186 
GLN   H    H  N N 187 
GLN   H2   H  N N 188 
GLN   HA   H  N N 189 
GLN   HB2  H  N N 190 
GLN   HB3  H  N N 191 
GLN   HG2  H  N N 192 
GLN   HG3  H  N N 193 
GLN   HE21 H  N N 194 
GLN   HE22 H  N N 195 
GLN   HXT  H  N N 196 
GLU   N    N  N N 197 
GLU   CA   C  N S 198 
GLU   C    C  N N 199 
GLU   O    O  N N 200 
GLU   CB   C  N N 201 
GLU   CG   C  N N 202 
GLU   CD   C  N N 203 
GLU   OE1  O  N N 204 
GLU   OE2  O  N N 205 
GLU   OXT  O  N N 206 
GLU   H    H  N N 207 
GLU   H2   H  N N 208 
GLU   HA   H  N N 209 
GLU   HB2  H  N N 210 
GLU   HB3  H  N N 211 
GLU   HG2  H  N N 212 
GLU   HG3  H  N N 213 
GLU   HE2  H  N N 214 
GLU   HXT  H  N N 215 
GLY   N    N  N N 216 
GLY   CA   C  N N 217 
GLY   C    C  N N 218 
GLY   O    O  N N 219 
GLY   OXT  O  N N 220 
GLY   H    H  N N 221 
GLY   H2   H  N N 222 
GLY   HA2  H  N N 223 
GLY   HA3  H  N N 224 
GLY   HXT  H  N N 225 
GOL   C1   C  N N 226 
GOL   O1   O  N N 227 
GOL   C2   C  N N 228 
GOL   O2   O  N N 229 
GOL   C3   C  N N 230 
GOL   O3   O  N N 231 
GOL   H11  H  N N 232 
GOL   H12  H  N N 233 
GOL   HO1  H  N N 234 
GOL   H2   H  N N 235 
GOL   HO2  H  N N 236 
GOL   H31  H  N N 237 
GOL   H32  H  N N 238 
GOL   HO3  H  N N 239 
HIS   N    N  N N 240 
HIS   CA   C  N S 241 
HIS   C    C  N N 242 
HIS   O    O  N N 243 
HIS   CB   C  N N 244 
HIS   CG   C  Y N 245 
HIS   ND1  N  Y N 246 
HIS   CD2  C  Y N 247 
HIS   CE1  C  Y N 248 
HIS   NE2  N  Y N 249 
HIS   OXT  O  N N 250 
HIS   H    H  N N 251 
HIS   H2   H  N N 252 
HIS   HA   H  N N 253 
HIS   HB2  H  N N 254 
HIS   HB3  H  N N 255 
HIS   HD1  H  N N 256 
HIS   HD2  H  N N 257 
HIS   HE1  H  N N 258 
HIS   HE2  H  N N 259 
HIS   HXT  H  N N 260 
HOH   O    O  N N 261 
HOH   H1   H  N N 262 
HOH   H2   H  N N 263 
ILE   N    N  N N 264 
ILE   CA   C  N S 265 
ILE   C    C  N N 266 
ILE   O    O  N N 267 
ILE   CB   C  N S 268 
ILE   CG1  C  N N 269 
ILE   CG2  C  N N 270 
ILE   CD1  C  N N 271 
ILE   OXT  O  N N 272 
ILE   H    H  N N 273 
ILE   H2   H  N N 274 
ILE   HA   H  N N 275 
ILE   HB   H  N N 276 
ILE   HG12 H  N N 277 
ILE   HG13 H  N N 278 
ILE   HG21 H  N N 279 
ILE   HG22 H  N N 280 
ILE   HG23 H  N N 281 
ILE   HD11 H  N N 282 
ILE   HD12 H  N N 283 
ILE   HD13 H  N N 284 
ILE   HXT  H  N N 285 
LEU   N    N  N N 286 
LEU   CA   C  N S 287 
LEU   C    C  N N 288 
LEU   O    O  N N 289 
LEU   CB   C  N N 290 
LEU   CG   C  N N 291 
LEU   CD1  C  N N 292 
LEU   CD2  C  N N 293 
LEU   OXT  O  N N 294 
LEU   H    H  N N 295 
LEU   H2   H  N N 296 
LEU   HA   H  N N 297 
LEU   HB2  H  N N 298 
LEU   HB3  H  N N 299 
LEU   HG   H  N N 300 
LEU   HD11 H  N N 301 
LEU   HD12 H  N N 302 
LEU   HD13 H  N N 303 
LEU   HD21 H  N N 304 
LEU   HD22 H  N N 305 
LEU   HD23 H  N N 306 
LEU   HXT  H  N N 307 
LYS   N    N  N N 308 
LYS   CA   C  N S 309 
LYS   C    C  N N 310 
LYS   O    O  N N 311 
LYS   CB   C  N N 312 
LYS   CG   C  N N 313 
LYS   CD   C  N N 314 
LYS   CE   C  N N 315 
LYS   NZ   N  N N 316 
LYS   OXT  O  N N 317 
LYS   H    H  N N 318 
LYS   H2   H  N N 319 
LYS   HA   H  N N 320 
LYS   HB2  H  N N 321 
LYS   HB3  H  N N 322 
LYS   HG2  H  N N 323 
LYS   HG3  H  N N 324 
LYS   HD2  H  N N 325 
LYS   HD3  H  N N 326 
LYS   HE2  H  N N 327 
LYS   HE3  H  N N 328 
LYS   HZ1  H  N N 329 
LYS   HZ2  H  N N 330 
LYS   HZ3  H  N N 331 
LYS   HXT  H  N N 332 
MET   N    N  N N 333 
MET   CA   C  N S 334 
MET   C    C  N N 335 
MET   O    O  N N 336 
MET   CB   C  N N 337 
MET   CG   C  N N 338 
MET   SD   S  N N 339 
MET   CE   C  N N 340 
MET   OXT  O  N N 341 
MET   H    H  N N 342 
MET   H2   H  N N 343 
MET   HA   H  N N 344 
MET   HB2  H  N N 345 
MET   HB3  H  N N 346 
MET   HG2  H  N N 347 
MET   HG3  H  N N 348 
MET   HE1  H  N N 349 
MET   HE2  H  N N 350 
MET   HE3  H  N N 351 
MET   HXT  H  N N 352 
NA    NA   NA N N 353 
PHE   N    N  N N 354 
PHE   CA   C  N S 355 
PHE   C    C  N N 356 
PHE   O    O  N N 357 
PHE   CB   C  N N 358 
PHE   CG   C  Y N 359 
PHE   CD1  C  Y N 360 
PHE   CD2  C  Y N 361 
PHE   CE1  C  Y N 362 
PHE   CE2  C  Y N 363 
PHE   CZ   C  Y N 364 
PHE   OXT  O  N N 365 
PHE   H    H  N N 366 
PHE   H2   H  N N 367 
PHE   HA   H  N N 368 
PHE   HB2  H  N N 369 
PHE   HB3  H  N N 370 
PHE   HD1  H  N N 371 
PHE   HD2  H  N N 372 
PHE   HE1  H  N N 373 
PHE   HE2  H  N N 374 
PHE   HZ   H  N N 375 
PHE   HXT  H  N N 376 
PRO   N    N  N N 377 
PRO   CA   C  N S 378 
PRO   C    C  N N 379 
PRO   O    O  N N 380 
PRO   CB   C  N N 381 
PRO   CG   C  N N 382 
PRO   CD   C  N N 383 
PRO   OXT  O  N N 384 
PRO   H    H  N N 385 
PRO   HA   H  N N 386 
PRO   HB2  H  N N 387 
PRO   HB3  H  N N 388 
PRO   HG2  H  N N 389 
PRO   HG3  H  N N 390 
PRO   HD2  H  N N 391 
PRO   HD3  H  N N 392 
PRO   HXT  H  N N 393 
SER   N    N  N N 394 
SER   CA   C  N S 395 
SER   C    C  N N 396 
SER   O    O  N N 397 
SER   CB   C  N N 398 
SER   OG   O  N N 399 
SER   OXT  O  N N 400 
SER   H    H  N N 401 
SER   H2   H  N N 402 
SER   HA   H  N N 403 
SER   HB2  H  N N 404 
SER   HB3  H  N N 405 
SER   HG   H  N N 406 
SER   HXT  H  N N 407 
THR   N    N  N N 408 
THR   CA   C  N S 409 
THR   C    C  N N 410 
THR   O    O  N N 411 
THR   CB   C  N R 412 
THR   OG1  O  N N 413 
THR   CG2  C  N N 414 
THR   OXT  O  N N 415 
THR   H    H  N N 416 
THR   H2   H  N N 417 
THR   HA   H  N N 418 
THR   HB   H  N N 419 
THR   HG1  H  N N 420 
THR   HG21 H  N N 421 
THR   HG22 H  N N 422 
THR   HG23 H  N N 423 
THR   HXT  H  N N 424 
TRP   N    N  N N 425 
TRP   CA   C  N S 426 
TRP   C    C  N N 427 
TRP   O    O  N N 428 
TRP   CB   C  N N 429 
TRP   CG   C  Y N 430 
TRP   CD1  C  Y N 431 
TRP   CD2  C  Y N 432 
TRP   NE1  N  Y N 433 
TRP   CE2  C  Y N 434 
TRP   CE3  C  Y N 435 
TRP   CZ2  C  Y N 436 
TRP   CZ3  C  Y N 437 
TRP   CH2  C  Y N 438 
TRP   OXT  O  N N 439 
TRP   H    H  N N 440 
TRP   H2   H  N N 441 
TRP   HA   H  N N 442 
TRP   HB2  H  N N 443 
TRP   HB3  H  N N 444 
TRP   HD1  H  N N 445 
TRP   HE1  H  N N 446 
TRP   HE3  H  N N 447 
TRP   HZ2  H  N N 448 
TRP   HZ3  H  N N 449 
TRP   HH2  H  N N 450 
TRP   HXT  H  N N 451 
TYR   N    N  N N 452 
TYR   CA   C  N S 453 
TYR   C    C  N N 454 
TYR   O    O  N N 455 
TYR   CB   C  N N 456 
TYR   CG   C  Y N 457 
TYR   CD1  C  Y N 458 
TYR   CD2  C  Y N 459 
TYR   CE1  C  Y N 460 
TYR   CE2  C  Y N 461 
TYR   CZ   C  Y N 462 
TYR   OH   O  N N 463 
TYR   OXT  O  N N 464 
TYR   H    H  N N 465 
TYR   H2   H  N N 466 
TYR   HA   H  N N 467 
TYR   HB2  H  N N 468 
TYR   HB3  H  N N 469 
TYR   HD1  H  N N 470 
TYR   HD2  H  N N 471 
TYR   HE1  H  N N 472 
TYR   HE2  H  N N 473 
TYR   HH   H  N N 474 
TYR   HXT  H  N N 475 
VAL   N    N  N N 476 
VAL   CA   C  N S 477 
VAL   C    C  N N 478 
VAL   O    O  N N 479 
VAL   CB   C  N N 480 
VAL   CG1  C  N N 481 
VAL   CG2  C  N N 482 
VAL   OXT  O  N N 483 
VAL   H    H  N N 484 
VAL   H2   H  N N 485 
VAL   HA   H  N N 486 
VAL   HB   H  N N 487 
VAL   HG11 H  N N 488 
VAL   HG12 H  N N 489 
VAL   HG13 H  N N 490 
VAL   HG21 H  N N 491 
VAL   HG22 H  N N 492 
VAL   HG23 H  N N 493 
VAL   HXT  H  N N 494 
# 
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 
A1IMT C26 N4   sing N N 1   
A1IMT C24 N4   sing N N 2   
A1IMT C24 C23  sing N N 3   
A1IMT N4  C25  sing N N 4   
A1IMT C23 C22  doub N Z 5   
A1IMT C22 C21  sing N N 6   
A1IMT C31 N6   sing N N 7   
A1IMT C31 C32  sing N N 8   
A1IMT N6  C30  sing N N 9   
A1IMT C32 C28  sing N N 10  
A1IMT O2  C21  doub N N 11  
A1IMT C21 N3   sing N N 12  
A1IMT C30 O3   doub N N 13  
A1IMT C30 C29  sing N N 14  
A1IMT C28 C29  doub N N 15  
A1IMT C28 N5   sing N N 16  
A1IMT C29 C8   sing N N 17  
A1IMT C20 N3   sing N N 18  
A1IMT C20 C19  sing N N 19  
A1IMT N3  C17  sing N N 20  
A1IMT N5  C9   sing N N 21  
A1IMT C8  C9   sing N N 22  
A1IMT C8  N1   sing N N 23  
A1IMT C9  C10  sing N N 24  
A1IMT N1  C7   sing N N 25  
A1IMT C1  O1   sing N N 26  
A1IMT O1  C2   sing N N 27  
A1IMT C17 C16  sing N N 28  
A1IMT C17 C27  sing N N 29  
A1IMT C17 C18  sing N N 30  
A1IMT C16 C15  trip N N 31  
A1IMT C19 C18  sing N N 32  
A1IMT C15 C14  sing N N 33  
A1IMT C10 C14  doub Y N 34  
A1IMT C10 C11  sing Y N 35  
A1IMT C14 C13  sing Y N 36  
A1IMT C11 C12  doub Y N 37  
A1IMT C13 N2   doub Y N 38  
A1IMT C7  C2   doub Y N 39  
A1IMT C7  C6   sing Y N 40  
A1IMT C12 N2   sing Y N 41  
A1IMT C2  C3   sing Y N 42  
A1IMT C6  C5   doub Y N 43  
A1IMT C3  CL1  sing N N 44  
A1IMT C3  C4   doub Y N 45  
A1IMT C5  C4   sing Y N 46  
A1IMT N1  H1   sing N N 47  
A1IMT C4  H2   sing N N 48  
A1IMT C5  H3   sing N N 49  
A1IMT C6  H4   sing N N 50  
A1IMT C8  H5   sing N N 51  
A1IMT C13 H6   sing N N 52  
A1IMT C20 H7   sing N N 53  
A1IMT C20 H8   sing N N 54  
A1IMT C24 H11  sing N N 55  
A1IMT C24 H12  sing N N 56  
A1IMT C26 H13  sing N N 57  
A1IMT C26 H14  sing N N 58  
A1IMT C26 H15  sing N N 59  
A1IMT C1  H16  sing N N 60  
A1IMT C1  H17  sing N N 61  
A1IMT C1  H18  sing N N 62  
A1IMT C9  H19  sing N N 63  
A1IMT C11 H20  sing N N 64  
A1IMT C12 H21  sing N N 65  
A1IMT C18 H22  sing N N 66  
A1IMT C18 H23  sing N N 67  
A1IMT C19 H24  sing N N 68  
A1IMT C19 H25  sing N N 69  
A1IMT C25 H29  sing N N 70  
A1IMT C25 H30  sing N N 71  
A1IMT C25 H31  sing N N 72  
A1IMT C27 H32  sing N N 73  
A1IMT C27 H33  sing N N 74  
A1IMT C27 H34  sing N N 75  
A1IMT N5  H35  sing N N 76  
A1IMT N6  H36  sing N N 77  
A1IMT C31 H37  sing N N 78  
A1IMT C31 H38  sing N N 79  
A1IMT C32 H39  sing N N 80  
A1IMT C32 H40  sing N N 81  
A1IMT C22 H9   sing N N 82  
A1IMT C23 H10  sing N N 83  
ALA   N   CA   sing N N 84  
ALA   N   H    sing N N 85  
ALA   N   H2   sing N N 86  
ALA   CA  C    sing N N 87  
ALA   CA  CB   sing N N 88  
ALA   CA  HA   sing N N 89  
ALA   C   O    doub N N 90  
ALA   C   OXT  sing N N 91  
ALA   CB  HB1  sing N N 92  
ALA   CB  HB2  sing N N 93  
ALA   CB  HB3  sing N N 94  
ALA   OXT HXT  sing N N 95  
ARG   N   CA   sing N N 96  
ARG   N   H    sing N N 97  
ARG   N   H2   sing N N 98  
ARG   CA  C    sing N N 99  
ARG   CA  CB   sing N N 100 
ARG   CA  HA   sing N N 101 
ARG   C   O    doub N N 102 
ARG   C   OXT  sing N N 103 
ARG   CB  CG   sing N N 104 
ARG   CB  HB2  sing N N 105 
ARG   CB  HB3  sing N N 106 
ARG   CG  CD   sing N N 107 
ARG   CG  HG2  sing N N 108 
ARG   CG  HG3  sing N N 109 
ARG   CD  NE   sing N N 110 
ARG   CD  HD2  sing N N 111 
ARG   CD  HD3  sing N N 112 
ARG   NE  CZ   sing N N 113 
ARG   NE  HE   sing N N 114 
ARG   CZ  NH1  sing N N 115 
ARG   CZ  NH2  doub N N 116 
ARG   NH1 HH11 sing N N 117 
ARG   NH1 HH12 sing N N 118 
ARG   NH2 HH21 sing N N 119 
ARG   NH2 HH22 sing N N 120 
ARG   OXT HXT  sing N N 121 
ASN   N   CA   sing N N 122 
ASN   N   H    sing N N 123 
ASN   N   H2   sing N N 124 
ASN   CA  C    sing N N 125 
ASN   CA  CB   sing N N 126 
ASN   CA  HA   sing N N 127 
ASN   C   O    doub N N 128 
ASN   C   OXT  sing N N 129 
ASN   CB  CG   sing N N 130 
ASN   CB  HB2  sing N N 131 
ASN   CB  HB3  sing N N 132 
ASN   CG  OD1  doub N N 133 
ASN   CG  ND2  sing N N 134 
ASN   ND2 HD21 sing N N 135 
ASN   ND2 HD22 sing N N 136 
ASN   OXT HXT  sing N N 137 
ASP   N   CA   sing N N 138 
ASP   N   H    sing N N 139 
ASP   N   H2   sing N N 140 
ASP   CA  C    sing N N 141 
ASP   CA  CB   sing N N 142 
ASP   CA  HA   sing N N 143 
ASP   C   O    doub N N 144 
ASP   C   OXT  sing N N 145 
ASP   CB  CG   sing N N 146 
ASP   CB  HB2  sing N N 147 
ASP   CB  HB3  sing N N 148 
ASP   CG  OD1  doub N N 149 
ASP   CG  OD2  sing N N 150 
ASP   OD2 HD2  sing N N 151 
ASP   OXT HXT  sing N N 152 
CYS   N   CA   sing N N 153 
CYS   N   H    sing N N 154 
CYS   N   H2   sing N N 155 
CYS   CA  C    sing N N 156 
CYS   CA  CB   sing N N 157 
CYS   CA  HA   sing N N 158 
CYS   C   O    doub N N 159 
CYS   C   OXT  sing N N 160 
CYS   CB  SG   sing N N 161 
CYS   CB  HB2  sing N N 162 
CYS   CB  HB3  sing N N 163 
CYS   SG  HG   sing N N 164 
CYS   OXT HXT  sing N N 165 
EDO   C1  O1   sing N N 166 
EDO   C1  C2   sing N N 167 
EDO   C1  H11  sing N N 168 
EDO   C1  H12  sing N N 169 
EDO   O1  HO1  sing N N 170 
EDO   C2  O2   sing N N 171 
EDO   C2  H21  sing N N 172 
EDO   C2  H22  sing N N 173 
EDO   O2  HO2  sing N N 174 
GLN   N   CA   sing N N 175 
GLN   N   H    sing N N 176 
GLN   N   H2   sing N N 177 
GLN   CA  C    sing N N 178 
GLN   CA  CB   sing N N 179 
GLN   CA  HA   sing N N 180 
GLN   C   O    doub N N 181 
GLN   C   OXT  sing N N 182 
GLN   CB  CG   sing N N 183 
GLN   CB  HB2  sing N N 184 
GLN   CB  HB3  sing N N 185 
GLN   CG  CD   sing N N 186 
GLN   CG  HG2  sing N N 187 
GLN   CG  HG3  sing N N 188 
GLN   CD  OE1  doub N N 189 
GLN   CD  NE2  sing N N 190 
GLN   NE2 HE21 sing N N 191 
GLN   NE2 HE22 sing N N 192 
GLN   OXT HXT  sing N N 193 
GLU   N   CA   sing N N 194 
GLU   N   H    sing N N 195 
GLU   N   H2   sing N N 196 
GLU   CA  C    sing N N 197 
GLU   CA  CB   sing N N 198 
GLU   CA  HA   sing N N 199 
GLU   C   O    doub N N 200 
GLU   C   OXT  sing N N 201 
GLU   CB  CG   sing N N 202 
GLU   CB  HB2  sing N N 203 
GLU   CB  HB3  sing N N 204 
GLU   CG  CD   sing N N 205 
GLU   CG  HG2  sing N N 206 
GLU   CG  HG3  sing N N 207 
GLU   CD  OE1  doub N N 208 
GLU   CD  OE2  sing N N 209 
GLU   OE2 HE2  sing N N 210 
GLU   OXT HXT  sing N N 211 
GLY   N   CA   sing N N 212 
GLY   N   H    sing N N 213 
GLY   N   H2   sing N N 214 
GLY   CA  C    sing N N 215 
GLY   CA  HA2  sing N N 216 
GLY   CA  HA3  sing N N 217 
GLY   C   O    doub N N 218 
GLY   C   OXT  sing N N 219 
GLY   OXT HXT  sing N N 220 
GOL   C1  O1   sing N N 221 
GOL   C1  C2   sing N N 222 
GOL   C1  H11  sing N N 223 
GOL   C1  H12  sing N N 224 
GOL   O1  HO1  sing N N 225 
GOL   C2  O2   sing N N 226 
GOL   C2  C3   sing N N 227 
GOL   C2  H2   sing N N 228 
GOL   O2  HO2  sing N N 229 
GOL   C3  O3   sing N N 230 
GOL   C3  H31  sing N N 231 
GOL   C3  H32  sing N N 232 
GOL   O3  HO3  sing N N 233 
HIS   N   CA   sing N N 234 
HIS   N   H    sing N N 235 
HIS   N   H2   sing N N 236 
HIS   CA  C    sing N N 237 
HIS   CA  CB   sing N N 238 
HIS   CA  HA   sing N N 239 
HIS   C   O    doub N N 240 
HIS   C   OXT  sing N N 241 
HIS   CB  CG   sing N N 242 
HIS   CB  HB2  sing N N 243 
HIS   CB  HB3  sing N N 244 
HIS   CG  ND1  sing Y N 245 
HIS   CG  CD2  doub Y N 246 
HIS   ND1 CE1  doub Y N 247 
HIS   ND1 HD1  sing N N 248 
HIS   CD2 NE2  sing Y N 249 
HIS   CD2 HD2  sing N N 250 
HIS   CE1 NE2  sing Y N 251 
HIS   CE1 HE1  sing N N 252 
HIS   NE2 HE2  sing N N 253 
HIS   OXT HXT  sing N N 254 
HOH   O   H1   sing N N 255 
HOH   O   H2   sing N N 256 
ILE   N   CA   sing N N 257 
ILE   N   H    sing N N 258 
ILE   N   H2   sing N N 259 
ILE   CA  C    sing N N 260 
ILE   CA  CB   sing N N 261 
ILE   CA  HA   sing N N 262 
ILE   C   O    doub N N 263 
ILE   C   OXT  sing N N 264 
ILE   CB  CG1  sing N N 265 
ILE   CB  CG2  sing N N 266 
ILE   CB  HB   sing N N 267 
ILE   CG1 CD1  sing N N 268 
ILE   CG1 HG12 sing N N 269 
ILE   CG1 HG13 sing N N 270 
ILE   CG2 HG21 sing N N 271 
ILE   CG2 HG22 sing N N 272 
ILE   CG2 HG23 sing N N 273 
ILE   CD1 HD11 sing N N 274 
ILE   CD1 HD12 sing N N 275 
ILE   CD1 HD13 sing N N 276 
ILE   OXT HXT  sing N N 277 
LEU   N   CA   sing N N 278 
LEU   N   H    sing N N 279 
LEU   N   H2   sing N N 280 
LEU   CA  C    sing N N 281 
LEU   CA  CB   sing N N 282 
LEU   CA  HA   sing N N 283 
LEU   C   O    doub N N 284 
LEU   C   OXT  sing N N 285 
LEU   CB  CG   sing N N 286 
LEU   CB  HB2  sing N N 287 
LEU   CB  HB3  sing N N 288 
LEU   CG  CD1  sing N N 289 
LEU   CG  CD2  sing N N 290 
LEU   CG  HG   sing N N 291 
LEU   CD1 HD11 sing N N 292 
LEU   CD1 HD12 sing N N 293 
LEU   CD1 HD13 sing N N 294 
LEU   CD2 HD21 sing N N 295 
LEU   CD2 HD22 sing N N 296 
LEU   CD2 HD23 sing N N 297 
LEU   OXT HXT  sing N N 298 
LYS   N   CA   sing N N 299 
LYS   N   H    sing N N 300 
LYS   N   H2   sing N N 301 
LYS   CA  C    sing N N 302 
LYS   CA  CB   sing N N 303 
LYS   CA  HA   sing N N 304 
LYS   C   O    doub N N 305 
LYS   C   OXT  sing N N 306 
LYS   CB  CG   sing N N 307 
LYS   CB  HB2  sing N N 308 
LYS   CB  HB3  sing N N 309 
LYS   CG  CD   sing N N 310 
LYS   CG  HG2  sing N N 311 
LYS   CG  HG3  sing N N 312 
LYS   CD  CE   sing N N 313 
LYS   CD  HD2  sing N N 314 
LYS   CD  HD3  sing N N 315 
LYS   CE  NZ   sing N N 316 
LYS   CE  HE2  sing N N 317 
LYS   CE  HE3  sing N N 318 
LYS   NZ  HZ1  sing N N 319 
LYS   NZ  HZ2  sing N N 320 
LYS   NZ  HZ3  sing N N 321 
LYS   OXT HXT  sing N N 322 
MET   N   CA   sing N N 323 
MET   N   H    sing N N 324 
MET   N   H2   sing N N 325 
MET   CA  C    sing N N 326 
MET   CA  CB   sing N N 327 
MET   CA  HA   sing N N 328 
MET   C   O    doub N N 329 
MET   C   OXT  sing N N 330 
MET   CB  CG   sing N N 331 
MET   CB  HB2  sing N N 332 
MET   CB  HB3  sing N N 333 
MET   CG  SD   sing N N 334 
MET   CG  HG2  sing N N 335 
MET   CG  HG3  sing N N 336 
MET   SD  CE   sing N N 337 
MET   CE  HE1  sing N N 338 
MET   CE  HE2  sing N N 339 
MET   CE  HE3  sing N N 340 
MET   OXT HXT  sing N N 341 
PHE   N   CA   sing N N 342 
PHE   N   H    sing N N 343 
PHE   N   H2   sing N N 344 
PHE   CA  C    sing N N 345 
PHE   CA  CB   sing N N 346 
PHE   CA  HA   sing N N 347 
PHE   C   O    doub N N 348 
PHE   C   OXT  sing N N 349 
PHE   CB  CG   sing N N 350 
PHE   CB  HB2  sing N N 351 
PHE   CB  HB3  sing N N 352 
PHE   CG  CD1  doub Y N 353 
PHE   CG  CD2  sing Y N 354 
PHE   CD1 CE1  sing Y N 355 
PHE   CD1 HD1  sing N N 356 
PHE   CD2 CE2  doub Y N 357 
PHE   CD2 HD2  sing N N 358 
PHE   CE1 CZ   doub Y N 359 
PHE   CE1 HE1  sing N N 360 
PHE   CE2 CZ   sing Y N 361 
PHE   CE2 HE2  sing N N 362 
PHE   CZ  HZ   sing N N 363 
PHE   OXT HXT  sing N N 364 
PRO   N   CA   sing N N 365 
PRO   N   CD   sing N N 366 
PRO   N   H    sing N N 367 
PRO   CA  C    sing N N 368 
PRO   CA  CB   sing N N 369 
PRO   CA  HA   sing N N 370 
PRO   C   O    doub N N 371 
PRO   C   OXT  sing N N 372 
PRO   CB  CG   sing N N 373 
PRO   CB  HB2  sing N N 374 
PRO   CB  HB3  sing N N 375 
PRO   CG  CD   sing N N 376 
PRO   CG  HG2  sing N N 377 
PRO   CG  HG3  sing N N 378 
PRO   CD  HD2  sing N N 379 
PRO   CD  HD3  sing N N 380 
PRO   OXT HXT  sing N N 381 
SER   N   CA   sing N N 382 
SER   N   H    sing N N 383 
SER   N   H2   sing N N 384 
SER   CA  C    sing N N 385 
SER   CA  CB   sing N N 386 
SER   CA  HA   sing N N 387 
SER   C   O    doub N N 388 
SER   C   OXT  sing N N 389 
SER   CB  OG   sing N N 390 
SER   CB  HB2  sing N N 391 
SER   CB  HB3  sing N N 392 
SER   OG  HG   sing N N 393 
SER   OXT HXT  sing N N 394 
THR   N   CA   sing N N 395 
THR   N   H    sing N N 396 
THR   N   H2   sing N N 397 
THR   CA  C    sing N N 398 
THR   CA  CB   sing N N 399 
THR   CA  HA   sing N N 400 
THR   C   O    doub N N 401 
THR   C   OXT  sing N N 402 
THR   CB  OG1  sing N N 403 
THR   CB  CG2  sing N N 404 
THR   CB  HB   sing N N 405 
THR   OG1 HG1  sing N N 406 
THR   CG2 HG21 sing N N 407 
THR   CG2 HG22 sing N N 408 
THR   CG2 HG23 sing N N 409 
THR   OXT HXT  sing N N 410 
TRP   N   CA   sing N N 411 
TRP   N   H    sing N N 412 
TRP   N   H2   sing N N 413 
TRP   CA  C    sing N N 414 
TRP   CA  CB   sing N N 415 
TRP   CA  HA   sing N N 416 
TRP   C   O    doub N N 417 
TRP   C   OXT  sing N N 418 
TRP   CB  CG   sing N N 419 
TRP   CB  HB2  sing N N 420 
TRP   CB  HB3  sing N N 421 
TRP   CG  CD1  doub Y N 422 
TRP   CG  CD2  sing Y N 423 
TRP   CD1 NE1  sing Y N 424 
TRP   CD1 HD1  sing N N 425 
TRP   CD2 CE2  doub Y N 426 
TRP   CD2 CE3  sing Y N 427 
TRP   NE1 CE2  sing Y N 428 
TRP   NE1 HE1  sing N N 429 
TRP   CE2 CZ2  sing Y N 430 
TRP   CE3 CZ3  doub Y N 431 
TRP   CE3 HE3  sing N N 432 
TRP   CZ2 CH2  doub Y N 433 
TRP   CZ2 HZ2  sing N N 434 
TRP   CZ3 CH2  sing Y N 435 
TRP   CZ3 HZ3  sing N N 436 
TRP   CH2 HH2  sing N N 437 
TRP   OXT HXT  sing N N 438 
TYR   N   CA   sing N N 439 
TYR   N   H    sing N N 440 
TYR   N   H2   sing N N 441 
TYR   CA  C    sing N N 442 
TYR   CA  CB   sing N N 443 
TYR   CA  HA   sing N N 444 
TYR   C   O    doub N N 445 
TYR   C   OXT  sing N N 446 
TYR   CB  CG   sing N N 447 
TYR   CB  HB2  sing N N 448 
TYR   CB  HB3  sing N N 449 
TYR   CG  CD1  doub Y N 450 
TYR   CG  CD2  sing Y N 451 
TYR   CD1 CE1  sing Y N 452 
TYR   CD1 HD1  sing N N 453 
TYR   CD2 CE2  doub Y N 454 
TYR   CD2 HD2  sing N N 455 
TYR   CE1 CZ   doub Y N 456 
TYR   CE1 HE1  sing N N 457 
TYR   CE2 CZ   sing Y N 458 
TYR   CE2 HE2  sing N N 459 
TYR   CZ  OH   sing N N 460 
TYR   OH  HH   sing N N 461 
TYR   OXT HXT  sing N N 462 
VAL   N   CA   sing N N 463 
VAL   N   H    sing N N 464 
VAL   N   H2   sing N N 465 
VAL   CA  C    sing N N 466 
VAL   CA  CB   sing N N 467 
VAL   CA  HA   sing N N 468 
VAL   C   O    doub N N 469 
VAL   C   OXT  sing N N 470 
VAL   CB  CG1  sing N N 471 
VAL   CB  CG2  sing N N 472 
VAL   CB  HB   sing N N 473 
VAL   CG1 HG11 sing N N 474 
VAL   CG1 HG12 sing N N 475 
VAL   CG1 HG13 sing N N 476 
VAL   CG2 HG21 sing N N 477 
VAL   CG2 HG22 sing N N 478 
VAL   CG2 HG23 sing N N 479 
VAL   OXT HXT  sing N N 480 
# 
_pdbx_audit_support.funding_organization   'Not funded' 
_pdbx_audit_support.country                ? 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      Other 
_pdbx_initial_refinement_model.accession_code   ? 
_pdbx_initial_refinement_model.details          'Unpublished model' 
# 
_atom_sites.entry_id                    9GL8 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.024819 
_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]   0.009368 
_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]   0.005707 
_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  
CL 
H  
N  
NA 
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_site.pdbx_tls_group_id 
ATOM   1    N  N    . GLN   A 1 8   ? 13.14   -3.536  -8.872  1   55.08 ? 701  GLN   A N    1 1 
ATOM   2    C  CA   . GLN   A 1 8   ? 12.164  -4.021  -7.896  1   55.18 ? 701  GLN   A CA   1 1 
ATOM   3    C  C    . GLN   A 1 8   ? 11.413  -2.851  -7.259  1   53.95 ? 701  GLN   A C    1 1 
ATOM   4    O  O    . GLN   A 1 8   ? 12.048  -1.936  -6.733  1   54.53 ? 701  GLN   A O    1 1 
ATOM   5    C  CB   . GLN   A 1 8   ? 12.841  -4.909  -6.827  1   57.96 ? 701  GLN   A CB   1 1 
ATOM   6    C  CG   . GLN   A 1 8   ? 14.098  -4.327  -6.183  1   63.22 ? 701  GLN   A CG   1 1 
ATOM   7    C  CD   . GLN   A 1 8   ? 14.578  -5.177  -5.025  1   69.62 ? 701  GLN   A CD   1 1 
ATOM   8    O  OE1  . GLN   A 1 8   ? 14.677  -6.409  -5.125  1   71.56 ? 701  GLN   A OE1  1 1 
ATOM   9    N  NE2  . GLN   A 1 8   ? 14.904  -4.55   -3.896  1   71.01 ? 701  GLN   A NE2  1 1 
ATOM   10   H  HA   . GLN   A 1 8   ? 11.442  -4.643  -8.423  0   62.77 ? 701  GLN   A HA   1 1 
ATOM   11   H  HB2  . GLN   A 1 8   ? 12.123  -5.092  -6.03   0   66.58 ? 701  GLN   A HB2  1 1 
ATOM   12   H  HB3  . GLN   A 1 8   ? 13.119  -5.854  -7.29   0   66.91 ? 701  GLN   A HB3  1 1 
ATOM   13   H  HG2  . GLN   A 1 8   ? 14.898  -4.295  -6.922  0   72.07 ? 701  GLN   A HG2  1 1 
ATOM   14   H  HG3  . GLN   A 1 8   ? 13.88   -3.323  -5.824  0   71.57 ? 701  GLN   A HG3  1 1 
ATOM   15   H  HE21 . GLN   A 1 8   ? 14.835  -3.539  -3.821  0   80.33 ? 701  GLN   A HE21 1 1 
ATOM   16   H  HE22 . GLN   A 1 8   ? 15.231  -5.089  -3.101  0   81.42 ? 701  GLN   A HE22 1 1 
ATOM   17   N  N    . ALA   A 1 9   ? 10.066  -2.858  -7.335  1   52.11 ? 702  ALA   A N    1 1 
ATOM   18   C  CA   . ALA   A 1 9   ? 9.238   -1.791  -6.781  1   51.15 ? 702  ALA   A CA   1 1 
ATOM   19   C  C    . ALA   A 1 9   ? 9.274   -1.753  -5.248  1   50.69 ? 702  ALA   A C    1 1 
ATOM   20   O  O    . ALA   A 1 9   ? 8.944   -2.736  -4.598  1   51.08 ? 702  ALA   A O    1 1 
ATOM   21   C  CB   . ALA   A 1 9   ? 7.803   -1.942  -7.251  1   51.1  ? 702  ALA   A CB   1 1 
ATOM   22   H  H    . ALA   A 1 9   ? 9.524   -3.593  -7.778  0   58.92 ? 702  ALA   A H    1 1 
ATOM   23   H  HA   . ALA   A 1 9   ? 9.605   -0.84   -7.163  0   56.97 ? 702  ALA   A HA   1 1 
ATOM   24   H  HB1  . ALA   A 1 9   ? 7.193   -1.178  -6.769  0   56.72 ? 702  ALA   A HB1  1 1 
ATOM   25   H  HB2  . ALA   A 1 9   ? 7.771   -1.814  -8.332  0   56.72 ? 702  ALA   A HB2  1 1 
ATOM   26   H  HB3  . ALA   A 1 9   ? 7.441   -2.933  -6.984  0   57.49 ? 702  ALA   A HB3  1 1 
ATOM   27   N  N    . LEU   A 1 10  ? 9.684   -0.62   -4.688  1   49.59 ? 703  LEU   A N    1 1 
ATOM   28   C  CA   . LEU   A 1 10  ? 9.761   -0.375  -3.25   1   49.84 ? 703  LEU   A CA   1 1 
ATOM   29   C  C    . LEU   A 1 10  ? 8.901   0.861   -2.941  1   50.05 ? 703  LEU   A C    1 1 
ATOM   30   O  O    . LEU   A 1 10  ? 8.646   1.68    -3.829  1   49.83 ? 703  LEU   A O    1 1 
ATOM   31   C  CB   . LEU   A 1 10  ? 11.227  -0.135  -2.831  1   50.32 ? 703  LEU   A CB   1 1 
ATOM   32   C  CG   . LEU   A 1 10  ? 12.02   -1.334  -2.265  1   52.86 ? 703  LEU   A CG   1 1 
ATOM   33   C  CD1  . LEU   A 1 10  ? 12.149  -2.471  -3.28   1   53.46 ? 703  LEU   A CD1  1 1 
ATOM   34   C  CD2  . LEU   A 1 10  ? 13.408  -0.909  -1.834  1   53.98 ? 703  LEU   A CD2  1 1 
ATOM   35   H  H    . LEU   A 1 10  ? 9.976   0.191   -5.223  0   55.6  ? 703  LEU   A H    1 1 
ATOM   36   H  HA   . LEU   A 1 10  ? 9.344   -1.208  -2.687  0   57.02 ? 703  LEU   A HA   1 1 
ATOM   37   H  HB2  . LEU   A 1 10  ? 11.776  0.225   -3.7    0   57.2  ? 703  LEU   A HB2  1 1 
ATOM   38   H  HB3  . LEU   A 1 10  ? 11.232  0.641   -2.067  0   57.39 ? 703  LEU   A HB3  1 1 
ATOM   39   H  HG   . LEU   A 1 10  ? 11.502  -1.722  -1.389  0   61.1  ? 703  LEU   A HG   1 1 
ATOM   40   H  HD11 . LEU   A 1 10  ? 12.881  -3.195  -2.924  0   62.28 ? 703  LEU   A HD11 1 1 
ATOM   41   H  HD12 . LEU   A 1 10  ? 11.19   -2.972  -3.398  0   61.43 ? 703  LEU   A HD12 1 1 
ATOM   42   H  HD13 . LEU   A 1 10  ? 12.473  -2.057  -4.234  0   61.36 ? 703  LEU   A HD13 1 1 
ATOM   43   H  HD21 . LEU   A 1 10  ? 13.892  -1.746  -1.331  0   63    ? 703  LEU   A HD21 1 1 
ATOM   44   H  HD22 . LEU   A 1 10  ? 13.981  -0.63   -2.717  0   62.13 ? 703  LEU   A HD22 1 1 
ATOM   45   H  HD23 . LEU   A 1 10  ? 13.327  -0.059  -1.159  0   62.28 ? 703  LEU   A HD23 1 1 
ATOM   46   N  N    . LEU   A 1 11  ? 8.403   0.967   -1.712  1   49.9  ? 704  LEU   A N    1 1 
ATOM   47   C  CA   . LEU   A 1 11  ? 7.542   2.089   -1.306  1   50.75 ? 704  LEU   A CA   1 1 
ATOM   48   C  C    . LEU   A 1 11  ? 7.969   2.637   0.046   1   50.66 ? 704  LEU   A C    1 1 
ATOM   49   O  O    . LEU   A 1 11  ? 7.875   1.908   1.026   1   50.94 ? 704  LEU   A O    1 1 
ATOM   50   C  CB   . LEU   A 1 11  ? 6.08    1.603   -1.165  1   51.73 ? 704  LEU   A CB   1 1 
ATOM   51   C  CG   . LEU   A 1 11  ? 5.089   1.847   -2.288  1   53.95 ? 704  LEU   A CG   1 1 
ATOM   52   C  CD1  . LEU   A 1 11  ? 3.716   1.289   -1.895  1   54.55 ? 704  LEU   A CD1  1 1 
ATOM   53   C  CD2  . LEU   A 1 11  ? 4.961   3.315   -2.6    1   54.77 ? 704  LEU   A CD2  1 1 
ATOM   54   H  H    . LEU   A 1 11  ? 8.576   0.296   -0.97   0   56.87 ? 704  LEU   A H    1 1 
ATOM   55   H  HA   . LEU   A 1 11  ? 7.622   2.9     -2.027  0   56.34 ? 704  LEU   A HA   1 1 
ATOM   56   H  HB2  . LEU   A 1 11  ? 6.103   0.523   -1.032  0   58.29 ? 704  LEU   A HB2  1 1 
ATOM   57   H  HB3  . LEU   A 1 11  ? 5.647   2.062   -0.278  0   57.96 ? 704  LEU   A HB3  1 1 
ATOM   58   H  HG   . LEU   A 1 11  ? 5.43    1.335   -3.186  0   59.48 ? 704  LEU   A HG   1 1 
ATOM   59   H  HD11 . LEU   A 1 11  ? 3.05    1.346   -2.755  0   60.11 ? 704  LEU   A HD11 1 1 
ATOM   60   H  HD12 . LEU   A 1 11  ? 3.822   0.256   -1.567  0   60.89 ? 704  LEU   A HD12 1 1 
ATOM   61   H  HD13 . LEU   A 1 11  ? 3.311   1.89    -1.084  0   60.55 ? 704  LEU   A HD13 1 1 
ATOM   62   H  HD21 . LEU   A 1 11  ? 4.043   3.49    -3.155  0   59.45 ? 704  LEU   A HD21 1 1 
ATOM   63   H  HD22 . LEU   A 1 11  ? 4.944   3.878   -1.667  0   59.87 ? 704  LEU   A HD22 1 1 
ATOM   64   H  HD23 . LEU   A 1 11  ? 5.797   3.638   -3.219  0   59.64 ? 704  LEU   A HD23 1 1 
ATOM   65   N  N    . ARG   A 1 12  ? 8.437   3.894   0.117   1   50.2  ? 705  ARG   A N    1 1 
ATOM   66   C  CA   . ARG   A 1 12  ? 8.814   4.496   1.394   1   50.65 ? 705  ARG   A CA   1 1 
ATOM   67   C  C    . ARG   A 1 12  ? 7.55    4.983   2.06    1   50.14 ? 705  ARG   A C    1 1 
ATOM   68   O  O    . ARG   A 1 12  ? 6.96    5.929   1.552   1   49.87 ? 705  ARG   A O    1 1 
ATOM   69   C  CB   . ARG   A 1 12  ? 9.731   5.714   1.205   1   52.77 ? 705  ARG   A CB   1 1 
ATOM   70   C  CG   . ARG   A 1 12  ? 11.2    5.384   0.953   1   57.11 ? 705  ARG   A CG   1 1 
ATOM   71   C  CD   . ARG   A 1 12  ? 12.061  6.637   0.957   1   61.57 ? 705  ARG   A CD   1 1 
ATOM   72   N  NE   . ARG   A 1 12  ? 12.15   7.249   2.289   1   65.98 ? 705  ARG   A NE   1 1 
ATOM   73   C  CZ   . ARG   A 1 12  ? 12.746  8.411   2.559   1   69.48 ? 705  ARG   A CZ   1 1 
ATOM   74   N  NH1  . ARG   A 1 12  ? 12.771  8.878   3.803   1   68.36 ? 705  ARG   A NH1  1 1 
ATOM   75   N  NH2  . ARG   A 1 12  ? 13.325  9.115   1.588   1   69.26 ? 705  ARG   A NH2  1 1 
ATOM   76   H  H    . ARG   A 1 12  ? 8.563   4.504   -0.685  0   55.9  ? 705  ARG   A H    1 1 
ATOM   77   H  HA   . ARG   A 1 12  ? 9.314   3.773   2.037   0   57.6  ? 705  ARG   A HA   1 1 
ATOM   78   H  HB2  . ARG   A 1 12  ? 9.376   6.313   0.368   0   58.53 ? 705  ARG   A HB2  1 1 
ATOM   79   H  HB3  . ARG   A 1 12  ? 9.677   6.303   2.119   0   59.18 ? 705  ARG   A HB3  1 1 
ATOM   80   H  HG2  . ARG   A 1 12  ? 11.56   4.723   1.74    0   64.25 ? 705  ARG   A HG2  1 1 
ATOM   81   H  HG3  . ARG   A 1 12  ? 11.301  4.904   -0.019  0   63.55 ? 705  ARG   A HG3  1 1 
ATOM   82   H  HD2  . ARG   A 1 12  ? 13.068  6.378   0.633   0   68.42 ? 705  ARG   A HD2  1 1 
ATOM   83   H  HD3  . ARG   A 1 12  ? 11.624  7.365   0.275   0   67.66 ? 705  ARG   A HD3  1 1 
ATOM   84   H  HE   . ARG   A 1 12  ? 11.739  6.745   3.067   0   73.16 ? 705  ARG   A HE   1 1 
ATOM   85   H  HH11 . ARG   A 1 12  ? 12.342  8.351   4.556   0   75.98 ? 705  ARG   A HH11 1 1 
ATOM   86   H  HH12 . ARG   A 1 12  ? 13.226  9.761   4.009   0   75.9  ? 705  ARG   A HH12 1 1 
ATOM   87   H  HH21 . ARG   A 1 12  ? 13.332  8.811   0.62    0   75.81 ? 705  ARG   A HH21 1 1 
ATOM   88   H  HH22 . ARG   A 1 12  ? 13.768  9.999   1.815   0   76.23 ? 705  ARG   A HH22 1 1 
ATOM   89   N  N    . ILE   A 1 13  ? 7.118   4.366   3.181   1   49.4  ? 706  ILE   A N    1 1 
ATOM   90   C  CA   . ILE   A 1 13  ? 5.918   4.836   3.871   1   49.61 ? 706  ILE   A CA   1 1 
ATOM   91   C  C    . ILE   A 1 13  ? 6.353   5.98    4.775   1   49.3  ? 706  ILE   A C    1 1 
ATOM   92   O  O    . ILE   A 1 13  ? 7.205   5.797   5.652   1   49.48 ? 706  ILE   A O    1 1 
ATOM   93   C  CB   . ILE   A 1 13  ? 5.138   3.755   4.651   1   50.49 ? 706  ILE   A CB   1 1 
ATOM   94   C  CG1  . ILE   A 1 13  ? 4.684   2.597   3.714   1   51.43 ? 706  ILE   A CG1  1 1 
ATOM   95   C  CG2  . ILE   A 1 13  ? 3.909   4.41    5.327   1   51.23 ? 706  ILE   A CG2  1 1 
ATOM   96   C  CD1  . ILE   A 1 13  ? 4.479   1.257   4.44    1   53.34 ? 706  ILE   A CD1  1 1 
ATOM   97   H  H    . ILE   A 1 13  ? 7.577   3.575   3.621   0   56.68 ? 706  ILE   A H    1 1 
ATOM   98   H  HA   . ILE   A 1 13  ? 5.226   5.229   3.128   0   56.02 ? 706  ILE   A HA   1 1 
ATOM   99   H  HB   . ILE   A 1 13  ? 5.79    3.358   5.427   0   58.32 ? 706  ILE   A HB   1 1 
ATOM   100  H  HG12 . ILE   A 1 13  ? 3.737   2.866   3.247   0   58.5  ? 706  ILE   A HG12 1 1 
ATOM   101  H  HG13 . ILE   A 1 13  ? 5.432   2.428   2.941   0   58.59 ? 706  ILE   A HG13 1 1 
ATOM   102  H  HG21 . ILE   A 1 13  ? 3.193   3.644   5.623   0   59.07 ? 706  ILE   A HG21 1 1 
ATOM   103  H  HG22 . ILE   A 1 13  ? 4.227   4.961   6.211   0   58.69 ? 706  ILE   A HG22 1 1 
ATOM   104  H  HG23 . ILE   A 1 13  ? 3.429   5.085   4.62    0   58.21 ? 706  ILE   A HG23 1 1 
ATOM   105  H  HD11 . ILE   A 1 13  ? 4.135   0.513   3.723   0   61.44 ? 706  ILE   A HD11 1 1 
ATOM   106  H  HD12 . ILE   A 1 13  ? 5.424   0.942   4.88    0   61.76 ? 706  ILE   A HD12 1 1 
ATOM   107  H  HD13 . ILE   A 1 13  ? 3.73    1.378   5.222   0   61.67 ? 706  ILE   A HD13 1 1 
ATOM   108  N  N    . LEU   A 1 14  ? 5.775   7.161   4.548   1   48.22 ? 707  LEU   A N    1 1 
ATOM   109  C  CA   . LEU   A 1 14  ? 6.116   8.367   5.274   1   48.14 ? 707  LEU   A CA   1 1 
ATOM   110  C  C    . LEU   A 1 14  ? 5.015   8.61    6.313   1   47.74 ? 707  LEU   A C    1 1 
ATOM   111  O  O    . LEU   A 1 14  ? 3.827   8.534   5.982   1   47.76 ? 707  LEU   A O    1 1 
ATOM   112  C  CB   . LEU   A 1 14  ? 6.251   9.55    4.282   1   48.57 ? 707  LEU   A CB   1 1 
ATOM   113  C  CG   . LEU   A 1 14  ? 7.087   9.296   2.995   1   50.29 ? 707  LEU   A CG   1 1 
ATOM   114  C  CD1  . LEU   A 1 14  ? 7.125   10.535  2.115   1   51.06 ? 707  LEU   A CD1  1 1 
ATOM   115  C  CD2  . LEU   A 1 14  ? 8.521   8.833   3.315   1   50.98 ? 707  LEU   A CD2  1 1 
ATOM   116  H  H    . LEU   A 1 14  ? 5.031   7.306   3.873   0   54.38 ? 707  LEU   A H    1 1 
ATOM   117  H  HA   . LEU   A 1 14  ? 7.062   8.254   5.801   0   55.06 ? 707  LEU   A HA   1 1 
ATOM   118  H  HB2  . LEU   A 1 14  ? 5.251   9.841   3.965   0   54.34 ? 707  LEU   A HB2  1 1 
ATOM   119  H  HB3  . LEU   A 1 14  ? 6.717   10.382  4.808   0   54.74 ? 707  LEU   A HB3  1 1 
ATOM   120  H  HG   . LEU   A 1 14  ? 6.61    8.509   2.412   0   55.87 ? 707  LEU   A HG   1 1 
ATOM   121  H  HD11 . LEU   A 1 14  ? 7.79    10.359  1.271   0   56.11 ? 707  LEU   A HD11 1 1 
ATOM   122  H  HD12 . LEU   A 1 14  ? 6.122   10.734  1.741   0   56.03 ? 707  LEU   A HD12 1 1 
ATOM   123  H  HD13 . LEU   A 1 14  ? 7.482   11.379  2.704   0   56.48 ? 707  LEU   A HD13 1 1 
ATOM   124  H  HD21 . LEU   A 1 14  ? 9.121   8.877   2.407   0   56.93 ? 707  LEU   A HD21 1 1 
ATOM   125  H  HD22 . LEU   A 1 14  ? 8.943   9.492   4.072   0   57.33 ? 707  LEU   A HD22 1 1 
ATOM   126  H  HD23 . LEU   A 1 14  ? 8.504   7.806   3.676   0   57.48 ? 707  LEU   A HD23 1 1 
ATOM   127  N  N    . LYS   A 1 15  ? 5.404   8.804   7.582   1   46.78 ? 708  LYS   A N    1 1 
ATOM   128  C  CA   . LYS   A 1 15  ? 4.435   9.007   8.658   1   46.78 ? 708  LYS   A CA   1 1 
ATOM   129  C  C    . LYS   A 1 15  ? 3.686   10.31   8.446   1   46.31 ? 708  LYS   A C    1 1 
ATOM   130  O  O    . LYS   A 1 15  ? 4.33    11.308  8.149   1   45.97 ? 708  LYS   A O    1 1 
ATOM   131  C  CB   . LYS   A 1 15  ? 5.14    9.105   10.02   1   48.78 ? 708  LYS   A CB   1 1 
ATOM   132  C  CG   . LYS   A 1 15  ? 5.85    7.836   10.466  1   53.9  ? 708  LYS   A CG   1 1 
ATOM   133  C  CD   . LYS   A 1 15  ? 6.217   7.853   11.954  1   59    ? 708  LYS   A CD   1 1 
ATOM   134  C  CE   . LYS   A 1 15  ? 7.473   8.634   12.244  1   64.01 ? 708  LYS   A CE   1 1 
ATOM   135  N  NZ   . LYS   A 1 15  ? 7.834   8.594   13.692  1   67.18 ? 708  LYS   A NZ   1 1 
ATOM   136  H  H    . LYS   A 1 15  ? 6.374   8.864   7.873   0   54.34 ? 708  LYS   A H    1 1 
ATOM   137  H  HA   . LYS   A 1 15  ? 3.722   8.184   8.682   0   54.6  ? 708  LYS   A HA   1 1 
ATOM   138  H  HB2  . LYS   A 1 15  ? 5.881   9.901   9.966   0   57    ? 708  LYS   A HB2  1 1 
ATOM   139  H  HB3  . LYS   A 1 15  ? 4.392   9.353   10.772  0   57.32 ? 708  LYS   A HB3  1 1 
ATOM   140  H  HG2  . LYS   A 1 15  ? 5.19    6.988   10.291  0   62.73 ? 708  LYS   A HG2  1 1 
ATOM   141  H  HG3  . LYS   A 1 15  ? 6.769   7.722   9.893   0   62.55 ? 708  LYS   A HG3  1 1 
ATOM   142  H  HD2  . LYS   A 1 15  ? 5.405   8.294   12.53   0   68.58 ? 708  LYS   A HD2  1 1 
ATOM   143  H  HD3  . LYS   A 1 15  ? 6.382   6.827   12.28   0   68.86 ? 708  LYS   A HD3  1 1 
ATOM   144  H  HE2  . LYS   A 1 15  ? 8.298   8.204   11.678  0   73.57 ? 708  LYS   A HE2  1 1 
ATOM   145  H  HE3  . LYS   A 1 15  ? 7.332   9.677   11.966  0   73.31 ? 708  LYS   A HE3  1 1 
ATOM   146  H  HZ1  . LYS   A 1 15  ? 8.781   8.935   13.822  0   77.72 ? 708  LYS   A HZ1  1 1 
ATOM   147  H  HZ2  . LYS   A 1 15  ? 7.2     9.184   14.221  0   77.58 ? 708  LYS   A HZ2  1 1 
ATOM   148  H  HZ3  . LYS   A 1 15  ? 7.774   7.644   14.043  0   77.85 ? 708  LYS   A HZ3  1 1 
ATOM   149  N  N    . GLU   A 1 16  ? 2.356   10.335  8.648   1   46.31 ? 709  GLU   A N    1 1 
ATOM   150  C  CA   . GLU   A 1 16  ? 1.598   11.59   8.511   1   46.92 ? 709  GLU   A CA   1 1 
ATOM   151  C  C    . GLU   A 1 16  ? 2.126   12.712  9.416   1   46.27 ? 709  GLU   A C    1 1 
ATOM   152  O  O    . GLU   A 1 16  ? 2.026   13.885  9.046   1   46.17 ? 709  GLU   A O    1 1 
ATOM   153  C  CB   . GLU   A 1 16  ? 0.089   11.39   8.7     1   50.44 ? 709  GLU   A CB   1 1 
ATOM   154  C  CG   . GLU   A 1 16  ? -0.357  10.942  10.077  1   57.68 ? 709  GLU   A CG   1 1 
ATOM   155  C  CD   . GLU   A 1 16  ? -1.816  10.531  10.072  1   66.32 ? 709  GLU   A CD   1 1 
ATOM   156  O  OE1  . GLU   A 1 16  ? -2.104  9.347   10.362  1   67.42 ? 709  GLU   A OE1  1 1 
ATOM   157  O  OE2  . GLU   A 1 16  ? -2.67   11.395  9.76    1   69.04 ? 709  GLU   A OE2  1 1 
ATOM   158  H  H    . GLU   A 1 16  ? 1.801   9.516   8.874   0   54.02 ? 709  GLU   A H    1 1 
ATOM   159  H  HA   . GLU   A 1 16  ? 1.704   11.92   7.48    0   53.72 ? 709  GLU   A HA   1 1 
ATOM   160  H  HB2  . GLU   A 1 16  ? -0.41   12.334  8.491   0   57.74 ? 709  GLU   A HB2  1 1 
ATOM   161  H  HB3  . GLU   A 1 16  ? -0.237  10.638  7.983   0   57.73 ? 709  GLU   A HB3  1 1 
ATOM   162  H  HG2  . GLU   A 1 16  ? 0.238   10.089  10.403  0   66.05 ? 709  GLU   A HG2  1 1 
ATOM   163  H  HG3  . GLU   A 1 16  ? -0.25   11.772  10.776  0   66.04 ? 709  GLU   A HG3  1 1 
ATOM   164  N  N    . THR   A 1 17  ? 2.74    12.36   10.567  1   45.55 ? 710  THR   A N    1 1 
ATOM   165  C  CA   . THR   A 1 17  ? 3.344   13.336  11.493  1   45.52 ? 710  THR   A CA   1 1 
ATOM   166  C  C    . THR   A 1 17  ? 4.539   14.076  10.866  1   45.38 ? 710  THR   A C    1 1 
ATOM   167  O  O    . THR   A 1 17  ? 4.853   15.196  11.285  1   45.77 ? 710  THR   A O    1 1 
ATOM   168  C  CB   . THR   A 1 17  ? 3.726   12.648  12.825  1   46.99 ? 710  THR   A CB   1 1 
ATOM   169  O  OG1  . THR   A 1 17  ? 4.415   11.42   12.553  1   47.84 ? 710  THR   A OG1  1 1 
ATOM   170  C  CG2  . THR   A 1 17  ? 2.504   12.361  13.711  1   47.73 ? 710  THR   A CG2  1 1 
ATOM   171  H  H    . THR   A 1 17  ? 2.838   11.403  10.89   0   53.84 ? 710  THR   A H    1 1 
ATOM   172  H  HA   . THR   A 1 17  ? 2.609   14.103  11.729  0   53.99 ? 710  THR   A HA   1 1 
ATOM   173  H  HB   . THR   A 1 17  ? 4.386   13.304  13.391  0   56.3  ? 710  THR   A HB   1 1 
ATOM   174  H  HG1  . THR   A 1 17  ? 4.61    10.944  13.403  0   57.37 ? 710  THR   A HG1  1 1 
ATOM   175  H  HG21 . THR   A 1 17  ? 2.82    11.869  14.63   0   57.71 ? 710  THR   A HG21 1 1 
ATOM   176  H  HG22 . THR   A 1 17  ? 2.001   13.292  13.966  0   57.28 ? 710  THR   A HG22 1 1 
ATOM   177  H  HG23 . THR   A 1 17  ? 1.803   11.714  13.186  0   57.05 ? 710  THR   A HG23 1 1 
ATOM   178  N  N    . GLU   A 1 18  ? 5.185   13.467  9.845   1   44.6  ? 711  GLU   A N    1 1 
ATOM   179  C  CA   . GLU   A 1 18  ? 6.276   14.088  9.096   1   44.34 ? 711  GLU   A CA   1 1 
ATOM   180  C  C    . GLU   A 1 18  ? 5.758   15.196  8.145   1   43.46 ? 711  GLU   A C    1 1 
ATOM   181  O  O    . GLU   A 1 18  ? 6.576   15.934  7.615   1   43.52 ? 711  GLU   A O    1 1 
ATOM   182  C  CB   . GLU   A 1 18  ? 7.057   13.03   8.285   1   47.03 ? 711  GLU   A CB   1 1 
ATOM   183  C  CG   . GLU   A 1 18  ? 7.883   12.073  9.131   1   52.03 ? 711  GLU   A CG   1 1 
ATOM   184  C  CD   . GLU   A 1 18  ? 8.336   10.816  8.41    1   59.01 ? 711  GLU   A CD   1 1 
ATOM   185  O  OE1  . GLU   A 1 18  ? 8.43    10.837  7.161   1   59.41 ? 711  GLU   A OE1  1 1 
ATOM   186  O  OE2  . GLU   A 1 18  ? 8.578   9.798   9.096   1   61.84 ? 711  GLU   A OE2  1 1 
ATOM   187  H  H    . GLU   A 1 18  ? 4.97    12.53   9.52    0   52.25 ? 711  GLU   A H    1 1 
ATOM   188  H  HA   . GLU   A 1 18  ? 6.973   14.547  9.796   0   52.27 ? 711  GLU   A HA   1 1 
ATOM   189  H  HB2  . GLU   A 1 18  ? 6.357   12.445  7.69    0   54.08 ? 711  GLU   A HB2  1 1 
ATOM   190  H  HB3  . GLU   A 1 18  ? 7.754   13.549  7.629   0   54.19 ? 711  GLU   A HB3  1 1 
ATOM   191  H  HG2  . GLU   A 1 18  ? 8.777   12.606  9.452   0   60.22 ? 711  GLU   A HG2  1 1 
ATOM   192  H  HG3  . GLU   A 1 18  ? 7.307   11.766  10.003  0   60.23 ? 711  GLU   A HG3  1 1 
ATOM   193  N  N    . PHE   A 1 19  ? 4.423   15.341  7.94    1   42.45 ? 712  PHE   A N    1 1 
ATOM   194  C  CA   . PHE   A 1 19  ? 3.87    16.374  7.064   1   41.79 ? 712  PHE   A CA   1 1 
ATOM   195  C  C    . PHE   A 1 19  ? 3.175   17.453  7.854   1   42.08 ? 712  PHE   A C    1 1 
ATOM   196  O  O    . PHE   A 1 19  ? 2.388   17.154  8.754   1   42.7  ? 712  PHE   A O    1 1 
ATOM   197  C  CB   . PHE   A 1 19  ? 2.845   15.783  6.101   1   40.88 ? 712  PHE   A CB   1 1 
ATOM   198  C  CG   . PHE   A 1 19  ? 3.406   14.691  5.236   1   40.58 ? 712  PHE   A CG   1 1 
ATOM   199  C  CD1  . PHE   A 1 19  ? 3.46    13.389  5.689   1   41.05 ? 712  PHE   A CD1  1 1 
ATOM   200  C  CD2  . PHE   A 1 19  ? 3.883   14.967  3.97    1   40.56 ? 712  PHE   A CD2  1 1 
ATOM   201  C  CE1  . PHE   A 1 19  ? 4.027   12.389  4.91    1   41.49 ? 712  PHE   A CE1  1 1 
ATOM   202  C  CE2  . PHE   A 1 19  ? 4.404   13.959  3.179   1   41    ? 712  PHE   A CE2  1 1 
ATOM   203  C  CZ   . PHE   A 1 19  ? 4.474   12.68   3.651   1   40.78 ? 712  PHE   A CZ   1 1 
ATOM   204  H  H    . PHE   A 1 19  ? 3.701   14.76   8.354   0   49.44 ? 712  PHE   A H    1 1 
ATOM   205  H  HA   . PHE   A 1 19  ? 4.656   16.826  6.461   0   48.1  ? 712  PHE   A HA   1 1 
ATOM   206  H  HB2  . PHE   A 1 19  ? 2.014   15.372  6.671   0   47.12 ? 712  PHE   A HB2  1 1 
ATOM   207  H  HB3  . PHE   A 1 19  ? 2.497   16.579  5.444   0   46.65 ? 712  PHE   A HB3  1 1 
ATOM   208  H  HD1  . PHE   A 1 19  ? 3.157   13.178  6.695   0   47.39 ? 712  PHE   A HD1  1 1 
ATOM   209  H  HD2  . PHE   A 1 19  ? 3.826   15.97   3.583   0   45.67 ? 712  PHE   A HD2  1 1 
ATOM   210  H  HE1  . PHE   A 1 19  ? 4.075   11.379  5.28    0   47.49 ? 712  PHE   A HE1  1 1 
ATOM   211  H  HE2  . PHE   A 1 19  ? 4.758   14.192  2.19    0   45.7  ? 712  PHE   A HE2  1 1 
ATOM   212  H  HZ   . PHE   A 1 19  ? 4.879   11.9    3.033   0   45.93 ? 712  PHE   A HZ   1 1 
ATOM   213  N  N    . LYS   A 1 20  ? 3.433   18.706  7.494   1   41.31 ? 713  LYS   A N    1 1 
ATOM   214  C  CA   . LYS   A 1 20  ? 2.796   19.85   8.123   1   41.34 ? 713  LYS   A CA   1 1 
ATOM   215  C  C    . LYS   A 1 20  ? 2.353   20.848  7.043   1   41.1  ? 713  LYS   A C    1 1 
ATOM   216  O  O    . LYS   A 1 20  ? 2.714   20.701  5.86    1   41.16 ? 713  LYS   A O    1 1 
ATOM   217  C  CB   . LYS   A 1 20  ? 3.74    20.51   9.164   1   42.72 ? 713  LYS   A CB   1 1 
ATOM   218  C  CG   . LYS   A 1 20  ? 4.113   19.622  10.367  1   46.26 ? 713  LYS   A CG   1 1 
ATOM   219  C  CD   . LYS   A 1 20  ? 2.98    19.396  11.396  1   50.88 ? 713  LYS   A CD   1 1 
ATOM   220  C  CE   . LYS   A 1 20  ? 3.295   18.23   12.311  1   55.51 ? 713  LYS   A CE   1 1 
ATOM   221  N  NZ   . LYS   A 1 20  ? 2.144   17.829  13.177  1   58.26 ? 713  LYS   A NZ   1 1 
ATOM   222  H  H    . LYS   A 1 20  ? 4.084   18.971  6.761   0   47.79 ? 713  LYS   A H    1 1 
ATOM   223  H  HA   . LYS   A 1 20  ? 1.882   19.539  8.625   0   48.56 ? 713  LYS   A HA   1 1 
ATOM   224  H  HB2  . LYS   A 1 20  ? 4.665   20.789  8.663   0   50.23 ? 713  LYS   A HB2  1 1 
ATOM   225  H  HB3  . LYS   A 1 20  ? 3.254   21.401  9.558   0   50.57 ? 713  LYS   A HB3  1 1 
ATOM   226  H  HG2  . LYS   A 1 20  ? 4.433   18.649  9.998   0   54.09 ? 713  LYS   A HG2  1 1 
ATOM   227  H  HG3  . LYS   A 1 20  ? 4.941   20.096  10.894  0   54.66 ? 713  LYS   A HG3  1 1 
ATOM   228  H  HD2  . LYS   A 1 20  ? 2.876   20.291  12.007  0   59.64 ? 713  LYS   A HD2  1 1 
ATOM   229  H  HD3  . LYS   A 1 20  ? 2.04    19.176  10.894  0   59.02 ? 713  LYS   A HD3  1 1 
ATOM   230  H  HE2  . LYS   A 1 20  ? 3.571   17.367  11.708  0   63.98 ? 713  LYS   A HE2  1 1 
ATOM   231  H  HE3  . LYS   A 1 20  ? 4.123   18.506  12.963  0   64.63 ? 713  LYS   A HE3  1 1 
ATOM   232  H  HZ1  . LYS   A 1 20  ? 2.245   16.856  13.447  0   67.34 ? 713  LYS   A HZ1  1 1 
ATOM   233  H  HZ2  . LYS   A 1 20  ? 2.13    18.395  14.02   0   67.82 ? 713  LYS   A HZ2  1 1 
ATOM   234  H  HZ3  . LYS   A 1 20  ? 1.262   17.943  12.688  0   67.18 ? 713  LYS   A HZ3  1 1 
ATOM   235  N  N    . LYS   A 1 21  ? 1.504   21.819  7.443   1   39.87 ? 714  LYS   A N    1 1 
ATOM   236  C  CA   . LYS   A 1 21  ? 0.972   22.849  6.563   1   39.28 ? 714  LYS   A CA   1 1 
ATOM   237  C  C    . LYS   A 1 21  ? 0.28    22.279  5.307   1   37.58 ? 714  LYS   A C    1 1 
ATOM   238  O  O    . LYS   A 1 21  ? 0.418   22.854  4.23    1   37.22 ? 714  LYS   A O    1 1 
ATOM   239  C  CB   . LYS   A 1 21  ? 2.07    23.86   6.186   1   42.1  ? 714  LYS   A CB   1 1 
ATOM   240  C  CG   . LYS   A 1 21  ? 2.784   24.453  7.405   1   48.79 ? 714  LYS   A CG   1 1 
ATOM   241  C  CD   . LYS   A 1 21  ? 3.488   25.763  7.07    1   54.85 ? 714  LYS   A CD   1 1 
ATOM   242  C  CE   . LYS   A 1 21  ? 4.646   26.053  7.998   1   60.16 ? 714  LYS   A CE   1 1 
ATOM   243  N  NZ   . LYS   A 1 21  ? 5.326   27.338  7.654   1   63.75 ? 714  LYS   A NZ   1 1 
ATOM   244  H  H    . LYS   A 1 21  ? 1.156   21.902  8.393   0   47.28 ? 714  LYS   A H    1 1 
ATOM   245  H  HA   . LYS   A 1 21  ? 0.213   23.4    7.116   0   46.44 ? 714  LYS   A HA   1 1 
ATOM   246  H  HB2  . LYS   A 1 21  ? 2.815   23.362  5.567   0   48.66 ? 714  LYS   A HB2  1 1 
ATOM   247  H  HB3  . LYS   A 1 21  ? 1.622   24.687  5.635   0   48.91 ? 714  LYS   A HB3  1 1 
ATOM   248  H  HG2  . LYS   A 1 21  ? 2.051   24.652  8.185   0   56.63 ? 714  LYS   A HG2  1 1 
ATOM   249  H  HG3  . LYS   A 1 21  ? 3.526   23.738  7.76    0   56.35 ? 714  LYS   A HG3  1 1 
ATOM   250  H  HD2  . LYS   A 1 21  ? 3.876   25.713  6.054   0   62.21 ? 714  LYS   A HD2  1 1 
ATOM   251  H  HD3  . LYS   A 1 21  ? 2.774   26.581  7.157   0   62.77 ? 714  LYS   A HD3  1 1 
ATOM   252  H  HE2  . LYS   A 1 21  ? 4.274   26.127  9.019   0   68.86 ? 714  LYS   A HE2  1 1 
ATOM   253  H  HE3  . LYS   A 1 21  ? 5.377   25.25   7.92    0   68.34 ? 714  LYS   A HE3  1 1 
ATOM   254  H  HZ1  . LYS   A 1 21  ? 6.232   27.383  8.11    0   72.67 ? 714  LYS   A HZ1  1 1 
ATOM   255  H  HZ2  . LYS   A 1 21  ? 5.458   27.405  6.65    0   72.02 ? 714  LYS   A HZ2  1 1 
ATOM   256  H  HZ3  . LYS   A 1 21  ? 4.762   28.12   7.969   0   72.75 ? 714  LYS   A HZ3  1 1 
ATOM   257  N  N    . ILE   A 1 22  ? -0.487  21.179  5.452   1   36.7  ? 715  ILE   A N    1 1 
ATOM   258  C  CA   . ILE   A 1 22  ? -1.194  20.603  4.306   1   36.7  ? 715  ILE   A CA   1 1 
ATOM   259  C  C    . ILE   A 1 22  ? -2.383  21.521  3.987   1   36.51 ? 715  ILE   A C    1 1 
ATOM   260  O  O    . ILE   A 1 22  ? -3.175  21.836  4.884   1   36.3  ? 715  ILE   A O    1 1 
ATOM   261  C  CB   . ILE   A 1 22  ? -1.64   19.132  4.536   1   37.13 ? 715  ILE   A CB   1 1 
ATOM   262  C  CG1  . ILE   A 1 22  ? -0.404  18.195  4.707   1   37.75 ? 715  ILE   A CG1  1 1 
ATOM   263  C  CG2  . ILE   A 1 22  ? -2.523  18.654  3.357   1   37.91 ? 715  ILE   A CG2  1 1 
ATOM   264  C  CD1  . ILE   A 1 22  ? -0.72   16.8    5.286   1   39.28 ? 715  ILE   A CD1  1 1 
ATOM   265  H  H    . ILE   A 1 22  ? -0.657  20.7    6.33    0   43.19 ? 715  ILE   A H    1 1 
ATOM   266  H  HA   . ILE   A 1 22  ? -0.522  20.592  3.449   0   42.06 ? 715  ILE   A HA   1 1 
ATOM   267  H  HB   . ILE   A 1 22  ? -2.232  19.091  5.449   0   43.3  ? 715  ILE   A HB   1 1 
ATOM   268  H  HG12 . ILE   A 1 22  ? 0.051   18.045  3.729   0   42.98 ? 715  ILE   A HG12 1 1 
ATOM   269  H  HG13 . ILE   A 1 22  ? 0.316   18.663  5.376   0   43.61 ? 715  ILE   A HG13 1 1 
ATOM   270  H  HG21 . ILE   A 1 22  ? -2.816  17.616  3.502   0   43.36 ? 715  ILE   A HG21 1 1 
ATOM   271  H  HG22 . ILE   A 1 22  ? -3.429  19.255  3.289   0   43.45 ? 715  ILE   A HG22 1 1 
ATOM   272  H  HG23 . ILE   A 1 22  ? -1.944  18.743  2.439   0   42.88 ? 715  ILE   A HG23 1 1 
ATOM   273  H  HD11 . ILE   A 1 22  ? 0.214   16.287  5.506   0   45.07 ? 715  ILE   A HD11 1 1 
ATOM   274  H  HD12 . ILE   A 1 22  ? -1.299  16.921  6.201   0   45.55 ? 715  ILE   A HD12 1 1 
ATOM   275  H  HD13 . ILE   A 1 22  ? -1.286  16.215  4.563   0   44.93 ? 715  ILE   A HD13 1 1 
ATOM   276  N  N    . LYS   A 1 23  ? -2.476  21.979  2.724   1   35.58 ? 716  LYS   A N    1 1 
ATOM   277  C  CA   . LYS   A 1 23  ? -3.546  22.849  2.241   1   36.22 ? 716  LYS   A CA   1 1 
ATOM   278  C  C    . LYS   A 1 23  ? -3.979  22.325  0.855   1   34.98 ? 716  LYS   A C    1 1 
ATOM   279  O  O    . LYS   A 1 23  ? -3.119  21.995  0.043   1   33.52 ? 716  LYS   A O    1 1 
ATOM   280  C  CB   . LYS   A 1 23  ? -3.064  24.316  2.055   1   39.93 ? 716  LYS   A CB   1 1 
ATOM   281  C  CG   . LYS   A 1 23  ? -2.149  24.896  3.139   1   47.48 ? 716  LYS   A CG   1 1 
ATOM   282  C  CD   . LYS   A 1 23  ? -2.908  25.422  4.36    1   54.16 ? 716  LYS   A CD   1 1 
ATOM   283  C  CE   . LYS   A 1 23  ? -1.988  25.801  5.507   1   58.88 ? 716  LYS   A CE   1 1 
ATOM   284  N  NZ   . LYS   A 1 23  ? -1.319  27.122  5.307   1   62.37 ? 716  LYS   A NZ   1 1 
ATOM   285  H  H    . LYS   A 1 23  ? -1.808  21.754  1.995   0   40.69 ? 716  LYS   A H    1 1 
ATOM   286  H  HA   . LYS   A 1 23  ? -4.404  22.833  2.911   0   42.21 ? 716  LYS   A HA   1 1 
ATOM   287  H  HB2  . LYS   A 1 23  ? -2.522  24.38   1.113   0   45.25 ? 716  LYS   A HB2  1 1 
ATOM   288  H  HB3  . LYS   A 1 23  ? -3.944  24.956  2.007   0   45.86 ? 716  LYS   A HB3  1 1 
ATOM   289  H  HG2  . LYS   A 1 23  ? -1.437  24.147  3.48    0   53.5  ? 716  LYS   A HG2  1 1 
ATOM   290  H  HG3  . LYS   A 1 23  ? -1.604  25.737  2.712   0   53.6  ? 716  LYS   A HG3  1 1 
ATOM   291  H  HD2  . LYS   A 1 23  ? -3.468  26.31   4.069   0   61.11 ? 716  LYS   A HD2  1 1 
ATOM   292  H  HD3  . LYS   A 1 23  ? -3.593  24.655  4.718   0   60.99 ? 716  LYS   A HD3  1 1 
ATOM   293  H  HE2  . LYS   A 1 23  ? -2.58   25.865  6.418   0   66.55 ? 716  LYS   A HE2  1 1 
ATOM   294  H  HE3  . LYS   A 1 23  ? -1.216  25.042  5.619   0   65.94 ? 716  LYS   A HE3  1 1 
ATOM   295  H  HZ1  . LYS   A 1 23  ? -0.56   27.226  5.974   0   69.91 ? 716  LYS   A HZ1  1 1 
ATOM   296  H  HZ2  . LYS   A 1 23  ? -0.94   27.206  4.37    0   69.39 ? 716  LYS   A HZ2  1 1 
ATOM   297  H  HZ3  . LYS   A 1 23  ? -1.987  27.871  5.457   0   70.16 ? 716  LYS   A HZ3  1 1 
ATOM   298  N  N    . VAL   A 1 24  ? -5.286  22.358  0.546   1   35.06 ? 717  VAL   A N    1 1 
ATOM   299  C  CA   . VAL   A 1 24  ? -5.776  21.918  -0.773  1   35.65 ? 717  VAL   A CA   1 1 
ATOM   300  C  C    . VAL   A 1 24  ? -5.214  22.859  -1.843  1   34.57 ? 717  VAL   A C    1 1 
ATOM   301  O  O    . VAL   A 1 24  ? -5.209  24.071  -1.626  1   34.03 ? 717  VAL   A O    1 1 
ATOM   302  C  CB   . VAL   A 1 24  ? -7.329  21.903  -0.901  1   37.89 ? 717  VAL   A CB   1 1 
ATOM   303  C  CG1  . VAL   A 1 24  ? -7.761  21.386  -2.275  1   39.42 ? 717  VAL   A CG1  1 1 
ATOM   304  C  CG2  . VAL   A 1 24  ? -7.987  21.077  0.179   1   39.05 ? 717  VAL   A CG2  1 1 
ATOM   305  H  H    . VAL   A 1 24  ? -5.991  22.739  1.168   0   40.76 ? 717  VAL   A H    1 1 
ATOM   306  H  HA   . VAL   A 1 24  ? -5.416  20.909  -0.964  0   40.28 ? 717  VAL   A HA   1 1 
ATOM   307  H  HB   . VAL   A 1 24  ? -7.697  22.924  -0.806  0   43.4  ? 717  VAL   A HB   1 1 
ATOM   308  H  HG11 . VAL   A 1 24  ? -8.832  21.185  -2.268  0   44.61 ? 717  VAL   A HG11 1 1 
ATOM   309  H  HG12 . VAL   A 1 24  ? -7.552  22.132  -3.038  0   43.99 ? 717  VAL   A HG12 1 1 
ATOM   310  H  HG13 . VAL   A 1 24  ? -7.217  20.468  -2.493  0   44.03 ? 717  VAL   A HG13 1 1 
ATOM   311  H  HG21 . VAL   A 1 24  ? -9.068  21.133  0.058   0   45.08 ? 717  VAL   A HG21 1 1 
ATOM   312  H  HG22 . VAL   A 1 24  ? -7.658  20.045  0.066   0   44.54 ? 717  VAL   A HG22 1 1 
ATOM   313  H  HG23 . VAL   A 1 24  ? -7.714  21.454  1.164   0   45.06 ? 717  VAL   A HG23 1 1 
ATOM   314  N  N    . LEU   A 1 25  ? -4.754  22.298  -2.986  1   33.64 ? 718  LEU   A N    1 1 
ATOM   315  C  CA   . LEU   A 1 25  ? -4.307  23.058  -4.167  1   33.56 ? 718  LEU   A CA   1 1 
ATOM   316  C  C    . LEU   A 1 25  ? -5.443  23.068  -5.203  1   33.45 ? 718  LEU   A C    1 1 
ATOM   317  O  O    . LEU   A 1 25  ? -5.708  24.096  -5.826  1   34.06 ? 718  LEU   A O    1 1 
ATOM   318  C  CB   . LEU   A 1 25  ? -3.072  22.424  -4.844  1   33.75 ? 718  LEU   A CB   1 1 
ATOM   319  C  CG   . LEU   A 1 25  ? -1.686  22.843  -4.387  1   35.66 ? 718  LEU   A CG   1 1 
ATOM   320  C  CD1  . LEU   A 1 25  ? -0.655  22.001  -5.088  1   35.74 ? 718  LEU   A CD1  1 1 
ATOM   321  C  CD2  . LEU   A 1 25  ? -1.415  24.349  -4.647  1   36.45 ? 718  LEU   A CD2  1 1 
ATOM   322  H  H    . LEU   A 1 25  ? -4.69   21.293  -3.115  0   37.46 ? 718  LEU   A H    1 1 
ATOM   323  H  HA   . LEU   A 1 25  ? -4.102  24.091  -3.892  0   37.47 ? 718  LEU   A HA   1 1 
ATOM   324  H  HB2  . LEU   A 1 25  ? -3.136  21.343  -4.728  0   36.84 ? 718  LEU   A HB2  1 1 
ATOM   325  H  HB3  . LEU   A 1 25  ? -3.129  22.661  -5.905  0   36.68 ? 718  LEU   A HB3  1 1 
ATOM   326  H  HG   . LEU   A 1 25  ? -1.595  22.665  -3.316  0   39.17 ? 718  LEU   A HG   1 1 
ATOM   327  H  HD11 . LEU   A 1 25  ? 0.337   22.38   -4.852  0   38.64 ? 718  LEU   A HD11 1 1 
ATOM   328  H  HD12 . LEU   A 1 25  ? -0.748  20.972  -4.742  0   38.49 ? 718  LEU   A HD12 1 1 
ATOM   329  H  HD13 . LEU   A 1 25  ? -0.827  22.05   -6.162  0   38.28 ? 718  LEU   A HD13 1 1 
ATOM   330  H  HD21 . LEU   A 1 25  ? -0.346  24.542  -4.562  0   39.95 ? 718  LEU   A HD21 1 1 
ATOM   331  H  HD22 . LEU   A 1 25  ? -1.758  24.604  -5.649  0   39.61 ? 718  LEU   A HD22 1 1 
ATOM   332  H  HD23 . LEU   A 1 25  ? -1.939  24.949  -3.905  0   40.21 ? 718  LEU   A HD23 1 1 
ATOM   333  N  N    . GLY   A 1 26  ? -6.076  21.916  -5.411  1   32.63 ? 719  GLY   A N    1 1 
ATOM   334  C  CA   . GLY   A 1 26  ? -7.159  21.806  -6.369  1   32.92 ? 719  GLY   A CA   1 1 
ATOM   335  C  C    . GLY   A 1 26  ? -7.759  20.423  -6.416  1   32.9  ? 719  GLY   A C    1 1 
ATOM   336  O  O    . GLY   A 1 26  ? -7.183  19.456  -5.913  1   33.29 ? 719  GLY   A O    1 1 
ATOM   337  H  H    . GLY   A 1 26  ? -5.856  21.037  -4.953  0   36.15 ? 719  GLY   A H    1 1 
ATOM   338  H  HA2  . GLY   A 1 26  ? -7.945  22.513  -6.11   0   36.84 ? 719  GLY   A HA2  1 1 
ATOM   339  H  HA3  . GLY   A 1 26  ? -6.788  22.052  -7.363  0   36.12 ? 719  GLY   A HA3  1 1 
ATOM   340  N  N    . SER   A 1 27  ? -8.911  20.328  -7.051  1   32.74 ? 720  SER   A N    1 1 
ATOM   341  C  CA   . SER   A 1 27  ? -9.662  19.092  -7.201  1   33.25 ? 720  SER   A CA   1 1 
ATOM   342  C  C    . SER   A 1 27  ? -10.183 18.973  -8.63   1   32.94 ? 720  SER   A C    1 1 
ATOM   343  O  O    . SER   A 1 27  ? -10.28  19.972  -9.339  1   33.51 ? 720  SER   A O    1 1 
ATOM   344  C  CB   . SER   A 1 27  ? -10.847 19.096  -6.232  1   35.17 ? 720  SER   A CB   1 1 
ATOM   345  O  OG   . SER   A 1 27  ? -10.473 18.673  -4.934  1   38.92 ? 720  SER   A OG   1 1 
ATOM   346  H  H    . SER   A 1 27  ? -9.374  21.118  -7.49   0   36.61 ? 720  SER   A H    1 1 
ATOM   347  H  HA   . SER   A 1 27  ? -9.029  18.223  -7.022  0   36.96 ? 720  SER   A HA   1 1 
ATOM   348  H  HB2  . SER   A 1 27  ? -11.242 20.109  -6.169  0   40.06 ? 720  SER   A HB2  1 1 
ATOM   349  H  HB3  . SER   A 1 27  ? -11.615 18.424  -6.61   0   40.03 ? 720  SER   A HB3  1 1 
ATOM   350  H  HG   . SER   A 1 27  ? -10.097 17.754  -4.967  0   43.65 ? 720  SER   A HG   1 1 
ATOM   351  N  N    . GLY   A 1 28  ? -10.515 17.755  -9.037  1   32.05 ? 721  GLY   A N    1 1 
ATOM   352  C  CA   . GLY   A 1 28  ? -11.047 17.503  -10.372 1   32.18 ? 721  GLY   A CA   1 1 
ATOM   353  C  C    . GLY   A 1 28  ? -11.216 16.025  -10.626 1   32.24 ? 721  GLY   A C    1 1 
ATOM   354  O  O    . GLY   A 1 28  ? -11.291 15.238  -9.676  1   32.56 ? 721  GLY   A O    1 1 
ATOM   355  H  H    . GLY   A 1 28  ? -10.429 16.92   -8.466  0   35.91 ? 721  GLY   A H    1 1 
ATOM   356  H  HA2  . GLY   A 1 28  ? -12.015 17.99   -10.477 0   36.22 ? 721  GLY   A HA2  1 1 
ATOM   357  H  HA3  . GLY   A 1 28  ? -10.368 17.91   -11.12  0   35.37 ? 721  GLY   A HA3  1 1 
ATOM   358  N  N    . ALA   A 1 29  ? -11.237 15.618  -11.907 1   31.65 ? 722  ALA   A N    1 1 
ATOM   359  C  CA   . ALA   A 1 29  ? -11.35  14.198  -12.256 1   31.23 ? 722  ALA   A CA   1 1 
ATOM   360  C  C    . ALA   A 1 29  ? -10.21  13.36   -11.656 1   30.63 ? 722  ALA   A C    1 1 
ATOM   361  O  O    . ALA   A 1 29  ? -10.375 12.159  -11.458 1   31.79 ? 722  ALA   A O    1 1 
ATOM   362  C  CB   . ALA   A 1 29  ? -11.368 14.033  -13.771 1   31.42 ? 722  ALA   A CB   1 1 
ATOM   363  H  H    . ALA   A 1 29  ? -11.179 16.238  -12.708 0   34.84 ? 722  ALA   A H    1 1 
ATOM   364  H  HA   . ALA   A 1 29  ? -12.29  13.813  -11.864 0   35.29 ? 722  ALA   A HA   1 1 
ATOM   365  H  HB1  . ALA   A 1 29  ? -11.454 12.974  -14.011 0   34.71 ? 722  ALA   A HB1  1 1 
ATOM   366  H  HB2  . ALA   A 1 29  ? -12.22  14.577  -14.177 0   34.86 ? 722  ALA   A HB2  1 1 
ATOM   367  H  HB3  . ALA   A 1 29  ? -10.442 14.433  -14.181 0   34.09 ? 722  ALA   A HB3  1 1 
ATOM   368  N  N    . PHE   A 1 30  ? -9.049  13.984  -11.397 1   28.73 ? 723  PHE   A N    1 1 
ATOM   369  C  CA   . PHE   A 1 30  ? -7.884  13.333  -10.792 1   27.48 ? 723  PHE   A CA   1 1 
ATOM   370  C  C    . PHE   A 1 30  ? -8.027  13.072  -9.266  1   28.21 ? 723  PHE   A C    1 1 
ATOM   371  O  O    . PHE   A 1 30  ? -7.179  12.397  -8.701  1   29.15 ? 723  PHE   A O    1 1 
ATOM   372  C  CB   . PHE   A 1 30  ? -6.616  14.187  -11.064 1   26.05 ? 723  PHE   A CB   1 1 
ATOM   373  C  CG   . PHE   A 1 30  ? -6.697  15.619  -10.577 1   24.95 ? 723  PHE   A CG   1 1 
ATOM   374  C  CD1  . PHE   A 1 30  ? -6.407  15.941  -9.26   1   24.91 ? 723  PHE   A CD1  1 1 
ATOM   375  C  CD2  . PHE   A 1 30  ? -7.105  16.636  -11.427 1   24.76 ? 723  PHE   A CD2  1 1 
ATOM   376  C  CE1  . PHE   A 1 30  ? -6.551  17.25   -8.801  1   25.43 ? 723  PHE   A CE1  1 1 
ATOM   377  C  CE2  . PHE   A 1 30  ? -7.229  17.945  -10.97  1   25.1  ? 723  PHE   A CE2  1 1 
ATOM   378  C  CZ   . PHE   A 1 30  ? -6.935  18.244  -9.662  1   25.03 ? 723  PHE   A CZ   1 1 
ATOM   379  H  H    . PHE   A 1 30  ? -8.884  14.952  -11.65  0   31.31 ? 723  PHE   A H    1 1 
ATOM   380  H  HA   . PHE   A 1 30  ? -7.731  12.369  -11.275 0   30    ? 723  PHE   A HA   1 1 
ATOM   381  H  HB2  . PHE   A 1 30  ? -5.767  13.719  -10.568 0   27.98 ? 723  PHE   A HB2  1 1 
ATOM   382  H  HB3  . PHE   A 1 30  ? -6.441  14.215  -12.138 0   27.77 ? 723  PHE   A HB3  1 1 
ATOM   383  H  HD1  . PHE   A 1 30  ? -6.111  15.165  -8.574  0   27.31 ? 723  PHE   A HD1  1 1 
ATOM   384  H  HD2  . PHE   A 1 30  ? -7.344  16.408  -12.453 0   26.58 ? 723  PHE   A HD2  1 1 
ATOM   385  H  HE1  . PHE   A 1 30  ? -6.309  17.49   -7.779  0   28.08 ? 723  PHE   A HE1  1 1 
ATOM   386  H  HE2  . PHE   A 1 30  ? -7.535  18.726  -11.645 0   27.2  ? 723  PHE   A HE2  1 1 
ATOM   387  H  HZ   . PHE   A 1 30  ? -7.017  19.258  -9.311  0   27.53 ? 723  PHE   A HZ   1 1 
ATOM   388  N  N    . GLY   A 1 31  ? -9.047  13.633  -8.629  1   27.58 ? 724  GLY   A N    1 1 
ATOM   389  C  CA   . GLY   A 1 31  ? -9.26   13.514  -7.192  1   27.89 ? 724  GLY   A CA   1 1 
ATOM   390  C  C    . GLY   A 1 31  ? -8.952  14.849  -6.557  1   27.44 ? 724  GLY   A C    1 1 
ATOM   391  O  O    . GLY   A 1 31  ? -9.415  15.873  -7.055  1   27.21 ? 724  GLY   A O    1 1 
ATOM   392  H  H    . GLY   A 1 31  ? -9.768  14.195  -9.071  0   31.14 ? 724  GLY   A H    1 1 
ATOM   393  H  HA2  . GLY   A 1 31  ? -10.301 13.264  -6.995  0   32.32 ? 724  GLY   A HA2  1 1 
ATOM   394  H  HA3  . GLY   A 1 31  ? -8.63   12.742  -6.753  0   31.77 ? 724  GLY   A HA3  1 1 
ATOM   395  N  N    . THR   A 1 32  ? -8.176  14.851  -5.458  1   27.17 ? 725  THR   A N    1 1 
ATOM   396  C  CA   . THR   A 1 32  ? -7.781  16.064  -4.75   1   27.26 ? 725  THR   A CA   1 1 
ATOM   397  C  C    . THR   A 1 32  ? -6.284  16.056  -4.579  1   26.28 ? 725  THR   A C    1 1 
ATOM   398  O  O    . THR   A 1 32  ? -5.702  15.03   -4.245  1   26.7  ? 725  THR   A O    1 1 
ATOM   399  C  CB   . THR   A 1 32  ? -8.446  16.137  -3.347  1   29.61 ? 725  THR   A CB   1 1 
ATOM   400  O  OG1  . THR   A 1 32  ? -9.842  15.914  -3.494  1   31.8  ? 725  THR   A OG1  1 1 
ATOM   401  C  CG2  . THR   A 1 32  ? -8.219  17.479  -2.664  1   29.22 ? 725  THR   A CG2  1 1 
ATOM   402  H  H    . THR   A 1 32  ? -7.806  14.009  -5.028  0   31.13 ? 725  THR   A H    1 1 
ATOM   403  H  HA   . THR   A 1 32  ? -8.067  16.952  -5.312  0   31.1  ? 725  THR   A HA   1 1 
ATOM   404  H  HB   . THR   A 1 32  ? -8.029  15.36   -2.708  0   34.24 ? 725  THR   A HB   1 1 
ATOM   405  H  HG1  . THR   A 1 32  ? -10.266 15.835  -2.6    0   37.29 ? 725  THR   A HG1  1 1 
ATOM   406  H  HG21 . THR   A 1 32  ? -8.799  17.525  -1.744  0   34.38 ? 725  THR   A HG21 1 1 
ATOM   407  H  HG22 . THR   A 1 32  ? -7.167  17.61   -2.414  0   33.6  ? 725  THR   A HG22 1 1 
ATOM   408  H  HG23 . THR   A 1 32  ? -8.532  18.291  -3.319  0   33.86 ? 725  THR   A HG23 1 1 
ATOM   409  N  N    . VAL   A 1 33  ? -5.657  17.204  -4.798  1   25.43 ? 726  VAL   A N    1 1 
ATOM   410  C  CA   . VAL   A 1 33  ? -4.222  17.371  -4.617  1   25.59 ? 726  VAL   A CA   1 1 
ATOM   411  C  C    . VAL   A 1 33  ? -4.036  18.498  -3.609  1   26.84 ? 726  VAL   A C    1 1 
ATOM   412  O  O    . VAL   A 1 33  ? -4.715  19.522  -3.697  1   27.52 ? 726  VAL   A O    1 1 
ATOM   413  C  CB   . VAL   A 1 33  ? -3.507  17.66   -5.967  1   25.84 ? 726  VAL   A CB   1 1 
ATOM   414  C  CG1  . VAL   A 1 33  ? -2.051  18.092  -5.754  1   26.01 ? 726  VAL   A CG1  1 1 
ATOM   415  C  CG2  . VAL   A 1 33  ? -3.572  16.431  -6.878  1   26.03 ? 726  VAL   A CG2  1 1 
ATOM   416  H  H    . VAL   A 1 33  ? -6.114  18.058  -5.103  0   28.75 ? 726  VAL   A H    1 1 
ATOM   417  H  HA   . VAL   A 1 33  ? -3.783  16.468  -4.196  0   28.62 ? 726  VAL   A HA   1 1 
ATOM   418  H  HB   . VAL   A 1 33  ? -4.023  18.476  -6.47   0   28.34 ? 726  VAL   A HB   1 1 
ATOM   419  H  HG11 . VAL   A 1 33  ? -1.536  18.084  -6.713  0   28.08 ? 726  VAL   A HG11 1 1 
ATOM   420  H  HG12 . VAL   A 1 33  ? -2.02   19.1    -5.344  0   28.6  ? 726  VAL   A HG12 1 1 
ATOM   421  H  HG13 . VAL   A 1 33  ? -1.571  17.392  -5.071  0   28.43 ? 726  VAL   A HG13 1 1 
ATOM   422  H  HG21 . VAL   A 1 33  ? -3.029  16.64   -7.799  0   27.95 ? 726  VAL   A HG21 1 1 
ATOM   423  H  HG22 . VAL   A 1 33  ? -3.116  15.588  -6.362  0   28.34 ? 726  VAL   A HG22 1 1 
ATOM   424  H  HG23 . VAL   A 1 33  ? -4.612  16.207  -7.11   0   28.43 ? 726  VAL   A HG23 1 1 
ATOM   425  N  N    . TYR   A 1 34  ? -3.154  18.285  -2.637  1   26.61 ? 727  TYR   A N    1 1 
ATOM   426  C  CA   . TYR   A 1 34  ? -2.783  19.269  -1.626  1   27.19 ? 727  TYR   A CA   1 1 
ATOM   427  C  C    . TYR   A 1 34  ? -1.283  19.556  -1.763  1   27.6  ? 727  TYR   A C    1 1 
ATOM   428  O  O    . TYR   A 1 34  ? -0.546  18.775  -2.356  1   27.42 ? 727  TYR   A O    1 1 
ATOM   429  C  CB   . TYR   A 1 34  ? -2.977  18.702  -0.189  1   27.36 ? 727  TYR   A CB   1 1 
ATOM   430  C  CG   . TYR   A 1 34  ? -4.3    18.03   0.095   1   29.01 ? 727  TYR   A CG   1 1 
ATOM   431  C  CD1  . TYR   A 1 34  ? -5.297  18.688  0.803   1   30.67 ? 727  TYR   A CD1  1 1 
ATOM   432  C  CD2  . TYR   A 1 34  ? -4.509  16.697  -0.231  1   29.97 ? 727  TYR   A CD2  1 1 
ATOM   433  C  CE1  . TYR   A 1 34  ? -6.514  18.076  1.074   1   32.03 ? 727  TYR   A CE1  1 1 
ATOM   434  C  CE2  . TYR   A 1 34  ? -5.736  16.088  -0.002  1   31.65 ? 727  TYR   A CE2  1 1 
ATOM   435  C  CZ   . TYR   A 1 34  ? -6.724  16.77   0.687   1   33.39 ? 727  TYR   A CZ   1 1 
ATOM   436  O  OH   . TYR   A 1 34  ? -7.926  16.177  0.974   1   35.48 ? 727  TYR   A OH   1 1 
ATOM   437  H  H    . TYR   A 1 34  ? -2.658  17.408  -2.512  0   29.98 ? 727  TYR   A H    1 1 
ATOM   438  H  HA   . TYR   A 1 34  ? -3.336  20.201  -1.729  0   31.06 ? 727  TYR   A HA   1 1 
ATOM   439  H  HB2  . TYR   A 1 34  ? -2.182  17.993  0.029   0   31.49 ? 727  TYR   A HB2  1 1 
ATOM   440  H  HB3  . TYR   A 1 34  ? -2.899  19.544  0.498   0   31.85 ? 727  TYR   A HB3  1 1 
ATOM   441  H  HD1  . TYR   A 1 34  ? -5.148  19.711  1.104   0   35.82 ? 727  TYR   A HD1  1 1 
ATOM   442  H  HD2  . TYR   A 1 34  ? -3.755  16.168  -0.789  0   34.09 ? 727  TYR   A HD2  1 1 
ATOM   443  H  HE1  . TYR   A 1 34  ? -7.282  18.606  1.61    0   37.84 ? 727  TYR   A HE1  1 1 
ATOM   444  H  HE2  . TYR   A 1 34  ? -5.894  15.07   -0.29   0   36.42 ? 727  TYR   A HE2  1 1 
ATOM   445  H  HH   . TYR   A 1 34  ? -7.895  15.202  0.788   0   41.25 ? 727  TYR   A HH   1 1 
ATOM   446  N  N    . LYS   A 1 35  ? -0.829  20.64   -1.164  1   28.02 ? 728  LYS   A N    1 1 
ATOM   447  C  CA   . LYS   A 1 35  ? 0.597   20.928  -1.039  1   29.41 ? 728  LYS   A CA   1 1 
ATOM   448  C  C    . LYS   A 1 35  ? 0.907   20.758  0.451   1   31.6  ? 728  LYS   A C    1 1 
ATOM   449  O  O    . LYS   A 1 35  ? 0.014   20.881  1.295   1   32.21 ? 728  LYS   A O    1 1 
ATOM   450  C  CB   . LYS   A 1 35  ? 0.978   22.338  -1.527  1   30.98 ? 728  LYS   A CB   1 1 
ATOM   451  C  CG   . LYS   A 1 35  ? 0.368   23.493  -0.758  1   35.44 ? 728  LYS   A CG   1 1 
ATOM   452  C  CD   . LYS   A 1 35  ? 0.945   24.825  -1.204  1   41.04 ? 728  LYS   A CD   1 1 
ATOM   453  C  CE   . LYS   A 1 35  ? 0.263   25.99   -0.517  1   45.88 ? 728  LYS   A CE   1 1 
ATOM   454  N  NZ   . LYS   A 1 35  ? 0.723   26.197  0.891   1   50.19 ? 728  LYS   A NZ   1 1 
ATOM   455  H  H    . LYS   A 1 35  ? -1.435  21.329  -0.732  0   32.1  ? 728  LYS   A H    1 1 
ATOM   456  H  HA   . LYS   A 1 35  ? 1.202   20.212  -1.593  0   32.94 ? 728  LYS   A HA   1 1 
ATOM   457  H  HB2  . LYS   A 1 35  ? 2.06    22.443  -1.464  0   34.86 ? 728  LYS   A HB2  1 1 
ATOM   458  H  HB3  . LYS   A 1 35  ? 0.663   22.439  -2.564  0   34.55 ? 728  LYS   A HB3  1 1 
ATOM   459  H  HG2  . LYS   A 1 35  ? -0.707  23.506  -0.932  0   39.81 ? 728  LYS   A HG2  1 1 
ATOM   460  H  HG3  . LYS   A 1 35  ? 0.577   23.398  0.306   0   40.09 ? 728  LYS   A HG3  1 1 
ATOM   461  H  HD2  . LYS   A 1 35  ? 2.006   24.858  -0.96   0   45.55 ? 728  LYS   A HD2  1 1 
ATOM   462  H  HD3  . LYS   A 1 35  ? 0.804   24.935  -2.278  0   45.17 ? 728  LYS   A HD3  1 1 
ATOM   463  H  HE2  . LYS   A 1 35  ? 0.479   26.9    -1.076  0   50.91 ? 728  LYS   A HE2  1 1 
ATOM   464  H  HE3  . LYS   A 1 35  ? -0.812  25.816  -0.497  0   50.83 ? 728  LYS   A HE3  1 1 
ATOM   465  H  HZ1  . LYS   A 1 35  ? 0.021   26.72   1.403   0   55.95 ? 728  LYS   A HZ1  1 1 
ATOM   466  H  HZ2  . LYS   A 1 35  ? 0.885   25.316  1.367   0   55.53 ? 728  LYS   A HZ2  1 1 
ATOM   467  H  HZ3  . LYS   A 1 35  ? 1.585   26.734  0.892   0   55.85 ? 728  LYS   A HZ3  1 1 
ATOM   468  N  N    . GLY   A 1 36  ? 2.156   20.486  0.762   1   32.83 ? 729  GLY   A N    1 1 
ATOM   469  C  CA   . GLY   A 1 36  ? 2.582   20.314  2.142   1   35.02 ? 729  GLY   A CA   1 1 
ATOM   470  C  C    . GLY   A 1 36  ? 4.081   20.423  2.3     1   37.07 ? 729  GLY   A C    1 1 
ATOM   471  O  O    . GLY   A 1 36  ? 4.802   20.736  1.343   1   36.47 ? 729  GLY   A O    1 1 
ATOM   472  H  H    . GLY   A 1 36  ? 2.905   20.378  0.085   0   36.97 ? 729  GLY   A H    1 1 
ATOM   473  H  HA2  . GLY   A 1 36  ? 2.127   21.079  2.77    0   40.14 ? 729  GLY   A HA2  1 1 
ATOM   474  H  HA3  . GLY   A 1 36  ? 2.266   19.337  2.503   0   39.86 ? 729  GLY   A HA3  1 1 
ATOM   475  N  N    . LEU   A 1 37  ? 4.549   20.197  3.53    1   38.85 ? 730  LEU   A N    1 1 
ATOM   476  C  CA   . LEU   A 1 37  ? 5.964   20.236  3.849   1   41.22 ? 730  LEU   A CA   1 1 
ATOM   477  C  C    . LEU   A 1 37  ? 6.291   18.933  4.517   1   43.02 ? 730  LEU   A C    1 1 
ATOM   478  O  O    . LEU   A 1 37  ? 5.746   18.652  5.582   1   43.19 ? 730  LEU   A O    1 1 
ATOM   479  C  CB   . LEU   A 1 37  ? 6.281   21.396  4.806   1   42.02 ? 730  LEU   A CB   1 1 
ATOM   480  C  CG   . LEU   A 1 37  ? 6.184   22.799  4.219   1   44.37 ? 730  LEU   A CG   1 1 
ATOM   481  C  CD1  . LEU   A 1 37  ? 6.175   23.851  5.328   1   44.97 ? 730  LEU   A CD1  1 1 
ATOM   482  C  CD2  . LEU   A 1 37  ? 7.33    23.079  3.231   1   45.4  ? 730  LEU   A CD2  1 1 
ATOM   483  H  H    . LEU   A 1 37  ? 3.96    19.983  4.328   0   44.49 ? 730  LEU   A H    1 1 
ATOM   484  H  HA   . LEU   A 1 37  ? 6.57    20.322  2.949   0   46.73 ? 730  LEU   A HA   1 1 
ATOM   485  H  HB2  . LEU   A 1 37  ? 5.587   21.34   5.643   0   48.53 ? 730  LEU   A HB2  1 1 
ATOM   486  H  HB3  . LEU   A 1 37  ? 7.298   21.266  5.175   0   48.63 ? 730  LEU   A HB3  1 1 
ATOM   487  H  HG   . LEU   A 1 37  ? 5.247   22.887  3.672   0   50.35 ? 730  LEU   A HG   1 1 
ATOM   488  H  HD11 . LEU   A 1 37  ? 6.106   24.84   4.878   0   51.97 ? 730  LEU   A HD11 1 1 
ATOM   489  H  HD12 . LEU   A 1 37  ? 5.314   23.68   5.972   0   51.99 ? 730  LEU   A HD12 1 1 
ATOM   490  H  HD13 . LEU   A 1 37  ? 7.094   23.767  5.906   0   52.29 ? 730  LEU   A HD13 1 1 
ATOM   491  H  HD21 . LEU   A 1 37  ? 7.328   24.139  2.982   0   51.69 ? 730  LEU   A HD21 1 1 
ATOM   492  H  HD22 . LEU   A 1 37  ? 8.279   22.811  3.695   0   52    ? 730  LEU   A HD22 1 1 
ATOM   493  H  HD23 . LEU   A 1 37  ? 7.181   22.497  2.323   0   51.19 ? 730  LEU   A HD23 1 1 
ATOM   494  N  N    . TRP   A 1 38  ? 7.135   18.115  3.881   1   43.95 ? 731  TRP   A N    1 1 
ATOM   495  C  CA   . TRP   A 1 38  ? 7.542   16.829  4.427   1   45.62 ? 731  TRP   A CA   1 1 
ATOM   496  C  C    . TRP   A 1 38  ? 8.887   17.002  5.143   1   47.95 ? 731  TRP   A C    1 1 
ATOM   497  O  O    . TRP   A 1 38  ? 9.851   17.463  4.545   1   47.97 ? 731  TRP   A O    1 1 
ATOM   498  C  CB   . TRP   A 1 38  ? 7.631   15.775  3.306   1   45.26 ? 731  TRP   A CB   1 1 
ATOM   499  C  CG   . TRP   A 1 38  ? 8.261   14.481  3.723   1   45.54 ? 731  TRP   A CG   1 1 
ATOM   500  C  CD1  . TRP   A 1 38  ? 7.981   13.747  4.838   1   46.36 ? 731  TRP   A CD1  1 1 
ATOM   501  C  CD2  . TRP   A 1 38  ? 9.267   13.759  3.007   1   45.79 ? 731  TRP   A CD2  1 1 
ATOM   502  N  NE1  . TRP   A 1 38  ? 8.767   12.62   4.87    1   46.69 ? 731  TRP   A NE1  1 1 
ATOM   503  C  CE2  . TRP   A 1 38  ? 9.563   12.602  3.751   1   46.6  ? 731  TRP   A CE2  1 1 
ATOM   504  C  CE3  . TRP   A 1 38  ? 9.922   13.961  1.787   1   46.34 ? 731  TRP   A CE3  1 1 
ATOM   505  C  CZ2  . TRP   A 1 38  ? 10.513  11.671  3.33    1   47.29 ? 731  TRP   A CZ2  1 1 
ATOM   506  C  CZ3  . TRP   A 1 38  ? 10.856  13.033  1.37    1   47.11 ? 731  TRP   A CZ3  1 1 
ATOM   507  C  CH2  . TRP   A 1 38  ? 11.129  11.896  2.127   1   47.19 ? 731  TRP   A CH2  1 1 
ATOM   508  H  H    . TRP   A 1 38  ? 7.558   18.321  2.982   0   49.43 ? 731  TRP   A H    1 1 
ATOM   509  H  HA   . TRP   A 1 38  ? 6.803   16.47   5.142   0   51.65 ? 731  TRP   A HA   1 1 
ATOM   510  H  HB2  . TRP   A 1 38  ? 6.623   15.552  2.958   0   50.43 ? 731  TRP   A HB2  1 1 
ATOM   511  H  HB3  . TRP   A 1 38  ? 8.217   16.184  2.485   0   50.58 ? 731  TRP   A HB3  1 1 
ATOM   512  H  HD1  . TRP   A 1 38  ? 7.271   14.024  5.597   0   52.64 ? 731  TRP   A HD1  1 1 
ATOM   513  H  HE1  . TRP   A 1 38  ? 8.76    11.899  5.62    0   53.37 ? 731  TRP   A HE1  1 1 
ATOM   514  H  HE3  . TRP   A 1 38  ? 9.722   14.839  1.196   0   51.55 ? 731  TRP   A HE3  1 1 
ATOM   515  H  HZ2  . TRP   A 1 38  ? 10.716  10.783  3.904   0   53.93 ? 731  TRP   A HZ2  1 1 
ATOM   516  H  HZ3  . TRP   A 1 38  ? 11.388  13.195  0.448   0   52.57 ? 731  TRP   A HZ3  1 1 
ATOM   517  H  HH2  . TRP   A 1 38  ? 11.876  11.202  1.78    0   53.36 ? 731  TRP   A HH2  1 1 
ATOM   518  N  N    . ILE   A 1 39  ? 8.925   16.676  6.435   1   49.99 ? 732  ILE   A N    1 1 
ATOM   519  C  CA   . ILE   A 1 39  ? 10.118  16.754  7.264   1   52.5  ? 732  ILE   A CA   1 1 
ATOM   520  C  C    . ILE   A 1 39  ? 10.474  15.288  7.564   1   54.53 ? 732  ILE   A C    1 1 
ATOM   521  O  O    . ILE   A 1 39  ? 9.859   14.713  8.463   1   54.68 ? 732  ILE   A O    1 1 
ATOM   522  C  CB   . ILE   A 1 39  ? 9.841   17.566  8.569   1   53.57 ? 732  ILE   A CB   1 1 
ATOM   523  C  CG1  . ILE   A 1 39  ? 9.217   18.973  8.259   1   54.44 ? 732  ILE   A CG1  1 1 
ATOM   524  C  CG2  . ILE   A 1 39  ? 11.135  17.702  9.396   1   54.56 ? 732  ILE   A CG2  1 1 
ATOM   525  C  CD1  . ILE   A 1 39  ? 7.653   19.096  8.442   1   55.48 ? 732  ILE   A CD1  1 1 
ATOM   526  H  H    . ILE   A 1 39  ? 8.12    16.342  6.954   0   56.95 ? 732  ILE   A H    1 1 
ATOM   527  H  HA   . ILE   A 1 39  ? 10.932  17.258  6.746   0   60.16 ? 732  ILE   A HA   1 1 
ATOM   528  H  HB   . ILE   A 1 39  ? 9.129   17.008  9.175   0   61.69 ? 732  ILE   A HB   1 1 
ATOM   529  H  HG12 . ILE   A 1 39  ? 9.644   19.715  8.933   0   62.84 ? 732  ILE   A HG12 1 1 
ATOM   530  H  HG13 . ILE   A 1 39  ? 9.446   19.254  7.232   0   62.04 ? 732  ILE   A HG13 1 1 
ATOM   531  H  HG21 . ILE   A 1 39  ? 10.937  18.329  10.264  0   63.75 ? 732  ILE   A HG21 1 1 
ATOM   532  H  HG22 . ILE   A 1 39  ? 11.463  16.72   9.734   0   63.54 ? 732  ILE   A HG22 1 1 
ATOM   533  H  HG23 . ILE   A 1 39  ? 11.904  18.158  8.776   0   63.43 ? 732  ILE   A HG23 1 1 
ATOM   534  H  HD11 . ILE   A 1 39  ? 7.345   20.109  8.186   0   63.11 ? 732  ILE   A HD11 1 1 
ATOM   535  H  HD12 . ILE   A 1 39  ? 7.162   18.381  7.784   0   62.73 ? 732  ILE   A HD12 1 1 
ATOM   536  H  HD13 . ILE   A 1 39  ? 7.4     18.882  9.479   0   63.52 ? 732  ILE   A HD13 1 1 
ATOM   537  N  N    . PRO   A 1 40  ? 11.368  14.626  6.79    1   55.98 ? 733  PRO   A N    1 1 
ATOM   538  C  CA   . PRO   A 1 40  ? 11.686  13.215  7.103   1   57.5  ? 733  PRO   A CA   1 1 
ATOM   539  C  C    . PRO   A 1 40  ? 12.266  13.06   8.509   1   59.46 ? 733  PRO   A C    1 1 
ATOM   540  O  O    . PRO   A 1 40  ? 13.004  13.939  8.949   1   59.56 ? 733  PRO   A O    1 1 
ATOM   541  C  CB   . PRO   A 1 40  ? 12.712  12.81   6.034   1   57.97 ? 733  PRO   A CB   1 1 
ATOM   542  C  CG   . PRO   A 1 40  ? 12.769  13.918  5.058   1   57.98 ? 733  PRO   A CG   1 1 
ATOM   543  C  CD   . PRO   A 1 40  ? 12.178  15.139  5.664   1   55.85 ? 733  PRO   A CD   1 1 
ATOM   544  H  HA   . PRO   A 1 40  ? 10.796  12.595  7.003   0   65.21 ? 733  PRO   A HA   1 1 
ATOM   545  H  HB2  . PRO   A 1 40  ? 13.685  12.667  6.501   0   66.41 ? 733  PRO   A HB2  1 1 
ATOM   546  H  HB3  . PRO   A 1 40  ? 12.385  11.892  5.547   0   65.64 ? 733  PRO   A HB3  1 1 
ATOM   547  H  HG2  . PRO   A 1 40  ? 13.809  14.101  4.791   0   65.78 ? 733  PRO   A HG2  1 1 
ATOM   548  H  HG3  . PRO   A 1 40  ? 12.203  13.636  4.171   0   64.98 ? 733  PRO   A HG3  1 1 
ATOM   549  H  HD2  . PRO   A 1 40  ? 12.964  15.797  6.032   0   63.83 ? 733  PRO   A HD2  1 1 
ATOM   550  H  HD3  . PRO   A 1 40  ? 11.551  15.638  4.927   0   62.94 ? 733  PRO   A HD3  1 1 
ATOM   551  N  N    . GLU   A 1 41  ? 11.897  11.991  9.234   1   60.96 ? 734  GLU   A N    1 1 
ATOM   552  C  CA   . GLU   A 1 41  ? 12.403  11.786  10.597  1   62.98 ? 734  GLU   A CA   1 1 
ATOM   553  C  C    . GLU   A 1 41  ? 13.914  11.601  10.584  1   63.93 ? 734  GLU   A C    1 1 
ATOM   554  O  O    . GLU   A 1 41  ? 14.445  10.935  9.694   1   64.06 ? 734  GLU   A O    1 1 
ATOM   555  C  CB   . GLU   A 1 41  ? 11.737  10.571  11.281  1   66.26 ? 734  GLU   A CB   1 1 
ATOM   556  C  CG   . GLU   A 1 41  ? 10.354  10.842  11.858  1   71.68 ? 734  GLU   A CG   1 1 
ATOM   557  C  CD   . GLU   A 1 41  ? 10.303  11.819  13.017  1   78.79 ? 734  GLU   A CD   1 1 
ATOM   558  O  OE1  . GLU   A 1 41  ? 11.24   11.812  13.848  1   80.28 ? 734  GLU   A OE1  1 1 
ATOM   559  O  OE2  . GLU   A 1 41  ? 9.319   12.591  13.096  1   80.85 ? 734  GLU   A OE2  1 1 
ATOM   560  H  H    . GLU   A 1 41  ? 11.26   11.273  8.907   0   69.63 ? 734  GLU   A H    1 1 
ATOM   561  H  HA   . GLU   A 1 41  ? 12.188  12.684  11.174  0   72.79 ? 734  GLU   A HA   1 1 
ATOM   562  H  HB2  . GLU   A 1 41  ? 11.64   9.762   10.558  0   75.89 ? 734  GLU   A HB2  1 1 
ATOM   563  H  HB3  . GLU   A 1 41  ? 12.381  10.239  12.094  0   76.74 ? 734  GLU   A HB3  1 1 
ATOM   564  H  HG2  . GLU   A 1 41  ? 9.721   11.24   11.068  0   80.87 ? 734  GLU   A HG2  1 1 
ATOM   565  H  HG3  . GLU   A 1 41  ? 9.94    9.899   12.211  0   81.56 ? 734  GLU   A HG3  1 1 
ATOM   566  N  N    . GLY   A 1 42  ? 14.587  12.205  11.558  1   64.35 ? 735  GLY   A N    1 1 
ATOM   567  C  CA   . GLY   A 1 42  ? 16.042  12.159  11.65   1   65.25 ? 735  GLY   A CA   1 1 
ATOM   568  C  C    . GLY   A 1 42  ? 16.742  13.044  10.631  1   65.85 ? 735  GLY   A C    1 1 
ATOM   569  O  O    . GLY   A 1 42  ? 17.908  12.809  10.301  1   66.09 ? 735  GLY   A O    1 1 
ATOM   570  H  H    . GLY   A 1 42  ? 14.157  12.737  12.308  0   75.37 ? 735  GLY   A H    1 1 
ATOM   571  H  HA2  . GLY   A 1 42  ? 16.346  12.484  12.643  0   77.37 ? 735  GLY   A HA2  1 1 
ATOM   572  H  HA3  . GLY   A 1 42  ? 16.385  11.135  11.51   0   76.96 ? 735  GLY   A HA3  1 1 
ATOM   573  N  N    . GLU   A 1 43  ? 16.028  14.059  10.106  1   65.78 ? 736  GLU   A N    1 1 
ATOM   574  C  CA   . GLU   A 1 43  ? 16.531  15.014  9.121   1   66.07 ? 736  GLU   A CA   1 1 
ATOM   575  C  C    . GLU   A 1 43  ? 16.035  16.418  9.508   1   65.47 ? 736  GLU   A C    1 1 
ATOM   576  O  O    . GLU   A 1 43  ? 15.066  16.553  10.26   1   65.65 ? 736  GLU   A O    1 1 
ATOM   577  C  CB   . GLU   A 1 43  ? 16.036  14.651  7.705   1   69.29 ? 736  GLU   A CB   1 1 
ATOM   578  C  CG   . GLU   A 1 43  ? 16.59   13.351  7.14    1   75.89 ? 736  GLU   A CG   1 1 
ATOM   579  C  CD   . GLU   A 1 43  ? 18.073  13.363  6.817   1   84.11 ? 736  GLU   A CD   1 1 
ATOM   580  O  OE1  . GLU   A 1 43  ? 18.772  12.398  7.203   1   85.5  ? 736  GLU   A OE1  1 1 
ATOM   581  O  OE2  . GLU   A 1 43  ? 18.537  14.338  6.183   1   86.85 ? 736  GLU   A OE2  1 1 
ATOM   582  H  H    . GLU   A 1 43  ? 15.069  14.271  10.362  0   76.31 ? 736  GLU   A H    1 1 
ATOM   583  H  HA   . GLU   A 1 43  ? 17.62   15.032  9.122   0   77.31 ? 736  GLU   A HA   1 1 
ATOM   584  H  HB2  . GLU   A 1 43  ? 14.953  14.55   7.738   0   78.69 ? 736  GLU   A HB2  1 1 
ATOM   585  H  HB3  . GLU   A 1 43  ? 16.305  15.458  7.024   0   79.06 ? 736  GLU   A HB3  1 1 
ATOM   586  H  HG2  . GLU   A 1 43  ? 16.419  12.551  7.859   0   86.01 ? 736  GLU   A HG2  1 1 
ATOM   587  H  HG3  . GLU   A 1 43  ? 16.059  13.126  6.216   0   85.2  ? 736  GLU   A HG3  1 1 
ATOM   588  N  N    . LYS   A 1 44  ? 16.699  17.458  8.988   1   64.79 ? 737  LYS   A N    1 1 
ATOM   589  C  CA   . LYS   A 1 44  ? 16.357  18.858  9.278   1   64.74 ? 737  LYS   A CA   1 1 
ATOM   590  C  C    . LYS   A 1 44  ? 15.71   19.596  8.087   1   63.45 ? 737  LYS   A C    1 1 
ATOM   591  O  O    . LYS   A 1 44  ? 15.184  20.694  8.277   1   63.93 ? 737  LYS   A O    1 1 
ATOM   592  C  CB   . LYS   A 1 44  ? 17.623  19.622  9.743   1   67.73 ? 737  LYS   A CB   1 1 
ATOM   593  C  CG   . LYS   A 1 44  ? 18.592  20.042  8.617   1   72.71 ? 737  LYS   A CG   1 1 
ATOM   594  C  CD   . LYS   A 1 44  ? 20.034  20.247  9.11    1   77.67 ? 737  LYS   A CD   1 1 
ATOM   595  C  CE   . LYS   A 1 44  ? 20.889  19.002  9.008   1   81.68 ? 737  LYS   A CE   1 1 
ATOM   596  N  NZ   . LYS   A 1 44  ? 22.278  19.226  9.5     1   83.97 ? 737  LYS   A NZ   1 1 
ATOM   597  H  H    . LYS   A 1 44  ? 17.477  17.347  8.345   0   75.83 ? 737  LYS   A H    1 1 
ATOM   598  H  HA   . LYS   A 1 44  ? 15.649  18.904  10.104  0   75.71 ? 737  LYS   A HA   1 1 
ATOM   599  H  HB2  . LYS   A 1 44  ? 17.305  20.529  10.255  0   79.89 ? 737  LYS   A HB2  1 1 
ATOM   600  H  HB3  . LYS   A 1 44  ? 18.172  18.987  10.437  0   80.19 ? 737  LYS   A HB3  1 1 
ATOM   601  H  HG2  . LYS   A 1 44  ? 18.6    19.271  7.848   0   84.39 ? 737  LYS   A HG2  1 1 
ATOM   602  H  HG3  . LYS   A 1 44  ? 18.253  20.986  8.193   0   84.6  ? 737  LYS   A HG3  1 1 
ATOM   603  H  HD2  . LYS   A 1 44  ? 20.503  21.022  8.505   0   91.1  ? 737  LYS   A HD2  1 1 
ATOM   604  H  HD3  . LYS   A 1 44  ? 20.011  20.555  10.154  0   91.36 ? 737  LYS   A HD3  1 1 
ATOM   605  H  HE2  . LYS   A 1 44  ? 20.442  18.214  9.612   0   95.04 ? 737  LYS   A HE2  1 1 
ATOM   606  H  HE3  . LYS   A 1 44  ? 20.943  18.689  7.967   0   94.74 ? 737  LYS   A HE3  1 1 
ATOM   607  H  HZ1  . LYS   A 1 44  ? 22.893  18.502  9.142   0   98.8  ? 737  LYS   A HZ1  1 1 
ATOM   608  H  HZ2  . LYS   A 1 44  ? 22.62   20.132  9.195   0   98.95 ? 737  LYS   A HZ2  1 1 
ATOM   609  H  HZ3  . LYS   A 1 44  ? 22.294  19.195  10.514  0   99.08 ? 737  LYS   A HZ3  1 1 
ATOM   610  N  N    . VAL   A 1 45  ? 15.75   19.016  6.873   1   61.53 ? 738  VAL   A N    1 1 
ATOM   611  C  CA   . VAL   A 1 45  ? 15.256  19.683  5.664   1   59.92 ? 738  VAL   A CA   1 1 
ATOM   612  C  C    . VAL   A 1 45  ? 13.726  19.566  5.521   1   57.12 ? 738  VAL   A C    1 1 
ATOM   613  O  O    . VAL   A 1 45  ? 13.186  18.467  5.636   1   57.56 ? 738  VAL   A O    1 1 
ATOM   614  C  CB   . VAL   A 1 45  ? 15.993  19.131  4.405   1   61.18 ? 738  VAL   A CB   1 1 
ATOM   615  C  CG1  . VAL   A 1 45  ? 15.571  19.879  3.14    1   61.98 ? 738  VAL   A CG1  1 1 
ATOM   616  C  CG2  . VAL   A 1 45  ? 17.513  19.21   4.577   1   61.99 ? 738  VAL   A CG2  1 1 
ATOM   617  H  H    . VAL   A 1 45  ? 16.065  18.067  6.702   0   71.3  ? 738  VAL   A H    1 1 
ATOM   618  H  HA   . VAL   A 1 45  ? 15.505  20.741  5.725   0   69.4  ? 738  VAL   A HA   1 1 
ATOM   619  H  HB   . VAL   A 1 45  ? 15.729  18.083  4.275   0   69.86 ? 738  VAL   A HB   1 1 
ATOM   620  H  HG11 . VAL   A 1 45  ? 16.208  19.573  2.311   0   70.32 ? 738  VAL   A HG11 1 1 
ATOM   621  H  HG12 . VAL   A 1 45  ? 14.537  19.647  2.893   0   69.86 ? 738  VAL   A HG12 1 1 
ATOM   622  H  HG13 . VAL   A 1 45  ? 15.678  20.948  3.314   0   70.75 ? 738  VAL   A HG13 1 1 
ATOM   623  H  HG21 . VAL   A 1 45  ? 17.994  18.965  3.632   0   71.73 ? 738  VAL   A HG21 1 1 
ATOM   624  H  HG22 . VAL   A 1 45  ? 17.783  20.221  4.881   0   72.21 ? 738  VAL   A HG22 1 1 
ATOM   625  H  HG23 . VAL   A 1 45  ? 17.832  18.495  5.334   0   72.23 ? 738  VAL   A HG23 1 1 
ATOM   626  N  N    . LYS   A 1 46  ? 13.036  20.697  5.263   1   54.1  ? 739  LYS   A N    1 1 
ATOM   627  C  CA   . LYS   A 1 46  ? 11.591  20.724  5.018   1   51.8  ? 739  LYS   A CA   1 1 
ATOM   628  C  C    . LYS   A 1 46  ? 11.42   20.673  3.493   1   48.52 ? 739  LYS   A C    1 1 
ATOM   629  O  O    . LYS   A 1 46  ? 11.81   21.63   2.817   1   48.79 ? 739  LYS   A O    1 1 
ATOM   630  C  CB   . LYS   A 1 46  ? 10.963  22.023  5.541   1   54.2  ? 739  LYS   A CB   1 1 
ATOM   631  C  CG   . LYS   A 1 46  ? 10.993  22.173  7.057   1   59.42 ? 739  LYS   A CG   1 1 
ATOM   632  C  CD   . LYS   A 1 46  ? 10.252  23.432  7.528   1   64.81 ? 739  LYS   A CD   1 1 
ATOM   633  C  CE   . LYS   A 1 46  ? 11.114  24.676  7.522   1   69.4  ? 739  LYS   A CE   1 1 
ATOM   634  N  NZ   . LYS   A 1 46  ? 10.361  25.877  7.984   1   72.07 ? 739  LYS   A NZ   1 1 
ATOM   635  H  H    . LYS   A 1 46  ? 13.463  21.616  5.212   0   62.67 ? 739  LYS   A H    1 1 
ATOM   636  H  HA   . LYS   A 1 46  ? 11.087  19.877  5.48    0   59.32 ? 739  LYS   A HA   1 1 
ATOM   637  H  HB2  . LYS   A 1 46  ? 11.495  22.872  5.115   0   62.22 ? 739  LYS   A HB2  1 1 
ATOM   638  H  HB3  . LYS   A 1 46  ? 9.921   22.048  5.225   0   61.58 ? 739  LYS   A HB3  1 1 
ATOM   639  H  HG2  . LYS   A 1 46  ? 10.511  21.308  7.508   0   67.72 ? 739  LYS   A HG2  1 1 
ATOM   640  H  HG3  . LYS   A 1 46  ? 12.028  22.243  7.389   0   68.35 ? 739  LYS   A HG3  1 1 
ATOM   641  H  HD2  . LYS   A 1 46  ? 9.4     23.613  6.874   0   72.99 ? 739  LYS   A HD2  1 1 
ATOM   642  H  HD3  . LYS   A 1 46  ? 9.906   23.273  8.548   0   73.67 ? 739  LYS   A HD3  1 1 
ATOM   643  H  HE2  . LYS   A 1 46  ? 11.95   24.527  8.204   0   79.18 ? 739  LYS   A HE2  1 1 
ATOM   644  H  HE3  . LYS   A 1 46  ? 11.478  24.871  6.514   0   78.5  ? 739  LYS   A HE3  1 1 
ATOM   645  H  HZ1  . LYS   A 1 46  ? 10.876  26.72   7.755   0   81.82 ? 739  LYS   A HZ1  1 1 
ATOM   646  H  HZ2  . LYS   A 1 46  ? 9.449   25.911  7.54    0   81.14 ? 739  LYS   A HZ2  1 1 
ATOM   647  H  HZ3  . LYS   A 1 46  ? 10.233  25.835  8.991   0   82.04 ? 739  LYS   A HZ3  1 1 
ATOM   648  N  N    . ILE   A 1 47  ? 10.861  19.579  2.955   1   45.21 ? 740  ILE   A N    1 1 
ATOM   649  C  CA   . ILE   A 1 47  ? 10.7    19.403  1.501   1   42.86 ? 740  ILE   A CA   1 1 
ATOM   650  C  C    . ILE   A 1 47  ? 9.266   19.774  0.994   1   39.61 ? 740  ILE   A C    1 1 
ATOM   651  O  O    . ILE   A 1 47  ? 8.322   19.084  1.385   1   39.03 ? 740  ILE   A O    1 1 
ATOM   652  C  CB   . ILE   A 1 47  ? 11.055  17.939  1.129   1   43.38 ? 740  ILE   A CB   1 1 
ATOM   653  C  CG1  . ILE   A 1 47  ? 12.529  17.606  1.524   1   44.81 ? 740  ILE   A CG1  1 1 
ATOM   654  C  CG2  . ILE   A 1 47  ? 10.828  17.684  -0.384  1   43.35 ? 740  ILE   A CG2  1 1 
ATOM   655  C  CD1  . ILE   A 1 47  ? 12.787  16.163  1.863   1   46.96 ? 740  ILE   A CD1  1 1 
ATOM   656  H  H    . ILE   A 1 47  ? 10.5    18.802  3.499   0   51.66 ? 740  ILE   A H    1 1 
ATOM   657  H  HA   . ILE   A 1 47  ? 11.448  20.005  0.989   0   48.9  ? 740  ILE   A HA   1 1 
ATOM   658  H  HB   . ILE   A 1 47  ? 10.38   17.286  1.682   0   49.04 ? 740  ILE   A HB   1 1 
ATOM   659  H  HG12 . ILE   A 1 47  ? 13.182  17.866  0.692   0   51.15 ? 740  ILE   A HG12 1 1 
ATOM   660  H  HG13 . ILE   A 1 47  ? 12.823  18.179  2.402   0   51.59 ? 740  ILE   A HG13 1 1 
ATOM   661  H  HG21 . ILE   A 1 47  ? 11.287  16.737  -0.663  0   48.42 ? 740  ILE   A HG21 1 1 
ATOM   662  H  HG22 . ILE   A 1 47  ? 9.762   17.632  -0.597  0   48.12 ? 740  ILE   A HG22 1 1 
ATOM   663  H  HG23 . ILE   A 1 47  ? 11.284  18.494  -0.951  0   48.57 ? 740  ILE   A HG23 1 1 
ATOM   664  H  HD11 . ILE   A 1 47  ? 13.825  16.056  2.177   0   53.9  ? 740  ILE   A HD11 1 1 
ATOM   665  H  HD12 . ILE   A 1 47  ? 12.121  15.865  2.671   0   53.46 ? 740  ILE   A HD12 1 1 
ATOM   666  H  HD13 . ILE   A 1 47  ? 12.602  15.549  0.983   0   53.01 ? 740  ILE   A HD13 1 1 
ATOM   667  N  N    . PRO   A 1 48  ? 9.065   20.774  0.096   1   37.67 ? 741  PRO   A N    1 1 
ATOM   668  C  CA   . PRO   A 1 48  ? 7.698   21.022  -0.418  1   36.21 ? 741  PRO   A CA   1 1 
ATOM   669  C  C    . PRO   A 1 48  ? 7.215   19.826  -1.241  1   33.3  ? 741  PRO   A C    1 1 
ATOM   670  O  O    . PRO   A 1 48  ? 7.944   19.343  -2.115  1   32.9  ? 741  PRO   A O    1 1 
ATOM   671  C  CB   . PRO   A 1 48  ? 7.846   22.285  -1.281  1   37.27 ? 741  PRO   A CB   1 1 
ATOM   672  C  CG   . PRO   A 1 48  ? 9.159   22.87   -0.898  1   38.39 ? 741  PRO   A CG   1 1 
ATOM   673  C  CD   . PRO   A 1 48  ? 10.025  21.717  -0.506  1   37.02 ? 741  PRO   A CD   1 1 
ATOM   674  H  HA   . PRO   A 1 48  ? 7.007   21.22   0.4     0   41.04 ? 741  PRO   A HA   1 1 
ATOM   675  H  HB2  . PRO   A 1 48  ? 7.84    22.015  -2.336  0   41.58 ? 741  PRO   A HB2  1 1 
ATOM   676  H  HB3  . PRO   A 1 48  ? 7.036   22.978  -1.057  0   41.97 ? 741  PRO   A HB3  1 1 
ATOM   677  H  HG2  . PRO   A 1 48  ? 9.586   23.396  -1.751  0   43.63 ? 741  PRO   A HG2  1 1 
ATOM   678  H  HG3  . PRO   A 1 48  ? 9.025   23.55   -0.058  0   44.02 ? 741  PRO   A HG3  1 1 
ATOM   679  H  HD2  . PRO   A 1 48  ? 10.497  21.277  -1.383  0   42.22 ? 741  PRO   A HD2  1 1 
ATOM   680  H  HD3  . PRO   A 1 48  ? 10.76   22.066  0.217   0   42.94 ? 741  PRO   A HD3  1 1 
ATOM   681  N  N    . VAL   A 1 49  ? 6.019   19.32   -0.919  1   30.84 ? 742  VAL   A N    1 1 
ATOM   682  C  CA   . VAL   A 1 49  ? 5.454   18.132  -1.553  1   29.45 ? 742  VAL   A CA   1 1 
ATOM   683  C  C    . VAL   A 1 49  ? 4.023   18.375  -2.021  1   27.46 ? 742  VAL   A C    1 1 
ATOM   684  O  O    . VAL   A 1 49  ? 3.345   19.274  -1.529  1   27.39 ? 742  VAL   A O    1 1 
ATOM   685  C  CB   . VAL   A 1 49  ? 5.489   16.891  -0.604  1   30.35 ? 742  VAL   A CB   1 1 
ATOM   686  C  CG1  . VAL   A 1 49  ? 6.914   16.433  -0.314  1   31.04 ? 742  VAL   A CG1  1 1 
ATOM   687  C  CG2  . VAL   A 1 49  ? 4.712   17.14   0.698   1   30.71 ? 742  VAL   A CG2  1 1 
ATOM   688  H  H    . VAL   A 1 49  ? 5.396   19.753  -0.245  0   35.04 ? 742  VAL   A H    1 1 
ATOM   689  H  HA   . VAL   A 1 49  ? 6.034   17.875  -2.437  0   32.89 ? 742  VAL   A HA   1 1 
ATOM   690  H  HB   . VAL   A 1 49  ? 4.992   16.068  -1.115  0   33.95 ? 742  VAL   A HB   1 1 
ATOM   691  H  HG11 . VAL   A 1 49  ? 6.881   15.554  0.327   0   35.38 ? 742  VAL   A HG11 1 1 
ATOM   692  H  HG12 . VAL   A 1 49  ? 7.403   16.19   -1.256  0   34.97 ? 742  VAL   A HG12 1 1 
ATOM   693  H  HG13 . VAL   A 1 49  ? 7.454   17.236  0.188   0   35.48 ? 742  VAL   A HG13 1 1 
ATOM   694  H  HG21 . VAL   A 1 49  ? 4.831   16.268  1.339   0   35.11 ? 742  VAL   A HG21 1 1 
ATOM   695  H  HG22 . VAL   A 1 49  ? 5.112   18.018  1.204   0   35.19 ? 742  VAL   A HG22 1 1 
ATOM   696  H  HG23 . VAL   A 1 49  ? 3.654   17.282  0.481   0   34.77 ? 742  VAL   A HG23 1 1 
ATOM   697  N  N    . ALA   A 1 50  ? 3.58    17.584  -2.988  1   25.74 ? 743  ALA   A N    1 1 
ATOM   698  C  CA   . ALA   A 1 50  ? 2.207   17.542  -3.449  1   25.2  ? 743  ALA   A CA   1 1 
ATOM   699  C  C    . ALA   A 1 50  ? 1.678   16.176  -2.991  1   24.99 ? 743  ALA   A C    1 1 
ATOM   700  O  O    . ALA   A 1 50  ? 2.433   15.191  -2.97   1   24.8  ? 743  ALA   A O    1 1 
ATOM   701  C  CB   . ALA   A 1 50  ? 2.13    17.676  -4.966  1   24.7  ? 743  ALA   A CB   1 1 
ATOM   702  H  H    . ALA   A 1 50  ? 4.173   16.933  -3.493  0   28.58 ? 743  ALA   A H    1 1 
ATOM   703  H  HA   . ALA   A 1 50  ? 1.604   18.329  -2.998  0   28.13 ? 743  ALA   A HA   1 1 
ATOM   704  H  HB1  . ALA   A 1 50  ? 1.098   17.533  -5.282  0   26.95 ? 743  ALA   A HB1  1 1 
ATOM   705  H  HB2  . ALA   A 1 50  ? 2.47    18.671  -5.248  0   27.03 ? 743  ALA   A HB2  1 1 
ATOM   706  H  HB3  . ALA   A 1 50  ? 2.771   16.927  -5.427  0   26.9  ? 743  ALA   A HB3  1 1 
ATOM   707  N  N    . ILE   A 1 51  ? 0.407   16.126  -2.566  1   24.41 ? 744  ILE   A N    1 1 
ATOM   708  C  CA   . ILE   A 1 51  ? -0.2    14.913  -2.005  1   25.07 ? 744  ILE   A CA   1 1 
ATOM   709  C  C    . ILE   A 1 51  ? -1.506  14.632  -2.723  1   25.2  ? 744  ILE   A C    1 1 
ATOM   710  O  O    . ILE   A 1 51  ? -2.36   15.509  -2.74   1   25.25 ? 744  ILE   A O    1 1 
ATOM   711  C  CB   . ILE   A 1 51  ? -0.465  15.169  -0.483  1   25.75 ? 744  ILE   A CB   1 1 
ATOM   712  C  CG1  . ILE   A 1 51  ? 0.833   15.532  0.268   1   27.19 ? 744  ILE   A CG1  1 1 
ATOM   713  C  CG2  . ILE   A 1 51  ? -1.16   13.972  0.141   1   26.12 ? 744  ILE   A CG2  1 1 
ATOM   714  C  CD1  . ILE   A 1 51  ? 0.59    16.433  1.605   1   29.15 ? 744  ILE   A CD1  1 1 
ATOM   715  H  H    . ILE   A 1 51  ? -0.231  16.914  -2.6    0   27.48 ? 744  ILE   A H    1 1 
ATOM   716  H  HA   . ILE   A 1 51  ? 0.455   14.048  -2.106  0   28.28 ? 744  ILE   A HA   1 1 
ATOM   717  H  HB   . ILE   A 1 51  ? -1.142  16.017  -0.405  0   29.59 ? 744  ILE   A HB   1 1 
ATOM   718  H  HG12 . ILE   A 1 51  ? 1.317   14.611  0.588   0   31.22 ? 744  ILE   A HG12 1 1 
ATOM   719  H  HG13 . ILE   A 1 51  ? 1.514   16.091  -0.371  0   30.87 ? 744  ILE   A HG13 1 1 
ATOM   720  H  HG21 . ILE   A 1 51  ? -1.063  14.011  1.224   0   30.58 ? 744  ILE   A HG21 1 1 
ATOM   721  H  HG22 . ILE   A 1 51  ? -2.218  13.986  -0.117  0   30.17 ? 744  ILE   A HG22 1 1 
ATOM   722  H  HG23 . ILE   A 1 51  ? -0.694  13.062  -0.233  0   30.16 ? 744  ILE   A HG23 1 1 
ATOM   723  H  HD11 . ILE   A 1 51  ? 1.554   16.653  2.062   0   33.68 ? 744  ILE   A HD11 1 1 
ATOM   724  H  HD12 . ILE   A 1 51  ? 0.094   17.36   1.319   0   33.48 ? 744  ILE   A HD12 1 1 
ATOM   725  H  HD13 . ILE   A 1 51  ? -0.034  15.877  2.303   0   33.82 ? 744  ILE   A HD13 1 1 
ATOM   726  N  N    . LYS   A 1 52  ? -1.684  13.436  -3.294  1   25.44 ? 745  LYS   A N    1 1 
ATOM   727  C  CA   . LYS   A 1 52  ? -2.894  13.133  -4.054  1   26.51 ? 745  LYS   A CA   1 1 
ATOM   728  C  C    . LYS   A 1 52  ? -3.748  12.049  -3.414  1   29.11 ? 745  LYS   A C    1 1 
ATOM   729  O  O    . LYS   A 1 52  ? -3.225  11.033  -2.994  1   29.07 ? 745  LYS   A O    1 1 
ATOM   730  C  CB   . LYS   A 1 52  ? -2.528  12.716  -5.51   1   26.25 ? 745  LYS   A CB   1 1 
ATOM   731  C  CG   . LYS   A 1 52  ? -3.757  12.468  -6.382  1   28.27 ? 745  LYS   A CG   1 1 
ATOM   732  C  CD   . LYS   A 1 52  ? -3.473  12.446  -7.912  1   29.82 ? 745  LYS   A CD   1 1 
ATOM   733  C  CE   . LYS   A 1 52  ? -2.715  11.225  -8.382  1   30.31 ? 745  LYS   A CE   1 1 
ATOM   734  N  NZ   . LYS   A 1 52  ? -2.877  10.941  -9.853  1   28.76 ? 745  LYS   A NZ   1 1 
ATOM   735  H  H    . LYS   A 1 52  ? -1.022  12.667  -3.25   0   28.53 ? 745  LYS   A H    1 1 
ATOM   736  H  HA   . LYS   A 1 52  ? -3.508  14.027  -4.142  0   29.61 ? 745  LYS   A HA   1 1 
ATOM   737  H  HB2  . LYS   A 1 52  ? -1.945  13.511  -5.972  0   28.6  ? 745  LYS   A HB2  1 1 
ATOM   738  H  HB3  . LYS   A 1 52  ? -1.945  11.798  -5.474  0   28.9  ? 745  LYS   A HB3  1 1 
ATOM   739  H  HG2  . LYS   A 1 52  ? -4.191  11.504  -6.123  0   31.2  ? 745  LYS   A HG2  1 1 
ATOM   740  H  HG3  . LYS   A 1 52  ? -4.482  13.259  -6.193  0   31.05 ? 745  LYS   A HG3  1 1 
ATOM   741  H  HD2  . LYS   A 1 52  ? -4.429  12.478  -8.431  0   32.06 ? 745  LYS   A HD2  1 1 
ATOM   742  H  HD3  . LYS   A 1 52  ? -2.884  13.325  -8.171  0   31.75 ? 745  LYS   A HD3  1 1 
ATOM   743  H  HE2  . LYS   A 1 52  ? -1.654  11.38   -8.191  0   32.23 ? 745  LYS   A HE2  1 1 
ATOM   744  H  HE3  . LYS   A 1 52  ? -3.065  10.353  -7.833  0   32.69 ? 745  LYS   A HE3  1 1 
ATOM   745  H  HZ1  . LYS   A 1 52  ? -3.171  9.978   -9.981  0   30.74 ? 745  LYS   A HZ1  1 1 
ATOM   746  H  HZ2  . LYS   A 1 52  ? -3.561  11.55   -10.291 0   30.5  ? 745  LYS   A HZ2  1 1 
ATOM   747  H  HZ3  . LYS   A 1 52  ? -1.986  11.069  -10.321 0   30.27 ? 745  LYS   A HZ3  1 1 
ATOM   748  N  N    . GLU   A 1 53  ? -5.078  12.237  -3.444  1   32.02 ? 746  GLU   A N    1 1 
ATOM   749  C  CA   . GLU   A 1 53  ? -6.081  11.277  -2.976  1   35.68 ? 746  GLU   A CA   1 1 
ATOM   750  C  C    . GLU   A 1 53  ? -7.202  11.219  -3.993  1   39.53 ? 746  GLU   A C    1 1 
ATOM   751  O  O    . GLU   A 1 53  ? -7.49   12.226  -4.634  1   38.63 ? 746  GLU   A O    1 1 
ATOM   752  C  CB   . GLU   A 1 53  ? -6.787  11.771  -1.698  1   37.74 ? 746  GLU   A CB   1 1 
ATOM   753  C  CG   . GLU   A 1 53  ? -5.903  12.378  -0.659  1   43.34 ? 746  GLU   A CG   1 1 
ATOM   754  C  CD   . GLU   A 1 53  ? -6.671  12.814  0.569   1   47.5  ? 746  GLU   A CD   1 1 
ATOM   755  O  OE1  . GLU   A 1 53  ? -7.879  13.128  0.468   1   47.98 ? 746  GLU   A OE1  1 1 
ATOM   756  O  OE2  . GLU   A 1 53  ? -6.038  12.855  1.644   1   50.11 ? 746  GLU   A OE2  1 1 
ATOM   757  H  H    . GLU   A 1 53  ? -5.511  13.081  -3.806  0   35.73 ? 746  GLU   A H    1 1 
ATOM   758  H  HA   . GLU   A 1 53  ? -5.668  10.282  -2.82   0   40.08 ? 746  GLU   A HA   1 1 
ATOM   759  H  HB2  . GLU   A 1 53  ? -7.515  12.528  -1.987  0   42.69 ? 746  GLU   A HB2  1 1 
ATOM   760  H  HB3  . GLU   A 1 53  ? -7.301  10.927  -1.239  0   43.09 ? 746  GLU   A HB3  1 1 
ATOM   761  H  HG2  . GLU   A 1 53  ? -5.178  11.625  -0.358  0   48.24 ? 746  GLU   A HG2  1 1 
ATOM   762  H  HG3  . GLU   A 1 53  ? -5.377  13.232  -1.08   0   47.87 ? 746  GLU   A HG3  1 1 
ATOM   763  N  N    . LEU   A 1 54  ? -7.961  10.126  -3.988  1   43.37 ? 747  LEU   A N    1 1 
ATOM   764  C  CA   . LEU   A 1 54  ? -9.173  10.032  -4.791  1   48.34 ? 747  LEU   A CA   1 1 
ATOM   765  C  C    . LEU   A 1 54  ? -10.38  10.431  -3.929  1   53.32 ? 747  LEU   A C    1 1 
ATOM   766  O  O    . LEU   A 1 54  ? -10.311 10.37   -2.699  1   53.76 ? 747  LEU   A O    1 1 
ATOM   767  C  CB   . LEU   A 1 54  ? -9.358  8.594   -5.3    1   49    ? 747  LEU   A CB   1 1 
ATOM   768  C  CG   . LEU   A 1 54  ? -8.337  8.125   -6.341  1   50.99 ? 747  LEU   A CG   1 1 
ATOM   769  C  CD1  . LEU   A 1 54  ? -8.306  6.611   -6.437  1   51.7  ? 747  LEU   A CD1  1 1 
ATOM   770  C  CD2  . LEU   A 1 54  ? -8.615  8.736   -7.71   1   51.83 ? 747  LEU   A CD2  1 1 
ATOM   771  H  H    . LEU   A 1 54  ? -7.76   9.298   -3.437  0   48.47 ? 747  LEU   A H    1 1 
ATOM   772  H  HA   . LEU   A 1 54  ? -9.133  10.71   -5.642  0   53.01 ? 747  LEU   A HA   1 1 
ATOM   773  H  HB2  . LEU   A 1 54  ? -9.313  7.92    -4.445  0   54.69 ? 747  LEU   A HB2  1 1 
ATOM   774  H  HB3  . LEU   A 1 54  ? -10.345 8.52    -5.756  0   54.63 ? 747  LEU   A HB3  1 1 
ATOM   775  H  HG   . LEU   A 1 54  ? -7.34   8.448   -6.049  0   55.37 ? 747  LEU   A HG   1 1 
ATOM   776  H  HD11 . LEU   A 1 54  ? -7.53   6.328   -7.146  0   56.37 ? 747  LEU   A HD11 1 1 
ATOM   777  H  HD12 . LEU   A 1 54  ? -8.082  6.194   -5.457  0   57.06 ? 747  LEU   A HD12 1 1 
ATOM   778  H  HD13 . LEU   A 1 54  ? -9.277  6.257   -6.782  0   57.18 ? 747  LEU   A HD13 1 1 
ATOM   779  H  HD21 . LEU   A 1 54  ? -7.948  8.277   -8.438  0   55.75 ? 747  LEU   A HD21 1 1 
ATOM   780  H  HD22 . LEU   A 1 54  ? -9.651  8.545   -7.986  0   56.51 ? 747  LEU   A HD22 1 1 
ATOM   781  H  HD23 . LEU   A 1 54  ? -8.43   9.809   -7.681  0   55.91 ? 747  LEU   A HD23 1 1 
ATOM   782  N  N    . ARG   A 1 55  ? -11.485 10.84   -4.566  1   56.85 ? 748  ARG   A N    1 1 
ATOM   783  C  CA   . ARG   A 1 55  ? -12.719 11.142  -3.829  1   60.6  ? 748  ARG   A CA   1 1 
ATOM   784  C  C    . ARG   A 1 55  ? -13.39  9.784   -3.588  1   62.96 ? 748  ARG   A C    1 1 
ATOM   785  O  O    . ARG   A 1 55  ? -13.857 9.166   -4.544  1   63.39 ? 748  ARG   A O    1 1 
ATOM   786  C  CB   . ARG   A 1 55  ? -13.635 12.065  -4.646  1   63.71 ? 748  ARG   A CB   1 1 
ATOM   787  C  CG   . ARG   A 1 55  ? -13.13  13.518  -4.743  1   69.11 ? 748  ARG   A CG   1 1 
ATOM   788  C  CD   . ARG   A 1 55  ? -13.367 14.12   -6.119  1   74.42 ? 748  ARG   A CD   1 1 
ATOM   789  N  NE   . ARG   A 1 55  ? -13.502 15.576  -6.094  1   78.93 ? 748  ARG   A NE   1 1 
ATOM   790  C  CZ   . ARG   A 1 55  ? -13.797 16.326  -7.156  1   82.44 ? 748  ARG   A CZ   1 1 
ATOM   791  N  NH1  . ARG   A 1 55  ? -13.978 15.765  -8.35   1   82.47 ? 748  ARG   A NH1  1 1 
ATOM   792  N  NH2  . ARG   A 1 55  ? -13.913 17.644  -7.034  1   82.86 ? 748  ARG   A NH2  1 1 
ATOM   793  H  H    . ARG   A 1 55  ? -11.549 10.967  -5.571  0   62.58 ? 748  ARG   A H    1 1 
ATOM   794  H  HA   . ARG   A 1 55  ? -12.503 11.629  -2.88   0   67.49 ? 748  ARG   A HA   1 1 
ATOM   795  H  HB2  . ARG   A 1 55  ? -13.742 11.647  -5.646  0   70.4  ? 748  ARG   A HB2  1 1 
ATOM   796  H  HB3  . ARG   A 1 55  ? -14.61  12.093  -4.162  0   71.27 ? 748  ARG   A HB3  1 1 
ATOM   797  H  HG2  . ARG   A 1 55  ? -13.667 14.118  -4.009  0   75.91 ? 748  ARG   A HG2  1 1 
ATOM   798  H  HG3  . ARG   A 1 55  ? -12.06  13.555  -4.543  0   75.01 ? 748  ARG   A HG3  1 1 
ATOM   799  H  HD2  . ARG   A 1 55  ? -12.532 13.869  -6.771  0   79.87 ? 748  ARG   A HD2  1 1 
ATOM   800  H  HD3  . ARG   A 1 55  ? -14.292 13.717  -6.529  0   80.87 ? 748  ARG   A HD3  1 1 
ATOM   801  H  HE   . ARG   A 1 55  ? -13.372 16.046  -5.204  0   85.07 ? 748  ARG   A HE   1 1 
ATOM   802  H  HH11 . ARG   A 1 55  ? -13.908 14.765  -8.503  0   88.08 ? 748  ARG   A HH11 1 1 
ATOM   803  H  HH12 . ARG   A 1 55  ? -14.201 16.355  -9.145  0   87.96 ? 748  ARG   A HH12 1 1 
ATOM   804  H  HH21 . ARG   A 1 55  ? -13.772 18.089  -6.133  0   88.89 ? 748  ARG   A HH21 1 1 
ATOM   805  H  HH22 . ARG   A 1 55  ? -14.13  18.216  -7.843  0   88.6  ? 748  ARG   A HH22 1 1 
ATOM   806  N  N    . GLU   A 1 56  ? -13.371 9.281   -2.342  1   64.3  ? 749  GLU   A N    1 1 
ATOM   807  C  CA   . GLU   A 1 56  ? -13.922 7.954   -2.027  1   66.07 ? 749  GLU   A CA   1 1 
ATOM   808  C  C    . GLU   A 1 56  ? -15.444 7.921   -2.179  1   66.98 ? 749  GLU   A C    1 1 
ATOM   809  O  O    . GLU   A 1 56  ? -15.945 7.703   -3.283  1   67.45 ? 749  GLU   A O    1 1 
ATOM   810  C  CB   . GLU   A 1 56  ? -13.531 7.508   -0.6    1   69.09 ? 749  GLU   A CB   1 1 
ATOM   811  C  CG   . GLU   A 1 56  ? -12.036 7.323   -0.37   1   75.23 ? 749  GLU   A CG   1 1 
ATOM   812  C  CD   . GLU   A 1 56  ? -11.424 6.148   -1.107  1   83.2  ? 749  GLU   A CD   1 1 
ATOM   813  O  OE1  . GLU   A 1 56  ? -10.86  6.356   -2.207  1   84.37 ? 749  GLU   A OE1  1 1 
ATOM   814  O  OE2  . GLU   A 1 56  ? -11.506 5.017   -0.575  1   85.94 ? 749  GLU   A OE2  1 1 
ATOM   815  H  H    . GLU   A 1 56  ? -13.015 9.783   -1.534  0   72.23 ? 749  GLU   A H    1 1 
ATOM   816  H  HA   . GLU   A 1 56  ? -13.515 7.23    -2.731  0   74.49 ? 749  GLU   A HA   1 1 
ATOM   817  H  HB2  . GLU   A 1 56  ? -13.892 8.248   0.113   0   78.47 ? 749  GLU   A HB2  1 1 
ATOM   818  H  HB3  . GLU   A 1 56  ? -14.008 6.551   -0.396  0   78.77 ? 749  GLU   A HB3  1 1 
ATOM   819  H  HG2  . GLU   A 1 56  ? -11.51  8.225   -0.682  0   83.04 ? 749  GLU   A HG2  1 1 
ATOM   820  H  HG3  . GLU   A 1 56  ? -11.869 7.153   0.692   0   83.94 ? 749  GLU   A HG3  1 1 
ATOM   821  N  N    . ALA   A 1 62  ? -11.616 1.269   -4.575  1   59.74 ? 755  ALA   A N    1 1 
ATOM   822  C  CA   . ALA   A 1 62  ? -11.222 2.677   -4.486  1   60.06 ? 755  ALA   A CA   1 1 
ATOM   823  C  C    . ALA   A 1 62  ? -9.75   2.809   -4.049  1   59.57 ? 755  ALA   A C    1 1 
ATOM   824  O  O    . ALA   A 1 62  ? -8.99   3.515   -4.715  1   59.92 ? 755  ALA   A O    1 1 
ATOM   825  C  CB   . ALA   A 1 62  ? -12.148 3.424   -3.534  1   60.53 ? 755  ALA   A CB   1 1 
ATOM   826  H  HA   . ALA   A 1 62  ? -11.323 3.131   -5.471  0   67.84 ? 755  ALA   A HA   1 1 
ATOM   827  H  HB1  . ALA   A 1 62  ? -11.841 4.468   -3.488  0   68.7  ? 755  ALA   A HB1  1 1 
ATOM   828  H  HB2  . ALA   A 1 62  ? -13.169 3.353   -3.905  0   69.68 ? 755  ALA   A HB2  1 1 
ATOM   829  H  HB3  . ALA   A 1 62  ? -12.079 2.973   -2.545  0   69.67 ? 755  ALA   A HB3  1 1 
ATOM   830  N  N    . ASN   A 1 63  ? -9.333  2.116   -2.959  1   58.57 ? 756  ASN   A N    1 1 
ATOM   831  C  CA   . ASN   A 1 63  ? -7.917  2.11    -2.539  1   57.86 ? 756  ASN   A CA   1 1 
ATOM   832  C  C    . ASN   A 1 63  ? -7.06   1.266   -3.52   1   55.96 ? 756  ASN   A C    1 1 
ATOM   833  O  O    . ASN   A 1 63  ? -5.852  1.473   -3.582  1   56.1  ? 756  ASN   A O    1 1 
ATOM   834  C  CB   . ASN   A 1 63  ? -7.732  1.595   -1.094  1   59.52 ? 756  ASN   A CB   1 1 
ATOM   835  C  CG   . ASN   A 1 63  ? -7.875  2.64    -0      1   63.54 ? 756  ASN   A CG   1 1 
ATOM   836  O  OD1  . ASN   A 1 63  ? -7.964  3.85    -0.243  1   64.75 ? 756  ASN   A OD1  1 1 
ATOM   837  N  ND2  . ASN   A 1 63  ? -7.891  2.194   1.251   1   64.81 ? 756  ASN   A ND2  1 1 
ATOM   838  H  H    . ASN   A 1 63  ? -9.95   1.566   -2.369  0   67.29 ? 756  ASN   A H    1 1 
ATOM   839  H  HA   . ASN   A 1 63  ? -7.532  3.127   -2.587  0   64.92 ? 756  ASN   A HA   1 1 
ATOM   840  H  HB2  . ASN   A 1 63  ? -8.454  0.804   -0.893  0   68.4  ? 756  ASN   A HB2  1 1 
ATOM   841  H  HB3  . ASN   A 1 63  ? -6.726  1.186   -1.012  0   67.56 ? 756  ASN   A HB3  1 1 
ATOM   842  H  HD21 . ASN   A 1 63  ? -7.984  2.852   2.019   0   73.71 ? 756  ASN   A HD21 1 1 
ATOM   843  H  HD22 . ASN   A 1 63  ? -7.812  1.2     1.447   0   74.08 ? 756  ASN   A HD22 1 1 
ATOM   844  N  N    . LYS   A 1 64  ? -7.679  0.309   -4.254  1   54.08 ? 757  LYS   A N    1 1 
ATOM   845  C  CA   . LYS   A 1 64  ? -7.031  -0.497  -5.295  1   52.48 ? 757  LYS   A CA   1 1 
ATOM   846  C  C    . LYS   A 1 64  ? -6.517  0.439   -6.397  1   50.07 ? 757  LYS   A C    1 1 
ATOM   847  O  O    . LYS   A 1 64  ? -5.381  0.288   -6.841  1   50.19 ? 757  LYS   A O    1 1 
ATOM   848  C  CB   . LYS   A 1 64  ? -8.042  -1.534  -5.87   1   54.62 ? 757  LYS   A CB   1 1 
ATOM   849  C  CG   . LYS   A 1 64  ? -7.76   -2.133  -7.267  1   58.69 ? 757  LYS   A CG   1 1 
ATOM   850  C  CD   . LYS   A 1 64  ? -6.534  -3.038  -7.337  1   63.36 ? 757  LYS   A CD   1 1 
ATOM   851  C  CE   . LYS   A 1 64  ? -6.501  -3.831  -8.629  1   66.87 ? 757  LYS   A CE   1 1 
ATOM   852  N  NZ   . LYS   A 1 64  ? -5.248  -4.622  -8.792  1   68.79 ? 757  LYS   A NZ   1 1 
ATOM   853  H  H    . LYS   A 1 64  ? -8.648  0.046   -4.106  0   62.34 ? 757  LYS   A H    1 1 
ATOM   854  H  HA   . LYS   A 1 64  ? -6.184  -1.034  -4.869  0   60.08 ? 757  LYS   A HA   1 1 
ATOM   855  H  HB2  . LYS   A 1 64  ? -8.104  -2.367  -5.171  0   63.5  ? 757  LYS   A HB2  1 1 
ATOM   856  H  HB3  . LYS   A 1 64  ? -9.02   -1.061  -5.947  0   63.03 ? 757  LYS   A HB3  1 1 
ATOM   857  H  HG2  . LYS   A 1 64  ? -8.617  -2.745  -7.542  0   67.28 ? 757  LYS   A HG2  1 1 
ATOM   858  H  HG3  . LYS   A 1 64  ? -7.644  -1.343  -8.007  0   66.08 ? 757  LYS   A HG3  1 1 
ATOM   859  H  HD2  . LYS   A 1 64  ? -5.633  -2.427  -7.291  0   70.76 ? 757  LYS   A HD2  1 1 
ATOM   860  H  HD3  . LYS   A 1 64  ? -6.557  -3.74   -6.505  0   71.95 ? 757  LYS   A HD3  1 1 
ATOM   861  H  HE2  . LYS   A 1 64  ? -7.342  -4.522  -8.64   0   75.61 ? 757  LYS   A HE2  1 1 
ATOM   862  H  HE3  . LYS   A 1 64  ? -6.576  -3.139  -9.467  0   74.39 ? 757  LYS   A HE3  1 1 
ATOM   863  H  HZ1  . LYS   A 1 64  ? -5.158  -4.93   -9.755  0   76.6  ? 757  LYS   A HZ1  1 1 
ATOM   864  H  HZ2  . LYS   A 1 64  ? -4.441  -4.059  -8.546  0   76.38 ? 757  LYS   A HZ2  1 1 
ATOM   865  H  HZ3  . LYS   A 1 64  ? -5.275  -5.441  -8.192  0   77.48 ? 757  LYS   A HZ3  1 1 
ATOM   866  N  N    . GLU   A 1 65  ? -7.352  1.392   -6.843  1   47.57 ? 758  GLU   A N    1 1 
ATOM   867  C  CA   . GLU   A 1 65  ? -6.958  2.323   -7.9    1   45.77 ? 758  GLU   A CA   1 1 
ATOM   868  C  C    . GLU   A 1 65  ? -5.672  3.103   -7.549  1   42.39 ? 758  GLU   A C    1 1 
ATOM   869  O  O    . GLU   A 1 65  ? -4.74   3.119   -8.353  1   42.13 ? 758  GLU   A O    1 1 
ATOM   870  C  CB   . GLU   A 1 65  ? -8.088  3.342   -8.208  1   48.95 ? 758  GLU   A CB   1 1 
ATOM   871  C  CG   . GLU   A 1 65  ? -8.879  3.124   -9.489  1   54.88 ? 758  GLU   A CG   1 1 
ATOM   872  C  CD   . GLU   A 1 65  ? -9.74   4.316   -9.868  1   62.53 ? 758  GLU   A CD   1 1 
ATOM   873  O  OE1  . GLU   A 1 65  ? -9.181  5.421   -10.059 1   63.12 ? 758  GLU   A OE1  1 1 
ATOM   874  O  OE2  . GLU   A 1 65  ? -10.976 4.145   -9.974  1   65.48 ? 758  GLU   A OE2  1 1 
ATOM   875  H  H    . GLU   A 1 65  ? -8.303  1.512   -6.512  0   54.35 ? 758  GLU   A H    1 1 
ATOM   876  H  HA   . GLU   A 1 65  ? -6.748  1.73    -8.79   0   51.3  ? 758  GLU   A HA   1 1 
ATOM   877  H  HB2  . GLU   A 1 65  ? -8.802  3.376   -7.386  0   54.99 ? 758  GLU   A HB2  1 1 
ATOM   878  H  HB3  . GLU   A 1 65  ? -7.617  4.319   -8.3    0   53.97 ? 758  GLU   A HB3  1 1 
ATOM   879  H  HG2  . GLU   A 1 65  ? -8.183  2.938   -10.305 0   60.09 ? 758  GLU   A HG2  1 1 
ATOM   880  H  HG3  . GLU   A 1 65  ? -9.534  2.264   -9.357  0   61.12 ? 758  GLU   A HG3  1 1 
ATOM   881  N  N    . ILE   A 1 66  ? -5.613  3.73    -6.356  1   39.46 ? 759  ILE   A N    1 1 
ATOM   882  C  CA   . ILE   A 1 66  ? -4.46   4.564   -6      1   37.27 ? 759  ILE   A CA   1 1 
ATOM   883  C  C    . ILE   A 1 66  ? -3.201  3.712   -5.742  1   33.61 ? 759  ILE   A C    1 1 
ATOM   884  O  O    . ILE   A 1 66  ? -2.106  4.161   -6.083  1   31.54 ? 759  ILE   A O    1 1 
ATOM   885  C  CB   . ILE   A 1 66  ? -4.779  5.59    -4.847  1   38.86 ? 759  ILE   A CB   1 1 
ATOM   886  C  CG1  . ILE   A 1 66  ? -3.814  6.822   -4.889  1   40.5  ? 759  ILE   A CG1  1 1 
ATOM   887  C  CG2  . ILE   A 1 66  ? -4.783  4.946   -3.465  1   39.65 ? 759  ILE   A CG2  1 1 
ATOM   888  C  CD1  . ILE   A 1 66  ? -4.426  8.163   -4.419  1   42.06 ? 759  ILE   A CD1  1 1 
ATOM   889  H  H    . ILE   A 1 66  ? -6.34   3.682   -5.651  0   44.97 ? 759  ILE   A H    1 1 
ATOM   890  H  HA   . ILE   A 1 66  ? -4.237  5.151   -6.889  0   41.36 ? 759  ILE   A HA   1 1 
ATOM   891  H  HB   . ILE   A 1 66  ? -5.789  5.965   -5.012  0   43.67 ? 759  ILE   A HB   1 1 
ATOM   892  H  HG12 . ILE   A 1 66  ? -2.957  6.613   -4.251  0   44.64 ? 759  ILE   A HG12 1 1 
ATOM   893  H  HG13 . ILE   A 1 66  ? -3.471  6.98    -5.91   0   44.19 ? 759  ILE   A HG13 1 1 
ATOM   894  H  HG21 . ILE   A 1 66  ? -5.244  5.64    -2.763  0   45    ? 759  ILE   A HG21 1 1 
ATOM   895  H  HG22 . ILE   A 1 66  ? -5.36   4.023   -3.507  0   45.41 ? 759  ILE   A HG22 1 1 
ATOM   896  H  HG23 . ILE   A 1 66  ? -3.763  4.731   -3.151  0   44.87 ? 759  ILE   A HG23 1 1 
ATOM   897  H  HD11 . ILE   A 1 66  ? -3.727  8.982   -4.58   0   45.75 ? 759  ILE   A HD11 1 1 
ATOM   898  H  HD12 . ILE   A 1 66  ? -5.329  8.35    -4.996  0   46.09 ? 759  ILE   A HD12 1 1 
ATOM   899  H  HD13 . ILE   A 1 66  ? -4.673  8.087   -3.362  0   46.52 ? 759  ILE   A HD13 1 1 
ATOM   900  N  N    . LEU   A 1 67  ? -3.34   2.467   -5.228  1   32.41 ? 760  LEU   A N    1 1 
ATOM   901  C  CA   . LEU   A 1 67  ? -2.171  1.596   -5.038  1   31.57 ? 760  LEU   A CA   1 1 
ATOM   902  C  C    . LEU   A 1 67  ? -1.64   1.086   -6.369  1   29.67 ? 760  LEU   A C    1 1 
ATOM   903  O  O    . LEU   A 1 67  ? -0.435  0.903   -6.504  1   29.22 ? 760  LEU   A O    1 1 
ATOM   904  C  CB   . LEU   A 1 67  ? -2.505  0.396   -4.152  1   32.16 ? 760  LEU   A CB   1 1 
ATOM   905  C  CG   . LEU   A 1 67  ? -2.772  0.725   -2.679  1   34.18 ? 760  LEU   A CG   1 1 
ATOM   906  C  CD1  . LEU   A 1 67  ? -3.524  -0.402  -2.021  1   34.99 ? 760  LEU   A CD1  1 1 
ATOM   907  C  CD2  . LEU   A 1 67  ? -1.464  1.002   -1.916  1   35.15 ? 760  LEU   A CD2  1 1 
ATOM   908  H  H    . LEU   A 1 67  ? -4.222  2.053   -4.945  0   38.09 ? 760  LEU   A H    1 1 
ATOM   909  H  HA   . LEU   A 1 67  ? -1.373  2.17    -4.571  0   36.72 ? 760  LEU   A HA   1 1 
ATOM   910  H  HB2  . LEU   A 1 67  ? -3.378  -0.09   -4.587  0   38.63 ? 760  LEU   A HB2  1 1 
ATOM   911  H  HB3  . LEU   A 1 67  ? -1.664  -0.295  -4.181  0   38.47 ? 760  LEU   A HB3  1 1 
ATOM   912  H  HG   . LEU   A 1 67  ? -3.397  1.614   -2.602  0   40.52 ? 760  LEU   A HG   1 1 
ATOM   913  H  HD11 . LEU   A 1 67  ? -4.035  0.004   -1.151  0   42.68 ? 760  LEU   A HD11 1 1 
ATOM   914  H  HD12 . LEU   A 1 67  ? -4.265  -0.808  -2.708  0   42.57 ? 760  LEU   A HD12 1 1 
ATOM   915  H  HD13 . LEU   A 1 67  ? -2.834  -1.188  -1.719  0   42.67 ? 760  LEU   A HD13 1 1 
ATOM   916  H  HD21 . LEU   A 1 67  ? -1.699  1.118   -0.859  0   41.86 ? 760  LEU   A HD21 1 1 
ATOM   917  H  HD22 . LEU   A 1 67  ? -0.791  0.157   -2.051  0   41.81 ? 760  LEU   A HD22 1 1 
ATOM   918  H  HD23 . LEU   A 1 67  ? -1      1.915   -2.287  0   41.02 ? 760  LEU   A HD23 1 1 
ATOM   919  N  N    . ASP   A 1 68  ? -2.515  0.862   -7.356  1   28.67 ? 761  ASP   A N    1 1 
ATOM   920  C  CA   . ASP   A 1 68  ? -2.083  0.486   -8.706  1   28.62 ? 761  ASP   A CA   1 1 
ATOM   921  C  C    . ASP   A 1 68  ? -1.194  1.603   -9.285  1   26.57 ? 761  ASP   A C    1 1 
ATOM   922  O  O    . ASP   A 1 68  ? -0.138  1.316   -9.854  1   26.27 ? 761  ASP   A O    1 1 
ATOM   923  C  CB   . ASP   A 1 68  ? -3.295  0.288   -9.624  1   32    ? 761  ASP   A CB   1 1 
ATOM   924  C  CG   . ASP   A 1 68  ? -4.048  -1.012  -9.433  1   39.64 ? 761  ASP   A CG   1 1 
ATOM   925  O  OD1  . ASP   A 1 68  ? -3.584  -1.863  -8.63   1   40.25 ? 761  ASP   A OD1  1 1 
ATOM   926  O  OD2  . ASP   A 1 68  ? -5.089  -1.191  -10.102 1   43.35 ? 761  ASP   A OD2  1 1 
ATOM   927  H  H    . ASP   A 1 68  ? -3.524  0.899   -7.25   0   33.96 ? 761  ASP   A H    1 1 
ATOM   928  H  HA   . ASP   A 1 68  ? -1.492  -0.429  -8.67   0   33.71 ? 761  ASP   A HA   1 1 
ATOM   929  H  HB2  . ASP   A 1 68  ? -3.996  1.107   -9.473  0   36.76 ? 761  ASP   A HB2  1 1 
ATOM   930  H  HB3  . ASP   A 1 68  ? -2.942  0.305   -10.654 0   36.55 ? 761  ASP   A HB3  1 1 
ATOM   931  N  N    . GLU   A 1 69  ? -1.593  2.868   -9.071  1   25.52 ? 762  GLU   A N    1 1 
ATOM   932  C  CA   . GLU   A 1 69  ? -0.808  4.026   -9.522  1   24.97 ? 762  GLU   A CA   1 1 
ATOM   933  C  C    . GLU   A 1 69  ? 0.532   4.06    -8.787  1   24.44 ? 762  GLU   A C    1 1 
ATOM   934  O  O    . GLU   A 1 69  ? 1.568   4.297   -9.398  1   23.71 ? 762  GLU   A O    1 1 
ATOM   935  C  CB   . GLU   A 1 69  ? -1.594  5.326   -9.288  1   25.3  ? 762  GLU   A CB   1 1 
ATOM   936  C  CG   . GLU   A 1 69  ? -0.853  6.551   -9.803  1   25.97 ? 762  GLU   A CG   1 1 
ATOM   937  C  CD   . GLU   A 1 69  ? -1.669  7.817   -9.962  1   25.47 ? 762  GLU   A CD   1 1 
ATOM   938  O  OE1  . GLU   A 1 69  ? -2.894  7.788   -9.688  1   24.19 ? 762  GLU   A OE1  1 1 
ATOM   939  O  OE2  . GLU   A 1 69  ? -1.079  8.836   -10.397 1   25.13 ? 762  GLU   A OE2  1 1 
ATOM   940  H  H    . GLU   A 1 69  ? -2.459  3.131   -8.611  0   29.42 ? 762  GLU   A H    1 1 
ATOM   941  H  HA   . GLU   A 1 69  ? -0.611  3.933   -10.589 0   27.83 ? 762  GLU   A HA   1 1 
ATOM   942  H  HB2  . GLU   A 1 69  ? -2.545  5.249   -9.813  0   28.26 ? 762  GLU   A HB2  1 1 
ATOM   943  H  HB3  . GLU   A 1 69  ? -1.763  5.456   -8.22   0   28.46 ? 762  GLU   A HB3  1 1 
ATOM   944  H  HG2  . GLU   A 1 69  ? -0.041  6.788   -9.117  0   28.33 ? 762  GLU   A HG2  1 1 
ATOM   945  H  HG3  . GLU   A 1 69  ? -0.444  6.309   -10.782 0   28.1  ? 762  GLU   A HG3  1 1 
ATOM   946  N  N    . ALA   A 1 70  ? 0.525   3.788   -7.466  1   24.69 ? 763  ALA   A N    1 1 
ATOM   947  C  CA   . ALA   A 1 70  ? 1.77    3.748   -6.696  1   25.4  ? 763  ALA   A CA   1 1 
ATOM   948  C  C    . ALA   A 1 70  ? 2.715   2.656   -7.243  1   25.65 ? 763  ALA   A C    1 1 
ATOM   949  O  O    . ALA   A 1 70  ? 3.896   2.912   -7.44   1   25.38 ? 763  ALA   A O    1 1 
ATOM   950  C  CB   . ALA   A 1 70  ? 1.455   3.482   -5.22   1   25.97 ? 763  ALA   A CB   1 1 
ATOM   951  H  H    . ALA   A 1 70  ? -0.306  3.613   -6.91   0   28.54 ? 763  ALA   A H    1 1 
ATOM   952  H  HA   . ALA   A 1 70  ? 2.27    4.713   -6.774  0   28.76 ? 763  ALA   A HA   1 1 
ATOM   953  H  HB1  . ALA   A 1 70  ? 2.392   3.43    -4.671  0   30.3  ? 763  ALA   A HB1  1 1 
ATOM   954  H  HB2  . ALA   A 1 70  ? 0.837   4.29    -4.831  0   30.08 ? 763  ALA   A HB2  1 1 
ATOM   955  H  HB3  . ALA   A 1 70  ? 0.924   2.535   -5.138  0   30.55 ? 763  ALA   A HB3  1 1 
ATOM   956  N  N    . TYR   A 1 71  ? 2.188   1.445   -7.507  1   26.37 ? 764  TYR   A N    1 1 
ATOM   957  C  CA   . TYR   A 1 71  ? 2.979   0.333   -8.018  1   27.96 ? 764  TYR   A CA   1 1 
ATOM   958  C  C    . TYR   A 1 71  ? 3.655   0.695   -9.336  1   27.83 ? 764  TYR   A C    1 1 
ATOM   959  O  O    . TYR   A 1 71  ? 4.854   0.487   -9.491  1   28.08 ? 764  TYR   A O    1 1 
ATOM   960  C  CB   . TYR   A 1 71  ? 2.098   -0.914  -8.206  1   29.5  ? 764  TYR   A CB   1 1 
ATOM   961  C  CG   . TYR   A 1 71  ? 2.831   -2.037  -8.901  1   32.91 ? 764  TYR   A CG   1 1 
ATOM   962  C  CD1  . TYR   A 1 71  ? 3.864   -2.708  -8.267  1   34.88 ? 764  TYR   A CD1  1 1 
ATOM   963  C  CD2  . TYR   A 1 71  ? 2.638   -2.285  -10.257 1   34.71 ? 764  TYR   A CD2  1 1 
ATOM   964  C  CE1  . TYR   A 1 71  ? 4.575   -3.71   -8.904  1   36.28 ? 764  TYR   A CE1  1 1 
ATOM   965  C  CE2  . TYR   A 1 71  ? 3.376   -3.253  -10.922 1   36.17 ? 764  TYR   A CE2  1 1 
ATOM   966  C  CZ   . TYR   A 1 71  ? 4.316   -3.994  -10.229 1   37.92 ? 764  TYR   A CZ   1 1 
ATOM   967  O  OH   . TYR   A 1 71  ? 5.096   -4.909  -10.883 1   40.86 ? 764  TYR   A OH   1 1 
ATOM   968  H  H    . TYR   A 1 71  ? 1.213   1.204   -7.358  0   30.79 ? 764  TYR   A H    1 1 
ATOM   969  H  HA   . TYR   A 1 71  ? 3.757   0.096   -7.294  0   32.74 ? 764  TYR   A HA   1 1 
ATOM   970  H  HB2  . TYR   A 1 71  ? 1.81    -1.266  -7.217  0   34.93 ? 764  TYR   A HB2  1 1 
ATOM   971  H  HB3  . TYR   A 1 71  ? 1.217   -0.659  -8.792  0   34.3  ? 764  TYR   A HB3  1 1 
ATOM   972  H  HD1  . TYR   A 1 71  ? 4.051   -2.512  -7.225  0   40.78 ? 764  TYR   A HD1  1 1 
ATOM   973  H  HD2  . TYR   A 1 71  ? 1.878   -1.742  -10.792 0   39.45 ? 764  TYR   A HD2  1 1 
ATOM   974  H  HE1  . TYR   A 1 71  ? 5.343   -4.243  -8.37   0   42.8  ? 764  TYR   A HE1  1 1 
ATOM   975  H  HE2  . TYR   A 1 71  ? 3.173   -3.469  -11.957 0   41.4  ? 764  TYR   A HE2  1 1 
ATOM   976  H  HH   . TYR   A 1 71  ? 5.988   -4.982  -10.452 0   47.43 ? 764  TYR   A HH   1 1 
ATOM   977  N  N    . VAL   A 1 72  ? 2.887   1.227   -10.279 1   27.06 ? 765  VAL   A N    1 1 
ATOM   978  C  CA   . VAL   A 1 72  ? 3.419   1.57    -11.601 1   27.03 ? 765  VAL   A CA   1 1 
ATOM   979  C  C    . VAL   A 1 72  ? 4.561   2.591   -11.483 1   25.57 ? 765  VAL   A C    1 1 
ATOM   980  O  O    . VAL   A 1 72  ? 5.618   2.401   -12.071 1   25.37 ? 765  VAL   A O    1 1 
ATOM   981  C  CB   . VAL   A 1 72  ? 2.259   2.07    -12.528 1   28.97 ? 765  VAL   A CB   1 1 
ATOM   982  C  CG1  . VAL   A 1 72  ? 2.804   2.851   -13.715 1   30.56 ? 765  VAL   A CG1  1 1 
ATOM   983  C  CG2  . VAL   A 1 72  ? 1.388   0.894   -12.999 1   29.5  ? 765  VAL   A CG2  1 1 
ATOM   984  H  H    . VAL   A 1 72  ? 1.903   1.444   -10.153 0   30.66 ? 765  VAL   A H    1 1 
ATOM   985  H  HA   . VAL   A 1 72  ? 3.848   0.664   -12.029 0   30.46 ? 765  VAL   A HA   1 1 
ATOM   986  H  HB   . VAL   A 1 72  ? 1.614   2.76    -11.986 0   31.72 ? 765  VAL   A HB   1 1 
ATOM   987  H  HG11 . VAL   A 1 72  ? 2.03    2.892   -14.477 0   32.67 ? 765  VAL   A HG11 1 1 
ATOM   988  H  HG12 . VAL   A 1 72  ? 3.052   3.863   -13.402 0   32.68 ? 765  VAL   A HG12 1 1 
ATOM   989  H  HG13 . VAL   A 1 72  ? 3.694   2.341   -14.08  0   32.97 ? 765  VAL   A HG13 1 1 
ATOM   990  H  HG21 . VAL   A 1 72  ? 0.577   1.273   -13.618 0   32.51 ? 765  VAL   A HG21 1 1 
ATOM   991  H  HG22 . VAL   A 1 72  ? 2.007   0.207   -13.575 0   32.85 ? 765  VAL   A HG22 1 1 
ATOM   992  H  HG23 . VAL   A 1 72  ? 0.983   0.384   -12.126 0   33.13 ? 765  VAL   A HG23 1 1 
ATOM   993  N  N    . MET   A 1 73  ? 4.351   3.642   -10.694 1   25.1  ? 766  MET   A N    1 1 
ATOM   994  C  CA   . MET   A 1 73  ? 5.361   4.674   -10.516 1   25.44 ? 766  MET   A CA   1 1 
ATOM   995  C  C    . MET   A 1 73  ? 6.608   4.129   -9.849  1   26.44 ? 766  MET   A C    1 1 
ATOM   996  O  O    . MET   A 1 73  ? 7.716   4.454   -10.277 1   26.71 ? 766  MET   A O    1 1 
ATOM   997  C  CB   . MET   A 1 73  ? 4.793   5.846   -9.703  1   25.39 ? 766  MET   A CB   1 1 
ATOM   998  C  CG   . MET   A 1 73  ? 3.798   6.666   -10.485 1   26.78 ? 766  MET   A CG   1 1 
ATOM   999  S  SD   . MET   A 1 73  ? 3.128   8.031   -9.558  1   27.49 ? 766  MET   A SD   1 1 
ATOM   1000 C  CE   . MET   A 1 73  ? 4.457   9.206   -9.663  1   24.52 ? 766  MET   A CE   1 1 
ATOM   1001 H  H    . MET   A 1 73  ? 3.497   3.791   -10.166 0   27.88 ? 766  MET   A H    1 1 
ATOM   1002 H  HA   . MET   A 1 73  ? 5.641   5.041   -11.503 0   27.69 ? 766  MET   A HA   1 1 
ATOM   1003 H  HB2  . MET   A 1 73  ? 4.294   5.464   -8.813  0   28.06 ? 766  MET   A HB2  1 1 
ATOM   1004 H  HB3  . MET   A 1 73  ? 5.624   6.487   -9.411  0   27.77 ? 766  MET   A HB3  1 1 
ATOM   1005 H  HG2  . MET   A 1 73  ? 4.286   7.065   -11.373 0   28.48 ? 766  MET   A HG2  1 1 
ATOM   1006 H  HG3  . MET   A 1 73  ? 2.969   6.022   -10.772 0   28.8  ? 766  MET   A HG3  1 1 
ATOM   1007 H  HE1  . MET   A 1 73  ? 4.16    10.118  -9.148  0   26.19 ? 766  MET   A HE1  1 1 
ATOM   1008 H  HE2  . MET   A 1 73  ? 5.353   8.796   -9.201  0   26.46 ? 766  MET   A HE2  1 1 
ATOM   1009 H  HE3  . MET   A 1 73  ? 4.651   9.423   -10.713 0   25.95 ? 766  MET   A HE3  1 1 
ATOM   1010 N  N    . ALA   A 1 74  ? 6.446   3.304   -8.808  1   26.72 ? 767  ALA   A N    1 1 
ATOM   1011 C  CA   . ALA   A 1 74  ? 7.599   2.711   -8.128  1   27.9  ? 767  ALA   A CA   1 1 
ATOM   1012 C  C    . ALA   A 1 74  ? 8.363   1.788   -9.09   1   28.59 ? 767  ALA   A C    1 1 
ATOM   1013 O  O    . ALA   A 1 74  ? 9.595   1.801   -9.096  1   28.87 ? 767  ALA   A O    1 1 
ATOM   1014 C  CB   . ALA   A 1 74  ? 7.127   1.924   -6.919  1   28.41 ? 767  ALA   A CB   1 1 
ATOM   1015 H  H    . ALA   A 1 74  ? 5.553   3.04    -8.405  0   30.25 ? 767  ALA   A H    1 1 
ATOM   1016 H  HA   . ALA   A 1 74  ? 8.272   3.498   -7.792  0   31.8  ? 767  ALA   A HA   1 1 
ATOM   1017 H  HB1  . ALA   A 1 74  ? 7.992   1.487   -6.422  0   33.26 ? 767  ALA   A HB1  1 1 
ATOM   1018 H  HB2  . ALA   A 1 74  ? 6.607   2.595   -6.238  0   32.75 ? 767  ALA   A HB2  1 1 
ATOM   1019 H  HB3  . ALA   A 1 74  ? 6.453   1.136   -7.251  0   32.97 ? 767  ALA   A HB3  1 1 
ATOM   1020 N  N    . SER   A 1 75  ? 7.625   1.005   -9.917  1   28.51 ? 768  SER   A N    1 1 
ATOM   1021 C  CA   . SER   A 1 75  ? 8.196   0.086   -10.909 1   29.36 ? 768  SER   A CA   1 1 
ATOM   1022 C  C    . SER   A 1 75  ? 9.094   0.745   -11.948 1   29.53 ? 768  SER   A C    1 1 
ATOM   1023 O  O    . SER   A 1 75  ? 9.948   0.062   -12.504 1   30.17 ? 768  SER   A O    1 1 
ATOM   1024 C  CB   . SER   A 1 75  ? 7.086   -0.647  -11.658 1   31.93 ? 768  SER   A CB   1 1 
ATOM   1025 O  OG   . SER   A 1 75  ? 6.356   -1.486  -10.778 1   35.36 ? 768  SER   A OG   1 1 
ATOM   1026 H  H    . SER   A 1 75  ? 6.611   0.978   -9.896  0   32.48 ? 768  SER   A H    1 1 
ATOM   1027 H  HA   . SER   A 1 75  ? 8.794   -0.658  -10.387 0   34.16 ? 768  SER   A HA   1 1 
ATOM   1028 H  HB2  . SER   A 1 75  ? 6.407   0.084   -12.096 0   35.73 ? 768  SER   A HB2  1 1 
ATOM   1029 H  HB3  . SER   A 1 75  ? 7.531   -1.257  -12.442 0   36.32 ? 768  SER   A HB3  1 1 
ATOM   1030 H  HG   . SER   A 1 75  ? 5.526   -1.802  -11.222 0   40.03 ? 768  SER   A HG   1 1 
ATOM   1031 N  N    . VAL   A 1 76  ? 8.869   2.031   -12.264 1   28.92 ? 769  VAL   A N    1 1 
ATOM   1032 C  CA   . VAL   A 1 76  ? 9.672   2.75    -13.263 1   29.19 ? 769  VAL   A CA   1 1 
ATOM   1033 C  C    . VAL   A 1 76  ? 10.608  3.805   -12.611 1   30.27 ? 769  VAL   A C    1 1 
ATOM   1034 O  O    . VAL   A 1 76  ? 11.239  4.58    -13.336 1   28.98 ? 769  VAL   A O    1 1 
ATOM   1035 C  CB   . VAL   A 1 76  ? 8.769   3.374   -14.392 1   29.46 ? 769  VAL   A CB   1 1 
ATOM   1036 C  CG1  . VAL   A 1 76  ? 7.931   2.294   -15.072 1   30.49 ? 769  VAL   A CG1  1 1 
ATOM   1037 C  CG2  . VAL   A 1 76  ? 7.871   4.497   -13.869 1   29.37 ? 769  VAL   A CG2  1 1 
ATOM   1038 H  H    . VAL   A 1 76  ? 8.156   2.6     -11.82  0   32.15 ? 769  VAL   A H    1 1 
ATOM   1039 H  HA   . VAL   A 1 76  ? 10.327  2.046   -13.773 0   32.68 ? 769  VAL   A HA   1 1 
ATOM   1040 H  HB   . VAL   A 1 76  ? 9.418   3.804   -15.154 0   31.96 ? 769  VAL   A HB   1 1 
ATOM   1041 H  HG11 . VAL   A 1 76  ? 7.432   2.731   -15.935 0   32.78 ? 769  VAL   A HG11 1 1 
ATOM   1042 H  HG12 . VAL   A 1 76  ? 8.585   1.483   -15.389 0   33.44 ? 769  VAL   A HG12 1 1 
ATOM   1043 H  HG13 . VAL   A 1 76  ? 7.186   1.92    -14.372 0   33.34 ? 769  VAL   A HG13 1 1 
ATOM   1044 H  HG21 . VAL   A 1 76  ? 7.219   4.821   -14.679 0   31.24 ? 769  VAL   A HG21 1 1 
ATOM   1045 H  HG22 . VAL   A 1 76  ? 7.265   4.129   -13.043 0   31.74 ? 769  VAL   A HG22 1 1 
ATOM   1046 H  HG23 . VAL   A 1 76  ? 8.48    5.338   -13.542 0   31.59 ? 769  VAL   A HG23 1 1 
ATOM   1047 N  N    . ASP   A 1 77  ? 10.777  3.777   -11.264 1   32.29 ? 770  ASP   A N    1 1 
ATOM   1048 C  CA   . ASP   A 1 77  ? 11.591  4.76    -10.509 1   35.09 ? 770  ASP   A CA   1 1 
ATOM   1049 C  C    . ASP   A 1 77  ? 13.094  4.598   -10.693 1   37.28 ? 770  ASP   A C    1 1 
ATOM   1050 O  O    . ASP   A 1 77  ? 13.807  5.57    -10.48  1   38.11 ? 770  ASP   A O    1 1 
ATOM   1051 C  CB   . ASP   A 1 77  ? 11.154  4.565   -9.033  1   38.32 ? 770  ASP   A CB   1 1 
ATOM   1052 C  CG   . ASP   A 1 77  ? 11.65   5.78    -8.265  1   45.6  ? 770  ASP   A CG   1 1 
ATOM   1053 O  OD1  . ASP   A 1 77  ? 11.008  6.848   -8.369  1   47.29 ? 770  ASP   A OD1  1 1 
ATOM   1054 O  OD2  . ASP   A 1 77  ? 12.65   5.65    -7.527  1   48.68 ? 770  ASP   A OD2  1 1 
ATOM   1055 H  H    . ASP   A 1 77  ? 10.406  3       -10.726 0   36.08 ? 770  ASP   A H    1 1 
ATOM   1056 H  HA   . ASP   A 1 77  ? 11.313  5.755   -10.856 0   38.43 ? 770  ASP   A HA   1 1 
ATOM   1057 H  HB2  . ASP   A 1 77  ? 10.068  4.506   -8.977  0   42.04 ? 770  ASP   A HB2  1 1 
ATOM   1058 H  HB3  . ASP   A 1 77  ? 11.606  3.655   -8.641  0   42.74 ? 770  ASP   A HB3  1 1 
ATOM   1059 N  N    . ASN   A 1 78  A 13.602  3.418   -11.09  1   38.37 ? 770  ASN   A N    1 1 
ATOM   1060 C  CA   . ASN   A 1 78  A 15.027  3.17    -11.3   1   40.07 ? 770  ASN   A CA   1 1 
ATOM   1061 C  C    . ASN   A 1 78  A 15.373  2.924   -12.774 1   39.67 ? 770  ASN   A C    1 1 
ATOM   1062 O  O    . ASN   A 1 78  A 14.875  1.944   -13.32  1   40.72 ? 770  ASN   A O    1 1 
ATOM   1063 C  CB   . ASN   A 1 78  A 15.305  1.926   -10.424 1   43.38 ? 770  ASN   A CB   1 1 
ATOM   1064 C  CG   . ASN   A 1 78  A 16.833  1.657   -10.599 1   49.92 ? 770  ASN   A CG   1 1 
ATOM   1065 O  OD1  . ASN   A 1 78  A 17.671  2.563   -10.46  1   51.93 ? 770  ASN   A OD1  1 1 
ATOM   1066 N  ND2  . ASN   A 1 78  A 17.205  0.421   -10.945 1   51.8  ? 770  ASN   A ND2  1 1 
ATOM   1067 H  H    . ASN   A 1 78  A 13.038  2.596   -11.277 0   42.95 ? 770  ASN   A H    1 1 
ATOM   1068 H  HA   . ASN   A 1 78  A 15.599  3.993   -10.879 0   45.32 ? 770  ASN   A HA   1 1 
ATOM   1069 H  HB2  . ASN   A 1 78  A 15.073  2.154   -9.385  0   49.26 ? 770  ASN   A HB2  1 1 
ATOM   1070 H  HB3  . ASN   A 1 78  A 14.712  1.082   -10.774 0   49.16 ? 770  ASN   A HB3  1 1 
ATOM   1071 H  HD21 . ASN   A 1 78  A 18.19   0.208   -11.068 0   59.34 ? 770  ASN   A HD21 1 1 
ATOM   1072 H  HD22 . ASN   A 1 78  A 16.511  -0.306  -11.088 0   58.72 ? 770  ASN   A HD22 1 1 
ATOM   1073 N  N    . PRO   A 1 79  B 16.29   3.683   -13.416 1   38.01 ? 770  PRO   A N    1 1 
ATOM   1074 C  CA   . PRO   A 1 79  B 17.002  4.877   -12.92  1   37.27 ? 770  PRO   A CA   1 1 
ATOM   1075 C  C    . PRO   A 1 79  B 16.151  6.139   -12.776 1   36.7  ? 770  PRO   A C    1 1 
ATOM   1076 O  O    . PRO   A 1 79  B 16.581  7.09    -12.13  1   37.83 ? 770  PRO   A O    1 1 
ATOM   1077 C  CB   . PRO   A 1 79  B 18.091  5.085   -13.976 1   38.08 ? 770  PRO   A CB   1 1 
ATOM   1078 C  CG   . PRO   A 1 79  B 17.497  4.562   -15.238 1   38.93 ? 770  PRO   A CG   1 1 
ATOM   1079 C  CD   . PRO   A 1 79  B 16.633  3.396   -14.824 1   37.47 ? 770  PRO   A CD   1 1 
ATOM   1080 H  HA   . PRO   A 1 79  B 17.506  4.673   -11.976 0   43    ? 770  PRO   A HA   1 1 
ATOM   1081 H  HB2  . PRO   A 1 79  B 18.32   6.146   -14.066 0   43.62 ? 770  PRO   A HB2  1 1 
ATOM   1082 H  HB3  . PRO   A 1 79  B 18.979  4.518   -13.703 0   44.35 ? 770  PRO   A HB3  1 1 
ATOM   1083 H  HG2  . PRO   A 1 79  B 16.896  5.339   -15.709 0   43.6  ? 770  PRO   A HG2  1 1 
ATOM   1084 H  HG3  . PRO   A 1 79  B 18.291  4.233   -15.907 0   44.49 ? 770  PRO   A HG3  1 1 
ATOM   1085 H  HD2  . PRO   A 1 79  B 15.732  3.365   -15.435 0   42.13 ? 770  PRO   A HD2  1 1 
ATOM   1086 H  HD3  . PRO   A 1 79  B 17.194  2.465   -14.896 0   43.11 ? 770  PRO   A HD3  1 1 
ATOM   1087 N  N    . GLY   A 1 80  C 14.965  6.157   -13.38  1   34.88 ? 770  GLY   A N    1 1 
ATOM   1088 C  CA   . GLY   A 1 80  C 14.078  7.308   -13.436 1   33.41 ? 770  GLY   A CA   1 1 
ATOM   1089 C  C    . GLY   A 1 80  C 14.506  8.234   -14.568 1   30.99 ? 770  GLY   A C    1 1 
ATOM   1090 O  O    . GLY   A 1 80  C 15.474  7.944   -15.285 1   31    ? 770  GLY   A O    1 1 
ATOM   1091 H  H    . GLY   A 1 80  C 14.563  5.364   -13.869 0   38.84 ? 770  GLY   A H    1 1 
ATOM   1092 H  HA2  . GLY   A 1 80  C 13.054  6.983   -13.611 0   36.51 ? 770  GLY   A HA2  1 1 
ATOM   1093 H  HA3  . GLY   A 1 80  C 14.12   7.86    -12.499 0   36.98 ? 770  GLY   A HA3  1 1 
ATOM   1094 N  N    . ASN   A 1 81  ? 13.816  9.37    -14.717 1   28.38 ? 771  ASN   A N    1 1 
ATOM   1095 C  CA   . ASN   A 1 81  ? 14.12   10.317  -15.792 1   26.38 ? 771  ASN   A CA   1 1 
ATOM   1096 C  C    . ASN   A 1 81  ? 13.761  11.77   -15.368 1   25.21 ? 771  ASN   A C    1 1 
ATOM   1097 O  O    . ASN   A 1 81  ? 12.758  11.951  -14.674 1   24.93 ? 771  ASN   A O    1 1 
ATOM   1098 C  CB   . ASN   A 1 81  ? 13.333  9.895   -17.033 1   26.6  ? 771  ASN   A CB   1 1 
ATOM   1099 C  CG   . ASN   A 1 81  ? 13.6    10.725  -18.25  1   26.95 ? 771  ASN   A CG   1 1 
ATOM   1100 O  OD1  . ASN   A 1 81  ? 12.947  11.738  -18.468 1   26.7  ? 771  ASN   A OD1  1 1 
ATOM   1101 N  ND2  . ASN   A 1 81  ? 14.568  10.344  -19.058 1   26.91 ? 771  ASN   A ND2  1 1 
ATOM   1102 H  H    . ASN   A 1 81  ? 13.049  9.658   -14.117 0   31    ? 771  ASN   A H    1 1 
ATOM   1103 H  HA   . ASN   A 1 81  ? 15.18   10.248  -16.026 0   29.49 ? 771  ASN   A HA   1 1 
ATOM   1104 H  HB2  . ASN   A 1 81  ? 13.574  8.859   -17.268 0   29    ? 771  ASN   A HB2  1 1 
ATOM   1105 H  HB3  . ASN   A 1 81  ? 12.271  9.978   -16.809 0   28.47 ? 771  ASN   A HB3  1 1 
ATOM   1106 H  HD21 . ASN   A 1 81  ? 14.769  10.888  -19.891 0   29.27 ? 771  ASN   A HD21 1 1 
ATOM   1107 H  HD22 . ASN   A 1 81  ? 15.119  9.516   -18.856 0   29.66 ? 771  ASN   A HD22 1 1 
ATOM   1108 N  N    . PRO   A 1 82  ? 14.513  12.824  -15.782 1   24.73 ? 772  PRO   A N    1 1 
ATOM   1109 C  CA   . PRO   A 1 82  ? 14.131  14.198  -15.368 1   23.99 ? 772  PRO   A CA   1 1 
ATOM   1110 C  C    . PRO   A 1 82  ? 12.743  14.652  -15.827 1   22.4  ? 772  PRO   A C    1 1 
ATOM   1111 O  O    . PRO   A 1 82  ? 12.18   15.58   -15.244 1   22.25 ? 772  PRO   A O    1 1 
ATOM   1112 C  CB   . PRO   A 1 82  ? 15.191  15.097  -16.02  1   25.29 ? 772  PRO   A CB   1 1 
ATOM   1113 C  CG   . PRO   A 1 82  ? 16.263  14.211  -16.471 1   26.59 ? 772  PRO   A CG   1 1 
ATOM   1114 C  CD   . PRO   A 1 82  ? 15.746  12.824  -16.6   1   24.4  ? 772  PRO   A CD   1 1 
ATOM   1115 H  HA   . PRO   A 1 82  ? 14.199  14.295  -14.285 0   26.76 ? 772  PRO   A HA   1 1 
ATOM   1116 H  HB2  . PRO   A 1 82  ? 14.752  15.626  -16.864 0   28    ? 772  PRO   A HB2  1 1 
ATOM   1117 H  HB3  . PRO   A 1 82  ? 15.569  15.805  -15.283 0   28.63 ? 772  PRO   A HB3  1 1 
ATOM   1118 H  HG2  . PRO   A 1 82  ? 16.624  14.562  -17.436 0   30.05 ? 772  PRO   A HG2  1 1 
ATOM   1119 H  HG3  . PRO   A 1 82  ? 17.072  14.238  -15.742 0   30.55 ? 772  PRO   A HG3  1 1 
ATOM   1120 H  HD2  . PRO   A 1 82  ? 15.512  12.598  -17.639 0   27.31 ? 772  PRO   A HD2  1 1 
ATOM   1121 H  HD3  . PRO   A 1 82  ? 16.489  12.136  -16.198 0   27.98 ? 772  PRO   A HD3  1 1 
ATOM   1122 N  N    . HIS   A 1 83  ? 12.199  14.021  -16.882 1   20.25 ? 773  HIS   A N    1 1 
ATOM   1123 C  CA   . HIS   A 1 83  ? 10.903  14.416  -17.428 1   18.99 ? 773  HIS   A CA   1 1 
ATOM   1124 C  C    . HIS   A 1 83  ? 9.775   13.432  -17.06  1   18.61 ? 773  HIS   A C    1 1 
ATOM   1125 O  O    . HIS   A 1 83  ? 8.746   13.376  -17.745 1   17.38 ? 773  HIS   A O    1 1 
ATOM   1126 C  CB   . HIS   A 1 83  ? 11.078  14.619  -18.935 1   19.16 ? 773  HIS   A CB   1 1 
ATOM   1127 C  CG   . HIS   A 1 83  ? 12.172  15.603  -19.206 1   20.36 ? 773  HIS   A CG   1 1 
ATOM   1128 N  ND1  . HIS   A 1 83  ? 12.098  16.892  -18.729 1   21.83 ? 773  HIS   A ND1  1 1 
ATOM   1129 C  CD2  . HIS   A 1 83  ? 13.41   15.399  -19.708 1   21.43 ? 773  HIS   A CD2  1 1 
ATOM   1130 C  CE1  . HIS   A 1 83  ? 13.245  17.469  -19.06  1   22.12 ? 773  HIS   A CE1  1 1 
ATOM   1131 N  NE2  . HIS   A 1 83  ? 14.068  16.606  -19.638 1   22.08 ? 773  HIS   A NE2  1 1 
ATOM   1132 H  H    . HIS   A 1 83  ? 12.623  13.251  -17.389 0   21.97 ? 773  HIS   A H    1 1 
ATOM   1133 H  HA   . HIS   A 1 83  ? 10.606  15.381  -17.022 0   20.07 ? 773  HIS   A HA   1 1 
ATOM   1134 H  HB2  . HIS   A 1 83  ? 11.342  13.671  -19.402 0   20.13 ? 773  HIS   A HB2  1 1 
ATOM   1135 H  HB3  . HIS   A 1 83  ? 10.154  15.009  -19.36  0   19.77 ? 773  HIS   A HB3  1 1 
ATOM   1136 H  HD2  . HIS   A 1 83  ? 13.806  14.472  -20.088 0   23.26 ? 773  HIS   A HD2  1 1 
ATOM   1137 H  HE1  . HIS   A 1 83  ? 13.477  18.505  -18.883 0   24.24 ? 773  HIS   A HE1  1 1 
ATOM   1138 H  HE2  . HIS   A 1 83  ? 15.01   16.799  -19.964 0   24.58 ? 773  HIS   A HE2  1 1 
ATOM   1139 N  N    . VAL   A 1 84  ? 9.94    12.694  -15.937 1   18.86 ? 774  VAL   A N    1 1 
ATOM   1140 C  CA   . VAL   A 1 84  ? 8.922   11.757  -15.464 1   19.1  ? 774  VAL   A CA   1 1 
ATOM   1141 C  C    . VAL   A 1 84  ? 8.808   11.978  -13.931 1   20    ? 774  VAL   A C    1 1 
ATOM   1142 O  O    . VAL   A 1 84  ? 9.818   11.879  -13.224 1   20.08 ? 774  VAL   A O    1 1 
ATOM   1143 C  CB   . VAL   A 1 84  ? 9.249   10.268  -15.787 1   19.09 ? 774  VAL   A CB   1 1 
ATOM   1144 C  CG1  . VAL   A 1 84  ? 8.283   9.322   -15.048 1   19.68 ? 774  VAL   A CG1  1 1 
ATOM   1145 C  CG2  . VAL   A 1 84  ? 9.236   9.985   -17.302 1   18.52 ? 774  VAL   A CG2  1 1 
ATOM   1146 H  H    . VAL   A 1 84  ? 10.75   12.729  -15.326 0   20.27 ? 774  VAL   A H    1 1 
ATOM   1147 H  HA   . VAL   A 1 84  ? 7.961   11.982  -15.926 0   19.73 ? 774  VAL   A HA   1 1 
ATOM   1148 H  HB   . VAL   A 1 84  ? 10.254  10.053  -15.425 0   20.53 ? 774  VAL   A HB   1 1 
ATOM   1149 H  HG11 . VAL   A 1 84  ? 8.34    8.333   -15.501 0   20.97 ? 774  VAL   A HG11 1 1 
ATOM   1150 H  HG12 . VAL   A 1 84  ? 8.579   9.244   -14.004 0   20.99 ? 774  VAL   A HG12 1 1 
ATOM   1151 H  HG13 . VAL   A 1 84  ? 7.269   9.712   -15.122 0   20.53 ? 774  VAL   A HG13 1 1 
ATOM   1152 H  HG21 . VAL   A 1 84  ? 9.482   8.937   -17.473 0   19.58 ? 774  VAL   A HG21 1 1 
ATOM   1153 H  HG22 . VAL   A 1 84  ? 8.245   10.204  -17.696 0   19.1  ? 774  VAL   A HG22 1 1 
ATOM   1154 H  HG23 . VAL   A 1 84  ? 9.977   10.62   -17.785 0   19.47 ? 774  VAL   A HG23 1 1 
ATOM   1155 N  N    A CYS   A 1 85  ? 7.582   12.301  -13.472 0.5 20.44 ? 775  CYS   A N    1 1 
ATOM   1156 N  N    B CYS   A 1 85  ? 7.605   12.247  -13.424 0.5 19.95 ? 775  CYS   A N    1 1 
ATOM   1157 C  CA   A CYS   A 1 85  ? 7.186   12.533  -12.066 0.5 22.07 ? 775  CYS   A CA   1 1 
ATOM   1158 C  CA   B CYS   A 1 85  ? 7.405   12.441  -11.983 0.5 21.04 ? 775  CYS   A CA   1 1 
ATOM   1159 C  C    A CYS   A 1 85  ? 7.555   11.296  -11.241 0.5 23.33 ? 775  CYS   A C    1 1 
ATOM   1160 C  C    B CYS   A 1 85  ? 7.818   11.195  -11.193 0.5 22.7  ? 775  CYS   A C    1 1 
ATOM   1161 O  O    A CYS   A 1 85  ? 7.196   10.185  -11.629 0.5 22.86 ? 775  CYS   A O    1 1 
ATOM   1162 O  O    B CYS   A 1 85  ? 7.597   10.075  -11.649 0.5 22.31 ? 775  CYS   A O    1 1 
ATOM   1163 C  CB   A CYS   A 1 85  ? 5.681   12.816  -11.992 0.5 23.56 ? 775  CYS   A CB   1 1 
ATOM   1164 C  CB   B CYS   A 1 85  ? 5.959   12.824  -11.685 0.5 21.44 ? 775  CYS   A CB   1 1 
ATOM   1165 S  SG   A CYS   A 1 85  ? 5.053   13.22   -10.345 0.5 30.04 ? 775  CYS   A SG   1 1 
ATOM   1166 S  SG   B CYS   A 1 85  ? 5.542   14.535  -12.104 0.5 23.4  ? 775  CYS   A SG   1 1 
ATOM   1167 H  H    A CYS   A 1 85  ? 6.804   12.411  -14.116 0   21.14 ? 775  CYS   A H    1 1 
ATOM   1168 H  H    B CYS   A 1 85  ? 6.76    12.345  -13.977 0   20.67 ? 775  CYS   A H    1 1 
ATOM   1169 H  HA   A CYS   A 1 85  ? 7.721   13.398  -11.677 0   23.37 ? 775  CYS   A HA   1 1 
ATOM   1170 H  HA   B CYS   A 1 85  ? 8.055   13.253  -11.659 0   22.4  ? 775  CYS   A HA   1 1 
ATOM   1171 H  HB2  A CYS   A 1 85  ? 5.456   13.662  -12.641 0   24.27 ? 775  CYS   A HB2  1 1 
ATOM   1172 H  HB2  B CYS   A 1 85  ? 5.289   12.169  -12.241 0   22.3  ? 775  CYS   A HB2  1 1 
ATOM   1173 H  HB3  A CYS   A 1 85  ? 5.145   11.936  -12.342 0   24.41 ? 775  CYS   A HB3  1 1 
ATOM   1174 H  HB3  B CYS   A 1 85  ? 5.782   12.698  -10.618 0   22.67 ? 775  CYS   A HB3  1 1 
ATOM   1175 H  HG   A CYS   A 1 85  ? 3.741   13.47   -10.428 0   31.09 ? 775  CYS   A HG   1 1 
ATOM   1176 H  HG   B CYS   A 1 85  ? 5.87    14.702  -13.389 0   23.93 ? 775  CYS   A HG   1 1 
ATOM   1177 N  N    A ARG   A 1 86  ? 8.275   11.491  -10.11  0.5 24.49 ? 776  ARG   A N    1 1 
ATOM   1178 N  N    B ARG   A 1 86  ? 8.44    11.41   -10.018 0.5 24.18 ? 776  ARG   A N    1 1 
ATOM   1179 C  CA   A ARG   A 1 86  ? 8.718   10.398  -9.234  0.5 25.59 ? 776  ARG   A CA   1 1 
ATOM   1180 C  CA   B ARG   A 1 86  ? 8.911   10.337  -9.144  0.5 25.6  ? 776  ARG   A CA   1 1 
ATOM   1181 C  C    A ARG   A 1 86  ? 7.858   10.33   -7.977  0.5 26.07 ? 776  ARG   A C    1 1 
ATOM   1182 C  C    B ARG   A 1 86  ? 8.06    10.302  -7.876  0.5 26.18 ? 776  ARG   A C    1 1 
ATOM   1183 O  O    A ARG   A 1 86  ? 7.484   11.367  -7.429  0.5 25.8  ? 776  ARG   A O    1 1 
ATOM   1184 O  O    B ARG   A 1 86  ? 7.864   11.338  -7.24   0.5 26.15 ? 776  ARG   A O    1 1 
ATOM   1185 C  CB   A ARG   A 1 86  ? 10.181  10.605  -8.814  0.5 27.82 ? 776  ARG   A CB   1 1 
ATOM   1186 C  CB   B ARG   A 1 86  ? 10.37   10.579  -8.729  0.5 28.25 ? 776  ARG   A CB   1 1 
ATOM   1187 C  CG   A ARG   A 1 86  ? 11.181  10.413  -9.938  0.5 32.87 ? 776  ARG   A CG   1 1 
ATOM   1188 C  CG   B ARG   A 1 86  ? 11.439  10.027  -9.661  0.5 33.78 ? 776  ARG   A CG   1 1 
ATOM   1189 C  CD   A ARG   A 1 86  ? 12.588  10.852  -9.56   0.5 37.57 ? 776  ARG   A CD   1 1 
ATOM   1190 C  CD   B ARG   A 1 86  ? 12.805  10.347  -9.081  0.5 38.7  ? 776  ARG   A CD   1 1 
ATOM   1191 N  NE   A ARG   A 1 86  ? 13.203  10.007  -8.528  0.5 41.94 ? 776  ARG   A NE   1 1 
ATOM   1192 N  NE   B ARG   A 1 86  ? 13.925  9.737   -9.804  0.5 42.56 ? 776  ARG   A NE   1 1 
ATOM   1193 C  CZ   A ARG   A 1 86  ? 13.77   8.816   -8.733  0.5 44.86 ? 776  ARG   A CZ   1 1 
ATOM   1194 C  CZ   B ARG   A 1 86  ? 14.49   10.215  -10.912 0.5 44.94 ? 776  ARG   A CZ   1 1 
ATOM   1195 N  NH1  A ARG   A 1 86  ? 13.783  8.276   -9.947  0.5 44.67 ? 776  ARG   A NH1  1 1 
ATOM   1196 N  NH1  B ARG   A 1 86  ? 14.024  11.319  -11.485 0.5 44.97 ? 776  ARG   A NH1  1 1 
ATOM   1197 N  NH2  A ARG   A 1 86  ? 14.307  8.147   -7.72   0.5 45.33 ? 776  ARG   A NH2  1 1 
ATOM   1198 N  NH2  B ARG   A 1 86  ? 15.52   9.585   -11.463 0.5 45.14 ? 776  ARG   A NH2  1 1 
ATOM   1199 H  H    A ARG   A 1 86  ? 8.561   12.406  -9.777  0   26.42 ? 776  ARG   A H    1 1 
ATOM   1200 H  H    B ARG   A 1 86  ? 8.609   12.336  -9.636  0   26.15 ? 776  ARG   A H    1 1 
ATOM   1201 H  HA   A ARG   A 1 86  ? 8.655   9.444   -9.755  0   27.81 ? 776  ARG   A HA   1 1 
ATOM   1202 H  HA   B ARG   A 1 86  ? 8.84    9.372   -9.643  0   27.89 ? 776  ARG   A HA   1 1 
ATOM   1203 H  HB2  A ARG   A 1 86  ? 10.299  11.616  -8.427  0   30.55 ? 776  ARG   A HB2  1 1 
ATOM   1204 H  HB2  B ARG   A 1 86  ? 10.54   11.65   -8.64   0   30.99 ? 776  ARG   A HB2  1 1 
ATOM   1205 H  HB3  A ARG   A 1 86  ? 10.422  9.887   -8.032  0   30.84 ? 776  ARG   A HB3  1 1 
ATOM   1206 H  HB3  B ARG   A 1 86  ? 10.518  10.112  -7.756  0   31.34 ? 776  ARG   A HB3  1 1 
ATOM   1207 H  HG2  A ARG   A 1 86  ? 11.217  9.357   -10.201 0   35.67 ? 776  ARG   A HG2  1 1 
ATOM   1208 H  HG2  B ARG   A 1 86  ? 11.336  8.945   -9.741  0   36.77 ? 776  ARG   A HG2  1 1 
ATOM   1209 H  HG3  A ARG   A 1 86  ? 10.87   11      -10.801 0   35.26 ? 776  ARG   A HG3  1 1 
ATOM   1210 H  HG3  B ARG   A 1 86  ? 11.354  10.497  -10.64  0   36.4  ? 776  ARG   A HG3  1 1 
ATOM   1211 H  HD2  A ARG   A 1 86  ? 13.221  10.856  -10.446 0   40.84 ? 776  ARG   A HD2  1 1 
ATOM   1212 H  HD2  B ARG   A 1 86  ? 12.943  11.427  -9.044  0   42.13 ? 776  ARG   A HD2  1 1 
ATOM   1213 H  HD3  A ARG   A 1 86  ? 12.534  11.863  -9.157  0   40.81 ? 776  ARG   A HD3  1 1 
ATOM   1214 H  HD3  B ARG   A 1 86  ? 12.841  9.953   -8.067  0   42.45 ? 776  ARG   A HD3  1 1 
ATOM   1215 H  HE   A ARG   A 1 86  ? 13.232  10.385  -7.586  0   45.92 ? 776  ARG   A HE   1 1 
ATOM   1216 H  HE   B ARG   A 1 86  ? 14.326  8.9     -9.396  0   46.69 ? 776  ARG   A HE   1 1 
ATOM   1217 H  HH11 A ARG   A 1 86  ? 13.361  8.739   -10.745 0   48.14 ? 776  ARG   A HH11 1 1 
ATOM   1218 H  HH11 B ARG   A 1 86  ? 13.237  11.844  -11.119 0   48.03 ? 776  ARG   A HH11 1 1 
ATOM   1219 H  HH12 A ARG   A 1 86  ? 14.198  7.359   -10.082 0   48.82 ? 776  ARG   A HH12 1 1 
ATOM   1220 H  HH12 B ARG   A 1 86  ? 14.463  11.652  -12.337 0   48.28 ? 776  ARG   A HH12 1 1 
ATOM   1221 H  HH21 A ARG   A 1 86  ? 14.313  8.549   -6.789  0   50.13 ? 776  ARG   A HH21 1 1 
ATOM   1222 H  HH21 B ARG   A 1 86  ? 15.888  8.738   -11.042 0   49.61 ? 776  ARG   A HH21 1 1 
ATOM   1223 H  HH22 A ARG   A 1 86  ? 14.729  7.237   -7.874  0   50.23 ? 776  ARG   A HH22 1 1 
ATOM   1224 H  HH22 B ARG   A 1 86  ? 15.942  9.939   -12.316 0   49.25 ? 776  ARG   A HH22 1 1 
ATOM   1225 N  N    . LEU   A 1 87  ? 7.576   9.115   -7.507  1   26.54 ? 777  LEU   A N    1 1 
ATOM   1226 C  CA   . LEU   A 1 87  ? 6.791   8.904   -6.298  1   28.6  ? 777  LEU   A CA   1 1 
ATOM   1227 C  C    . LEU   A 1 87  ? 7.782   8.894   -5.143  1   30.26 ? 777  LEU   A C    1 1 
ATOM   1228 O  O    . LEU   A 1 87  ? 8.736   8.109   -5.177  1   30.63 ? 777  LEU   A O    1 1 
ATOM   1229 C  CB   . LEU   A 1 87  ? 6.079   7.531   -6.384  1   28.64 ? 777  LEU   A CB   1 1 
ATOM   1230 C  CG   . LEU   A 1 87  ? 5.186   7.095   -5.207  1   30.02 ? 777  LEU   A CG   1 1 
ATOM   1231 C  CD1  . LEU   A 1 87  ? 3.892   7.895   -5.149  1   30.48 ? 777  LEU   A CD1  1 1 
ATOM   1232 C  CD2  . LEU   A 1 87  ? 4.847   5.617   -5.337  1   30.22 ? 777  LEU   A CD2  1 1 
ATOM   1233 H  H    A LEU   A 1 87  ? 7.885   8.252   -7.943  0   29.23 ? 777  LEU   A H    1 1 
ATOM   1234 H  H    B LEU   A 1 87  ? 7.72    8.264   -8.042  0   29.18 ? 777  LEU   A H    1 1 
ATOM   1235 H  HA   . LEU   A 1 87  ? 6.051   9.691   -6.161  0   31.25 ? 777  LEU   A HA   1 1 
ATOM   1236 H  HB2  . LEU   A 1 87  ? 5.447   7.528   -7.271  0   31.3  ? 777  LEU   A HB2  1 1 
ATOM   1237 H  HB3  . LEU   A 1 87  ? 6.847   6.765   -6.494  0   31.82 ? 777  LEU   A HB3  1 1 
ATOM   1238 H  HG   . LEU   A 1 87  ? 5.714   7.233   -4.265  0   33.57 ? 777  LEU   A HG   1 1 
ATOM   1239 H  HD11 . LEU   A 1 87  ? 3.258   7.49    -4.361  0   33.82 ? 777  LEU   A HD11 1 1 
ATOM   1240 H  HD12 . LEU   A 1 87  ? 4.116   8.937   -4.926  0   33.38 ? 777  LEU   A HD12 1 1 
ATOM   1241 H  HD13 . LEU   A 1 87  ? 3.383   7.82    -6.109  0   33.28 ? 777  LEU   A HD13 1 1 
ATOM   1242 H  HD21 . LEU   A 1 87  ? 4.125   5.343   -4.569  0   34.05 ? 777  LEU   A HD21 1 1 
ATOM   1243 H  HD22 . LEU   A 1 87  ? 4.431   5.437   -6.327  0   33.53 ? 777  LEU   A HD22 1 1 
ATOM   1244 H  HD23 . LEU   A 1 87  ? 5.759   5.036   -5.209  0   34    ? 777  LEU   A HD23 1 1 
ATOM   1245 N  N    . LEU   A 1 88  ? 7.611   9.801   -4.164  1   31    ? 778  LEU   A N    1 1 
ATOM   1246 C  CA   . LEU   A 1 88  ? 8.453   9.839   -2.95   1   32.71 ? 778  LEU   A CA   1 1 
ATOM   1247 C  C    . LEU   A 1 88  ? 8.016   8.769   -1.937  1   33.67 ? 778  LEU   A C    1 1 
ATOM   1248 O  O    . LEU   A 1 88  ? 8.838   8.291   -1.16   1   34.32 ? 778  LEU   A O    1 1 
ATOM   1249 C  CB   . LEU   A 1 88  ? 8.401   11.216  -2.261  1   33.12 ? 778  LEU   A CB   1 1 
ATOM   1250 C  CG   . LEU   A 1 88  ? 9.073   12.392  -2.988  1   34.84 ? 778  LEU   A CG   1 1 
ATOM   1251 C  CD1  . LEU   A 1 88  ? 8.679   13.709  -2.352  1   35.1  ? 778  LEU   A CD1  1 1 
ATOM   1252 C  CD2  . LEU   A 1 88  ? 10.597  12.27   -2.977  1   35.9  ? 778  LEU   A CD2  1 1 
ATOM   1253 H  H    . LEU   A 1 88  ? 6.898   10.523  -4.184  0   34.2  ? 778  LEU   A H    1 1 
ATOM   1254 H  HA   . LEU   A 1 88  ? 9.485   9.621   -3.22   0   36.79 ? 778  LEU   A HA   1 1 
ATOM   1255 H  HB2  . LEU   A 1 88  ? 7.356   11.478  -2.105  0   36.91 ? 778  LEU   A HB2  1 1 
ATOM   1256 H  HB3  . LEU   A 1 88  ? 8.889   11.121  -1.292  0   37.49 ? 778  LEU   A HB3  1 1 
ATOM   1257 H  HG   . LEU   A 1 88  ? 8.742   12.406  -4.025  0   38.27 ? 778  LEU   A HG   1 1 
ATOM   1258 H  HD11 . LEU   A 1 88  ? 9.169   14.526  -2.881  0   38.9  ? 778  LEU   A HD11 1 1 
ATOM   1259 H  HD12 . LEU   A 1 88  ? 7.598   13.824  -2.419  0   38.71 ? 778  LEU   A HD12 1 1 
ATOM   1260 H  HD13 . LEU   A 1 88  ? 8.988   13.705  -1.308  0   39.34 ? 778  LEU   A HD13 1 1 
ATOM   1261 H  HD21 . LEU   A 1 88  ? 11.032  13.192  -3.361  0   40.05 ? 778  LEU   A HD21 1 1 
ATOM   1262 H  HD22 . LEU   A 1 88  ? 10.935  12.102  -1.955  0   40.52 ? 778  LEU   A HD22 1 1 
ATOM   1263 H  HD23 . LEU   A 1 88  ? 10.904  11.44   -3.611  0   40.11 ? 778  LEU   A HD23 1 1 
ATOM   1264 N  N    . GLY   A 1 89  ? 6.734   8.439   -1.929  1   33.43 ? 779  GLY   A N    1 1 
ATOM   1265 C  CA   . GLY   A 1 89  ? 6.172   7.438   -1.046  1   33.89 ? 779  GLY   A CA   1 1 
ATOM   1266 C  C    . GLY   A 1 89  ? 4.667   7.556   -0.964  1   34.1  ? 779  GLY   A C    1 1 
ATOM   1267 O  O    . GLY   A 1 89  ? 4.045   8.292   -1.731  1   33.69 ? 779  GLY   A O    1 1 
ATOM   1268 H  H    . GLY   A 1 89  ? 6.032   8.873   -2.521  0   37.23 ? 779  GLY   A H    1 1 
ATOM   1269 H  HA2  . GLY   A 1 89  ? 6.427   6.443   -1.409  0   38.57 ? 779  GLY   A HA2  1 1 
ATOM   1270 H  HA3  . GLY   A 1 89  ? 6.577   7.556   -0.042  0   38.79 ? 779  GLY   A HA3  1 1 
ATOM   1271 N  N    . ILE   A 1 90  ? 4.07    6.808   -0.054  1   33.6  ? 780  ILE   A N    1 1 
ATOM   1272 C  CA   . ILE   A 1 90  ? 2.632   6.85    0.169   1   34.09 ? 780  ILE   A CA   1 1 
ATOM   1273 C  C    . ILE   A 1 90  ? 2.411   7.175   1.645   1   34.63 ? 780  ILE   A C    1 1 
ATOM   1274 O  O    . ILE   A 1 90  ? 3.326   7.025   2.46    1   34.38 ? 780  ILE   A O    1 1 
ATOM   1275 C  CB   . ILE   A 1 90  ? 1.866   5.559   -0.278  1   34.5  ? 780  ILE   A CB   1 1 
ATOM   1276 C  CG1  . ILE   A 1 90  ? 2.312   4.302   0.519   1   35.86 ? 780  ILE   A CG1  1 1 
ATOM   1277 C  CG2  . ILE   A 1 90  ? 2.002   5.356   -1.801  1   35    ? 780  ILE   A CG2  1 1 
ATOM   1278 C  CD1  . ILE   A 1 90  ? 1.279   3.181   0.573   1   38    ? 780  ILE   A CD1  1 1 
ATOM   1279 H  H    . ILE   A 1 90  ? 4.569   6.178   0.566   0   38.81 ? 780  ILE   A H    1 1 
ATOM   1280 H  HA   . ILE   A 1 90  ? 2.191   7.676   -0.386  0   38.61 ? 780  ILE   A HA   1 1 
ATOM   1281 H  HB   . ILE   A 1 90  ? 0.81    5.73    -0.071  0   39.7  ? 780  ILE   A HB   1 1 
ATOM   1282 H  HG12 . ILE   A 1 90  ? 3.205   3.903   0.041   0   41.5  ? 780  ILE   A HG12 1 1 
ATOM   1283 H  HG13 . ILE   A 1 90  ? 2.545   4.562   1.55    0   41.81 ? 780  ILE   A HG13 1 1 
ATOM   1284 H  HG21 . ILE   A 1 90  ? 1.456   4.469   -2.117  0   39.83 ? 780  ILE   A HG21 1 1 
ATOM   1285 H  HG22 . ILE   A 1 90  ? 1.592   6.236   -2.295  0   39.28 ? 780  ILE   A HG22 1 1 
ATOM   1286 H  HG23 . ILE   A 1 90  ? 3.057   5.258   -2.052  0   39.57 ? 780  ILE   A HG23 1 1 
ATOM   1287 H  HD11 . ILE   A 1 90  ? 1.659   2.387   1.215   0   44.56 ? 780  ILE   A HD11 1 1 
ATOM   1288 H  HD12 . ILE   A 1 90  ? 0.351   3.578   0.984   0   44.24 ? 780  ILE   A HD12 1 1 
ATOM   1289 H  HD13 . ILE   A 1 90  ? 1.107   2.791   -0.429  0   43.89 ? 780  ILE   A HD13 1 1 
ATOM   1290 N  N    . CYS   A 1 91  ? 1.211   7.628   1.97    1   35.29 ? 781  CYS   A N    1 1 
ATOM   1291 C  CA   . CYS   A 1 91  ? 0.842   7.926   3.345   1   36.13 ? 781  CYS   A CA   1 1 
ATOM   1292 C  C    . CYS   A 1 91  ? -0.489  7.274   3.65    1   37.18 ? 781  CYS   A C    1 1 
ATOM   1293 O  O    . CYS   A 1 91  ? -1.415  7.35    2.848   1   35.98 ? 781  CYS   A O    1 1 
ATOM   1294 C  CB   . CYS   A 1 91  ? 0.787   9.428   3.591   1   36.65 ? 781  CYS   A CB   1 1 
ATOM   1295 S  SG   . CYS   A 1 91  ? 0.471   9.861   5.323   1   41.63 ? 781  CYS   A SG   1 1 
ATOM   1296 H  H    . CYS   A 1 91  ? 0.467   7.809   1.303   0   40.46 ? 781  CYS   A H    1 1 
ATOM   1297 H  HA   . CYS   A 1 91  ? 1.577   7.512   4.033   0   42.27 ? 781  CYS   A HA   1 1 
ATOM   1298 H  HB2  . CYS   A 1 91  ? 1.742   9.868   3.305   0   42.08 ? 781  CYS   A HB2  1 1 
ATOM   1299 H  HB3  . CYS   A 1 91  ? -0.012  9.856   2.988   0   42.07 ? 781  CYS   A HB3  1 1 
ATOM   1300 H  HG   . CYS   A 1 91  ? 1.479   9.396   6.07    0   48.17 ? 781  CYS   A HG   1 1 
ATOM   1301 N  N    . LEU   A 1 92  ? -0.597  6.645   4.828   1   38.87 ? 782  LEU   A N    1 1 
ATOM   1302 C  CA   . LEU   A 1 92  ? -1.829  5.989   5.254   1   40.98 ? 782  LEU   A CA   1 1 
ATOM   1303 C  C    . LEU   A 1 92  ? -2.533  6.849   6.336   1   43.19 ? 782  LEU   A C    1 1 
ATOM   1304 O  O    . LEU   A 1 92  ? -2.068  6.922   7.472   1   43.97 ? 782  LEU   A O    1 1 
ATOM   1305 C  CB   . LEU   A 1 92  ? -1.519  4.588   5.803   1   41.16 ? 782  LEU   A CB   1 1 
ATOM   1306 C  CG   . LEU   A 1 92  ? -0.582  3.681   4.975   1   43    ? 782  LEU   A CG   1 1 
ATOM   1307 C  CD1  . LEU   A 1 92  ? -0.305  2.407   5.729   1   43.74 ? 782  LEU   A CD1  1 1 
ATOM   1308 C  CD2  . LEU   A 1 92  ? -1.164  3.334   3.592   1   43.4  ? 782  LEU   A CD2  1 1 
ATOM   1309 H  H    . LEU   A 1 92  ? 0.145   6.593   5.519   0   45.91 ? 782  LEU   A H    1 1 
ATOM   1310 H  HA   . LEU   A 1 92  ? -2.519  5.87    4.42    0   48.17 ? 782  LEU   A HA   1 1 
ATOM   1311 H  HB2  . LEU   A 1 92  ? -1.056  4.697   6.783   0   49.39 ? 782  LEU   A HB2  1 1 
ATOM   1312 H  HB3  . LEU   A 1 92  ? -2.462  4.055   5.913   0   49.5  ? 782  LEU   A HB3  1 1 
ATOM   1313 H  HG   . LEU   A 1 92  ? 0.374   4.18    4.822   0   50.4  ? 782  LEU   A HG   1 1 
ATOM   1314 H  HD11 . LEU   A 1 92  ? 0.423   1.812   5.18    0   52.09 ? 782  LEU   A HD11 1 1 
ATOM   1315 H  HD12 . LEU   A 1 92  ? 0.085   2.672   6.71    0   52.41 ? 782  LEU   A HD12 1 1 
ATOM   1316 H  HD13 . LEU   A 1 92  ? -1.236  1.854   5.845   0   52.59 ? 782  LEU   A HD13 1 1 
ATOM   1317 H  HD21 . LEU   A 1 92  ? -0.549  2.556   3.143   0   50.75 ? 782  LEU   A HD21 1 1 
ATOM   1318 H  HD22 . LEU   A 1 92  ? -2.184  2.975   3.718   0   51.24 ? 782  LEU   A HD22 1 1 
ATOM   1319 H  HD23 . LEU   A 1 92  ? -1.153  4.216   2.954   0   50.36 ? 782  LEU   A HD23 1 1 
ATOM   1320 N  N    . THR   A 1 93  ? -3.612  7.542   5.953   1   43.99 ? 783  THR   A N    1 1 
ATOM   1321 C  CA   . THR   A 1 93  ? -4.434  8.404   6.835   1   45.16 ? 783  THR   A CA   1 1 
ATOM   1322 C  C    . THR   A 1 93  ? -5.881  7.81    6.732   1   45.9  ? 783  THR   A C    1 1 
ATOM   1323 O  O    . THR   A 1 93  ? -5.985  6.587   6.574   1   46.43 ? 783  THR   A O    1 1 
ATOM   1324 C  CB   . THR   A 1 93  ? -4.274  9.9     6.374   1   46.6  ? 783  THR   A CB   1 1 
ATOM   1325 O  OG1  . THR   A 1 93  ? -4.882  10.067  5.085   1   47.52 ? 783  THR   A OG1  1 1 
ATOM   1326 C  CG2  . THR   A 1 93  ? -2.844  10.348  6.326   1   47.17 ? 783  THR   A CG2  1 1 
ATOM   1327 H  H    . THR   A 1 93  ? -3.962  7.538   5       0   51.3  ? 783  THR   A H    1 1 
ATOM   1328 H  HA   . THR   A 1 93  ? -4.109  8.328   7.872   0   53.49 ? 783  THR   A HA   1 1 
ATOM   1329 H  HB   . THR   A 1 93  ? -4.791  10.536  7.091   0   54.34 ? 783  THR   A HB   1 1 
ATOM   1330 H  HG1  . THR   A 1 93  ? -4.536  9.408   4.428   0   54.6  ? 783  THR   A HG1  1 1 
ATOM   1331 H  HG21 . THR   A 1 93  ? -2.796  11.419  6.136   0   53.9  ? 783  THR   A HG21 1 1 
ATOM   1332 H  HG22 . THR   A 1 93  ? -2.374  10.135  7.285   0   54.54 ? 783  THR   A HG22 1 1 
ATOM   1333 H  HG23 . THR   A 1 93  ? -2.302  9.83    5.536   0   53.93 ? 783  THR   A HG23 1 1 
ATOM   1334 N  N    . SER   A 1 94  ? -6.992  8.613   6.775   1   45.99 ? 784  SER   A N    1 1 
ATOM   1335 C  CA   . SER   A 1 94  ? -8.327  8.06    6.535   1   46.68 ? 784  SER   A CA   1 1 
ATOM   1336 C  C    . SER   A 1 94  ? -8.385  7.41    5.116   1   46.1  ? 784  SER   A C    1 1 
ATOM   1337 O  O    . SER   A 1 94  ? -9.098  6.423   4.942   1   46.93 ? 784  SER   A O    1 1 
ATOM   1338 C  CB   . SER   A 1 94  ? -9.397  9.134   6.699   1   49.26 ? 784  SER   A CB   1 1 
ATOM   1339 O  OG   . SER   A 1 94  ? -9.287  10.142  5.71    1   53.7  ? 784  SER   A OG   1 1 
ATOM   1340 H  H    . SER   A 1 94  ? -7.004  9.603   6.994   0   54.51 ? 784  SER   A H    1 1 
ATOM   1341 H  HA   . SER   A 1 94  ? -8.521  7.278   7.267   0   56.45 ? 784  SER   A HA   1 1 
ATOM   1342 H  HB2  . SER   A 1 94  ? -10.377 8.666   6.615   0   59.2  ? 784  SER   A HB2  1 1 
ATOM   1343 H  HB3  . SER   A 1 94  ? -9.29   9.591   7.682   0   58.99 ? 784  SER   A HB3  1 1 
ATOM   1344 H  HG   . SER   A 1 94  ? -9.974  10.842  5.862   0   62.7  ? 784  SER   A HG   1 1 
ATOM   1345 N  N    . THR   A 1 95  ? -7.561  7.916   4.147   1   44.31 ? 785  THR   A N    1 1 
ATOM   1346 C  CA   . THR   A 1 95  ? -7.396  7.37    2.793   1   43.04 ? 785  THR   A CA   1 1 
ATOM   1347 C  C    . THR   A 1 95  ? -5.878  7.109   2.508   1   40.35 ? 785  THR   A C    1 1 
ATOM   1348 O  O    . THR   A 1 95  ? -5.011  7.537   3.276   1   40.49 ? 785  THR   A O    1 1 
ATOM   1349 C  CB   . THR   A 1 95  ? -7.947  8.385   1.756   1   45.33 ? 785  THR   A CB   1 1 
ATOM   1350 O  OG1  . THR   A 1 95  ? -7.135  9.563   1.79    1   46.49 ? 785  THR   A OG1  1 1 
ATOM   1351 C  CG2  . THR   A 1 95  ? -9.42   8.728   1.981   1   46.14 ? 785  THR   A CG2  1 1 
ATOM   1352 H  H    . THR   A 1 95  ? -6.998  8.75    4.274   0   51.96 ? 785  THR   A H    1 1 
ATOM   1353 H  HA   . THR   A 1 95  ? -7.934  6.43    2.682   0   51.01 ? 785  THR   A HA   1 1 
ATOM   1354 H  HB   . THR   A 1 95  ? -7.867  7.94    0.765   0   52.19 ? 785  THR   A HB   1 1 
ATOM   1355 H  HG1  . THR   A 1 95  ? -7.52   10.259  1.195   0   52.9  ? 785  THR   A HG1  1 1 
ATOM   1356 H  HG21 . THR   A 1 95  ? -9.78   9.358   1.169   0   53.55 ? 785  THR   A HG21 1 1 
ATOM   1357 H  HG22 . THR   A 1 95  ? -10.013 7.816   2.013   0   54.29 ? 785  THR   A HG22 1 1 
ATOM   1358 H  HG23 . THR   A 1 95  ? -9.547  9.267   2.919   0   54.16 ? 785  THR   A HG23 1 1 
ATOM   1359 N  N    . VAL   A 1 96  ? -5.56   6.437   1.383   1   37.58 ? 786  VAL   A N    1 1 
ATOM   1360 C  CA   . VAL   A 1 96  ? -4.178  6.221   0.962   1   35.1  ? 786  VAL   A CA   1 1 
ATOM   1361 C  C    . VAL   A 1 96  ? -3.835  7.42    0.072   1   33.02 ? 786  VAL   A C    1 1 
ATOM   1362 O  O    . VAL   A 1 96  ? -4.61   7.742   -0.835  1   33.25 ? 786  VAL   A O    1 1 
ATOM   1363 C  CB   . VAL   A 1 96  ? -4.025  4.881   0.215   1   35.66 ? 786  VAL   A CB   1 1 
ATOM   1364 C  CG1  . VAL   A 1 96  ? -2.613  4.725   -0.345  1   35.91 ? 786  VAL   A CG1  1 1 
ATOM   1365 C  CG2  . VAL   A 1 96  ? -4.392  3.711   1.133   1   35.91 ? 786  VAL   A CG2  1 1 
ATOM   1366 H  H    . VAL   A 1 96  ? -6.247  6.053   0.742   0   44.36 ? 786  VAL   A H    1 1 
ATOM   1367 H  HA   . VAL   A 1 96  ? -3.507  6.202   1.82    0   41.47 ? 786  VAL   A HA   1 1 
ATOM   1368 H  HB   . VAL   A 1 96  ? -4.715  4.868   -0.627  0   41.85 ? 786  VAL   A HB   1 1 
ATOM   1369 H  HG11 . VAL   A 1 96  ? -2.48   3.701   -0.689  0   41.86 ? 786  VAL   A HG11 1 1 
ATOM   1370 H  HG12 . VAL   A 1 96  ? -2.47   5.403   -1.185  0   41.24 ? 786  VAL   A HG12 1 1 
ATOM   1371 H  HG13 . VAL   A 1 96  ? -1.896  4.947   0.445   0   41.89 ? 786  VAL   A HG13 1 1 
ATOM   1372 H  HG21 . VAL   A 1 96  ? -4.177  2.774   0.622   0   43.1  ? 786  VAL   A HG21 1 1 
ATOM   1373 H  HG22 . VAL   A 1 96  ? -3.803  3.779   2.046   0   43.14 ? 786  VAL   A HG22 1 1 
ATOM   1374 H  HG23 . VAL   A 1 96  ? -5.454  3.755   1.372   0   43.37 ? 786  VAL   A HG23 1 1 
ATOM   1375 N  N    . GLN   A 1 97  ? -2.712  8.09    0.34    1   31.09 ? 787  GLN   A N    1 1 
ATOM   1376 C  CA   . GLN   A 1 97  ? -2.3    9.272   -0.437  1   30.9  ? 787  GLN   A CA   1 1 
ATOM   1377 C  C    . GLN   A 1 97  ? -0.949  9.035   -1.106  1   29.7  ? 787  GLN   A C    1 1 
ATOM   1378 O  O    . GLN   A 1 97  ? -0.089  8.396   -0.513  1   29.95 ? 787  GLN   A O    1 1 
ATOM   1379 C  CB   . GLN   A 1 97  ? -2.151  10.509  0.474   1   32.32 ? 787  GLN   A CB   1 1 
ATOM   1380 C  CG   . GLN   A 1 97  ? -3.098  10.594  1.667   1   35.68 ? 787  GLN   A CG   1 1 
ATOM   1381 C  CD   . GLN   A 1 97  ? -2.837  11.851  2.453   1   38.42 ? 787  GLN   A CD   1 1 
ATOM   1382 O  OE1  . GLN   A 1 97  ? -1.783  12.008  3.06    1   39.94 ? 787  GLN   A OE1  1 1 
ATOM   1383 N  NE2  . GLN   A 1 97  ? -3.768  12.786  2.455   1   38.97 ? 787  GLN   A NE2  1 1 
ATOM   1384 H  H    . GLN   A 1 97  ? -2.053  7.831   1.067   0   36.5  ? 787  GLN   A H    1 1 
ATOM   1385 H  HA   . GLN   A 1 97  ? -3.025  9.511   -1.213  0   35.4  ? 787  GLN   A HA   1 1 
ATOM   1386 H  HB2  . GLN   A 1 97  ? -1.135  10.52   0.867   0   37    ? 787  GLN   A HB2  1 1 
ATOM   1387 H  HB3  . GLN   A 1 97  ? -2.315  11.399  -0.131  0   36.72 ? 787  GLN   A HB3  1 1 
ATOM   1388 H  HG2  . GLN   A 1 97  ? -4.136  10.555  1.343   0   41.06 ? 787  GLN   A HG2  1 1 
ATOM   1389 H  HG3  . GLN   A 1 97  ? -2.897  9.765   2.344   0   41.3  ? 787  GLN   A HG3  1 1 
ATOM   1390 H  HE21 . GLN   A 1 97  ? -4.632  12.657  1.942   0   44.41 ? 787  GLN   A HE21 1 1 
ATOM   1391 H  HE22 . GLN   A 1 97  ? -3.615  13.648  2.969   0   44.46 ? 787  GLN   A HE22 1 1 
ATOM   1392 N  N    . LEU   A 1 98  ? -0.729  9.601   -2.313  1   28.48 ? 788  LEU   A N    1 1 
ATOM   1393 C  CA   . LEU   A 1 98  ? 0.573   9.479   -2.978  1   27.31 ? 788  LEU   A CA   1 1 
ATOM   1394 C  C    . LEU   A 1 98  ? 1.336   10.755  -2.73   1   25.78 ? 788  LEU   A C    1 1 
ATOM   1395 O  O    . LEU   A 1 98  ? 0.737   11.828  -2.706  1   25.37 ? 788  LEU   A O    1 1 
ATOM   1396 C  CB   . LEU   A 1 98  ? 0.424   9.26    -4.506  1   28.04 ? 788  LEU   A CB   1 1 
ATOM   1397 C  CG   . LEU   A 1 98  ? -0.558  8.189   -4.983  1   30.62 ? 788  LEU   A CG   1 1 
ATOM   1398 C  CD1  . LEU   A 1 98  ? -0.677  8.22    -6.493  1   31.57 ? 788  LEU   A CD1  1 1 
ATOM   1399 C  CD2  . LEU   A 1 98  ? -0.145  6.771   -4.522  1   31.86 ? 788  LEU   A CD2  1 1 
ATOM   1400 H  H    . LEU   A 1 98  ? -1.412  10.152  -2.822  0   32.06 ? 788  LEU   A H    1 1 
ATOM   1401 H  HA   . LEU   A 1 98  ? 1.154   8.655   -2.568  0   31    ? 788  LEU   A HA   1 1 
ATOM   1402 H  HB2  . LEU   A 1 98  ? 0.108   10.203  -4.95   0   30.83 ? 788  LEU   A HB2  1 1 
ATOM   1403 H  HB3  . LEU   A 1 98  ? 1.402   8.991   -4.903  0   30.95 ? 788  LEU   A HB3  1 1 
ATOM   1404 H  HG   . LEU   A 1 98  ? -1.538  8.406   -4.564  0   34.02 ? 788  LEU   A HG   1 1 
ATOM   1405 H  HD11 . LEU   A 1 98  ? -1.384  7.457   -6.816  0   34.52 ? 788  LEU   A HD11 1 1 
ATOM   1406 H  HD12 . LEU   A 1 98  ? -1.03   9.204   -6.798  0   34.12 ? 788  LEU   A HD12 1 1 
ATOM   1407 H  HD13 . LEU   A 1 98  ? 0.302   8.027   -6.929  0   34.18 ? 788  LEU   A HD13 1 1 
ATOM   1408 H  HD21 . LEU   A 1 98  ? -0.716  6.031   -5.08   0   35.63 ? 788  LEU   A HD21 1 1 
ATOM   1409 H  HD22 . LEU   A 1 98  ? 0.922   6.634   -4.694  0   35.33 ? 788  LEU   A HD22 1 1 
ATOM   1410 H  HD23 . LEU   A 1 98  ? -0.372  6.662   -3.463  0   35.79 ? 788  LEU   A HD23 1 1 
ATOM   1411 N  N    . ILE   A 1 99  ? 2.65    10.669  -2.567  1   25.58 ? 789  ILE   A N    1 1 
ATOM   1412 C  CA   . ILE   A 1 99  ? 3.474   11.853  -2.3    1   26.73 ? 789  ILE   A CA   1 1 
ATOM   1413 C  C    . ILE   A 1 99  ? 4.513   12.051  -3.424  1   26.77 ? 789  ILE   A C    1 1 
ATOM   1414 O  O    . ILE   A 1 99  ? 5.201   11.102  -3.786  1   27.25 ? 789  ILE   A O    1 1 
ATOM   1415 C  CB   . ILE   A 1 99  ? 4.212   11.71   -0.928  1   27.87 ? 789  ILE   A CB   1 1 
ATOM   1416 C  CG1  . ILE   A 1 99  ? 3.301   11.138  0.219   1   29.55 ? 789  ILE   A CG1  1 1 
ATOM   1417 C  CG2  . ILE   A 1 99  ? 4.866   13.04   -0.514  1   28.07 ? 789  ILE   A CG2  1 1 
ATOM   1418 C  CD1  . ILE   A 1 99  ? 2.096   11.963  0.63    1   31.21 ? 789  ILE   A CD1  1 1 
ATOM   1419 H  H    . ILE   A 1 99  ? 3.181   9.806   -2.619  0   29.02 ? 789  ILE   A H    1 1 
ATOM   1420 H  HA   . ILE   A 1 99  ? 2.852   12.747  -2.261  0   29.94 ? 789  ILE   A HA   1 1 
ATOM   1421 H  HB   . ILE   A 1 99  ? 5.018   10.99   -1.063  0   31.73 ? 789  ILE   A HB   1 1 
ATOM   1422 H  HG12 . ILE   A 1 99  ? 2.943   10.148  -0.059  0   33.74 ? 789  ILE   A HG12 1 1 
ATOM   1423 H  HG13 . ILE   A 1 99  ? 3.915   11.043  1.113   0   34.05 ? 789  ILE   A HG13 1 1 
ATOM   1424 H  HG21 . ILE   A 1 99  ? 5.217   12.944  0.512   0   32.29 ? 789  ILE   A HG21 1 1 
ATOM   1425 H  HG22 . ILE   A 1 99  ? 5.715   13.242  -1.165  0   31.74 ? 789  ILE   A HG22 1 1 
ATOM   1426 H  HG23 . ILE   A 1 99  ? 4.14    13.849  -0.591  0   31.85 ? 789  ILE   A HG23 1 1 
ATOM   1427 H  HD11 . ILE   A 1 99  ? 1.432   11.321  1.207   0   35.74 ? 789  ILE   A HD11 1 1 
ATOM   1428 H  HD12 . ILE   A 1 99  ? 2.446   12.769  1.273   0   35.43 ? 789  ILE   A HD12 1 1 
ATOM   1429 H  HD13 . ILE   A 1 99  ? 1.565   12.356  -0.236  0   35.11 ? 789  ILE   A HD13 1 1 
ATOM   1430 N  N    . THR   A 1 100 ? 4.694   13.282  -3.877  1   25.91 ? 790  THR   A N    1 1 
ATOM   1431 C  CA   . THR   A 1 100 ? 5.712   13.616  -4.869  1   26.12 ? 790  THR   A CA   1 1 
ATOM   1432 C  C    . THR   A 1 100 ? 6.241   15.016  -4.571  1   27.91 ? 790  THR   A C    1 1 
ATOM   1433 O  O    . THR   A 1 100 ? 5.638   15.762  -3.786  1   28.69 ? 790  THR   A O    1 1 
ATOM   1434 C  CB   . THR   A 1 100 ? 5.109   13.556  -6.315  1   25.85 ? 790  THR   A CB   1 1 
ATOM   1435 O  OG1  . THR   A 1 100 ? 6.171   13.563  -7.265  1   25.44 ? 790  THR   A OG1  1 1 
ATOM   1436 C  CG2  . THR   A 1 100 ? 4.188   14.738  -6.614  1   25.93 ? 790  THR   A CG2  1 1 
ATOM   1437 H  H    . THR   A 1 100 ? 4.154   14.084  -3.569  0   28.72 ? 790  THR   A H    1 1 
ATOM   1438 H  HA   . THR   A 1 100 ? 6.552   12.927  -4.791  0   28.89 ? 790  THR   A HA   1 1 
ATOM   1439 H  HB   . THR   A 1 100 ? 4.535   12.638  -6.432  0   27.97 ? 790  THR   A HB   1 1 
ATOM   1440 H  HG1  . THR   A 1 100 ? 6.734   12.752  -7.158  0   27.66 ? 790  THR   A HG1  1 1 
ATOM   1441 H  HG21 . THR   A 1 100 ? 3.69    14.576  -7.569  0   27.59 ? 790  THR   A HG21 1 1 
ATOM   1442 H  HG22 . THR   A 1 100 ? 3.431   14.794  -5.834  0   28.01 ? 790  THR   A HG22 1 1 
ATOM   1443 H  HG23 . THR   A 1 100 ? 4.735   15.678  -6.672  0   27.95 ? 790  THR   A HG23 1 1 
ATOM   1444 N  N    . GLN   A 1 101 ? 7.357   15.396  -5.208  1   28.48 ? 791  GLN   A N    1 1 
ATOM   1445 C  CA   . GLN   A 1 101 ? 7.924   16.735  -5.08   1   29.81 ? 791  GLN   A CA   1 1 
ATOM   1446 C  C    . GLN   A 1 101 ? 6.932   17.733  -5.665  1   29.03 ? 791  GLN   A C    1 1 
ATOM   1447 O  O    . GLN   A 1 101 ? 6.373   17.482  -6.744  1   28.78 ? 791  GLN   A O    1 1 
ATOM   1448 C  CB   . GLN   A 1 101 ? 9.266   16.799  -5.846  1   34.25 ? 791  GLN   A CB   1 1 
ATOM   1449 C  CG   . GLN   A 1 101 ? 9.95    18.158  -5.911  1   42.47 ? 791  GLN   A CG   1 1 
ATOM   1450 C  CD   . GLN   A 1 101 ? 11.186  18.155  -6.802  1   52.34 ? 791  GLN   A CD   1 1 
ATOM   1451 O  OE1  . GLN   A 1 101 ? 11.686  17.102  -7.245  1   54.88 ? 791  GLN   A OE1  1 1 
ATOM   1452 N  NE2  . GLN   A 1 101 ? 11.706  19.346  -7.103  1   54.04 ? 791  GLN   A NE2  1 1 
ATOM   1453 H  H    . GLN   A 1 101 ? 7.89    14.779  -5.812  0   31.16 ? 791  GLN   A H    1 1 
ATOM   1454 H  HA   . GLN   A 1 101 ? 8.101   16.966  -4.03   0   33.09 ? 791  GLN   A HA   1 1 
ATOM   1455 H  HB2  . GLN   A 1 101 ? 9.963   16.109  -5.373  0   37.58 ? 791  GLN   A HB2  1 1 
ATOM   1456 H  HB3  . GLN   A 1 101 ? 9.086   16.486  -6.873  0   36.98 ? 791  GLN   A HB3  1 1 
ATOM   1457 H  HG2  . GLN   A 1 101 ? 9.269   18.902  -6.322  0   45.56 ? 791  GLN   A HG2  1 1 
ATOM   1458 H  HG3  . GLN   A 1 101 ? 10.258  18.448  -4.908  0   46.16 ? 791  GLN   A HG3  1 1 
ATOM   1459 H  HE21 . GLN   A 1 101 ? 11.284  20.198  -6.745  0   57.82 ? 791  GLN   A HE21 1 1 
ATOM   1460 H  HE22 . GLN   A 1 101 ? 12.531  19.401  -7.691  0   57.93 ? 791  GLN   A HE22 1 1 
ATOM   1461 N  N    . LEU   A 1 102 ? 6.702   18.854  -4.971  1   28.18 ? 792  LEU   A N    1 1 
ATOM   1462 C  CA   . LEU   A 1 102 ? 5.782   19.862  -5.465  1   28.55 ? 792  LEU   A CA   1 1 
ATOM   1463 C  C    . LEU   A 1 102 ? 6.346   20.482  -6.752  1   28.4  ? 792  LEU   A C    1 1 
ATOM   1464 O  O    . LEU   A 1 102 ? 7.549   20.746  -6.825  1   28.57 ? 792  LEU   A O    1 1 
ATOM   1465 C  CB   . LEU   A 1 102 ? 5.587   20.954  -4.388  1   28.79 ? 792  LEU   A CB   1 1 
ATOM   1466 C  CG   . LEU   A 1 102 ? 4.628   22.101  -4.685  1   30.41 ? 792  LEU   A CG   1 1 
ATOM   1467 C  CD1  . LEU   A 1 102 ? 3.195   21.628  -4.816  1   31    ? 792  LEU   A CD1  1 1 
ATOM   1468 C  CD2  . LEU   A 1 102 ? 4.69    23.168  -3.569  1   31.3  ? 792  LEU   A CD2  1 1 
ATOM   1469 H  H    . LEU   A 1 102 ? 7.136   19.084  -4.083  0   31.42 ? 792  LEU   A H    1 1 
ATOM   1470 H  HA   . LEU   A 1 102 ? 4.827   19.386  -5.682  0   31.02 ? 792  LEU   A HA   1 1 
ATOM   1471 H  HB2  . LEU   A 1 102 ? 5.229   20.469  -3.482  0   32.05 ? 792  LEU   A HB2  1 1 
ATOM   1472 H  HB3  . LEU   A 1 102 ? 6.56    21.401  -4.191  0   32.2  ? 792  LEU   A HB3  1 1 
ATOM   1473 H  HG   . LEU   A 1 102 ? 4.909   22.589  -5.617  0   33.36 ? 792  LEU   A HG   1 1 
ATOM   1474 H  HD11 . LEU   A 1 102 ? 2.583   22.514  -4.966  0   33.89 ? 792  LEU   A HD11 1 1 
ATOM   1475 H  HD12 . LEU   A 1 102 ? 3.087   20.967  -5.674  0   33.51 ? 792  LEU   A HD12 1 1 
ATOM   1476 H  HD13 . LEU   A 1 102 ? 2.901   21.114  -3.902  0   34.02 ? 792  LEU   A HD13 1 1 
ATOM   1477 H  HD21 . LEU   A 1 102 ? 4.026   23.992  -3.825  0   34.94 ? 792  LEU   A HD21 1 1 
ATOM   1478 H  HD22 . LEU   A 1 102 ? 4.375   22.715  -2.63   0   35.08 ? 792  LEU   A HD22 1 1 
ATOM   1479 H  HD23 . LEU   A 1 102 ? 5.713   23.53   -3.482  0   35.17 ? 792  LEU   A HD23 1 1 
ATOM   1480 N  N    . MET   A 1 103 ? 5.483   20.66   -7.772  1   27.29 ? 793  MET   A N    1 1 
ATOM   1481 C  CA   . MET   A 1 103 ? 5.839   21.295  -9.042  1   26.72 ? 793  MET   A CA   1 1 
ATOM   1482 C  C    . MET   A 1 103 ? 5.203   22.677  -8.898  1   27.47 ? 793  MET   A C    1 1 
ATOM   1483 O  O    . MET   A 1 103 ? 3.972   22.797  -8.985  1   27.16 ? 793  MET   A O    1 1 
ATOM   1484 C  CB   . MET   A 1 103 ? 5.277   20.48   -10.221 1   26.65 ? 793  MET   A CB   1 1 
ATOM   1485 C  CG   . MET   A 1 103 ? 5.919   19.092  -10.339 1   28.16 ? 793  MET   A CG   1 1 
ATOM   1486 S  SD   . MET   A 1 103 ? 7.673   19.169  -10.816 1   31.51 ? 793  MET   A SD   1 1 
ATOM   1487 C  CE   . MET   A 1 103 ? 8.492   18.506  -9.361  1   32.56 ? 793  MET   A CE   1 1 
ATOM   1488 H  H    . MET   A 1 103 ? 4.511   20.37   -7.74   0   29.3  ? 793  MET   A H    1 1 
ATOM   1489 H  HA   . MET   A 1 103 ? 6.919   21.349  -9.164  0   28.9  ? 793  MET   A HA   1 1 
ATOM   1490 H  HB2  . MET   A 1 103 ? 4.205   20.345  -10.088 0   28.08 ? 793  MET   A HB2  1 1 
ATOM   1491 H  HB3  . MET   A 1 103 ? 5.472   21.02   -11.147 0   28.1  ? 793  MET   A HB3  1 1 
ATOM   1492 H  HG2  . MET   A 1 103 ? 5.852   18.571  -9.385  0   29.76 ? 793  MET   A HG2  1 1 
ATOM   1493 H  HG3  . MET   A 1 103 ? 5.393   18.522  -11.102 0   29.32 ? 793  MET   A HG3  1 1 
ATOM   1494 H  HE1  . MET   A 1 103 ? 9.568   18.5    -9.533  0   34.93 ? 793  MET   A HE1  1 1 
ATOM   1495 H  HE2  . MET   A 1 103 ? 8.256   19.134  -8.504  0   34.9  ? 793  MET   A HE2  1 1 
ATOM   1496 H  HE3  . MET   A 1 103 ? 8.137   17.491  -9.187  0   34.56 ? 793  MET   A HE3  1 1 
ATOM   1497 N  N    . PRO   A 1 104 ? 5.991   23.717  -8.529  1   28.32 ? 794  PRO   A N    1 1 
ATOM   1498 C  CA   . PRO   A 1 104 ? 5.365   24.996  -8.135  1   28.18 ? 794  PRO   A CA   1 1 
ATOM   1499 C  C    . PRO   A 1 104 ? 4.632   25.771  -9.205  1   27.02 ? 794  PRO   A C    1 1 
ATOM   1500 O  O    . PRO   A 1 104 ? 3.823   26.629  -8.862  1   27.5  ? 794  PRO   A O    1 1 
ATOM   1501 C  CB   . PRO   A 1 104 ? 6.526   25.823  -7.573  1   29.61 ? 794  PRO   A CB   1 1 
ATOM   1502 C  CG   . PRO   A 1 104 ? 7.756   25.181  -8.063  1   30.58 ? 794  PRO   A CG   1 1 
ATOM   1503 C  CD   . PRO   A 1 104 ? 7.453   23.741  -8.312  1   28.63 ? 794  PRO   A CD   1 1 
ATOM   1504 H  HA   . PRO   A 1 104 ? 4.665   24.809  -7.322  0   31.11 ? 794  PRO   A HA   1 1 
ATOM   1505 H  HB2  . PRO   A 1 104 ? 6.456   26.846  -7.94   0   33.31 ? 794  PRO   A HB2  1 1 
ATOM   1506 H  HB3  . PRO   A 1 104 ? 6.493   25.805  -6.485  0   33.38 ? 794  PRO   A HB3  1 1 
ATOM   1507 H  HG2  . PRO   A 1 104 ? 8.069   25.663  -8.988  0   34.06 ? 794  PRO   A HG2  1 1 
ATOM   1508 H  HG3  . PRO   A 1 104 ? 8.536   25.275  -7.308  0   34.46 ? 794  PRO   A HG3  1 1 
ATOM   1509 H  HD2  . PRO   A 1 104 ? 7.986   23.414  -9.203  0   31.46 ? 794  PRO   A HD2  1 1 
ATOM   1510 H  HD3  . PRO   A 1 104 ? 7.724   23.146  -7.441  0   31.75 ? 794  PRO   A HD3  1 1 
ATOM   1511 N  N    . PHE   A 1 105 ? 4.911   25.496  -10.481 1   24.96 ? 795  PHE   A N    1 1 
ATOM   1512 C  CA   . PHE   A 1 105 ? 4.232   26.185  -11.56  1   23.94 ? 795  PHE   A CA   1 1 
ATOM   1513 C  C    . PHE   A 1 105 ? 2.97    25.429  -12.053 1   23.75 ? 795  PHE   A C    1 1 
ATOM   1514 O  O    . PHE   A 1 105 ? 2.358   25.887  -13.007 1   24.85 ? 795  PHE   A O    1 1 
ATOM   1515 C  CB   . PHE   A 1 105 ? 5.23    26.494  -12.678 1   23.64 ? 795  PHE   A CB   1 1 
ATOM   1516 C  CG   . PHE   A 1 105 ? 6.327   27.457  -12.266 1   24.49 ? 795  PHE   A CG   1 1 
ATOM   1517 C  CD1  . PHE   A 1 105 ? 7.495   26.997  -11.689 1   25.52 ? 795  PHE   A CD1  1 1 
ATOM   1518 C  CD2  . PHE   A 1 105 ? 6.182   28.817  -12.453 1   25.85 ? 795  PHE   A CD2  1 1 
ATOM   1519 C  CE1  . PHE   A 1 105 ? 8.505   27.879  -11.311 1   26.16 ? 795  PHE   A CE1  1 1 
ATOM   1520 C  CE2  . PHE   A 1 105 ? 7.201   29.698  -12.089 1   26.83 ? 795  PHE   A CE2  1 1 
ATOM   1521 C  CZ   . PHE   A 1 105 ? 8.354   29.222  -11.521 1   26    ? 795  PHE   A CZ   1 1 
ATOM   1522 H  H    . PHE   A 1 105 ? 5.593   24.814  -10.797 0   27.28 ? 795  PHE   A H    1 1 
ATOM   1523 H  HA   . PHE   A 1 105 ? 3.881   27.153  -11.206 0   26.57 ? 795  PHE   A HA   1 1 
ATOM   1524 H  HB2  . PHE   A 1 105 ? 5.729   25.568  -12.956 0   25.73 ? 795  PHE   A HB2  1 1 
ATOM   1525 H  HB3  . PHE   A 1 105 ? 4.712   26.918  -13.537 0   25.86 ? 795  PHE   A HB3  1 1 
ATOM   1526 H  HD1  . PHE   A 1 105 ? 7.626   25.94   -11.528 0   28.42 ? 795  PHE   A HD1  1 1 
ATOM   1527 H  HD2  . PHE   A 1 105 ? 5.284   29.2    -12.909 0   29.04 ? 795  PHE   A HD2  1 1 
ATOM   1528 H  HE1  . PHE   A 1 105 ? 9.411   27.503  -10.867 0   30.18 ? 795  PHE   A HE1  1 1 
ATOM   1529 H  HE2  . PHE   A 1 105 ? 7.076   30.756  -12.244 0   31.14 ? 795  PHE   A HE2  1 1 
ATOM   1530 H  HZ   . PHE   A 1 105 ? 9.132   29.906  -11.227 0   30.74 ? 795  PHE   A HZ   1 1 
ATOM   1531 N  N    . GLY   A 1 106 ? 2.593   24.301  -11.409 1   22.85 ? 796  GLY   A N    1 1 
ATOM   1532 C  CA   . GLY   A 1 106 ? 1.369   23.579  -11.726 1   22.52 ? 796  GLY   A CA   1 1 
ATOM   1533 C  C    . GLY   A 1 106 ? 1.393   22.76   -13.005 1   21.61 ? 796  GLY   A C    1 1 
ATOM   1534 O  O    . GLY   A 1 106 ? 2.453   22.274  -13.411 1   21.82 ? 796  GLY   A O    1 1 
ATOM   1535 H  H    . GLY   A 1 106 ? 3.115   23.852  -10.664 0   24.67 ? 796  GLY   A H    1 1 
ATOM   1536 H  HA2  . GLY   A 1 106 ? 1.143   22.901  -10.904 0   24    ? 796  GLY   A HA2  1 1 
ATOM   1537 H  HA3  . GLY   A 1 106 ? 0.55    24.294  -11.802 0   24.09 ? 796  GLY   A HA3  1 1 
ATOM   1538 N  N    . CYS   A 1 107 ? 0.215   22.535  -13.603 1   20.57 ? 797  CYS   A N    1 1 
ATOM   1539 C  CA   . CYS   A 1 107 ? 0.143   21.733  -14.835 1   20.38 ? 797  CYS   A CA   1 1 
ATOM   1540 C  C    . CYS   A 1 107 ? 0.365   22.578  -16.091 1   19.72 ? 797  CYS   A C    1 1 
ATOM   1541 O  O    . CYS   A 1 107 ? 0.073   23.776  -16.144 1   19.83 ? 797  CYS   A O    1 1 
ATOM   1542 C  CB   . CYS   A 1 107 ? -1.141  20.915  -14.91  1   20.99 ? 797  CYS   A CB   1 1 
ATOM   1543 S  SG   . CYS   A 1 107 ? -2.639  21.906  -15.082 1   24.03 ? 797  CYS   A SG   1 1 
ATOM   1544 H  H    . CYS   A 1 107 ? -0.68   22.882  -13.274 0   21.59 ? 797  CYS   A H    1 1 
ATOM   1545 H  HA   . CYS   A 1 107 ? 0.925   20.981  -14.813 0   20.79 ? 797  CYS   A HA   1 1 
ATOM   1546 H  HB2  . CYS   A 1 107 ? -1.081  20.251  -15.771 0   21.2  ? 797  CYS   A HB2  1 1 
ATOM   1547 H  HB3  . CYS   A 1 107 ? -1.235  20.327  -13.998 0   21.53 ? 797  CYS   A HB3  1 1 
ATOM   1548 N  N    . LEU   A 1 108 ? 0.88    21.936  -17.124 1   18.77 ? 798  LEU   A N    1 1 
ATOM   1549 C  CA   . LEU   A 1 108 ? 1.226   22.614  -18.354 1   18.43 ? 798  LEU   A CA   1 1 
ATOM   1550 C  C    . LEU   A 1 108 ? -0.001  23.153  -19.12  1   17.91 ? 798  LEU   A C    1 1 
ATOM   1551 O  O    . LEU   A 1 108 ? 0.097   24.226  -19.705 1   19.48 ? 798  LEU   A O    1 1 
ATOM   1552 C  CB   . LEU   A 1 108 ? 2.111   21.684  -19.214 1   18.37 ? 798  LEU   A CB   1 1 
ATOM   1553 C  CG   . LEU   A 1 108 ? 2.752   22.3    -20.471 1   19.36 ? 798  LEU   A CG   1 1 
ATOM   1554 C  CD1  . LEU   A 1 108 ? 3.572   23.571  -20.156 1   20.06 ? 798  LEU   A CD1  1 1 
ATOM   1555 C  CD2  . LEU   A 1 108 ? 3.648   21.272  -21.148 1   20.03 ? 798  LEU   A CD2  1 1 
ATOM   1556 H  H    . LEU   A 1 108 ? 1.056   20.936  -17.141 0   18.78 ? 798  LEU   A H    1 1 
ATOM   1557 H  HA   . LEU   A 1 108 ? 1.82    23.479  -18.065 0   18.75 ? 798  LEU   A HA   1 1 
ATOM   1558 H  HB2  . LEU   A 1 108 ? 2.918   21.302  -18.59  0   18.29 ? 798  LEU   A HB2  1 1 
ATOM   1559 H  HB3  . LEU   A 1 108 ? 1.489   20.856  -19.55  0   18.03 ? 798  LEU   A HB3  1 1 
ATOM   1560 H  HG   . LEU   A 1 108 ? 1.965   22.573  -21.174 0   19.11 ? 798  LEU   A HG   1 1 
ATOM   1561 H  HD11 . LEU   A 1 108 ? 4.145   23.838  -21.043 0   20.28 ? 798  LEU   A HD11 1 1 
ATOM   1562 H  HD12 . LEU   A 1 108 ? 2.908   24.399  -19.909 0   20.41 ? 798  LEU   A HD12 1 1 
ATOM   1563 H  HD13 . LEU   A 1 108 ? 4.253   23.368  -19.331 0   20.38 ? 798  LEU   A HD13 1 1 
ATOM   1564 H  HD21 . LEU   A 1 108 ? 4.068   21.7    -22.057 0   19.72 ? 798  LEU   A HD21 1 1 
ATOM   1565 H  HD22 . LEU   A 1 108 ? 4.444   20.993  -20.46  0   19.81 ? 798  LEU   A HD22 1 1 
ATOM   1566 H  HD23 . LEU   A 1 108 ? 3.056   20.39   -21.389 0   19.48 ? 798  LEU   A HD23 1 1 
ATOM   1567 N  N    . LEU   A 1 109 ? -1.178  22.505  -19.022 1   17.73 ? 799  LEU   A N    1 1 
ATOM   1568 C  CA   . LEU   A 1 109 ? -2.39   23.004  -19.681 1   18.42 ? 799  LEU   A CA   1 1 
ATOM   1569 C  C    . LEU   A 1 109 ? -2.769  24.383  -19.103 1   18.69 ? 799  LEU   A C    1 1 
ATOM   1570 O  O    . LEU   A 1 109 ? -3.001  25.312  -19.866 1   18.52 ? 799  LEU   A O    1 1 
ATOM   1571 C  CB   . LEU   A 1 109 ? -3.563  22.008  -19.497 1   18.58 ? 799  LEU   A CB   1 1 
ATOM   1572 C  CG   . LEU   A 1 109 ? -4.921  22.454  -20.071 1   19.99 ? 799  LEU   A CG   1 1 
ATOM   1573 C  CD1  . LEU   A 1 109 ? -4.85   22.628  -21.575 1   20.44 ? 799  LEU   A CD1  1 1 
ATOM   1574 C  CD2  . LEU   A 1 109 ? -6.016  21.452  -19.69  1   21.26 ? 799  LEU   A CD2  1 1 
ATOM   1575 H  H    . LEU   A 1 109 ? -1.323  21.638  -18.514 0   17.71 ? 799  LEU   A H    1 1 
ATOM   1576 H  HA   . LEU   A 1 109 ? -2.169  23.125  -20.74  0   18.41 ? 799  LEU   A HA   1 1 
ATOM   1577 H  HB2  . LEU   A 1 109 ? -3.296  21.069  -19.98  0   18.48 ? 799  LEU   A HB2  1 1 
ATOM   1578 H  HB3  . LEU   A 1 109 ? -3.704  21.838  -18.431 0   18.85 ? 799  LEU   A HB3  1 1 
ATOM   1579 H  HG   . LEU   A 1 109 ? -5.214  23.41   -19.64  0   20.61 ? 799  LEU   A HG   1 1 
ATOM   1580 H  HD11 . LEU   A 1 109 ? -5.861  22.688  -21.975 0   20.83 ? 799  LEU   A HD11 1 1 
ATOM   1581 H  HD12 . LEU   A 1 109 ? -4.321  23.548  -21.819 0   20.61 ? 799  LEU   A HD12 1 1 
ATOM   1582 H  HD13 . LEU   A 1 109 ? -4.332  21.773  -22.007 0   20.38 ? 799  LEU   A HD13 1 1 
ATOM   1583 H  HD21 . LEU   A 1 109 ? -6.973  21.81   -20.066 0   21.97 ? 799  LEU   A HD21 1 1 
ATOM   1584 H  HD22 . LEU   A 1 109 ? -5.78   20.486  -20.134 0   21.53 ? 799  LEU   A HD22 1 1 
ATOM   1585 H  HD23 . LEU   A 1 109 ? -6.052  21.364  -18.605 0   21.91 ? 799  LEU   A HD23 1 1 
ATOM   1586 N  N    . ASP   A 1 110 ? -2.827  24.512  -17.765 1   19.17 ? 800  ASP   A N    1 1 
ATOM   1587 C  CA   . ASP   A 1 110 ? -3.111  25.813  -17.151 1   20.51 ? 800  ASP   A CA   1 1 
ATOM   1588 C  C    . ASP   A 1 110 ? -2.014  26.818  -17.488 1   21.04 ? 800  ASP   A C    1 1 
ATOM   1589 O  O    . ASP   A 1 110 ? -2.33   27.965  -17.765 1   21.63 ? 800  ASP   A O    1 1 
ATOM   1590 C  CB   . ASP   A 1 110 ? -3.167  25.697  -15.622 1   22.78 ? 800  ASP   A CB   1 1 
ATOM   1591 C  CG   . ASP   A 1 110 ? -4.373  24.979  -15.06  1   27.42 ? 800  ASP   A CG   1 1 
ATOM   1592 O  OD1  . ASP   A 1 110 ? -5.258  24.602  -15.847 1   28.41 ? 800  ASP   A OD1  1 1 
ATOM   1593 O  OD2  . ASP   A 1 110 ? -4.454  24.846  -13.832 1   29.23 ? 800  ASP   A OD2  1 1 
ATOM   1594 H  H    . ASP   A 1 110 ? -2.69   23.755  -17.102 0   19.84 ? 800  ASP   A H    1 1 
ATOM   1595 H  HA   . ASP   A 1 110 ? -4.059  26.201  -17.52  0   21.82 ? 800  ASP   A HA   1 1 
ATOM   1596 H  HB2  . ASP   A 1 110 ? -2.28   25.167  -15.277 0   24.01 ? 800  ASP   A HB2  1 1 
ATOM   1597 H  HB3  . ASP   A 1 110 ? -3.168  26.703  -15.204 0   24.49 ? 800  ASP   A HB3  1 1 
ATOM   1598 N  N    . TYR   A 1 111 ? -0.731  26.393  -17.442 1   20.35 ? 801  TYR   A N    1 1 
ATOM   1599 C  CA   . TYR   A 1 111 ? 0.404   27.288  -17.693 1   21.08 ? 801  TYR   A CA   1 1 
ATOM   1600 C  C    . TYR   A 1 111 ? 0.35    27.941  -19.082 1   21.73 ? 801  TYR   A C    1 1 
ATOM   1601 O  O    . TYR   A 1 111 ? 0.579   29.154  -19.206 1   22.3  ? 801  TYR   A O    1 1 
ATOM   1602 C  CB   . TYR   A 1 111 ? 1.739   26.529  -17.505 1   20.87 ? 801  TYR   A CB   1 1 
ATOM   1603 C  CG   . TYR   A 1 111 ? 2.936   27.45   -17.425 1   22.4  ? 801  TYR   A CG   1 1 
ATOM   1604 C  CD1  . TYR   A 1 111 ? 3.626   27.829  -18.571 1   23.9  ? 801  TYR   A CD1  1 1 
ATOM   1605 C  CD2  . TYR   A 1 111 ? 3.305   28.039  -16.219 1   23.92 ? 801  TYR   A CD2  1 1 
ATOM   1606 C  CE1  . TYR   A 1 111 ? 4.668   28.749  -18.516 1   25.27 ? 801  TYR   A CE1  1 1 
ATOM   1607 C  CE2  . TYR   A 1 111 ? 4.367   28.93   -16.146 1   25.1  ? 801  TYR   A CE2  1 1 
ATOM   1608 C  CZ   . TYR   A 1 111 ? 5.033   29.299  -17.299 1   26.64 ? 801  TYR   A CZ   1 1 
ATOM   1609 O  OH   . TYR   A 1 111 ? 6.058   30.203  -17.226 1   29.4  ? 801  TYR   A OH   1 1 
ATOM   1610 H  H    . TYR   A 1 111 ? -0.451  25.441  -17.229 0   21.21 ? 801  TYR   A H    1 1 
ATOM   1611 H  HA   . TYR   A 1 111 ? 0.37    28.088  -16.956 0   22.73 ? 801  TYR   A HA   1 1 
ATOM   1612 H  HB2  . TYR   A 1 111 ? 1.703   25.958  -16.578 0   21.99 ? 801  TYR   A HB2  1 1 
ATOM   1613 H  HB3  . TYR   A 1 111 ? 1.889   25.858  -18.35  0   21.71 ? 801  TYR   A HB3  1 1 
ATOM   1614 H  HD1  . TYR   A 1 111 ? 3.329   27.424  -19.524 0   25.16 ? 801  TYR   A HD1  1 1 
ATOM   1615 H  HD2  . TYR   A 1 111 ? 2.779   27.77   -15.319 0   25.86 ? 801  TYR   A HD2  1 1 
ATOM   1616 H  HE1  . TYR   A 1 111 ? 5.191   29.017  -19.419 0   27.37 ? 801  TYR   A HE1  1 1 
ATOM   1617 H  HE2  . TYR   A 1 111 ? 4.641   29.366  -15.2   0   27.83 ? 801  TYR   A HE2  1 1 
ATOM   1618 H  HH   . TYR   A 1 111 ? 6.597   30.191  -18.058 0   32.39 ? 801  TYR   A HH   1 1 
ATOM   1619 N  N    . VAL   A 1 112 ? 0.056   27.15   -20.132 1   20.76 ? 802  VAL   A N    1 1 
ATOM   1620 C  CA   . VAL   A 1 112 ? -0.003  27.688  -21.49  1   20.44 ? 802  VAL   A CA   1 1 
ATOM   1621 C  C    . VAL   A 1 112 ? -1.202  28.644  -21.675 1   22.15 ? 802  VAL   A C    1 1 
ATOM   1622 O  O    . VAL   A 1 112 ? -1.099  29.599  -22.449 1   22.63 ? 802  VAL   A O    1 1 
ATOM   1623 C  CB   . VAL   A 1 112 ? 0.075   26.615  -22.625 1   20.19 ? 802  VAL   A CB   1 1 
ATOM   1624 C  CG1  . VAL   A 1 112 ? 1.377   25.812  -22.541 1   20.16 ? 802  VAL   A CG1  1 1 
ATOM   1625 C  CG2  . VAL   A 1 112 ? -1.151  25.694  -22.648 1   19.23 ? 802  VAL   A CG2  1 1 
ATOM   1626 H  H    . VAL   A 1 112 ? -0.143  26.158  -20.043 0   21.41 ? 802  VAL   A H    1 1 
ATOM   1627 H  HA   . VAL   A 1 112 ? 0.884   28.303  -21.631 0   21.56 ? 802  VAL   A HA   1 1 
ATOM   1628 H  HB   . VAL   A 1 112 ? 0.104   27.147  -23.574 0   20.75 ? 802  VAL   A HB   1 1 
ATOM   1629 H  HG11 . VAL   A 1 112 ? 1.449   25.163  -23.412 0   20.21 ? 802  VAL   A HG11 1 1 
ATOM   1630 H  HG12 . VAL   A 1 112 ? 2.219   26.503  -22.52  0   20.7  ? 802  VAL   A HG12 1 1 
ATOM   1631 H  HG13 . VAL   A 1 112 ? 1.366   25.212  -21.632 0   20.44 ? 802  VAL   A HG13 1 1 
ATOM   1632 H  HG21 . VAL   A 1 112 ? -0.974  24.899  -23.37  0   19.25 ? 802  VAL   A HG21 1 1 
ATOM   1633 H  HG22 . VAL   A 1 112 ? -1.3    25.269  -21.656 0   19.48 ? 802  VAL   A HG22 1 1 
ATOM   1634 H  HG23 . VAL   A 1 112 ? -2.031  26.262  -22.946 0   19.7  ? 802  VAL   A HG23 1 1 
ATOM   1635 N  N    . ARG   A 1 113 ? -2.329  28.395  -20.981 1   23.45 ? 803  ARG   A N    1 1 
ATOM   1636 C  CA   . ARG   A 1 113 ? -3.487  29.29   -21.085 1   25.07 ? 803  ARG   A CA   1 1 
ATOM   1637 C  C    . ARG   A 1 113 ? -3.182  30.625  -20.367 1   27.35 ? 803  ARG   A C    1 1 
ATOM   1638 O  O    . ARG   A 1 113 ? -3.544  31.695  -20.868 1   27.89 ? 803  ARG   A O    1 1 
ATOM   1639 C  CB   . ARG   A 1 113 ? -4.731  28.652  -20.445 1   25.84 ? 803  ARG   A CB   1 1 
ATOM   1640 C  CG   . ARG   A 1 113 ? -5.274  27.46   -21.226 1   26.28 ? 803  ARG   A CG   1 1 
ATOM   1641 C  CD   . ARG   A 1 113 ? -6.34   26.718  -20.453 1   26.41 ? 803  ARG   A CD   1 1 
ATOM   1642 N  NE   . ARG   A 1 113 ? -6.991  25.702  -21.276 1   25.83 ? 803  ARG   A NE   1 1 
ATOM   1643 C  CZ   . ARG   A 1 113 ? -7.853  24.787  -20.84  1   27.08 ? 803  ARG   A CZ   1 1 
ATOM   1644 N  NH1  . ARG   A 1 113 ? -8.164  24.713  -19.546 1   25.61 ? 803  ARG   A NH1  1 1 
ATOM   1645 N  NH2  . ARG   A 1 113 ? -8.404  23.927  -21.691 1   27.53 ? 803  ARG   A NH2  1 1 
ATOM   1646 H  H    . ARG   A 1 113 ? -2.462  27.608  -20.354 0   24.58 ? 803  ARG   A H    1 1 
ATOM   1647 H  HA   . ARG   A 1 113 ? -3.709  29.495  -22.131 0   26.72 ? 803  ARG   A HA   1 1 
ATOM   1648 H  HB2  . ARG   A 1 113 ? -4.485  28.313  -19.439 0   27.56 ? 803  ARG   A HB2  1 1 
ATOM   1649 H  HB3  . ARG   A 1 113 ? -5.52   29.401  -20.396 0   27.95 ? 803  ARG   A HB3  1 1 
ATOM   1650 H  HG2  . ARG   A 1 113 ? -5.692  27.801  -22.172 0   27.7  ? 803  ARG   A HG2  1 1 
ATOM   1651 H  HG3  . ARG   A 1 113 ? -4.453  26.766  -21.392 0   27.29 ? 803  ARG   A HG3  1 1 
ATOM   1652 H  HD2  . ARG   A 1 113 ? -5.877  26.224  -19.6   0   27.78 ? 803  ARG   A HD2  1 1 
ATOM   1653 H  HD3  . ARG   A 1 113 ? -7.098  27.423  -20.116 0   28.29 ? 803  ARG   A HD3  1 1 
ATOM   1654 H  HE   . ARG   A 1 113 ? -6.793  25.722  -22.272 0   26.93 ? 803  ARG   A HE   1 1 
ATOM   1655 H  HH11 . ARG   A 1 113 ? -7.779  25.347  -18.853 0   27.31 ? 803  ARG   A HH11 1 1 
ATOM   1656 H  HH12 . ARG   A 1 113 ? -8.817  24.001  -19.233 0   27.31 ? 803  ARG   A HH12 1 1 
ATOM   1657 H  HH21 . ARG   A 1 113 ? -8.171  23.961  -22.678 0   28.6  ? 803  ARG   A HH21 1 1 
ATOM   1658 H  HH22 . ARG   A 1 113 ? -9.048  23.217  -21.356 0   28.9  ? 803  ARG   A HH22 1 1 
ATOM   1659 N  N    . GLU   A 1 114 ? -2.51   30.548  -19.211 1   28.5  ? 804  GLU   A N    1 1 
ATOM   1660 C  CA   . GLU   A 1 114 ? -2.226  31.723  -18.389 1   30.12 ? 804  GLU   A CA   1 1 
ATOM   1661 C  C    . GLU   A 1 114 ? -1.075  32.591  -18.911 1   31.66 ? 804  GLU   A C    1 1 
ATOM   1662 O  O    . GLU   A 1 114 ? -1.117  33.805  -18.709 1   32.91 ? 804  GLU   A O    1 1 
ATOM   1663 C  CB   . GLU   A 1 114 ? -1.986  31.289  -16.927 1   32.94 ? 804  GLU   A CB   1 1 
ATOM   1664 C  CG   . GLU   A 1 114 ? -3.262  30.771  -16.268 1   39.99 ? 804  GLU   A CG   1 1 
ATOM   1665 C  CD   . GLU   A 1 114 ? -3.124  29.985  -14.977 1   50.02 ? 804  GLU   A CD   1 1 
ATOM   1666 O  OE1  . GLU   A 1 114 ? -2.008  29.94   -14.409 1   52.66 ? 804  GLU   A OE1  1 1 
ATOM   1667 O  OE2  . GLU   A 1 114 ? -4.143  29.405  -14.536 1   51.72 ? 804  GLU   A OE2  1 1 
ATOM   1668 H  H    . GLU   A 1 114 ? -2.147  29.685  -18.819 0   30.48 ? 804  GLU   A H    1 1 
ATOM   1669 H  HA   . GLU   A 1 114 ? -3.11   32.36   -18.399 0   33.26 ? 804  GLU   A HA   1 1 
ATOM   1670 H  HB2  . GLU   A 1 114 ? -1.234  30.501  -16.898 0   35.46 ? 804  GLU   A HB2  1 1 
ATOM   1671 H  HB3  . GLU   A 1 114 ? -1.641  32.15   -16.357 0   36.2  ? 804  GLU   A HB3  1 1 
ATOM   1672 H  HG2  . GLU   A 1 114 ? -3.893  31.63   -16.047 0   43.28 ? 804  GLU   A HG2  1 1 
ATOM   1673 H  HG3  . GLU   A 1 114 ? -3.784  30.121  -16.969 0   42.56 ? 804  GLU   A HG3  1 1 
ATOM   1674 N  N    . HIS   A 1 115 ? -0.065  32.01   -19.587 1   30.78 ? 805  HIS   A N    1 1 
ATOM   1675 C  CA   . HIS   A 1 115 ? 1.105   32.778  -20.035 1   30.82 ? 805  HIS   A CA   1 1 
ATOM   1676 C  C    . HIS   A 1 115 ? 1.262   32.859  -21.549 1   32.05 ? 805  HIS   A C    1 1 
ATOM   1677 O  O    . HIS   A 1 115 ? 2.371   33.097  -22.018 1   31.99 ? 805  HIS   A O    1 1 
ATOM   1678 C  CB   . HIS   A 1 115 ? 2.375   32.183  -19.406 1   30.05 ? 805  HIS   A CB   1 1 
ATOM   1679 C  CG   . HIS   A 1 115 ? 2.323   32.113  -17.914 1   31.65 ? 805  HIS   A CG   1 1 
ATOM   1680 N  ND1  . HIS   A 1 115 ? 1.833   31      -17.258 1   33.15 ? 805  HIS   A ND1  1 1 
ATOM   1681 C  CD2  . HIS   A 1 115 ? 2.683   33.036  -16.995 1   32.78 ? 805  HIS   A CD2  1 1 
ATOM   1682 C  CE1  . HIS   A 1 115 ? 1.919   31.277  -15.964 1   33.88 ? 805  HIS   A CE1  1 1 
ATOM   1683 N  NE2  . HIS   A 1 115 ? 2.439   32.485  -15.762 1   34.12 ? 805  HIS   A NE2  1 1 
ATOM   1684 H  H    . HIS   A 1 115 ? -0.016  31.026  -19.833 0   33.08 ? 805  HIS   A H    1 1 
ATOM   1685 H  HA   . HIS   A 1 115 ? 1.04    33.803  -19.677 0   34.37 ? 805  HIS   A HA   1 1 
ATOM   1686 H  HB2  . HIS   A 1 115 ? 2.514   31.167  -19.769 0   32.56 ? 805  HIS   A HB2  1 1 
ATOM   1687 H  HB3  . HIS   A 1 115 ? 3.237   32.796  -19.667 0   33.34 ? 805  HIS   A HB3  1 1 
ATOM   1688 H  HD2  . HIS   A 1 115 ? 3.085   34.016  -17.192 0   36.96 ? 805  HIS   A HD2  1 1 
ATOM   1689 H  HE1  . HIS   A 1 115 ? 1.607   30.61   -15.178 0   36.76 ? 805  HIS   A HE1  1 1 
ATOM   1690 H  HE2  . HIS   A 1 115 ? 2.622   32.919  -14.864 0   38.11 ? 805  HIS   A HE2  1 1 
ATOM   1691 N  N    . LYS   A 1 116 ? 0.168   32.725  -22.307 1   33.01 ? 806  LYS   A N    1 1 
ATOM   1692 C  CA   . LYS   A 1 116 ? 0.187   32.782  -23.775 1   35.51 ? 806  LYS   A CA   1 1 
ATOM   1693 C  C    . LYS   A 1 116 ? 1.011   33.967  -24.337 1   37.69 ? 806  LYS   A C    1 1 
ATOM   1694 O  O    . LYS   A 1 116 ? 1.774   33.794  -25.293 1   38.83 ? 806  LYS   A O    1 1 
ATOM   1695 C  CB   . LYS   A 1 116 ? -1.26   32.862  -24.3   1   37.96 ? 806  LYS   A CB   1 1 
ATOM   1696 C  CG   . LYS   A 1 116 ? -1.374  32.987  -25.818 1   44.1  ? 806  LYS   A CG   1 1 
ATOM   1697 C  CD   . LYS   A 1 116 ? -2.81   33.103  -26.284 1   50.08 ? 806  LYS   A CD   1 1 
ATOM   1698 C  CE   . LYS   A 1 116 ? -2.93   32.996  -27.79  1   54.8  ? 806  LYS   A CE   1 1 
ATOM   1699 N  NZ   . LYS   A 1 116 ? -2.206  34.078  -28.522 1   58.2  ? 806  LYS   A NZ   1 1 
ATOM   1700 H  H    . LYS   A 1 116 ? -0.762  32.58   -21.927 0   35.72 ? 806  LYS   A H    1 1 
ATOM   1701 H  HA   . LYS   A 1 116 ? 0.628   31.862  -24.157 0   37.74 ? 806  LYS   A HA   1 1 
ATOM   1702 H  HB2  . LYS   A 1 116 ? -1.791  31.96   -24     0   40.24 ? 806  LYS   A HB2  1 1 
ATOM   1703 H  HB3  . LYS   A 1 116 ? -1.741  33.734  -23.859 0   41.01 ? 806  LYS   A HB3  1 1 
ATOM   1704 H  HG2  . LYS   A 1 116 ? -0.859  33.882  -26.163 0   47.03 ? 806  LYS   A HG2  1 1 
ATOM   1705 H  HG3  . LYS   A 1 116 ? -0.941  32.102  -26.281 0   46.25 ? 806  LYS   A HG3  1 1 
ATOM   1706 H  HD2  . LYS   A 1 116 ? -3.395  32.299  -25.84  0   52.47 ? 806  LYS   A HD2  1 1 
ATOM   1707 H  HD3  . LYS   A 1 116 ? -3.208  34.069  -25.98  0   53.21 ? 806  LYS   A HD3  1 1 
ATOM   1708 H  HE2  . LYS   A 1 116 ? -2.514  32.041  -28.108 0   56.88 ? 806  LYS   A HE2  1 1 
ATOM   1709 H  HE3  . LYS   A 1 116 ? -3.982  33.051  -28.066 0   57.45 ? 806  LYS   A HE3  1 1 
ATOM   1710 H  HZ1  . LYS   A 1 116 ? -2.562  34.145  -29.471 0   61.06 ? 806  LYS   A HZ1  1 1 
ATOM   1711 H  HZ2  . LYS   A 1 116 ? -2.335  34.97   -28.055 0   61.62 ? 806  LYS   A HZ2  1 1 
ATOM   1712 H  HZ3  . LYS   A 1 116 ? -1.214  33.871  -28.577 0   61.08 ? 806  LYS   A HZ3  1 1 
ATOM   1713 N  N    . ASP   A 1 117 ? 0.879   35.149  -23.72  1   37.94 ? 807  ASP   A N    1 1 
ATOM   1714 C  CA   . ASP   A 1 117 ? 1.565   36.359  -24.174 1   38.88 ? 807  ASP   A CA   1 1 
ATOM   1715 C  C    . ASP   A 1 117 ? 3.091   36.366  -23.954 1   37.37 ? 807  ASP   A C    1 1 
ATOM   1716 O  O    . ASP   A 1 117 ? 3.747   37.239  -24.511 1   37.91 ? 807  ASP   A O    1 1 
ATOM   1717 C  CB   . ASP   A 1 117 ? 0.916   37.603  -23.533 1   42.58 ? 807  ASP   A CB   1 1 
ATOM   1718 C  CG   . ASP   A 1 117 ? -0.555  37.75   -23.897 1   50.27 ? 807  ASP   A CG   1 1 
ATOM   1719 O  OD1  . ASP   A 1 117 ? -0.907  37.495  -25.069 1   51.08 ? 807  ASP   A OD1  1 1 
ATOM   1720 O  OD2  . ASP   A 1 117 ? -1.359  38.1    -23     1   54.51 ? 807  ASP   A OD2  1 1 
ATOM   1721 H  H    . ASP   A 1 117 ? 0.311   35.293  -22.891 0   41.85 ? 807  ASP   A H    1 1 
ATOM   1722 H  HA   . ASP   A 1 117 ? 1.42    36.44   -25.25  0   43.25 ? 807  ASP   A HA   1 1 
ATOM   1723 H  HB2  . ASP   A 1 117 ? 0.991   37.527  -22.45  0   47.78 ? 807  ASP   A HB2  1 1 
ATOM   1724 H  HB3  . ASP   A 1 117 ? 1.436   38.495  -23.88  0   48.25 ? 807  ASP   A HB3  1 1 
ATOM   1725 N  N    . ASN   A 1 118 ? 3.665   35.418  -23.19  1   35.4  ? 808  ASN   A N    1 1 
ATOM   1726 C  CA   . ASN   A 1 118 ? 5.127   35.343  -23.023 1   33.87 ? 808  ASN   A CA   1 1 
ATOM   1727 C  C    . ASN   A 1 118 ? 5.716   33.971  -23.398 1   30.89 ? 808  ASN   A C    1 1 
ATOM   1728 O  O    . ASN   A 1 118 ? 6.917   33.755  -23.184 1   30.91 ? 808  ASN   A O    1 1 
ATOM   1729 C  CB   . ASN   A 1 118 ? 5.546   35.762  -21.598 1   36.69 ? 808  ASN   A CB   1 1 
ATOM   1730 C  CG   . ASN   A 1 118 ? 5.771   37.257  -21.456 1   42.13 ? 808  ASN   A CG   1 1 
ATOM   1731 O  OD1  . ASN   A 1 118 ? 6.735   37.819  -22.009 1   42.35 ? 808  ASN   A OD1  1 1 
ATOM   1732 N  ND2  . ASN   A 1 118 ? 4.877   37.939  -20.742 1   44.45 ? 808  ASN   A ND2  1 1 
ATOM   1733 H  H    . ASN   A 1 118 ? 3.166   34.708  -22.665 0   39.27 ? 808  ASN   A H    1 1 
ATOM   1734 H  HA   . ASN   A 1 118 ? 5.597   36.02   -23.734 0   38.81 ? 808  ASN   A HA   1 1 
ATOM   1735 H  HB2  . ASN   A 1 118 ? 4.764   35.455  -20.906 0   41.4  ? 808  ASN   A HB2  1 1 
ATOM   1736 H  HB3  . ASN   A 1 118 ? 6.479   35.274  -21.321 0   41.62 ? 808  ASN   A HB3  1 1 
ATOM   1737 H  HD21 . ASN   A 1 118 ? 4.992   38.94   -20.623 0   51.24 ? 808  ASN   A HD21 1 1 
ATOM   1738 H  HD22 . ASN   A 1 118 ? 4.08    37.475  -20.317 0   50.21 ? 808  ASN   A HD22 1 1 
ATOM   1739 N  N    . ILE   A 1 119 ? 4.936   33.091  -24.052 1   28.18 ? 809  ILE   A N    1 1 
ATOM   1740 C  CA   . ILE   A 1 119 ? 5.462   31.783  -24.442 1   26.57 ? 809  ILE   A CA   1 1 
ATOM   1741 C  C    . ILE   A 1 119 ? 6.033   31.889  -25.859 1   26.47 ? 809  ILE   A C    1 1 
ATOM   1742 O  O    . ILE   A 1 119 ? 5.278   32.052  -26.805 1   26.75 ? 809  ILE   A O    1 1 
ATOM   1743 C  CB   . ILE   A 1 119 ? 4.373   30.675  -24.289 1   25.48 ? 809  ILE   A CB   1 1 
ATOM   1744 C  CG1  . ILE   A 1 119 ? 4.102   30.407  -22.787 1   25.02 ? 809  ILE   A CG1  1 1 
ATOM   1745 C  CG2  . ILE   A 1 119 ? 4.833   29.378  -24.975 1   25.34 ? 809  ILE   A CG2  1 1 
ATOM   1746 C  CD1  . ILE   A 1 119 ? 2.828   29.74   -22.491 1   26.1  ? 809  ILE   A CD1  1 1 
ATOM   1747 H  H    . ILE   A 1 119 ? 3.974   33.243  -24.334 0   31.34 ? 809  ILE   A H    1 1 
ATOM   1748 H  HA   . ILE   A 1 119 ? 6.285   31.505  -23.785 0   29.43 ? 809  ILE   A HA   1 1 
ATOM   1749 H  HB   . ILE   A 1 119 ? 3.452   31.01   -24.763 0   27.56 ? 809  ILE   A HB   1 1 
ATOM   1750 H  HG12 . ILE   A 1 119 ? 4.896   29.772  -22.398 0   27.03 ? 809  ILE   A HG12 1 1 
ATOM   1751 H  HG13 . ILE   A 1 119 ? 4.099   31.352  -22.245 0   27.54 ? 809  ILE   A HG13 1 1 
ATOM   1752 H  HG21 . ILE   A 1 119 ? 4.137   28.563  -24.785 0   26.58 ? 809  ILE   A HG21 1 1 
ATOM   1753 H  HG22 . ILE   A 1 119 ? 4.867   29.547  -26.049 0   27.01 ? 809  ILE   A HG22 1 1 
ATOM   1754 H  HG23 . ILE   A 1 119 ? 5.822   29.114  -24.605 0   27.05 ? 809  ILE   A HG23 1 1 
ATOM   1755 H  HD11 . ILE   A 1 119 ? 2.766   29.611  -21.412 0   27.82 ? 809  ILE   A HD11 1 1 
ATOM   1756 H  HD12 . ILE   A 1 119 ? 2.011   30.369  -22.84  0   27.9  ? 809  ILE   A HD12 1 1 
ATOM   1757 H  HD13 . ILE   A 1 119 ? 2.773   28.76   -22.961 0   27.38 ? 809  ILE   A HD13 1 1 
ATOM   1758 N  N    . GLY   A 1 120 ? 7.359   31.852  -25.98  1   25.51 ? 810  GLY   A N    1 1 
ATOM   1759 C  CA   . GLY   A 1 120 ? 8.019   31.911  -27.276 1   24.81 ? 810  GLY   A CA   1 1 
ATOM   1760 C  C    . GLY   A 1 120 ? 8.19    30.533  -27.898 1   23.58 ? 810  GLY   A C    1 1 
ATOM   1761 O  O    . GLY   A 1 120 ? 7.942   29.506  -27.248 1   23.12 ? 810  GLY   A O    1 1 
ATOM   1762 H  H    . GLY   A 1 120 ? 8.009   31.786  -25.203 0   28.86 ? 810  GLY   A H    1 1 
ATOM   1763 H  HA2  . GLY   A 1 120 ? 7.461   32.54   -27.968 0   28.22 ? 810  GLY   A HA2  1 1 
ATOM   1764 H  HA3  . GLY   A 1 120 ? 9.008   32.347  -27.15  0   28.65 ? 810  GLY   A HA3  1 1 
ATOM   1765 N  N    . SER   A 1 121 ? 8.676   30.511  -29.139 1   22.98 ? 811  SER   A N    1 1 
ATOM   1766 C  CA   . SER   A 1 121 ? 8.892   29.278  -29.898 1   22.55 ? 811  SER   A CA   1 1 
ATOM   1767 C  C    . SER   A 1 121 ? 9.906   28.352  -29.223 1   21.92 ? 811  SER   A C    1 1 
ATOM   1768 O  O    . SER   A 1 121 ? 9.723   27.139  -29.301 1   21.74 ? 811  SER   A O    1 1 
ATOM   1769 C  CB   . SER   A 1 121 ? 9.356   29.595  -31.318 1   23.25 ? 811  SER   A CB   1 1 
ATOM   1770 O  OG   . SER   A 1 121 ? 10.539  30.385  -31.296 1   24.59 ? 811  SER   A OG   1 1 
ATOM   1771 H  H    . SER   A 1 121 ? 8.935   31.347  -29.653 0   26.28 ? 811  SER   A H    1 1 
ATOM   1772 H  HA   . SER   A 1 121 ? 7.948   28.741  -29.97  0   24.48 ? 811  SER   A HA   1 1 
ATOM   1773 H  HB2  . SER   A 1 121 ? 9.553   28.665  -31.848 0   25.65 ? 811  SER   A HB2  1 1 
ATOM   1774 H  HB3  . SER   A 1 121 ? 8.571   30.158  -31.82  0   25.9  ? 811  SER   A HB3  1 1 
ATOM   1775 H  HG   . SER   A 1 121 ? 10.315  31.351  -31.231 0   28.34 ? 811  SER   A HG   1 1 
ATOM   1776 N  N    . GLN   A 1 122 ? 10.971  28.888  -28.573 1   21.77 ? 812  GLN   A N    1 1 
ATOM   1777 C  CA   . GLN   A 1 122 ? 11.966  28.025  -27.934 1   22.26 ? 812  GLN   A CA   1 1 
ATOM   1778 C  C    . GLN   A 1 122 ? 11.329  27.221  -26.805 1   22.09 ? 812  GLN   A C    1 1 
ATOM   1779 O  O    . GLN   A 1 122 ? 11.631  26.045  -26.679 1   23.1  ? 812  GLN   A O    1 1 
ATOM   1780 C  CB   . GLN   A 1 122 ? 13.154  28.839  -27.366 1   25.05 ? 812  GLN   A CB   1 1 
ATOM   1781 C  CG   . GLN   A 1 122 ? 14.318  27.989  -26.84  1   29.66 ? 812  GLN   A CG   1 1 
ATOM   1782 C  CD   . GLN   A 1 122 ? 15.097  27.374  -27.982 1   36.97 ? 812  GLN   A CD   1 1 
ATOM   1783 O  OE1  . GLN   A 1 122 ? 15.86   28.06   -28.675 1   40.64 ? 812  GLN   A OE1  1 1 
ATOM   1784 N  NE2  . GLN   A 1 122 ? 14.933  26.081  -28.225 1   36.78 ? 812  GLN   A NE2  1 1 
ATOM   1785 H  H    . GLN   A 1 122 ? 11.17   29.88   -28.487 0   25.26 ? 812  GLN   A H    1 1 
ATOM   1786 H  HA   . GLN   A 1 122 ? 12.348  27.329  -28.678 0   25.27 ? 812  GLN   A HA   1 1 
ATOM   1787 H  HB2  . GLN   A 1 122 ? 13.543  29.482  -28.153 0   29.44 ? 812  GLN   A HB2  1 1 
ATOM   1788 H  HB3  . GLN   A 1 122 ? 12.794  29.45   -26.54  0   29.14 ? 812  GLN   A HB3  1 1 
ATOM   1789 H  HG2  . GLN   A 1 122 ? 14.998  28.639  -26.293 0   34.48 ? 812  GLN   A HG2  1 1 
ATOM   1790 H  HG3  . GLN   A 1 122 ? 13.961  27.201  -26.179 0   33.43 ? 812  GLN   A HG3  1 1 
ATOM   1791 H  HE21 . GLN   A 1 122 ? 14.299  25.523  -27.662 0   40.12 ? 812  GLN   A HE21 1 1 
ATOM   1792 H  HE22 . GLN   A 1 122 ? 15.446  25.647  -28.985 0   40.7  ? 812  GLN   A HE22 1 1 
ATOM   1793 N  N    . TYR   A 1 123 ? 10.443  27.832  -26     1   21.41 ? 813  TYR   A N    1 1 
ATOM   1794 C  CA   . TYR   A 1 123 ? 9.786   27.099  -24.908 1   22.49 ? 813  TYR   A CA   1 1 
ATOM   1795 C  C    . TYR   A 1 123 ? 8.894   25.958  -25.42  1   21.03 ? 813  TYR   A C    1 1 
ATOM   1796 O  O    . TYR   A 1 123 ? 8.952   24.845  -24.875 1   20.79 ? 813  TYR   A O    1 1 
ATOM   1797 C  CB   . TYR   A 1 123 ? 8.933   28.038  -24.044 1   24.23 ? 813  TYR   A CB   1 1 
ATOM   1798 C  CG   . TYR   A 1 123 ? 9.752   28.826  -23.059 1   27.61 ? 813  TYR   A CG   1 1 
ATOM   1799 C  CD1  . TYR   A 1 123 ? 10.009  28.333  -21.793 1   29.93 ? 813  TYR   A CD1  1 1 
ATOM   1800 C  CD2  . TYR   A 1 123 ? 10.391  29.995  -23.44  1   30.33 ? 813  TYR   A CD2  1 1 
ATOM   1801 C  CE1  . TYR   A 1 123 ? 10.795  29.03   -20.893 1   31.96 ? 813  TYR   A CE1  1 1 
ATOM   1802 C  CE2  . TYR   A 1 123 ? 11.206  30.692  -22.558 1   32.26 ? 813  TYR   A CE2  1 1 
ATOM   1803 C  CZ   . TYR   A 1 123 ? 11.395  30.211  -21.278 1   33.86 ? 813  TYR   A CZ   1 1 
ATOM   1804 O  OH   . TYR   A 1 123 ? 12.194  30.881  -20.379 1   37.6  ? 813  TYR   A OH   1 1 
ATOM   1805 H  H    . TYR   A 1 123 ? 10.185  28.812  -26.061 0   24.19 ? 813  TYR   A H    1 1 
ATOM   1806 H  HA   . TYR   A 1 123 ? 10.561  26.642  -24.293 0   24.78 ? 813  TYR   A HA   1 1 
ATOM   1807 H  HB2  . TYR   A 1 123 ? 8.392   28.738  -24.679 0   26.48 ? 813  TYR   A HB2  1 1 
ATOM   1808 H  HB3  . TYR   A 1 123 ? 8.223   27.438  -23.477 0   26.07 ? 813  TYR   A HB3  1 1 
ATOM   1809 H  HD1  . TYR   A 1 123 ? 9.536   27.418  -21.479 0   32.35 ? 813  TYR   A HD1  1 1 
ATOM   1810 H  HD2  . TYR   A 1 123 ? 10.243  30.377  -24.436 0   33.86 ? 813  TYR   A HD2  1 1 
ATOM   1811 H  HE1  . TYR   A 1 123 ? 10.95   28.645  -19.899 0   35.48 ? 813  TYR   A HE1  1 1 
ATOM   1812 H  HE2  . TYR   A 1 123 ? 11.662  31.616  -22.87  0   37.01 ? 813  TYR   A HE2  1 1 
ATOM   1813 H  HH   . TYR   A 1 123 ? 12.426  31.782  -20.726 0   42.79 ? 813  TYR   A HH   1 1 
ATOM   1814 N  N    . LEU   A 1 124 ? 8.036   26.254  -26.397 1   20.2  ? 814  LEU   A N    1 1 
ATOM   1815 C  CA   . LEU   A 1 124 ? 7.099   25.262  -26.938 1   19.25 ? 814  LEU   A CA   1 1 
ATOM   1816 C  C    . LEU   A 1 124 ? 7.829   24.048  -27.509 1   18.37 ? 814  LEU   A C    1 1 
ATOM   1817 O  O    . LEU   A 1 124 ? 7.501   22.908  -27.154 1   17.32 ? 814  LEU   A O    1 1 
ATOM   1818 C  CB   . LEU   A 1 124 ? 6.179   25.894  -28.007 1   19.52 ? 814  LEU   A CB   1 1 
ATOM   1819 C  CG   . LEU   A 1 124 ? 5.063   26.805  -27.452 1   20.64 ? 814  LEU   A CG   1 1 
ATOM   1820 C  CD1  . LEU   A 1 124 ? 4.547   27.764  -28.522 1   21.46 ? 814  LEU   A CD1  1 1 
ATOM   1821 C  CD2  . LEU   A 1 124 ? 3.918   25.978  -26.834 1   20.87 ? 814  LEU   A CD2  1 1 
ATOM   1822 H  H    . LEU   A 1 124 ? 7.973   27.168  -26.835 0   21.67 ? 814  LEU   A H    1 1 
ATOM   1823 H  HA   . LEU   A 1 124 ? 6.495   24.914  -26.101 0   19.72 ? 814  LEU   A HA   1 1 
ATOM   1824 H  HB2  . LEU   A 1 124 ? 6.792   26.481  -28.69  0   20.4  ? 814  LEU   A HB2  1 1 
ATOM   1825 H  HB3  . LEU   A 1 124 ? 5.7     25.089  -28.562 0   19.77 ? 814  LEU   A HB3  1 1 
ATOM   1826 H  HG   . LEU   A 1 124 ? 5.477   27.419  -26.652 0   21.61 ? 814  LEU   A HG   1 1 
ATOM   1827 H  HD11 . LEU   A 1 124 ? 3.758   28.384  -28.097 0   22.41 ? 814  LEU   A HD11 1 1 
ATOM   1828 H  HD12 . LEU   A 1 124 ? 5.37    28.392  -28.858 0   22.66 ? 814  LEU   A HD12 1 1 
ATOM   1829 H  HD13 . LEU   A 1 124 ? 4.156   27.186  -29.358 0   22.04 ? 814  LEU   A HD13 1 1 
ATOM   1830 H  HD21 . LEU   A 1 124 ? 3.095   26.651  -26.598 0   21.25 ? 814  LEU   A HD21 1 1 
ATOM   1831 H  HD22 . LEU   A 1 124 ? 3.589   25.23   -27.553 0   20.87 ? 814  LEU   A HD22 1 1 
ATOM   1832 H  HD23 . LEU   A 1 124 ? 4.256   25.492  -25.92  0   21.06 ? 814  LEU   A HD23 1 1 
ATOM   1833 N  N    . LEU   A 1 125 ? 8.884   24.296  -28.297 1   17.85 ? 815  LEU   A N    1 1 
ATOM   1834 C  CA   . LEU   A 1 125 ? 9.637   23.187  -28.891 1   17.86 ? 815  LEU   A CA   1 1 
ATOM   1835 C  C    . LEU   A 1 125 ? 10.434  22.42   -27.833 1   17.91 ? 815  LEU   A C    1 1 
ATOM   1836 O  O    . LEU   A 1 125 ? 10.471  21.19   -27.895 1   17.46 ? 815  LEU   A O    1 1 
ATOM   1837 C  CB   . LEU   A 1 125 ? 10.544  23.694  -30.023 1   17.68 ? 815  LEU   A CB   1 1 
ATOM   1838 C  CG   . LEU   A 1 125 ? 9.763   24.32   -31.23  1   17.57 ? 815  LEU   A CG   1 1 
ATOM   1839 C  CD1  . LEU   A 1 125 ? 10.69   25.166  -32.11  1   17.84 ? 815  LEU   A CD1  1 1 
ATOM   1840 C  CD2  . LEU   A 1 125 ? 9.051   23.242  -32.086 1   16.96 ? 815  LEU   A CD2  1 1 
ATOM   1841 H  H    . LEU   A 1 125 ? 9.242   25.222  -28.51  0   19.03 ? 815  LEU   A H    1 1 
ATOM   1842 H  HA   . LEU   A 1 125 ? 8.917   22.493  -29.322 0   18.26 ? 815  LEU   A HA   1 1 
ATOM   1843 H  HB2  . LEU   A 1 125 ? 11.207  24.46   -29.623 0   19.32 ? 815  LEU   A HB2  1 1 
ATOM   1844 H  HB3  . LEU   A 1 125 ? 11.132  22.86   -30.403 0   18.88 ? 815  LEU   A HB3  1 1 
ATOM   1845 H  HG   . LEU   A 1 125 ? 8.991   24.991  -30.855 0   18.57 ? 815  LEU   A HG   1 1 
ATOM   1846 H  HD11 . LEU   A 1 125 ? 10.13   25.548  -32.962 0   19.41 ? 815  LEU   A HD11 1 1 
ATOM   1847 H  HD12 . LEU   A 1 125 ? 11.06   25.995  -31.511 0   19.88 ? 815  LEU   A HD12 1 1 
ATOM   1848 H  HD13 . LEU   A 1 125 ? 11.52   24.548  -32.452 0   19.61 ? 815  LEU   A HD13 1 1 
ATOM   1849 H  HD21 . LEU   A 1 125 ? 8.666   23.707  -32.992 0   17.51 ? 815  LEU   A HD21 1 1 
ATOM   1850 H  HD22 . LEU   A 1 125 ? 9.77    22.465  -32.342 0   17.62 ? 815  LEU   A HD22 1 1 
ATOM   1851 H  HD23 . LEU   A 1 125 ? 8.221   22.813  -31.527 0   17.21 ? 815  LEU   A HD23 1 1 
ATOM   1852 N  N    . ASN   A 1 126 ? 11.025  23.111  -26.83  1   18.99 ? 816  ASN   A N    1 1 
ATOM   1853 C  CA   . ASN   A 1 126 ? 11.738  22.404  -25.766 1   19.28 ? 816  ASN   A CA   1 1 
ATOM   1854 C  C    . ASN   A 1 126 ? 10.747  21.508  -24.966 1   17.8  ? 816  ASN   A C    1 1 
ATOM   1855 O  O    . ASN   A 1 126 ? 11.115  20.386  -24.611 1   17.01 ? 816  ASN   A O    1 1 
ATOM   1856 C  CB   . ASN   A 1 126 ? 12.469  23.377  -24.833 1   22.45 ? 816  ASN   A CB   1 1 
ATOM   1857 C  CG   . ASN   A 1 126 ? 13.759  23.95   -25.411 1   29    ? 816  ASN   A CG   1 1 
ATOM   1858 O  OD1  . ASN   A 1 126 ? 14.108  23.746  -26.565 1   31.97 ? 816  ASN   A OD1  1 1 
ATOM   1859 N  ND2  . ASN   A 1 126 ? 14.487  24.711  -24.615 1   31.15 ? 816  ASN   A ND2  1 1 
ATOM   1860 H  H    . ASN   A 1 126 ? 11.04   24.122  -26.748 0   20.55 ? 816  ASN   A H    1 1 
ATOM   1861 H  HA   . ASN   A 1 126 ? 12.48   21.743  -26.214 0   20.89 ? 816  ASN   A HA   1 1 
ATOM   1862 H  HB2  . ASN   A 1 126 ? 11.809  24.209  -24.592 0   24.45 ? 816  ASN   A HB2  1 1 
ATOM   1863 H  HB3  . ASN   A 1 126 ? 12.73   22.845  -23.92  0   24.53 ? 816  ASN   A HB3  1 1 
ATOM   1864 H  HD21 . ASN   A 1 126 ? 15.354  25.114  -24.959 0   35.02 ? 816  ASN   A HD21 1 1 
ATOM   1865 H  HD22 . ASN   A 1 126 ? 14.188  24.896  -23.663 0   34.45 ? 816  ASN   A HD22 1 1 
ATOM   1866 N  N    . TRP   A 1 127 ? 9.49    21.964  -24.735 1   16.87 ? 817  TRP   A N    1 1 
ATOM   1867 C  CA   . TRP   A 1 127 ? 8.512   21.122  -24.023 1   16.6  ? 817  TRP   A CA   1 1 
ATOM   1868 C  C    . TRP   A 1 127 ? 8.194   19.873  -24.837 1   15.78 ? 817  TRP   A C    1 1 
ATOM   1869 O  O    . TRP   A 1 127 ? 8.13    18.781  -24.267 1   15.3  ? 817  TRP   A O    1 1 
ATOM   1870 C  CB   . TRP   A 1 127 ? 7.221   21.887  -23.716 1   16.69 ? 817  TRP   A CB   1 1 
ATOM   1871 C  CG   . TRP   A 1 127 ? 7.42    23.033  -22.753 1   17.93 ? 817  TRP   A CG   1 1 
ATOM   1872 C  CD1  . TRP   A 1 127 ? 8.312   23.104  -21.713 1   19.36 ? 817  TRP   A CD1  1 1 
ATOM   1873 C  CD2  . TRP   A 1 127 ? 6.628   24.217  -22.682 1   18.16 ? 817  TRP   A CD2  1 1 
ATOM   1874 N  NE1  . TRP   A 1 127 ? 8.169   24.3    -21.054 1   19.67 ? 817  TRP   A NE1  1 1 
ATOM   1875 C  CE2  . TRP   A 1 127 ? 7.141   25.003  -21.625 1   19.21 ? 817  TRP   A CE2  1 1 
ATOM   1876 C  CE3  . TRP   A 1 127 ? 5.563   24.714  -23.436 1   18.9  ? 817  TRP   A CE3  1 1 
ATOM   1877 C  CZ2  . TRP   A 1 127 ? 6.593   26.241  -21.288 1   19.83 ? 817  TRP   A CZ2  1 1 
ATOM   1878 C  CZ3  . TRP   A 1 127 ? 5.053   25.958  -23.13  1   20.07 ? 817  TRP   A CZ3  1 1 
ATOM   1879 C  CH2  . TRP   A 1 127 ? 5.546   26.695  -22.052 1   19.79 ? 817  TRP   A CH2  1 1 
ATOM   1880 H  H    . TRP   A 1 127 ? 9.135   22.872  -25.015 0   17.59 ? 817  TRP   A H    1 1 
ATOM   1881 H  HA   . TRP   A 1 127 ? 8.95    20.799  -23.079 0   17.02 ? 817  TRP   A HA   1 1 
ATOM   1882 H  HB2  . TRP   A 1 127 ? 6.827   22.294  -24.646 0   16.71 ? 817  TRP   A HB2  1 1 
ATOM   1883 H  HB3  . TRP   A 1 127 ? 6.5     21.201  -23.276 0   16.55 ? 817  TRP   A HB3  1 1 
ATOM   1884 H  HD1  . TRP   A 1 127 ? 9.057   22.367  -21.466 0   20.23 ? 817  TRP   A HD1  1 1 
ATOM   1885 H  HE1  . TRP   A 1 127 ? 8.729   24.609  -20.233 0   21.11 ? 817  TRP   A HE1  1 1 
ATOM   1886 H  HE3  . TRP   A 1 127 ? 5.169   24.15   -24.265 0   19.03 ? 817  TRP   A HE3  1 1 
ATOM   1887 H  HZ2  . TRP   A 1 127 ? 6.989   26.826  -20.474 0   21.43 ? 817  TRP   A HZ2  1 1 
ATOM   1888 H  HZ3  . TRP   A 1 127 ? 4.222   26.343  -23.698 0   20.7  ? 817  TRP   A HZ3  1 1 
ATOM   1889 H  HH2  . TRP   A 1 127 ? 5.116   27.658  -21.835 0   21.12 ? 817  TRP   A HH2  1 1 
ATOM   1890 N  N    . CYS   A 1 128 ? 8.085   20.025  -26.168 1   14.45 ? 818  CYS   A N    1 1 
ATOM   1891 C  CA   . CYS   A 1 128 ? 7.864   18.863  -27.054 1   14.56 ? 818  CYS   A CA   1 1 
ATOM   1892 C  C    . CYS   A 1 128 ? 9.036   17.872  -26.941 1   14.28 ? 818  CYS   A C    1 1 
ATOM   1893 O  O    . CYS   A 1 128 ? 8.816   16.661  -26.823 1   14.67 ? 818  CYS   A O    1 1 
ATOM   1894 C  CB   . CYS   A 1 128 ? 7.653   19.336  -28.488 1   16.09 ? 818  CYS   A CB   1 1 
ATOM   1895 S  SG   . CYS   A 1 128 ? 6.123   20.276  -28.696 1   18.27 ? 818  CYS   A SG   1 1 
ATOM   1896 H  H    . CYS   A 1 128 ? 8.113   20.913  -26.658 0   14.42 ? 818  CYS   A H    1 1 
ATOM   1897 H  HA   . CYS   A 1 128 ? 6.965   18.341  -26.731 0   13.92 ? 818  CYS   A HA   1 1 
ATOM   1898 H  HB2  . CYS   A 1 128 ? 8.487   19.972  -28.783 0   15.93 ? 818  CYS   A HB2  1 1 
ATOM   1899 H  HB3  . CYS   A 1 128 ? 7.602   18.466  -29.141 0   15.51 ? 818  CYS   A HB3  1 1 
ATOM   1900 H  HG   . CYS   A 1 128 ? 6.016   20.656  -29.974 0   17.61 ? 818  CYS   A HG   1 1 
ATOM   1901 N  N    . VAL   A 1 129 ? 10.262  18.374  -26.921 1   14.13 ? 819  VAL   A N    1 1 
ATOM   1902 C  CA   . VAL   A 1 129 ? 11.448  17.51   -26.772 1   14.74 ? 819  VAL   A CA   1 1 
ATOM   1903 C  C    . VAL   A 1 129 ? 11.385  16.759  -25.421 1   14.26 ? 819  VAL   A C    1 1 
ATOM   1904 O  O    . VAL   A 1 129 ? 11.525  15.535  -25.376 1   14.66 ? 819  VAL   A O    1 1 
ATOM   1905 C  CB   . VAL   A 1 129 ? 12.768  18.342  -26.89  1   15.26 ? 819  VAL   A CB   1 1 
ATOM   1906 C  CG1  . VAL   A 1 129 ? 13.988  17.518  -26.441 1   16.64 ? 819  VAL   A CG1  1 1 
ATOM   1907 C  CG2  . VAL   A 1 129 ? 12.956  18.868  -28.322 1   15.51 ? 819  VAL   A CG2  1 1 
ATOM   1908 H  H    . VAL   A 1 129 ? 10.47   19.366  -26.989 0   14.54 ? 819  VAL   A H    1 1 
ATOM   1909 H  HA   . VAL   A 1 129 ? 11.446  16.767  -27.568 0   15.19 ? 819  VAL   A HA   1 1 
ATOM   1910 H  HB   . VAL   A 1 129 ? 12.698  19.204  -26.228 0   16.5  ? 819  VAL   A HB   1 1 
ATOM   1911 H  HG11 . VAL   A 1 129 ? 14.896  17.975  -26.831 0   18.71 ? 819  VAL   A HG11 1 1 
ATOM   1912 H  HG12 . VAL   A 1 129 ? 14.042  17.512  -25.354 0   18.19 ? 819  VAL   A HG12 1 1 
ATOM   1913 H  HG13 . VAL   A 1 129 ? 13.897  16.501  -26.82  0   18.16 ? 819  VAL   A HG13 1 1 
ATOM   1914 H  HG21 . VAL   A 1 129 ? 13.934  19.341  -28.393 0   17.22 ? 819  VAL   A HG21 1 1 
ATOM   1915 H  HG22 . VAL   A 1 129 ? 12.88   18.039  -29.023 0   16.64 ? 819  VAL   A HG22 1 1 
ATOM   1916 H  HG23 . VAL   A 1 129 ? 12.184  19.61   -28.519 0   16.48 ? 819  VAL   A HG23 1 1 
ATOM   1917 N  N    . GLN   A 1 130 ? 11.108  17.496  -24.35  1   13.55 ? 820  GLN   A N    1 1 
ATOM   1918 C  CA   . GLN   A 1 130 ? 11.111  16.931  -23.011 1   15.14 ? 820  GLN   A CA   1 1 
ATOM   1919 C  C    . GLN   A 1 130 ? 10.051  15.87   -22.796 1   15.04 ? 820  GLN   A C    1 1 
ATOM   1920 O  O    . GLN   A 1 130 ? 10.332  14.833  -22.176 1   16.57 ? 820  GLN   A O    1 1 
ATOM   1921 C  CB   . GLN   A 1 130 ? 10.998  18.063  -21.973 1   17.5  ? 820  GLN   A CB   1 1 
ATOM   1922 C  CG   . GLN   A 1 130 ? 12.263  18.965  -21.941 1   21.18 ? 820  GLN   A CG   1 1 
ATOM   1923 C  CD   . GLN   A 1 130 ? 12.11   20.135  -21.006 1   24.38 ? 820  GLN   A CD   1 1 
ATOM   1924 O  OE1  . GLN   A 1 130 ? 11.344  20.088  -20.048 1   24.31 ? 820  GLN   A OE1  1 1 
ATOM   1925 N  NE2  . GLN   A 1 130 ? 12.88   21.194  -21.231 1   26.95 ? 820  GLN   A NE2  1 1 
ATOM   1926 H  H    . GLN   A 1 130 ? 10.862  18.479  -24.389 0   14.13 ? 820  GLN   A H    1 1 
ATOM   1927 H  HA   . GLN   A 1 130 ? 12.079  16.452  -22.867 0   16.08 ? 820  GLN   A HA   1 1 
ATOM   1928 H  HB2  . GLN   A 1 130 ? 10.135  18.687  -22.203 0   18.04 ? 820  GLN   A HB2  1 1 
ATOM   1929 H  HB3  . GLN   A 1 130 ? 10.879  17.618  -20.987 0   18.29 ? 820  GLN   A HB3  1 1 
ATOM   1930 H  HG2  . GLN   A 1 130 ? 13.112  18.372  -21.603 0   22.83 ? 820  GLN   A HG2  1 1 
ATOM   1931 H  HG3  . GLN   A 1 130 ? 12.454  19.355  -22.94  0   22.57 ? 820  GLN   A HG3  1 1 
ATOM   1932 H  HE21 . GLN   A 1 130 ? 13.542  21.201  -22     0   29.17 ? 820  GLN   A HE21 1 1 
ATOM   1933 H  HE22 . GLN   A 1 130 ? 12.808  22.004  -20.623 0   29.19 ? 820  GLN   A HE22 1 1 
ATOM   1934 N  N    . ILE   A 1 131 ? 8.834   16.097  -23.31  1   13.81 ? 821  ILE   A N    1 1 
ATOM   1935 C  CA   . ILE   A 1 131 ? 7.76    15.109  -23.168 1   13.98 ? 821  ILE   A CA   1 1 
ATOM   1936 C  C    . ILE   A 1 131 ? 8.154   13.854  -23.968 1   13.71 ? 821  ILE   A C    1 1 
ATOM   1937 O  O    . ILE   A 1 131 ? 7.964   12.746  -23.467 1   13.56 ? 821  ILE   A O    1 1 
ATOM   1938 C  CB   . ILE   A 1 131 ? 6.373   15.7    -23.624 1   14.02 ? 821  ILE   A CB   1 1 
ATOM   1939 C  CG1  . ILE   A 1 131 ? 5.934   16.871  -22.682 1   14.42 ? 821  ILE   A CG1  1 1 
ATOM   1940 C  CG2  . ILE   A 1 131 ? 5.266   14.604  -23.687 1   14.63 ? 821  ILE   A CG2  1 1 
ATOM   1941 C  CD1  . ILE   A 1 131 ? 4.843   17.817  -23.28  1   16.27 ? 821  ILE   A CD1  1 1 
ATOM   1942 H  H    . ILE   A 1 131 ? 8.579   16.928  -23.835 0   13.61 ? 821  ILE   A H    1 1 
ATOM   1943 H  HA   . ILE   A 1 131 ? 7.668   14.827  -22.12  0   13.64 ? 821  ILE   A HA   1 1 
ATOM   1944 H  HB   . ILE   A 1 131 ? 6.495   16.105  -24.628 0   13.26 ? 821  ILE   A HB   1 1 
ATOM   1945 H  HG12 . ILE   A 1 131 ? 5.529   16.441  -21.767 0   13.77 ? 821  ILE   A HG12 1 1 
ATOM   1946 H  HG13 . ILE   A 1 131 ? 6.797   17.49   -22.441 0   13.98 ? 821  ILE   A HG13 1 1 
ATOM   1947 H  HG21 . ILE   A 1 131 ? 4.317   15.048  -23.981 0   13.59 ? 821  ILE   A HG21 1 1 
ATOM   1948 H  HG22 . ILE   A 1 131 ? 5.537   13.843  -24.416 0   13.73 ? 821  ILE   A HG22 1 1 
ATOM   1949 H  HG23 . ILE   A 1 131 ? 5.169   14.15   -22.701 0   13.81 ? 821  ILE   A HG23 1 1 
ATOM   1950 H  HD11 . ILE   A 1 131 ? 4.69    18.644  -22.588 0   15.56 ? 821  ILE   A HD11 1 1 
ATOM   1951 H  HD12 . ILE   A 1 131 ? 5.188   18.196  -24.241 0   15.47 ? 821  ILE   A HD12 1 1 
ATOM   1952 H  HD13 . ILE   A 1 131 ? 3.909   17.273  -23.405 0   15.3  ? 821  ILE   A HD13 1 1 
ATOM   1953 N  N    . ALA   A 1 132 ? 8.749   14.03   -25.179 1   14.24 ? 822  ALA   A N    1 1 
ATOM   1954 C  CA   . ALA   A 1 132 ? 9.169   12.872  -25.995 1   15.33 ? 822  ALA   A CA   1 1 
ATOM   1955 C  C    . ALA   A 1 132 ? 10.304  12.095  -25.275 1   16.68 ? 822  ALA   A C    1 1 
ATOM   1956 O  O    . ALA   A 1 132 ? 10.299  10.869  -25.273 1   17.05 ? 822  ALA   A O    1 1 
ATOM   1957 C  CB   . ALA   A 1 132 ? 9.612   13.333  -27.378 1   14.48 ? 822  ALA   A CB   1 1 
ATOM   1958 H  H    . ALA   A 1 132 ? 8.931   14.926  -25.62  0   13.93 ? 822  ALA   A H    1 1 
ATOM   1959 H  HA   . ALA   A 1 132 ? 8.324   12.196  -26.119 0   14.9  ? 822  ALA   A HA   1 1 
ATOM   1960 H  HB1  . ALA   A 1 132 ? 9.917   12.465  -27.96  0   14.36 ? 822  ALA   A HB1  1 1 
ATOM   1961 H  HB2  . ALA   A 1 132 ? 8.778   13.836  -27.866 0   14.01 ? 822  ALA   A HB2  1 1 
ATOM   1962 H  HB3  . ALA   A 1 132 ? 10.449  14.022  -27.27  0   14.51 ? 822  ALA   A HB3  1 1 
ATOM   1963 N  N    . LYS   A 1 133 ? 11.196  12.8    -24.568 1   17.16 ? 823  LYS   A N    1 1 
ATOM   1964 C  CA   . LYS   A 1 133 ? 12.251  12.139  -23.789 1   17.46 ? 823  LYS   A CA   1 1 
ATOM   1965 C  C    . LYS   A 1 133 ? 11.651  11.307  -22.645 1   17.4  ? 823  LYS   A C    1 1 
ATOM   1966 O  O    . LYS   A 1 133 ? 12.064  10.163  -22.454 1   18    ? 823  LYS   A O    1 1 
ATOM   1967 C  CB   . LYS   A 1 133 ? 13.27   13.166  -23.23  1   18.08 ? 823  LYS   A CB   1 1 
ATOM   1968 C  CG   . LYS   A 1 133 ? 14.274  13.648  -24.277 1   20.31 ? 823  LYS   A CG   1 1 
ATOM   1969 C  CD   . LYS   A 1 133 ? 15.229  14.752  -23.77  1   24.73 ? 823  LYS   A CD   1 1 
ATOM   1970 C  CE   . LYS   A 1 133 ? 16.35   14.973  -24.77  1   30.34 ? 823  LYS   A CE   1 1 
ATOM   1971 N  NZ   . LYS   A 1 133 ? 17.218  16.134  -24.409 1   34.29 ? 823  LYS   A NZ   1 1 
ATOM   1972 H  H    . LYS   A 1 133 ? 11.229  13.814  -24.53  0   17.59 ? 823  LYS   A H    1 1 
ATOM   1973 H  HA   . LYS   A 1 133 ? 12.781  11.452  -24.448 0   18.53 ? 823  LYS   A HA   1 1 
ATOM   1974 H  HB2  . LYS   A 1 133 ? 12.742  14.034  -22.838 0   19.19 ? 823  LYS   A HB2  1 1 
ATOM   1975 H  HB3  . LYS   A 1 133 ? 13.834  12.691  -22.429 0   19.68 ? 823  LYS   A HB3  1 1 
ATOM   1976 H  HG2  . LYS   A 1 133 ? 14.877  12.804  -24.608 0   22.19 ? 823  LYS   A HG2  1 1 
ATOM   1977 H  HG3  . LYS   A 1 133 ? 13.723  14.069  -25.116 0   21.65 ? 823  LYS   A HG3  1 1 
ATOM   1978 H  HD2  . LYS   A 1 133 ? 14.678  15.684  -23.654 0   26.65 ? 823  LYS   A HD2  1 1 
ATOM   1979 H  HD3  . LYS   A 1 133 ? 15.667  14.447  -22.82  0   27.12 ? 823  LYS   A HD3  1 1 
ATOM   1980 H  HE2  . LYS   A 1 133 ? 16.976  14.082  -24.805 0   33.24 ? 823  LYS   A HE2  1 1 
ATOM   1981 H  HE3  . LYS   A 1 133 ? 15.92   15.167  -25.751 0   32.69 ? 823  LYS   A HE3  1 1 
ATOM   1982 H  HZ1  . LYS   A 1 133 ? 17.978  16.223  -25.077 0   37.87 ? 823  LYS   A HZ1  1 1 
ATOM   1983 H  HZ2  . LYS   A 1 133 ? 16.672  16.99   -24.416 0   37.24 ? 823  LYS   A HZ2  1 1 
ATOM   1984 H  HZ3  . LYS   A 1 133 ? 17.609  16      -23.482 0   37.73 ? 823  LYS   A HZ3  1 1 
ATOM   1985 N  N    . GLY   A 1 134 ? 10.705  11.876  -21.893 1   17.1  ? 824  GLY   A N    1 1 
ATOM   1986 C  CA   . GLY   A 1 134 ? 10.058  11.157  -20.793 1   17.07 ? 824  GLY   A CA   1 1 
ATOM   1987 C  C    . GLY   A 1 134 ? 9.302   9.939   -21.297 1   16.82 ? 824  GLY   A C    1 1 
ATOM   1988 O  O    . GLY   A 1 134 ? 9.394   8.85    -20.723 1   16.34 ? 824  GLY   A O    1 1 
ATOM   1989 H  H    . GLY   A 1 134 ? 10.372  12.828  -22.007 0   17.5  ? 824  GLY   A H    1 1 
ATOM   1990 H  HA2  . GLY   A 1 134 ? 10.813  10.824  -20.082 0   17.93 ? 824  GLY   A HA2  1 1 
ATOM   1991 H  HA3  . GLY   A 1 134 ? 9.372   11.828  -20.279 0   17.42 ? 824  GLY   A HA3  1 1 
ATOM   1992 N  N    . MET   A 1 135 ? 8.588   10.104  -22.432 1   15.88 ? 825  MET   A N    1 1 
ATOM   1993 C  CA   . MET   A 1 135 ? 7.818   9.015   -23.016 1   16.11 ? 825  MET   A CA   1 1 
ATOM   1994 C  C    . MET   A 1 135 ? 8.751   7.917   -23.562 1   17.91 ? 825  MET   A C    1 1 
ATOM   1995 O  O    . MET   A 1 135 ? 8.444   6.737   -23.399 1   18.66 ? 825  MET   A O    1 1 
ATOM   1996 C  CB   . MET   A 1 135 ? 6.872   9.549   -24.121 1   15.62 ? 825  MET   A CB   1 1 
ATOM   1997 C  CG   . MET   A 1 135 ? 5.686   10.36   -23.569 1   16.53 ? 825  MET   A CG   1 1 
ATOM   1998 S  SD   . MET   A 1 135 ? 4.644   9.495   -22.352 1   19.24 ? 825  MET   A SD   1 1 
ATOM   1999 C  CE   . MET   A 1 135 ? 3.907   8.26    -23.37  1   20.11 ? 825  MET   A CE   1 1 
ATOM   2000 H  H    . MET   A 1 135 ? 8.534   10.975  -22.95  0   15.82 ? 825  MET   A H    1 1 
ATOM   2001 H  HA   . MET   A 1 135 ? 7.217   8.561   -22.23  0   16.15 ? 825  MET   A HA   1 1 
ATOM   2002 H  HB2  . MET   A 1 135 ? 7.435   10.202  -24.786 0   15.27 ? 825  MET   A HB2  1 1 
ATOM   2003 H  HB3  . MET   A 1 135 ? 6.49    8.705   -24.694 0   15.31 ? 825  MET   A HB3  1 1 
ATOM   2004 H  HG2  . MET   A 1 135 ? 6.075   11.255  -23.086 0   15.97 ? 825  MET   A HG2  1 1 
ATOM   2005 H  HG3  . MET   A 1 135 ? 5.051   10.646  -24.407 0   15.79 ? 825  MET   A HG3  1 1 
ATOM   2006 H  HE1  . MET   A 1 135 ? 3.138   7.741   -22.8   0   19.85 ? 825  MET   A HE1  1 1 
ATOM   2007 H  HE2  . MET   A 1 135 ? 3.466   8.781   -24.217 0   19.53 ? 825  MET   A HE2  1 1 
ATOM   2008 H  HE3  . MET   A 1 135 ? 4.665   7.555   -23.708 0   19.84 ? 825  MET   A HE3  1 1 
ATOM   2009 N  N    . ASN   A 1 136 ? 9.89    8.285   -24.14  1   18.04 ? 826  ASN   A N    1 1 
ATOM   2010 C  CA   . ASN   A 1 136 ? 10.855  7.295   -24.63  1   19.5  ? 826  ASN   A CA   1 1 
ATOM   2011 C  C    . ASN   A 1 136 ? 11.398  6.466   -23.454 1   20.41 ? 826  ASN   A C    1 1 
ATOM   2012 O  O    . ASN   A 1 136 ? 11.556  5.244   -23.586 1   21.24 ? 826  ASN   A O    1 1 
ATOM   2013 C  CB   . ASN   A 1 136 ? 11.995  7.98    -25.346 1   20.25 ? 826  ASN   A CB   1 1 
ATOM   2014 C  CG   . ASN   A 1 136 ? 13.006  7.026   -25.909 1   24.88 ? 826  ASN   A CG   1 1 
ATOM   2015 O  OD1  . ASN   A 1 136 ? 12.691  6.211   -26.798 1   24.79 ? 826  ASN   A OD1  1 1 
ATOM   2016 N  ND2  . ASN   A 1 136 ? 14.249  7.095   -25.405 1   26.56 ? 826  ASN   A ND2  1 1 
ATOM   2017 H  H    . ASN   A 1 136 ? 10.176  9.245   -24.307 0   18.48 ? 826  ASN   A H    1 1 
ATOM   2018 H  HA   . ASN   A 1 136 ? 10.36   6.622   -25.329 0   20.33 ? 826  ASN   A HA   1 1 
ATOM   2019 H  HB2  . ASN   A 1 136 ? 11.57   8.532   -26.183 0   21.09 ? 826  ASN   A HB2  1 1 
ATOM   2020 H  HB3  . ASN   A 1 136 ? 12.483  8.669   -24.658 0   21.49 ? 826  ASN   A HB3  1 1 
ATOM   2021 H  HD21 . ASN   A 1 136 ? 14.965  6.467   -25.757 0   29.05 ? 826  ASN   A HD21 1 1 
ATOM   2022 H  HD22 . ASN   A 1 136 ? 14.486  7.761   -24.677 0   28.68 ? 826  ASN   A HD22 1 1 
ATOM   2023 N  N    . TYR   A 1 137 ? 11.643  7.119   -22.301 1   19.55 ? 827  TYR   A N    1 1 
ATOM   2024 C  CA   . TYR   A 1 137 ? 12.08   6.419   -21.083 1   20.95 ? 827  TYR   A CA   1 1 
ATOM   2025 C  C    . TYR   A 1 137 ? 10.989  5.429   -20.649 1   21.53 ? 827  TYR   A C    1 1 
ATOM   2026 O  O    . TYR   A 1 137 ? 11.297  4.28    -20.316 1   22.71 ? 827  TYR   A O    1 1 
ATOM   2027 C  CB   . TYR   A 1 137 ? 12.372  7.426   -19.944 1   21.12 ? 827  TYR   A CB   1 1 
ATOM   2028 C  CG   . TYR   A 1 137 ? 12.607  6.739   -18.61  1   23.06 ? 827  TYR   A CG   1 1 
ATOM   2029 C  CD1  . TYR   A 1 137 ? 11.58   6.614   -17.681 1   24.37 ? 827  TYR   A CD1  1 1 
ATOM   2030 C  CD2  . TYR   A 1 137 ? 13.798  6.07    -18.352 1   25.13 ? 827  TYR   A CD2  1 1 
ATOM   2031 C  CE1  . TYR   A 1 137 ? 11.762  5.921   -16.486 1   25.91 ? 827  TYR   A CE1  1 1 
ATOM   2032 C  CE2  . TYR   A 1 137 ? 13.994  5.375   -17.159 1   26.43 ? 827  TYR   A CE2  1 1 
ATOM   2033 C  CZ   . TYR   A 1 137 ? 12.967  5.293   -16.235 1   27.83 ? 827  TYR   A CZ   1 1 
ATOM   2034 O  OH   . TYR   A 1 137 ? 13.137  4.579   -15.062 1   30.97 ? 827  TYR   A OH   1 1 
ATOM   2035 H  H    . TYR   A 1 137 ? 11.577  8.124   -22.182 0   20.74 ? 827  TYR   A H    1 1 
ATOM   2036 H  HA   . TYR   A 1 137 ? 12.99   5.859   -21.293 0   23.13 ? 827  TYR   A HA   1 1 
ATOM   2037 H  HB2  . TYR   A 1 137 ? 13.266  7.995   -20.193 0   23.14 ? 827  TYR   A HB2  1 1 
ATOM   2038 H  HB3  . TYR   A 1 137 ? 11.522  8.098   -19.83  0   22.57 ? 827  TYR   A HB3  1 1 
ATOM   2039 H  HD1  . TYR   A 1 137 ? 10.633  7.09    -17.872 0   25.98 ? 827  TYR   A HD1  1 1 
ATOM   2040 H  HD2  . TYR   A 1 137 ? 14.599  6.122   -19.07  0   28.14 ? 827  TYR   A HD2  1 1 
ATOM   2041 H  HE1  . TYR   A 1 137 ? 10.955  5.86    -15.775 0   28.18 ? 827  TYR   A HE1  1 1 
ATOM   2042 H  HE2  . TYR   A 1 137 ? 14.933  4.884   -16.968 0   30.12 ? 827  TYR   A HE2  1 1 
ATOM   2043 H  HH   . TYR   A 1 137 ? 12.517  4.906   -14.359 0   34.2  ? 827  TYR   A HH   1 1 
ATOM   2044 N  N    . LEU   A 1 138 ? 9.722   5.869   -20.648 1   20.5  ? 828  LEU   A N    1 1 
ATOM   2045 C  CA   . LEU   A 1 138 ? 8.619   5.013   -20.239 1   20.02 ? 828  LEU   A CA   1 1 
ATOM   2046 C  C    . LEU   A 1 138 ? 8.462   3.814   -21.192 1   20.28 ? 828  LEU   A C    1 1 
ATOM   2047 O  O    . LEU   A 1 138 ? 8.227   2.695   -20.725 1   20.84 ? 828  LEU   A O    1 1 
ATOM   2048 C  CB   . LEU   A 1 138 ? 7.323   5.837   -20.124 1   19.65 ? 828  LEU   A CB   1 1 
ATOM   2049 C  CG   . LEU   A 1 138 ? 7.288   6.886   -18.961 1   19.84 ? 828  LEU   A CG   1 1 
ATOM   2050 C  CD1  . LEU   A 1 138 ? 6.008   7.721   -19.029 1   20.35 ? 828  LEU   A CD1  1 1 
ATOM   2051 C  CD2  . LEU   A 1 138 ? 7.396   6.196   -17.55  1   20.25 ? 828  LEU   A CD2  1 1 
ATOM   2052 H  H    . LEU   A 1 138 ? 9.444   6.802   -20.935 0   21.46 ? 828  LEU   A H    1 1 
ATOM   2053 H  HA   . LEU   A 1 138 ? 8.862   4.596   -19.262 0   21.54 ? 828  LEU   A HA   1 1 
ATOM   2054 H  HB2  . LEU   A 1 138 ? 7.173   6.381   -21.055 0   20.22 ? 828  LEU   A HB2  1 1 
ATOM   2055 H  HB3  . LEU   A 1 138 ? 6.487   5.156   -19.979 0   20.53 ? 828  LEU   A HB3  1 1 
ATOM   2056 H  HG   . LEU   A 1 138 ? 8.134   7.563   -19.069 0   20.6  ? 828  LEU   A HG   1 1 
ATOM   2057 H  HD11 . LEU   A 1 138 ? 6.015   8.454   -18.224 0   20.72 ? 828  LEU   A HD11 1 1 
ATOM   2058 H  HD12 . LEU   A 1 138 ? 5.967   8.228   -19.992 0   20.51 ? 828  LEU   A HD12 1 1 
ATOM   2059 H  HD13 . LEU   A 1 138 ? 5.15    7.058   -18.921 0   20.78 ? 828  LEU   A HD13 1 1 
ATOM   2060 H  HD21 . LEU   A 1 138 ? 7.072   6.905   -16.79  0   21.32 ? 828  LEU   A HD21 1 1 
ATOM   2061 H  HD22 . LEU   A 1 138 ? 6.74    5.327   -17.536 0   21.42 ? 828  LEU   A HD22 1 1 
ATOM   2062 H  HD23 . LEU   A 1 138 ? 8.425   5.896   -17.358 0   21.67 ? 828  LEU   A HD23 1 1 
ATOM   2063 N  N    . GLU   A 1 139 ? 8.626   4.031   -22.51  1   18.9  ? 829  GLU   A N    1 1 
ATOM   2064 C  CA   . GLU   A 1 139 ? 8.548   2.951   -23.492 1   19.61 ? 829  GLU   A CA   1 1 
ATOM   2065 C  C    . GLU   A 1 139 ? 9.674   1.928   -23.219 1   21.79 ? 829  GLU   A C    1 1 
ATOM   2066 O  O    . GLU   A 1 139 ? 9.424   0.722   -23.264 1   22.41 ? 829  GLU   A O    1 1 
ATOM   2067 C  CB   . GLU   A 1 139 ? 8.673   3.526   -24.918 1   18.47 ? 829  GLU   A CB   1 1 
ATOM   2068 C  CG   . GLU   A 1 139 ? 8.664   2.451   -25.987 1   21    ? 829  GLU   A CG   1 1 
ATOM   2069 C  CD   . GLU   A 1 139 ? 8.506   2.928   -27.417 1   24.22 ? 829  GLU   A CD   1 1 
ATOM   2070 O  OE1  . GLU   A 1 139 ? 8.356   4.151   -27.641 1   25.11 ? 829  GLU   A OE1  1 1 
ATOM   2071 O  OE2  . GLU   A 1 139 ? 8.548   2.065   -28.321 1   24.79 ? 829  GLU   A OE2  1 1 
ATOM   2072 H  H    . GLU   A 1 139 ? 8.797   4.94    -22.926 0   19.92 ? 829  GLU   A H    1 1 
ATOM   2073 H  HA   . GLU   A 1 139 ? 7.589   2.444   -23.403 0   21.05 ? 829  GLU   A HA   1 1 
ATOM   2074 H  HB2  . GLU   A 1 139 ? 7.829   4.191   -25.092 0   19.31 ? 829  GLU   A HB2  1 1 
ATOM   2075 H  HB3  . GLU   A 1 139 ? 9.608   4.077   -25.001 0   19.71 ? 829  GLU   A HB3  1 1 
ATOM   2076 H  HG2  . GLU   A 1 139 ? 9.607   1.908   -25.953 0   22.82 ? 829  GLU   A HG2  1 1 
ATOM   2077 H  HG3  . GLU   A 1 139 ? 7.842   1.767   -25.78  0   22.52 ? 829  GLU   A HG3  1 1 
ATOM   2078 N  N    . ASP   A 1 140 ? 10.891  2.404   -22.915 1   22.91 ? 830  ASP   A N    1 1 
ATOM   2079 C  CA   . ASP   A 1 140 ? 12.021  1.531   -22.585 1   25.24 ? 830  ASP   A CA   1 1 
ATOM   2080 C  C    . ASP   A 1 140 ? 11.745  0.66    -21.346 1   27.09 ? 830  ASP   A C    1 1 
ATOM   2081 O  O    . ASP   A 1 140 ? 12.261  -0.451  -21.266 1   28.5  ? 830  ASP   A O    1 1 
ATOM   2082 C  CB   . ASP   A 1 140 ? 13.296  2.358   -22.367 1   27.73 ? 830  ASP   A CB   1 1 
ATOM   2083 C  CG   . ASP   A 1 140 ? 13.972  2.866   -23.621 1   33.85 ? 830  ASP   A CG   1 1 
ATOM   2084 O  OD1  . ASP   A 1 140 ? 13.649  2.36    -24.724 1   35    ? 830  ASP   A OD1  1 1 
ATOM   2085 O  OD2  . ASP   A 1 140 ? 14.83   3.765   -23.504 1   37.2  ? 830  ASP   A OD2  1 1 
ATOM   2086 H  H    . ASP   A 1 140 ? 11.132  3.39    -22.919 0   24.92 ? 830  ASP   A H    1 1 
ATOM   2087 H  HA   . ASP   A 1 140 ? 12.186  0.844   -23.413 0   28.29 ? 830  ASP   A HA   1 1 
ATOM   2088 H  HB2  . ASP   A 1 140 ? 13.064  3.218   -21.741 0   30.52 ? 830  ASP   A HB2  1 1 
ATOM   2089 H  HB3  . ASP   A 1 140 ? 14.017  1.728   -21.849 0   31.29 ? 830  ASP   A HB3  1 1 
ATOM   2090 N  N    . ARG   A 1 141 ? 10.898  1.133   -20.423 1   26.96 ? 831  ARG   A N    1 1 
ATOM   2091 C  CA   . ARG   A 1 141 ? 10.469  0.38    -19.229 1   27.79 ? 831  ARG   A CA   1 1 
ATOM   2092 C  C    . ARG   A 1 141 ? 9.195   -0.474  -19.486 1   27.03 ? 831  ARG   A C    1 1 
ATOM   2093 O  O    . ARG   A 1 141 ? 8.602   -0.975  -18.52  1   27.57 ? 831  ARG   A O    1 1 
ATOM   2094 C  CB   . ARG   A 1 141 ? 10.187  1.365   -18.071 1   30.28 ? 831  ARG   A CB   1 1 
ATOM   2095 C  CG   . ARG   A 1 141 ? 11.343  2.319   -17.68  1   35.52 ? 831  ARG   A CG   1 1 
ATOM   2096 C  CD   . ARG   A 1 141 ? 12.689  1.661   -17.4   1   40.72 ? 831  ARG   A CD   1 1 
ATOM   2097 N  NE   . ARG   A 1 141 ? 12.567  0.453   -16.58  1   46.6  ? 831  ARG   A NE   1 1 
ATOM   2098 C  CZ   . ARG   A 1 141 ? 12.53   0.398   -15.245 1   50.79 ? 831  ARG   A CZ   1 1 
ATOM   2099 N  NH1  . ARG   A 1 141 ? 12.416  -0.77   -14.625 1   50.83 ? 831  ARG   A NH1  1 1 
ATOM   2100 N  NH2  . ARG   A 1 141 ? 12.622  1.509   -14.519 1   51.23 ? 831  ARG   A NH2  1 1 
ATOM   2101 H  H    . ARG   A 1 141 ? 10.465  2.05    -20.472 0   29.44 ? 831  ARG   A H    1 1 
ATOM   2102 H  HA   . ARG   A 1 141 ? 11.253  -0.309  -18.92  0   31.48 ? 831  ARG   A HA   1 1 
ATOM   2103 H  HB2  . ARG   A 1 141 ? 9.341   1.987   -18.356 0   32.79 ? 831  ARG   A HB2  1 1 
ATOM   2104 H  HB3  . ARG   A 1 141 ? 9.927   0.797   -17.179 0   33.49 ? 831  ARG   A HB3  1 1 
ATOM   2105 H  HG2  . ARG   A 1 141 ? 11.491  3.033   -18.489 0   38.23 ? 831  ARG   A HG2  1 1 
ATOM   2106 H  HG3  . ARG   A 1 141 ? 11.053  2.854   -16.777 0   38.41 ? 831  ARG   A HG3  1 1 
ATOM   2107 H  HD2  . ARG   A 1 141 ? 13.138  1.363   -18.347 0   44.48 ? 831  ARG   A HD2  1 1 
ATOM   2108 H  HD3  . ARG   A 1 141 ? 13.355  2.375   -16.918 0   44.45 ? 831  ARG   A HD3  1 1 
ATOM   2109 H  HE   . ARG   A 1 141 ? 12.503  -0.425  -17.085 0   50.97 ? 831  ARG   A HE   1 1 
ATOM   2110 H  HH11 . ARG   A 1 141 ? 12.355  -1.63   -15.161 0   55.94 ? 831  ARG   A HH11 1 1 
ATOM   2111 H  HH12 . ARG   A 1 141 ? 12.392  -0.814  -13.611 0   55.91 ? 831  ARG   A HH12 1 1 
ATOM   2112 H  HH21 . ARG   A 1 141 ? 12.697  2.436   -14.92  0   55.06 ? 831  ARG   A HH21 1 1 
ATOM   2113 H  HH22 . ARG   A 1 141 ? 12.586  1.434   -13.507 0   55.59 ? 831  ARG   A HH22 1 1 
ATOM   2114 N  N    . ARG   A 1 142 ? 8.758   -0.596  -20.762 1   26.13 ? 832  ARG   A N    1 1 
ATOM   2115 C  CA   . ARG   A 1 142 ? 7.564   -1.324  -21.203 1   26.26 ? 832  ARG   A CA   1 1 
ATOM   2116 C  C    . ARG   A 1 142 ? 6.273   -0.73   -20.637 1   25.23 ? 832  ARG   A C    1 1 
ATOM   2117 O  O    . ARG   A 1 142 ? 5.288   -1.446  -20.512 1   26.12 ? 832  ARG   A O    1 1 
ATOM   2118 C  CB   . ARG   A 1 142 ? 7.652   -2.838  -20.873 1   28.31 ? 832  ARG   A CB   1 1 
ATOM   2119 C  CG   . ARG   A 1 142 ? 8.978   -3.482  -21.295 1   31.69 ? 832  ARG   A CG   1 1 
ATOM   2120 C  CD   . ARG   A 1 142 ? 8.995   -4.997  -21.083 1   35.6  ? 832  ARG   A CD   1 1 
ATOM   2121 N  NE   . ARG   A 1 142 ? 8.006   -5.7    -21.908 1   39.21 ? 832  ARG   A NE   1 1 
ATOM   2122 C  CZ   . ARG   A 1 142 ? 8.106   -5.919  -23.219 1   42.32 ? 832  ARG   A CZ   1 1 
ATOM   2123 N  NH1  . ARG   A 1 142 ? 9.165   -5.482  -23.899 1   41.76 ? 832  ARG   A NH1  1 1 
ATOM   2124 N  NH2  . ARG   A 1 142 ? 7.141   -6.563  -23.867 1   43.26 ? 832  ARG   A NH2  1 1 
ATOM   2125 H  H    . ARG   A 1 142 ? 9.239   -0.197  -21.561 0   28.98 ? 832  ARG   A H    1 1 
ATOM   2126 H  HA   . ARG   A 1 142 ? 7.502   -1.239  -22.287 0   29.13 ? 832  ARG   A HA   1 1 
ATOM   2127 H  HB2  . ARG   A 1 142 ? 7.541   -2.973  -19.798 0   32.23 ? 832  ARG   A HB2  1 1 
ATOM   2128 H  HB3  . ARG   A 1 142 ? 6.849   -3.354  -21.397 0   32.12 ? 832  ARG   A HB3  1 1 
ATOM   2129 H  HG2  . ARG   A 1 142 ? 9.147   -3.287  -22.353 0   35.72 ? 832  ARG   A HG2  1 1 
ATOM   2130 H  HG3  . ARG   A 1 142 ? 9.79    -3.063  -20.703 0   35.92 ? 832  ARG   A HG3  1 1 
ATOM   2131 H  HD2  . ARG   A 1 142 ? 9.985   -5.382  -21.323 0   40.93 ? 832  ARG   A HD2  1 1 
ATOM   2132 H  HD3  . ARG   A 1 142 ? 8.764   -5.205  -20.039 0   40.77 ? 832  ARG   A HD3  1 1 
ATOM   2133 H  HE   . ARG   A 1 142 ? 7.178   -6.047  -21.433 0   44.41 ? 832  ARG   A HE   1 1 
ATOM   2134 H  HH11 . ARG   A 1 142 ? 9.931   -4.982  -23.459 0   46.66 ? 832  ARG   A HH11 1 1 
ATOM   2135 H  HH12 . ARG   A 1 142 ? 9.22    -5.659  -24.897 0   46.74 ? 832  ARG   A HH12 1 1 
ATOM   2136 H  HH21 . ARG   A 1 142 ? 6.326   -6.902  -23.365 0   48.64 ? 832  ARG   A HH21 1 1 
ATOM   2137 H  HH22 . ARG   A 1 142 ? 7.216   -6.73   -24.865 0   48.51 ? 832  ARG   A HH22 1 1 
ATOM   2138 N  N    . LEU   A 1 143 ? 6.257   0.567   -20.342 1   23.31 ? 833  LEU   A N    1 1 
ATOM   2139 C  CA   . LEU   A 1 143 ? 5.095   1.208   -19.77  1   22.91 ? 833  LEU   A CA   1 1 
ATOM   2140 C  C    . LEU   A 1 143 ? 4.28    1.916   -20.872 1   22.14 ? 833  LEU   A C    1 1 
ATOM   2141 O  O    . LEU   A 1 143 ? 4.845   2.73    -21.617 1   21.71 ? 833  LEU   A O    1 1 
ATOM   2142 C  CB   . LEU   A 1 143 ? 5.605   2.226   -18.718 1   23.37 ? 833  LEU   A CB   1 1 
ATOM   2143 C  CG   . LEU   A 1 143 ? 4.626   2.926   -17.76  1   26.79 ? 833  LEU   A CG   1 1 
ATOM   2144 C  CD1  . LEU   A 1 143 ? 3.841   4.057   -18.431 1   27.32 ? 833  LEU   A CD1  1 1 
ATOM   2145 C  CD2  . LEU   A 1 143 ? 3.745   1.967   -17.083 1   28.88 ? 833  LEU   A CD2  1 1 
ATOM   2146 H  H    . LEU   A 1 143 ? 7.024   1.212   -20.506 0   25.4  ? 833  LEU   A H    1 1 
ATOM   2147 H  HA   . LEU   A 1 143 ? 4.468   0.464   -19.283 0   25.17 ? 833  LEU   A HA   1 1 
ATOM   2148 H  HB2  . LEU   A 1 143 ? 6.325   1.703   -18.089 0   25.51 ? 833  LEU   A HB2  1 1 
ATOM   2149 H  HB3  . LEU   A 1 143 ? 6.129   3.014   -19.256 0   24.9  ? 833  LEU   A HB3  1 1 
ATOM   2150 H  HG   . LEU   A 1 143 ? 5.223   3.393   -16.978 0   28.45 ? 833  LEU   A HG   1 1 
ATOM   2151 H  HD11 . LEU   A 1 143 ? 3.174   4.505   -17.697 0   28.45 ? 833  LEU   A HD11 1 1 
ATOM   2152 H  HD12 . LEU   A 1 143 ? 4.536   4.809   -18.801 0   28.26 ? 833  LEU   A HD12 1 1 
ATOM   2153 H  HD13 . LEU   A 1 143 ? 3.259   3.648   -19.256 0   28.47 ? 833  LEU   A HD13 1 1 
ATOM   2154 H  HD21 . LEU   A 1 143 ? 3.297   2.5     -16.253 0   30.82 ? 833  LEU   A HD21 1 1 
ATOM   2155 H  HD22 . LEU   A 1 143 ? 2.968   1.615   -17.76  0   30.97 ? 833  LEU   A HD22 1 1 
ATOM   2156 H  HD23 . LEU   A 1 143 ? 4.342   1.135   -16.714 0   31.27 ? 833  LEU   A HD23 1 1 
ATOM   2157 N  N    . VAL   A 1 144 ? 2.961   1.626   -20.947 1   21    ? 834  VAL   A N    1 1 
ATOM   2158 C  CA   . VAL   A 1 144 ? 2.028   2.33    -21.846 1   20.21 ? 834  VAL   A CA   1 1 
ATOM   2159 C  C    . VAL   A 1 144 ? 1.271   3.279   -20.883 1   19.12 ? 834  VAL   A C    1 1 
ATOM   2160 O  O    . VAL   A 1 144 ? 0.617   2.814   -19.931 1   19.47 ? 834  VAL   A O    1 1 
ATOM   2161 C  CB   . VAL   A 1 144 ? 1.061   1.393   -22.587 1   20.92 ? 834  VAL   A CB   1 1 
ATOM   2162 C  CG1  . VAL   A 1 144 ? 0.146   2.194   -23.529 1   21.79 ? 834  VAL   A CG1  1 1 
ATOM   2163 C  CG2  . VAL   A 1 144 ? 1.829   0.317   -23.375 1   20.99 ? 834  VAL   A CG2  1 1 
ATOM   2164 H  H    . VAL   A 1 144 ? 2.508   0.907   -20.393 0   22.93 ? 834  VAL   A H    1 1 
ATOM   2165 H  HA   . VAL   A 1 144 ? 2.565   2.92    -22.587 0   21.2  ? 834  VAL   A HA   1 1 
ATOM   2166 H  HB   . VAL   A 1 144 ? 0.432   0.888   -21.856 0   22.78 ? 834  VAL   A HB   1 1 
ATOM   2167 H  HG11 . VAL   A 1 144 ? -0.57   1.508   -23.978 0   23.29 ? 834  VAL   A HG11 1 1 
ATOM   2168 H  HG12 . VAL   A 1 144 ? -0.381  2.981   -22.995 0   22.9  ? 834  VAL   A HG12 1 1 
ATOM   2169 H  HG13 . VAL   A 1 144 ? 0.762   2.638   -24.309 0   22.73 ? 834  VAL   A HG13 1 1 
ATOM   2170 H  HG21 . VAL   A 1 144 ? 1.112   -0.296  -23.919 0   23.07 ? 834  VAL   A HG21 1 1 
ATOM   2171 H  HG22 . VAL   A 1 144 ? 2.505   0.806   -24.074 0   22.55 ? 834  VAL   A HG22 1 1 
ATOM   2172 H  HG23 . VAL   A 1 144 ? 2.393   -0.305  -22.683 0   23.11 ? 834  VAL   A HG23 1 1 
ATOM   2173 N  N    . HIS   A 1 145 ? 1.44    4.598   -21.071 1   17.37 ? 835  HIS   A N    1 1 
ATOM   2174 C  CA   . HIS   A 1 145 ? 0.888   5.594   -20.152 1   16.97 ? 835  HIS   A CA   1 1 
ATOM   2175 C  C    . HIS   A 1 145 ? -0.649  5.648   -20.198 1   17.21 ? 835  HIS   A C    1 1 
ATOM   2176 O  O    . HIS   A 1 145 ? -1.286  5.665   -19.141 1   17.9  ? 835  HIS   A O    1 1 
ATOM   2177 C  CB   . HIS   A 1 145 ? 1.509   6.968   -20.456 1   16.82 ? 835  HIS   A CB   1 1 
ATOM   2178 C  CG   . HIS   A 1 145 ? 1.157   8.019   -19.458 1   16.4  ? 835  HIS   A CG   1 1 
ATOM   2179 N  ND1  . HIS   A 1 145 ? -0.074  8.627   -19.472 1   17.85 ? 835  HIS   A ND1  1 1 
ATOM   2180 C  CD2  . HIS   A 1 145 ? 1.908   8.572   -18.476 1   17.12 ? 835  HIS   A CD2  1 1 
ATOM   2181 C  CE1  . HIS   A 1 145 ? -0.07   9.484   -18.462 1   18.02 ? 835  HIS   A CE1  1 1 
ATOM   2182 N  NE2  . HIS   A 1 145 ? 1.118   9.503   -17.853 1   17.78 ? 835  HIS   A NE2  1 1 
ATOM   2183 H  H    . HIS   A 1 145 ? 1.949   5.006   -21.85  0   17.81 ? 835  HIS   A H    1 1 
ATOM   2184 H  HA   . HIS   A 1 145 ? 1.178   5.325   -19.138 0   17.71 ? 835  HIS   A HA   1 1 
ATOM   2185 H  HB2  . HIS   A 1 145 ? 2.594   6.868   -20.468 0   16.96 ? 835  HIS   A HB2  1 1 
ATOM   2186 H  HB3  . HIS   A 1 145 ? 1.159   7.303   -21.432 0   16.77 ? 835  HIS   A HB3  1 1 
ATOM   2187 H  HD2  . HIS   A 1 145 ? 2.928   8.327   -18.232 0   17.28 ? 835  HIS   A HD2  1 1 
ATOM   2188 H  HE1  . HIS   A 1 145 ? -0.914  10.086  -18.17  0   18.04 ? 835  HIS   A HE1  1 1 
ATOM   2189 H  HE2  . HIS   A 1 145 ? 1.387   10.097  -17.075 0   17.83 ? 835  HIS   A HE2  1 1 
ATOM   2190 N  N    . ARG   A 1 146 ? -1.232  5.672   -21.418 1   16.84 ? 836  ARG   A N    1 1 
ATOM   2191 C  CA   . ARG   A 1 146 ? -2.678  5.682   -21.67  1   17.04 ? 836  ARG   A CA   1 1 
ATOM   2192 C  C    . ARG   A 1 146 ? -3.41   6.978   -21.272 1   17.67 ? 836  ARG   A C    1 1 
ATOM   2193 O  O    . ARG   A 1 146 ? -4.612  7.078   -21.543 1   18.81 ? 836  ARG   A O    1 1 
ATOM   2194 C  CB   . ARG   A 1 146 ? -3.369  4.466   -21.02  1   18.17 ? 836  ARG   A CB   1 1 
ATOM   2195 C  CG   . ARG   A 1 146 ? -2.863  3.134   -21.556 1   20.36 ? 836  ARG   A CG   1 1 
ATOM   2196 C  CD   . ARG   A 1 146 ? -3.62   1.938   -20.986 1   22.79 ? 836  ARG   A CD   1 1 
ATOM   2197 N  NE   . ARG   A 1 146 ? -5.065  2.027   -21.234 1   23.71 ? 836  ARG   A NE   1 1 
ATOM   2198 C  CZ   . ARG   A 1 146 ? -6.057  1.927   -20.341 1   25.3  ? 836  ARG   A CZ   1 1 
ATOM   2199 N  NH1  . ARG   A 1 146 ? -5.794  1.752   -19.045 1   25.35 ? 836  ARG   A NH1  1 1 
ATOM   2200 N  NH2  . ARG   A 1 146 ? -7.321  2.014   -20.735 1   23.39 ? 836  ARG   A NH2  1 1 
ATOM   2201 H  H    . ARG   A 1 146 ? -0.7    5.695   -22.282 0   17.22 ? 836  ARG   A H    1 1 
ATOM   2202 H  HA   . ARG   A 1 146 ? -2.817  5.574   -22.745 0   17.68 ? 836  ARG   A HA   1 1 
ATOM   2203 H  HB2  . ARG   A 1 146 ? -3.208  4.484   -19.943 0   19.56 ? 836  ARG   A HB2  1 1 
ATOM   2204 H  HB3  . ARG   A 1 146 ? -4.435  4.529   -21.229 0   19.66 ? 836  ARG   A HB3  1 1 
ATOM   2205 H  HG2  . ARG   A 1 146 ? -2.944  3.116   -22.642 0   21.8  ? 836  ARG   A HG2  1 1 
ATOM   2206 H  HG3  . ARG   A 1 146 ? -1.828  3.015   -21.241 0   21.79 ? 836  ARG   A HG3  1 1 
ATOM   2207 H  HD2  . ARG   A 1 146 ? -3.266  1.042   -21.493 0   25.21 ? 836  ARG   A HD2  1 1 
ATOM   2208 H  HD3  . ARG   A 1 146 ? -3.364  1.874   -19.931 0   25.13 ? 836  ARG   A HD3  1 1 
ATOM   2209 H  HE   . ARG   A 1 146 ? -5.335  2.156   -22.204 0   26.11 ? 836  ARG   A HE   1 1 
ATOM   2210 H  HH11 . ARG   A 1 146 ? -4.869  1.663   -18.641 0   28.27 ? 836  ARG   A HH11 1 1 
ATOM   2211 H  HH12 . ARG   A 1 146 ? -6.58   1.686   -18.406 0   28.84 ? 836  ARG   A HH12 1 1 
ATOM   2212 H  HH21 . ARG   A 1 146 ? -7.547  2.157   -21.713 0   26.56 ? 836  ARG   A HH21 1 1 
ATOM   2213 H  HH22 . ARG   A 1 146 ? -8.074  1.951   -20.058 0   27.06 ? 836  ARG   A HH22 1 1 
ATOM   2214 N  N    . ASP   A 1 147 ? -2.717  7.976   -20.686 1   16.3  ? 837  ASP   A N    1 1 
ATOM   2215 C  CA   . ASP   A 1 147 ? -3.367  9.235   -20.361 1   16.04 ? 837  ASP   A CA   1 1 
ATOM   2216 C  C    . ASP   A 1 147 ? -2.466  10.447  -20.592 1   16.16 ? 837  ASP   A C    1 1 
ATOM   2217 O  O    . ASP   A 1 147 ? -2.54   11.432  -19.832 1   16.13 ? 837  ASP   A O    1 1 
ATOM   2218 C  CB   . ASP   A 1 147 ? -3.901  9.229   -18.925 1   17.13 ? 837  ASP   A CB   1 1 
ATOM   2219 C  CG   . ASP   A 1 147 ? -5.06   10.189  -18.68  1   19.44 ? 837  ASP   A CG   1 1 
ATOM   2220 O  OD1  . ASP   A 1 147 ? -5.512  10.864  -19.653 1   18.9  ? 837  ASP   A OD1  1 1 
ATOM   2221 O  OD2  . ASP   A 1 147 ? -5.468  10.333  -17.513 1   21.36 ? 837  ASP   A OD2  1 1 
ATOM   2222 H  H    . ASP   A 1 147 ? -1.739  7.943   -20.418 0   16.49 ? 837  ASP   A H    1 1 
ATOM   2223 H  HA   . ASP   A 1 147 ? -4.205  9.362   -21.043 0   16.31 ? 837  ASP   A HA   1 1 
ATOM   2224 H  HB2  . ASP   A 1 147 ? -4.21   8.216   -18.675 0   17.95 ? 837  ASP   A HB2  1 1 
ATOM   2225 H  HB3  . ASP   A 1 147 ? -3.097  9.515   -18.249 0   17.54 ? 837  ASP   A HB3  1 1 
ATOM   2226 N  N    . LEU   A 1 148 ? -1.662  10.404  -21.672 1   15.01 ? 838  LEU   A N    1 1 
ATOM   2227 C  CA   . LEU   A 1 148 ? -0.816  11.548  -21.968 1   14.98 ? 838  LEU   A CA   1 1 
ATOM   2228 C  C    . LEU   A 1 148 ? -1.732  12.695  -22.494 1   14.28 ? 838  LEU   A C    1 1 
ATOM   2229 O  O    . LEU   A 1 148 ? -2.516  12.506  -23.418 1   13    ? 838  LEU   A O    1 1 
ATOM   2230 C  CB   . LEU   A 1 148 ? 0.284   11.201  -22.983 1   14.31 ? 838  LEU   A CB   1 1 
ATOM   2231 C  CG   . LEU   A 1 148 ? 1.271   12.358  -23.354 1   16.37 ? 838  LEU   A CG   1 1 
ATOM   2232 C  CD1  . LEU   A 1 148 ? 2.044   12.91   -22.118 1   16.81 ? 838  LEU   A CD1  1 1 
ATOM   2233 C  CD2  . LEU   A 1 148 ? 2.271   11.852  -24.361 1   17.45 ? 838  LEU   A CD2  1 1 
ATOM   2234 H  H    . LEU   A 1 148 ? -1.587  9.641   -22.337 0   14.64 ? 838  LEU   A H    1 1 
ATOM   2235 H  HA   . LEU   A 1 148 ? -0.341  11.858  -21.039 0   14.33 ? 838  LEU   A HA   1 1 
ATOM   2236 H  HB2  . LEU   A 1 148 ? 0.879   10.383  -22.58  0   13.62 ? 838  LEU   A HB2  1 1 
ATOM   2237 H  HB3  . LEU   A 1 148 ? -0.196  10.878  -23.906 0   13.48 ? 838  LEU   A HB3  1 1 
ATOM   2238 H  HG   . LEU   A 1 148 ? 0.728   13.176  -23.822 0   15.29 ? 838  LEU   A HG   1 1 
ATOM   2239 H  HD11 . LEU   A 1 148 ? 2.828   13.581  -22.463 0   15.83 ? 838  LEU   A HD11 1 1 
ATOM   2240 H  HD12 . LEU   A 1 148 ? 1.363   13.461  -21.471 0   15.94 ? 838  LEU   A HD12 1 1 
ATOM   2241 H  HD13 . LEU   A 1 148 ? 2.484   12.076  -21.573 0   16.01 ? 838  LEU   A HD13 1 1 
ATOM   2242 H  HD21 . LEU   A 1 148 ? 2.963   12.654  -24.617 0   16.35 ? 838  LEU   A HD21 1 1 
ATOM   2243 H  HD22 . LEU   A 1 148 ? 2.81    11.014  -23.923 0   16.55 ? 838  LEU   A HD22 1 1 
ATOM   2244 H  HD23 . LEU   A 1 148 ? 1.738   11.525  -25.253 0   16.37 ? 838  LEU   A HD23 1 1 
ATOM   2245 N  N    . ALA   A 1 149 ? -1.602  13.862  -21.878 1   14.19 ? 839  ALA   A N    1 1 
ATOM   2246 C  CA   . ALA   A 1 149 ? -2.377  15.077  -22.201 1   14.28 ? 839  ALA   A CA   1 1 
ATOM   2247 C  C    . ALA   A 1 149 ? -1.691  16.261  -21.508 1   14.45 ? 839  ALA   A C    1 1 
ATOM   2248 O  O    . ALA   A 1 149 ? -0.92   16.041  -20.542 1   15.05 ? 839  ALA   A O    1 1 
ATOM   2249 C  CB   . ALA   A 1 149 ? -3.83   14.949  -21.72  1   14.25 ? 839  ALA   A CB   1 1 
ATOM   2250 H  H    . ALA   A 1 149 ? -0.951  13.99   -21.109 0   13.43 ? 839  ALA   A H    1 1 
ATOM   2251 H  HA   . ALA   A 1 149 ? -2.39   15.249  -23.276 0   13.39 ? 839  ALA   A HA   1 1 
ATOM   2252 H  HB1  . ALA   A 1 149 ? -4.321  15.916  -21.818 0   13.8  ? 839  ALA   A HB1  1 1 
ATOM   2253 H  HB2  . ALA   A 1 149 ? -4.341  14.21   -22.334 0   13.83 ? 839  ALA   A HB2  1 1 
ATOM   2254 H  HB3  . ALA   A 1 149 ? -3.83   14.63   -20.679 0   13.89 ? 839  ALA   A HB3  1 1 
ATOM   2255 N  N    . ALA   A 1 150 ? -1.922  17.492  -21.99  1   13.73 ? 840  ALA   A N    1 1 
ATOM   2256 C  CA   . ALA   A 1 150 ? -1.304  18.671  -21.385 1   14.98 ? 840  ALA   A CA   1 1 
ATOM   2257 C  C    . ALA   A 1 150 ? -1.666  18.807  -19.884 1   15.18 ? 840  ALA   A C    1 1 
ATOM   2258 O  O    . ALA   A 1 150 ? -0.877  19.352  -19.109 1   15.13 ? 840  ALA   A O    1 1 
ATOM   2259 C  CB   . ALA   A 1 150 ? -1.705  19.932  -22.15  1   15.79 ? 840  ALA   A CB   1 1 
ATOM   2260 H  H    . ALA   A 1 150 ? -2.523  17.696  -22.782 0   12.93 ? 840  ALA   A H    1 1 
ATOM   2261 H  HA   . ALA   A 1 150 ? -0.221  18.572  -21.455 0   14.18 ? 840  ALA   A HA   1 1 
ATOM   2262 H  HB1  . ALA   A 1 150 ? -1.233  20.796  -21.684 0   15.24 ? 840  ALA   A HB1  1 1 
ATOM   2263 H  HB2  . ALA   A 1 150 ? -1.372  19.84   -23.183 0   14.99 ? 840  ALA   A HB2  1 1 
ATOM   2264 H  HB3  . ALA   A 1 150 ? -2.788  20.033  -22.116 0   15.26 ? 840  ALA   A HB3  1 1 
ATOM   2265 N  N    . ARG   A 1 151 ? -2.873  18.337  -19.494 1   15.28 ? 841  ARG   A N    1 1 
ATOM   2266 C  CA   . ARG   A 1 151 ? -3.31   18.345  -18.082 1   15.92 ? 841  ARG   A CA   1 1 
ATOM   2267 C  C    . ARG   A 1 151 ? -2.418  17.445  -17.191 1   16.75 ? 841  ARG   A C    1 1 
ATOM   2268 O  O    . ARG   A 1 151 ? -2.387  17.646  -15.97  1   18.1  ? 841  ARG   A O    1 1 
ATOM   2269 C  CB   . ARG   A 1 151 ? -4.795  17.896  -17.942 1   16.76 ? 841  ARG   A CB   1 1 
ATOM   2270 C  CG   . ARG   A 1 151 ? -5.087  16.429  -18.373 1   18.17 ? 841  ARG   A CG   1 1 
ATOM   2271 C  CD   . ARG   A 1 151 ? -6.557  15.983  -18.211 1   20.03 ? 841  ARG   A CD   1 1 
ATOM   2272 N  NE   . ARG   A 1 151 ? -6.735  14.673  -18.854 1   19.91 ? 841  ARG   A NE   1 1 
ATOM   2273 C  CZ   . ARG   A 1 151 ? -6.996  14.477  -20.152 1   19.58 ? 841  ARG   A CZ   1 1 
ATOM   2274 N  NH1  . ARG   A 1 151 ? -7.251  15.509  -20.956 1   18.28 ? 841  ARG   A NH1  1 1 
ATOM   2275 N  NH2  . ARG   A 1 151 ? -7.065  13.246  -20.641 1   17.97 ? 841  ARG   A NH2  1 1 
ATOM   2276 H  H    . ARG   A 1 151 ? -3.578  17.996  -20.139 0   14.95 ? 841  ARG   A H    1 1 
ATOM   2277 H  HA   . ARG   A 1 151 ? -3.236  19.362  -17.702 0   15.95 ? 841  ARG   A HA   1 1 
ATOM   2278 H  HB2  . ARG   A 1 151 ? -5.087  17.993  -16.897 0   17.19 ? 841  ARG   A HB2  1 1 
ATOM   2279 H  HB3  . ARG   A 1 151 ? -5.415  18.548  -18.556 0   17.03 ? 841  ARG   A HB3  1 1 
ATOM   2280 H  HG2  . ARG   A 1 151 ? -4.826  16.323  -19.425 0   18.12 ? 841  ARG   A HG2  1 1 
ATOM   2281 H  HG3  . ARG   A 1 151 ? -4.485  15.746  -17.776 0   18.3  ? 841  ARG   A HG3  1 1 
ATOM   2282 H  HD2  . ARG   A 1 151 ? -6.752  15.847  -17.148 0   20.83 ? 841  ARG   A HD2  1 1 
ATOM   2283 H  HD3  . ARG   A 1 151 ? -7.246  16.727  -18.606 0   20.7  ? 841  ARG   A HD3  1 1 
ATOM   2284 H  HE   . ARG   A 1 151 ? -6.533  13.858  -18.284 0   20.59 ? 841  ARG   A HE   1 1 
ATOM   2285 H  HH11 . ARG   A 1 151 ? -7.184  16.481  -20.672 0   18.69 ? 841  ARG   A HH11 1 1 
ATOM   2286 H  HH12 . ARG   A 1 151 ? -7.463  15.322  -21.931 0   18.61 ? 841  ARG   A HH12 1 1 
ATOM   2287 H  HH21 . ARG   A 1 151 ? -6.914  12.446  -20.035 0   18.61 ? 841  ARG   A HH21 1 1 
ATOM   2288 H  HH22 . ARG   A 1 151 ? -7.314  13.093  -21.613 0   18.44 ? 841  ARG   A HH22 1 1 
ATOM   2289 N  N    . ASN   A 1 152 ? -1.756  16.41   -17.791 1   15.46 ? 842  ASN   A N    1 1 
ATOM   2290 C  CA   . ASN   A 1 152 ? -0.895  15.47   -17.091 1   15.59 ? 842  ASN   A CA   1 1 
ATOM   2291 C  C    . ASN   A 1 152 ? 0.594   15.711  -17.349 1   16.8  ? 842  ASN   A C    1 1 
ATOM   2292 O  O    . ASN   A 1 152 ? 1.397   14.799  -17.236 1   17.99 ? 842  ASN   A O    1 1 
ATOM   2293 C  CB   . ASN   A 1 152 ? -1.32   14.034  -17.412 1   15.91 ? 842  ASN   A CB   1 1 
ATOM   2294 C  CG   . ASN   A 1 152 ? -2.711  13.751  -16.872 1   18.29 ? 842  ASN   A CG   1 1 
ATOM   2295 O  OD1  . ASN   A 1 152 ? -3.138  14.33   -15.867 1   19.77 ? 842  ASN   A OD1  1 1 
ATOM   2296 N  ND2  . ASN   A 1 152 ? -3.442  12.849  -17.479 1   15.98 ? 842  ASN   A ND2  1 1 
ATOM   2297 H  H    . ASN   A 1 152 ? -1.816  16.195  -18.781 0   15.03 ? 842  ASN   A H    1 1 
ATOM   2298 H  HA   . ASN   A 1 152 ? -1.014  15.604  -16.017 0   15.52 ? 842  ASN   A HA   1 1 
ATOM   2299 H  HB2  . ASN   A 1 152 ? -1.326  13.89   -18.492 0   15.53 ? 842  ASN   A HB2  1 1 
ATOM   2300 H  HB3  . ASN   A 1 152 ? -0.64   13.327  -16.939 0   15.73 ? 842  ASN   A HB3  1 1 
ATOM   2301 H  HD21 . ASN   A 1 152 ? -4.374  12.643  -17.135 0   16.38 ? 842  ASN   A HD21 1 1 
ATOM   2302 H  HD22 . ASN   A 1 152 ? -3.082  12.351  -18.287 0   15.98 ? 842  ASN   A HD22 1 1 
ATOM   2303 N  N    . VAL   A 1 153 ? 0.967   16.953  -17.64  1   16.53 ? 843  VAL   A N    1 1 
ATOM   2304 C  CA   . VAL   A 1 153 ? 2.351   17.352  -17.733 1   16.94 ? 843  VAL   A CA   1 1 
ATOM   2305 C  C    . VAL   A 1 153 ? 2.462   18.477  -16.688 1   17.78 ? 843  VAL   A C    1 1 
ATOM   2306 O  O    . VAL   A 1 153 ? 1.589   19.349  -16.637 1   18.77 ? 843  VAL   A O    1 1 
ATOM   2307 C  CB   . VAL   A 1 153 ? 2.762   17.802  -19.147 1   17.56 ? 843  VAL   A CB   1 1 
ATOM   2308 C  CG1  . VAL   A 1 153 ? 4.212   18.281  -19.149 1   17.6  ? 843  VAL   A CG1  1 1 
ATOM   2309 C  CG2  . VAL   A 1 153 ? 2.571   16.65   -20.164 1   17.38 ? 843  VAL   A CG2  1 1 
ATOM   2310 H  H    . VAL   A 1 153 ? 0.335   17.728  -17.813 0   16.13 ? 843  VAL   A H    1 1 
ATOM   2311 H  HA   . VAL   A 1 153 ? 3.018   16.543  -17.437 0   16.57 ? 843  VAL   A HA   1 1 
ATOM   2312 H  HB   . VAL   A 1 153 ? 2.129   18.63   -19.458 0   17    ? 843  VAL   A HB   1 1 
ATOM   2313 H  HG11 . VAL   A 1 153 ? 4.566   18.337  -20.177 0   17.13 ? 843  VAL   A HG11 1 1 
ATOM   2314 H  HG12 . VAL   A 1 153 ? 4.235   19.274  -18.705 0   17.38 ? 843  VAL   A HG12 1 1 
ATOM   2315 H  HG13 . VAL   A 1 153 ? 4.826   17.585  -18.579 0   17.26 ? 843  VAL   A HG13 1 1 
ATOM   2316 H  HG21 . VAL   A 1 153 ? 2.928   16.972  -21.141 0   16.55 ? 843  VAL   A HG21 1 1 
ATOM   2317 H  HG22 . VAL   A 1 153 ? 3.143   15.788  -19.826 0   16.7  ? 843  VAL   A HG22 1 1 
ATOM   2318 H  HG23 . VAL   A 1 153 ? 1.514   16.395  -20.229 0   16.6  ? 843  VAL   A HG23 1 1 
ATOM   2319 N  N    . LEU   A 1 154 ? 3.49    18.423  -15.849 1   17.09 ? 844  LEU   A N    1 1 
ATOM   2320 C  CA   . LEU   A 1 154 ? 3.718   19.4    -14.783 1   18.55 ? 844  LEU   A CA   1 1 
ATOM   2321 C  C    . LEU   A 1 154 ? 4.927   20.263  -15.052 1   19.2  ? 844  LEU   A C    1 1 
ATOM   2322 O  O    . LEU   A 1 154 ? 5.802   19.888  -15.831 1   19.9  ? 844  LEU   A O    1 1 
ATOM   2323 C  CB   . LEU   A 1 154 ? 3.851   18.68   -13.445 1   19.7  ? 844  LEU   A CB   1 1 
ATOM   2324 C  CG   . LEU   A 1 154 ? 2.702   17.764  -13.067 1   22.9  ? 844  LEU   A CG   1 1 
ATOM   2325 C  CD1  . LEU   A 1 154 ? 3.016   17.056  -11.768 1   24.74 ? 844  LEU   A CD1  1 1 
ATOM   2326 C  CD2  . LEU   A 1 154 ? 1.368   18.52   -12.975 1   24.06 ? 844  LEU   A CD2  1 1 
ATOM   2327 H  H    . LEU   A 1 154 ? 4.203   17.701  -15.875 0   17.14 ? 844  LEU   A H    1 1 
ATOM   2328 H  HA   . LEU   A 1 154 ? 2.893   20.101  -14.715 0   18.89 ? 844  LEU   A HA   1 1 
ATOM   2329 H  HB2  . LEU   A 1 154 ? 4.757   18.076  -13.467 0   20.26 ? 844  LEU   A HB2  1 1 
ATOM   2330 H  HB3  . LEU   A 1 154 ? 3.933   19.433  -12.664 0   20.45 ? 844  LEU   A HB3  1 1 
ATOM   2331 H  HG   . LEU   A 1 154 ? 2.599   16.996  -13.831 0   23.16 ? 844  LEU   A HG   1 1 
ATOM   2332 H  HD11 . LEU   A 1 154 ? 2.186   16.403  -11.505 0   25.44 ? 844  LEU   A HD11 1 1 
ATOM   2333 H  HD12 . LEU   A 1 154 ? 3.923   16.468  -11.895 0   25.45 ? 844  LEU   A HD12 1 1 
ATOM   2334 H  HD13 . LEU   A 1 154 ? 3.162   17.802  -10.988 0   25.65 ? 844  LEU   A HD13 1 1 
ATOM   2335 H  HD21 . LEU   A 1 154 ? 0.643   17.895  -12.458 0   24.56 ? 844  LEU   A HD21 1 1 
ATOM   2336 H  HD22 . LEU   A 1 154 ? 1.522   19.442  -12.417 0   24.76 ? 844  LEU   A HD22 1 1 
ATOM   2337 H  HD23 . LEU   A 1 154 ? 0.993   18.745  -13.972 0   24.39 ? 844  LEU   A HD23 1 1 
ATOM   2338 N  N    . VAL   A 1 155 ? 4.938   21.449  -14.469 1   18.91 ? 845  VAL   A N    1 1 
ATOM   2339 C  CA   . VAL   A 1 155 ? 5.951   22.457  -14.739 1   19.19 ? 845  VAL   A CA   1 1 
ATOM   2340 C  C    . VAL   A 1 155 ? 6.805   22.649  -13.495 1   20.57 ? 845  VAL   A C    1 1 
ATOM   2341 O  O    . VAL   A 1 155 ? 6.344   23.245  -12.534 1   20.9  ? 845  VAL   A O    1 1 
ATOM   2342 C  CB   . VAL   A 1 155 ? 5.256   23.776  -15.176 1   19.14 ? 845  VAL   A CB   1 1 
ATOM   2343 C  CG1  . VAL   A 1 155 ? 6.287   24.847  -15.564 1   20.07 ? 845  VAL   A CG1  1 1 
ATOM   2344 C  CG2  . VAL   A 1 155 ? 4.29    23.544  -16.351 1   18.99 ? 845  VAL   A CG2  1 1 
ATOM   2345 H  H    . VAL   A 1 155 ? 4.254   21.752  -13.781 0   19.79 ? 845  VAL   A H    1 1 
ATOM   2346 H  HA   . VAL   A 1 155 ? 6.607   22.15   -15.55  0   20.21 ? 845  VAL   A HA   1 1 
ATOM   2347 H  HB   . VAL   A 1 155 ? 4.647   24.148  -14.354 0   20.47 ? 845  VAL   A HB   1 1 
ATOM   2348 H  HG11 . VAL   A 1 155 ? 5.759   25.78   -15.756 0   21.73 ? 845  VAL   A HG11 1 1 
ATOM   2349 H  HG12 . VAL   A 1 155 ? 7.02    24.997  -14.773 0   21.97 ? 845  VAL   A HG12 1 1 
ATOM   2350 H  HG13 . VAL   A 1 155 ? 6.794   24.526  -16.472 0   21.54 ? 845  VAL   A HG13 1 1 
ATOM   2351 H  HG21 . VAL   A 1 155 ? 4.014   24.506  -16.779 0   19.9  ? 845  VAL   A HG21 1 1 
ATOM   2352 H  HG22 . VAL   A 1 155 ? 4.781   22.93   -17.105 0   19.65 ? 845  VAL   A HG22 1 1 
ATOM   2353 H  HG23 . VAL   A 1 155 ? 3.395   23.039  -15.989 0   19.61 ? 845  VAL   A HG23 1 1 
ATOM   2354 N  N    . LYS   A 1 156 ? 8.032   22.14   -13.502 1   21.12 ? 846  LYS   A N    1 1 
ATOM   2355 C  CA   . LYS   A 1 156 ? 8.949   22.3    -12.351 1   22.03 ? 846  LYS   A CA   1 1 
ATOM   2356 C  C    . LYS   A 1 156 ? 9.466   23.754  -12.39  1   22.18 ? 846  LYS   A C    1 1 
ATOM   2357 O  O    . LYS   A 1 156 ? 9.506   24.439  -11.365 1   22.84 ? 846  LYS   A O    1 1 
ATOM   2358 C  CB   . LYS   A 1 156 ? 10.102  21.284  -12.45  1   24.06 ? 846  LYS   A CB   1 1 
ATOM   2359 C  CG   . LYS   A 1 156 ? 11.109  21.38   -11.301 1   28.62 ? 846  LYS   A CG   1 1 
ATOM   2360 C  CD   . LYS   A 1 156 ? 12.363  20.544  -11.588 1   34.73 ? 846  LYS   A CD   1 1 
ATOM   2361 C  CE   . LYS   A 1 156 ? 13.396  20.734  -10.496 1   40.66 ? 846  LYS   A CE   1 1 
ATOM   2362 N  NZ   . LYS   A 1 156 ? 14.631  19.941  -10.726 1   44.47 ? 846  LYS   A NZ   1 1 
ATOM   2363 H  H    . LYS   A 1 156 ? 8.432   21.613  -14.272 0   22.68 ? 846  LYS   A H    1 1 
ATOM   2364 H  HA   . LYS   A 1 156 ? 8.419   22.133  -11.414 0   24.23 ? 846  LYS   A HA   1 1 
ATOM   2365 H  HB2  . LYS   A 1 156 ? 9.685   20.278  -12.443 0   26.07 ? 846  LYS   A HB2  1 1 
ATOM   2366 H  HB3  . LYS   A 1 156 ? 10.642  21.454  -13.38  0   26.39 ? 846  LYS   A HB3  1 1 
ATOM   2367 H  HG2  . LYS   A 1 156 ? 11.434  22.41   -11.158 0   31.85 ? 846  LYS   A HG2  1 1 
ATOM   2368 H  HG3  . LYS   A 1 156 ? 10.65   21.002  -10.388 0   31.48 ? 846  LYS   A HG3  1 1 
ATOM   2369 H  HD2  . LYS   A 1 156 ? 12.093  19.489  -11.627 0   37.59 ? 846  LYS   A HD2  1 1 
ATOM   2370 H  HD3  . LYS   A 1 156 ? 12.8    20.859  -12.534 0   37.9  ? 846  LYS   A HD3  1 1 
ATOM   2371 H  HE2  . LYS   A 1 156 ? 13.676  21.785  -10.452 0   44.8  ? 846  LYS   A HE2  1 1 
ATOM   2372 H  HE3  . LYS   A 1 156 ? 12.967  20.423  -9.545  0   44.46 ? 846  LYS   A HE3  1 1 
ATOM   2373 H  HZ1  . LYS   A 1 156 ? 15.104  19.795  -9.841  0   48.95 ? 846  LYS   A HZ1  1 1 
ATOM   2374 H  HZ2  . LYS   A 1 156 ? 14.406  19.039  -11.135 0   48.29 ? 846  LYS   A HZ2  1 1 
ATOM   2375 H  HZ3  . LYS   A 1 156 ? 15.256  20.443  -11.349 0   48.98 ? 846  LYS   A HZ3  1 1 
ATOM   2376 N  N    . THR   A 1 157 ? 9.918   24.181  -13.566 1   22.22 ? 847  THR   A N    1 1 
ATOM   2377 C  CA   . THR   A 1 157 ? 10.288  25.553  -13.929 1   22.75 ? 847  THR   A CA   1 1 
ATOM   2378 C  C    . THR   A 1 157 ? 9.724   25.762  -15.369 1   23.12 ? 847  THR   A C    1 1 
ATOM   2379 O  O    . THR   A 1 157 ? 9.546   24.76   -16.083 1   22.9  ? 847  THR   A O    1 1 
ATOM   2380 C  CB   . THR   A 1 157 ? 11.847  25.758  -13.944 1   24.02 ? 847  THR   A CB   1 1 
ATOM   2381 O  OG1  . THR   A 1 157 ? 12.392  25.144  -15.115 1   25.12 ? 847  THR   A OG1  1 1 
ATOM   2382 C  CG2  . THR   A 1 157 ? 12.562  25.222  -12.674 1   24.43 ? 847  THR   A CG2  1 1 
ATOM   2383 H  H    . THR   A 1 157 ? 10.087  23.548  -14.342 0   24.64 ? 847  THR   A H    1 1 
ATOM   2384 H  HA   . THR   A 1 157 ? 9.832   26.257  -13.234 0   26.06 ? 847  THR   A HA   1 1 
ATOM   2385 H  HB   . THR   A 1 157 ? 12.047  26.827  -13.997 0   28.15 ? 847  THR   A HB   1 1 
ATOM   2386 H  HG1  . THR   A 1 157 ? 13.291  25.52   -15.309 0   29.14 ? 847  THR   A HG1  1 1 
ATOM   2387 H  HG21 . THR   A 1 157 ? 13.635  25.381  -12.762 0   29.02 ? 847  THR   A HG21 1 1 
ATOM   2388 H  HG22 . THR   A 1 157 ? 12.196  25.744  -11.792 0   28.68 ? 847  THR   A HG22 1 1 
ATOM   2389 H  HG23 . THR   A 1 157 ? 12.383  24.154  -12.555 0   28.17 ? 847  THR   A HG23 1 1 
ATOM   2390 N  N    . PRO   A 1 158 ? 9.544   26.998  -15.885 1   23.25 ? 848  PRO   A N    1 1 
ATOM   2391 C  CA   . PRO   A 1 158 ? 9.106   27.137  -17.298 1   23.13 ? 848  PRO   A CA   1 1 
ATOM   2392 C  C    . PRO   A 1 158 ? 10.006  26.382  -18.31  1   23.66 ? 848  PRO   A C    1 1 
ATOM   2393 O  O    . PRO   A 1 158 ? 9.543   26.025  -19.392 1   23.69 ? 848  PRO   A O    1 1 
ATOM   2394 C  CB   . PRO   A 1 158 ? 9.143   28.656  -17.529 1   23.84 ? 848  PRO   A CB   1 1 
ATOM   2395 C  CG   . PRO   A 1 158 ? 8.92    29.234  -16.153 1   24.58 ? 848  PRO   A CG   1 1 
ATOM   2396 C  CD   . PRO   A 1 158 ? 9.686   28.32   -15.233 1   22.93 ? 848  PRO   A CD   1 1 
ATOM   2397 H  HA   . PRO   A 1 158 ? 8.081   26.785  -17.407 0   25.36 ? 848  PRO   A HA   1 1 
ATOM   2398 H  HB2  . PRO   A 1 158 ? 10.119  28.946  -17.915 0   27.41 ? 848  PRO   A HB2  1 1 
ATOM   2399 H  HB3  . PRO   A 1 158 ? 8.35    28.948  -18.215 0   26.82 ? 848  PRO   A HB3  1 1 
ATOM   2400 H  HG2  . PRO   A 1 158 ? 9.316   30.248  -16.109 0   28.64 ? 848  PRO   A HG2  1 1 
ATOM   2401 H  HG3  . PRO   A 1 158 ? 7.858   29.221  -15.915 0   27.85 ? 848  PRO   A HG3  1 1 
ATOM   2402 H  HD2  . PRO   A 1 158 ? 10.733  28.613  -15.188 0   27    ? 848  PRO   A HD2  1 1 
ATOM   2403 H  HD3  . PRO   A 1 158 ? 9.224   28.326  -14.247 0   26.54 ? 848  PRO   A HD3  1 1 
ATOM   2404 N  N    . GLN   A 1 159 ? 11.275  26.11   -17.957 1   23.55 ? 849  GLN   A N    1 1 
ATOM   2405 C  CA   . GLN   A 1 159 ? 12.216  25.374  -18.814 1   24.85 ? 849  GLN   A CA   1 1 
ATOM   2406 C  C    . GLN   A 1 159 ? 12.273  23.842  -18.541 1   25.26 ? 849  GLN   A C    1 1 
ATOM   2407 O  O    . GLN   A 1 159 ? 13.123  23.18   -19.132 1   26.87 ? 849  GLN   A O    1 1 
ATOM   2408 C  CB   . GLN   A 1 159 ? 13.65   25.929  -18.616 1   27.25 ? 849  GLN   A CB   1 1 
ATOM   2409 C  CG   . GLN   A 1 159 ? 13.823  27.417  -18.946 1   32.62 ? 849  GLN   A CG   1 1 
ATOM   2410 C  CD   . GLN   A 1 159 ? 13.278  28.345  -17.874 1   37.88 ? 849  GLN   A CD   1 1 
ATOM   2411 O  OE1  . GLN   A 1 159 ? 13.3    28.036  -16.679 1   39.95 ? 849  GLN   A OE1  1 1 
ATOM   2412 N  NE2  . GLN   A 1 159 ? 12.764  29.507  -18.267 1   37.77 ? 849  GLN   A NE2  1 1 
ATOM   2413 H  H    . GLN   A 1 159 ? 11.693  26.386  -17.074 0   26.92 ? 849  GLN   A H    1 1 
ATOM   2414 H  HA   . GLN   A 1 159 ? 11.958  25.518  -19.862 0   27.67 ? 849  GLN   A HA   1 1 
ATOM   2415 H  HB2  . GLN   A 1 159 ? 13.958  25.759  -17.586 0   31.33 ? 849  GLN   A HB2  1 1 
ATOM   2416 H  HB3  . GLN   A 1 159 ? 14.328  25.396  -19.281 0   31.17 ? 849  GLN   A HB3  1 1 
ATOM   2417 H  HG2  . GLN   A 1 159 ? 14.884  27.629  -19.063 0   37.58 ? 849  GLN   A HG2  1 1 
ATOM   2418 H  HG3  . GLN   A 1 159 ? 13.298  27.625  -19.877 0   36.74 ? 849  GLN   A HG3  1 1 
ATOM   2419 H  HE21 . GLN   A 1 159 ? 12.754  29.762  -19.249 0   42.52 ? 849  GLN   A HE21 1 1 
ATOM   2420 H  HE22 . GLN   A 1 159 ? 12.393  30.151  -17.576 0   42.73 ? 849  GLN   A HE22 1 1 
ATOM   2421 N  N    . HIS   A 1 160 ? 11.455  23.282  -17.639 1   23.99 ? 850  HIS   A N    1 1 
ATOM   2422 C  CA   . HIS   A 1 160 ? 11.572  21.872  -17.262 1   23.53 ? 850  HIS   A CA   1 1 
ATOM   2423 C  C    . HIS   A 1 160 ? 10.198  21.33   -16.87  1   22.49 ? 850  HIS   A C    1 1 
ATOM   2424 O  O    . HIS   A 1 160 ? 9.626   21.749  -15.855 1   22.48 ? 850  HIS   A O    1 1 
ATOM   2425 C  CB   . HIS   A 1 160 ? 12.551  21.754  -16.076 1   25.4  ? 850  HIS   A CB   1 1 
ATOM   2426 C  CG   . HIS   A 1 160 ? 12.881  20.361  -15.617 1   29.46 ? 850  HIS   A CG   1 1 
ATOM   2427 N  ND1  . HIS   A 1 160 ? 14.016  20.116  -14.854 1   32.81 ? 850  HIS   A ND1  1 1 
ATOM   2428 C  CD2  . HIS   A 1 160 ? 12.209  19.197  -15.771 1   30.33 ? 850  HIS   A CD2  1 1 
ATOM   2429 C  CE1  . HIS   A 1 160 ? 13.995  18.823  -14.58  1   33.16 ? 850  HIS   A CE1  1 1 
ATOM   2430 N  NE2  . HIS   A 1 160 ? 12.935  18.23   -15.126 1   32.31 ? 850  HIS   A NE2  1 1 
ATOM   2431 H  H    . HIS   A 1 160 ? 10.702  23.76   -17.155 0   26.25 ? 850  HIS   A H    1 1 
ATOM   2432 H  HA   . HIS   A 1 160 ? 11.962  21.28   -18.089 0   25.56 ? 850  HIS   A HA   1 1 
ATOM   2433 H  HB2  . HIS   A 1 160 ? 13.489  22.224  -16.367 0   28.5  ? 850  HIS   A HB2  1 1 
ATOM   2434 H  HB3  . HIS   A 1 160 ? 12.135  22.289  -15.223 0   28.13 ? 850  HIS   A HB3  1 1 
ATOM   2435 H  HD2  . HIS   A 1 160 ? 11.278  19.046  -16.292 0   32.03 ? 850  HIS   A HD2  1 1 
ATOM   2436 H  HE1  . HIS   A 1 160 ? 14.74   18.314  -13.99  0   36.54 ? 850  HIS   A HE1  1 1 
ATOM   2437 H  HE2  . HIS   A 1 160 ? 12.707  17.243  -15.074 0   34.53 ? 850  HIS   A HE2  1 1 
ATOM   2438 N  N    . VAL   A 1 161 ? 9.698   20.37   -17.67  1   20.94 ? 851  VAL   A N    1 1 
ATOM   2439 C  CA   . VAL   A 1 161 ? 8.392   19.751  -17.478 1   19.81 ? 851  VAL   A CA   1 1 
ATOM   2440 C  C    . VAL   A 1 161 ? 8.536   18.26   -17.236 1   19.38 ? 851  VAL   A C    1 1 
ATOM   2441 O  O    . VAL   A 1 161 ? 9.565   17.666  -17.579 1   19.68 ? 851  VAL   A O    1 1 
ATOM   2442 C  CB   . VAL   A 1 161 ? 7.415   20.047  -18.657 1   19.39 ? 851  VAL   A CB   1 1 
ATOM   2443 C  CG1  . VAL   A 1 161 ? 7.148   21.55   -18.773 1   19.81 ? 851  VAL   A CG1  1 1 
ATOM   2444 C  CG2  . VAL   A 1 161 ? 7.921   19.463  -19.999 1   19.38 ? 851  VAL   A CG2  1 1 
ATOM   2445 H  H    . VAL   A 1 161 ? 10.215  19.973  -18.447 0   22.1  ? 851  VAL   A H    1 1 
ATOM   2446 H  HA   . VAL   A 1 161 ? 7.925   20.163  -16.585 0   20.64 ? 851  VAL   A HA   1 1 
ATOM   2447 H  HB   . VAL   A 1 161 ? 6.47    19.559  -18.427 0   19.55 ? 851  VAL   A HB   1 1 
ATOM   2448 H  HG11 . VAL   A 1 161 ? 6.445   21.725  -19.585 0   20.15 ? 851  VAL   A HG11 1 1 
ATOM   2449 H  HG12 . VAL   A 1 161 ? 6.728   21.909  -17.836 0   20.46 ? 851  VAL   A HG12 1 1 
ATOM   2450 H  HG13 . VAL   A 1 161 ? 8.08    22.071  -18.986 0   20.66 ? 851  VAL   A HG13 1 1 
ATOM   2451 H  HG21 . VAL   A 1 161 ? 7.252   19.798  -20.79  0   19.42 ? 851  VAL   A HG21 1 1 
ATOM   2452 H  HG22 . VAL   A 1 161 ? 8.93    19.821  -20.197 0   19.92 ? 851  VAL   A HG22 1 1 
ATOM   2453 H  HG23 . VAL   A 1 161 ? 7.911   18.375  -19.956 0   19.56 ? 851  VAL   A HG23 1 1 
ATOM   2454 N  N    . LYS   A 1 162 ? 7.525   17.668  -16.581 1   18.52 ? 852  LYS   A N    1 1 
ATOM   2455 C  CA   . LYS   A 1 162 ? 7.52    16.251  -16.229 1   18.46 ? 852  LYS   A CA   1 1 
ATOM   2456 C  C    . LYS   A 1 162 ? 6.171   15.629  -16.509 1   18.07 ? 852  LYS   A C    1 1 
ATOM   2457 O  O    . LYS   A 1 162 ? 5.162   16.201  -16.144 1   17.94 ? 852  LYS   A O    1 1 
ATOM   2458 C  CB   . LYS   A 1 162 ? 7.791   16.078  -14.717 1   20.04 ? 852  LYS   A CB   1 1 
ATOM   2459 C  CG   . LYS   A 1 162 ? 9.122   16.63   -14.26  1   23.53 ? 852  LYS   A CG   1 1 
ATOM   2460 C  CD   . LYS   A 1 162 ? 9.452   16.09   -12.845 1   27.65 ? 852  LYS   A CD   1 1 
ATOM   2461 C  CE   . LYS   A 1 162 ? 10.652  16.766  -12.22  1   33.53 ? 852  LYS   A CE   1 1 
ATOM   2462 N  NZ   . LYS   A 1 162 ? 11.964  16.117  -12.547 1   37.46 ? 852  LYS   A NZ   1 1 
ATOM   2463 H  H    . LYS   A 1 162 ? 6.687   18.156  -16.279 0   18.89 ? 852  LYS   A H    1 1 
ATOM   2464 H  HA   . LYS   A 1 162 ? 8.282   15.708  -16.785 0   18.95 ? 852  LYS   A HA   1 1 
ATOM   2465 H  HB2  . LYS   A 1 162 ? 7.01    16.594  -14.161 0   20.73 ? 852  LYS   A HB2  1 1 
ATOM   2466 H  HB3  . LYS   A 1 162 ? 7.768   15.014  -14.483 0   20.78 ? 852  LYS   A HB3  1 1 
ATOM   2467 H  HG2  . LYS   A 1 162 ? 9.906   16.31   -14.945 0   24.77 ? 852  LYS   A HG2  1 1 
ATOM   2468 H  HG3  . LYS   A 1 162 ? 9.067   17.717  -14.219 0   24.75 ? 852  LYS   A HG3  1 1 
ATOM   2469 H  HD2  . LYS   A 1 162 ? 8.597   16.276  -12.197 0   29.03 ? 852  LYS   A HD2  1 1 
ATOM   2470 H  HD3  . LYS   A 1 162 ? 9.636   15.018  -12.904 0   29.13 ? 852  LYS   A HD3  1 1 
ATOM   2471 H  HE2  . LYS   A 1 162 ? 10.699  17.799  -12.56  0   35.54 ? 852  LYS   A HE2  1 1 
ATOM   2472 H  HE3  . LYS   A 1 162 ? 10.536  16.744  -11.137 0   35.69 ? 852  LYS   A HE3  1 1 
ATOM   2473 H  HZ1  . LYS   A 1 162 ? 12.479  15.944  -11.69  0   40.12 ? 852  LYS   A HZ1  1 1 
ATOM   2474 H  HZ2  . LYS   A 1 162 ? 11.848  15.237  -13.039 0   39.58 ? 852  LYS   A HZ2  1 1 
ATOM   2475 H  HZ3  . LYS   A 1 162 ? 12.512  16.742  -13.129 0   39.92 ? 852  LYS   A HZ3  1 1 
ATOM   2476 N  N    . ILE   A 1 163 ? 6.16    14.392  -16.977 1   17.63 ? 853  ILE   A N    1 1 
ATOM   2477 C  CA   . ILE   A 1 163 ? 4.926   13.647  -17.191 1   17.58 ? 853  ILE   A CA   1 1 
ATOM   2478 C  C    . ILE   A 1 163 ? 4.43    13.13   -15.827 1   18.42 ? 853  ILE   A C    1 1 
ATOM   2479 O  O    . ILE   A 1 163 ? 5.213   12.558  -15.057 1   18.79 ? 853  ILE   A O    1 1 
ATOM   2480 C  CB   . ILE   A 1 163 ? 5.192   12.458  -18.156 1   17.68 ? 853  ILE   A CB   1 1 
ATOM   2481 C  CG1  . ILE   A 1 163 ? 5.603   12.987  -19.57  1   18.15 ? 853  ILE   A CG1  1 1 
ATOM   2482 C  CG2  . ILE   A 1 163 ? 3.95    11.55   -18.236 1   17.64 ? 853  ILE   A CG2  1 1 
ATOM   2483 C  CD1  . ILE   A 1 163 ? 6.426   12.021  -20.35  1   18.56 ? 853  ILE   A CD1  1 1 
ATOM   2484 H  H    . ILE   A 1 163 ? 7.003   13.863  -17.179 0   17.78 ? 853  ILE   A H    1 1 
ATOM   2485 H  HA   . ILE   A 1 163 ? 4.169   14.291  -17.638 0   17.28 ? 853  ILE   A HA   1 1 
ATOM   2486 H  HB   . ILE   A 1 163 ? 6       11.864  -17.729 0   17.7  ? 853  ILE   A HB   1 1 
ATOM   2487 H  HG12 . ILE   A 1 163 ? 4.699   13.186  -20.144 0   17.6  ? 853  ILE   A HG12 1 1 
ATOM   2488 H  HG13 . ILE   A 1 163 ? 6.187   13.902  -19.48  0   17.85 ? 853  ILE   A HG13 1 1 
ATOM   2489 H  HG21 . ILE   A 1 163 ? 4.072   10.823  -19.037 0   17.4  ? 853  ILE   A HG21 1 1 
ATOM   2490 H  HG22 . ILE   A 1 163 ? 3.824   11.008  -17.299 0   17.57 ? 853  ILE   A HG22 1 1 
ATOM   2491 H  HG23 . ILE   A 1 163 ? 3.073   12.165  -18.429 0   17.24 ? 853  ILE   A HG23 1 1 
ATOM   2492 H  HD11 . ILE   A 1 163 ? 6.916   12.548  -21.167 0   18.18 ? 853  ILE   A HD11 1 1 
ATOM   2493 H  HD12 . ILE   A 1 163 ? 7.166   11.574  -19.689 0   18.52 ? 853  ILE   A HD12 1 1 
ATOM   2494 H  HD13 . ILE   A 1 163 ? 5.774   11.246  -20.753 0   18.26 ? 853  ILE   A HD13 1 1 
ATOM   2495 N  N    . THR   A 1 164 ? 3.135   13.25   -15.569 1   18.06 ? 854  THR   A N    1 1 
ATOM   2496 C  CA   . THR   A 1 164 ? 2.528   12.767  -14.319 1   18.78 ? 854  THR   A CA   1 1 
ATOM   2497 C  C    . THR   A 1 164 ? 1.282   11.888  -14.637 1   18.79 ? 854  THR   A C    1 1 
ATOM   2498 O  O    . THR   A 1 164 ? 0.981   11.622  -15.824 1   18.39 ? 854  THR   A O    1 1 
ATOM   2499 C  CB   . THR   A 1 164 ? 2.178   13.986  -13.379 1   19.85 ? 854  THR   A CB   1 1 
ATOM   2500 O  OG1  . THR   A 1 164 ? 1.934   13.463  -12.05  1   21.55 ? 854  THR   A OG1  1 1 
ATOM   2501 C  CG2  . THR   A 1 164 ? 0.905   14.73   -13.807 1   20.13 ? 854  THR   A CG2  1 1 
ATOM   2502 H  H    . THR   A 1 164 ? 2.465   13.661  -16.212 0   17.9  ? 854  THR   A H    1 1 
ATOM   2503 H  HA   . THR   A 1 164 ? 3.237   12.116  -13.808 0   19.19 ? 854  THR   A HA   1 1 
ATOM   2504 H  HB   . THR   A 1 164 ? 3.01    14.689  -13.354 0   20.18 ? 854  THR   A HB   1 1 
ATOM   2505 H  HG1  . THR   A 1 164 ? 1.872   14.204  -11.393 0   22.29 ? 854  THR   A HG1  1 1 
ATOM   2506 H  HG21 . THR   A 1 164 ? 0.811   15.653  -13.238 0   20.49 ? 854  THR   A HG21 1 1 
ATOM   2507 H  HG22 . THR   A 1 164 ? 0.944   14.967  -14.869 0   20.16 ? 854  THR   A HG22 1 1 
ATOM   2508 H  HG23 . THR   A 1 164 ? 0.022   14.127  -13.606 0   20.43 ? 854  THR   A HG23 1 1 
ATOM   2509 N  N    . ASP   A 1 165 ? 0.583   11.437  -13.555 1   18.57 ? 855  ASP   A N    1 1 
ATOM   2510 C  CA   . ASP   A 1 165 ? -0.677  10.725  -13.561 1   19.09 ? 855  ASP   A CA   1 1 
ATOM   2511 C  C    . ASP   A 1 165 ? -0.579  9.375   -14.227 1   19.8  ? 855  ASP   A C    1 1 
ATOM   2512 O  O    . ASP   A 1 165 ? -0.872  9.227   -15.418 1   19.26 ? 855  ASP   A O    1 1 
ATOM   2513 C  CB   . ASP   A 1 165 ? -1.807  11.579  -14.159 1   20.44 ? 855  ASP   A CB   1 1 
ATOM   2514 C  CG   . ASP   A 1 165 ? -3.173  11.128  -13.666 1   22.5  ? 855  ASP   A CG   1 1 
ATOM   2515 O  OD1  . ASP   A 1 165 ? -3.387  9.897   -13.537 1   22.03 ? 855  ASP   A OD1  1 1 
ATOM   2516 O  OD2  . ASP   A 1 165 ? -3.991  11.988  -13.346 1   23.2  ? 855  ASP   A OD2  1 1 
ATOM   2517 H  H    . ASP   A 1 165 ? 0.937   11.541  -12.61  0   19.26 ? 855  ASP   A H    1 1 
ATOM   2518 H  HA   . ASP   A 1 165 ? -0.922  10.536  -12.516 0   20.06 ? 855  ASP   A HA   1 1 
ATOM   2519 H  HB2  . ASP   A 1 165 ? -1.681  12.61   -13.833 0   20.97 ? 855  ASP   A HB2  1 1 
ATOM   2520 H  HB3  . ASP   A 1 165 ? -1.794  11.535  -15.246 0   20.85 ? 855  ASP   A HB3  1 1 
ATOM   2521 N  N    . PHE   A 1 166 ? -0.218  8.368   -13.42  1   20.13 ? 856  PHE   A N    1 1 
ATOM   2522 C  CA   . PHE   A 1 166 ? -0.096  7.002   -13.889 1   21.23 ? 856  PHE   A CA   1 1 
ATOM   2523 C  C    . PHE   A 1 166 ? -1.344  6.168   -13.52  1   21.7  ? 856  PHE   A C    1 1 
ATOM   2524 O  O    . PHE   A 1 166 ? -1.251  4.942   -13.452 1   22.07 ? 856  PHE   A O    1 1 
ATOM   2525 C  CB   . PHE   A 1 166 ? 1.23    6.413   -13.351 1   21.97 ? 856  PHE   A CB   1 1 
ATOM   2526 C  CG   . PHE   A 1 166 ? 2.442   7.053   -13.994 1   22.8  ? 856  PHE   A CG   1 1 
ATOM   2527 C  CD1  . PHE   A 1 166 ? 2.904   8.292   -13.569 1   23.98 ? 856  PHE   A CD1  1 1 
ATOM   2528 C  CD2  . PHE   A 1 166 ? 3.033   6.485   -15.112 1   24.06 ? 856  PHE   A CD2  1 1 
ATOM   2529 C  CE1  . PHE   A 1 166 ? 3.942   8.939   -14.244 1   24.36 ? 856  PHE   A CE1  1 1 
ATOM   2530 C  CE2  . PHE   A 1 166 ? 4.082   7.129   -15.776 1   24.22 ? 856  PHE   A CE2  1 1 
ATOM   2531 C  CZ   . PHE   A 1 166 ? 4.533   8.343   -15.33  1   23.82 ? 856  PHE   A CZ   1 1 
ATOM   2532 H  H    . PHE   A 1 166 ? -0.005  8.471   -12.433 0   21.37 ? 856  PHE   A H    1 1 
ATOM   2533 H  HA   . PHE   A 1 166 ? -0.036  6.988   -14.976 0   22.3  ? 856  PHE   A HA   1 1 
ATOM   2534 H  HB2  . PHE   A 1 166 ? 1.296   6.579   -12.277 0   23.58 ? 856  PHE   A HB2  1 1 
ATOM   2535 H  HB3  . PHE   A 1 166 ? 1.269   5.347   -13.566 0   23.63 ? 856  PHE   A HB3  1 1 
ATOM   2536 H  HD1  . PHE   A 1 166 ? 2.432   8.778   -12.732 0   25.02 ? 856  PHE   A HD1  1 1 
ATOM   2537 H  HD2  . PHE   A 1 166 ? 2.672   5.541   -15.482 0   25.27 ? 856  PHE   A HD2  1 1 
ATOM   2538 H  HE1  . PHE   A 1 166 ? 4.312   9.883   -13.882 0   25.05 ? 856  PHE   A HE1  1 1 
ATOM   2539 H  HE2  . PHE   A 1 166 ? 4.553   6.658   -16.622 0   25.02 ? 856  PHE   A HE2  1 1 
ATOM   2540 H  HZ   . PHE   A 1 166 ? 5.365   8.821   -15.818 0   24.42 ? 856  PHE   A HZ   1 1 
ATOM   2541 N  N    . GLY   A 1 167 ? -2.514  6.826   -13.422 1   21.42 ? 857  GLY   A N    1 1 
ATOM   2542 C  CA   . GLY   A 1 167 ? -3.778  6.186   -13.062 1   21.81 ? 857  GLY   A CA   1 1 
ATOM   2543 C  C    . GLY   A 1 167 ? -4.282  5.19    -14.077 1   21.57 ? 857  GLY   A C    1 1 
ATOM   2544 O  O    . GLY   A 1 167 ? -4.964  4.239   -13.714 1   22.01 ? 857  GLY   A O    1 1 
ATOM   2545 H  H    . GLY   A 1 167 ? -2.633  7.816   -13.612 0   22.9  ? 857  GLY   A H    1 1 
ATOM   2546 H  HA2  . GLY   A 1 167 ? -3.657  5.669   -12.111 0   24.34 ? 857  GLY   A HA2  1 1 
ATOM   2547 H  HA3  . GLY   A 1 167 ? -4.54   6.954   -12.935 0   24.03 ? 857  GLY   A HA3  1 1 
ATOM   2548 N  N    . LEU   A 1 168 ? -3.974  5.4     -15.369 1   20.07 ? 858  LEU   A N    1 1 
ATOM   2549 C  CA   . LEU   A 1 168 ? -4.362  4.458   -16.424 1   20.35 ? 858  LEU   A CA   1 1 
ATOM   2550 C  C    . LEU   A 1 168 ? -3.191  3.64    -16.972 1   20.85 ? 858  LEU   A C    1 1 
ATOM   2551 O  O    . LEU   A 1 168 ? -3.405  2.776   -17.815 1   21.63 ? 858  LEU   A O    1 1 
ATOM   2552 C  CB   . LEU   A 1 168 ? -5.033  5.251   -17.584 1   20.19 ? 858  LEU   A CB   1 1 
ATOM   2553 C  CG   . LEU   A 1 168 ? -6.373  5.941   -17.229 1   22.43 ? 858  LEU   A CG   1 1 
ATOM   2554 C  CD1  . LEU   A 1 168 ? -6.976  6.675   -18.451 1   22.61 ? 858  LEU   A CD1  1 1 
ATOM   2555 C  CD2  . LEU   A 1 168 ? -7.417  4.923   -16.719 1   23.61 ? 858  LEU   A CD2  1 1 
ATOM   2556 H  H    . LEU   A 1 168 ? -3.477  6.21    -15.724 0   21.7  ? 858  LEU   A H    1 1 
ATOM   2557 H  HA   . LEU   A 1 168 ? -5.066  3.722   -16.041 0   23.04 ? 858  LEU   A HA   1 1 
ATOM   2558 H  HB2  . LEU   A 1 168 ? -4.339  6.016   -17.927 0   21.68 ? 858  LEU   A HB2  1 1 
ATOM   2559 H  HB3  . LEU   A 1 168 ? -5.241  4.561   -18.4   0   22.25 ? 858  LEU   A HB3  1 1 
ATOM   2560 H  HG   . LEU   A 1 168 ? -6.204  6.675   -16.442 0   24.48 ? 858  LEU   A HG   1 1 
ATOM   2561 H  HD11 . LEU   A 1 168 ? -7.928  7.119   -18.166 0   24.82 ? 858  LEU   A HD11 1 1 
ATOM   2562 H  HD12 . LEU   A 1 168 ? -6.306  7.46    -18.794 0   24.12 ? 858  LEU   A HD12 1 1 
ATOM   2563 H  HD13 . LEU   A 1 168 ? -7.134  5.95    -19.247 0   24.72 ? 858  LEU   A HD13 1 1 
ATOM   2564 H  HD21 . LEU   A 1 168 ? -8.41   5.368   -16.744 0   26.74 ? 858  LEU   A HD21 1 1 
ATOM   2565 H  HD22 . LEU   A 1 168 ? -7.391  4.04    -17.356 0   26.7  ? 858  LEU   A HD22 1 1 
ATOM   2566 H  HD23 . LEU   A 1 168 ? -7.186  4.646   -15.692 0   26.7  ? 858  LEU   A HD23 1 1 
ATOM   2567 N  N    . ALA   A 1 169 ? -1.962  3.901   -16.51  1   20.64 ? 859  ALA   A N    1 1 
ATOM   2568 C  CA   . ALA   A 1 169 ? -0.772  3.266   -17.037 1   20.77 ? 859  ALA   A CA   1 1 
ATOM   2569 C  C    . ALA   A 1 169 ? -0.683  1.764   -16.785 1   22.1  ? 859  ALA   A C    1 1 
ATOM   2570 O  O    . ALA   A 1 169 ? -1.056  1.276   -15.704 1   21.77 ? 859  ALA   A O    1 1 
ATOM   2571 C  CB   . ALA   A 1 169 ? 0.462   3.964   -16.511 1   20.47 ? 859  ALA   A CB   1 1 
ATOM   2572 H  H    . ALA   A 1 169 ? -1.774  4.553   -15.756 0   22.41 ? 859  ALA   A H    1 1 
ATOM   2573 H  HA   . ALA   A 1 169 ? -0.781  3.415   -18.116 0   22.39 ? 859  ALA   A HA   1 1 
ATOM   2574 H  HB1  . ALA   A 1 169 ? 1.332   3.385   -16.809 0   22.07 ? 859  ALA   A HB1  1 1 
ATOM   2575 H  HB2  . ALA   A 1 169 ? 0.512   4.962   -16.943 0   21.69 ? 859  ALA   A HB2  1 1 
ATOM   2576 H  HB3  . ALA   A 1 169 ? 0.381   4.049   -15.429 0   22.26 ? 859  ALA   A HB3  1 1 
ATOM   2577 N  N    . LYS   A 1 170 ? -0.187  1.036   -17.797 1   22.53 ? 860  LYS   A N    1 1 
ATOM   2578 C  CA   . LYS   A 1 170 ? -0.051  -0.413  -17.748 1   24.19 ? 860  LYS   A CA   1 1 
ATOM   2579 C  C    . LYS   A 1 170 ? 1.333   -0.84   -18.203 1   26.24 ? 860  LYS   A C    1 1 
ATOM   2580 O  O    . LYS   A 1 170 ? 1.861   -0.304  -19.18  1   26.42 ? 860  LYS   A O    1 1 
ATOM   2581 C  CB   . LYS   A 1 170 ? -1.11   -1.076  -18.642 1   25.21 ? 860  LYS   A CB   1 1 
ATOM   2582 C  CG   . LYS   A 1 170 ? -2.555  -0.695  -18.295 1   27.38 ? 860  LYS   A CG   1 1 
ATOM   2583 C  CD   . LYS   A 1 170 ? -3.088  -1.408  -17.025 1   30.21 ? 860  LYS   A CD   1 1 
ATOM   2584 C  CE   . LYS   A 1 170 ? -4.369  -0.763  -16.568 1   34.06 ? 860  LYS   A CE   1 1 
ATOM   2585 N  NZ   . LYS   A 1 170 ? -5.056  -1.575  -15.54  1   37.88 ? 860  LYS   A NZ   1 1 
ATOM   2586 H  H    . LYS   A 1 170 ? 0.136   1.428   -18.675 0   24.64 ? 860  LYS   A H    1 1 
ATOM   2587 H  HA   . LYS   A 1 170 ? -0.182  -0.768  -16.727 0   27.52 ? 860  LYS   A HA   1 1 
ATOM   2588 H  HB2  . LYS   A 1 170 ? -0.929  -0.783  -19.675 0   28.21 ? 860  LYS   A HB2  1 1 
ATOM   2589 H  HB3  . LYS   A 1 170 ? -1.021  -2.157  -18.546 0   28.99 ? 860  LYS   A HB3  1 1 
ATOM   2590 H  HG2  . LYS   A 1 170 ? -2.64   0.379   -18.138 0   30.39 ? 860  LYS   A HG2  1 1 
ATOM   2591 H  HG3  . LYS   A 1 170 ? -3.195  -0.989  -19.125 0   30.93 ? 860  LYS   A HG3  1 1 
ATOM   2592 H  HD2  . LYS   A 1 170 ? -3.295  -2.451  -17.26  0   34.78 ? 860  LYS   A HD2  1 1 
ATOM   2593 H  HD3  . LYS   A 1 170 ? -2.373  -1.34   -16.207 0   34.25 ? 860  LYS   A HD3  1 1 
ATOM   2594 H  HE2  . LYS   A 1 170 ? -4.145  0.211   -16.136 0   37.8  ? 860  LYS   A HE2  1 1 
ATOM   2595 H  HE3  . LYS   A 1 170 ? -5.041  -0.651  -17.418 0   38.19 ? 860  LYS   A HE3  1 1 
ATOM   2596 H  HZ1  . LYS   A 1 170 ? -5.747  -1.006  -15.061 0   42.78 ? 860  LYS   A HZ1  1 1 
ATOM   2597 H  HZ2  . LYS   A 1 170 ? -5.527  -2.36   -15.979 0   43.23 ? 860  LYS   A HZ2  1 1 
ATOM   2598 H  HZ3  . LYS   A 1 170 ? -4.39   -1.927  -14.86  0   42.95 ? 860  LYS   A HZ3  1 1 
ATOM   2599 N  N    . LEU   A 1 171 ? 1.917   -1.813  -17.497 1   26.92 ? 861  LEU   A N    1 1 
ATOM   2600 C  CA   . LEU   A 1 171 ? 3.212   -2.379  -17.855 1   28.8  ? 861  LEU   A CA   1 1 
ATOM   2601 C  C    . LEU   A 1 171 ? 2.935   -3.584  -18.74  1   30.76 ? 861  LEU   A C    1 1 
ATOM   2602 O  O    . LEU   A 1 171 ? 2.057   -4.391  -18.414 1   31.4  ? 861  LEU   A O    1 1 
ATOM   2603 C  CB   . LEU   A 1 171 ? 3.986   -2.823  -16.587 1   29.37 ? 861  LEU   A CB   1 1 
ATOM   2604 C  CG   . LEU   A 1 171 ? 4.508   -1.675  -15.684 1   31.61 ? 861  LEU   A CG   1 1 
ATOM   2605 C  CD1  . LEU   A 1 171 ? 4.705   -2.152  -14.222 1   31.94 ? 861  LEU   A CD1  1 1 
ATOM   2606 C  CD2  . LEU   A 1 171 ? 5.831   -1.097  -16.238 1   32.19 ? 861  LEU   A CD2  1 1 
ATOM   2607 H  H    . LEU   A 1 171 ? 1.51    -2.236  -16.67  0   30.76 ? 861  LEU   A H    1 1 
ATOM   2608 H  HA   . LEU   A 1 171 ? 3.815   -1.657  -18.404 0   32.04 ? 861  LEU   A HA   1 1 
ATOM   2609 H  HB2  . LEU   A 1 171 ? 3.331   -3.453  -15.988 0   33.84 ? 861  LEU   A HB2  1 1 
ATOM   2610 H  HB3  . LEU   A 1 171 ? 4.846   -3.41   -16.905 0   33.7  ? 861  LEU   A HB3  1 1 
ATOM   2611 H  HG   . LEU   A 1 171 ? 3.779   -0.867  -15.658 0   34.96 ? 861  LEU   A HG   1 1 
ATOM   2612 H  HD11 . LEU   A 1 171 ? 5.073   -1.32   -13.625 0   35.91 ? 861  LEU   A HD11 1 1 
ATOM   2613 H  HD12 . LEU   A 1 171 ? 3.749   -2.497  -13.83  0   36.35 ? 861  LEU   A HD12 1 1 
ATOM   2614 H  HD13 . LEU   A 1 171 ? 5.427   -2.967  -14.209 0   36.55 ? 861  LEU   A HD13 1 1 
ATOM   2615 H  HD21 . LEU   A 1 171 ? 6.169   -0.301  -15.576 0   35.46 ? 861  LEU   A HD21 1 1 
ATOM   2616 H  HD22 . LEU   A 1 171 ? 6.577   -1.89   -16.266 0   36.05 ? 861  LEU   A HD22 1 1 
ATOM   2617 H  HD23 . LEU   A 1 171 ? 5.673   -0.706  -17.241 0   35.31 ? 861  LEU   A HD23 1 1 
ATOM   2618 N  N    . LEU   A 1 172 ? 3.665   -3.708  -19.85  1   31.17 ? 862  LEU   A N    1 1 
ATOM   2619 C  CA   . LEU   A 1 172 ? 3.494   -4.834  -20.753 1   33.15 ? 862  LEU   A CA   1 1 
ATOM   2620 C  C    . LEU   A 1 172 ? 4.448   -5.936  -20.328 1   36.19 ? 862  LEU   A C    1 1 
ATOM   2621 O  O    . LEU   A 1 172 ? 5.622   -5.668  -20.084 1   36.16 ? 862  LEU   A O    1 1 
ATOM   2622 C  CB   . LEU   A 1 172 ? 3.8     -4.441  -22.217 1   32.28 ? 862  LEU   A CB   1 1 
ATOM   2623 C  CG   . LEU   A 1 172 ? 2.978   -3.3    -22.802 1   32.33 ? 862  LEU   A CG   1 1 
ATOM   2624 C  CD1  . LEU   A 1 172 ? 3.5     -2.905  -24.169 1   32.48 ? 862  LEU   A CD1  1 1 
ATOM   2625 C  CD2  . LEU   A 1 172 ? 1.497   -3.651  -22.875 1   32.14 ? 862  LEU   A CD2  1 1 
ATOM   2626 H  H    . LEU   A 1 172 ? 4.393   -3.06   -20.134 0   34.81 ? 862  LEU   A H    1 1 
ATOM   2627 H  HA   . LEU   A 1 172 ? 2.478   -5.22   -20.697 0   37.8  ? 862  LEU   A HA   1 1 
ATOM   2628 H  HB2  . LEU   A 1 172 ? 4.848   -4.152  -22.281 0   36.23 ? 862  LEU   A HB2  1 1 
ATOM   2629 H  HB3  . LEU   A 1 172 ? 3.63    -5.315  -22.844 0   36.74 ? 862  LEU   A HB3  1 1 
ATOM   2630 H  HG   . LEU   A 1 172 ? 3.081   -2.436  -22.148 0   35.45 ? 862  LEU   A HG   1 1 
ATOM   2631 H  HD11 . LEU   A 1 172 ? 2.909   -2.073  -24.549 0   35.19 ? 862  LEU   A HD11 1 1 
ATOM   2632 H  HD12 . LEU   A 1 172 ? 4.543   -2.606  -24.076 0   35.49 ? 862  LEU   A HD12 1 1 
ATOM   2633 H  HD13 . LEU   A 1 172 ? 3.416   -3.759  -24.84  0   35.95 ? 862  LEU   A HD13 1 1 
ATOM   2634 H  HD21 . LEU   A 1 172 ? 0.985   -2.911  -23.489 0   35.4  ? 862  LEU   A HD21 1 1 
ATOM   2635 H  HD22 . LEU   A 1 172 ? 1.39    -4.641  -23.317 0   36.2  ? 862  LEU   A HD22 1 1 
ATOM   2636 H  HD23 . LEU   A 1 172 ? 1.063   -3.639  -21.877 0   36.05 ? 862  LEU   A HD23 1 1 
ATOM   2637 N  N    . GLY   A 1 173 ? 3.941   -7.162  -20.263 1   38.36 ? 863  GLY   A N    1 1 
ATOM   2638 C  CA   . GLY   A 1 173 ? 4.766   -8.321  -19.952 1   40.67 ? 863  GLY   A CA   1 1 
ATOM   2639 C  C    . GLY   A 1 173 ? 5.751   -8.595  -21.073 1   42.58 ? 863  GLY   A C    1 1 
ATOM   2640 O  O    . GLY   A 1 173 ? 5.539   -8.172  -22.213 1   42.52 ? 863  GLY   A O    1 1 
ATOM   2641 H  H    . GLY   A 1 173 ? 2.967   -7.395  -20.423 0   44.27 ? 863  GLY   A H    1 1 
ATOM   2642 H  HA2  . GLY   A 1 173 ? 5.32    -8.146  -19.031 0   47.24 ? 863  GLY   A HA2  1 1 
ATOM   2643 H  HA3  . GLY   A 1 173 ? 4.134   -9.198  -19.82  0   47.75 ? 863  GLY   A HA3  1 1 
ATOM   2644 N  N    . ALA   A 1 174 ? 6.833   -9.319  -20.752 1   44.29 ? 864  ALA   A N    1 1 
ATOM   2645 C  CA   . ALA   A 1 174 ? 7.911   -9.672  -21.686 1   45.5  ? 864  ALA   A CA   1 1 
ATOM   2646 C  C    . ALA   A 1 174 ? 7.452   -10.14  -23.065 1   46.1  ? 864  ALA   A C    1 1 
ATOM   2647 O  O    . ALA   A 1 174 ? 8.098   -9.807  -24.059 1   46.49 ? 864  ALA   A O    1 1 
ATOM   2648 C  CB   . ALA   A 1 174 ? 8.793   -10.744 -21.063 1   46.21 ? 864  ALA   A CB   1 1 
ATOM   2649 H  H    . ALA   A 1 174 ? 6.99    -9.683  -19.817 0   51.8  ? 864  ALA   A H    1 1 
ATOM   2650 H  HA   . ALA   A 1 174 ? 8.533   -8.79   -21.835 0   52.36 ? 864  ALA   A HA   1 1 
ATOM   2651 H  HB1  . ALA   A 1 174 ? 9.57    -11.019 -21.775 0   54.68 ? 864  ALA   A HB1  1 1 
ATOM   2652 H  HB2  . ALA   A 1 174 ? 9.245   -10.348 -20.155 0   54.4  ? 864  ALA   A HB2  1 1 
ATOM   2653 H  HB3  . ALA   A 1 174 ? 8.18    -11.612 -20.827 0   54.99 ? 864  ALA   A HB3  1 1 
ATOM   2654 N  N    . GLU   A 1 175 ? 6.355   -10.899 -23.142 1   46.31 ? 865  GLU   A N    1 1 
ATOM   2655 C  CA   . GLU   A 1 175 ? 5.86    -11.41  -24.425 1   47.19 ? 865  GLU   A CA   1 1 
ATOM   2656 C  C    . GLU   A 1 175 ? 4.549   -10.719 -24.843 1   47.13 ? 865  GLU   A C    1 1 
ATOM   2657 O  O    . GLU   A 1 175 ? 3.691   -11.366 -25.453 1   47.69 ? 865  GLU   A O    1 1 
ATOM   2658 C  CB   . GLU   A 1 175 ? 5.652   -12.938 -24.332 1   50.27 ? 865  GLU   A CB   1 1 
ATOM   2659 C  CG   . GLU   A 1 175 ? 6.84    -13.705 -23.762 1   56.28 ? 865  GLU   A CG   1 1 
ATOM   2660 C  CD   . GLU   A 1 175 ? 8.103   -13.605 -24.593 1   64.92 ? 865  GLU   A CD   1 1 
ATOM   2661 O  OE1  . GLU   A 1 175 ? 8.069   -14.032 -25.771 1   66.97 ? 865  GLU   A OE1  1 1 
ATOM   2662 O  OE2  . GLU   A 1 175 ? 9.128   -13.108 -24.07  1   67.58 ? 865  GLU   A OE2  1 1 
ATOM   2663 H  H    . GLU   A 1 175 ? 5.788   -11.181 -22.348 0   54.41 ? 865  GLU   A H    1 1 
ATOM   2664 H  HA   . GLU   A 1 175 ? 6.582   -11.231 -25.22  0   55.07 ? 865  GLU   A HA   1 1 
ATOM   2665 H  HB2  . GLU   A 1 175 ? 4.792   -13.136 -23.695 0   59.57 ? 865  GLU   A HB2  1 1 
ATOM   2666 H  HB3  . GLU   A 1 175 ? 5.467   -13.329 -25.332 0   59.57 ? 865  GLU   A HB3  1 1 
ATOM   2667 H  HG2  . GLU   A 1 175 ? 7.067   -13.354 -22.757 0   65.93 ? 865  GLU   A HG2  1 1 
ATOM   2668 H  HG3  . GLU   A 1 175 ? 6.571   -14.76  -23.718 0   66.85 ? 865  GLU   A HG3  1 1 
ATOM   2669 N  N    . GLU   A 1 176 ? 4.4     -9.407  -24.535 1   45.84 ? 866  GLU   A N    1 1 
ATOM   2670 C  CA   . GLU   A 1 176 ? 3.191   -8.645  -24.848 1   44.77 ? 866  GLU   A CA   1 1 
ATOM   2671 C  C    . GLU   A 1 176 ? 3.53    -7.344  -25.57  1   43.05 ? 866  GLU   A C    1 1 
ATOM   2672 O  O    . GLU   A 1 176 ? 4.367   -6.579  -25.104 1   43.11 ? 866  GLU   A O    1 1 
ATOM   2673 C  CB   . GLU   A 1 176 ? 2.429   -8.305  -23.564 1   47.53 ? 866  GLU   A CB   1 1 
ATOM   2674 C  CG   . GLU   A 1 176 ? 1.722   -9.489  -22.923 1   53.23 ? 866  GLU   A CG   1 1 
ATOM   2675 C  CD   . GLU   A 1 176 ? 1.052   -9.189  -21.593 1   60.38 ? 866  GLU   A CD   1 1 
ATOM   2676 O  OE1  . GLU   A 1 176 ? 1.28    -8.087  -21.039 1   60.35 ? 866  GLU   A OE1  1 1 
ATOM   2677 O  OE2  . GLU   A 1 176 ? 0.31    -10.066 -21.093 1   64.23 ? 866  GLU   A OE2  1 1 
ATOM   2678 H  H    . GLU   A 1 176 ? 5.11    -8.839  -24.084 0   52.23 ? 866  GLU   A H    1 1 
ATOM   2679 H  HA   . GLU   A 1 176 ? 2.529   -9.226  -25.486 0   51.31 ? 866  GLU   A HA   1 1 
ATOM   2680 H  HB2  . GLU   A 1 176 ? 3.143   -7.905  -22.845 0   53.44 ? 866  GLU   A HB2  1 1 
ATOM   2681 H  HB3  . GLU   A 1 176 ? 1.675   -7.554  -23.793 0   53.22 ? 866  GLU   A HB3  1 1 
ATOM   2682 H  HG2  . GLU   A 1 176 ? 0.954   -9.844  -23.609 0   60.47 ? 866  GLU   A HG2  1 1 
ATOM   2683 H  HG3  . GLU   A 1 176 ? 2.452   -10.28  -22.753 0   60.7  ? 866  GLU   A HG3  1 1 
ATOM   2684 N  N    . LYS   A 1 177 ? 2.834   -7.076  -26.673 1   41.54 ? 867  LYS   A N    1 1 
ATOM   2685 C  CA   . LYS   A 1 177 ? 2.997   -5.841  -27.45  1   40.49 ? 867  LYS   A CA   1 1 
ATOM   2686 C  C    . LYS   A 1 177 ? 1.825   -4.865  -27.247 1   37.8  ? 867  LYS   A C    1 1 
ATOM   2687 O  O    . LYS   A 1 177 ? 1.912   -3.727  -27.7   1   37.56 ? 867  LYS   A O    1 1 
ATOM   2688 C  CB   . LYS   A 1 177 ? 3.186   -6.145  -28.951 1   44.06 ? 867  LYS   A CB   1 1 
ATOM   2689 C  CG   . LYS   A 1 177 ? 1.993   -6.837  -29.657 1   50.56 ? 867  LYS   A CG   1 1 
ATOM   2690 C  CD   . LYS   A 1 177 ? 2.319   -7.26   -31.107 1   57.08 ? 867  LYS   A CD   1 1 
ATOM   2691 C  CE   . LYS   A 1 177 ? 3.06    -8.583  -31.198 1   62.14 ? 867  LYS   A CE   1 1 
ATOM   2692 N  NZ   . LYS   A 1 177 ? 3.491   -8.9    -32.592 1   65.49 ? 867  LYS   A NZ   1 1 
ATOM   2693 H  H    . LYS   A 1 177 ? 2.1     -7.685  -27.019 0   47.03 ? 867  LYS   A H    1 1 
ATOM   2694 H  HA   . LYS   A 1 177 ? 3.899   -5.321  -27.13  0   44.62 ? 867  LYS   A HA   1 1 
ATOM   2695 H  HB2  . LYS   A 1 177 ? 3.366   -5.204  -29.469 0   47.99 ? 867  LYS   A HB2  1 1 
ATOM   2696 H  HB3  . LYS   A 1 177 ? 4.062   -6.784  -29.053 0   48.86 ? 867  LYS   A HB3  1 1 
ATOM   2697 H  HG2  . LYS   A 1 177 ? 1.708   -7.737  -29.114 0   55.97 ? 867  LYS   A HG2  1 1 
ATOM   2698 H  HG3  . LYS   A 1 177 ? 1.154   -6.146  -29.702 0   55.09 ? 867  LYS   A HG3  1 1 
ATOM   2699 H  HD2  . LYS   A 1 177 ? 1.388   -7.36   -31.663 0   62.21 ? 867  LYS   A HD2  1 1 
ATOM   2700 H  HD3  . LYS   A 1 177 ? 2.94    -6.49   -31.562 0   61.65 ? 867  LYS   A HD3  1 1 
ATOM   2701 H  HE2  . LYS   A 1 177 ? 3.952   -8.552  -30.574 0   67.93 ? 867  LYS   A HE2  1 1 
ATOM   2702 H  HE3  . LYS   A 1 177 ? 2.399   -9.381  -30.861 0   68.48 ? 867  LYS   A HE3  1 1 
ATOM   2703 H  HZ1  . LYS   A 1 177 ? 4.225   -9.601  -32.576 0   71.83 ? 867  LYS   A HZ1  1 1 
ATOM   2704 H  HZ2  . LYS   A 1 177 ? 2.705   -9.264  -33.12  0   71.82 ? 867  LYS   A HZ2  1 1 
ATOM   2705 H  HZ3  . LYS   A 1 177 ? 3.84    -8.065  -33.052 0   70.93 ? 867  LYS   A HZ3  1 1 
ATOM   2706 N  N    . GLU   A 1 178 ? 0.735   -5.292  -26.585 1   35.68 ? 868  GLU   A N    1 1 
ATOM   2707 C  CA   . GLU   A 1 178 ? -0.418  -4.443  -26.384 1   34.72 ? 868  GLU   A CA   1 1 
ATOM   2708 C  C    . GLU   A 1 178 ? -1.161  -4.76   -25.095 1   32.89 ? 868  GLU   A C    1 1 
ATOM   2709 O  O    . GLU   A 1 178 ? -0.979  -5.834  -24.501 1   32.36 ? 868  GLU   A O    1 1 
ATOM   2710 C  CB   . GLU   A 1 178 ? -1.356  -4.531  -27.607 1   36.85 ? 868  GLU   A CB   1 1 
ATOM   2711 C  CG   . GLU   A 1 178 ? -2.004  -5.873  -27.877 1   41.45 ? 868  GLU   A CG   1 1 
ATOM   2712 C  CD   . GLU   A 1 178 ? -2.673  -5.957  -29.243 1   47.83 ? 868  GLU   A CD   1 1 
ATOM   2713 O  OE1  . GLU   A 1 178 ? -2.184  -5.318  -30.202 1   49.54 ? 868  GLU   A OE1  1 1 
ATOM   2714 O  OE2  . GLU   A 1 178 ? -3.688  -6.677  -29.356 1   50.66 ? 868  GLU   A OE2  1 1 
ATOM   2715 H  H    . GLU   A 1 178 ? 0.613   -6.215  -26.183 0   40.49 ? 868  GLU   A H    1 1 
ATOM   2716 H  HA   . GLU   A 1 178 ? -0.092  -3.407  -26.3   0   38.12 ? 868  GLU   A HA   1 1 
ATOM   2717 H  HB2  . GLU   A 1 178 ? -2.144  -3.795  -27.467 0   40.68 ? 868  GLU   A HB2  1 1 
ATOM   2718 H  HB3  . GLU   A 1 178 ? -0.765  -4.291  -28.489 0   40.63 ? 868  GLU   A HB3  1 1 
ATOM   2719 H  HG2  . GLU   A 1 178 ? -1.248  -6.656  -27.831 0   46.66 ? 868  GLU   A HG2  1 1 
ATOM   2720 H  HG3  . GLU   A 1 178 ? -2.77   -6.053  -27.124 0   46.66 ? 868  GLU   A HG3  1 1 
ATOM   2721 N  N    . TYR   A 1 179 ? -1.95   -3.782  -24.638 1   31.02 ? 869  TYR   A N    1 1 
ATOM   2722 C  CA   . TYR   A 1 179 ? -2.792  -3.896  -23.464 1   30.17 ? 869  TYR   A CA   1 1 
ATOM   2723 C  C    . TYR   A 1 179 ? -4.243  -3.835  -23.959 1   29.97 ? 869  TYR   A C    1 1 
ATOM   2724 O  O    . TYR   A 1 179 ? -4.578  -2.941  -24.735 1   28.5  ? 869  TYR   A O    1 1 
ATOM   2725 C  CB   . TYR   A 1 179 ? -2.522  -2.728  -22.485 1   29.94 ? 869  TYR   A CB   1 1 
ATOM   2726 C  CG   . TYR   A 1 179 ? -3.516  -2.699  -21.346 1   30.44 ? 869  TYR   A CG   1 1 
ATOM   2727 C  CD1  . TYR   A 1 179 ? -4.588  -1.817  -21.354 1   31.03 ? 869  TYR   A CD1  1 1 
ATOM   2728 C  CD2  . TYR   A 1 179 ? -3.462  -3.644  -20.333 1   31.34 ? 869  TYR   A CD2  1 1 
ATOM   2729 C  CE1  . TYR   A 1 179 ? -5.537  -1.83   -20.34  1   32.19 ? 869  TYR   A CE1  1 1 
ATOM   2730 C  CE2  . TYR   A 1 179 ? -4.44   -3.711  -19.354 1   32.23 ? 869  TYR   A CE2  1 1 
ATOM   2731 C  CZ   . TYR   A 1 179 ? -5.477  -2.804  -19.358 1   33.3  ? 869  TYR   A CZ   1 1 
ATOM   2732 O  OH   . TYR   A 1 179 ? -6.388  -2.848  -18.333 1   35.47 ? 869  TYR   A OH   1 1 
ATOM   2733 H  H    . TYR   A 1 179 ? -2.029  -2.871  -25.078 0   34.54 ? 869  TYR   A H    1 1 
ATOM   2734 H  HA   . TYR   A 1 179 ? -2.618  -4.835  -22.943 0   35.02 ? 869  TYR   A HA   1 1 
ATOM   2735 H  HB2  . TYR   A 1 179 ? -1.528  -2.848  -22.059 0   33.65 ? 869  TYR   A HB2  1 1 
ATOM   2736 H  HB3  . TYR   A 1 179 ? -2.583  -1.785  -23.025 0   33.24 ? 869  TYR   A HB3  1 1 
ATOM   2737 H  HD1  . TYR   A 1 179 ? -4.659  -1.074  -22.131 0   34.61 ? 869  TYR   A HD1  1 1 
ATOM   2738 H  HD2  . TYR   A 1 179 ? -2.678  -4.382  -20.344 0   36.27 ? 869  TYR   A HD2  1 1 
ATOM   2739 H  HE1  . TYR   A 1 179 ? -6.351  -1.125  -20.356 0   36.48 ? 869  TYR   A HE1  1 1 
ATOM   2740 H  HE2  . TYR   A 1 179 ? -4.362  -4.438  -18.564 0   37.91 ? 869  TYR   A HE2  1 1 
ATOM   2741 H  HH   . TYR   A 1 179 ? -6.791  -1.951  -18.198 0   40.61 ? 869  TYR   A HH   1 1 
ATOM   2742 N  N    A HIS   A 1 180 ? -5.087  -4.764  -23.488 0.5 30.58 ? 870  HIS   A N    1 1 
ATOM   2743 N  N    B HIS   A 1 180 ? -5.102  -4.781  -23.539 0.5 30.38 ? 870  HIS   A N    1 1 
ATOM   2744 C  CA   A HIS   A 1 180 ? -6.496  -4.822  -23.848 0.5 31.65 ? 870  HIS   A CA   1 1 
ATOM   2745 C  CA   B HIS   A 1 180 ? -6.511  -4.758  -23.934 0.5 31.2  ? 870  HIS   A CA   1 1 
ATOM   2746 C  C    A HIS   A 1 180 ? -7.292  -4.354  -22.636 0.5 31.78 ? 870  HIS   A C    1 1 
ATOM   2747 C  C    B HIS   A 1 180 ? -7.328  -4.381  -22.702 0.5 31.55 ? 870  HIS   A C    1 1 
ATOM   2748 O  O    A HIS   A 1 180 ? -7.2    -4.972  -21.577 0.5 32.1  ? 870  HIS   A O    1 1 
ATOM   2749 O  O    B HIS   A 1 180 ? -7.301  -5.097  -21.705 0.5 31.84 ? 870  HIS   A O    1 1 
ATOM   2750 C  CB   A HIS   A 1 180 ? -6.896  -6.257  -24.226 0.5 33.02 ? 870  HIS   A CB   1 1 
ATOM   2751 C  CB   B HIS   A 1 180 ? -6.979  -6.097  -24.527 0.5 31.98 ? 870  HIS   A CB   1 1 
ATOM   2752 C  CG   A HIS   A 1 180 ? -6.002  -6.896  -25.24  0.5 35.86 ? 870  HIS   A CG   1 1 
ATOM   2753 C  CG   B HIS   A 1 180 ? -8.416  -6.064  -24.949 0.5 34.07 ? 870  HIS   A CG   1 1 
ATOM   2754 N  ND1  A HIS   A 1 180 ? -6.148  -6.64   -26.583 0.5 37.73 ? 870  HIS   A ND1  1 1 
ATOM   2755 N  ND1  B HIS   A 1 180 ? -8.791  -5.598  -26.197 0.5 35.95 ? 870  HIS   A ND1  1 1 
ATOM   2756 C  CD2  A HIS   A 1 180 ? -5.014  -7.806  -25.074 0.5 37.28 ? 870  HIS   A CD2  1 1 
ATOM   2757 C  CD2  B HIS   A 1 180 ? -9.529  -6.398  -24.257 0.5 35.04 ? 870  HIS   A CD2  1 1 
ATOM   2758 C  CE1  A HIS   A 1 180 ? -5.231  -7.372  -27.195 0.5 38.48 ? 870  HIS   A CE1  1 1 
ATOM   2759 C  CE1  B HIS   A 1 180 ? -10.111 -5.688  -26.232 0.5 36.38 ? 870  HIS   A CE1  1 1 
ATOM   2760 N  NE2  A HIS   A 1 180 ? -4.521  -8.088  -26.325 0.5 38.35 ? 870  HIS   A NE2  1 1 
ATOM   2761 N  NE2  B HIS   A 1 180 ? -10.598 -6.156  -25.083 0.5 36.07 ? 870  HIS   A NE2  1 1 
ATOM   2762 H  H    A HIS   A 1 180 ? -4.815  -5.501  -22.844 0   36.36 ? 870  HIS   A H    1 1 
ATOM   2763 H  H    B HIS   A 1 180 ? -4.855  -5.561  -22.939 0   36.2  ? 870  HIS   A H    1 1 
ATOM   2764 H  HA   A HIS   A 1 180 ? -6.716  -4.175  -24.696 0   37.12 ? 870  HIS   A HA   1 1 
ATOM   2765 H  HA   B HIS   A 1 180 ? -6.682  -4.006  -24.702 0   36.56 ? 870  HIS   A HA   1 1 
ATOM   2766 H  HB2  A HIS   A 1 180 ? -6.874  -6.884  -23.335 0   40.25 ? 870  HIS   A HB2  1 1 
ATOM   2767 H  HB2  B HIS   A 1 180 ? -6.375  -6.326  -25.404 0   38.49 ? 870  HIS   A HB2  1 1 
ATOM   2768 H  HB3  A HIS   A 1 180 ? -7.904  -6.241  -24.639 0   40.14 ? 870  HIS   A HB3  1 1 
ATOM   2769 H  HB3  B HIS   A 1 180 ? -6.864  -6.879  -23.778 0   39.14 ? 870  HIS   A HB3  1 1 
ATOM   2770 H  HD2  A HIS   A 1 180 ? -4.679  -8.228  -24.141 0   44.5  ? 870  HIS   A HD2  1 1 
ATOM   2771 H  HD2  B HIS   A 1 180 ? -9.57   -6.78   -23.25  0   43.32 ? 870  HIS   A HD2  1 1 
ATOM   2772 H  HE1  A HIS   A 1 180 ? -5.078  -7.386  -28.261 0   45.05 ? 870  HIS   A HE1  1 1 
ATOM   2773 H  HE1  B HIS   A 1 180 ? -10.715 -5.419  -27.081 0   44.03 ? 870  HIS   A HE1  1 1 
ATOM   2774 H  HE2  A HIS   A 1 180 ? -3.758  -8.721  -26.544 0   45.45 ? 870  HIS   A HE2  1 1 
ATOM   2775 H  HE2  B HIS   A 1 180 ? -11.576 -6.306  -24.859 0   44.88 ? 870  HIS   A HE2  1 1 
ATOM   2776 N  N    . ALA   A 1 181 ? -8.044  -3.254  -22.768 1   31.51 ? 871  ALA   A N    1 1 
ATOM   2777 C  CA   . ALA   A 1 181 ? -8.816  -2.725  -21.65  1   32.87 ? 871  ALA   A CA   1 1 
ATOM   2778 C  C    . ALA   A 1 181 ? -10.227 -3.34   -21.523 1   35.06 ? 871  ALA   A C    1 1 
ATOM   2779 O  O    . ALA   A 1 181 ? -10.748 -3.921  -22.481 1   35.28 ? 871  ALA   A O    1 1 
ATOM   2780 C  CB   . ALA   A 1 181 ? -8.903  -1.202  -21.779 1   32.47 ? 871  ALA   A CB   1 1 
ATOM   2781 H  H    A ALA   A 1 181 ? -8.138  -2.715  -23.624 0   36.85 ? 871  ALA   A H    1 1 
ATOM   2782 H  H    B ALA   A 1 181 ? -8.114  -2.674  -23.598 0   36.82 ? 871  ALA   A H    1 1 
ATOM   2783 H  HA   . ALA   A 1 181 ? -8.291  -2.912  -20.714 0   38.76 ? 871  ALA   A HA   1 1 
ATOM   2784 H  HB1  . ALA   A 1 181 ? -9.39   -0.803  -20.891 0   37.75 ? 871  ALA   A HB1  1 1 
ATOM   2785 H  HB2  . ALA   A 1 181 ? -7.894  -0.799  -21.861 0   36.99 ? 871  ALA   A HB2  1 1 
ATOM   2786 H  HB3  . ALA   A 1 181 ? -9.48   -0.934  -22.661 0   37.56 ? 871  ALA   A HB3  1 1 
ATOM   2787 N  N    . GLU   A 1 182 ? -10.811 -3.223  -20.319 1   36.3  ? 872  GLU   A N    1 1 
ATOM   2788 C  CA   . GLU   A 1 182 ? -12.185 -3.607  -20.002 1   38.23 ? 872  GLU   A CA   1 1 
ATOM   2789 C  C    . GLU   A 1 182 ? -13.067 -2.304  -20.121 1   38.26 ? 872  GLU   A C    1 1 
ATOM   2790 O  O    . GLU   A 1 182 ? -12.755 -1.48   -20.983 1   38.48 ? 872  GLU   A O    1 1 
ATOM   2791 C  CB   . GLU   A 1 182 ? -12.237 -4.318  -18.62  1   42.74 ? 872  GLU   A CB   1 1 
ATOM   2792 C  CG   . GLU   A 1 182 ? -11.39  -5.583  -18.538 1   51.04 ? 872  GLU   A CG   1 1 
ATOM   2793 C  CD   . GLU   A 1 182 ? -11.603 -6.591  -19.653 1   60.58 ? 872  GLU   A CD   1 1 
ATOM   2794 O  OE1  . GLU   A 1 182 ? -12.775 -6.937  -19.934 1   62.98 ? 872  GLU   A OE1  1 1 
ATOM   2795 O  OE2  . GLU   A 1 182 ? -10.595 -7.027  -20.254 1   64.25 ? 872  GLU   A OE2  1 1 
ATOM   2796 H  H    . GLU   A 1 182 ? -10.327 -2.844  -19.511 0   43.17 ? 872  GLU   A H    1 1 
ATOM   2797 H  HA   . GLU   A 1 182 ? -12.563 -4.301  -20.75  0   46.92 ? 872  GLU   A HA   1 1 
ATOM   2798 H  HB2  . GLU   A 1 182 ? -11.88  -3.628  -17.858 0   51.09 ? 872  GLU   A HB2  1 1 
ATOM   2799 H  HB3  . GLU   A 1 182 ? -13.267 -4.601  -18.41  0   52.3  ? 872  GLU   A HB3  1 1 
ATOM   2800 H  HG2  . GLU   A 1 182 ? -10.338 -5.298  -18.551 0   59.46 ? 872  GLU   A HG2  1 1 
ATOM   2801 H  HG3  . GLU   A 1 182 ? -11.615 -6.085  -17.598 0   60.72 ? 872  GLU   A HG3  1 1 
ATOM   2802 N  N    . GLY   A 1 183 ? -14.128 -2.117  -19.323 1   37.69 ? 873  GLY   A N    1 1 
ATOM   2803 C  CA   . GLY   A 1 183 ? -15.027 -0.975  -19.492 1   37.56 ? 873  GLY   A CA   1 1 
ATOM   2804 C  C    . GLY   A 1 183 ? -14.827 0.3     -18.701 1   37.19 ? 873  GLY   A C    1 1 
ATOM   2805 O  O    . GLY   A 1 183 ? -15.776 1.077   -18.591 1   38.06 ? 873  GLY   A O    1 1 
ATOM   2806 H  H    . GLY   A 1 183 ? -14.415 -2.723  -18.562 0   46.87 ? 873  GLY   A H    1 1 
ATOM   2807 H  HA2  . GLY   A 1 183 ? -15.055 -0.694  -20.544 0   45.76 ? 873  GLY   A HA2  1 1 
ATOM   2808 H  HA3  . GLY   A 1 183 ? -16.028 -1.325  -19.245 0   46.93 ? 873  GLY   A HA3  1 1 
ATOM   2809 N  N    . GLY   A 1 184 ? -13.635 0.556   -18.172 1   35.82 ? 874  GLY   A N    1 1 
ATOM   2810 C  CA   . GLY   A 1 184 ? -13.385 1.781   -17.407 1   34.85 ? 874  GLY   A CA   1 1 
ATOM   2811 C  C    . GLY   A 1 184 ? -13.435 3.062   -18.239 1   33.54 ? 874  GLY   A C    1 1 
ATOM   2812 O  O    . GLY   A 1 184 ? -13.317 3.002   -19.464 1   33.91 ? 874  GLY   A O    1 1 
ATOM   2813 H  H    . GLY   A 1 184 ? -12.823 -0.047  -18.252 0   42.81 ? 874  GLY   A H    1 1 
ATOM   2814 H  HA2  . GLY   A 1 184 ? -14.123 1.863   -16.611 0   42.02 ? 874  GLY   A HA2  1 1 
ATOM   2815 H  HA3  . GLY   A 1 184 ? -12.4   1.717   -16.948 0   41.07 ? 874  GLY   A HA3  1 1 
ATOM   2816 N  N    . LYS   A 1 185 ? -13.605 4.236   -17.582 1   31.46 ? 875  LYS   A N    1 1 
ATOM   2817 C  CA   . LYS   A 1 185 ? -13.684 5.521   -18.296 1   29.82 ? 875  LYS   A CA   1 1 
ATOM   2818 C  C    . LYS   A 1 185 ? -12.302 5.887   -18.887 1   27.37 ? 875  LYS   A C    1 1 
ATOM   2819 O  O    . LYS   A 1 185 ? -11.286 5.727   -18.218 1   27.02 ? 875  LYS   A O    1 1 
ATOM   2820 C  CB   . LYS   A 1 185 ? -14.176 6.649   -17.38  1   32.24 ? 875  LYS   A CB   1 1 
ATOM   2821 C  CG   . LYS   A 1 185 ? -15.638 6.539   -16.959 1   38.56 ? 875  LYS   A CG   1 1 
ATOM   2822 C  CD   . LYS   A 1 185 ? -16.013 7.65    -15.987 1   44.76 ? 875  LYS   A CD   1 1 
ATOM   2823 C  CE   . LYS   A 1 185 ? -17.346 7.4     -15.324 1   50.67 ? 875  LYS   A CE   1 1 
ATOM   2824 N  NZ   . LYS   A 1 185 ? -17.715 8.494   -14.384 1   54.19 ? 875  LYS   A NZ   1 1 
ATOM   2825 H  H    . LYS   A 1 185 ? -13.672 4.311   -16.572 0   37.45 ? 875  LYS   A H    1 1 
ATOM   2826 H  HA   . LYS   A 1 185 ? -14.394 5.426   -19.115 0   35.42 ? 875  LYS   A HA   1 1 
ATOM   2827 H  HB2  . LYS   A 1 185 ? -13.562 6.671   -16.481 0   37.4  ? 875  LYS   A HB2  1 1 
ATOM   2828 H  HB3  . LYS   A 1 185 ? -14.079 7.59    -17.919 0   37.17 ? 875  LYS   A HB3  1 1 
ATOM   2829 H  HG2  . LYS   A 1 185 ? -16.276 6.621   -17.838 0   45.13 ? 875  LYS   A HG2  1 1 
ATOM   2830 H  HG3  . LYS   A 1 185 ? -15.799 5.583   -16.464 0   45.4  ? 875  LYS   A HG3  1 1 
ATOM   2831 H  HD2  . LYS   A 1 185 ? -15.257 7.713   -15.206 0   50.88 ? 875  LYS   A HD2  1 1 
ATOM   2832 H  HD3  . LYS   A 1 185 ? -16.075 8.595   -16.524 0   50.82 ? 875  LYS   A HD3  1 1 
ATOM   2833 H  HE2  . LYS   A 1 185 ? -18.118 7.337   -16.089 0   58.53 ? 875  LYS   A HE2  1 1 
ATOM   2834 H  HE3  . LYS   A 1 185 ? -17.297 6.468   -14.762 0   58.58 ? 875  LYS   A HE3  1 1 
ATOM   2835 H  HZ1  . LYS   A 1 185 ? -18.459 8.183   -13.767 0   62.52 ? 875  LYS   A HZ1  1 1 
ATOM   2836 H  HZ2  . LYS   A 1 185 ? -16.911 8.76    -13.824 0   61.25 ? 875  LYS   A HZ2  1 1 
ATOM   2837 H  HZ3  . LYS   A 1 185 ? -18.039 9.302   -14.905 0   61.89 ? 875  LYS   A HZ3  1 1 
ATOM   2838 N  N    . VAL   A 1 186 ? -12.276 6.369   -20.139 1   25.97 ? 876  VAL   A N    1 1 
ATOM   2839 C  CA   . VAL   A 1 186 ? -11.034 6.658   -20.849 1   24.66 ? 876  VAL   A CA   1 1 
ATOM   2840 C  C    . VAL   A 1 186 ? -11.114 8.016   -21.597 1   24    ? 876  VAL   A C    1 1 
ATOM   2841 O  O    . VAL   A 1 186 ? -12.208 8.444   -21.98  1   24.13 ? 876  VAL   A O    1 1 
ATOM   2842 C  CB   . VAL   A 1 186 ? -10.656 5.49    -21.819 1   24.98 ? 876  VAL   A CB   1 1 
ATOM   2843 C  CG1  . VAL   A 1 186 ? -10.118 4.271   -21.068 1   24.93 ? 876  VAL   A CG1  1 1 
ATOM   2844 C  CG2  . VAL   A 1 186 ? -11.827 5.101   -22.723 1   25.81 ? 876  VAL   A CG2  1 1 
ATOM   2845 H  H    . VAL   A 1 186 ? -13.112 6.619   -20.657 0   30.25 ? 876  VAL   A H    1 1 
ATOM   2846 H  HA   . VAL   A 1 186 ? -10.244 6.753   -20.105 0   27.59 ? 876  VAL   A HA   1 1 
ATOM   2847 H  HB   . VAL   A 1 186 ? -9.859  5.833   -22.475 0   27.7  ? 876  VAL   A HB   1 1 
ATOM   2848 H  HG11 . VAL   A 1 186 ? -9.873  3.493   -21.789 0   28.51 ? 876  VAL   A HG11 1 1 
ATOM   2849 H  HG12 . VAL   A 1 186 ? -9.226  4.562   -20.515 0   28.05 ? 876  VAL   A HG12 1 1 
ATOM   2850 H  HG13 . VAL   A 1 186 ? -10.883 3.913   -20.38  0   29    ? 876  VAL   A HG13 1 1 
ATOM   2851 H  HG21 . VAL   A 1 186 ? -11.506 4.283   -23.365 0   29.68 ? 876  VAL   A HG21 1 1 
ATOM   2852 H  HG22 . VAL   A 1 186 ? -12.671 4.766   -22.121 0   30.24 ? 876  VAL   A HG22 1 1 
ATOM   2853 H  HG23 . VAL   A 1 186 ? -12.117 5.957   -23.329 0   29.44 ? 876  VAL   A HG23 1 1 
ATOM   2854 N  N    . PRO   A 1 187 ? -9.958  8.703   -21.828 1   22.25 ? 877  PRO   A N    1 1 
ATOM   2855 C  CA   . PRO   A 1 187 ? -10.005 10.027  -22.484 1   20.76 ? 877  PRO   A CA   1 1 
ATOM   2856 C  C    . PRO   A 1 187 ? -10.129 9.951   -24.015 1   19.15 ? 877  PRO   A C    1 1 
ATOM   2857 O  O    . PRO   A 1 187 ? -9.153  10.137  -24.725 1   18.66 ? 877  PRO   A O    1 1 
ATOM   2858 C  CB   . PRO   A 1 187 ? -8.684  10.671  -22.028 1   21.99 ? 877  PRO   A CB   1 1 
ATOM   2859 C  CG   . PRO   A 1 187 ? -7.723  9.502   -21.955 1   22.16 ? 877  PRO   A CG   1 1 
ATOM   2860 C  CD   . PRO   A 1 187 ? -8.574  8.336   -21.443 1   21.53 ? 877  PRO   A CD   1 1 
ATOM   2861 H  HA   . PRO   A 1 187 ? -10.827 10.624  -22.092 0   22.84 ? 877  PRO   A HA   1 1 
ATOM   2862 H  HB2  . PRO   A 1 187 ? -8.346  11.426  -22.736 0   22.88 ? 877  PRO   A HB2  1 1 
ATOM   2863 H  HB3  . PRO   A 1 187 ? -8.818  11.11   -21.04  0   23.28 ? 877  PRO   A HB3  1 1 
ATOM   2864 H  HG2  . PRO   A 1 187 ? -7.328  9.286   -22.947 0   23.04 ? 877  PRO   A HG2  1 1 
ATOM   2865 H  HG3  . PRO   A 1 187 ? -6.919  9.729   -21.256 0   23.03 ? 877  PRO   A HG3  1 1 
ATOM   2866 H  HD2  . PRO   A 1 187 ? -8.259  7.417   -21.934 0   23.28 ? 877  PRO   A HD2  1 1 
ATOM   2867 H  HD3  . PRO   A 1 187 ? -8.481  8.263   -20.36  0   23.35 ? 877  PRO   A HD3  1 1 
ATOM   2868 N  N    . ILE   A 1 188 ? -11.357 9.738   -24.513 1   18.43 ? 878  ILE   A N    1 1 
ATOM   2869 C  CA   . ILE   A 1 188 ? -11.645 9.536   -25.942 1   19.19 ? 878  ILE   A CA   1 1 
ATOM   2870 C  C    . ILE   A 1 188 ? -10.932 10.537  -26.886 1   17.58 ? 878  ILE   A C    1 1 
ATOM   2871 O  O    . ILE   A 1 188 ? -10.349 10.121  -27.886 1   17.08 ? 878  ILE   A O    1 1 
ATOM   2872 C  CB   . ILE   A 1 188 ? -13.2   9.531   -26.196 1   20.6  ? 878  ILE   A CB   1 1 
ATOM   2873 C  CG1  . ILE   A 1 188 ? -13.943 8.363   -25.441 1   22.47 ? 878  ILE   A CG1  1 1 
ATOM   2874 C  CG2  . ILE   A 1 188 ? -13.526 9.507   -27.7   1   21.43 ? 878  ILE   A CG2  1 1 
ATOM   2875 C  CD1  . ILE   A 1 188 ? -13.535 6.894   -25.796 1   25.21 ? 878  ILE   A CD1  1 1 
ATOM   2876 H  H    . ILE   A 1 188 ? -12.179 9.77    -23.919 0   21.08 ? 878  ILE   A H    1 1 
ATOM   2877 H  HA   . ILE   A 1 188 ? -11.264 8.549   -26.2   0   21.44 ? 878  ILE   A HA   1 1 
ATOM   2878 H  HB   . ILE   A 1 188 ? -13.588 10.467  -25.798 0   23.63 ? 878  ILE   A HB   1 1 
ATOM   2879 H  HG12 . ILE   A 1 188 ? -13.804 8.482   -24.367 0   26.16 ? 878  ILE   A HG12 1 1 
ATOM   2880 H  HG13 . ILE   A 1 188 ? -15.006 8.451   -25.66  0   26.73 ? 878  ILE   A HG13 1 1 
ATOM   2881 H  HG21 . ILE   A 1 188 ? -14.556 9.178   -27.832 0   25.06 ? 878  ILE   A HG21 1 1 
ATOM   2882 H  HG22 . ILE   A 1 188 ? -13.421 10.509  -28.112 0   24.05 ? 878  ILE   A HG22 1 1 
ATOM   2883 H  HG23 . ILE   A 1 188 ? -12.849 8.818   -28.203 0   24.42 ? 878  ILE   A HG23 1 1 
ATOM   2884 H  HD11 . ILE   A 1 188 ? -14.191 6.22    -25.247 0   29.64 ? 878  ILE   A HD11 1 1 
ATOM   2885 H  HD12 . ILE   A 1 188 ? -13.65  6.716   -26.864 0   29.12 ? 878  ILE   A HD12 1 1 
ATOM   2886 H  HD13 . ILE   A 1 188 ? -12.504 6.711   -25.497 0   28.57 ? 878  ILE   A HD13 1 1 
ATOM   2887 N  N    . LYS   A 1 189 ? -10.974 11.845  -26.578 1   16.66 ? 879  LYS   A N    1 1 
ATOM   2888 C  CA   . LYS   A 1 189 ? -10.423 12.848  -27.499 1   16.32 ? 879  LYS   A CA   1 1 
ATOM   2889 C  C    . LYS   A 1 189 ? -8.863  12.872  -27.595 1   16.38 ? 879  LYS   A C    1 1 
ATOM   2890 O  O    . LYS   A 1 189 ? -8.327  13.572  -28.449 1   16.72 ? 879  LYS   A O    1 1 
ATOM   2891 C  CB   . LYS   A 1 189 ? -10.986 14.228  -27.158 1   16.07 ? 879  LYS   A CB   1 1 
ATOM   2892 C  CG   . LYS   A 1 189 ? -12.511 14.318  -27.449 1   18.01 ? 879  LYS   A CG   1 1 
ATOM   2893 C  CD   . LYS   A 1 189 ? -13.079 15.692  -27.169 1   18.7  ? 879  LYS   A CD   1 1 
ATOM   2894 C  CE   . LYS   A 1 189 ? -14.53  15.793  -27.613 1   20.6  ? 879  LYS   A CE   1 1 
ATOM   2895 N  NZ   . LYS   A 1 189 ? -15.147 17.131  -27.316 1   21.01 ? 879  LYS   A NZ   1 1 
ATOM   2896 H  H    . LYS   A 1 189 ? -11.352 12.216  -25.712 0   18.34 ? 879  LYS   A H    1 1 
ATOM   2897 H  HA   . LYS   A 1 189 ? -10.767 12.602  -28.503 0   17.5  ? 879  LYS   A HA   1 1 
ATOM   2898 H  HB2  . LYS   A 1 189 ? -10.826 14.437  -26.101 0   17.24 ? 879  LYS   A HB2  1 1 
ATOM   2899 H  HB3  . LYS   A 1 189 ? -10.483 14.982  -27.761 0   16.96 ? 879  LYS   A HB3  1 1 
ATOM   2900 H  HG2  . LYS   A 1 189 ? -12.685 14.091  -28.499 0   19.9  ? 879  LYS   A HG2  1 1 
ATOM   2901 H  HG3  . LYS   A 1 189 ? -13.043 13.606  -26.819 0   20.22 ? 879  LYS   A HG3  1 1 
ATOM   2902 H  HD2  . LYS   A 1 189 ? -13.034 15.89   -26.099 0   20.78 ? 879  LYS   A HD2  1 1 
ATOM   2903 H  HD3  . LYS   A 1 189 ? -12.501 16.437  -27.715 0   20.4  ? 879  LYS   A HD3  1 1 
ATOM   2904 H  HE2  . LYS   A 1 189 ? -14.597 15.633  -28.687 0   23.33 ? 879  LYS   A HE2  1 1 
ATOM   2905 H  HE3  . LYS   A 1 189 ? -15.111 15.036  -27.089 0   23.75 ? 879  LYS   A HE3  1 1 
ATOM   2906 H  HZ1  . LYS   A 1 189 ? -15.803 17.372  -28.052 0   24.3  ? 879  LYS   A HZ1  1 1 
ATOM   2907 H  HZ2  . LYS   A 1 189 ? -15.651 17.091  -26.437 0   24.48 ? 879  LYS   A HZ2  1 1 
ATOM   2908 H  HZ3  . LYS   A 1 189 ? -14.439 17.857  -27.26  0   23.66 ? 879  LYS   A HZ3  1 1 
ATOM   2909 N  N    . TRP   A 1 190 ? -8.174  12.136  -26.728 1   15.76 ? 880  TRP   A N    1 1 
ATOM   2910 C  CA   . TRP   A 1 190 ? -6.709  11.982  -26.761 1   16.05 ? 880  TRP   A CA   1 1 
ATOM   2911 C  C    . TRP   A 1 190 ? -6.321  10.586  -27.286 1   16.81 ? 880  TRP   A C    1 1 
ATOM   2912 O  O    . TRP   A 1 190 ? -5.139  10.336  -27.45  1   16.81 ? 880  TRP   A O    1 1 
ATOM   2913 C  CB   . TRP   A 1 190 ? -6.112  12.191  -25.344 1   15.23 ? 880  TRP   A CB   1 1 
ATOM   2914 C  CG   . TRP   A 1 190 ? -6.031  13.635  -24.946 1   15.7  ? 880  TRP   A CG   1 1 
ATOM   2915 C  CD1  . TRP   A 1 190 ? -4.936  14.443  -25.044 1   16.6  ? 880  TRP   A CD1  1 1 
ATOM   2916 C  CD2  . TRP   A 1 190 ? -7.117  14.479  -24.531 1   16.26 ? 880  TRP   A CD2  1 1 
ATOM   2917 N  NE1  . TRP   A 1 190 ? -5.258  15.723  -24.67  1   17.25 ? 880  TRP   A NE1  1 1 
ATOM   2918 C  CE2  . TRP   A 1 190 ? -6.602  15.784  -24.392 1   17.06 ? 880  TRP   A CE2  1 1 
ATOM   2919 C  CE3  . TRP   A 1 190 ? -8.479  14.257  -24.261 1   16.79 ? 880  TRP   A CE3  1 1 
ATOM   2920 C  CZ2  . TRP   A 1 190 ? -7.39   16.859  -23.97  1   17.99 ? 880  TRP   A CZ2  1 1 
ATOM   2921 C  CZ3  . TRP   A 1 190 ? -9.255  15.32   -23.836 1   17.75 ? 880  TRP   A CZ3  1 1 
ATOM   2922 C  CH2  . TRP   A 1 190 ? -8.721  16.61   -23.734 1   17.98 ? 880  TRP   A CH2  1 1 
ATOM   2923 H  H    . TRP   A 1 190 ? -8.592  11.621  -25.959 0   16.41 ? 880  TRP   A H    1 1 
ATOM   2924 H  HA   . TRP   A 1 190 ? -6.26   12.716  -27.429 0   15.75 ? 880  TRP   A HA   1 1 
ATOM   2925 H  HB2  . TRP   A 1 190 ? -6.729  11.676  -24.609 0   15.38 ? 880  TRP   A HB2  1 1 
ATOM   2926 H  HB3  . TRP   A 1 190 ? -5.099  11.791  -25.314 0   14.9  ? 880  TRP   A HB3  1 1 
ATOM   2927 H  HD1  . TRP   A 1 190 ? -3.956  14.117  -25.35  0   15.81 ? 880  TRP   A HD1  1 1 
ATOM   2928 H  HE1  . TRP   A 1 190 ? -4.597  16.522  -24.661 0   16.59 ? 880  TRP   A HE1  1 1 
ATOM   2929 H  HE3  . TRP   A 1 190 ? -8.914  13.281  -24.4   0   17.48 ? 880  TRP   A HE3  1 1 
ATOM   2930 H  HZ2  . TRP   A 1 190 ? -6.97   17.839  -23.826 0   17.96 ? 880  TRP   A HZ2  1 1 
ATOM   2931 H  HZ3  . TRP   A 1 190 ? -10.307 15.168  -23.658 0   18.9  ? 880  TRP   A HZ3  1 1 
ATOM   2932 H  HH2  . TRP   A 1 190 ? -9.348  17.41   -23.377 0   18.74 ? 880  TRP   A HH2  1 1 
ATOM   2933 N  N    . MET   A 1 191 ? -7.31   9.689   -27.571 1   16.46 ? 881  MET   A N    1 1 
ATOM   2934 C  CA   . MET   A 1 191 ? -7.029  8.315   -27.939 1   16.91 ? 881  MET   A CA   1 1 
ATOM   2935 C  C    . MET   A 1 191 ? -6.885  8.032   -29.42  1   17.84 ? 881  MET   A C    1 1 
ATOM   2936 O  O    . MET   A 1 191 ? -7.595  8.62    -30.264 1   18.25 ? 881  MET   A O    1 1 
ATOM   2937 C  CB   . MET   A 1 191 ? -8.146  7.398   -27.373 1   17.25 ? 881  MET   A CB   1 1 
ATOM   2938 C  CG   . MET   A 1 191 ? -8.047  7.154   -25.864 1   19.02 ? 881  MET   A CG   1 1 
ATOM   2939 S  SD   . MET   A 1 191 ? -9.602  6.639   -25.104 1   23.3  ? 881  MET   A SD   1 1 
ATOM   2940 C  CE   . MET   A 1 191 ? -9.938  5.109   -26.004 1   19.48 ? 881  MET   A CE   1 1 
ATOM   2941 H  H    . MET   A 1 191 ? -8.303  9.9     -27.571 0   17.16 ? 881  MET   A H    1 1 
ATOM   2942 H  HA   . MET   A 1 191 ? -6.097  8.023   -27.458 0   17.27 ? 881  MET   A HA   1 1 
ATOM   2943 H  HB2  . MET   A 1 191 ? -9.124  7.828   -27.582 0   18.68 ? 881  MET   A HB2  1 1 
ATOM   2944 H  HB3  . MET   A 1 191 ? -8.061  6.439   -27.879 0   18.65 ? 881  MET   A HB3  1 1 
ATOM   2945 H  HG2  . MET   A 1 191 ? -7.313  6.369   -25.685 0   20.31 ? 881  MET   A HG2  1 1 
ATOM   2946 H  HG3  . MET   A 1 191 ? -7.731  8.074   -25.375 0   20.05 ? 881  MET   A HG3  1 1 
ATOM   2947 H  HE1  . MET   A 1 191 ? -10.767 4.593   -25.523 0   22.68 ? 881  MET   A HE1  1 1 
ATOM   2948 H  HE2  . MET   A 1 191 ? -10.218 5.344   -27.029 0   21.99 ? 881  MET   A HE2  1 1 
ATOM   2949 H  HE3  . MET   A 1 191 ? -9.052  4.476   -25.981 0   22.01 ? 881  MET   A HE3  1 1 
ATOM   2950 N  N    . ALA   A 1 192 ? -6.009  7.059   -29.725 1   17.35 ? 882  ALA   A N    1 1 
ATOM   2951 C  CA   . ALA   A 1 192 ? -5.842  6.545   -31.08  1   17.22 ? 882  ALA   A CA   1 1 
ATOM   2952 C  C    . ALA   A 1 192 ? -7.126  5.848   -31.518 1   17.51 ? 882  ALA   A C    1 1 
ATOM   2953 O  O    . ALA   A 1 192 ? -7.88   5.313   -30.684 1   17.67 ? 882  ALA   A O    1 1 
ATOM   2954 C  CB   . ALA   A 1 192 ? -4.69   5.555   -31.122 1   16.91 ? 882  ALA   A CB   1 1 
ATOM   2955 H  H    . ALA   A 1 192 ? -5.405  6.605   -29.047 0   17.83 ? 882  ALA   A H    1 1 
ATOM   2956 H  HA   . ALA   A 1 192 ? -5.638  7.365   -31.765 0   17.48 ? 882  ALA   A HA   1 1 
ATOM   2957 H  HB1  . ALA   A 1 192 ? -4.598  5.163   -32.134 0   17.48 ? 882  ALA   A HB1  1 1 
ATOM   2958 H  HB2  . ALA   A 1 192 ? -3.779  6.082   -30.845 0   17.09 ? 882  ALA   A HB2  1 1 
ATOM   2959 H  HB3  . ALA   A 1 192 ? -4.885  4.743   -30.423 0   17.72 ? 882  ALA   A HB3  1 1 
ATOM   2960 N  N    . LEU   A 1 193 ? -7.407  5.866   -32.829 1   18.09 ? 883  LEU   A N    1 1 
ATOM   2961 C  CA   . LEU   A 1 193 ? -8.627  5.215   -33.33  1   19.02 ? 883  LEU   A CA   1 1 
ATOM   2962 C  C    . LEU   A 1 193 ? -8.74   3.728   -32.904 1   19.44 ? 883  LEU   A C    1 1 
ATOM   2963 O  O    . LEU   A 1 193 ? -9.816  3.293   -32.466 1   20.38 ? 883  LEU   A O    1 1 
ATOM   2964 C  CB   . LEU   A 1 193 ? -8.697  5.345   -34.865 1   19.12 ? 883  LEU   A CB   1 1 
ATOM   2965 C  CG   . LEU   A 1 193 ? -9.96   4.725   -35.526 1   21.23 ? 883  LEU   A CG   1 1 
ATOM   2966 C  CD1  . LEU   A 1 193 ? -11.236 5.377   -35.006 1   21.7  ? 883  LEU   A CD1  1 1 
ATOM   2967 C  CD2  . LEU   A 1 193 ? -9.87   4.85    -37.017 1   21.6  ? 883  LEU   A CD2  1 1 
ATOM   2968 H  H    . LEU   A 1 193 ? -6.834  6.306   -33.542 0   18.94 ? 883  LEU   A H    1 1 
ATOM   2969 H  HA   . LEU   A 1 193 ? -9.468  5.746   -32.886 0   20.96 ? 883  LEU   A HA   1 1 
ATOM   2970 H  HB2  . LEU   A 1 193 ? -8.678  6.402   -35.123 0   20.55 ? 883  LEU   A HB2  1 1 
ATOM   2971 H  HB3  . LEU   A 1 193 ? -7.826  4.851   -35.293 0   20.71 ? 883  LEU   A HB3  1 1 
ATOM   2972 H  HG   . LEU   A 1 193 ? -10.015 3.66    -35.303 0   24.04 ? 883  LEU   A HG   1 1 
ATOM   2973 H  HD11 . LEU   A 1 193 ? -12.062 5.168   -35.685 0   25.03 ? 883  LEU   A HD11 1 1 
ATOM   2974 H  HD12 . LEU   A 1 193 ? -11.48  4.98    -34.022 0   24.55 ? 883  LEU   A HD12 1 1 
ATOM   2975 H  HD13 . LEU   A 1 193 ? -11.074 6.451   -34.937 0   24.16 ? 883  LEU   A HD13 1 1 
ATOM   2976 H  HD21 . LEU   A 1 193 ? -10.775 4.448   -37.469 0   24.54 ? 883  LEU   A HD21 1 1 
ATOM   2977 H  HD22 . LEU   A 1 193 ? -9.752  5.9     -37.281 0   23.67 ? 883  LEU   A HD22 1 1 
ATOM   2978 H  HD23 . LEU   A 1 193 ? -9.007  4.278   -37.353 0   23.84 ? 883  LEU   A HD23 1 1 
ATOM   2979 N  N    . GLU   A 1 194 ? -7.657  2.958   -33.008 1   19.21 ? 884  GLU   A N    1 1 
ATOM   2980 C  CA   . GLU   A 1 194 ? -7.708  1.53    -32.612 1   20.14 ? 884  GLU   A CA   1 1 
ATOM   2981 C  C    . GLU   A 1 194 ? -8.079  1.347   -31.118 1   21.13 ? 884  GLU   A C    1 1 
ATOM   2982 O  O    . GLU   A 1 194 ? -8.703  0.343   -30.761 1   22.16 ? 884  GLU   A O    1 1 
ATOM   2983 C  CB   . GLU   A 1 194 ? -6.415  0.768   -32.984 1   21.7  ? 884  GLU   A CB   1 1 
ATOM   2984 C  CG   . GLU   A 1 194 ? -5.166  1.163   -32.209 1   22.17 ? 884  GLU   A CG   1 1 
ATOM   2985 C  CD   . GLU   A 1 194 ? -4.409  2.386   -32.712 1   23.03 ? 884  GLU   A CD   1 1 
ATOM   2986 O  OE1  . GLU   A 1 194 ? -3.27   2.599   -32.23  1   19.89 ? 884  GLU   A OE1  1 1 
ATOM   2987 O  OE2  . GLU   A 1 194 ? -4.928  3.114   -33.592 1   22.71 ? 884  GLU   A OE2  1 1 
ATOM   2988 H  H    . GLU   A 1 194 ? -6.764  3.272   -33.375 0   20.96 ? 884  GLU   A H    1 1 
ATOM   2989 H  HA   . GLU   A 1 194 ? -8.508  1.063   -33.185 0   23.32 ? 884  GLU   A HA   1 1 
ATOM   2990 H  HB2  . GLU   A 1 194 ? -6.586  -0.29   -32.792 0   24.8  ? 884  GLU   A HB2  1 1 
ATOM   2991 H  HB3  . GLU   A 1 194 ? -6.219  0.909   -34.045 0   24.17 ? 884  GLU   A HB3  1 1 
ATOM   2992 H  HG2  . GLU   A 1 194 ? -5.413  1.348   -31.165 0   24.28 ? 884  GLU   A HG2  1 1 
ATOM   2993 H  HG3  . GLU   A 1 194 ? -4.47   0.327   -32.26  0   24.42 ? 884  GLU   A HG3  1 1 
ATOM   2994 N  N    . SER   A 1 195 ? -7.738  2.319   -30.258 1   19.78 ? 885  SER   A N    1 1 
ATOM   2995 C  CA   . SER   A 1 195 ? -8.091  2.244   -28.85  1   19.4  ? 885  SER   A CA   1 1 
ATOM   2996 C  C    . SER   A 1 195 ? -9.591  2.512   -28.669 1   20.03 ? 885  SER   A C    1 1 
ATOM   2997 O  O    . SER   A 1 195 ? -10.222 1.859   -27.829 1   20.68 ? 885  SER   A O    1 1 
ATOM   2998 C  CB   . SER   A 1 195 ? -7.284  3.257   -28.042 1   18.8  ? 885  SER   A CB   1 1 
ATOM   2999 O  OG   . SER   A 1 195 ? -5.893  3.069   -28.281 1   19.38 ? 885  SER   A OG   1 1 
ATOM   3000 H  H    . SER   A 1 195 ? -7.208  3.152   -30.493 0   21.77 ? 885  SER   A H    1 1 
ATOM   3001 H  HA   . SER   A 1 195 ? -7.867  1.252   -28.462 0   22.43 ? 885  SER   A HA   1 1 
ATOM   3002 H  HB2  . SER   A 1 195 ? -7.585  4.257   -28.347 0   20.64 ? 885  SER   A HB2  1 1 
ATOM   3003 H  HB3  . SER   A 1 195 ? -7.481  3.104   -26.982 0   21.08 ? 885  SER   A HB3  1 1 
ATOM   3004 H  HG   . SER   A 1 195 ? -5.417  3.941   -28.245 0   20.69 ? 885  SER   A HG   1 1 
ATOM   3005 N  N    . ILE   A 1 196 ? -10.162 3.445   -29.435 1   19.61 ? 886  ILE   A N    1 1 
ATOM   3006 C  CA   . ILE   A 1 196 ? -11.591 3.734   -29.343 1   21.62 ? 886  ILE   A CA   1 1 
ATOM   3007 C  C    . ILE   A 1 196 ? -12.397 2.533   -29.885 1   23.69 ? 886  ILE   A C    1 1 
ATOM   3008 O  O    . ILE   A 1 196 ? -13.387 2.134   -29.264 1   23.88 ? 886  ILE   A O    1 1 
ATOM   3009 C  CB   . ILE   A 1 196 ? -11.995 5.048   -30.093 1   21.86 ? 886  ILE   A CB   1 1 
ATOM   3010 C  CG1  . ILE   A 1 196 ? -11.28  6.307   -29.503 1   22.47 ? 886  ILE   A CG1  1 1 
ATOM   3011 C  CG2  . ILE   A 1 196 ? -13.556 5.233   -30.052 1   21.96 ? 886  ILE   A CG2  1 1 
ATOM   3012 C  CD1  . ILE   A 1 196 ? -11.22  7.495   -30.478 1   23.5  ? 886  ILE   A CD1  1 1 
ATOM   3013 H  H    . ILE   A 1 196 ? -9.673  4.002   -30.129 0   22.23 ? 886  ILE   A H    1 1 
ATOM   3014 H  HA   . ILE   A 1 196 ? -11.858 3.869   -28.296 0   25.35 ? 886  ILE   A HA   1 1 
ATOM   3015 H  HB   . ILE   A 1 196 ? -11.693 4.943   -31.133 0   25.01 ? 886  ILE   A HB   1 1 
ATOM   3016 H  HG12 . ILE   A 1 196 ? -11.82  6.633   -28.616 0   25.31 ? 886  ILE   A HG12 1 1 
ATOM   3017 H  HG13 . ILE   A 1 196 ? -10.252 6.057   -29.242 0   24.75 ? 886  ILE   A HG13 1 1 
ATOM   3018 H  HG21 . ILE   A 1 196 ? -13.83  6.249   -30.33  0   25.87 ? 886  ILE   A HG21 1 1 
ATOM   3019 H  HG22 . ILE   A 1 196 ? -14.029 4.544   -30.75  0   26.55 ? 886  ILE   A HG22 1 1 
ATOM   3020 H  HG23 . ILE   A 1 196 ? -13.903 5.023   -29.041 0   26.25 ? 886  ILE   A HG23 1 1 
ATOM   3021 H  HD11 . ILE   A 1 196 ? -10.617 8.284   -30.03  0   25.34 ? 886  ILE   A HD11 1 1 
ATOM   3022 H  HD12 . ILE   A 1 196 ? -10.762 7.163   -31.409 0   25.55 ? 886  ILE   A HD12 1 1 
ATOM   3023 H  HD13 . ILE   A 1 196 ? -12.223 7.871   -30.668 0   26.14 ? 886  ILE   A HD13 1 1 
ATOM   3024 N  N    . LEU   A 1 197 ? -11.974 1.962   -31.024 1   24.91 ? 887  LEU   A N    1 1 
ATOM   3025 C  CA   . LEU   A 1 197 ? -12.705 0.865   -31.656 1   27.18 ? 887  LEU   A CA   1 1 
ATOM   3026 C  C    . LEU   A 1 197 ? -12.513 -0.502  -30.988 1   29.04 ? 887  LEU   A C    1 1 
ATOM   3027 O  O    . LEU   A 1 197 ? -13.462 -1.288  -30.949 1   30.1  ? 887  LEU   A O    1 1 
ATOM   3028 C  CB   . LEU   A 1 197 ? -12.274 0.716   -33.129 1   27.86 ? 887  LEU   A CB   1 1 
ATOM   3029 C  CG   . LEU   A 1 197 ? -12.51  1.873   -34.099 1   29.6  ? 887  LEU   A CG   1 1 
ATOM   3030 C  CD1  . LEU   A 1 197 ? -11.963 1.511   -35.482 1   29.98 ? 887  LEU   A CD1  1 1 
ATOM   3031 C  CD2  . LEU   A 1 197 ? -14.002 2.239   -34.223 1   30.68 ? 887  LEU   A CD2  1 1 
ATOM   3032 H  H    . LEU   A 1 197 ? -11.129 2.232   -31.518 0   28.77 ? 887  LEU   A H    1 1 
ATOM   3033 H  HA   . LEU   A 1 197 ? -13.769 1.089   -31.622 0   32.85 ? 887  LEU   A HA   1 1 
ATOM   3034 H  HB2  . LEU   A 1 197 ? -11.204 0.514   -33.142 0   32.46 ? 887  LEU   A HB2  1 1 
ATOM   3035 H  HB3  . LEU   A 1 197 ? -12.795 -0.146  -33.54  0   33.54 ? 887  LEU   A HB3  1 1 
ATOM   3036 H  HG   . LEU   A 1 197 ? -11.972 2.745   -33.733 0   33.63 ? 887  LEU   A HG   1 1 
ATOM   3037 H  HD11 . LEU   A 1 197 ? -12.11  2.353   -36.158 0   34.26 ? 887  LEU   A HD11 1 1 
ATOM   3038 H  HD12 . LEU   A 1 197 ? -10.901 1.29    -35.393 0   34.08 ? 887  LEU   A HD12 1 1 
ATOM   3039 H  HD13 . LEU   A 1 197 ? -12.495 0.638   -35.856 0   35.14 ? 887  LEU   A HD13 1 1 
ATOM   3040 H  HD21 . LEU   A 1 197 ? -14.127 2.929   -35.056 0   35.72 ? 887  LEU   A HD21 1 1 
ATOM   3041 H  HD22 . LEU   A 1 197 ? -14.576 1.331   -34.402 0   36.65 ? 887  LEU   A HD22 1 1 
ATOM   3042 H  HD23 . LEU   A 1 197 ? -14.338 2.72    -33.306 0   36.08 ? 887  LEU   A HD23 1 1 
ATOM   3043 N  N    . HIS   A 1 198 ? -11.278 -0.832  -30.574 1   28.81 ? 888  HIS   A N    1 1 
ATOM   3044 C  CA   . HIS   A 1 198 ? -10.958 -2.166  -30.062 1   28.92 ? 888  HIS   A CA   1 1 
ATOM   3045 C  C    . HIS   A 1 198 ? -10.382 -2.225  -28.655 1   28.18 ? 888  HIS   A C    1 1 
ATOM   3046 O  O    . HIS   A 1 198 ? -10.043 -3.324  -28.219 1   27.91 ? 888  HIS   A O    1 1 
ATOM   3047 C  CB   . HIS   A 1 198 ? -9.992  -2.844  -31.037 1   30.34 ? 888  HIS   A CB   1 1 
ATOM   3048 C  CG   . HIS   A 1 198 ? -10.49  -2.839  -32.441 1   33.39 ? 888  HIS   A CG   1 1 
ATOM   3049 N  ND1  . HIS   A 1 198 ? -11.688 -3.452  -32.785 1   35.73 ? 888  HIS   A ND1  1 1 
ATOM   3050 C  CD2  . HIS   A 1 198 ? -9.984  -2.223  -33.531 1   34.13 ? 888  HIS   A CD2  1 1 
ATOM   3051 C  CE1  . HIS   A 1 198 ? -11.845 -3.225  -34.08  1   36.12 ? 888  HIS   A CE1  1 1 
ATOM   3052 N  NE2  . HIS   A 1 198 ? -10.84  -2.496  -34.57  1   35.56 ? 888  HIS   A NE2  1 1 
ATOM   3053 H  H    . HIS   A 1 198 ? -10.479 -0.205  -30.587 0   33.42 ? 888  HIS   A H    1 1 
ATOM   3054 H  HA   . HIS   A 1 198 ? -11.856 -2.78   -30.044 0   35.46 ? 888  HIS   A HA   1 1 
ATOM   3055 H  HB2  . HIS   A 1 198 ? -9.047  -2.304  -31.027 0   35.33 ? 888  HIS   A HB2  1 1 
ATOM   3056 H  HB3  . HIS   A 1 198 ? -9.838  -3.881  -30.744 0   36.48 ? 888  HIS   A HB3  1 1 
ATOM   3057 H  HD2  . HIS   A 1 198 ? -9.084  -1.634  -33.577 0   38.74 ? 888  HIS   A HD2  1 1 
ATOM   3058 H  HE1  . HIS   A 1 198 ? -12.677 -3.583  -34.662 0   43.44 ? 888  HIS   A HE1  1 1 
ATOM   3059 H  HE2  . HIS   A 1 198 ? -10.729 -2.198  -35.534 0   41.16 ? 888  HIS   A HE2  1 1 
ATOM   3060 N  N    . ARG   A 1 199 ? -10.259 -1.083  -27.932 1   27.55 ? 889  ARG   A N    1 1 
ATOM   3061 C  CA   . ARG   A 1 199 ? -9.723  -1.085  -26.563 1   27.6  ? 889  ARG   A CA   1 1 
ATOM   3062 C  C    . ARG   A 1 199 ? -8.262  -1.59   -26.496 1   26.64 ? 889  ARG   A C    1 1 
ATOM   3063 O  O    . ARG   A 1 199 ? -7.831  -2.108  -25.465 1   26.6  ? 889  ARG   A O    1 1 
ATOM   3064 C  CB   . ARG   A 1 199 ? -10.655 -1.89   -25.615 1   29.14 ? 889  ARG   A CB   1 1 
ATOM   3065 C  CG   . ARG   A 1 199 ? -12.1   -1.39   -25.663 1   33.44 ? 889  ARG   A CG   1 1 
ATOM   3066 C  CD   . ARG   A 1 199 ? -12.989 -2.031  -24.61  1   37.9  ? 889  ARG   A CD   1 1 
ATOM   3067 N  NE   . ARG   A 1 199 ? -14.351 -1.504  -24.687 1   41.46 ? 889  ARG   A NE   1 1 
ATOM   3068 C  CZ   . ARG   A 1 199 ? -15.359 -1.862  -23.89  1   45.05 ? 889  ARG   A CZ   1 1 
ATOM   3069 N  NH1  . ARG   A 1 199 ? -15.172 -2.766  -22.929 1   45.09 ? 889  ARG   A NH1  1 1 
ATOM   3070 N  NH2  . ARG   A 1 199 ? -16.561 -1.32   -24.045 1   45.35 ? 889  ARG   A NH2  1 1 
ATOM   3071 H  H    . ARG   A 1 199 ? -10.518 -0.156  -28.253 0   32.28 ? 889  ARG   A H    1 1 
ATOM   3072 H  HA   . ARG   A 1 199 ? -9.718  -0.057  -26.205 0   32.06 ? 889  ARG   A HA   1 1 
ATOM   3073 H  HB2  . ARG   A 1 199 ? -10.65  -2.939  -25.905 0   35.44 ? 889  ARG   A HB2  1 1 
ATOM   3074 H  HB3  . ARG   A 1 199 ? -10.305 -1.793  -24.59  0   34.83 ? 889  ARG   A HB3  1 1 
ATOM   3075 H  HG2  . ARG   A 1 199 ? -12.109 -0.313  -25.5   0   39.22 ? 889  ARG   A HG2  1 1 
ATOM   3076 H  HG3  . ARG   A 1 199 ? -12.53  -1.624  -26.635 0   39.95 ? 889  ARG   A HG3  1 1 
ATOM   3077 H  HD2  . ARG   A 1 199 ? -13.027 -3.107  -24.773 0   45.64 ? 889  ARG   A HD2  1 1 
ATOM   3078 H  HD3  . ARG   A 1 199 ? -12.593 -1.812  -23.62  0   44.87 ? 889  ARG   A HD3  1 1 
ATOM   3079 H  HE   . ARG   A 1 199 ? -14.539 -0.808  -25.401 0   48.85 ? 889  ARG   A HE   1 1 
ATOM   3080 H  HH11 . ARG   A 1 199 ? -14.277 -3.214  -22.765 0   53.84 ? 889  ARG   A HH11 1 1 
ATOM   3081 H  HH12 . ARG   A 1 199 ? -15.955 -3.026  -22.337 0   54.89 ? 889  ARG   A HH12 1 1 
ATOM   3082 H  HH21 . ARG   A 1 199 ? -16.724 -0.631  -24.772 0   54.11 ? 889  ARG   A HH21 1 1 
ATOM   3083 H  HH22 . ARG   A 1 199 ? -17.328 -1.596  -23.44  0   55.18 ? 889  ARG   A HH22 1 1 
ATOM   3084 N  N    . ILE   A 1 200 ? -7.506  -1.391  -27.582 1   25.93 ? 890  ILE   A N    1 1 
ATOM   3085 C  CA   . ILE   A 1 200 ? -6.105  -1.797  -27.702 1   26.15 ? 890  ILE   A CA   1 1 
ATOM   3086 C  C    . ILE   A 1 200 ? -5.226  -0.576  -27.429 1   24.75 ? 890  ILE   A C    1 1 
ATOM   3087 O  O    . ILE   A 1 200 ? -5.414  0.446   -28.085 1   24.78 ? 890  ILE   A O    1 1 
ATOM   3088 C  CB   . ILE   A 1 200 ? -5.856  -2.324  -29.157 1   28.11 ? 890  ILE   A CB   1 1 
ATOM   3089 C  CG1  . ILE   A 1 200 ? -6.66   -3.625  -29.442 1   30.88 ? 890  ILE   A CG1  1 1 
ATOM   3090 C  CG2  . ILE   A 1 200 ? -4.371  -2.509  -29.476 1   28.77 ? 890  ILE   A CG2  1 1 
ATOM   3091 C  CD1  . ILE   A 1 200 ? -6.517  -4.745  -28.467 1   33.1  ? 890  ILE   A CD1  1 1 
ATOM   3092 H  H    . ILE   A 1 200 ? -7.834  -0.912  -28.414 0   29.91 ? 890  ILE   A H    1 1 
ATOM   3093 H  HA   . ILE   A 1 200 ? -5.851  -2.561  -26.97  0   30.33 ? 890  ILE   A HA   1 1 
ATOM   3094 H  HB   . ILE   A 1 200 ? -6.212  -1.573  -29.861 0   31.75 ? 890  ILE   A HB   1 1 
ATOM   3095 H  HG12 . ILE   A 1 200 ? -7.717  -3.369  -29.464 0   35.95 ? 890  ILE   A HG12 1 1 
ATOM   3096 H  HG13 . ILE   A 1 200 ? -6.368  -4.011  -30.417 0   35.76 ? 890  ILE   A HG13 1 1 
ATOM   3097 H  HG21 . ILE   A 1 200 ? -4.272  -3.05   -30.415 0   32.44 ? 890  ILE   A HG21 1 1 
ATOM   3098 H  HG22 . ILE   A 1 200 ? -3.884  -1.54   -29.575 0   31.75 ? 890  ILE   A HG22 1 1 
ATOM   3099 H  HG23 . ILE   A 1 200 ? -3.915  -3.079  -28.669 0   32.6  ? 890  ILE   A HG23 1 1 
ATOM   3100 H  HD11 . ILE   A 1 200 ? -6.899  -5.651  -28.935 0   39.19 ? 890  ILE   A HD11 1 1 
ATOM   3101 H  HD12 . ILE   A 1 200 ? -5.47   -4.886  -28.202 0   38.35 ? 890  ILE   A HD12 1 1 
ATOM   3102 H  HD13 . ILE   A 1 200 ? -7.102  -4.539  -27.572 0   38.52 ? 890  ILE   A HD13 1 1 
ATOM   3103 N  N    . TYR   A 1 201 ? -4.219  -0.717  -26.545 1   22.67 ? 891  TYR   A N    1 1 
ATOM   3104 C  CA   . TYR   A 1 201 ? -3.29   0.364   -26.22  1   21.71 ? 891  TYR   A CA   1 1 
ATOM   3105 C  C    . TYR   A 1 201 ? -1.866  -0.154  -26.364 1   21.44 ? 891  TYR   A C    1 1 
ATOM   3106 O  O    . TYR   A 1 201 ? -1.562  -1.283  -25.979 1   21.96 ? 891  TYR   A O    1 1 
ATOM   3107 C  CB   . TYR   A 1 201 ? -3.528  0.893   -24.807 1   20.83 ? 891  TYR   A CB   1 1 
ATOM   3108 C  CG   . TYR   A 1 201 ? -4.913  1.463   -24.615 1   20.52 ? 891  TYR   A CG   1 1 
ATOM   3109 C  CD1  . TYR   A 1 201 ? -5.995  0.635   -24.327 1   20.4  ? 891  TYR   A CD1  1 1 
ATOM   3110 C  CD2  . TYR   A 1 201 ? -5.123  2.836   -24.594 1   20.94 ? 891  TYR   A CD2  1 1 
ATOM   3111 C  CE1  . TYR   A 1 201 ? -7.264  1.159   -24.093 1   20.86 ? 891  TYR   A CE1  1 1 
ATOM   3112 C  CE2  . TYR   A 1 201 ? -6.387  3.37    -24.386 1   21.47 ? 891  TYR   A CE2  1 1 
ATOM   3113 C  CZ   . TYR   A 1 201 ? -7.46   2.529   -24.145 1   22.36 ? 891  TYR   A CZ   1 1 
ATOM   3114 O  OH   . TYR   A 1 201 ? -8.705  3.064   -23.903 1   23.14 ? 891  TYR   A OH   1 1 
ATOM   3115 H  H    . TYR   A 1 201 ? -4.021  -1.574  -26.039 0   25.92 ? 891  TYR   A H    1 1 
ATOM   3116 H  HA   . TYR   A 1 201 ? -3.422  1.196   -26.909 0   23.58 ? 891  TYR   A HA   1 1 
ATOM   3117 H  HB2  . TYR   A 1 201 ? -3.406  0.078   -24.096 0   23.37 ? 891  TYR   A HB2  1 1 
ATOM   3118 H  HB3  . TYR   A 1 201 ? -2.808  1.682   -24.598 0   22.58 ? 891  TYR   A HB3  1 1 
ATOM   3119 H  HD1  . TYR   A 1 201 ? -5.851  -0.432  -24.303 0   23.79 ? 891  TYR   A HD1  1 1 
ATOM   3120 H  HD2  . TYR   A 1 201 ? -4.3    3.5     -24.802 0   22.34 ? 891  TYR   A HD2  1 1 
ATOM   3121 H  HE1  . TYR   A 1 201 ? -8.095  0.5     -23.906 0   24.65 ? 891  TYR   A HE1  1 1 
ATOM   3122 H  HE2  . TYR   A 1 201 ? -6.521  4.438   -24.41  0   23.2  ? 891  TYR   A HE2  1 1 
ATOM   3123 H  HH   . TYR   A 1 201 ? -8.672  4.057   -23.884 0   25.79 ? 891  TYR   A HH   1 1 
ATOM   3124 N  N    . THR   A 1 202 ? -1.008  0.656   -26.972 1   19.62 ? 892  THR   A N    1 1 
ATOM   3125 C  CA   . THR   A 1 202 ? 0.391   0.314   -27.252 1   18.67 ? 892  THR   A CA   1 1 
ATOM   3126 C  C    . THR   A 1 202 ? 1.248   1.591   -27.072 1   18.12 ? 892  THR   A C    1 1 
ATOM   3127 O  O    . THR   A 1 202 ? 0.691   2.694   -26.923 1   17.37 ? 892  THR   A O    1 1 
ATOM   3128 C  CB   . THR   A 1 202 ? 0.503   -0.134  -28.753 1   19.38 ? 892  THR   A CB   1 1 
ATOM   3129 O  OG1  . THR   A 1 202 ? 0.15    0.964   -29.602 1   20.13 ? 892  THR   A OG1  1 1 
ATOM   3130 C  CG2  . THR   A 1 202 ? -0.297  -1.376  -29.095 1   19.5  ? 892  THR   A CG2  1 1 
ATOM   3131 H  H    . THR   A 1 202 ? -1.243  1.589   -27.294 0   20.94 ? 892  THR   A H    1 1 
ATOM   3132 H  HA   . THR   A 1 202 ? 0.763   -0.472  -26.597 0   20.63 ? 892  THR   A HA   1 1 
ATOM   3133 H  HB   . THR   A 1 202 ? 1.544   -0.385  -28.95  0   21.15 ? 892  THR   A HB   1 1 
ATOM   3134 H  HG1  . THR   A 1 202 ? -0.837  1.047   -29.683 0   21.54 ? 892  THR   A HG1  1 1 
ATOM   3135 H  HG21 . THR   A 1 202 ? -0.133  -1.653  -30.135 0   21.86 ? 892  THR   A HG21 1 1 
ATOM   3136 H  HG22 . THR   A 1 202 ? 0.039   -2.184  -28.449 0   22.18 ? 892  THR   A HG22 1 1 
ATOM   3137 H  HG23 . THR   A 1 202 ? -1.361  -1.204  -28.939 0   21.86 ? 892  THR   A HG23 1 1 
ATOM   3138 N  N    . HIS   A 1 203 ? 2.596   1.487   -27.246 1   17.19 ? 893  HIS   A N    1 1 
ATOM   3139 C  CA   . HIS   A 1 203 ? 3.423   2.689   -27.262 1   17.56 ? 893  HIS   A CA   1 1 
ATOM   3140 C  C    . HIS   A 1 203 ? 3.007   3.588   -28.456 1   16.21 ? 893  HIS   A C    1 1 
ATOM   3141 O  O    . HIS   A 1 203 ? 3.011   4.806   -28.308 1   15.53 ? 893  HIS   A O    1 1 
ATOM   3142 C  CB   . HIS   A 1 203 ? 4.912   2.325   -27.349 1   18.19 ? 893  HIS   A CB   1 1 
ATOM   3143 C  CG   . HIS   A 1 203 ? 5.336   1.431   -26.22  1   20.42 ? 893  HIS   A CG   1 1 
ATOM   3144 N  ND1  . HIS   A 1 203 ? 5.249   1.836   -24.91  1   21.47 ? 893  HIS   A ND1  1 1 
ATOM   3145 C  CD2  . HIS   A 1 203 ? 5.853   0.178   -26.259 1   21.86 ? 893  HIS   A CD2  1 1 
ATOM   3146 C  CE1  . HIS   A 1 203 ? 5.674   0.817   -24.178 1   22.78 ? 893  HIS   A CE1  1 1 
ATOM   3147 N  NE2  . HIS   A 1 203 ? 6.046   -0.209  -24.946 1   22.22 ? 893  HIS   A NE2  1 1 
ATOM   3148 H  H    . HIS   A 1 203 ? 3.094   0.614   -27.389 0   18.59 ? 893  HIS   A H    1 1 
ATOM   3149 H  HA   . HIS   A 1 203 ? 3.264   3.248   -26.34  0   18.12 ? 893  HIS   A HA   1 1 
ATOM   3150 H  HB2  . HIS   A 1 203 ? 5.098   1.8     -28.286 0   19.2  ? 893  HIS   A HB2  1 1 
ATOM   3151 H  HB3  . HIS   A 1 203 ? 5.507   3.236   -27.304 0   18.83 ? 893  HIS   A HB3  1 1 
ATOM   3152 H  HD1  . HIS   A 1 203 ? 4.929   2.736   -24.567 0   22.4  ? 893  HIS   A HD1  1 1 
ATOM   3153 H  HD2  . HIS   A 1 203 ? 6.071   -0.402  -27.14  0   23.83 ? 893  HIS   A HD2  1 1 
ATOM   3154 H  HE1  . HIS   A 1 203 ? 5.714   0.816   -23.102 0   24.56 ? 893  HIS   A HE1  1 1 
ATOM   3155 N  N    . GLN   A 1 204 ? 2.534   2.997   -29.583 1   15.33 ? 894  GLN   A N    1 1 
ATOM   3156 C  CA   . GLN   A 1 204 ? 2.11    3.809   -30.731 1   15.67 ? 894  GLN   A CA   1 1 
ATOM   3157 C  C    . GLN   A 1 204 ? 0.745   4.513   -30.517 1   15.01 ? 894  GLN   A C    1 1 
ATOM   3158 O  O    . GLN   A 1 204 ? 0.533   5.579   -31.111 1   14.65 ? 894  GLN   A O    1 1 
ATOM   3159 C  CB   . GLN   A 1 204 ? 2.16    2.965   -32.023 1   16.87 ? 894  GLN   A CB   1 1 
ATOM   3160 C  CG   . GLN   A 1 204 ? 3.608   2.513   -32.382 1   19.32 ? 894  GLN   A CG   1 1 
ATOM   3161 C  CD   . GLN   A 1 204 ? 4.598   3.67    -32.435 1   22.64 ? 894  GLN   A CD   1 1 
ATOM   3162 O  OE1  . GLN   A 1 204 ? 5.364   3.902   -31.498 1   23.34 ? 894  GLN   A OE1  1 1 
ATOM   3163 N  NE2  . GLN   A 1 204 ? 4.58    4.442   -33.521 1   22.21 ? 894  GLN   A NE2  1 1 
ATOM   3164 H  H    . GLN   A 1 204 ? 2.431   1.996   -29.72  0   16.13 ? 894  GLN   A H    1 1 
ATOM   3165 H  HA   . GLN   A 1 204 ? 2.823   4.623   -30.849 0   15.63 ? 894  GLN   A HA   1 1 
ATOM   3166 H  HB2  . GLN   A 1 204 ? 1.554   2.07    -31.887 0   17.6  ? 894  GLN   A HB2  1 1 
ATOM   3167 H  HB3  . GLN   A 1 204 ? 1.775   3.558   -32.851 0   17.12 ? 894  GLN   A HB3  1 1 
ATOM   3168 H  HG2  . GLN   A 1 204 ? 3.959   1.806   -31.631 0   20.17 ? 894  GLN   A HG2  1 1 
ATOM   3169 H  HG3  . GLN   A 1 204 ? 3.597   2.038   -33.361 0   20.08 ? 894  GLN   A HG3  1 1 
ATOM   3170 H  HE21 . GLN   A 1 204 ? 3.954   4.219   -34.288 0   22.32 ? 894  GLN   A HE21 1 1 
ATOM   3171 H  HE22 . GLN   A 1 204 ? 5.225   5.222   -33.602 0   22.14 ? 894  GLN   A HE22 1 1 
ATOM   3172 N  N    . SER   A 1 205 ? -0.143  4.001   -29.632 1   14.76 ? 895  SER   A N    1 1 
ATOM   3173 C  CA   . SER   A 1 205 ? -1.355  4.754   -29.293 1   14.64 ? 895  SER   A CA   1 1 
ATOM   3174 C  C    . SER   A 1 205 ? -0.954  5.92    -28.331 1   14.32 ? 895  SER   A C    1 1 
ATOM   3175 O  O    . SER   A 1 205 ? -1.579  6.981   -28.374 1   14.81 ? 895  SER   A O    1 1 
ATOM   3176 C  CB   . SER   A 1 205 ? -2.452  3.867   -28.715 1   16.63 ? 895  SER   A CB   1 1 
ATOM   3177 O  OG   . SER   A 1 205 ? -2.1    3.188   -27.525 1   18.04 ? 895  SER   A OG   1 1 
ATOM   3178 H  H    . SER   A 1 205 ? -0.065  3.104   -29.164 0   15.33 ? 895  SER   A H    1 1 
ATOM   3179 H  HA   . SER   A 1 205 ? -1.758  5.201   -30.2   0   14.73 ? 895  SER   A HA   1 1 
ATOM   3180 H  HB2  . SER   A 1 205 ? -3.32   4.492   -28.508 0   17.27 ? 895  SER   A HB2  1 1 
ATOM   3181 H  HB3  . SER   A 1 205 ? -2.717  3.124   -29.466 0   17.54 ? 895  SER   A HB3  1 1 
ATOM   3182 H  HG   . SER   A 1 205 ? -1.428  3.666   -26.971 0   18.66 ? 895  SER   A HG   1 1 
ATOM   3183 N  N    . ASP   A 1 206 ? 0.105   5.75    -27.489 1   13.56 ? 896  ASP   A N    1 1 
ATOM   3184 C  CA   . ASP   A 1 206 ? 0.609   6.88    -26.683 1   13.34 ? 896  ASP   A CA   1 1 
ATOM   3185 C  C    . ASP   A 1 206 ? 1.18    7.967   -27.642 1   12.78 ? 896  ASP   A C    1 1 
ATOM   3186 O  O    . ASP   A 1 206 ? 1.103   9.15    -27.335 1   13.16 ? 896  ASP   A O    1 1 
ATOM   3187 C  CB   . ASP   A 1 206 ? 1.732   6.437   -25.726 1   14.59 ? 896  ASP   A CB   1 1 
ATOM   3188 C  CG   . ASP   A 1 206 ? 1.305   5.814   -24.403 1   17.94 ? 896  ASP   A CG   1 1 
ATOM   3189 O  OD1  . ASP   A 1 206 ? 0.09    5.905   -24.048 1   17.36 ? 896  ASP   A OD1  1 1 
ATOM   3190 O  OD2  . ASP   A 1 206 ? 2.178   5.254   -23.713 1   19.6  ? 896  ASP   A OD2  1 1 
ATOM   3191 H  H    . ASP   A 1 206 ? 0.592   4.873   -27.332 0   13.63 ? 896  ASP   A H    1 1 
ATOM   3192 H  HA   . ASP   A 1 206 ? -0.204  7.327   -26.112 0   12.96 ? 896  ASP   A HA   1 1 
ATOM   3193 H  HB2  . ASP   A 1 206 ? 2.364   5.711   -26.236 0   14.45 ? 896  ASP   A HB2  1 1 
ATOM   3194 H  HB3  . ASP   A 1 206 ? 2.33    7.316   -25.497 0   14.14 ? 896  ASP   A HB3  1 1 
ATOM   3195 N  N    . VAL   A 1 207 ? 1.746   7.579   -28.79  1   12.08 ? 897  VAL   A N    1 1 
ATOM   3196 C  CA   . VAL   A 1 207 ? 2.246   8.555   -29.787 1   11.71 ? 897  VAL   A CA   1 1 
ATOM   3197 C  C    . VAL   A 1 207 ? 1.077   9.392   -30.303 1   12.32 ? 897  VAL   A C    1 1 
ATOM   3198 O  O    . VAL   A 1 207 ? 1.206   10.621  -30.429 1   13.08 ? 897  VAL   A O    1 1 
ATOM   3199 C  CB   . VAL   A 1 207 ? 3.032   7.873   -30.948 1   12.06 ? 897  VAL   A CB   1 1 
ATOM   3200 C  CG1  . VAL   A 1 207 ? 3.277   8.865   -32.105 1   12.59 ? 897  VAL   A CG1  1 1 
ATOM   3201 C  CG2  . VAL   A 1 207 ? 4.364   7.322   -30.422 1   11.98 ? 897  VAL   A CG2  1 1 
ATOM   3202 H  H    . VAL   A 1 207 ? 1.872   6.611   -29.069 0   11.59 ? 897  VAL   A H    1 1 
ATOM   3203 H  HA   . VAL   A 1 207 ? 2.92    9.244   -29.279 0   10.73 ? 897  VAL   A HA   1 1 
ATOM   3204 H  HB   . VAL   A 1 207 ? 2.451   7.038   -31.335 0   11.41 ? 897  VAL   A HB   1 1 
ATOM   3205 H  HG11 . VAL   A 1 207 ? 4.031   8.447   -32.77  0   11.74 ? 897  VAL   A HG11 1 1 
ATOM   3206 H  HG12 . VAL   A 1 207 ? 2.356   9.014   -32.666 0   11.54 ? 897  VAL   A HG12 1 1 
ATOM   3207 H  HG13 . VAL   A 1 207 ? 3.627   9.811   -31.694 0   11.54 ? 897  VAL   A HG13 1 1 
ATOM   3208 H  HG21 . VAL   A 1 207 ? 4.914   6.87    -31.246 0   11.52 ? 897  VAL   A HG21 1 1 
ATOM   3209 H  HG22 . VAL   A 1 207 ? 4.941   8.141   -29.995 0   11.3  ? 897  VAL   A HG22 1 1 
ATOM   3210 H  HG23 . VAL   A 1 207 ? 4.164   6.571   -29.659 0   11.54 ? 897  VAL   A HG23 1 1 
ATOM   3211 N  N    . TRP   A 1 208 ? -0.088  8.766   -30.577 1   12.69 ? 898  TRP   A N    1 1 
ATOM   3212 C  CA   . TRP   A 1 208 ? -1.286  9.524   -30.977 1   12.85 ? 898  TRP   A CA   1 1 
ATOM   3213 C  C    . TRP   A 1 208 ? -1.616  10.585  -29.905 1   12.43 ? 898  TRP   A C    1 1 
ATOM   3214 O  O    . TRP   A 1 208 ? -1.751  11.759  -30.238 1   12.69 ? 898  TRP   A O    1 1 
ATOM   3215 C  CB   . TRP   A 1 208 ? -2.494  8.594   -31.161 1   13.42 ? 898  TRP   A CB   1 1 
ATOM   3216 C  CG   . TRP   A 1 208 ? -3.713  9.317   -31.668 1   13.6  ? 898  TRP   A CG   1 1 
ATOM   3217 C  CD1  . TRP   A 1 208 ? -4.47   10.235  -30.997 1   13.85 ? 898  TRP   A CD1  1 1 
ATOM   3218 C  CD2  . TRP   A 1 208 ? -4.363  9.097   -32.925 1   13.45 ? 898  TRP   A CD2  1 1 
ATOM   3219 N  NE1  . TRP   A 1 208 ? -5.52   10.647  -31.79  1   14.38 ? 898  TRP   A NE1  1 1 
ATOM   3220 C  CE2  . TRP   A 1 208 ? -5.502  9.927   -32.96  1   13.98 ? 898  TRP   A CE2  1 1 
ATOM   3221 C  CE3  . TRP   A 1 208 ? -4.174  8.173   -33.961 1   14.43 ? 898  TRP   A CE3  1 1 
ATOM   3222 C  CZ2  . TRP   A 1 208 ? -6.392  9.927   -34.036 1   14.61 ? 898  TRP   A CZ2  1 1 
ATOM   3223 C  CZ3  . TRP   A 1 208 ? -5.066  8.167   -35.022 1   14.68 ? 898  TRP   A CZ3  1 1 
ATOM   3224 C  CH2  . TRP   A 1 208 ? -6.139  9.057   -35.065 1   14.62 ? 898  TRP   A CH2  1 1 
ATOM   3225 H  H    . TRP   A 1 208 ? -0.231  7.761   -30.55  0   11.99 ? 898  TRP   A H    1 1 
ATOM   3226 H  HA   . TRP   A 1 208 ? -1.096  10.036  -31.919 0   11.8  ? 898  TRP   A HA   1 1 
ATOM   3227 H  HB2  . TRP   A 1 208 ? -2.23   7.809   -31.867 0   12.9  ? 898  TRP   A HB2  1 1 
ATOM   3228 H  HB3  . TRP   A 1 208 ? -2.747  8.154   -30.197 0   12.94 ? 898  TRP   A HB3  1 1 
ATOM   3229 H  HD1  . TRP   A 1 208 ? -4.196  10.687  -30.06  0   13.23 ? 898  TRP   A HD1  1 1 
ATOM   3230 H  HE1  . TRP   A 1 208 ? -6.219  11.376  -31.538 0   14.05 ? 898  TRP   A HE1  1 1 
ATOM   3231 H  HE3  . TRP   A 1 208 ? -3.327  7.507   -33.953 0   14.15 ? 898  TRP   A HE3  1 1 
ATOM   3232 H  HZ2  . TRP   A 1 208 ? -7.239  10.591  -34.061 0   14.67 ? 898  TRP   A HZ2  1 1 
ATOM   3233 H  HZ3  . TRP   A 1 208 ? -4.874  7.53    -35.869 0   14.76 ? 898  TRP   A HZ3  1 1 
ATOM   3234 H  HH2  . TRP   A 1 208 ? -6.796  9.047   -35.918 0   14.84 ? 898  TRP   A HH2  1 1 
ATOM   3235 N  N    . SER   A 1 209 ? -1.66   10.175  -28.618 1   11.35 ? 899  SER   A N    1 1 
ATOM   3236 C  CA   . SER   A 1 209 ? -1.936  11.095  -27.515 1   11.31 ? 899  SER   A CA   1 1 
ATOM   3237 C  C    . SER   A 1 209 ? -0.88   12.197  -27.434 1   12.15 ? 899  SER   A C    1 1 
ATOM   3238 O  O    . SER   A 1 209 ? -1.208  13.353  -27.127 1   12.44 ? 899  SER   A O    1 1 
ATOM   3239 C  CB   . SER   A 1 209 ? -1.969  10.338  -26.197 1   13.12 ? 899  SER   A CB   1 1 
ATOM   3240 O  OG   . SER   A 1 209 ? -2.994  9.359   -26.231 1   15.59 ? 899  SER   A OG   1 1 
ATOM   3241 H  H    . SER   A 1 209 ? -1.512  9.216   -28.32  0   10.57 ? 899  SER   A H    1 1 
ATOM   3242 H  HA   . SER   A 1 209 ? -2.908  11.562  -27.668 0   10.41 ? 899  SER   A HA   1 1 
ATOM   3243 H  HB2  . SER   A 1 209 ? -1.009  9.848   -26.042 0   12.32 ? 899  SER   A HB2  1 1 
ATOM   3244 H  HB3  . SER   A 1 209 ? -2.17   11.036  -25.386 0   12.33 ? 899  SER   A HB3  1 1 
ATOM   3245 H  HG   . SER   A 1 209 ? -3.081  8.93    -25.34  0   15.28 ? 899  SER   A HG   1 1 
ATOM   3246 N  N    . TYR   A 1 210 ? 0.404   11.853  -27.688 1   12.14 ? 900  TYR   A N    1 1 
ATOM   3247 C  CA   . TYR   A 1 210 ? 1.489   12.84   -27.735 1   12.34 ? 900  TYR   A CA   1 1 
ATOM   3248 C  C    . TYR   A 1 210 ? 1.171   13.913  -28.816 1   11.86 ? 900  TYR   A C    1 1 
ATOM   3249 O  O    . TYR   A 1 210 ? 1.303   15.096  -28.537 1   12    ? 900  TYR   A O    1 1 
ATOM   3250 C  CB   . TYR   A 1 210 ? 2.825   12.15   -28.031 1   12    ? 900  TYR   A CB   1 1 
ATOM   3251 C  CG   . TYR   A 1 210 ? 3.974   13.113  -28.242 1   12.75 ? 900  TYR   A CG   1 1 
ATOM   3252 C  CD1  . TYR   A 1 210 ? 4.283   13.594  -29.51  1   13.06 ? 900  TYR   A CD1  1 1 
ATOM   3253 C  CD2  . TYR   A 1 210 ? 4.756   13.537  -27.175 1   12.92 ? 900  TYR   A CD2  1 1 
ATOM   3254 C  CE1  . TYR   A 1 210 ? 5.33    14.486  -29.71  1   14.03 ? 900  TYR   A CE1  1 1 
ATOM   3255 C  CE2  . TYR   A 1 210 ? 5.835   14.397  -27.369 1   14.35 ? 900  TYR   A CE2  1 1 
ATOM   3256 C  CZ   . TYR   A 1 210 ? 6.084   14.907  -28.631 1   14.95 ? 900  TYR   A CZ   1 1 
ATOM   3257 O  OH   . TYR   A 1 210 ? 7.106   15.779  -28.845 1   16.13 ? 900  TYR   A OH   1 1 
ATOM   3258 H  H    . TYR   A 1 210 ? 0.725   10.902  -27.84  0   10.98 ? 900  TYR   A H    1 1 
ATOM   3259 H  HA   . TYR   A 1 210 ? 1.567   13.339  -26.77  0   11.01 ? 900  TYR   A HA   1 1 
ATOM   3260 H  HB2  . TYR   A 1 210 ? 3.064   11.516  -27.18  0   10.82 ? 900  TYR   A HB2  1 1 
ATOM   3261 H  HB3  . TYR   A 1 210 ? 2.724   11.548  -28.932 0   10.73 ? 900  TYR   A HB3  1 1 
ATOM   3262 H  HD1  . TYR   A 1 210 ? 3.678   13.293  -30.349 0   11.69 ? 900  TYR   A HD1  1 1 
ATOM   3263 H  HD2  . TYR   A 1 210 ? 4.547   13.157  -26.19  0   11.8  ? 900  TYR   A HD2  1 1 
ATOM   3264 H  HE1  . TYR   A 1 210 ? 5.538   14.865  -30.696 0   12.82 ? 900  TYR   A HE1  1 1 
ATOM   3265 H  HE2  . TYR   A 1 210 ? 6.415   14.735  -26.526 0   13.44 ? 900  TYR   A HE2  1 1 
ATOM   3266 H  HH   . TYR   A 1 210 ? 7.098   16.496  -28.158 0   15.28 ? 900  TYR   A HH   1 1 
ATOM   3267 N  N    . GLY   A 1 211 ? 0.721   13.499  -30     1   11.56 ? 901  GLY   A N    1 1 
ATOM   3268 C  CA   . GLY   A 1 211 ? 0.297   14.443  -31.045 1   12.3  ? 901  GLY   A CA   1 1 
ATOM   3269 C  C    . GLY   A 1 211 ? -0.807  15.387  -30.562 1   12.41 ? 901  GLY   A C    1 1 
ATOM   3270 O  O    . GLY   A 1 211 ? -0.749  16.604  -30.795 1   13.17 ? 901  GLY   A O    1 1 
ATOM   3271 H  H    . GLY   A 1 211 ? 0.647   12.526  -30.279 0   10.15 ? 901  GLY   A H    1 1 
ATOM   3272 H  HA2  . GLY   A 1 211 ? 1.149   15.043  -31.361 0   10.75 ? 901  GLY   A HA2  1 1 
ATOM   3273 H  HA3  . GLY   A 1 211 ? -0.073  13.89   -31.907 0   10.8  ? 901  GLY   A HA3  1 1 
ATOM   3274 N  N    . VAL   A 1 212 ? -1.803  14.853  -29.842 1   12.34 ? 902  VAL   A N    1 1 
ATOM   3275 C  CA   . VAL   A 1 212 ? -2.888  15.698  -29.297 1   12.94 ? 902  VAL   A CA   1 1 
ATOM   3276 C  C    . VAL   A 1 212 ? -2.313  16.674  -28.275 1   13.19 ? 902  VAL   A C    1 1 
ATOM   3277 O  O    . VAL   A 1 212 ? -2.695  17.846  -28.272 1   13.71 ? 902  VAL   A O    1 1 
ATOM   3278 C  CB   . VAL   A 1 212 ? -4.078  14.885  -28.716 1   13.53 ? 902  VAL   A CB   1 1 
ATOM   3279 C  CG1  . VAL   A 1 212 ? -5.171  15.827  -28.129 1   14.29 ? 902  VAL   A CG1  1 1 
ATOM   3280 C  CG2  . VAL   A 1 212 ? -4.679  13.967  -29.812 1   13.74 ? 902  VAL   A CG2  1 1 
ATOM   3281 H  H    . VAL   A 1 212 ? -1.864  13.871  -29.596 0   11.03 ? 902  VAL   A H    1 1 
ATOM   3282 H  HA   . VAL   A 1 212 ? -3.293  16.294  -30.113 0   11.74 ? 902  VAL   A HA   1 1 
ATOM   3283 H  HB   . VAL   A 1 212 ? -3.713  14.251  -27.909 0   12.53 ? 902  VAL   A HB   1 1 
ATOM   3284 H  HG11 . VAL   A 1 212 ? -6.065  15.242  -27.919 0   13.72 ? 902  VAL   A HG11 1 1 
ATOM   3285 H  HG12 . VAL   A 1 212 ? -4.813  16.273  -27.202 0   13.45 ? 902  VAL   A HG12 1 1 
ATOM   3286 H  HG13 . VAL   A 1 212 ? -5.394  16.605  -28.858 0   13.54 ? 902  VAL   A HG13 1 1 
ATOM   3287 H  HG21 . VAL   A 1 212 ? -5.638  13.567  -29.487 0   13.09 ? 902  VAL   A HG21 1 1 
ATOM   3288 H  HG22 . VAL   A 1 212 ? -4.813  14.554  -30.719 0   12.87 ? 902  VAL   A HG22 1 1 
ATOM   3289 H  HG23 . VAL   A 1 212 ? -3.984  13.149  -30     0   12.75 ? 902  VAL   A HG23 1 1 
ATOM   3290 N  N    . THR   A 1 213 ? -1.428  16.19   -27.396 1   12.66 ? 903  THR   A N    1 1 
ATOM   3291 C  CA   . THR   A 1 213 ? -0.76   17.033  -26.376 1   13.27 ? 903  THR   A CA   1 1 
ATOM   3292 C  C    . THR   A 1 213 ? 0.006   18.176  -27.037 1   13.74 ? 903  THR   A C    1 1 
ATOM   3293 O  O    . THR   A 1 213 ? -0.124  19.336  -26.605 1   14.05 ? 903  THR   A O    1 1 
ATOM   3294 C  CB   . THR   A 1 213 ? 0.182   16.171  -25.52  1   14.83 ? 903  THR   A CB   1 1 
ATOM   3295 O  OG1  . THR   A 1 213 ? -0.617  15.116  -24.936 1   14.26 ? 903  THR   A OG1  1 1 
ATOM   3296 C  CG2  . THR   A 1 213 ? 0.955   17.014  -24.419 1   16.19 ? 903  THR   A CG2  1 1 
ATOM   3297 H  H    . THR   A 1 213 ? -1.162  15.212  -27.345 0   11.34 ? 903  THR   A H    1 1 
ATOM   3298 H  HA   . THR   A 1 213 ? -1.515  17.463  -25.72  0   12.11 ? 903  THR   A HA   1 1 
ATOM   3299 H  HB   . THR   A 1 213 ? 0.928   15.72   -26.173 0   13.48 ? 903  THR   A HB   1 1 
ATOM   3300 H  HG1  . THR   A 1 213 ? -0.413  14.919  -23.984 0   13.12 ? 903  THR   A HG1  1 1 
ATOM   3301 H  HG21 . THR   A 1 213 ? 1.527   16.341  -23.784 0   15.02 ? 903  THR   A HG21 1 1 
ATOM   3302 H  HG22 . THR   A 1 213 ? 1.649   17.715  -24.881 0   15    ? 903  THR   A HG22 1 1 
ATOM   3303 H  HG23 . THR   A 1 213 ? 0.246   17.567  -23.805 0   15.08 ? 903  THR   A HG23 1 1 
ATOM   3304 N  N    . VAL   A 1 214 ? 0.755   17.879  -28.118 1   13.27 ? 904  VAL   A N    1 1 
ATOM   3305 C  CA   . VAL   A 1 214 ? 1.5     18.915  -28.863 1   13.77 ? 904  VAL   A CA   1 1 
ATOM   3306 C  C    . VAL   A 1 214 ? 0.489   19.96   -29.42  1   13.15 ? 904  VAL   A C    1 1 
ATOM   3307 O  O    . VAL   A 1 214 ? 0.73    21.16   -29.28  1   13.15 ? 904  VAL   A O    1 1 
ATOM   3308 C  CB   . VAL   A 1 214 ? 2.406   18.319  -29.999 1   15.06 ? 904  VAL   A CB   1 1 
ATOM   3309 C  CG1  . VAL   A 1 214 ? 2.932   19.429  -30.926 1   15.38 ? 904  VAL   A CG1  1 1 
ATOM   3310 C  CG2  . VAL   A 1 214 ? 3.596   17.546  -29.392 1   16.09 ? 904  VAL   A CG2  1 1 
ATOM   3311 H  H    . VAL   A 1 214 ? 0.853   16.944  -28.501 0   11.82 ? 904  VAL   A H    1 1 
ATOM   3312 H  HA   . VAL   A 1 214 ? 2.146   19.443  -28.163 0   12.55 ? 904  VAL   A HA   1 1 
ATOM   3313 H  HB   . VAL   A 1 214 ? 1.817   17.626  -30.598 0   13.6  ? 904  VAL   A HB   1 1 
ATOM   3314 H  HG11 . VAL   A 1 214 ? 3.519   18.972  -31.722 0   14.13 ? 904  VAL   A HG11 1 1 
ATOM   3315 H  HG12 . VAL   A 1 214 ? 2.092   19.969  -31.353 0   14.13 ? 904  VAL   A HG12 1 1 
ATOM   3316 H  HG13 . VAL   A 1 214 ? 3.558   20.107  -30.348 0   14.28 ? 904  VAL   A HG13 1 1 
ATOM   3317 H  HG21 . VAL   A 1 214 ? 4.208   17.148  -30.2   0   14.78 ? 904  VAL   A HG21 1 1 
ATOM   3318 H  HG22 . VAL   A 1 214 ? 4.183   18.23   -28.781 0   14.9  ? 904  VAL   A HG22 1 1 
ATOM   3319 H  HG23 . VAL   A 1 214 ? 3.212   16.732  -28.779 0   14.71 ? 904  VAL   A HG23 1 1 
ATOM   3320 N  N    . TRP   A 1 215 ? -0.633  19.51   -29.998 1   13.51 ? 905  TRP   A N    1 1 
ATOM   3321 C  CA   . TRP   A 1 215 ? -1.688  20.403  -30.502 1   14.18 ? 905  TRP   A CA   1 1 
ATOM   3322 C  C    . TRP   A 1 215 ? -2.222  21.303  -29.36  1   13.68 ? 905  TRP   A C    1 1 
ATOM   3323 O  O    . TRP   A 1 215 ? -2.377  22.507  -29.557 1   13.25 ? 905  TRP   A O    1 1 
ATOM   3324 C  CB   . TRP   A 1 215 ? -2.833  19.589  -31.111 1   14.3  ? 905  TRP   A CB   1 1 
ATOM   3325 C  CG   . TRP   A 1 215 ? -3.892  20.436  -31.751 1   15.17 ? 905  TRP   A CG   1 1 
ATOM   3326 C  CD1  . TRP   A 1 215 ? -3.922  20.883  -33.041 1   15.78 ? 905  TRP   A CD1  1 1 
ATOM   3327 C  CD2  . TRP   A 1 215 ? -5.091  20.917  -31.127 1   15.46 ? 905  TRP   A CD2  1 1 
ATOM   3328 N  NE1  . TRP   A 1 215 ? -5.064  21.625  -33.258 1   16.12 ? 905  TRP   A NE1  1 1 
ATOM   3329 C  CE2  . TRP   A 1 215 ? -5.806  21.648  -32.103 1   16.11 ? 905  TRP   A CE2  1 1 
ATOM   3330 C  CE3  . TRP   A 1 215 ? -5.605  20.843  -29.819 1   15.88 ? 905  TRP   A CE3  1 1 
ATOM   3331 C  CZ2  . TRP   A 1 215 ? -7.02   22.281  -31.819 1   16.78 ? 905  TRP   A CZ2  1 1 
ATOM   3332 C  CZ3  . TRP   A 1 215 ? -6.782  21.515  -29.525 1   16.68 ? 905  TRP   A CZ3  1 1 
ATOM   3333 C  CH2  . TRP   A 1 215 ? -7.502  22.178  -30.523 1   16.94 ? 905  TRP   A CH2  1 1 
ATOM   3334 H  H    . TRP   A 1 215 ? -0.841  18.528  -30.15  0   12.14 ? 905  TRP   A H    1 1 
ATOM   3335 H  HA   . TRP   A 1 215 ? -1.276  21.044  -31.279 0   13.08 ? 905  TRP   A HA   1 1 
ATOM   3336 H  HB2  . TRP   A 1 215 ? -2.428  18.929  -31.876 0   13.06 ? 905  TRP   A HB2  1 1 
ATOM   3337 H  HB3  . TRP   A 1 215 ? -3.302  18.997  -30.325 0   13.19 ? 905  TRP   A HB3  1 1 
ATOM   3338 H  HD1  . TRP   A 1 215 ? -3.188  20.646  -33.793 0   14.81 ? 905  TRP   A HD1  1 1 
ATOM   3339 H  HE1  . TRP   A 1 215 ? -5.347  22.044  -34.168 0   15.67 ? 905  TRP   A HE1  1 1 
ATOM   3340 H  HE3  . TRP   A 1 215 ? -5.078  20.3    -29.053 0   15.23 ? 905  TRP   A HE3  1 1 
ATOM   3341 H  HZ2  . TRP   A 1 215 ? -7.543  22.849  -32.57  0   16.94 ? 905  TRP   A HZ2  1 1 
ATOM   3342 H  HZ3  . TRP   A 1 215 ? -7.216  21.411  -28.544 0   16.65 ? 905  TRP   A HZ3  1 1 
ATOM   3343 H  HH2  . TRP   A 1 215 ? -8.43   22.662  -30.266 0   17.36 ? 905  TRP   A HH2  1 1 
ATOM   3344 N  N    . GLU   A 1 216 ? -2.437  20.734  -28.16  1   13.04 ? 906  GLU   A N    1 1 
ATOM   3345 C  CA   . GLU   A 1 216 ? -2.879  21.527  -26.988 1   12.62 ? 906  GLU   A CA   1 1 
ATOM   3346 C  C    . GLU   A 1 216 ? -1.85   22.624  -26.672 1   14.43 ? 906  GLU   A C    1 1 
ATOM   3347 O  O    . GLU   A 1 216 ? -2.239  23.765  -26.428 1   15.57 ? 906  GLU   A O    1 1 
ATOM   3348 C  CB   . GLU   A 1 216 ? -3.04   20.63   -25.743 1   13.51 ? 906  GLU   A CB   1 1 
ATOM   3349 C  CG   . GLU   A 1 216 ? -4.241  19.696  -25.786 1   15.8  ? 906  GLU   A CG   1 1 
ATOM   3350 C  CD   . GLU   A 1 216 ? -4.319  18.938  -24.475 1   17.19 ? 906  GLU   A CD   1 1 
ATOM   3351 O  OE1  . GLU   A 1 216 ? -5.016  19.413  -23.552 1   19.51 ? 906  GLU   A OE1  1 1 
ATOM   3352 O  OE2  . GLU   A 1 216 ? -3.61   17.917  -24.339 1   15.43 ? 906  GLU   A OE2  1 1 
ATOM   3353 H  H    . GLU   A 1 216 ? -2.312  19.745  -27.971 0   11.97 ? 906  GLU   A H    1 1 
ATOM   3354 H  HA   . GLU   A 1 216 ? -3.837  21.998  -27.205 0   12.05 ? 906  GLU   A HA   1 1 
ATOM   3355 H  HB2  . GLU   A 1 216 ? -2.146  20.017  -25.633 0   12.59 ? 906  GLU   A HB2  1 1 
ATOM   3356 H  HB3  . GLU   A 1 216 ? -3.152  21.269  -24.869 0   12.9  ? 906  GLU   A HB3  1 1 
ATOM   3357 H  HG2  . GLU   A 1 216 ? -5.155  20.274  -25.911 0   15.32 ? 906  GLU   A HG2  1 1 
ATOM   3358 H  HG3  . GLU   A 1 216 ? -4.123  18.979  -26.598 0   14.99 ? 906  GLU   A HG3  1 1 
ATOM   3359 N  N    . LEU   A 1 217 ? -0.543  22.307  -26.719 1   13.94 ? 907  LEU   A N    1 1 
ATOM   3360 C  CA   . LEU   A 1 217 ? 0.471   23.321  -26.419 1   15.14 ? 907  LEU   A CA   1 1 
ATOM   3361 C  C    . LEU   A 1 217 ? 0.507   24.418  -27.492 1   15.6  ? 907  LEU   A C    1 1 
ATOM   3362 O  O    . LEU   A 1 217 ? 0.528   25.61   -27.167 1   15.58 ? 907  LEU   A O    1 1 
ATOM   3363 C  CB   . LEU   A 1 217 ? 1.884   22.704  -26.274 1   14.41 ? 907  LEU   A CB   1 1 
ATOM   3364 C  CG   . LEU   A 1 217 ? 2.022   21.546  -25.261 1   15.31 ? 907  LEU   A CG   1 1 
ATOM   3365 C  CD1  . LEU   A 1 217 ? 3.476   21.052  -25.216 1   15.17 ? 907  LEU   A CD1  1 1 
ATOM   3366 C  CD2  . LEU   A 1 217 ? 1.5     21.929  -23.877 1   15.81 ? 907  LEU   A CD2  1 1 
ATOM   3367 H  H    . LEU   A 1 217 ? -0.179  21.399  -26.989 0   12.99 ? 907  LEU   A H    1 1 
ATOM   3368 H  HA   . LEU   A 1 217 ? 0.209   23.815  -25.484 0   14.7  ? 907  LEU   A HA   1 1 
ATOM   3369 H  HB2  . LEU   A 1 217 ? 2.189   22.32   -27.246 0   13.65 ? 907  LEU   A HB2  1 1 
ATOM   3370 H  HB3  . LEU   A 1 217 ? 2.571   23.49   -25.964 0   13.97 ? 907  LEU   A HB3  1 1 
ATOM   3371 H  HG   . LEU   A 1 217 ? 1.414   20.713  -25.612 0   14.35 ? 907  LEU   A HG   1 1 
ATOM   3372 H  HD11 . LEU   A 1 217 ? 3.554   20.24   -24.495 0   14.37 ? 907  LEU   A HD11 1 1 
ATOM   3373 H  HD12 . LEU   A 1 217 ? 3.76    20.698  -26.206 0   14.34 ? 907  LEU   A HD12 1 1 
ATOM   3374 H  HD13 . LEU   A 1 217 ? 4.121   21.878  -24.918 0   14.65 ? 907  LEU   A HD13 1 1 
ATOM   3375 H  HD21 . LEU   A 1 217 ? 1.796   21.151  -23.176 0   15.1  ? 907  LEU   A HD21 1 1 
ATOM   3376 H  HD22 . LEU   A 1 217 ? 1.933   22.883  -23.581 0   15.38 ? 907  LEU   A HD22 1 1 
ATOM   3377 H  HD23 . LEU   A 1 217 ? 0.413   21.993  -23.886 0   15.19 ? 907  LEU   A HD23 1 1 
ATOM   3378 N  N    . MET   A 1 218 ? 0.5     24.015  -28.77  1   14.72 ? 908  MET   A N    1 1 
ATOM   3379 C  CA   . MET   A 1 218 ? 0.612   24.961  -29.894 1   15.51 ? 908  MET   A CA   1 1 
ATOM   3380 C  C    . MET   A 1 218 ? -0.597  25.897  -30.034 1   16.03 ? 908  MET   A C    1 1 
ATOM   3381 O  O    . MET   A 1 218 ? -0.486  26.927  -30.708 1   17.11 ? 908  MET   A O    1 1 
ATOM   3382 C  CB   . MET   A 1 218 ? 0.833   24.177  -31.192 1   16.33 ? 908  MET   A CB   1 1 
ATOM   3383 C  CG   . MET   A 1 218 ? 2.128   23.372  -31.2   1   18.62 ? 908  MET   A CG   1 1 
ATOM   3384 S  SD   . MET   A 1 218 ? 3.618   24.365  -31.021 1   22.57 ? 908  MET   A SD   1 1 
ATOM   3385 C  CE   . MET   A 1 218 ? 4.849   22.998  -30.7   1   20.92 ? 908  MET   A CE   1 1 
ATOM   3386 H  H    . MET   A 1 218 ? 0.383   23.047  -29.05  0   13.95 ? 908  MET   A H    1 1 
ATOM   3387 H  HA   . MET   A 1 218 ? 1.481   25.593  -29.717 0   15.35 ? 908  MET   A HA   1 1 
ATOM   3388 H  HB2  . MET   A 1 218 ? 0.009   23.475  -31.317 0   15.61 ? 908  MET   A HB2  1 1 
ATOM   3389 H  HB3  . MET   A 1 218 ? 0.861   24.872  -32.029 0   15.93 ? 908  MET   A HB3  1 1 
ATOM   3390 H  HG2  . MET   A 1 218 ? 2.111   22.64   -30.393 0   17.8  ? 908  MET   A HG2  1 1 
ATOM   3391 H  HG3  . MET   A 1 218 ? 2.2     22.853  -32.155 0   17.83 ? 908  MET   A HG3  1 1 
ATOM   3392 H  HE1  . MET   A 1 218 ? 5.833   23.438  -30.546 0   20.75 ? 908  MET   A HE1  1 1 
ATOM   3393 H  HE2  . MET   A 1 218 ? 4.545   22.449  -29.81  0   20.33 ? 908  MET   A HE2  1 1 
ATOM   3394 H  HE3  . MET   A 1 218 ? 4.87    22.331  -31.56  0   20.34 ? 908  MET   A HE3  1 1 
ATOM   3395 N  N    . THR   A 1 219 ? -1.767  25.493  -29.488 1   15.53 ? 909  THR   A N    1 1 
ATOM   3396 C  CA   . THR   A 1 219 ? -2.989  26.311  -29.483 1   16.93 ? 909  THR   A CA   1 1 
ATOM   3397 C  C    . THR   A 1 219 ? -3.133  27.073  -28.132 1   18.71 ? 909  THR   A C    1 1 
ATOM   3398 O  O    . THR   A 1 219 ? -4.197  27.628  -27.885 1   19.97 ? 909  THR   A O    1 1 
ATOM   3399 C  CB   . THR   A 1 219 ? -4.273  25.434  -29.684 1   16.77 ? 909  THR   A CB   1 1 
ATOM   3400 O  OG1  . THR   A 1 219 ? -4.429  24.449  -28.632 1   17.79 ? 909  THR   A OG1  1 1 
ATOM   3401 C  CG2  . THR   A 1 219 ? -4.32   24.766  -31.072 1   17.42 ? 909  THR   A CG2  1 1 
ATOM   3402 H  H    . THR   A 1 219 ? -1.914  24.586  -29.058 0   15.16 ? 909  THR   A H    1 1 
ATOM   3403 H  HA   . THR   A 1 219 ? -2.963  27.045  -30.287 0   17.22 ? 909  THR   A HA   1 1 
ATOM   3404 H  HB   . THR   A 1 219 ? -5.142  26.088  -29.648 0   17.13 ? 909  THR   A HB   1 1 
ATOM   3405 H  HG1  . THR   A 1 219 ? -3.62   24.283  -28.079 0   17.62 ? 909  THR   A HG1  1 1 
ATOM   3406 H  HG21 . THR   A 1 219 ? -5.245  24.203  -31.182 0   17.32 ? 909  THR   A HG21 1 1 
ATOM   3407 H  HG22 . THR   A 1 219 ? -4.27   25.523  -31.854 0   17.46 ? 909  THR   A HG22 1 1 
ATOM   3408 H  HG23 . THR   A 1 219 ? -3.478  24.085  -31.184 0   17.04 ? 909  THR   A HG23 1 1 
ATOM   3409 N  N    . PHE   A 1 220 ? -2.118  27.026  -27.253 1   18.49 ? 910  PHE   A N    1 1 
ATOM   3410 C  CA   . PHE   A 1 220 ? -2.148  27.648  -25.934 1   19.96 ? 910  PHE   A CA   1 1 
ATOM   3411 C  C    . PHE   A 1 220 ? -3.331  27.145  -25.093 1   20.2  ? 910  PHE   A C    1 1 
ATOM   3412 O  O    . PHE   A 1 220 ? -3.95   27.913  -24.365 1   20.85 ? 910  PHE   A O    1 1 
ATOM   3413 C  CB   . PHE   A 1 220 ? -2.081  29.178  -26.039 1   20.78 ? 910  PHE   A CB   1 1 
ATOM   3414 C  CG   . PHE   A 1 220 ? -0.867  29.623  -26.822 1   21.64 ? 910  PHE   A CG   1 1 
ATOM   3415 C  CD1  . PHE   A 1 220 ? 0.387   29.645  -26.233 1   22.44 ? 910  PHE   A CD1  1 1 
ATOM   3416 C  CD2  . PHE   A 1 220 ? -0.965  29.934  -28.167 1   22.18 ? 910  PHE   A CD2  1 1 
ATOM   3417 C  CE1  . PHE   A 1 220 ? 1.51    30.018  -26.967 1   23.36 ? 910  PHE   A CE1  1 1 
ATOM   3418 C  CE2  . PHE   A 1 220 ? 0.159   30.323  -28.894 1   22.94 ? 910  PHE   A CE2  1 1 
ATOM   3419 C  CZ   . PHE   A 1 220 ? 1.386   30.358  -28.289 1   22.57 ? 910  PHE   A CZ   1 1 
ATOM   3420 H  H    . PHE   A 1 220 ? -1.229  26.567  -27.42  0   18.64 ? 910  PHE   A H    1 1 
ATOM   3421 H  HA   . PHE   A 1 220 ? -1.247  27.329  -25.415 0   20.46 ? 910  PHE   A HA   1 1 
ATOM   3422 H  HB2  . PHE   A 1 220 ? -2.973  29.544  -26.545 0   22.03 ? 910  PHE   A HB2  1 1 
ATOM   3423 H  HB3  . PHE   A 1 220 ? -2.011  29.606  -25.04  0   22.08 ? 910  PHE   A HB3  1 1 
ATOM   3424 H  HD1  . PHE   A 1 220 ? 0.493   29.382  -25.194 0   23.61 ? 910  PHE   A HD1  1 1 
ATOM   3425 H  HD2  . PHE   A 1 220 ? -1.928  29.915  -28.649 0   23.37 ? 910  PHE   A HD2  1 1 
ATOM   3426 H  HE1  . PHE   A 1 220 ? 2.475   30.054  -26.49  0   24.82 ? 910  PHE   A HE1  1 1 
ATOM   3427 H  HE2  . PHE   A 1 220 ? 0.063   30.584  -29.934 0   24.34 ? 910  PHE   A HE2  1 1 
ATOM   3428 H  HZ   . PHE   A 1 220 ? 2.255   30.652  -28.853 0   24.16 ? 910  PHE   A HZ   1 1 
ATOM   3429 N  N    . GLY   A 1 221 ? -3.58   25.836  -25.159 1   19.26 ? 911  GLY   A N    1 1 
ATOM   3430 C  CA   . GLY   A 1 221 ? -4.57   25.155  -24.328 1   20.17 ? 911  GLY   A CA   1 1 
ATOM   3431 C  C    . GLY   A 1 221 ? -6      25.101  -24.837 1   20.06 ? 911  GLY   A C    1 1 
ATOM   3432 O  O    . GLY   A 1 221 ? -6.919  25.034  -24.02  1   20.25 ? 911  GLY   A O    1 1 
ATOM   3433 H  H    . GLY   A 1 221 ? -3.096  25.193  -25.777 0   19.31 ? 911  GLY   A H    1 1 
ATOM   3434 H  HA2  . GLY   A 1 221 ? -4.241  24.125  -24.196 0   20.25 ? 911  GLY   A HA2  1 1 
ATOM   3435 H  HA3  . GLY   A 1 221 ? -4.59   25.613  -23.342 0   20.71 ? 911  GLY   A HA3  1 1 
ATOM   3436 N  N    . SER   A 1 222 ? -6.215  25.061  -26.167 1   19.51 ? 912  SER   A N    1 1 
ATOM   3437 C  CA   . SER   A 1 222 ? -7.572  24.897  -26.707 1   20.08 ? 912  SER   A CA   1 1 
ATOM   3438 C  C    . SER   A 1 222 ? -8.061  23.481  -26.393 1   19.81 ? 912  SER   A C    1 1 
ATOM   3439 O  O    . SER   A 1 222 ? -7.252  22.55   -26.253 1   19.01 ? 912  SER   A O    1 1 
ATOM   3440 C  CB   . SER   A 1 222 ? -7.614  25.092  -28.222 1   21.94 ? 912  SER   A CB   1 1 
ATOM   3441 O  OG   . SER   A 1 222 ? -7.359  26.443  -28.563 1   25.88 ? 912  SER   A OG   1 1 
ATOM   3442 H  H    . SER   A 1 222 ? -5.494  25.134  -26.877 0   19.83 ? 912  SER   A H    1 1 
ATOM   3443 H  HA   . SER   A 1 222 ? -8.247  25.617  -26.247 0   21.2  ? 912  SER   A HA   1 1 
ATOM   3444 H  HB2  . SER   A 1 222 ? -6.859  24.458  -28.686 0   22.32 ? 912  SER   A HB2  1 1 
ATOM   3445 H  HB3  . SER   A 1 222 ? -8.603  24.817  -28.585 0   22.86 ? 912  SER   A HB3  1 1 
ATOM   3446 H  HG   . SER   A 1 222 ? -7.38   26.554  -29.55  0   26.84 ? 912  SER   A HG   1 1 
ATOM   3447 N  N    . LYS   A 1 223 ? -9.389  23.325  -26.314 1   19.09 ? 913  LYS   A N    1 1 
ATOM   3448 C  CA   . LYS   A 1 223 ? -9.989  22.033  -26.061 1   19.88 ? 913  LYS   A CA   1 1 
ATOM   3449 C  C    . LYS   A 1 223 ? -10.083 21.316  -27.409 1   19.9  ? 913  LYS   A C    1 1 
ATOM   3450 O  O    . LYS   A 1 223 ? -10.584 21.914  -28.368 1   20.69 ? 913  LYS   A O    1 1 
ATOM   3451 C  CB   . LYS   A 1 223 ? -11.393 22.178  -25.451 1   22.68 ? 913  LYS   A CB   1 1 
ATOM   3452 C  CG   . LYS   A 1 223 ? -11.358 22.747  -24.034 1   28.93 ? 913  LYS   A CG   1 1 
ATOM   3453 C  CD   . LYS   A 1 223 ? -12.772 22.966  -23.488 1   35.91 ? 913  LYS   A CD   1 1 
ATOM   3454 C  CE   . LYS   A 1 223 ? -12.77  23.34   -22.021 1   42.66 ? 913  LYS   A CE   1 1 
ATOM   3455 N  NZ   . LYS   A 1 223 ? -12.55  24.799  -21.809 1   46.99 ? 913  LYS   A NZ   1 1 
ATOM   3456 H  H    . LYS   A 1 223 ? -10.055 24.08   -26.439 0   20.46 ? 913  LYS   A H    1 1 
ATOM   3457 H  HA   . LYS   A 1 223 ? -9.373  21.484  -25.35  0   20.71 ? 913  LYS   A HA   1 1 
ATOM   3458 H  HB2  . LYS   A 1 223 ? -11.993 22.843  -26.07  0   24.62 ? 913  LYS   A HB2  1 1 
ATOM   3459 H  HB3  . LYS   A 1 223 ? -11.859 21.195  -25.404 0   24.43 ? 913  LYS   A HB3  1 1 
ATOM   3460 H  HG2  . LYS   A 1 223 ? -10.838 22.045  -23.384 0   30.53 ? 913  LYS   A HG2  1 1 
ATOM   3461 H  HG3  . LYS   A 1 223 ? -10.848 23.709  -24.038 0   30.72 ? 913  LYS   A HG3  1 1 
ATOM   3462 H  HD2  . LYS   A 1 223 ? -13.247 23.775  -24.041 0   38.73 ? 913  LYS   A HD2  1 1 
ATOM   3463 H  HD3  . LYS   A 1 223 ? -13.346 22.047  -23.602 0   38.56 ? 913  LYS   A HD3  1 1 
ATOM   3464 H  HE2  . LYS   A 1 223 ? -13.734 23.079  -21.587 0   45.9  ? 913  LYS   A HE2  1 1 
ATOM   3465 H  HE3  . LYS   A 1 223 ? -11.977 22.797  -21.506 0   45.08 ? 913  LYS   A HE3  1 1 
ATOM   3466 H  HZ1  . LYS   A 1 223 ? -12.33  24.976  -20.834 0   49.89 ? 913  LYS   A HZ1  1 1 
ATOM   3467 H  HZ2  . LYS   A 1 223 ? -11.787 25.139  -22.385 0   49.57 ? 913  LYS   A HZ2  1 1 
ATOM   3468 H  HZ3  . LYS   A 1 223 ? -13.392 25.31   -22.05  0   50.37 ? 913  LYS   A HZ3  1 1 
ATOM   3469 N  N    . PRO   A 1 224 ? -9.595  20.071  -27.532 1   19.39 ? 914  PRO   A N    1 1 
ATOM   3470 C  CA   . PRO   A 1 224 ? -9.664  19.399  -28.839 1   18.53 ? 914  PRO   A CA   1 1 
ATOM   3471 C  C    . PRO   A 1 224 ? -11.083 18.983  -29.208 1   18.56 ? 914  PRO   A C    1 1 
ATOM   3472 O  O    . PRO   A 1 224 ? -11.84  18.538  -28.332 1   18.81 ? 914  PRO   A O    1 1 
ATOM   3473 C  CB   . PRO   A 1 224 ? -8.761  18.186  -28.662 1   19.76 ? 914  PRO   A CB   1 1 
ATOM   3474 C  CG   . PRO   A 1 224 ? -8.722  17.925  -27.231 1   20.43 ? 914  PRO   A CG   1 1 
ATOM   3475 C  CD   . PRO   A 1 224 ? -8.913  19.229  -26.525 1   19.09 ? 914  PRO   A CD   1 1 
ATOM   3476 H  HA   . PRO   A 1 224 ? -9.248  20.034  -29.62  0   18.97 ? 914  PRO   A HA   1 1 
ATOM   3477 H  HB2  . PRO   A 1 224 ? -9.183  17.334  -29.193 0   20.02 ? 914  PRO   A HB2  1 1 
ATOM   3478 H  HB3  . PRO   A 1 224 ? -7.765  18.416  -29.037 0   19.62 ? 914  PRO   A HB3  1 1 
ATOM   3479 H  HG2  . PRO   A 1 224 ? -9.525  17.236  -26.971 0   20.94 ? 914  PRO   A HG2  1 1 
ATOM   3480 H  HG3  . PRO   A 1 224 ? -7.756  17.492  -26.972 0   20.38 ? 914  PRO   A HG3  1 1 
ATOM   3481 H  HD2  . PRO   A 1 224 ? -9.544  19.08   -25.651 0   19.76 ? 914  PRO   A HD2  1 1 
ATOM   3482 H  HD3  . PRO   A 1 224 ? -7.95   19.66   -26.256 0   19.25 ? 914  PRO   A HD3  1 1 
ATOM   3483 N  N    . TYR   A 1 225 ? -11.464 19.163  -30.493 1   18.44 ? 915  TYR   A N    1 1 
ATOM   3484 C  CA   . TYR   A 1 225 ? -12.808 18.815  -31.001 1   19.09 ? 915  TYR   A CA   1 1 
ATOM   3485 C  C    . TYR   A 1 225 ? -13.902 19.479  -30.121 1   20.81 ? 915  TYR   A C    1 1 
ATOM   3486 O  O    . TYR   A 1 225 ? -14.84  18.822  -29.686 1   21.35 ? 915  TYR   A O    1 1 
ATOM   3487 C  CB   . TYR   A 1 225 ? -13     17.285  -31.026 1   18.16 ? 915  TYR   A CB   1 1 
ATOM   3488 C  CG   . TYR   A 1 225 ? -11.806 16.498  -31.537 1   17.26 ? 915  TYR   A CG   1 1 
ATOM   3489 C  CD1  . TYR   A 1 225 ? -11.003 15.776  -30.664 1   18.07 ? 915  TYR   A CD1  1 1 
ATOM   3490 C  CD2  . TYR   A 1 225 ? -11.579 16.35   -32.902 1   17.1  ? 915  TYR   A CD2  1 1 
ATOM   3491 C  CE1  . TYR   A 1 225 ? -9.948  15.001  -31.126 1   18.43 ? 915  TYR   A CE1  1 1 
ATOM   3492 C  CE2  . TYR   A 1 225 ? -10.546 15.55   -33.379 1   17.95 ? 915  TYR   A CE2  1 1 
ATOM   3493 C  CZ   . TYR   A 1 225 ? -9.694  14.924  -32.482 1   18.55 ? 915  TYR   A CZ   1 1 
ATOM   3494 O  OH   . TYR   A 1 225 ? -8.678  14.107  -32.902 1   18.55 ? 915  TYR   A OH   1 1 
ATOM   3495 H  H    . TYR   A 1 225 ? -10.861 19.547  -31.214 0   19.34 ? 915  TYR   A H    1 1 
ATOM   3496 H  HA   . TYR   A 1 225 ? -12.906 19.194  -32.017 0   20.83 ? 915  TYR   A HA   1 1 
ATOM   3497 H  HB2  . TYR   A 1 225 ? -13.201 16.933  -30.016 0   20.09 ? 915  TYR   A HB2  1 1 
ATOM   3498 H  HB3  . TYR   A 1 225 ? -13.834 17.039  -31.68  0   20.34 ? 915  TYR   A HB3  1 1 
ATOM   3499 H  HD1  . TYR   A 1 225 ? -11.169 15.859  -29.603 0   19.13 ? 915  TYR   A HD1  1 1 
ATOM   3500 H  HD2  . TYR   A 1 225 ? -12.217 16.862  -33.603 0   18.48 ? 915  TYR   A HD2  1 1 
ATOM   3501 H  HE1  . TYR   A 1 225 ? -9.31   14.485  -30.428 0   18.8  ? 915  TYR   A HE1  1 1 
ATOM   3502 H  HE2  . TYR   A 1 225 ? -10.361 15.495  -34.439 0   18.61 ? 915  TYR   A HE2  1 1 
ATOM   3503 H  HH   . TYR   A 1 225 ? -8.62   14.098  -33.894 0   18.73 ? 915  TYR   A HH   1 1 
ATOM   3504 N  N    . ASP   A 1 226 ? -13.719 20.761  -29.805 1   21.81 ? 916  ASP   A N    1 1 
ATOM   3505 C  CA   . ASP   A 1 226 ? -14.603 21.476  -28.884 1   23.7  ? 916  ASP   A CA   1 1 
ATOM   3506 C  C    . ASP   A 1 226 ? -16.034 21.515  -29.434 1   23.68 ? 916  ASP   A C    1 1 
ATOM   3507 O  O    . ASP   A 1 226 ? -16.223 21.837  -30.603 1   23.79 ? 916  ASP   A O    1 1 
ATOM   3508 C  CB   . ASP   A 1 226 ? -14.071 22.9    -28.672 1   26.55 ? 916  ASP   A CB   1 1 
ATOM   3509 C  CG   . ASP   A 1 226 ? -14.74  23.672  -27.551 1   33.2  ? 916  ASP   A CG   1 1 
ATOM   3510 O  OD1  . ASP   A 1 226 ? -15.159 23.039  -26.558 1   32.78 ? 916  ASP   A OD1  1 1 
ATOM   3511 O  OD2  . ASP   A 1 226 ? -14.796 24.916  -27.648 1   38.49 ? 916  ASP   A OD2  1 1 
ATOM   3512 H  H    . ASP   A 1 226 ? -12.978 21.334  -30.196 0   23.77 ? 916  ASP   A H    1 1 
ATOM   3513 H  HA   . ASP   A 1 226 ? -14.6   20.951  -27.93  0   26.55 ? 916  ASP   A HA   1 1 
ATOM   3514 H  HB2  . ASP   A 1 226 ? -13.01  22.846  -28.434 0   28.78 ? 916  ASP   A HB2  1 1 
ATOM   3515 H  HB3  . ASP   A 1 226 ? -14.212 23.465  -29.591 0   29.38 ? 916  ASP   A HB3  1 1 
ATOM   3516 N  N    . GLY   A 1 227 ? -17.001 21.1    -28.619 1   24.38 ? 917  GLY   A N    1 1 
ATOM   3517 C  CA   . GLY   A 1 227 ? -18.404 21.06   -29.026 1   24.94 ? 917  GLY   A CA   1 1 
ATOM   3518 C  C    . GLY   A 1 227 ? -18.793 19.832  -29.838 1   25    ? 917  GLY   A C    1 1 
ATOM   3519 O  O    . GLY   A 1 227 ? -19.95  19.726  -30.246 1   25.44 ? 917  GLY   A O    1 1 
ATOM   3520 H  H    . GLY   A 1 227 ? -16.853 20.784  -27.666 0   28.46 ? 917  GLY   A H    1 1 
ATOM   3521 H  HA2  . GLY   A 1 227 ? -19.024 21.073  -28.131 0   30.39 ? 917  GLY   A HA2  1 1 
ATOM   3522 H  HA3  . GLY   A 1 227 ? -18.643 21.949  -29.608 0   30.11 ? 917  GLY   A HA3  1 1 
ATOM   3523 N  N    . ILE   A 1 228 ? -17.848 18.89   -30.081 1   23.85 ? 918  ILE   A N    1 1 
ATOM   3524 C  CA   . ILE   A 1 228 ? -18.133 17.647  -30.78  1   23.36 ? 918  ILE   A CA   1 1 
ATOM   3525 C  C    . ILE   A 1 228 ? -18.31  16.549  -29.705 1   23.63 ? 918  ILE   A C    1 1 
ATOM   3526 O  O    . ILE   A 1 228 ? -17.397 16.386  -28.885 1   23.59 ? 918  ILE   A O    1 1 
ATOM   3527 C  CB   . ILE   A 1 228 ? -16.998 17.277  -31.764 1   23.24 ? 918  ILE   A CB   1 1 
ATOM   3528 C  CG1  . ILE   A 1 228 ? -16.934 18.31   -32.93  1   25.32 ? 918  ILE   A CG1  1 1 
ATOM   3529 C  CG2  . ILE   A 1 228 ? -17.247 15.862  -32.321 1   22.93 ? 918  ILE   A CG2  1 1 
ATOM   3530 C  CD1  . ILE   A 1 228 ? -15.636 18.297  -33.82  1   27.67 ? 918  ILE   A CD1  1 1 
ATOM   3531 H  H    . ILE   A 1 228 ? -16.874 18.962  -29.806 0   27.76 ? 918  ILE   A H    1 1 
ATOM   3532 H  HA   . ILE   A 1 228 ? -19.035 17.763  -31.377 0   28.58 ? 918  ILE   A HA   1 1 
ATOM   3533 H  HB   . ILE   A 1 228 ? -16.055 17.284  -31.22  0   26.6  ? 918  ILE   A HB   1 1 
ATOM   3534 H  HG12 . ILE   A 1 228 ? -17.777 18.122  -33.593 0   29.69 ? 918  ILE   A HG12 1 1 
ATOM   3535 H  HG13 . ILE   A 1 228 ? -17.02  19.316  -32.522 0   29.26 ? 918  ILE   A HG13 1 1 
ATOM   3536 H  HG21 . ILE   A 1 228 ? -16.515 15.641  -33.095 0   26.56 ? 918  ILE   A HG21 1 1 
ATOM   3537 H  HG22 . ILE   A 1 228 ? -17.138 15.118  -31.534 0   27.12 ? 918  ILE   A HG22 1 1 
ATOM   3538 H  HG23 . ILE   A 1 228 ? -18.249 15.818  -32.745 0   27.64 ? 918  ILE   A HG23 1 1 
ATOM   3539 H  HD11 . ILE   A 1 228 ? -15.734 19.068  -34.582 0   30.82 ? 918  ILE   A HD11 1 1 
ATOM   3540 H  HD12 . ILE   A 1 228 ? -14.776 18.516  -33.191 0   30.29 ? 918  ILE   A HD12 1 1 
ATOM   3541 H  HD13 . ILE   A 1 228 ? -15.509 17.329  -34.301 0   30.69 ? 918  ILE   A HD13 1 1 
ATOM   3542 N  N    . PRO   A 1 229 ? -19.411 15.764  -29.698 1   23.27 ? 919  PRO   A N    1 1 
ATOM   3543 C  CA   . PRO   A 1 229 ? -19.552 14.741  -28.639 1   23.69 ? 919  PRO   A CA   1 1 
ATOM   3544 C  C    . PRO   A 1 229 ? -18.534 13.629  -28.809 1   23.44 ? 919  PRO   A C    1 1 
ATOM   3545 O  O    . PRO   A 1 229 ? -18.214 13.271  -29.944 1   22.6  ? 919  PRO   A O    1 1 
ATOM   3546 C  CB   . PRO   A 1 229 ? -21.011 14.241  -28.78  1   24.38 ? 919  PRO   A CB   1 1 
ATOM   3547 C  CG   . PRO   A 1 229 ? -21.444 14.632  -30.128 1   24.77 ? 919  PRO   A CG   1 1 
ATOM   3548 C  CD   . PRO   A 1 229 ? -20.583 15.787  -30.606 1   23.23 ? 919  PRO   A CD   1 1 
ATOM   3549 H  HA   . PRO   A 1 229 ? -19.431 15.194  -27.657 0   29.48 ? 919  PRO   A HA   1 1 
ATOM   3550 H  HB2  . PRO   A 1 229 ? -21.037 13.158  -28.668 0   31.58 ? 919  PRO   A HB2  1 1 
ATOM   3551 H  HB3  . PRO   A 1 229 ? -21.633 14.719  -28.025 0   31.89 ? 919  PRO   A HB3  1 1 
ATOM   3552 H  HG2  . PRO   A 1 229 ? -21.329 13.781  -30.798 0   32    ? 919  PRO   A HG2  1 1 
ATOM   3553 H  HG3  . PRO   A 1 229 ? -22.488 14.938  -30.09  0   32.79 ? 919  PRO   A HG3  1 1 
ATOM   3554 H  HD2  . PRO   A 1 229 ? -20.278 15.615  -31.637 0   29.42 ? 919  PRO   A HD2  1 1 
ATOM   3555 H  HD3  . PRO   A 1 229 ? -21.118 16.73   -30.503 0   30.01 ? 919  PRO   A HD3  1 1 
ATOM   3556 N  N    . ALA   A 1 230 ? -17.974 13.103  -27.688 1   23.84 ? 920  ALA   A N    1 1 
ATOM   3557 C  CA   . ALA   A 1 230 ? -16.963 12.037  -27.784 1   24.7  ? 920  ALA   A CA   1 1 
ATOM   3558 C  C    . ALA   A 1 230 ? -17.453 10.824  -28.588 1   23.32 ? 920  ALA   A C    1 1 
ATOM   3559 O  O    . ALA   A 1 230 ? -16.649 10.16   -29.225 1   22.79 ? 920  ALA   A O    1 1 
ATOM   3560 C  CB   . ALA   A 1 230 ? -16.524 11.592  -26.4   1   25.64 ? 920  ALA   A CB   1 1 
ATOM   3561 H  H    . ALA   A 1 230 ? -18.197 13.387  -26.739 0   29.09 ? 920  ALA   A H    1 1 
ATOM   3562 H  HA   . ALA   A 1 230 ? -16.078 12.446  -28.267 0   28.64 ? 920  ALA   A HA   1 1 
ATOM   3563 H  HB1  . ALA   A 1 230 ? -15.786 10.798  -26.501 0   29.78 ? 920  ALA   A HB1  1 1 
ATOM   3564 H  HB2  . ALA   A 1 230 ? -16.086 12.442  -25.878 0   29.75 ? 920  ALA   A HB2  1 1 
ATOM   3565 H  HB3  . ALA   A 1 230 ? -17.39  11.227  -25.85  0   30.77 ? 920  ALA   A HB3  1 1 
ATOM   3566 N  N    . SER   A 1 231 ? -18.775 10.558  -28.578 1   22.62 ? 921  SER   A N    1 1 
ATOM   3567 C  CA   . SER   A 1 231 ? -19.345 9.442   -29.314 1   23.04 ? 921  SER   A CA   1 1 
ATOM   3568 C  C    . SER   A 1 231 ? -19.235 9.582   -30.845 1   23.35 ? 921  SER   A C    1 1 
ATOM   3569 O  O    . SER   A 1 231 ? -19.444 8.588   -31.54  1   24.61 ? 921  SER   A O    1 1 
ATOM   3570 C  CB   . SER   A 1 231 ? -20.811 9.253   -28.943 1   24.72 ? 921  SER   A CB   1 1 
ATOM   3571 O  OG   . SER   A 1 231 ? -21.544 10.442  -29.193 1   27.68 ? 921  SER   A OG   1 1 
ATOM   3572 H  H    . SER   A 1 231 ? -19.465 11.09   -28.055 0   29.01 ? 921  SER   A H    1 1 
ATOM   3573 H  HA   . SER   A 1 231 ? -18.814 8.535   -29.029 0   29.43 ? 921  SER   A HA   1 1 
ATOM   3574 H  HB2  . SER   A 1 231 ? -21.206 8.424   -29.529 0   32.97 ? 921  SER   A HB2  1 1 
ATOM   3575 H  HB3  . SER   A 1 231 ? -20.875 9.019   -27.881 0   32.67 ? 921  SER   A HB3  1 1 
ATOM   3576 H  HG   . SER   A 1 231 ? -22.349 10.282  -29.754 0   36.3  ? 921  SER   A HG   1 1 
ATOM   3577 N  N    . GLU   A 1 232 ? -18.97  10.803  -31.364 1   22.07 ? 922  GLU   A N    1 1 
ATOM   3578 C  CA   . GLU   A 1 232 ? -18.801 11.049  -32.813 1   21.79 ? 922  GLU   A CA   1 1 
ATOM   3579 C  C    . GLU   A 1 232 ? -17.322 10.955  -33.28  1   20.62 ? 922  GLU   A C    1 1 
ATOM   3580 O  O    . GLU   A 1 232 ? -17.06  10.91   -34.486 1   19.56 ? 922  GLU   A O    1 1 
ATOM   3581 C  CB   . GLU   A 1 232 ? -19.267 12.481  -33.128 1   23.54 ? 922  GLU   A CB   1 1 
ATOM   3582 C  CG   . GLU   A 1 232 ? -19.644 12.724  -34.584 1   26.24 ? 922  GLU   A CG   1 1 
ATOM   3583 C  CD   . GLU   A 1 232 ? -20.067 14.141  -34.915 1   30.82 ? 922  GLU   A CD   1 1 
ATOM   3584 O  OE1  . GLU   A 1 232 ? -20.21  14.96   -33.977 1   30.78 ? 922  GLU   A OE1  1 1 
ATOM   3585 O  OE2  . GLU   A 1 232 ? -20.289 14.424  -36.116 1   31.51 ? 922  GLU   A OE2  1 1 
ATOM   3586 H  H    . GLU   A 1 232 ? -18.87  11.651  -30.817 0   27.8  ? 922  GLU   A H    1 1 
ATOM   3587 H  HA   . GLU   A 1 232 ? -19.397 10.341  -33.387 0   28.08 ? 922  GLU   A HA   1 1 
ATOM   3588 H  HB2  . GLU   A 1 232 ? -20.123 12.72   -32.5   0   29.93 ? 922  GLU   A HB2  1 1 
ATOM   3589 H  HB3  . GLU   A 1 232 ? -18.449 13.161  -32.891 0   28.7  ? 922  GLU   A HB3  1 1 
ATOM   3590 H  HG2  . GLU   A 1 232 ? -18.792 12.48   -35.216 0   31.71 ? 922  GLU   A HG2  1 1 
ATOM   3591 H  HG3  . GLU   A 1 232 ? -20.477 12.071  -34.84  0   32.97 ? 922  GLU   A HG3  1 1 
ATOM   3592 N  N    . ILE   A 1 233 ? -16.365 10.94   -32.346 1   19.79 ? 923  ILE   A N    1 1 
ATOM   3593 C  CA   . ILE   A 1 233 ? -14.938 11.018  -32.684 1   18.68 ? 923  ILE   A CA   1 1 
ATOM   3594 C  C    . ILE   A 1 233 ? -14.437 9.886   -33.605 1   19.35 ? 923  ILE   A C    1 1 
ATOM   3595 O  O    . ILE   A 1 233 ? -13.724 10.175  -34.575 1   19.33 ? 923  ILE   A O    1 1 
ATOM   3596 C  CB   . ILE   A 1 233 ? -14.097 11.124  -31.375 1   18.46 ? 923  ILE   A CB   1 1 
ATOM   3597 C  CG1  . ILE   A 1 233 ? -14.398 12.457  -30.61  1   17.27 ? 923  ILE   A CG1  1 1 
ATOM   3598 C  CG2  . ILE   A 1 233 ? -12.574 10.98   -31.66  1   18.46 ? 923  ILE   A CG2  1 1 
ATOM   3599 C  CD1  . ILE   A 1 233 ? -14.036 13.782  -31.35  1   18.18 ? 923  ILE   A CD1  1 1 
ATOM   3600 H  H    . ILE   A 1 233 ? -16.543 10.826  -31.353 0   24.12 ? 923  ILE   A H    1 1 
ATOM   3601 H  HA   . ILE   A 1 233 ? -14.815 11.951  -33.234 0   21.77 ? 923  ILE   A HA   1 1 
ATOM   3602 H  HB   . ILE   A 1 233 ? -14.379 10.296  -30.727 0   21.66 ? 923  ILE   A HB   1 1 
ATOM   3603 H  HG12 . ILE   A 1 233 ? -15.471 12.503  -30.434 0   20.71 ? 923  ILE   A HG12 1 1 
ATOM   3604 H  HG13 . ILE   A 1 233 ? -13.867 12.446  -29.66  0   19.86 ? 923  ILE   A HG13 1 1 
ATOM   3605 H  HG21 . ILE   A 1 233 ? -12.027 11.421  -30.829 0   20.33 ? 923  ILE   A HG21 1 1 
ATOM   3606 H  HG22 . ILE   A 1 233 ? -12.32  9.924   -31.737 0   20.66 ? 923  ILE   A HG22 1 1 
ATOM   3607 H  HG23 . ILE   A 1 233 ? -12.325 11.489  -32.59  0   20.28 ? 923  ILE   A HG23 1 1 
ATOM   3608 H  HD11 . ILE   A 1 233 ? -14.03  14.594  -30.627 0   20.73 ? 923  ILE   A HD11 1 1 
ATOM   3609 H  HD12 . ILE   A 1 233 ? -13.056 13.716  -31.818 0   20.11 ? 923  ILE   A HD12 1 1 
ATOM   3610 H  HD13 . ILE   A 1 233 ? -14.791 13.994  -32.106 0   20.93 ? 923  ILE   A HD13 1 1 
ATOM   3611 N  N    . SER   A 1 234 ? -14.794 8.619   -33.335 1   19.64 ? 924  SER   A N    1 1 
ATOM   3612 C  CA   . SER   A 1 234 ? -14.325 7.52    -34.183 1   21.31 ? 924  SER   A CA   1 1 
ATOM   3613 C  C    . SER   A 1 234 ? -14.803 7.695   -35.641 1   22.05 ? 924  SER   A C    1 1 
ATOM   3614 O  O    . SER   A 1 234 ? -14.024 7.472   -36.551 1   22.19 ? 924  SER   A O    1 1 
ATOM   3615 C  CB   . SER   A 1 234 ? -14.729 6.161   -33.614 1   23.03 ? 924  SER   A CB   1 1 
ATOM   3616 O  OG   . SER   A 1 234 ? -16.134 5.983   -33.531 1   24.94 ? 924  SER   A OG   1 1 
ATOM   3617 H  H    . SER   A 1 234 ? -15.385 8.335   -32.561 0   23.78 ? 924  SER   A H    1 1 
ATOM   3618 H  HA   . SER   A 1 234 ? -13.237 7.545   -34.197 0   24.44 ? 924  SER   A HA   1 1 
ATOM   3619 H  HB2  . SER   A 1 234 ? -14.322 5.383   -34.26  0   27.33 ? 924  SER   A HB2  1 1 
ATOM   3620 H  HB3  . SER   A 1 234 ? -14.302 6.061   -32.618 0   27.18 ? 924  SER   A HB3  1 1 
ATOM   3621 H  HG   . SER   A 1 234 ? -16.514 5.685   -34.401 0   30.34 ? 924  SER   A HG   1 1 
ATOM   3622 N  N    . SER   A 1 235 ? -16.054 8.157   -35.852 1   22.63 ? 925  SER   A N    1 1 
ATOM   3623 C  CA   . SER   A 1 235 ? -16.579 8.38    -37.21  1   23.63 ? 925  SER   A CA   1 1 
ATOM   3624 C  C    . SER   A 1 235 ? -15.835 9.542   -37.916 1   22.78 ? 925  SER   A C    1 1 
ATOM   3625 O  O    . SER   A 1 235 ? -15.539 9.46    -39.112 1   22.19 ? 925  SER   A O    1 1 
ATOM   3626 C  CB   . SER   A 1 235 ? -18.083 8.654   -37.155 1   25.78 ? 925  SER   A CB   1 1 
ATOM   3627 O  OG   . SER   A 1 235 ? -18.38  9.945   -36.643 1   29.61 ? 925  SER   A OG   1 1 
ATOM   3628 H  H    . SER   A 1 235 ? -16.719 8.376   -35.119 0   27.55 ? 925  SER   A H    1 1 
ATOM   3629 H  HA   . SER   A 1 235 ? -16.427 7.479   -37.802 0   28.66 ? 925  SER   A HA   1 1 
ATOM   3630 H  HB2  . SER   A 1 235 ? -18.486 8.58    -38.164 0   31.9  ? 925  SER   A HB2  1 1 
ATOM   3631 H  HB3  . SER   A 1 235 ? -18.554 7.906   -36.519 0   32.08 ? 925  SER   A HB3  1 1 
ATOM   3632 H  HG   . SER   A 1 235 ? -17.892 10.123  -35.797 0   34.76 ? 925  SER   A HG   1 1 
ATOM   3633 N  N    . ILE   A 1 236 ? -15.517 10.604  -37.162 1   22.12 ? 926  ILE   A N    1 1 
ATOM   3634 C  CA   . ILE   A 1 236 ? -14.782 11.763  -37.672 1   22.07 ? 926  ILE   A CA   1 1 
ATOM   3635 C  C    . ILE   A 1 236 ? -13.364 11.309  -38.098 1   20.33 ? 926  ILE   A C    1 1 
ATOM   3636 O  O    . ILE   A 1 236 ? -12.926 11.621  -39.215 1   20    ? 926  ILE   A O    1 1 
ATOM   3637 C  CB   . ILE   A 1 236 ? -14.747 12.896  -36.591 1   23.41 ? 926  ILE   A CB   1 1 
ATOM   3638 C  CG1  . ILE   A 1 236 ? -16.123 13.581  -36.497 1   24.9  ? 926  ILE   A CG1  1 1 
ATOM   3639 C  CG2  . ILE   A 1 236 ? -13.644 13.958  -36.868 1   24.29 ? 926  ILE   A CG2  1 1 
ATOM   3640 C  CD1  . ILE   A 1 236 ? -16.279 14.433  -35.318 1   27.18 ? 926  ILE   A CD1  1 1 
ATOM   3641 H  H    . ILE   A 1 236 ? -15.764 10.683  -36.182 0   25.98 ? 926  ILE   A H    1 1 
ATOM   3642 H  HA   . ILE   A 1 236 ? -15.285 12.145  -38.558 0   25.47 ? 926  ILE   A HA   1 1 
ATOM   3643 H  HB   . ILE   A 1 236 ? -14.505 12.464  -35.621 0   26.26 ? 926  ILE   A HB   1 1 
ATOM   3644 H  HG12 . ILE   A 1 236 ? -16.27  14.206  -37.376 0   28.6  ? 926  ILE   A HG12 1 1 
ATOM   3645 H  HG13 . ILE   A 1 236 ? -16.896 12.815  -36.464 0   29.1  ? 926  ILE   A HG13 1 1 
ATOM   3646 H  HG21 . ILE   A 1 236 ? -13.465 14.531  -35.96  0   26.47 ? 926  ILE   A HG21 1 1 
ATOM   3647 H  HG22 . ILE   A 1 236 ? -12.707 13.491  -37.163 0   26.12 ? 926  ILE   A HG22 1 1 
ATOM   3648 H  HG23 . ILE   A 1 236 ? -13.995 14.634  -37.646 0   26.63 ? 926  ILE   A HG23 1 1 
ATOM   3649 H  HD11 . ILE   A 1 236 ? -17.325 14.722  -35.232 0   31.36 ? 926  ILE   A HD11 1 1 
ATOM   3650 H  HD12 . ILE   A 1 236 ? -15.977 13.862  -34.44  0   30.77 ? 926  ILE   A HD12 1 1 
ATOM   3651 H  HD13 . ILE   A 1 236 ? -15.666 15.327  -35.42  0   30.3  ? 926  ILE   A HD13 1 1 
ATOM   3652 N  N    . LEU   A 1 237 ? -12.687 10.516  -37.249 1   18.77 ? 927  LEU   A N    1 1 
ATOM   3653 C  CA   . LEU   A 1 237 ? -11.337 10.028  -37.581 1   18.17 ? 927  LEU   A CA   1 1 
ATOM   3654 C  C    . LEU   A 1 237 ? -11.383 9.071   -38.774 1   19.02 ? 927  LEU   A C    1 1 
ATOM   3655 O  O    . LEU   A 1 237 ? -10.531 9.154   -39.647 1   18.29 ? 927  LEU   A O    1 1 
ATOM   3656 C  CB   . LEU   A 1 237 ? -10.672 9.322   -36.375 1   17.75 ? 927  LEU   A CB   1 1 
ATOM   3657 C  CG   . LEU   A 1 237 ? -10.446 10.205  -35.131 1   18.13 ? 927  LEU   A CG   1 1 
ATOM   3658 C  CD1  . LEU   A 1 237 ? -10.033 9.345   -33.908 1   18.41 ? 927  LEU   A CD1  1 1 
ATOM   3659 C  CD2  . LEU   A 1 237 ? -9.46   11.349  -35.409 1   17.47 ? 927  LEU   A CD2  1 1 
ATOM   3660 H  H    . LEU   A 1 237 ? -13.049 10.185  -36.361 0   21.24 ? 927  LEU   A H    1 1 
ATOM   3661 H  HA   . LEU   A 1 237 ? -10.726 10.88   -37.875 0   19.51 ? 927  LEU   A HA   1 1 
ATOM   3662 H  HB2  . LEU   A 1 237 ? -11.303 8.488   -36.073 0   19.75 ? 927  LEU   A HB2  1 1 
ATOM   3663 H  HB3  . LEU   A 1 237 ? -9.699  8.946   -36.688 0   19.01 ? 927  LEU   A HB3  1 1 
ATOM   3664 H  HG   . LEU   A 1 237 ? -11.393 10.674  -34.87  0   19.72 ? 927  LEU   A HG   1 1 
ATOM   3665 H  HD11 . LEU   A 1 237 ? -9.877  9.999   -33.051 0   19.49 ? 927  LEU   A HD11 1 1 
ATOM   3666 H  HD12 . LEU   A 1 237 ? -10.829 8.633   -33.691 0   20.15 ? 927  LEU   A HD12 1 1 
ATOM   3667 H  HD13 . LEU   A 1 237 ? -9.112  8.814   -34.144 0   19.43 ? 927  LEU   A HD13 1 1 
ATOM   3668 H  HD21 . LEU   A 1 237 ? -9.169  11.797  -34.46  0   18.03 ? 927  LEU   A HD21 1 1 
ATOM   3669 H  HD22 . LEU   A 1 237 ? -8.58   10.947  -35.909 0   17.9  ? 927  LEU   A HD22 1 1 
ATOM   3670 H  HD23 . LEU   A 1 237 ? -9.933  12.106  -36.032 0   18.25 ? 927  LEU   A HD23 1 1 
ATOM   3671 N  N    . GLU   A 1 238 ? -12.423 8.224   -38.861 1   19.92 ? 928  GLU   A N    1 1 
ATOM   3672 C  CA   . GLU   A 1 238 ? -12.554 7.302   -40.01  1   20.84 ? 928  GLU   A CA   1 1 
ATOM   3673 C  C    . GLU   A 1 238 ? -12.764 8.054   -41.331 1   22.41 ? 928  GLU   A C    1 1 
ATOM   3674 O  O    . GLU   A 1 238 ? -12.325 7.569   -42.384 1   23.83 ? 928  GLU   A O    1 1 
ATOM   3675 C  CB   . GLU   A 1 238 ? -13.664 6.275   -39.763 1   21.65 ? 928  GLU   A CB   1 1 
ATOM   3676 C  CG   . GLU   A 1 238 ? -13.267 5.245   -38.712 1   26.64 ? 928  GLU   A CG   1 1 
ATOM   3677 C  CD   . GLU   A 1 238 ? -14.387 4.393   -38.146 1   35.52 ? 928  GLU   A CD   1 1 
ATOM   3678 O  OE1  . GLU   A 1 238 ? -15.557 4.835   -38.171 1   36.9  ? 928  GLU   A OE1  1 1 
ATOM   3679 O  OE2  . GLU   A 1 238 ? -14.085 3.282   -37.657 1   38.86 ? 928  GLU   A OE2  1 1 
ATOM   3680 H  H    . GLU   A 1 238 ? -13.168 8.151   -38.175 0   22.96 ? 928  GLU   A H    1 1 
ATOM   3681 H  HA   . GLU   A 1 238 ? -11.612 6.767   -40.122 0   23.58 ? 928  GLU   A HA   1 1 
ATOM   3682 H  HB2  . GLU   A 1 238 ? -14.559 6.799   -39.431 0   25.84 ? 928  GLU   A HB2  1 1 
ATOM   3683 H  HB3  . GLU   A 1 238 ? -13.869 5.745   -40.692 0   25.85 ? 928  GLU   A HB3  1 1 
ATOM   3684 H  HG2  . GLU   A 1 238 ? -12.542 4.567   -39.16  0   30.41 ? 928  GLU   A HG2  1 1 
ATOM   3685 H  HG3  . GLU   A 1 238 ? -12.805 5.759   -37.871 0   30.11 ? 928  GLU   A HG3  1 1 
ATOM   3686 N  N    . LYS   A 1 239 ? -13.394 9.225   -41.289 1   22.35 ? 929  LYS   A N    1 1 
ATOM   3687 C  CA   . LYS   A 1 239 ? -13.566 10.077  -42.483 1   23.99 ? 929  LYS   A CA   1 1 
ATOM   3688 C  C    . LYS   A 1 239 ? -12.27  10.844  -42.855 1   23.79 ? 929  LYS   A C    1 1 
ATOM   3689 O  O    . LYS   A 1 239 ? -12.289 11.582  -43.837 1   24.8  ? 929  LYS   A O    1 1 
ATOM   3690 C  CB   . LYS   A 1 239 ? -14.675 11.128  -42.251 1   27.82 ? 929  LYS   A CB   1 1 
ATOM   3691 C  CG   . LYS   A 1 239 ? -16.089 10.692  -42.621 1   35.83 ? 929  LYS   A CG   1 1 
ATOM   3692 C  CD   . LYS   A 1 239 ? -17.167 11.331  -41.71  1   42.89 ? 929  LYS   A CD   1 1 
ATOM   3693 C  CE   . LYS   A 1 239 ? -17.265 12.853  -41.767 1   48.25 ? 929  LYS   A CE   1 1 
ATOM   3694 N  NZ   . LYS   A 1 239 ? -17.717 13.483  -40.476 1   50.82 ? 929  LYS   A NZ   1 1 
ATOM   3695 H  H    . LYS   A 1 239 ? -13.82  9.606   -40.451 0   25.49 ? 929  LYS   A H    1 1 
ATOM   3696 H  HA   . LYS   A 1 239 ? -13.836 9.457   -43.338 0   27.42 ? 929  LYS   A HA   1 1 
ATOM   3697 H  HB2  . LYS   A 1 239 ? -14.661 11.424  -41.203 0   31.15 ? 929  LYS   A HB2  1 1 
ATOM   3698 H  HB3  . LYS   A 1 239 ? -14.47  12.008  -42.858 0   31.06 ? 929  LYS   A HB3  1 1 
ATOM   3699 H  HG2  . LYS   A 1 239 ? -16.297 10.99   -43.647 0   40.37 ? 929  LYS   A HG2  1 1 
ATOM   3700 H  HG3  . LYS   A 1 239 ? -16.164 9.61    -42.524 0   40.46 ? 929  LYS   A HG3  1 1 
ATOM   3701 H  HD2  . LYS   A 1 239 ? -18.139 10.934  -42     0   48.44 ? 929  LYS   A HD2  1 1 
ATOM   3702 H  HD3  . LYS   A 1 239 ? -16.949 11.036  -40.685 0   47.57 ? 929  LYS   A HD3  1 1 
ATOM   3703 H  HE2  . LYS   A 1 239 ? -16.306 13.301  -42.022 0   52.3  ? 929  LYS   A HE2  1 1 
ATOM   3704 H  HE3  . LYS   A 1 239 ? -17.997 13.118  -42.528 0   53.38 ? 929  LYS   A HE3  1 1 
ATOM   3705 H  HZ1  . LYS   A 1 239 ? -18.701 13.726  -40.538 0   56.23 ? 929  LYS   A HZ1  1 1 
ATOM   3706 H  HZ2  . LYS   A 1 239 ? -17.591 12.859  -39.686 0   55.69 ? 929  LYS   A HZ2  1 1 
ATOM   3707 H  HZ3  . LYS   A 1 239 ? -17.177 14.324  -40.306 0   55.13 ? 929  LYS   A HZ3  1 1 
ATOM   3708 N  N    . GLY   A 1 240 ? -11.184 10.711  -42.085 1   21.75 ? 930  GLY   A N    1 1 
ATOM   3709 C  CA   . GLY   A 1 240 ? -9.922  11.383  -42.387 1   20.79 ? 930  GLY   A CA   1 1 
ATOM   3710 C  C    . GLY   A 1 240 ? -9.773  12.762  -41.777 1   19.92 ? 930  GLY   A C    1 1 
ATOM   3711 O  O    . GLY   A 1 240 ? -8.755  13.417  -42     1   20.97 ? 930  GLY   A O    1 1 
ATOM   3712 H  H    . GLY   A 1 240 ? -11.128 10.154  -41.239 0   23.6  ? 930  GLY   A H    1 1 
ATOM   3713 H  HA2  . GLY   A 1 240 ? -9.106  10.769  -42.009 0   21.8  ? 930  GLY   A HA2  1 1 
ATOM   3714 H  HA3  . GLY   A 1 240 ? -9.791  11.47   -43.465 0   22.09 ? 930  GLY   A HA3  1 1 
ATOM   3715 N  N    . GLU   A 1 241 ? -10.744 13.2    -40.962 1   17.62 ? 931  GLU   A N    1 1 
ATOM   3716 C  CA   . GLU   A 1 241 ? -10.672 14.507  -40.327 1   17.35 ? 931  GLU   A CA   1 1 
ATOM   3717 C  C    . GLU   A 1 241 ? -9.778  14.434  -39.085 1   15.85 ? 931  GLU   A C    1 1 
ATOM   3718 O  O    . GLU   A 1 241 ? -9.766  13.426  -38.372 1   15.59 ? 931  GLU   A O    1 1 
ATOM   3719 C  CB   . GLU   A 1 241 ? -12.068 15.001  -39.926 1   19.7  ? 931  GLU   A CB   1 1 
ATOM   3720 C  CG   . GLU   A 1 241 ? -12.947 15.315  -41.121 1   27.2  ? 931  GLU   A CG   1 1 
ATOM   3721 C  CD   . GLU   A 1 241 ? -14.379 15.661  -40.757 1   35.32 ? 931  GLU   A CD   1 1 
ATOM   3722 O  OE1  . GLU   A 1 241 ? -15.265 15.434  -41.611 1   38.68 ? 931  GLU   A OE1  1 1 
ATOM   3723 O  OE2  . GLU   A 1 241 ? -14.614 16.179  -39.639 1   36.36 ? 931  GLU   A OE2  1 1 
ATOM   3724 H  H    . GLU   A 1 241 ? -11.572 12.672  -40.707 0   19.25 ? 931  GLU   A H    1 1 
ATOM   3725 H  HA   . GLU   A 1 241 ? -10.249 15.231  -41.021 0   18.25 ? 931  GLU   A HA   1 1 
ATOM   3726 H  HB2  . GLU   A 1 241 ? -12.56  14.21   -39.365 0   21.51 ? 931  GLU   A HB2  1 1 
ATOM   3727 H  HB3  . GLU   A 1 241 ? -11.971 15.9    -39.319 0   21.15 ? 931  GLU   A HB3  1 1 
ATOM   3728 H  HG2  . GLU   A 1 241 ? -12.524 16.163  -41.658 0   29.05 ? 931  GLU   A HG2  1 1 
ATOM   3729 H  HG3  . GLU   A 1 241 ? -12.98  14.447  -41.78  0   29.35 ? 931  GLU   A HG3  1 1 
ATOM   3730 N  N    . ARG   A 1 242 ? -9.062  15.522  -38.818 1   15.15 ? 932  ARG   A N    1 1 
ATOM   3731 C  CA   . ARG   A 1 242 ? -8.149  15.608  -37.68  1   14.73 ? 932  ARG   A CA   1 1 
ATOM   3732 C  C    . ARG   A 1 242 ? -8.229  17.005  -37.059 1   16.13 ? 932  ARG   A C    1 1 
ATOM   3733 O  O    . ARG   A 1 242 ? -8.863  17.909  -37.614 1   16.44 ? 932  ARG   A O    1 1 
ATOM   3734 C  CB   . ARG   A 1 242 ? -6.688  15.31   -38.166 1   14.29 ? 932  ARG   A CB   1 1 
ATOM   3735 C  CG   . ARG   A 1 242 ? -6.439  13.884  -38.736 1   14.67 ? 932  ARG   A CG   1 1 
ATOM   3736 C  CD   . ARG   A 1 242 ? -6.572  12.801  -37.676 1   16.02 ? 932  ARG   A CD   1 1 
ATOM   3737 N  NE   . ARG   A 1 242 ? -6.225  11.455  -38.16  1   15.89 ? 932  ARG   A NE   1 1 
ATOM   3738 C  CZ   . ARG   A 1 242 ? -7.047  10.609  -38.78  1   17.02 ? 932  ARG   A CZ   1 1 
ATOM   3739 N  NH1  . ARG   A 1 242 ? -8.3    10.974  -39.083 1   16.19 ? 932  ARG   A NH1  1 1 
ATOM   3740 N  NH2  . ARG   A 1 242 ? -6.618  9.408   -39.143 1   15.08 ? 932  ARG   A NH2  1 1 
ATOM   3741 H  H    . ARG   A 1 242 ? -9.091  16.373  -39.371 0   15.49 ? 932  ARG   A H    1 1 
ATOM   3742 H  HA   . ARG   A 1 242 ? -8.431  14.905  -36.898 0   14.78 ? 932  ARG   A HA   1 1 
ATOM   3743 H  HB2  . ARG   A 1 242 ? -6.437  16.021  -38.952 0   13.83 ? 932  ARG   A HB2  1 1 
ATOM   3744 H  HB3  . ARG   A 1 242 ? -6.005  15.439  -37.328 0   13.66 ? 932  ARG   A HB3  1 1 
ATOM   3745 H  HG2  . ARG   A 1 242 ? -7.162  13.676  -39.523 0   14.54 ? 932  ARG   A HG2  1 1 
ATOM   3746 H  HG3  . ARG   A 1 242 ? -5.428  13.837  -39.139 0   14.08 ? 932  ARG   A HG3  1 1 
ATOM   3747 H  HD2  . ARG   A 1 242 ? -5.877  13.045  -36.875 0   15.48 ? 932  ARG   A HD2  1 1 
ATOM   3748 H  HD3  . ARG   A 1 242 ? -7.581  12.773  -37.269 0   15.98 ? 932  ARG   A HD3  1 1 
ATOM   3749 H  HE   . ARG   A 1 242 ? -5.288  11.125  -37.951 0   15.46 ? 932  ARG   A HE   1 1 
ATOM   3750 H  HH11 . ARG   A 1 242 ? -8.691  11.878  -38.842 0   16.65 ? 932  ARG   A HH11 1 1 
ATOM   3751 H  HH12 . ARG   A 1 242 ? -8.896  10.315  -39.574 0   17.02 ? 932  ARG   A HH12 1 1 
ATOM   3752 H  HH21 . ARG   A 1 242 ? -5.667  9.118   -38.936 0   15.12 ? 932  ARG   A HH21 1 1 
ATOM   3753 H  HH22 . ARG   A 1 242 ? -7.232  8.773   -39.642 0   15.66 ? 932  ARG   A HH22 1 1 
ATOM   3754 N  N    . LEU   A 1 243 ? -7.499  17.218  -35.959 1   16.35 ? 933  LEU   A N    1 1 
ATOM   3755 C  CA   . LEU   A 1 243 ? -7.398  18.532  -35.351 1   15.75 ? 933  LEU   A CA   1 1 
ATOM   3756 C  C    . LEU   A 1 243 ? -6.793  19.549  -36.349 1   16.87 ? 933  LEU   A C    1 1 
ATOM   3757 O  O    . LEU   A 1 243 ? -5.953  19.172  -37.182 1   17.33 ? 933  LEU   A O    1 1 
ATOM   3758 C  CB   . LEU   A 1 243 ? -6.583  18.447  -34.058 1   14.93 ? 933  LEU   A CB   1 1 
ATOM   3759 C  CG   . LEU   A 1 243 ? -7.285  17.672  -32.91  1   15.88 ? 933  LEU   A CG   1 1 
ATOM   3760 C  CD1  . LEU   A 1 243 ? -6.266  17.297  -31.785 1   15.26 ? 933  LEU   A CD1  1 1 
ATOM   3761 C  CD2  . LEU   A 1 243 ? -8.477  18.476  -32.322 1   16.91 ? 933  LEU   A CD2  1 1 
ATOM   3762 H  H    . LEU   A 1 243 ? -6.968  16.492  -35.488 0   15.89 ? 933  LEU   A H    1 1 
ATOM   3763 H  HA   . LEU   A 1 243 ? -8.418  18.835  -35.124 0   15.75 ? 933  LEU   A HA   1 1 
ATOM   3764 H  HB2  . LEU   A 1 243 ? -5.638  17.948  -34.267 0   14.15 ? 933  LEU   A HB2  1 1 
ATOM   3765 H  HB3  . LEU   A 1 243 ? -6.39   19.458  -33.704 0   14.4  ? 933  LEU   A HB3  1 1 
ATOM   3766 H  HG   . LEU   A 1 243 ? -7.687  16.737  -33.298 0   15.58 ? 933  LEU   A HG   1 1 
ATOM   3767 H  HD11 . LEU   A 1 243 ? -6.79   16.762  -30.995 0   14.75 ? 933  LEU   A HD11 1 1 
ATOM   3768 H  HD12 . LEU   A 1 243 ? -5.487  16.667  -32.21  0   14.41 ? 933  LEU   A HD12 1 1 
ATOM   3769 H  HD13 . LEU   A 1 243 ? -5.828  18.212  -31.387 0   14.54 ? 933  LEU   A HD13 1 1 
ATOM   3770 H  HD21 . LEU   A 1 243 ? -8.785  18.004  -31.391 0   17.05 ? 933  LEU   A HD21 1 1 
ATOM   3771 H  HD22 . LEU   A 1 243 ? -8.154  19.499  -32.13  0   16.85 ? 933  LEU   A HD22 1 1 
ATOM   3772 H  HD23 . LEU   A 1 243 ? -9.313  18.469  -33.019 0   17.14 ? 933  LEU   A HD23 1 1 
ATOM   3773 N  N    . PRO   A 1 244 ? -7.28   20.805  -36.345 1   17.01 ? 934  PRO   A N    1 1 
ATOM   3774 C  CA   . PRO   A 1 244 ? -6.796  21.779  -37.33  1   16.88 ? 934  PRO   A CA   1 1 
ATOM   3775 C  C    . PRO   A 1 244 ? -5.37   22.258  -37.091 1   16.01 ? 934  PRO   A C    1 1 
ATOM   3776 O  O    . PRO   A 1 244 ? -4.815  22.071  -36.009 1   16.15 ? 934  PRO   A O    1 1 
ATOM   3777 C  CB   . PRO   A 1 244 ? -7.802  22.936  -37.185 1   17.91 ? 934  PRO   A CB   1 1 
ATOM   3778 C  CG   . PRO   A 1 244 ? -8.143  22.907  -35.721 1   18.27 ? 934  PRO   A CG   1 1 
ATOM   3779 C  CD   . PRO   A 1 244 ? -8.272  21.422  -35.431 1   17.19 ? 934  PRO   A CD   1 1 
ATOM   3780 H  HA   . PRO   A 1 244 ? -6.873  21.372  -38.338 0   16.77 ? 934  PRO   A HA   1 1 
ATOM   3781 H  HB2  . PRO   A 1 244 ? -7.331  23.879  -37.459 0   18.31 ? 934  PRO   A HB2  1 1 
ATOM   3782 H  HB3  . PRO   A 1 244 ? -8.683  22.744  -37.797 0   18.5  ? 934  PRO   A HB3  1 1 
ATOM   3783 H  HG2  . PRO   A 1 244 ? -7.338  23.352  -35.139 0   18.49 ? 934  PRO   A HG2  1 1 
ATOM   3784 H  HG3  . PRO   A 1 244 ? -9.086  23.424  -35.546 0   18.99 ? 934  PRO   A HG3  1 1 
ATOM   3785 H  HD2  . PRO   A 1 244 ? -8.018  21.238  -34.388 0   17.27 ? 934  PRO   A HD2  1 1 
ATOM   3786 H  HD3  . PRO   A 1 244 ? -9.277  21.075  -35.667 0   17.65 ? 934  PRO   A HD3  1 1 
ATOM   3787 N  N    . GLN   A 1 245 ? -4.781  22.878  -38.12  1   15.64 ? 935  GLN   A N    1 1 
ATOM   3788 C  CA   . GLN   A 1 245 ? -3.456  23.423  -38.018 1   16.03 ? 935  GLN   A CA   1 1 
ATOM   3789 C  C    . GLN   A 1 245 ? -3.444  24.643  -37.089 1   18.1  ? 935  GLN   A C    1 1 
ATOM   3790 O  O    . GLN   A 1 245 ? -4.041  25.66   -37.468 1   19.02 ? 935  GLN   A O    1 1 
ATOM   3791 C  CB   . GLN   A 1 245 ? -2.937  23.847  -39.396 1   15.98 ? 935  GLN   A CB   1 1 
ATOM   3792 C  CG   . GLN   A 1 245 ? -1.486  24.384  -39.344 1   16.53 ? 935  GLN   A CG   1 1 
ATOM   3793 C  CD   . GLN   A 1 245 ? -0.911  24.591  -40.739 1   17.32 ? 935  GLN   A CD   1 1 
ATOM   3794 O  OE1  . GLN   A 1 245 ? -1.639  24.584  -41.751 1   17.19 ? 935  GLN   A OE1  1 1 
ATOM   3795 N  NE2  . GLN   A 1 245 ? 0.406   24.772  -40.823 1   17.65 ? 935  GLN   A NE2  1 1 
ATOM   3796 H  H    . GLN   A 1 245 ? -5.212  23.012  -39.03  0   15.51 ? 935  GLN   A H    1 1 
ATOM   3797 H  HA   . GLN   A 1 245 ? -2.784  22.638  -37.677 0   15.43 ? 935  GLN   A HA   1 1 
ATOM   3798 H  HB2  . GLN   A 1 245 ? -2.947  22.976  -40.051 0   15.61 ? 935  GLN   A HB2  1 1 
ATOM   3799 H  HB3  . GLN   A 1 245 ? -3.577  24.624  -39.81  0   15.99 ? 935  GLN   A HB3  1 1 
ATOM   3800 H  HG2  . GLN   A 1 245 ? -1.468  25.354  -38.849 0   16.47 ? 935  GLN   A HG2  1 1 
ATOM   3801 H  HG3  . GLN   A 1 245 ? -0.862  23.677  -38.802 0   16.07 ? 935  GLN   A HG3  1 1 
ATOM   3802 H  HE21 . GLN   A 1 245 ? 0.981   24.769  -39.986 0   17.55 ? 935  GLN   A HE21 1 1 
ATOM   3803 H  HE22 . GLN   A 1 245 ? 0.838   24.917  -41.73  0   17.73 ? 935  GLN   A HE22 1 1 
ATOM   3804 N  N    . PRO   A 1 246 ? -2.713  24.636  -35.956 1   19.06 ? 936  PRO   A N    1 1 
ATOM   3805 C  CA   . PRO   A 1 246 ? -2.663  25.863  -35.129 1   19.64 ? 936  PRO   A CA   1 1 
ATOM   3806 C  C    . PRO   A 1 246 ? -1.989  27.009  -35.922 1   21.38 ? 936  PRO   A C    1 1 
ATOM   3807 O  O    . PRO   A 1 246 ? -1.02   26.752  -36.655 1   21.17 ? 936  PRO   A O    1 1 
ATOM   3808 C  CB   . PRO   A 1 246 ? -1.833  25.442  -33.917 1   20.13 ? 936  PRO   A CB   1 1 
ATOM   3809 C  CG   . PRO   A 1 246 ? -1.954  23.924  -33.863 1   20    ? 936  PRO   A CG   1 1 
ATOM   3810 C  CD   . PRO   A 1 246 ? -1.93   23.547  -35.326 1   18.19 ? 936  PRO   A CD   1 1 
ATOM   3811 H  HA   . PRO   A 1 246 ? -3.671  26.116  -34.806 0   19.8  ? 936  PRO   A HA   1 1 
ATOM   3812 H  HB2  . PRO   A 1 246 ? -0.796  25.741  -34.061 0   19.95 ? 936  PRO   A HB2  1 1 
ATOM   3813 H  HB3  . PRO   A 1 246 ? -2.244  25.896  -33.016 0   20.04 ? 936  PRO   A HB3  1 1 
ATOM   3814 H  HG2  . PRO   A 1 246 ? -1.101  23.493  -33.34  0   19.3  ? 936  PRO   A HG2  1 1 
ATOM   3815 H  HG3  . PRO   A 1 246 ? -2.895  23.635  -33.398 0   19.45 ? 936  PRO   A HG3  1 1 
ATOM   3816 H  HD2  . PRO   A 1 246 ? -0.909  23.537  -35.704 0   17.54 ? 936  PRO   A HD2  1 1 
ATOM   3817 H  HD3  . PRO   A 1 246 ? -2.41   22.575  -35.428 0   17.45 ? 936  PRO   A HD3  1 1 
ATOM   3818 N  N    . PRO   A 1 247 ? -2.492  28.262  -35.857 1   22.41 ? 937  PRO   A N    1 1 
ATOM   3819 C  CA   . PRO   A 1 247 ? -1.907  29.335  -36.695 1   22.92 ? 937  PRO   A CA   1 1 
ATOM   3820 C  C    . PRO   A 1 247 ? -0.412  29.631  -36.487 1   21.74 ? 937  PRO   A C    1 1 
ATOM   3821 O  O    . PRO   A 1 247 ? 0.227   30.091  -37.429 1   22.61 ? 937  PRO   A O    1 1 
ATOM   3822 C  CB   . PRO   A 1 247 ? -2.782  30.56   -36.368 1   24.53 ? 937  PRO   A CB   1 1 
ATOM   3823 C  CG   . PRO   A 1 247 ? -3.441  30.251  -35.102 1   25.37 ? 937  PRO   A CG   1 1 
ATOM   3824 C  CD   . PRO   A 1 247 ? -3.655  28.762  -35.103 1   23.2  ? 937  PRO   A CD   1 1 
ATOM   3825 H  HA   . PRO   A 1 247 ? -2.056  29.086  -37.744 0   23.91 ? 937  PRO   A HA   1 1 
ATOM   3826 H  HB2  . PRO   A 1 247 ? -2.151  31.442  -36.265 0   26.37 ? 937  PRO   A HB2  1 1 
ATOM   3827 H  HB3  . PRO   A 1 247 ? -3.517  30.705  -37.158 0   26.21 ? 937  PRO   A HB3  1 1 
ATOM   3828 H  HG2  . PRO   A 1 247 ? -2.796  30.545  -34.276 0   26.82 ? 937  PRO   A HG2  1 1 
ATOM   3829 H  HG3  . PRO   A 1 247 ? -4.395  30.774  -35.051 0   27.07 ? 937  PRO   A HG3  1 1 
ATOM   3830 H  HD2  . PRO   A 1 247 ? -3.653  28.4    -34.076 0   23.97 ? 937  PRO   A HD2  1 1 
ATOM   3831 H  HD3  . PRO   A 1 247 ? -4.581  28.511  -35.617 0   24.16 ? 937  PRO   A HD3  1 1 
ATOM   3832 N  N    . ILE   A 1 248 ? 0.166   29.317  -35.311 1   20.3  ? 938  ILE   A N    1 1 
ATOM   3833 C  CA   . ILE   A 1 248 ? 1.61    29.542  -35.113 1   19.41 ? 938  ILE   A CA   1 1 
ATOM   3834 C  C    . ILE   A 1 248 ? 2.456   28.435  -35.777 1   19.51 ? 938  ILE   A C    1 1 
ATOM   3835 O  O    . ILE   A 1 248 ? 3.654   28.613  -35.904 1   20.11 ? 938  ILE   A O    1 1 
ATOM   3836 C  CB   . ILE   A 1 248 ? 2.013   29.68   -33.612 1   19.28 ? 938  ILE   A CB   1 1 
ATOM   3837 C  CG1  . ILE   A 1 248 ? 1.817   28.33   -32.829 1   19    ? 938  ILE   A CG1  1 1 
ATOM   3838 C  CG2  . ILE   A 1 248 ? 1.253   30.839  -32.945 1   19.74 ? 938  ILE   A CG2  1 1 
ATOM   3839 C  CD1  . ILE   A 1 248 ? 2.642   28.244  -31.481 1   19.43 ? 938  ILE   A CD1  1 1 
ATOM   3840 H  H    . ILE   A 1 248 ? -0.333  28.916  -34.523 0   21.09 ? 938  ILE   A H    1 1 
ATOM   3841 H  HA   . ILE   A 1 248 ? 1.886   30.484  -35.584 0   20.93 ? 938  ILE   A HA   1 1 
ATOM   3842 H  HB   . ILE   A 1 248 ? 3.074   29.925  -33.58  0   20.65 ? 938  ILE   A HB   1 1 
ATOM   3843 H  HG12 . ILE   A 1 248 ? 0.763   28.233  -32.573 0   19.55 ? 938  ILE   A HG12 1 1 
ATOM   3844 H  HG13 . ILE   A 1 248 ? 2.12    27.478  -33.434 0   19.42 ? 938  ILE   A HG13 1 1 
ATOM   3845 H  HG21 . ILE   A 1 248 ? 1.693   31.057  -31.974 0   21.33 ? 938  ILE   A HG21 1 1 
ATOM   3846 H  HG22 . ILE   A 1 248 ? 1.315   31.718  -33.585 0   21.69 ? 938  ILE   A HG22 1 1 
ATOM   3847 H  HG23 . ILE   A 1 248 ? 0.213   30.545  -32.818 0   21.16 ? 938  ILE   A HG23 1 1 
ATOM   3848 H  HD11 . ILE   A 1 248 ? 2.485   27.263  -31.035 0   19.8  ? 938  ILE   A HD11 1 1 
ATOM   3849 H  HD12 . ILE   A 1 248 ? 3.699   28.384  -31.704 0   20.3  ? 938  ILE   A HD12 1 1 
ATOM   3850 H  HD13 . ILE   A 1 248 ? 2.303   29.017  -30.793 0   20.39 ? 938  ILE   A HD13 1 1 
ATOM   3851 N  N    . CYS   A 1 249 ? 1.864   27.274  -36.134 1   18.64 ? 939  CYS   A N    1 1 
ATOM   3852 C  CA   . CYS   A 1 249 ? 2.633   26.152  -36.652 1   18.05 ? 939  CYS   A CA   1 1 
ATOM   3853 C  C    . CYS   A 1 249 ? 2.954   26.269  -38.106 1   17.81 ? 939  CYS   A C    1 1 
ATOM   3854 O  O    . CYS   A 1 249 ? 2.028   26.285  -38.922 1   17.48 ? 939  CYS   A O    1 1 
ATOM   3855 C  CB   . CYS   A 1 249 ? 1.907   24.836  -36.38  1   18.67 ? 939  CYS   A CB   1 1 
ATOM   3856 S  SG   . CYS   A 1 249 ? 1.743   24.433  -34.626 1   21.99 ? 939  CYS   A SG   1 1 
ATOM   3857 H  H    . CYS   A 1 249 ? 0.87    27.079  -36.072 0   18.93 ? 939  CYS   A H    1 1 
ATOM   3858 H  HA   . CYS   A 1 249 ? 3.565   26.102  -36.091 0   18.31 ? 939  CYS   A HA   1 1 
ATOM   3859 H  HB2  . CYS   A 1 249 ? 0.907   24.882  -36.808 0   18.39 ? 939  CYS   A HB2  1 1 
ATOM   3860 H  HB3  . CYS   A 1 249 ? 2.467   24.029  -36.851 0   18.28 ? 939  CYS   A HB3  1 1 
ATOM   3861 H  HG   . CYS   A 1 249 ? 2.612   23.493  -34.238 0   21.37 ? 939  CYS   A HG   1 1 
ATOM   3862 N  N    . THR   A 1 250 ? 4.24    26.171  -38.445 1   16.94 ? 940  THR   A N    1 1 
ATOM   3863 C  CA   . THR   A 1 250 ? 4.619   26.052  -39.848 1   17.66 ? 940  THR   A CA   1 1 
ATOM   3864 C  C    . THR   A 1 250 ? 4.261   24.589  -40.252 1   16.83 ? 940  THR   A C    1 1 
ATOM   3865 O  O    . THR   A 1 250 ? 3.947   23.746  -39.396 1   16.47 ? 940  THR   A O    1 1 
ATOM   3866 C  CB   . THR   A 1 250 ? 6.094   26.382  -40.109 1   19.03 ? 940  THR   A CB   1 1 
ATOM   3867 O  OG1  . THR   A 1 250 ? 6.907   25.383  -39.497 1   18.72 ? 940  THR   A OG1  1 1 
ATOM   3868 C  CG2  . THR   A 1 250 ? 6.473   27.81   -39.704 1   20.33 ? 940  THR   A CG2  1 1 
ATOM   3869 H  H    . THR   A 1 250 ? 5.015   26.141  -37.791 0   17.52 ? 940  THR   A H    1 1 
ATOM   3870 H  HA   . THR   A 1 250 ? 4.023   26.732  -40.453 0   18.46 ? 940  THR   A HA   1 1 
ATOM   3871 H  HB   . THR   A 1 250 ? 6.254   26.318  -41.184 0   20.2  ? 940  THR   A HB   1 1 
ATOM   3872 H  HG1  . THR   A 1 250 ? 6.858   25.45   -38.506 0   19.29 ? 940  THR   A HG1  1 1 
ATOM   3873 H  HG21 . THR   A 1 250 ? 7.519   27.998  -39.947 0   22.24 ? 940  THR   A HG21 1 1 
ATOM   3874 H  HG22 . THR   A 1 250 ? 5.852   28.528  -40.237 0   22.05 ? 940  THR   A HG22 1 1 
ATOM   3875 H  HG23 . THR   A 1 250 ? 6.335   27.947  -38.632 0   21.8  ? 940  THR   A HG23 1 1 
ATOM   3876 N  N    . ILE   A 1 251 ? 4.269   24.31   -41.554 1   16.04 ? 941  ILE   A N    1 1 
ATOM   3877 C  CA   . ILE   A 1 251 ? 3.856   23.004  -42.054 1   15.63 ? 941  ILE   A CA   1 1 
ATOM   3878 C  C    . ILE   A 1 251 ? 4.654   21.808  -41.476 1   14.95 ? 941  ILE   A C    1 1 
ATOM   3879 O  O    . ILE   A 1 251 ? 4.025   20.801  -41.171 1   14.83 ? 941  ILE   A O    1 1 
ATOM   3880 C  CB   . ILE   A 1 251 ? 3.871   23.002  -43.629 1   16.18 ? 941  ILE   A CB   1 1 
ATOM   3881 C  CG1  . ILE   A 1 251 ? 3.2     21.731  -44.214 1   17.17 ? 941  ILE   A CG1  1 1 
ATOM   3882 C  CG2  . ILE   A 1 251 ? 5.29    23.167  -44.194 1   17    ? 941  ILE   A CG2  1 1 
ATOM   3883 C  CD1  . ILE   A 1 251 ? 1.821   21.444  -43.757 1   17.12 ? 941  ILE   A CD1  1 1 
ATOM   3884 H  H    . ILE   A 1 251 ? 4.504   24.99   -42.269 0   16.58 ? 941  ILE   A H    1 1 
ATOM   3885 H  HA   . ILE   A 1 251 ? 2.824   22.899  -41.723 0   15.38 ? 941  ILE   A HA   1 1 
ATOM   3886 H  HB   . ILE   A 1 251 ? 3.285   23.856  -43.963 0   16.45 ? 941  ILE   A HB   1 1 
ATOM   3887 H  HG12 . ILE   A 1 251 ? 3.148   21.857  -45.295 0   17.18 ? 941  ILE   A HG12 1 1 
ATOM   3888 H  HG13 . ILE   A 1 251 ? 3.82    20.863  -43.996 0   16.93 ? 941  ILE   A HG13 1 1 
ATOM   3889 H  HG21 . ILE   A 1 251 ? 5.222   23.234  -45.279 0   17.59 ? 941  ILE   A HG21 1 1 
ATOM   3890 H  HG22 . ILE   A 1 251 ? 5.737   24.08   -43.801 0   17.72 ? 941  ILE   A HG22 1 1 
ATOM   3891 H  HG23 . ILE   A 1 251 ? 5.9     22.307  -43.922 0   17.36 ? 941  ILE   A HG23 1 1 
ATOM   3892 H  HD11 . ILE   A 1 251 ? 1.384   20.697  -44.417 0   16.66 ? 941  ILE   A HD11 1 1 
ATOM   3893 H  HD12 . ILE   A 1 251 ? 1.839   21.044  -42.744 0   16.61 ? 941  ILE   A HD12 1 1 
ATOM   3894 H  HD13 . ILE   A 1 251 ? 1.231   22.359  -43.785 0   16.9  ? 941  ILE   A HD13 1 1 
ATOM   3895 N  N    . ASP   A 1 252 ? 5.99    21.907  -41.285 1   14.67 ? 942  ASP   A N    1 1 
ATOM   3896 C  CA   . ASP   A 1 252 ? 6.737   20.746  -40.761 1   15.75 ? 942  ASP   A CA   1 1 
ATOM   3897 C  C    . ASP   A 1 252 ? 6.265   20.35   -39.336 1   14.88 ? 942  ASP   A C    1 1 
ATOM   3898 O  O    . ASP   A 1 252 ? 6.156   19.155  -39.032 1   14.69 ? 942  ASP   A O    1 1 
ATOM   3899 C  CB   . ASP   A 1 252 ? 8.256   20.964  -40.815 1   19.06 ? 942  ASP   A CB   1 1 
ATOM   3900 C  CG   . ASP   A 1 252 ? 8.81    21.119  -42.235 1   28.66 ? 942  ASP   A CG   1 1 
ATOM   3901 O  OD1  . ASP   A 1 252 ? 8.089   20.779  -43.204 1   30.64 ? 942  ASP   A OD1  1 1 
ATOM   3902 O  OD2  . ASP   A 1 252 ? 9.936   21.596  -42.372 1   32.4  ? 942  ASP   A OD2  1 1 
ATOM   3903 H  H    . ASP   A 1 252 ? 6.549   22.734  -41.467 0   14.99 ? 942  ASP   A H    1 1 
ATOM   3904 H  HA   . ASP   A 1 252 ? 6.517   19.889  -41.396 0   15.55 ? 942  ASP   A HA   1 1 
ATOM   3905 H  HB2  . ASP   A 1 252 ? 8.502   21.868  -40.26  0   19.58 ? 942  ASP   A HB2  1 1 
ATOM   3906 H  HB3  . ASP   A 1 252 ? 8.75    20.106  -40.36  0   19.35 ? 942  ASP   A HB3  1 1 
ATOM   3907 N  N    . VAL   A 1 253 ? 5.889   21.333  -38.516 1   13.99 ? 943  VAL   A N    1 1 
ATOM   3908 C  CA   . VAL   A 1 253 ? 5.401   21.047  -37.162 1   14.79 ? 943  VAL   A CA   1 1 
ATOM   3909 C  C    . VAL   A 1 253 ? 4.047   20.37   -37.274 1   14.1  ? 943  VAL   A C    1 1 
ATOM   3910 O  O    . VAL   A 1 253 ? 3.827   19.349  -36.622 1   14.15 ? 943  VAL   A O    1 1 
ATOM   3911 C  CB   . VAL   A 1 253 ? 5.322   22.31   -36.273 1   16.66 ? 943  VAL   A CB   1 1 
ATOM   3912 C  CG1  . VAL   A 1 253 ? 4.681   21.97   -34.919 1   17.25 ? 943  VAL   A CG1  1 1 
ATOM   3913 C  CG2  . VAL   A 1 253 ? 6.714   22.91   -36.062 1   19.09 ? 943  VAL   A CG2  1 1 
ATOM   3914 H  H    . VAL   A 1 253 ? 5.888   22.319  -38.759 0   13.85 ? 943  VAL   A H    1 1 
ATOM   3915 H  HA   . VAL   A 1 253 ? 6.093   20.358  -36.679 0   14.22 ? 943  VAL   A HA   1 1 
ATOM   3916 H  HB   . VAL   A 1 253 ? 4.701   23.056  -36.766 0   16.33 ? 943  VAL   A HB   1 1 
ATOM   3917 H  HG11 . VAL   A 1 253 ? 4.825   22.81   -34.242 0   16.78 ? 943  VAL   A HG11 1 1 
ATOM   3918 H  HG12 . VAL   A 1 253 ? 3.614   21.794  -35.048 0   16.42 ? 943  VAL   A HG12 1 1 
ATOM   3919 H  HG13 . VAL   A 1 253 ? 5.161   21.081  -34.515 0   16.57 ? 943  VAL   A HG13 1 1 
ATOM   3920 H  HG21 . VAL   A 1 253 ? 6.642   23.766  -35.394 0   19.24 ? 943  VAL   A HG21 1 1 
ATOM   3921 H  HG22 . VAL   A 1 253 ? 7.36    22.151  -35.623 0   19.06 ? 943  VAL   A HG22 1 1 
ATOM   3922 H  HG23 . VAL   A 1 253 ? 7.111   23.226  -37.026 0   19.29 ? 943  VAL   A HG23 1 1 
ATOM   3923 N  N    . TYR   A 1 254 ? 3.121   20.933  -38.074 1   13.4  ? 944  TYR   A N    1 1 
ATOM   3924 C  CA   . TYR   A 1 254 ? 1.796   20.318  -38.221 1   13.57 ? 944  TYR   A CA   1 1 
ATOM   3925 C  C    . TYR   A 1 254 ? 1.889   18.92   -38.822 1   13.64 ? 944  TYR   A C    1 1 
ATOM   3926 O  O    . TYR   A 1 254 ? 1.129   18.04   -38.427 1   13.97 ? 944  TYR   A O    1 1 
ATOM   3927 C  CB   . TYR   A 1 254 ? 0.865   21.204  -39.055 1   13.61 ? 944  TYR   A CB   1 1 
ATOM   3928 C  CG   . TYR   A 1 254 ? -0.566  20.687  -39.126 1   14.43 ? 944  TYR   A CG   1 1 
ATOM   3929 C  CD1  . TYR   A 1 254 ? -1.326  20.509  -37.97  1   15.17 ? 944  TYR   A CD1  1 1 
ATOM   3930 C  CD2  . TYR   A 1 254 ? -1.136  20.324  -40.343 1   15.64 ? 944  TYR   A CD2  1 1 
ATOM   3931 C  CE1  . TYR   A 1 254 ? -2.646  20.054  -38.032 1   15.06 ? 944  TYR   A CE1  1 1 
ATOM   3932 C  CE2  . TYR   A 1 254 ? -2.461  19.899  -40.423 1   15.7  ? 944  TYR   A CE2  1 1 
ATOM   3933 C  CZ   . TYR   A 1 254 ? -3.212  19.762  -39.265 1   15.97 ? 944  TYR   A CZ   1 1 
ATOM   3934 O  OH   . TYR   A 1 254 ? -4.513  19.304  -39.364 1   16.48 ? 944  TYR   A OH   1 1 
ATOM   3935 H  H    . TYR   A 1 254 ? 3.244   21.79   -38.605 0   12.74 ? 944  TYR   A H    1 1 
ATOM   3936 H  HA   . TYR   A 1 254 ? 1.36    20.216  -37.23  0   12.45 ? 944  TYR   A HA   1 1 
ATOM   3937 H  HB2  . TYR   A 1 254 ? 0.854   22.191  -38.597 0   12.85 ? 944  TYR   A HB2  1 1 
ATOM   3938 H  HB3  . TYR   A 1 254 ? 1.257   21.271  -40.068 0   12.82 ? 944  TYR   A HB3  1 1 
ATOM   3939 H  HD1  . TYR   A 1 254 ? -0.916  20.78   -37.012 0   14.1  ? 944  TYR   A HD1  1 1 
ATOM   3940 H  HD2  . TYR   A 1 254 ? -0.565  20.451  -41.245 0   14.82 ? 944  TYR   A HD2  1 1 
ATOM   3941 H  HE1  . TYR   A 1 254 ? -3.226  19.965  -37.128 0   14.1  ? 944  TYR   A HE1  1 1 
ATOM   3942 H  HE2  . TYR   A 1 254 ? -2.891  19.642  -41.376 0   14.96 ? 944  TYR   A HE2  1 1 
ATOM   3943 H  HH   . TYR   A 1 254 ? -5.011  19.472  -38.522 0   15.86 ? 944  TYR   A HH   1 1 
ATOM   3944 N  N    . MET   A 1 255 ? 2.859   18.688  -39.721 1   13.37 ? 945  MET   A N    1 1 
ATOM   3945 C  CA   . MET   A 1 255 ? 3.025   17.371  -40.324 1   14.18 ? 945  MET   A CA   1 1 
ATOM   3946 C  C    . MET   A 1 255 ? 3.437   16.332  -39.275 1   13.24 ? 945  MET   A C    1 1 
ATOM   3947 O  O    . MET   A 1 255 ? 3.025   15.186  -39.399 1   12.78 ? 945  MET   A O    1 1 
ATOM   3948 C  CB   . MET   A 1 255 ? 4.012   17.418  -41.508 1   15.05 ? 945  MET   A CB   1 1 
ATOM   3949 C  CG   . MET   A 1 255 ? 3.411   18.047  -42.779 1   18.63 ? 945  MET   A CG   1 1 
ATOM   3950 S  SD   . MET   A 1 255 ? 1.771   17.467  -43.325 1   24.05 ? 945  MET   A SD   1 1 
ATOM   3951 C  CE   . MET   A 1 255 ? 2.04    15.744  -43.396 1   20.2  ? 945  MET   A CE   1 1 
ATOM   3952 H  H    . MET   A 1 255 ? 3.521   19.383  -40.052 0   12.49 ? 945  MET   A H    1 1 
ATOM   3953 H  HA   . MET   A 1 255 ? 2.048   17.063  -40.692 0   13.05 ? 945  MET   A HA   1 1 
ATOM   3954 H  HB2  . MET   A 1 255 ? 4.88    18.012  -41.227 0   14.31 ? 945  MET   A HB2  1 1 
ATOM   3955 H  HB3  . MET   A 1 255 ? 4.342   16.405  -41.739 0   14.18 ? 945  MET   A HB3  1 1 
ATOM   3956 H  HG2  . MET   A 1 255 ? 3.315   19.115  -42.591 0   17.95 ? 945  MET   A HG2  1 1 
ATOM   3957 H  HG3  . MET   A 1 255 ? 4.105   17.885  -43.603 0   18.03 ? 945  MET   A HG3  1 1 
ATOM   3958 H  HE1  . MET   A 1 255 ? 1.218   15.291  -43.948 0   19.3  ? 945  MET   A HE1  1 1 
ATOM   3959 H  HE2  . MET   A 1 255 ? 2.984   15.551  -43.905 0   19.42 ? 945  MET   A HE2  1 1 
ATOM   3960 H  HE3  . MET   A 1 255 ? 2.067   15.337  -42.387 0   19.2  ? 945  MET   A HE3  1 1 
ATOM   3961 N  N    . ILE   A 1 256 ? 4.185   16.73   -38.22  1   13.12 ? 946  ILE   A N    1 1 
ATOM   3962 C  CA   . ILE   A 1 256 ? 4.545   15.822  -37.113 1   13.52 ? 946  ILE   A CA   1 1 
ATOM   3963 C  C    . ILE   A 1 256 ? 3.236   15.377  -36.449 1   13.6  ? 946  ILE   A C    1 1 
ATOM   3964 O  O    . ILE   A 1 256 ? 3.04    14.182  -36.208 1   13.56 ? 946  ILE   A O    1 1 
ATOM   3965 C  CB   . ILE   A 1 256 ? 5.486   16.473  -36.062 1   14.56 ? 946  ILE   A CB   1 1 
ATOM   3966 C  CG1  . ILE   A 1 256 ? 6.897   16.705  -36.672 1   16.11 ? 946  ILE   A CG1  1 1 
ATOM   3967 C  CG2  . ILE   A 1 256 ? 5.554   15.568  -34.768 1   15.7  ? 946  ILE   A CG2  1 1 
ATOM   3968 C  CD1  . ILE   A 1 256 ? 7.843   17.505  -35.716 1   17.56 ? 946  ILE   A CD1  1 1 
ATOM   3969 H  H    . ILE   A 1 256 ? 4.547   17.671  -38.104 0   12.07 ? 946  ILE   A H    1 1 
ATOM   3970 H  HA   . ILE   A 1 256 ? 5.041   14.94   -37.516 0   12.4  ? 946  ILE   A HA   1 1 
ATOM   3971 H  HB   . ILE   A 1 256 ? 5.071   17.44   -35.781 0   13.45 ? 946  ILE   A HB   1 1 
ATOM   3972 H  HG12 . ILE   A 1 256 ? 7.36    15.741  -36.874 0   15.38 ? 946  ILE   A HG12 1 1 
ATOM   3973 H  HG13 . ILE   A 1 256 ? 6.801   17.273  -37.596 0   15.38 ? 946  ILE   A HG13 1 1 
ATOM   3974 H  HG21 . ILE   A 1 256 ? 6.273   15.968  -34.056 0   14.65 ? 946  ILE   A HG21 1 1 
ATOM   3975 H  HG22 . ILE   A 1 256 ? 4.582   15.545  -34.277 0   14.39 ? 946  ILE   A HG22 1 1 
ATOM   3976 H  HG23 . ILE   A 1 256 ? 5.845   14.56   -35.059 0   14.6  ? 946  ILE   A HG23 1 1 
ATOM   3977 H  HD11 . ILE   A 1 256 ? 8.667   17.912  -36.301 0   17.28 ? 946  ILE   A HD11 1 1 
ATOM   3978 H  HD12 . ILE   A 1 256 ? 7.283   18.316  -35.252 0   16.97 ? 946  ILE   A HD12 1 1 
ATOM   3979 H  HD13 . ILE   A 1 256 ? 8.244   16.843  -34.949 0   16.95 ? 946  ILE   A HD13 1 1 
ATOM   3980 N  N    . MET   A 1 257 ? 2.341   16.346  -36.138 1   13.52 ? 947  MET   A N    1 1 
ATOM   3981 C  CA   . MET   A 1 257 ? 1.049   15.987  -35.523 1   14.14 ? 947  MET   A CA   1 1 
ATOM   3982 C  C    . MET   A 1 257 ? 0.265   15.042  -36.435 1   13.55 ? 947  MET   A C    1 1 
ATOM   3983 O  O    . MET   A 1 257 ? -0.27   14.021  -35.972 1   13.4  ? 947  MET   A O    1 1 
ATOM   3984 C  CB   . MET   A 1 257 ? 0.196   17.237  -35.259 1   15.66 ? 947  MET   A CB   1 1 
ATOM   3985 C  CG   . MET   A 1 257 ? 0.652   18.059  -34.067 1   20.27 ? 947  MET   A CG   1 1 
ATOM   3986 S  SD   . MET   A 1 257 ? -0.201  19.691  -34.02  1   25    ? 947  MET   A SD   1 1 
ATOM   3987 C  CE   . MET   A 1 257 ? 1.138   20.752  -34.251 1   24.77 ? 947  MET   A CE   1 1 
ATOM   3988 H  H    . MET   A 1 257 ? 2.482   17.34   -36.291 0   12.15 ? 947  MET   A H    1 1 
ATOM   3989 H  HA   . MET   A 1 257 ? 1.234   15.482  -34.576 0   12.61 ? 947  MET   A HA   1 1 
ATOM   3990 H  HB2  . MET   A 1 257 ? 0.22    17.879  -36.138 0   14.26 ? 947  MET   A HB2  1 1 
ATOM   3991 H  HB3  . MET   A 1 257 ? -0.828  16.921  -35.066 0   14.22 ? 947  MET   A HB3  1 1 
ATOM   3992 H  HG2  . MET   A 1 257 ? 0.402   17.524  -33.152 0   18.78 ? 947  MET   A HG2  1 1 
ATOM   3993 H  HG3  . MET   A 1 257 ? 1.728   18.213  -34.124 0   18.85 ? 947  MET   A HG3  1 1 
ATOM   3994 H  HE1  . MET   A 1 257 ? 0.773   21.705  -34.632 0   23.75 ? 947  MET   A HE1  1 1 
ATOM   3995 H  HE2  . MET   A 1 257 ? 1.663   20.909  -33.312 0   23.6  ? 947  MET   A HE2  1 1 
ATOM   3996 H  HE3  . MET   A 1 257 ? 1.818   20.321  -34.983 0   23.61 ? 947  MET   A HE3  1 1 
ATOM   3997 N  N    . ARG   A 1 258 ? 0.204   15.37   -37.745 1   12.07 ? 948  ARG   A N    1 1 
ATOM   3998 C  CA   . ARG   A 1 258 ? -0.562  14.513  -38.672 1   11.68 ? 948  ARG   A CA   1 1 
ATOM   3999 C  C    . ARG   A 1 258 ? 0.035   13.081  -38.77  1   12.71 ? 948  ARG   A C    1 1 
ATOM   4000 O  O    . ARG   A 1 258 ? -0.729  12.099  -38.836 1   13.45 ? 948  ARG   A O    1 1 
ATOM   4001 C  CB   . ARG   A 1 258 ? -0.684  15.186  -40.05  1   11.67 ? 948  ARG   A CB   1 1 
ATOM   4002 C  CG   . ARG   A 1 258 ? -1.527  16.483  -40.022 1   13.82 ? 948  ARG   A CG   1 1 
ATOM   4003 C  CD   . ARG   A 1 258 ? -2.99   16.311  -39.617 1   14.8  ? 948  ARG   A CD   1 1 
ATOM   4004 N  NE   . ARG   A 1 258 ? -3.715  15.525  -40.606 1   16.36 ? 948  ARG   A NE   1 1 
ATOM   4005 C  CZ   . ARG   A 1 258 ? -4.678  15.953  -41.424 1   18.23 ? 948  ARG   A CZ   1 1 
ATOM   4006 N  NH1  . ARG   A 1 258 ? -5.213  15.128  -42.309 1   20.17 ? 948  ARG   A NH1  1 1 
ATOM   4007 N  NH2  . ARG   A 1 258 ? -5.104  17.221  -41.374 1   16.78 ? 948  ARG   A NH2  1 1 
ATOM   4008 H  H    . ARG   A 1 258 ? 0.666   16.166  -38.172 0   10.69 ? 948  ARG   A H    1 1 
ATOM   4009 H  HA   . ARG   A 1 258 ? -1.548  14.362  -38.239 0   10.42 ? 948  ARG   A HA   1 1 
ATOM   4010 H  HB2  . ARG   A 1 258 ? 0.312   15.442  -40.407 0   10.44 ? 948  ARG   A HB2  1 1 
ATOM   4011 H  HB3  . ARG   A 1 258 ? -1.156  14.49   -40.741 0   10.54 ? 948  ARG   A HB3  1 1 
ATOM   4012 H  HG2  . ARG   A 1 258 ? -1.074  17.184  -39.323 0   12.6  ? 948  ARG   A HG2  1 1 
ATOM   4013 H  HG3  . ARG   A 1 258 ? -1.518  16.916  -41.022 0   12.75 ? 948  ARG   A HG3  1 1 
ATOM   4014 H  HD2  . ARG   A 1 258 ? -3.114  15.827  -38.652 0   13.7  ? 948  ARG   A HD2  1 1 
ATOM   4015 H  HD3  . ARG   A 1 258 ? -3.395  17.311  -39.498 0   13.83 ? 948  ARG   A HD3  1 1 
ATOM   4016 H  HE   . ARG   A 1 258 ? -3.445  14.551  -40.699 0   15.47 ? 948  ARG   A HE   1 1 
ATOM   4017 H  HH11 . ARG   A 1 258 ? -4.919  14.158  -42.349 0   19.7  ? 948  ARG   A HH11 1 1 
ATOM   4018 H  HH12 . ARG   A 1 258 ? -5.959  15.446  -42.92  0   19.93 ? 948  ARG   A HH12 1 1 
ATOM   4019 H  HH21 . ARG   A 1 258 ? -4.748  17.947  -40.764 0   16.12 ? 948  ARG   A HH21 1 1 
ATOM   4020 H  HH22 . ARG   A 1 258 ? -5.834  17.497  -42.023 0   16.44 ? 948  ARG   A HH22 1 1 
ATOM   4021 N  N    . LYS   A 1 259 ? 1.361   12.956  -38.657 1   12.02 ? 949  LYS   A N    1 1 
ATOM   4022 C  CA   . LYS   A 1 259 ? 1.99    11.621  -38.672 1   12.47 ? 949  LYS   A CA   1 1 
ATOM   4023 C  C    . LYS   A 1 259 ? 1.636   10.853  -37.384 1   12.88 ? 949  LYS   A C    1 1 
ATOM   4024 O  O    . LYS   A 1 259 ? 1.433   9.635   -37.421 1   13.42 ? 949  LYS   A O    1 1 
ATOM   4025 C  CB   . LYS   A 1 259 ? 3.513   11.74   -38.868 1   13.65 ? 949  LYS   A CB   1 1 
ATOM   4026 C  CG   . LYS   A 1 259 ? 3.88    12.125  -40.323 1   16.32 ? 949  LYS   A CG   1 1 
ATOM   4027 C  CD   . LYS   A 1 259 ? 5.391   12.306  -40.479 1   23.94 ? 949  LYS   A CD   1 1 
ATOM   4028 C  CE   . LYS   A 1 259 ? 5.714   12.852  -41.865 1   30.76 ? 949  LYS   A CE   1 1 
ATOM   4029 N  NZ   . LYS   A 1 259 ? 7.187   13.087  -42.074 1   36.36 ? 949  LYS   A NZ   1 1 
ATOM   4030 H  H    . LYS   A 1 259 ? 2.016   13.727  -38.566 0   10.71 ? 949  LYS   A H    1 1 
ATOM   4031 H  HA   . LYS   A 1 259 ? 1.596   11.064  -39.519 0   11.41 ? 949  LYS   A HA   1 1 
ATOM   4032 H  HB2  . LYS   A 1 259 ? 3.929   12.479  -38.185 0   12.5  ? 949  LYS   A HB2  1 1 
ATOM   4033 H  HB3  . LYS   A 1 259 ? 3.978   10.769  -38.713 0   12.68 ? 949  LYS   A HB3  1 1 
ATOM   4034 H  HG2  . LYS   A 1 259 ? 3.558   11.335  -40.999 0   15.43 ? 949  LYS   A HG2  1 1 
ATOM   4035 H  HG3  . LYS   A 1 259 ? 3.395   13.065  -40.58  0   15.26 ? 949  LYS   A HG3  1 1 
ATOM   4036 H  HD2  . LYS   A 1 259 ? 5.753   13.015  -39.736 0   23.09 ? 949  LYS   A HD2  1 1 
ATOM   4037 H  HD3  . LYS   A 1 259 ? 5.887   11.344  -40.359 0   23.26 ? 949  LYS   A HD3  1 1 
ATOM   4038 H  HE2  . LYS   A 1 259 ? 5.382   12.135  -42.614 0   30.19 ? 949  LYS   A HE2  1 1 
ATOM   4039 H  HE3  . LYS   A 1 259 ? 5.197   13.8    -42.002 0   30.02 ? 949  LYS   A HE3  1 1 
ATOM   4040 H  HZ1  . LYS   A 1 259 ? 7.324   13.806  -42.777 0   36.06 ? 949  LYS   A HZ1  1 1 
ATOM   4041 H  HZ2  . LYS   A 1 259 ? 7.625   13.382  -41.207 0   36    ? 949  LYS   A HZ2  1 1 
ATOM   4042 H  HZ3  . LYS   A 1 259 ? 7.631   12.232  -42.392 0   36.18 ? 949  LYS   A HZ3  1 1 
ATOM   4043 N  N    . CYS   A 1 260 ? 1.542   11.557  -36.247 1   11.46 ? 950  CYS   A N    1 1 
ATOM   4044 C  CA   . CYS   A 1 260 ? 1.116   10.929  -34.976 1   12.09 ? 950  CYS   A CA   1 1 
ATOM   4045 C  C    . CYS   A 1 260 ? -0.315  10.37   -35.06  1   12.26 ? 950  CYS   A C    1 1 
ATOM   4046 O  O    . CYS   A 1 260 ? -0.686  9.501   -34.255 1   13.15 ? 950  CYS   A O    1 1 
ATOM   4047 C  CB   . CYS   A 1 260 ? 1.233   11.937  -33.831 1   12.99 ? 950  CYS   A CB   1 1 
ATOM   4048 S  SG   . CYS   A 1 260 ? 2.941   12.326  -33.377 1   15.94 ? 950  CYS   A SG   1 1 
ATOM   4049 H  H    . CYS   A 1 260 ? 1.776   12.539  -36.153 0   10.08 ? 950  CYS   A H    1 1 
ATOM   4050 H  HA   . CYS   A 1 260 ? 1.771   10.086  -34.76  0   10.92 ? 950  CYS   A HA   1 1 
ATOM   4051 H  HB2  . CYS   A 1 260 ? 0.736   12.864  -34.113 0   11.54 ? 950  CYS   A HB2  1 1 
ATOM   4052 H  HB3  . CYS   A 1 260 ? 0.748   11.517  -32.951 0   11.64 ? 950  CYS   A HB3  1 1 
ATOM   4053 H  HG   . CYS   A 1 260 ? 3.454   13.166  -34.284 0   14.55 ? 950  CYS   A HG   1 1 
ATOM   4054 N  N    . TRP   A 1 261 ? -1.157  10.963  -35.927 1   12.14 ? 951  TRP   A N    1 1 
ATOM   4055 C  CA   . TRP   A 1 261 ? -2.555  10.557  -36.065 1   13.21 ? 951  TRP   A CA   1 1 
ATOM   4056 C  C    . TRP   A 1 261 ? -2.818  9.699   -37.323 1   13.72 ? 951  TRP   A C    1 1 
ATOM   4057 O  O    . TRP   A 1 261 ? -3.944  9.663   -37.799 1   13.68 ? 951  TRP   A O    1 1 
ATOM   4058 C  CB   . TRP   A 1 261 ? -3.47   11.77   -36.044 1   13.13 ? 951  TRP   A CB   1 1 
ATOM   4059 C  CG   . TRP   A 1 261 ? -3.237  12.694  -34.871 1   12.79 ? 951  TRP   A CG   1 1 
ATOM   4060 C  CD1  . TRP   A 1 261 ? -2.921  12.346  -33.58  1   12.99 ? 951  TRP   A CD1  1 1 
ATOM   4061 C  CD2  . TRP   A 1 261 ? -3.285  14.129  -34.905 1   12.52 ? 951  TRP   A CD2  1 1 
ATOM   4062 N  NE1  . TRP   A 1 261 ? -2.783  13.488  -32.808 1   13.09 ? 951  TRP   A NE1  1 1 
ATOM   4063 C  CE2  . TRP   A 1 261 ? -3.002  14.592  -33.601 1   12.83 ? 951  TRP   A CE2  1 1 
ATOM   4064 C  CE3  . TRP   A 1 261 ? -3.562  15.073  -35.918 1   13.14 ? 951  TRP   A CE3  1 1 
ATOM   4065 C  CZ2  . TRP   A 1 261 ? -3.03   15.945  -33.272 1   13.93 ? 951  TRP   A CZ2  1 1 
ATOM   4066 C  CZ3  . TRP   A 1 261 ? -3.602  16.415  -35.586 1   14.21 ? 951  TRP   A CZ3  1 1 
ATOM   4067 C  CH2  . TRP   A 1 261 ? -3.279  16.843  -34.289 1   14.21 ? 951  TRP   A CH2  1 1 
ATOM   4068 H  H    . TRP   A 1 261 ? -0.917  11.735  -36.54  0   10.92 ? 951  TRP   A H    1 1 
ATOM   4069 H  HA   . TRP   A 1 261 ? -2.847  9.946   -35.213 0   12.4  ? 951  TRP   A HA   1 1 
ATOM   4070 H  HB2  . TRP   A 1 261 ? -3.332  12.335  -36.965 0   12.15 ? 951  TRP   A HB2  1 1 
ATOM   4071 H  HB3  . TRP   A 1 261 ? -4.499  11.423  -35.965 0   12.43 ? 951  TRP   A HB3  1 1 
ATOM   4072 H  HD1  . TRP   A 1 261 ? -2.789  11.342  -33.212 0   11.96 ? 951  TRP   A HD1  1 1 
ATOM   4073 H  HE1  . TRP   A 1 261 ? -2.552  13.507  -31.793 0   11.83 ? 951  TRP   A HE1  1 1 
ATOM   4074 H  HE3  . TRP   A 1 261 ? -3.807  14.747  -36.915 0   12.07 ? 951  TRP   A HE3  1 1 
ATOM   4075 H  HZ2  . TRP   A 1 261 ? -2.793  16.282  -32.277 0   12.63 ? 951  TRP   A HZ2  1 1 
ATOM   4076 H  HZ3  . TRP   A 1 261 ? -3.784  17.146  -36.356 0   13.13 ? 951  TRP   A HZ3  1 1 
ATOM   4077 H  HH2  . TRP   A 1 261 ? -3.285  17.898  -34.068 0   13.01 ? 951  TRP   A HH2  1 1 
ATOM   4078 N  N    . MET   A 1 262 ? -1.812  8.97    -37.799 1   13.95 ? 952  MET   A N    1 1 
ATOM   4079 C  CA   . MET   A 1 262 ? -2.009  8.044   -38.915 1   15.32 ? 952  MET   A CA   1 1 
ATOM   4080 C  C    . MET   A 1 262 ? -2.835  6.843   -38.468 1   16.61 ? 952  MET   A C    1 1 
ATOM   4081 O  O    . MET   A 1 262 ? -2.748  6.401   -37.318 1   16.28 ? 952  MET   A O    1 1 
ATOM   4082 C  CB   . MET   A 1 262 ? -0.656  7.575   -39.487 1   15.83 ? 952  MET   A CB   1 1 
ATOM   4083 C  CG   . MET   A 1 262 ? 0.01    8.634   -40.303 1   17.19 ? 952  MET   A CG   1 1 
ATOM   4084 S  SD   . MET   A 1 262 ? 1.719   8.195   -40.764 1   19.05 ? 952  MET   A SD   1 1 
ATOM   4085 C  CE   . MET   A 1 262 ? 1.362   7.288   -42.317 1   20.47 ? 952  MET   A CE   1 1 
ATOM   4086 H  H    . MET   A 1 262 ? -0.868  8.973   -37.429 0   13.14 ? 952  MET   A H    1 1 
ATOM   4087 H  HA   . MET   A 1 262 ? -2.564  8.557   -39.7   0   14.91 ? 952  MET   A HA   1 1 
ATOM   4088 H  HB2  . MET   A 1 262 ? 0.013   7.292   -38.676 0   15.36 ? 952  MET   A HB2  1 1 
ATOM   4089 H  HB3  . MET   A 1 262 ? -0.83   6.718   -40.136 0   15.64 ? 952  MET   A HB3  1 1 
ATOM   4090 H  HG2  . MET   A 1 262 ? -0.555  8.773   -41.223 0   16.64 ? 952  MET   A HG2  1 1 
ATOM   4091 H  HG3  . MET   A 1 262 ? 0.003   9.556   -39.727 0   16.36 ? 952  MET   A HG3  1 1 
ATOM   4092 H  HE1  . MET   A 1 262 ? 2.298   6.935   -42.744 0   20.36 ? 952  MET   A HE1  1 1 
ATOM   4093 H  HE2  . MET   A 1 262 ? 0.714   6.442   -42.091 0   20.41 ? 952  MET   A HE2  1 1 
ATOM   4094 H  HE3  . MET   A 1 262 ? 0.865   7.961   -43.014 0   20.18 ? 952  MET   A HE3  1 1 
ATOM   4095 N  N    . ILE   A 1 263 ? -3.643  6.301   -39.388 1   17.84 ? 953  ILE   A N    1 1 
ATOM   4096 C  CA   . ILE   A 1 263 ? -4.464  5.124   -39.093 1   19.1  ? 953  ILE   A CA   1 1 
ATOM   4097 C  C    . ILE   A 1 263 ? -3.575  3.93    -38.739 1   18.75 ? 953  ILE   A C    1 1 
ATOM   4098 O  O    . ILE   A 1 263 ? -3.862  3.206   -37.779 1   19.07 ? 953  ILE   A O    1 1 
ATOM   4099 C  CB   . ILE   A 1 263 ? -5.393  4.78    -40.311 1   20.46 ? 953  ILE   A CB   1 1 
ATOM   4100 C  CG1  . ILE   A 1 263 ? -6.459  5.892   -40.572 1   22.03 ? 953  ILE   A CG1  1 1 
ATOM   4101 C  CG2  . ILE   A 1 263 ? -6.056  3.403   -40.151 1   21.21 ? 953  ILE   A CG2  1 1 
ATOM   4102 C  CD1  . ILE   A 1 263 ? -7.505  6.153   -39.464 1   23.02 ? 953  ILE   A CD1  1 1 
ATOM   4103 H  H    . ILE   A 1 263 ? -3.713  6.641   -40.342 0   18.08 ? 953  ILE   A H    1 1 
ATOM   4104 H  HA   . ILE   A 1 263 ? -5.075  5.33    -38.216 0   19.85 ? 953  ILE   A HA   1 1 
ATOM   4105 H  HB   . ILE   A 1 263 ? -4.761  4.725   -41.195 0   21.48 ? 953  ILE   A HB   1 1 
ATOM   4106 H  HG12 . ILE   A 1 263 ? -5.94   6.833   -40.749 0   22.76 ? 953  ILE   A HG12 1 1 
ATOM   4107 H  HG13 . ILE   A 1 263 ? -7.012  5.624   -41.472 0   23.44 ? 953  ILE   A HG13 1 1 
ATOM   4108 H  HG21 . ILE   A 1 263 ? -6.915  3.353   -40.819 0   23.23 ? 953  ILE   A HG21 1 1 
ATOM   4109 H  HG22 . ILE   A 1 263 ? -5.348  2.623   -40.427 0   22.97 ? 953  ILE   A HG22 1 1 
ATOM   4110 H  HG23 . ILE   A 1 263 ? -6.381  3.266   -39.121 0   23.05 ? 953  ILE   A HG23 1 1 
ATOM   4111 H  HD11 . ILE   A 1 263 ? -8.227  6.874   -39.843 0   24.33 ? 953  ILE   A HD11 1 1 
ATOM   4112 H  HD12 . ILE   A 1 263 ? -8.029  5.231   -39.217 0   24.72 ? 953  ILE   A HD12 1 1 
ATOM   4113 H  HD13 . ILE   A 1 263 ? -7.022  6.563   -38.579 0   24    ? 953  ILE   A HD13 1 1 
ATOM   4114 N  N    . ASP   A 1 264 ? -2.489  3.743   -39.487 1   18.38 ? 954  ASP   A N    1 1 
ATOM   4115 C  CA   . ASP   A 1 264 ? -1.594  2.618   -39.236 1   18.89 ? 954  ASP   A CA   1 1 
ATOM   4116 C  C    . ASP   A 1 264 ? -0.67   2.943   -38.06  1   17.87 ? 954  ASP   A C    1 1 
ATOM   4117 O  O    . ASP   A 1 264 ? 0.244   3.749   -38.221 1   17.67 ? 954  ASP   A O    1 1 
ATOM   4118 C  CB   . ASP   A 1 264 ? -0.797  2.287   -40.495 1   21.12 ? 954  ASP   A CB   1 1 
ATOM   4119 C  CG   . ASP   A 1 264 ? 0.054   1.062   -40.3   1   27.43 ? 954  ASP   A CG   1 1 
ATOM   4120 O  OD1  . ASP   A 1 264 ? -0.485  0.037   -39.853 1   28.79 ? 954  ASP   A OD1  1 1 
ATOM   4121 O  OD2  . ASP   A 1 264 ? 1.26    1.133   -40.58  1   30.25 ? 954  ASP   A OD2  1 1 
ATOM   4122 H  H    . ASP   A 1 264 ? -2.205  4.323   -40.27  0   18.99 ? 954  ASP   A H    1 1 
ATOM   4123 H  HA   . ASP   A 1 264 ? -2.187  1.741   -38.98  0   20.27 ? 954  ASP   A HA   1 1 
ATOM   4124 H  HB2  . ASP   A 1 264 ? -1.489  2.09    -41.313 0   22.43 ? 954  ASP   A HB2  1 1 
ATOM   4125 H  HB3  . ASP   A 1 264 ? -0.147  3.122   -40.751 0   21.91 ? 954  ASP   A HB3  1 1 
ATOM   4126 N  N    . ALA   A 1 265 ? -0.898  2.324   -36.881 1   17.37 ? 955  ALA   A N    1 1 
ATOM   4127 C  CA   . ALA   A 1 265 ? -0.099  2.622   -35.674 1   17.95 ? 955  ALA   A CA   1 1 
ATOM   4128 C  C    . ALA   A 1 265 ? 1.428   2.489   -35.882 1   18.28 ? 955  ALA   A C    1 1 
ATOM   4129 O  O    . ALA   A 1 265 ? 2.192   3.344   -35.436 1   17.73 ? 955  ALA   A O    1 1 
ATOM   4130 C  CB   . ALA   A 1 265 ? -0.54   1.717   -34.519 1   18.48 ? 955  ALA   A CB   1 1 
ATOM   4131 H  H    . ALA   A 1 265 ? -1.618  1.625   -36.729 0   18.6  ? 955  ALA   A H    1 1 
ATOM   4132 H  HA   . ALA   A 1 265 ? -0.297  3.65    -35.376 0   18.3  ? 955  ALA   A HA   1 1 
ATOM   4133 H  HB1  . ALA   A 1 265 ? 0.029   1.979   -33.629 0   19.35 ? 955  ALA   A HB1  1 1 
ATOM   4134 H  HB2  . ALA   A 1 265 ? -1.603  1.868   -34.338 0   19.55 ? 955  ALA   A HB2  1 1 
ATOM   4135 H  HB3  . ALA   A 1 265 ? -0.352  0.679   -34.79  0   19.87 ? 955  ALA   A HB3  1 1 
ATOM   4136 N  N    . ASP   A 1 266 ? 1.868   1.433   -36.57  1   18.78 ? 956  ASP   A N    1 1 
ATOM   4137 C  CA   . ASP   A 1 266 ? 3.295   1.191   -36.817 1   19.91 ? 956  ASP   A CA   1 1 
ATOM   4138 C  C    . ASP   A 1 266 ? 3.952   2.222   -37.746 1   19.47 ? 956  ASP   A C    1 1 
ATOM   4139 O  O    . ASP   A 1 266 ? 5.177   2.331   -37.748 1   20.87 ? 956  ASP   A O    1 1 
ATOM   4140 C  CB   . ASP   A 1 266 ? 3.519   -0.238  -37.38  1   23.54 ? 956  ASP   A CB   1 1 
ATOM   4141 C  CG   . ASP   A 1 266 ? 3.168   -1.361  -36.403 1   32.71 ? 956  ASP   A CG   1 1 
ATOM   4142 O  OD1  . ASP   A 1 266 ? 3.222   -1.126  -35.181 1   33.41 ? 956  ASP   A OD1  1 1 
ATOM   4143 O  OD2  . ASP   A 1 266 ? 2.829   -2.476  -36.872 1   38.2  ? 956  ASP   A OD2  1 1 
ATOM   4144 H  H    . ASP   A 1 266 ? 1.262   0.724   -36.968 0   20.09 ? 956  ASP   A H    1 1 
ATOM   4145 H  HA   . ASP   A 1 266 ? 3.822   1.259   -35.867 0   20.97 ? 956  ASP   A HA   1 1 
ATOM   4146 H  HB2  . ASP   A 1 266 ? 2.906   -0.368  -38.27  0   25.31 ? 956  ASP   A HB2  1 1 
ATOM   4147 H  HB3  . ASP   A 1 266 ? 4.57    -0.346  -37.641 0   25.33 ? 956  ASP   A HB3  1 1 
ATOM   4148 N  N    . SER   A 1 267 ? 3.162   2.977   -38.51  1   17.44 ? 957  SER   A N    1 1 
ATOM   4149 C  CA   . SER   A 1 267 ? 3.665   4.026   -39.396 1   17.04 ? 957  SER   A CA   1 1 
ATOM   4150 C  C    . SER   A 1 267 ? 3.824   5.378   -38.661 1   16.27 ? 957  SER   A C    1 1 
ATOM   4151 O  O    . SER   A 1 267 ? 4.441   6.275   -39.214 1   16.34 ? 957  SER   A O    1 1 
ATOM   4152 C  CB   . SER   A 1 267 ? 2.703   4.226   -40.559 1   18.08 ? 957  SER   A CB   1 1 
ATOM   4153 O  OG   . SER   A 1 267 ? 2.694   3.094   -41.416 1   21.79 ? 957  SER   A OG   1 1 
ATOM   4154 H  H    . SER   A 1 267 ? 2.153   2.882   -38.557 0   18.06 ? 957  SER   A H    1 1 
ATOM   4155 H  HA   . SER   A 1 267 ? 4.634   3.743   -39.806 0   17.59 ? 957  SER   A HA   1 1 
ATOM   4156 H  HB2  . SER   A 1 267 ? 1.703   4.423   -40.174 0   18.36 ? 957  SER   A HB2  1 1 
ATOM   4157 H  HB3  . SER   A 1 267 ? 3.037   5.085   -41.14  0   18.26 ? 957  SER   A HB3  1 1 
ATOM   4158 H  HG   . SER   A 1 267 ? 1.895   2.525   -41.256 0   22.7  ? 957  SER   A HG   1 1 
ATOM   4159 N  N    . ARG   A 1 268 ? 3.212   5.546   -37.48  1   15.81 ? 958  ARG   A N    1 1 
ATOM   4160 C  CA   . ARG   A 1 268 ? 3.332   6.789   -36.708 1   15.25 ? 958  ARG   A CA   1 1 
ATOM   4161 C  C    . ARG   A 1 268 ? 4.807   6.968   -36.285 1   15.76 ? 958  ARG   A C    1 1 
ATOM   4162 O  O    . ARG   A 1 268 ? 5.512   5.95    -36.119 1   15.29 ? 958  ARG   A O    1 1 
ATOM   4163 C  CB   . ARG   A 1 268 ? 2.47    6.727   -35.424 1   14.64 ? 958  ARG   A CB   1 1 
ATOM   4164 C  CG   . ARG   A 1 268 ? 0.968   6.711   -35.73  1   15.06 ? 958  ARG   A CG   1 1 
ATOM   4165 C  CD   . ARG   A 1 268 ? 0.12    6.467   -34.482 1   15.77 ? 958  ARG   A CD   1 1 
ATOM   4166 N  NE   . ARG   A 1 268 ? -1.217  6.062   -34.926 1   14.78 ? 958  ARG   A NE   1 1 
ATOM   4167 C  CZ   . ARG   A 1 268 ? -2.042  5.251   -34.274 1   16.73 ? 958  ARG   A CZ   1 1 
ATOM   4168 N  NH1  . ARG   A 1 268 ? -3.198  4.886   -34.83  1   15.02 ? 958  ARG   A NH1  1 1 
ATOM   4169 N  NH2  . ARG   A 1 268 ? -1.728  4.802   -33.053 1   15.86 ? 958  ARG   A NH2  1 1 
ATOM   4170 H  H    . ARG   A 1 268 ? 2.648   4.838   -37.022 0   15.79 ? 958  ARG   A H    1 1 
ATOM   4171 H  HA   . ARG   A 1 268 ? 2.988   7.606   -37.339 0   14.61 ? 958  ARG   A HA   1 1 
ATOM   4172 H  HB2  . ARG   A 1 268 ? 2.711   5.824   -34.868 0   14.29 ? 958  ARG   A HB2  1 1 
ATOM   4173 H  HB3  . ARG   A 1 268 ? 2.679   7.606   -34.815 0   13.9  ? 958  ARG   A HB3  1 1 
ATOM   4174 H  HG2  . ARG   A 1 268 ? 0.68    7.674   -36.15  0   14.36 ? 958  ARG   A HG2  1 1 
ATOM   4175 H  HG3  . ARG   A 1 268 ? 0.751   5.914   -36.439 0   14.75 ? 958  ARG   A HG3  1 1 
ATOM   4176 H  HD2  . ARG   A 1 268 ? 0.596   5.673   -33.91  0   15.47 ? 958  ARG   A HD2  1 1 
ATOM   4177 H  HD3  . ARG   A 1 268 ? 0.041   7.381   -33.897 0   15.11 ? 958  ARG   A HD3  1 1 
ATOM   4178 H  HE   . ARG   A 1 268 ? -1.51   6.349   -35.855 0   14.51 ? 958  ARG   A HE   1 1 
ATOM   4179 H  HH11 . ARG   A 1 268 ? -3.464  5.237   -35.745 0   15.36 ? 958  ARG   A HH11 1 1 
ATOM   4180 H  HH12 . ARG   A 1 268 ? -3.852  4.304   -34.316 0   15.7  ? 958  ARG   A HH12 1 1 
ATOM   4181 H  HH21 . ARG   A 1 268 ? -0.864  5.024   -32.571 0   15.83 ? 958  ARG   A HH21 1 1 
ATOM   4182 H  HH22 . ARG   A 1 268 ? -2.39   4.2     -32.574 0   16.29 ? 958  ARG   A HH22 1 1 
ATOM   4183 N  N    . PRO   A 1 269 ? 5.262   8.199   -35.944 1   15.78 ? 959  PRO   A N    1 1 
ATOM   4184 C  CA   . PRO   A 1 269 ? 6.637   8.332   -35.459 1   15.47 ? 959  PRO   A CA   1 1 
ATOM   4185 C  C    . PRO   A 1 269 ? 6.854   7.558   -34.166 1   15.66 ? 959  PRO   A C    1 1 
ATOM   4186 O  O    . PRO   A 1 269 ? 5.89    7.219   -33.458 1   15.91 ? 959  PRO   A O    1 1 
ATOM   4187 C  CB   . PRO   A 1 269 ? 6.784   9.835   -35.187 1   16.37 ? 959  PRO   A CB   1 1 
ATOM   4188 C  CG   . PRO   A 1 269 ? 5.704   10.506  -36.05  1   16.73 ? 959  PRO   A CG   1 1 
ATOM   4189 C  CD   . PRO   A 1 269 ? 4.578   9.513   -35.977 1   15.59 ? 959  PRO   A CD   1 1 
ATOM   4190 H  HA   . PRO   A 1 269 ? 7.353   8.016   -36.217 0   15.23 ? 959  PRO   A HA   1 1 
ATOM   4191 H  HB2  . PRO   A 1 269 ? 6.609   10.034  -34.131 0   15.64 ? 959  PRO   A HB2  1 1 
ATOM   4192 H  HB3  . PRO   A 1 269 ? 7.778   10.166  -35.485 0   15.88 ? 959  PRO   A HB3  1 1 
ATOM   4193 H  HG2  . PRO   A 1 269 ? 5.417   11.462  -35.615 0   15.7  ? 959  PRO   A HG2  1 1 
ATOM   4194 H  HG3  . PRO   A 1 269 ? 6.061   10.626  -37.072 0   15.93 ? 959  PRO   A HG3  1 1 
ATOM   4195 H  HD2  . PRO   A 1 269 ? 4.033   9.658   -35.046 0   14.58 ? 959  PRO   A HD2  1 1 
ATOM   4196 H  HD3  . PRO   A 1 269 ? 3.917   9.621   -36.833 0   14.65 ? 959  PRO   A HD3  1 1 
ATOM   4197 N  N    . LYS   A 1 270 ? 8.117   7.255   -33.884 1   15.32 ? 960  LYS   A N    1 1 
ATOM   4198 C  CA   . LYS   A 1 270 ? 8.496   6.648   -32.609 1   16.19 ? 960  LYS   A CA   1 1 
ATOM   4199 C  C    . LYS   A 1 270 ? 8.941   7.788   -31.693 1   15.85 ? 960  LYS   A C    1 1 
ATOM   4200 O  O    . LYS   A 1 270 ? 9.421   8.829   -32.198 1   15.57 ? 960  LYS   A O    1 1 
ATOM   4201 C  CB   . LYS   A 1 270 ? 9.655   5.637   -32.797 1   18.7  ? 960  LYS   A CB   1 1 
ATOM   4202 C  CG   . LYS   A 1 270 ? 9.379   4.53    -33.842 1   24.57 ? 960  LYS   A CG   1 1 
ATOM   4203 C  CD   . LYS   A 1 270 ? 8.191   3.619   -33.453 1   30.94 ? 960  LYS   A CD   1 1 
ATOM   4204 C  CE   . LYS   A 1 270 ? 7.903   2.551   -34.491 1   36.72 ? 960  LYS   A CE   1 1 
ATOM   4205 N  NZ   . LYS   A 1 270 ? 7.074   3.074   -35.615 1   39.27 ? 960  LYS   A NZ   1 1 
ATOM   4206 H  H    . LYS   A 1 270 ? 8.9     7.435   -34.503 0   15.44 ? 960  LYS   A H    1 1 
ATOM   4207 H  HA   . LYS   A 1 270 ? 7.655   6.151   -32.129 0   16.27 ? 960  LYS   A HA   1 1 
ATOM   4208 H  HB2  . LYS   A 1 270 ? 10.542  6.18    -33.118 0   19.48 ? 960  LYS   A HB2  1 1 
ATOM   4209 H  HB3  . LYS   A 1 270 ? 9.849   5.148   -31.844 0   19.5  ? 960  LYS   A HB3  1 1 
ATOM   4210 H  HG2  . LYS   A 1 270 ? 9.161   4.979   -34.81  0   25.26 ? 960  LYS   A HG2  1 1 
ATOM   4211 H  HG3  . LYS   A 1 270 ? 10.264  3.901   -33.923 0   25.8  ? 960  LYS   A HG3  1 1 
ATOM   4212 H  HD2  . LYS   A 1 270 ? 8.428   3.117   -32.516 0   31.94 ? 960  LYS   A HD2  1 1 
ATOM   4213 H  HD3  . LYS   A 1 270 ? 7.279   4.203   -33.337 0   31.42 ? 960  LYS   A HD3  1 1 
ATOM   4214 H  HE2  . LYS   A 1 270 ? 8.845   2.191   -34.903 0   38.13 ? 960  LYS   A HE2  1 1 
ATOM   4215 H  HE3  . LYS   A 1 270 ? 7.359   1.733   -34.022 0   37.96 ? 960  LYS   A HE3  1 1 
ATOM   4216 H  HZ1  . LYS   A 1 270 ? 6.795   2.306   -36.217 0   40.29 ? 960  LYS   A HZ1  1 1 
ATOM   4217 H  HZ2  . LYS   A 1 270 ? 6.24    3.53    -35.261 0   39.8  ? 960  LYS   A HZ2  1 1 
ATOM   4218 H  HZ3  . LYS   A 1 270 ? 7.607   3.739   -36.167 0   40.03 ? 960  LYS   A HZ3  1 1 
ATOM   4219 N  N    . PHE   A 1 271 ? 8.85    7.605   -30.359 1   15.54 ? 961  PHE   A N    1 1 
ATOM   4220 C  CA   . PHE   A 1 271 ? 9.302   8.666   -29.435 1   16.12 ? 961  PHE   A CA   1 1 
ATOM   4221 C  C    . PHE   A 1 271 ? 10.792  9.021   -29.661 1   17.76 ? 961  PHE   A C    1 1 
ATOM   4222 O  O    . PHE   A 1 271 ? 11.152  10.209  -29.642 1   17.45 ? 961  PHE   A O    1 1 
ATOM   4223 C  CB   . PHE   A 1 271 ? 9       8.327   -27.969 1   15.93 ? 961  PHE   A CB   1 1 
ATOM   4224 C  CG   . PHE   A 1 271 ? 7.519   8.397   -27.642 1   15.76 ? 961  PHE   A CG   1 1 
ATOM   4225 C  CD1  . PHE   A 1 271 ? 6.838   9.605   -27.684 1   15.8  ? 961  PHE   A CD1  1 1 
ATOM   4226 C  CD2  . PHE   A 1 271 ? 6.822   7.263   -27.243 1   15.83 ? 961  PHE   A CD2  1 1 
ATOM   4227 C  CE1  . PHE   A 1 271 ? 5.48    9.672   -27.361 1   16.2  ? 961  PHE   A CE1  1 1 
ATOM   4228 C  CE2  . PHE   A 1 271 ? 5.469   7.334   -26.927 1   16.03 ? 961  PHE   A CE2  1 1 
ATOM   4229 C  CZ   . PHE   A 1 271 ? 4.802   8.53    -27.009 1   15.86 ? 961  PHE   A CZ   1 1 
ATOM   4230 H  H    . PHE   A 1 271 ? 8.483   6.772   -29.908 0   15.68 ? 961  PHE   A H    1 1 
ATOM   4231 H  HA   . PHE   A 1 271 ? 8.756   9.573   -29.685 0   15.87 ? 961  PHE   A HA   1 1 
ATOM   4232 H  HB2  . PHE   A 1 271 ? 9.354   7.32    -27.757 0   16.24 ? 961  PHE   A HB2  1 1 
ATOM   4233 H  HB3  . PHE   A 1 271 ? 9.517   9.042   -27.33  0   16.04 ? 961  PHE   A HB3  1 1 
ATOM   4234 H  HD1  . PHE   A 1 271 ? 7.356   10.505  -27.971 0   15.21 ? 961  PHE   A HD1  1 1 
ATOM   4235 H  HD2  . PHE   A 1 271 ? 7.327   6.312   -27.196 0   15.93 ? 961  PHE   A HD2  1 1 
ATOM   4236 H  HE1  . PHE   A 1 271 ? 4.968   10.615  -27.419 0   15.26 ? 961  PHE   A HE1  1 1 
ATOM   4237 H  HE2  . PHE   A 1 271 ? 4.937   6.441   -26.643 0   15.82 ? 961  PHE   A HE2  1 1 
ATOM   4238 H  HZ   . PHE   A 1 271 ? 3.756   8.582   -26.753 0   15.13 ? 961  PHE   A HZ   1 1 
ATOM   4239 N  N    A ARG   A 1 272 ? 11.635  8.014   -29.927 0.5 18.23 ? 962  ARG   A N    1 1 
ATOM   4240 N  N    B ARG   A 1 272 ? 11.635  8.014   -29.922 0.5 18.49 ? 962  ARG   A N    1 1 
ATOM   4241 C  CA   A ARG   A 1 272 ? 13.056  8.274   -30.22  0.5 19.72 ? 962  ARG   A CA   1 1 
ATOM   4242 C  CA   B ARG   A 1 272 ? 13.056  8.273   -30.221 0.5 20.21 ? 962  ARG   A CA   1 1 
ATOM   4243 C  C    A ARG   A 1 272 ? 13.237  9.202   -31.45  0.5 19.85 ? 962  ARG   A C    1 1 
ATOM   4244 C  C    B ARG   A 1 272 ? 13.228  9.214   -31.443 0.5 20    ? 962  ARG   A C    1 1 
ATOM   4245 O  O    A ARG   A 1 272 ? 14.132  10.057  -31.456 0.5 20.68 ? 962  ARG   A O    1 1 
ATOM   4246 O  O    B ARG   A 1 272 ? 14.108  10.085  -31.44  0.5 20.83 ? 962  ARG   A O    1 1 
ATOM   4247 C  CB   A ARG   A 1 272 ? 13.86   6.954   -30.358 0.5 20.83 ? 962  ARG   A CB   1 1 
ATOM   4248 C  CB   B ARG   A 1 272 ? 13.85   6.951   -30.395 0.5 22.11 ? 962  ARG   A CB   1 1 
ATOM   4249 C  CG   A ARG   A 1 272 ? 13.449  6.02    -31.506 0.5 23.56 ? 962  ARG   A CG   1 1 
ATOM   4250 C  CG   B ARG   A 1 272 ? 13.376  6.026   -31.518 0.5 26.44 ? 962  ARG   A CG   1 1 
ATOM   4251 C  CD   A ARG   A 1 272 ? 14.142  4.658   -31.425 0.5 26.88 ? 962  ARG   A CD   1 1 
ATOM   4252 C  CD   B ARG   A 1 272 ? 14.21   4.758   -31.625 0.5 31.45 ? 962  ARG   A CD   1 1 
ATOM   4253 N  NE   A ARG   A 1 272 ? 13.629  3.838   -30.322 0.5 28.9  ? 962  ARG   A NE   1 1 
ATOM   4254 N  NE   B ARG   A 1 272 ? 13.977  4.08    -32.906 0.5 35.26 ? 962  ARG   A NE   1 1 
ATOM   4255 C  CZ   A ARG   A 1 272 ? 12.543  3.063   -30.353 0.5 30.48 ? 962  ARG   A CZ   1 1 
ATOM   4256 C  CZ   B ARG   A 1 272 ? 13.005  3.206   -33.172 0.5 37.91 ? 962  ARG   A CZ   1 1 
ATOM   4257 N  NH1  A ARG   A 1 272 ? 11.806  2.974   -31.456 0.5 30.39 ? 962  ARG   A NH1  1 1 
ATOM   4258 N  NH1  B ARG   A 1 272 ? 12.138  2.851   -32.227 0.5 38.08 ? 962  ARG   A NH1  1 1 
ATOM   4259 N  NH2  A ARG   A 1 272 ? 12.172  2.388   -29.27  0.5 29.8  ? 962  ARG   A NH2  1 1 
ATOM   4260 N  NH2  B ARG   A 1 272 ? 12.895  2.676   -34.385 0.5 37.82 ? 962  ARG   A NH2  1 1 
ATOM   4261 H  H    A ARG   A 1 272 ? 11.378  7.032   -29.898 0   19.1  ? 962  ARG   A H    1 1 
ATOM   4262 H  H    B ARG   A 1 272 ? 11.378  7.033   -29.881 0   19.36 ? 962  ARG   A H    1 1 
ATOM   4263 H  HA   A ARG   A 1 272 ? 13.475  8.802   -29.365 0   21.08 ? 962  ARG   A HA   1 1 
ATOM   4264 H  HA   B ARG   A 1 272 ? 13.487  8.788   -29.363 0   21.58 ? 962  ARG   A HA   1 1 
ATOM   4265 H  HB2  A ARG   A 1 272 ? 14.908  7.209   -30.509 0   23.01 ? 962  ARG   A HB2  1 1 
ATOM   4266 H  HB2  B ARG   A 1 272 ? 14.89   7.202   -30.598 0   24.28 ? 962  ARG   A HB2  1 1 
ATOM   4267 H  HB3  A ARG   A 1 272 ? 13.756  6.4     -29.426 0   22.68 ? 962  ARG   A HB3  1 1 
ATOM   4268 H  HB3  B ARG   A 1 272 ? 13.789  6.389   -29.464 0   23.98 ? 962  ARG   A HB3  1 1 
ATOM   4269 H  HG2  A ARG   A 1 272 ? 12.374  5.852   -31.467 0   24.97 ? 962  ARG   A HG2  1 1 
ATOM   4270 H  HG2  B ARG   A 1 272 ? 12.345  5.733   -31.328 0   27.86 ? 962  ARG   A HG2  1 1 
ATOM   4271 H  HG3  A ARG   A 1 272 ? 13.722  6.481   -32.454 0   25.35 ? 962  ARG   A HG3  1 1 
ATOM   4272 H  HG3  B ARG   A 1 272 ? 13.445  6.549   -32.471 0   28.09 ? 962  ARG   A HG3  1 1 
ATOM   4273 H  HD2  A ARG   A 1 272 ? 14.035  4.126   -32.369 0   29.29 ? 962  ARG   A HD2  1 1 
ATOM   4274 H  HD2  B ARG   A 1 272 ? 15.26   5.045   -31.601 0   34.19 ? 962  ARG   A HD2  1 1 
ATOM   4275 H  HD3  A ARG   A 1 272 ? 15.199  4.829   -31.231 0   29.64 ? 962  ARG   A HD3  1 1 
ATOM   4276 H  HD3  B ARG   A 1 272 ? 14.004  4.092   -30.788 0   33.86 ? 962  ARG   A HD3  1 1 
ATOM   4277 H  HE   A ARG   A 1 272 ? 14.152  3.876   -29.453 0   31.47 ? 962  ARG   A HE   1 1 
ATOM   4278 H  HE   B ARG   A 1 272 ? 14.612  4.317   -33.663 0   37.9  ? 962  ARG   A HE   1 1 
ATOM   4279 H  HH11 A ARG   A 1 272 ? 12.017  3.478   -32.31  0   32.25 ? 962  ARG   A HH11 1 1 
ATOM   4280 H  HH11 B ARG   A 1 272 ? 12.148  3.227   -31.285 0   40.07 ? 962  ARG   A HH11 1 1 
ATOM   4281 H  HH12 A ARG   A 1 272 ? 10.981  2.383   -31.448 0   32.23 ? 962  ARG   A HH12 1 1 
ATOM   4282 H  HH12 B ARG   A 1 272 ? 11.408  2.186   -32.46  0   40.11 ? 962  ARG   A HH12 1 1 
ATOM   4283 H  HH21 A ARG   A 1 272 ? 12.724  2.439   -28.421 0   32.23 ? 962  ARG   A HH21 1 1 
ATOM   4284 H  HH21 B ARG   A 1 272 ? 13.553  2.929   -35.114 0   40.41 ? 962  ARG   A HH21 1 1 
ATOM   4285 H  HH22 A ARG   A 1 272 ? 11.349  1.794   -29.293 0   31.96 ? 962  ARG   A HH22 1 1 
ATOM   4286 H  HH22 B ARG   A 1 272 ? 12.161  2.005   -34.588 0   40.17 ? 962  ARG   A HH22 1 1 
ATOM   4287 N  N    . GLU   A 1 273 ? 12.366  9.076   -32.456 1   18.91 ? 963  GLU   A N    1 1 
ATOM   4288 C  CA   . GLU   A 1 273 ? 12.424  9.915   -33.668 1   18.47 ? 963  GLU   A CA   1 1 
ATOM   4289 C  C    . GLU   A 1 273 ? 11.911  11.332  -33.383 1   19.05 ? 963  GLU   A C    1 1 
ATOM   4290 O  O    . GLU   A 1 273 ? 12.41   12.317  -33.947 1   19.92 ? 963  GLU   A O    1 1 
ATOM   4291 C  CB   . GLU   A 1 273 ? 11.566  9.283   -34.788 1   20.04 ? 963  GLU   A CB   1 1 
ATOM   4292 C  CG   . GLU   A 1 273 ? 12.103  7.956   -35.323 1   22.38 ? 963  GLU   A CG   1 1 
ATOM   4293 C  CD   . GLU   A 1 273 ? 11.121  7.155   -36.167 1   26.4  ? 963  GLU   A CD   1 1 
ATOM   4294 O  OE1  . GLU   A 1 273 ? 9.909   7.47    -36.162 1   21.04 ? 963  GLU   A OE1  1 1 
ATOM   4295 O  OE2  . GLU   A 1 273 ? 11.566  6.191   -36.828 1   31.14 ? 963  GLU   A OE2  1 1 
ATOM   4296 H  H    A GLU   A 1 273 ? 11.603  8.408   -32.462 0   19.62 ? 963  GLU   A H    1 1 
ATOM   4297 H  H    B GLU   A 1 273 ? 11.612  8.398   -32.467 0   19.63 ? 963  GLU   A H    1 1 
ATOM   4298 H  HA   . GLU   A 1 273 ? 13.45   9.982   -34.027 0   19.71 ? 963  GLU   A HA   1 1 
ATOM   4299 H  HB2  . GLU   A 1 273 ? 10.557  9.132   -34.407 0   20.35 ? 963  GLU   A HB2  1 1 
ATOM   4300 H  HB3  . GLU   A 1 273 ? 11.533  9.979   -35.625 0   20.6  ? 963  GLU   A HB3  1 1 
ATOM   4301 H  HG2  . GLU   A 1 273 ? 12.972  8.164   -35.945 0   23.72 ? 963  GLU   A HG2  1 1 
ATOM   4302 H  HG3  . GLU   A 1 273 ? 12.398  7.325   -34.486 0   23.57 ? 963  GLU   A HG3  1 1 
ATOM   4303 N  N    . LEU   A 1 274 ? 10.876  11.436  -32.544 1   17.9  ? 964  LEU   A N    1 1 
ATOM   4304 C  CA   . LEU   A 1 274 ? 10.281  12.724  -32.175 1   17.03 ? 964  LEU   A CA   1 1 
ATOM   4305 C  C    . LEU   A 1 274 ? 11.274  13.552  -31.359 1   16.94 ? 964  LEU   A C    1 1 
ATOM   4306 O  O    . LEU   A 1 274 ? 11.331  14.769  -31.508 1   17.06 ? 964  LEU   A O    1 1 
ATOM   4307 C  CB   . LEU   A 1 274 ? 8.996   12.479  -31.343 1   15.95 ? 964  LEU   A CB   1 1 
ATOM   4308 C  CG   . LEU   A 1 274 ? 7.825   11.886  -32.154 1   16.08 ? 964  LEU   A CG   1 1 
ATOM   4309 C  CD1  . LEU   A 1 274 ? 6.729   11.391  -31.254 1   15.56 ? 964  LEU   A CD1  1 1 
ATOM   4310 C  CD2  . LEU   A 1 274 ? 7.263   12.913  -33.143 1   16.91 ? 964  LEU   A CD2  1 1 
ATOM   4311 H  H    . LEU   A 1 274 ? 10.433  10.64   -32.097 0   17.98 ? 964  LEU   A H    1 1 
ATOM   4312 H  HA   . LEU   A 1 274 ? 10.06   13.293  -33.076 0   16.86 ? 964  LEU   A HA   1 1 
ATOM   4313 H  HB2  . LEU   A 1 274 ? 9.222   11.792  -30.529 0   15.61 ? 964  LEU   A HB2  1 1 
ATOM   4314 H  HB3  . LEU   A 1 274 ? 8.666   13.431  -30.93  0   15.39 ? 964  LEU   A HB3  1 1 
ATOM   4315 H  HG   . LEU   A 1 274 ? 8.183   11.034  -32.729 0   15.54 ? 964  LEU   A HG   1 1 
ATOM   4316 H  HD11 . LEU   A 1 274 ? 5.865   11.119  -31.859 0   14.59 ? 964  LEU   A HD11 1 1 
ATOM   4317 H  HD12 . LEU   A 1 274 ? 7.054   10.514  -30.702 0   14.84 ? 964  LEU   A HD12 1 1 
ATOM   4318 H  HD13 . LEU   A 1 274 ? 6.459   12.191  -30.565 0   14.57 ? 964  LEU   A HD13 1 1 
ATOM   4319 H  HD21 . LEU   A 1 274 ? 6.316   12.554  -33.542 0   15.93 ? 964  LEU   A HD21 1 1 
ATOM   4320 H  HD22 . LEU   A 1 274 ? 7.104   13.854  -32.619 0   15.96 ? 964  LEU   A HD22 1 1 
ATOM   4321 H  HD23 . LEU   A 1 274 ? 7.951   13.056  -33.974 0   16.24 ? 964  LEU   A HD23 1 1 
ATOM   4322 N  N    . ILE   A 1 275 ? 12.085  12.904  -30.503 1   17.14 ? 965  ILE   A N    1 1 
ATOM   4323 C  CA   . ILE   A 1 275 ? 13.136  13.612  -29.742 1   17.59 ? 965  ILE   A CA   1 1 
ATOM   4324 C  C    . ILE   A 1 275 ? 14.08   14.303  -30.758 1   17.77 ? 965  ILE   A C    1 1 
ATOM   4325 O  O    . ILE   A 1 275 ? 14.321  15.495  -30.647 1   18.33 ? 965  ILE   A O    1 1 
ATOM   4326 C  CB   . ILE   A 1 275 ? 13.964  12.64   -28.839 1   18.39 ? 965  ILE   A CB   1 1 
ATOM   4327 C  CG1  . ILE   A 1 275 ? 13.131  12.075  -27.664 1   18.2  ? 965  ILE   A CG1  1 1 
ATOM   4328 C  CG2  . ILE   A 1 275 ? 15.264  13.342  -28.323 1   19.9  ? 965  ILE   A CG2  1 1 
ATOM   4329 C  CD1  . ILE   A 1 275 ? 13.846  10.808  -26.951 1   19.86 ? 965  ILE   A CD1  1 1 
ATOM   4330 H  H    . ILE   A 1 275 ? 12.043  11.907  -30.319 0   17.67 ? 965  ILE   A H    1 1 
ATOM   4331 H  HA   . ILE   A 1 275 ? 12.683  14.377  -29.113 0   18.35 ? 965  ILE   A HA   1 1 
ATOM   4332 H  HB   . ILE   A 1 275 ? 14.271  11.801  -29.461 0   19.83 ? 965  ILE   A HB   1 1 
ATOM   4333 H  HG12 . ILE   A 1 275 ? 12.982  12.854  -26.919 0   19.15 ? 965  ILE   A HG12 1 1 
ATOM   4334 H  HG13 . ILE   A 1 275 ? 12.167  11.737  -28.041 0   18.84 ? 965  ILE   A HG13 1 1 
ATOM   4335 H  HG21 . ILE   A 1 275 ? 15.769  12.721  -27.586 0   22.08 ? 965  ILE   A HG21 1 1 
ATOM   4336 H  HG22 . ILE   A 1 275 ? 15.953  13.499  -29.152 0   22.07 ? 965  ILE   A HG22 1 1 
ATOM   4337 H  HG23 . ILE   A 1 275 ? 14.996  14.299  -27.878 0   21.68 ? 965  ILE   A HG23 1 1 
ATOM   4338 H  HD11 . ILE   A 1 275 ? 13.092  10.244  -26.407 0   21.08 ? 965  ILE   A HD11 1 1 
ATOM   4339 H  HD12 . ILE   A 1 275 ? 14.319  10.182  -27.706 0   21.36 ? 965  ILE   A HD12 1 1 
ATOM   4340 H  HD13 . ILE   A 1 275 ? 14.599  11.169  -26.253 0   21.68 ? 965  ILE   A HD13 1 1 
ATOM   4341 N  N    . ILE   A 1 276 ? 14.522  13.556  -31.782 1   17.67 ? 966  ILE   A N    1 1 
ATOM   4342 C  CA   . ILE   A 1 276 ? 15.47   14.06   -32.783 1   18.66 ? 966  ILE   A CA   1 1 
ATOM   4343 C  C    . ILE   A 1 276 ? 14.861  15.182  -33.62  1   17.67 ? 966  ILE   A C    1 1 
ATOM   4344 O  O    . ILE   A 1 276 ? 15.487  16.248  -33.781 1   17.61 ? 966  ILE   A O    1 1 
ATOM   4345 C  CB   . ILE   A 1 276 ? 16.041  12.881  -33.653 1   20.37 ? 966  ILE   A CB   1 1 
ATOM   4346 C  CG1  . ILE   A 1 276 ? 16.984  11.987  -32.77  1   22.42 ? 966  ILE   A CG1  1 1 
ATOM   4347 C  CG2  . ILE   A 1 276 ? 16.765  13.425  -34.924 1   21.77 ? 966  ILE   A CG2  1 1 
ATOM   4348 C  CD1  . ILE   A 1 276 ? 17.336  10.663  -33.351 1   23.87 ? 966  ILE   A CD1  1 1 
ATOM   4349 H  H    . ILE   A 1 276 ? 14.227  12.599  -31.948 0   19.06 ? 966  ILE   A H    1 1 
ATOM   4350 H  HA   . ILE   A 1 276 ? 16.309  14.49   -32.236 0   21.07 ? 966  ILE   A HA   1 1 
ATOM   4351 H  HB   . ILE   A 1 276 ? 15.209  12.265  -33.99  0   22.25 ? 966  ILE   A HB   1 1 
ATOM   4352 H  HG12 . ILE   A 1 276 ? 17.906  12.539  -32.598 0   25.67 ? 966  ILE   A HG12 1 1 
ATOM   4353 H  HG13 . ILE   A 1 276 ? 16.498  11.79   -31.816 0   24.92 ? 966  ILE   A HG13 1 1 
ATOM   4354 H  HG21 . ILE   A 1 276 ? 17.273  12.617  -35.447 0   24.69 ? 966  ILE   A HG21 1 1 
ATOM   4355 H  HG22 . ILE   A 1 276 ? 16.036  13.862  -35.605 0   24.12 ? 966  ILE   A HG22 1 1 
ATOM   4356 H  HG23 . ILE   A 1 276 ? 17.49   14.18   -34.622 0   24.91 ? 966  ILE   A HG23 1 1 
ATOM   4357 H  HD11 . ILE   A 1 276 ? 17.851  10.075  -32.594 0   27.26 ? 966  ILE   A HD11 1 1 
ATOM   4358 H  HD12 . ILE   A 1 276 ? 16.421  10.157  -33.654 0   26.45 ? 966  ILE   A HD12 1 1 
ATOM   4359 H  HD13 . ILE   A 1 276 ? 17.991  10.788  -34.212 0   27.18 ? 966  ILE   A HD13 1 1 
ATOM   4360 N  N    . GLU   A 1 277 ? 13.622  14.968  -34.132 1   16.14 ? 967  GLU   A N    1 1 
ATOM   4361 C  CA   . GLU   A 1 277 ? 13.01   15.983  -34.983 1   15.92 ? 967  GLU   A CA   1 1 
ATOM   4362 C  C    . GLU   A 1 277 ? 12.704  17.266  -34.215 1   15.66 ? 967  GLU   A C    1 1 
ATOM   4363 O  O    . GLU   A 1 277 ? 12.996  18.348  -34.74  1   16.6  ? 967  GLU   A O    1 1 
ATOM   4364 C  CB   . GLU   A 1 277 ? 11.743  15.457  -35.674 1   18.72 ? 967  GLU   A CB   1 1 
ATOM   4365 C  CG   . GLU   A 1 277 ? 11.305  16.388  -36.802 1   24.52 ? 967  GLU   A CG   1 1 
ATOM   4366 C  CD   . GLU   A 1 277 ? 10.241  15.855  -37.743 1   30.57 ? 967  GLU   A CD   1 1 
ATOM   4367 O  OE1  . GLU   A 1 277 ? 9.697   14.755  -37.485 1   30.07 ? 967  GLU   A OE1  1 1 
ATOM   4368 O  OE2  . GLU   A 1 277 ? 9.933   16.56   -38.732 1   31.84 ? 967  GLU   A OE2  1 1 
ATOM   4369 H  H    . GLU   A 1 277 ? 13.056  14.138  -33.985 0   17.06 ? 967  GLU   A H    1 1 
ATOM   4370 H  HA   . GLU   A 1 277 ? 13.745  16.212  -35.755 0   17.29 ? 967  GLU   A HA   1 1 
ATOM   4371 H  HB2  . GLU   A 1 277 ? 11.951  14.475  -36.097 0   19.29 ? 967  GLU   A HB2  1 1 
ATOM   4372 H  HB3  . GLU   A 1 277 ? 10.934  15.394  -34.948 0   18.91 ? 967  GLU   A HB3  1 1 
ATOM   4373 H  HG2  . GLU   A 1 277 ? 10.915  17.307  -36.372 0   24.88 ? 967  GLU   A HG2  1 1 
ATOM   4374 H  HG3  . GLU   A 1 277 ? 12.175  16.626  -37.412 0   25.35 ? 967  GLU   A HG3  1 1 
ATOM   4375 N  N    . PHE   A 1 278 ? 12.099  17.172  -32.993 1   15.16 ? 968  PHE   A N    1 1 
ATOM   4376 C  CA   . PHE   A 1 278 ? 11.831  18.391  -32.238 1   16.01 ? 968  PHE   A CA   1 1 
ATOM   4377 C  C    . PHE   A 1 278 ? 13.122  19.044  -31.751 1   17.67 ? 968  PHE   A C    1 1 
ATOM   4378 O  O    . PHE   A 1 278 ? 13.159  20.274  -31.649 1   18.73 ? 968  PHE   A O    1 1 
ATOM   4379 C  CB   . PHE   A 1 278 ? 10.841  18.187  -31.074 1   15.71 ? 968  PHE   A CB   1 1 
ATOM   4380 C  CG   . PHE   A 1 278 ? 9.386   18.206  -31.51  1   15.6  ? 968  PHE   A CG   1 1 
ATOM   4381 C  CD1  . PHE   A 1 278 ? 8.779   19.388  -31.901 1   16.21 ? 968  PHE   A CD1  1 1 
ATOM   4382 C  CD2  . PHE   A 1 278 ? 8.643   17.041  -31.557 1   16.43 ? 968  PHE   A CD2  1 1 
ATOM   4383 C  CE1  . PHE   A 1 278 ? 7.44    19.411  -32.309 1   16.54 ? 968  PHE   A CE1  1 1 
ATOM   4384 C  CE2  . PHE   A 1 278 ? 7.281   17.076  -31.897 1   16.86 ? 968  PHE   A CE2  1 1 
ATOM   4385 C  CZ   . PHE   A 1 278 ? 6.707   18.252  -32.324 1   16.24 ? 968  PHE   A CZ   1 1 
ATOM   4386 H  H    . PHE   A 1 278 ? 11.805  16.308  -32.548 0   15.65 ? 968  PHE   A H    1 1 
ATOM   4387 H  HA   . PHE   A 1 278 ? 11.397  19.102  -32.941 0   16.61 ? 968  PHE   A HA   1 1 
ATOM   4388 H  HB2  . PHE   A 1 278 ? 11.044  17.24   -30.578 0   15.99 ? 968  PHE   A HB2  1 1 
ATOM   4389 H  HB3  . PHE   A 1 278 ? 10.968  19.007  -30.37  0   16.16 ? 968  PHE   A HB3  1 1 
ATOM   4390 H  HD1  . PHE   A 1 278 ? 9.35    20.301  -31.901 0   16.3  ? 968  PHE   A HD1  1 1 
ATOM   4391 H  HD2  . PHE   A 1 278 ? 9.081   16.113  -31.229 0   16.02 ? 968  PHE   A HD2  1 1 
ATOM   4392 H  HE1  . PHE   A 1 278 ? 6.984   20.341  -32.607 0   16.03 ? 968  PHE   A HE1  1 1 
ATOM   4393 H  HE2  . PHE   A 1 278 ? 6.714   16.161  -31.934 0   15.88 ? 968  PHE   A HE2  1 1 
ATOM   4394 H  HZ   . PHE   A 1 278 ? 5.672   18.272  -32.622 0   15.21 ? 968  PHE   A HZ   1 1 
ATOM   4395 N  N    . SER   A 1 279 ? 14.177  18.258  -31.481 1   17.45 ? 969  SER   A N    1 1 
ATOM   4396 C  CA   . SER   A 1 279 ? 15.46   18.846  -31.069 1   18.71 ? 969  SER   A CA   1 1 
ATOM   4397 C  C    . SER   A 1 279 ? 16.04   19.671  -32.219 1   20.03 ? 969  SER   A C    1 1 
ATOM   4398 O  O    . SER   A 1 279 ? 16.509  20.782  -31.991 1   21.06 ? 969  SER   A O    1 1 
ATOM   4399 C  CB   . SER   A 1 279 ? 16.448  17.77   -30.627 1   19.21 ? 969  SER   A CB   1 1 
ATOM   4400 O  OG   . SER   A 1 279 ? 16.05   17.208  -29.381 1   20.18 ? 969  SER   A OG   1 1 
ATOM   4401 H  H    . SER   A 1 279 ? 14.18   17.244  -31.51  0   18.98 ? 969  SER   A H    1 1 
ATOM   4402 H  HA   . SER   A 1 279 ? 15.291  19.524  -30.233 0   21.06 ? 969  SER   A HA   1 1 
ATOM   4403 H  HB2  . SER   A 1 279 ? 16.5    16.985  -31.381 0   21.87 ? 969  SER   A HB2  1 1 
ATOM   4404 H  HB3  . SER   A 1 279 ? 17.423  18.238  -30.503 0   22.53 ? 969  SER   A HB3  1 1 
ATOM   4405 H  HG   . SER   A 1 279 ? 15.34   16.529  -29.525 0   22.23 ? 969  SER   A HG   1 1 
ATOM   4406 N  N    . LYS   A 1 280 ? 15.952  19.172  -33.445 1   20.24 ? 970  LYS   A N    1 1 
ATOM   4407 C  CA   . LYS   A 1 280 ? 16.378  19.918  -34.629 1   21.11 ? 970  LYS   A CA   1 1 
ATOM   4408 C  C    . LYS   A 1 280 ? 15.61   21.237  -34.752 1   21.89 ? 970  LYS   A C    1 1 
ATOM   4409 O  O    . LYS   A 1 280 ? 16.222  22.285  -34.983 1   22.75 ? 970  LYS   A O    1 1 
ATOM   4410 C  CB   . LYS   A 1 280 ? 16.2    19.064  -35.886 1   22.3  ? 970  LYS   A CB   1 1 
ATOM   4411 C  CG   . LYS   A 1 280 ? 16.466  19.844  -37.207 1   26.01 ? 970  LYS   A CG   1 1 
ATOM   4412 C  CD   . LYS   A 1 280 ? 15.95   19.127  -38.4   1   33.12 ? 970  LYS   A CD   1 1 
ATOM   4413 C  CE   . LYS   A 1 280 ? 14.445  19.225  -38.576 1   36.69 ? 970  LYS   A CE   1 1 
ATOM   4414 N  NZ   . LYS   A 1 280 ? 14.018  18.494  -39.786 1   40.02 ? 970  LYS   A NZ   1 1 
ATOM   4415 H  H    . LYS   A 1 280 ? 15.615  18.239  -33.657 0   22.6  ? 970  LYS   A H    1 1 
ATOM   4416 H  HA   . LYS   A 1 280 ? 17.436  20.156  -34.532 0   24.82 ? 970  LYS   A HA   1 1 
ATOM   4417 H  HB2  . LYS   A 1 280 ? 16.913  18.241  -35.845 0   25.43 ? 970  LYS   A HB2  1 1 
ATOM   4418 H  HB3  . LYS   A 1 280 ? 15.188  18.666  -35.875 0   24.61 ? 970  LYS   A HB3  1 1 
ATOM   4419 H  HG2  . LYS   A 1 280 ? 15.977  20.816  -37.2   0   29.18 ? 970  LYS   A HG2  1 1 
ATOM   4420 H  HG3  . LYS   A 1 280 ? 17.541  19.97   -37.332 0   29.9  ? 970  LYS   A HG3  1 1 
ATOM   4421 H  HD2  . LYS   A 1 280 ? 16.418  19.546  -39.29  0   36.46 ? 970  LYS   A HD2  1 1 
ATOM   4422 H  HD3  . LYS   A 1 280 ? 16.209  18.074  -38.309 0   36.02 ? 970  LYS   A HD3  1 1 
ATOM   4423 H  HE2  . LYS   A 1 280 ? 13.907  18.784  -37.738 0   38.54 ? 970  LYS   A HE2  1 1 
ATOM   4424 H  HE3  . LYS   A 1 280 ? 14.164  20.271  -38.693 0   38.97 ? 970  LYS   A HE3  1 1 
ATOM   4425 H  HZ1  . LYS   A 1 280 ? 13.014  18.349  -39.76  0   41.54 ? 970  LYS   A HZ1  1 1 
ATOM   4426 H  HZ2  . LYS   A 1 280 ? 14.245  19.04   -40.611 0   42.19 ? 970  LYS   A HZ2  1 1 
ATOM   4427 H  HZ3  . LYS   A 1 280 ? 14.483  17.594  -39.848 0   42.27 ? 970  LYS   A HZ3  1 1 
ATOM   4428 N  N    . MET   A 1 281 ? 14.288  21.199  -34.547 1   20.92 ? 971  MET   A N    1 1 
ATOM   4429 C  CA   . MET   A 1 281 ? 13.478  22.405  -34.614 1   20.61 ? 971  MET   A CA   1 1 
ATOM   4430 C  C    . MET   A 1 281 ? 13.831  23.4    -33.521 1   21.67 ? 971  MET   A C    1 1 
ATOM   4431 O  O    . MET   A 1 281 ? 13.844  24.606  -33.785 1   22.53 ? 971  MET   A O    1 1 
ATOM   4432 C  CB   . MET   A 1 281 ? 11.987  22.038  -34.555 1   19.96 ? 971  MET   A CB   1 1 
ATOM   4433 C  CG   . MET   A 1 281 ? 11.54   21.248  -35.769 1   21.53 ? 971  MET   A CG   1 1 
ATOM   4434 S  SD   . MET   A 1 281 ? 9.781   20.838  -35.704 1   22.98 ? 971  MET   A SD   1 1 
ATOM   4435 C  CE   . MET   A 1 281 ? 9.547   20.248  -37.37  1   21.48 ? 971  MET   A CE   1 1 
ATOM   4436 H  H    . MET   A 1 281 ? 13.775  20.355  -34.311 0   22.75 ? 971  MET   A H    1 1 
ATOM   4437 H  HA   . MET   A 1 281 ? 13.663  22.889  -35.572 0   23    ? 971  MET   A HA   1 1 
ATOM   4438 H  HB2  . MET   A 1 281 ? 11.796  21.437  -33.667 0   21.14 ? 971  MET   A HB2  1 1 
ATOM   4439 H  HB3  . MET   A 1 281 ? 11.398  22.954  -34.517 0   21.33 ? 971  MET   A HB3  1 1 
ATOM   4440 H  HG2  . MET   A 1 281 ? 11.719  21.84   -36.665 0   22.89 ? 971  MET   A HG2  1 1 
ATOM   4441 H  HG3  . MET   A 1 281 ? 12.095  20.312  -35.821 0   22.72 ? 971  MET   A HG3  1 1 
ATOM   4442 H  HE1  . MET   A 1 281 ? 8.508   19.948  -37.497 0   21.46 ? 971  MET   A HE1  1 1 
ATOM   4443 H  HE2  . MET   A 1 281 ? 9.79    21.049  -38.067 0   22.07 ? 971  MET   A HE2  1 1 
ATOM   4444 H  HE3  . MET   A 1 281 ? 10.204  19.396  -37.54  0   21.91 ? 971  MET   A HE3  1 1 
ATOM   4445 N  N    . ALA   A 1 282 ? 14.139  22.914  -32.306 1   21.01 ? 972  ALA   A N    1 1 
ATOM   4446 C  CA   . ALA   A 1 282 ? 14.55   23.761  -31.17  1   21.64 ? 972  ALA   A CA   1 1 
ATOM   4447 C  C    . ALA   A 1 282 ? 15.916  24.453  -31.423 1   23.69 ? 972  ALA   A C    1 1 
ATOM   4448 O  O    . ALA   A 1 282 ? 16.244  25.384  -30.692 1   24.53 ? 972  ALA   A O    1 1 
ATOM   4449 C  CB   . ALA   A 1 282 ? 14.647  22.913  -29.904 1   21.37 ? 972  ALA   A CB   1 1 
ATOM   4450 H  H    . ALA   A 1 282 ? 14.097  21.93   -32.062 0   23.26 ? 972  ALA   A H    1 1 
ATOM   4451 H  HA   . ALA   A 1 282 ? 13.8    24.534  -31.007 0   24.39 ? 972  ALA   A HA   1 1 
ATOM   4452 H  HB1  . ALA   A 1 282 ? 14.941  23.548  -29.07  0   24.42 ? 972  ALA   A HB1  1 1 
ATOM   4453 H  HB2  . ALA   A 1 282 ? 13.675  22.466  -29.705 0   23.54 ? 972  ALA   A HB2  1 1 
ATOM   4454 H  HB3  . ALA   A 1 282 ? 15.391  22.133  -30.057 0   24.28 ? 972  ALA   A HB3  1 1 
ATOM   4455 N  N    . ARG   A 1 283 ? 16.713  23.979  -32.399 1   24.49 ? 973  ARG   A N    1 1 
ATOM   4456 C  CA   . ARG   A 1 283 ? 17.988  24.605  -32.765 1   26.16 ? 973  ARG   A CA   1 1 
ATOM   4457 C  C    . ARG   A 1 283 ? 17.762  25.855  -33.661 1   27.71 ? 973  ARG   A C    1 1 
ATOM   4458 O  O    . ARG   A 1 283 ? 18.663  26.673  -33.77  1   28.97 ? 973  ARG   A O    1 1 
ATOM   4459 C  CB   . ARG   A 1 283 ? 18.918  23.596  -33.469 1   26.93 ? 973  ARG   A CB   1 1 
ATOM   4460 C  CG   . ARG   A 1 283 ? 19.517  22.56   -32.503 1   27.39 ? 973  ARG   A CG   1 1 
ATOM   4461 C  CD   . ARG   A 1 283 ? 20.747  21.848  -33.055 1   25.83 ? 973  ARG   A CD   1 1 
ATOM   4462 N  NE   . ARG   A 1 283 ? 20.481  21.045  -34.254 1   25.19 ? 973  ARG   A NE   1 1 
ATOM   4463 C  CZ   . ARG   A 1 283 ? 19.975  19.81   -34.278 1   25.38 ? 973  ARG   A CZ   1 1 
ATOM   4464 N  NH1  . ARG   A 1 283 ? 19.624  19.198  -33.144 1   24.83 ? 973  ARG   A NH1  1 1 
ATOM   4465 N  NH2  . ARG   A 1 283 ? 19.804  19.179  -35.435 1   25.31 ? 973  ARG   A NH2  1 1 
ATOM   4466 H  H    . ARG   A 1 283 ? 16.512  23.15   -32.948 0   28.28 ? 973  ARG   A H    1 1 
ATOM   4467 H  HA   . ARG   A 1 283 ? 18.489  24.954  -31.863 0   31.62 ? 973  ARG   A HA   1 1 
ATOM   4468 H  HB2  . ARG   A 1 283 ? 18.369  23.063  -34.244 0   31.85 ? 973  ARG   A HB2  1 1 
ATOM   4469 H  HB3  . ARG   A 1 283 ? 19.744  24.143  -33.921 0   33.03 ? 973  ARG   A HB3  1 1 
ATOM   4470 H  HG2  . ARG   A 1 283 ? 19.811  23.057  -31.58  0   33.15 ? 973  ARG   A HG2  1 1 
ATOM   4471 H  HG3  . ARG   A 1 283 ? 18.764  21.803  -32.289 0   32.18 ? 973  ARG   A HG3  1 1 
ATOM   4472 H  HD2  . ARG   A 1 283 ? 21.477  22.606  -33.335 0   32.72 ? 973  ARG   A HD2  1 1 
ATOM   4473 H  HD3  . ARG   A 1 283 ? 21.174  21.209  -32.284 0   32.1  ? 973  ARG   A HD3  1 1 
ATOM   4474 H  HE   . ARG   A 1 283 ? 20.741  21.46   -35.143 0   31.3  ? 973  ARG   A HE   1 1 
ATOM   4475 H  HH11 . ARG   A 1 283 ? 19.728  19.626  -32.231 0   29.81 ? 973  ARG   A HH11 1 1 
ATOM   4476 H  HH12 . ARG   A 1 283 ? 19.232  18.263  -33.19  0   29.27 ? 973  ARG   A HH12 1 1 
ATOM   4477 H  HH21 . ARG   A 1 283 ? 20.06   19.631  -36.307 0   30.66 ? 973  ARG   A HH21 1 1 
ATOM   4478 H  HH22 . ARG   A 1 283 ? 19.406  18.246  -35.456 0   29.96 ? 973  ARG   A HH22 1 1 
ATOM   4479 N  N    . ASP   A 1 284 ? 16.593  25.989  -34.33  1   27.53 ? 974  ASP   A N    1 1 
ATOM   4480 C  CA   . ASP   A 1 284 ? 16.245  27.17   -35.157 1   27.28 ? 974  ASP   A CA   1 1 
ATOM   4481 C  C    . ASP   A 1 284 ? 14.74   27.416  -34.908 1   26.61 ? 974  ASP   A C    1 1 
ATOM   4482 O  O    . ASP   A 1 284 ? 13.926  27.196  -35.806 1   26.62 ? 974  ASP   A O    1 1 
ATOM   4483 C  CB   . ASP   A 1 284 ? 16.536  26.887  -36.64  1   29.3  ? 974  ASP   A CB   1 1 
ATOM   4484 C  CG   . ASP   A 1 284 ? 16.43   28.101  -37.561 1   34.06 ? 974  ASP   A CG   1 1 
ATOM   4485 O  OD1  . ASP   A 1 284 ? 16.145  29.219  -37.052 1   35.1  ? 974  ASP   A OD1  1 1 
ATOM   4486 O  OD2  . ASP   A 1 284 ? 16.621  27.931  -38.781 1   35.17 ? 974  ASP   A OD2  1 1 
ATOM   4487 H  H    . ASP   A 1 284 ? 15.87   25.277  -34.352 0   31.63 ? 974  ASP   A H    1 1 
ATOM   4488 H  HA   . ASP   A 1 284 ? 16.819  28.044  -34.854 0   32.93 ? 974  ASP   A HA   1 1 
ATOM   4489 H  HB2  . ASP   A 1 284 ? 17.559  26.522  -36.715 0   34.89 ? 974  ASP   A HB2  1 1 
ATOM   4490 H  HB3  . ASP   A 1 284 ? 15.859  26.119  -37.01  0   33.8  ? 974  ASP   A HB3  1 1 
ATOM   4491 N  N    . PRO   A 1 285 ? 14.357  27.793  -33.666 1   25.81 ? 975  PRO   A N    1 1 
ATOM   4492 C  CA   . PRO   A 1 285 ? 12.931  27.813  -33.302 1   25.38 ? 975  PRO   A CA   1 1 
ATOM   4493 C  C    . PRO   A 1 285 ? 12.009  28.722  -34.107 1   25.12 ? 975  PRO   A C    1 1 
ATOM   4494 O  O    . PRO   A 1 285 ? 10.874  28.329  -34.409 1   23.66 ? 975  PRO   A O    1 1 
ATOM   4495 C  CB   . PRO   A 1 285 ? 12.957  28.217  -31.824 1   26.45 ? 975  PRO   A CB   1 1 
ATOM   4496 C  CG   . PRO   A 1 285 ? 14.279  28.891  -31.632 1   27.11 ? 975  PRO   A CG   1 1 
ATOM   4497 C  CD   . PRO   A 1 285 ? 15.196  28.105  -32.492 1   25.37 ? 975  PRO   A CD   1 1 
ATOM   4498 H  HA   . PRO   A 1 285 ? 12.537  26.801  -33.367 0   28.29 ? 975  PRO   A HA   1 1 
ATOM   4499 H  HB2  . PRO   A 1 285 ? 12.136  28.899  -31.609 0   29.92 ? 975  PRO   A HB2  1 1 
ATOM   4500 H  HB3  . PRO   A 1 285 ? 12.903  27.33   -31.194 0   29.67 ? 975  PRO   A HB3  1 1 
ATOM   4501 H  HG2  . PRO   A 1 285 ? 14.221  29.925  -31.969 0   32.01 ? 975  PRO   A HG2  1 1 
ATOM   4502 H  HG3  . PRO   A 1 285 ? 14.579  28.834  -30.587 0   31.74 ? 975  PRO   A HG3  1 1 
ATOM   4503 H  HD2  . PRO   A 1 285 ? 16.049  28.728  -32.757 0   30.76 ? 975  PRO   A HD2  1 1 
ATOM   4504 H  HD3  . PRO   A 1 285 ? 15.505  27.19   -31.988 0   29.88 ? 975  PRO   A HD3  1 1 
ATOM   4505 N  N    . GLN   A 1 286 ? 12.489  29.91   -34.475 1   25.47 ? 976  GLN   A N    1 1 
ATOM   4506 C  CA   . GLN   A 1 286 ? 11.688  30.875  -35.239 1   26.5  ? 976  GLN   A CA   1 1 
ATOM   4507 C  C    . GLN   A 1 286 ? 11.435  30.441  -36.692 1   26.7  ? 976  GLN   A C    1 1 
ATOM   4508 O  O    . GLN   A 1 286 ? 10.522  30.962  -37.325 1   28.08 ? 976  GLN   A O    1 1 
ATOM   4509 C  CB   . GLN   A 1 286 ? 12.319  32.28   -35.155 1   29.08 ? 976  GLN   A CB   1 1 
ATOM   4510 C  CG   . GLN   A 1 286 ? 12.387  32.802  -33.71  1   34.07 ? 976  GLN   A CG   1 1 
ATOM   4511 C  CD   . GLN   A 1 286 ? 12.886  34.228  -33.661 1   43.21 ? 976  GLN   A CD   1 1 
ATOM   4512 O  OE1  . GLN   A 1 286 ? 12.328  35.12   -34.305 1   46    ? 976  GLN   A OE1  1 1 
ATOM   4513 N  NE2  . GLN   A 1 286 ? 13.924  34.49   -32.884 1   45.36 ? 976  GLN   A NE2  1 1 
ATOM   4514 H  H    . GLN   A 1 286 ? 13.438  30.216  -34.288 0   30.16 ? 976  GLN   A H    1 1 
ATOM   4515 H  HA   . GLN   A 1 286 ? 10.71   30.95   -34.765 0   30.3  ? 976  GLN   A HA   1 1 
ATOM   4516 H  HB2  . GLN   A 1 286 ? 13.333  32.241  -35.551 0   34.7  ? 976  GLN   A HB2  1 1 
ATOM   4517 H  HB3  . GLN   A 1 286 ? 11.716  32.972  -35.741 0   34.33 ? 976  GLN   A HB3  1 1 
ATOM   4518 H  HG2  . GLN   A 1 286 ? 11.388  32.779  -33.279 0   38.96 ? 976  GLN   A HG2  1 1 
ATOM   4519 H  HG3  . GLN   A 1 286 ? 13.058  32.171  -33.129 0   39.4  ? 976  GLN   A HG3  1 1 
ATOM   4520 H  HE21 . GLN   A 1 286 ? 14.361  33.762  -32.328 0   52.07 ? 976  GLN   A HE21 1 1 
ATOM   4521 H  HE22 . GLN   A 1 286 ? 14.281  35.438  -32.831 0   52.99 ? 976  GLN   A HE22 1 1 
ATOM   4522 N  N    . ARG   A 1 287 ? 12.194  29.47   -37.214 1   25.2  ? 977  ARG   A N    1 1 
ATOM   4523 C  CA   . ARG   A 1 287 ? 11.926  28.907  -38.526 1   24.25 ? 977  ARG   A CA   1 1 
ATOM   4524 C  C    . ARG   A 1 287 ? 10.635  28.014  -38.486 1   22.38 ? 977  ARG   A C    1 1 
ATOM   4525 O  O    . ARG   A 1 287 ? 9.917   27.93   -39.479 1   21.8  ? 977  ARG   A O    1 1 
ATOM   4526 C  CB   . ARG   A 1 287 ? 13.133  28.057  -38.994 1   25.72 ? 977  ARG   A CB   1 1 
ATOM   4527 C  CG   . ARG   A 1 287 ? 12.887  27.381  -40.339 1   29.9  ? 977  ARG   A CG   1 1 
ATOM   4528 C  CD   . ARG   A 1 287 ? 14.042  26.55   -40.847 1   34.51 ? 977  ARG   A CD   1 1 
ATOM   4529 N  NE   . ARG   A 1 287 ? 13.577  25.617  -41.879 1   38.66 ? 977  ARG   A NE   1 1 
ATOM   4530 C  CZ   . ARG   A 1 287 ? 14.357  24.872  -42.663 1   42.21 ? 977  ARG   A CZ   1 1 
ATOM   4531 N  NH1  . ARG   A 1 287 ? 15.682  24.944  -42.56  1   42.34 ? 977  ARG   A NH1  1 1 
ATOM   4532 N  NH2  . ARG   A 1 287 ? 13.817  24.053  -43.561 1   42.31 ? 977  ARG   A NH2  1 1 
ATOM   4533 H  H    . ARG   A 1 287 ? 13.013  29.069  -36.77  0   29.33 ? 977  ARG   A H    1 1 
ATOM   4534 H  HA   . ARG   A 1 287 ? 11.775  29.706  -39.251 0   28.27 ? 977  ARG   A HA   1 1 
ATOM   4535 H  HB2  . ARG   A 1 287 ? 14.005  28.701  -39.095 0   30.36 ? 977  ARG   A HB2  1 1 
ATOM   4536 H  HB3  . ARG   A 1 287 ? 13.326  27.276  -38.26  0   29.44 ? 977  ARG   A HB3  1 1 
ATOM   4537 H  HG2  . ARG   A 1 287 ? 12.035  26.709  -40.247 0   33    ? 977  ARG   A HG2  1 1 
ATOM   4538 H  HG3  . ARG   A 1 287 ? 12.674  28.146  -41.084 0   33.88 ? 977  ARG   A HG3  1 1 
ATOM   4539 H  HD2  . ARG   A 1 287 ? 14.794  27.207  -41.282 0   39.2  ? 977  ARG   A HD2  1 1 
ATOM   4540 H  HD3  . ARG   A 1 287 ? 14.465  25.974  -40.026 0   38.48 ? 977  ARG   A HD3  1 1 
ATOM   4541 H  HE   . ARG   A 1 287 ? 12.575  25.52   -42.008 0   41.79 ? 977  ARG   A HE   1 1 
ATOM   4542 H  HH11 . ARG   A 1 287 ? 16.148  25.547  -41.89  0   47.24 ? 977  ARG   A HH11 1 1 
ATOM   4543 H  HH12 . ARG   A 1 287 ? 16.258  24.369  -43.166 0   47.12 ? 977  ARG   A HH12 1 1 
ATOM   4544 H  HH21 . ARG   A 1 287 ? 12.808  23.99   -43.657 0   45.29 ? 977  ARG   A HH21 1 1 
ATOM   4545 H  HH22 . ARG   A 1 287 ? 14.409  23.489  -44.163 0   45.99 ? 977  ARG   A HH22 1 1 
ATOM   4546 N  N    . TYR   A 1 288 ? 10.391  27.31   -37.361 1   21.21 ? 978  TYR   A N    1 1 
ATOM   4547 C  CA   . TYR   A 1 288 ? 9.301   26.329  -37.271 1   20.53 ? 978  TYR   A CA   1 1 
ATOM   4548 C  C    . TYR   A 1 288 ? 7.996   26.83   -36.608 1   19.27 ? 978  TYR   A C    1 1 
ATOM   4549 O  O    . TYR   A 1 288 ? 6.944   26.244  -36.859 1   18.66 ? 978  TYR   A O    1 1 
ATOM   4550 C  CB   . TYR   A 1 288 ? 9.847   25.073  -36.559 1   20.48 ? 978  TYR   A CB   1 1 
ATOM   4551 C  CG   . TYR   A 1 288 ? 10.94   24.417  -37.383 1   22.04 ? 978  TYR   A CG   1 1 
ATOM   4552 C  CD1  . TYR   A 1 288 ? 10.628  23.635  -38.49  1   23.07 ? 978  TYR   A CD1  1 1 
ATOM   4553 C  CD2  . TYR   A 1 288 ? 12.28   24.677  -37.131 1   23.13 ? 978  TYR   A CD2  1 1 
ATOM   4554 C  CE1  . TYR   A 1 288 ? 11.621  23.09   -39.295 1   24.49 ? 978  TYR   A CE1  1 1 
ATOM   4555 C  CE2  . TYR   A 1 288 ? 13.283  24.172  -37.953 1   24.12 ? 978  TYR   A CE2  1 1 
ATOM   4556 C  CZ   . TYR   A 1 288 ? 12.951  23.355  -39.017 1   25.6  ? 978  TYR   A CZ   1 1 
ATOM   4557 O  OH   . TYR   A 1 288 ? 13.94   22.817  -39.805 1   27.66 ? 978  TYR   A OH   1 1 
ATOM   4558 H  H    . TYR   A 1 288 ? 10.926  27.387  -36.502 0   23.81 ? 978  TYR   A H    1 1 
ATOM   4559 H  HA   . TYR   A 1 288 ? 9.01    26.029  -38.276 0   22.12 ? 978  TYR   A HA   1 1 
ATOM   4560 H  HB2  . TYR   A 1 288 ? 10.262  25.348  -35.591 0   22.11 ? 978  TYR   A HB2  1 1 
ATOM   4561 H  HB3  . TYR   A 1 288 ? 9.042   24.352  -36.425 0   21.47 ? 978  TYR   A HB3  1 1 
ATOM   4562 H  HD1  . TYR   A 1 288 ? 9.595   23.43   -38.717 0   24.15 ? 978  TYR   A HD1  1 1 
ATOM   4563 H  HD2  . TYR   A 1 288 ? 12.547  25.322  -36.311 0   25.69 ? 978  TYR   A HD2  1 1 
ATOM   4564 H  HE1  . TYR   A 1 288 ? 11.352  22.466  -40.13  0   26.09 ? 978  TYR   A HE1  1 1 
ATOM   4565 H  HE2  . TYR   A 1 288 ? 14.318  24.36   -37.719 0   27.34 ? 978  TYR   A HE2  1 1 
ATOM   4566 H  HH   . TYR   A 1 288 ? 13.628  21.975  -40.23  0   30.14 ? 978  TYR   A HH   1 1 
ATOM   4567 N  N    . LEU   A 1 289 ? 8.052   27.855  -35.754 1   18.48 ? 979  LEU   A N    1 1 
ATOM   4568 C  CA   . LEU   A 1 289 ? 6.847   28.421  -35.148 1   19.09 ? 979  LEU   A CA   1 1 
ATOM   4569 C  C    . LEU   A 1 289 ? 6.897   29.932  -35.36  1   21.24 ? 979  LEU   A C    1 1 
ATOM   4570 O  O    . LEU   A 1 289 ? 7.932   30.55   -35.11  1   23.2  ? 979  LEU   A O    1 1 
ATOM   4571 C  CB   . LEU   A 1 289 ? 6.731   28.094  -33.641 1   18.65 ? 979  LEU   A CB   1 1 
ATOM   4572 C  CG   . LEU   A 1 289 ? 6.714   26.596  -33.271 1   19.99 ? 979  LEU   A CG   1 1 
ATOM   4573 C  CD1  . LEU   A 1 289 ? 6.758   26.417  -31.752 1   20.55 ? 979  LEU   A CD1  1 1 
ATOM   4574 C  CD2  . LEU   A 1 289 ? 5.449   25.88   -33.841 1   19.54 ? 979  LEU   A CD2  1 1 
ATOM   4575 H  H    . LEU   A 1 289 ? 8.905   28.309  -35.446 0   20.63 ? 979  LEU   A H    1 1 
ATOM   4576 H  HA   . LEU   A 1 289 ? 5.955   28.061  -35.658 0   20.33 ? 979  LEU   A HA   1 1 
ATOM   4577 H  HB2  . LEU   A 1 289 ? 7.586   28.536  -33.133 0   20.41 ? 979  LEU   A HB2  1 1 
ATOM   4578 H  HB3  . LEU   A 1 289 ? 5.812   28.537  -33.26  0   19.98 ? 979  LEU   A HB3  1 1 
ATOM   4579 H  HG   . LEU   A 1 289 ? 7.593   26.111  -33.692 0   20.96 ? 979  LEU   A HG   1 1 
ATOM   4580 H  HD11 . LEU   A 1 289 ? 6.764   25.354  -31.517 0   21.05 ? 979  LEU   A HD11 1 1 
ATOM   4581 H  HD12 . LEU   A 1 289 ? 7.662   26.887  -31.368 0   21.74 ? 979  LEU   A HD12 1 1 
ATOM   4582 H  HD13 . LEU   A 1 289 ? 5.88    26.89   -31.315 0   21.32 ? 979  LEU   A HD13 1 1 
ATOM   4583 H  HD21 . LEU   A 1 289 ? 5.36    24.903  -33.367 0   19.64 ? 979  LEU   A HD21 1 1 
ATOM   4584 H  HD22 . LEU   A 1 289 ? 4.57    26.482  -33.617 0   19.9  ? 979  LEU   A HD22 1 1 
ATOM   4585 H  HD23 . LEU   A 1 289 ? 5.551   25.755  -34.917 0   19.99 ? 979  LEU   A HD23 1 1 
ATOM   4586 N  N    . VAL   A 1 290 ? 5.798   30.513  -35.807 1   21.42 ? 980  VAL   A N    1 1 
ATOM   4587 C  CA   . VAL   A 1 290 ? 5.723   31.943  -36.102 1   23.4  ? 980  VAL   A CA   1 1 
ATOM   4588 C  C    . VAL   A 1 290 ? 4.855   32.59   -35.051 1   23.68 ? 980  VAL   A C    1 1 
ATOM   4589 O  O    . VAL   A 1 290 ? 3.636   32.385  -35.057 1   23.8  ? 980  VAL   A O    1 1 
ATOM   4590 C  CB   . VAL   A 1 290 ? 5.188   32.16   -37.528 1   25.27 ? 980  VAL   A CB   1 1 
ATOM   4591 C  CG1  . VAL   A 1 290 ? 5.083   33.657  -37.848 1   26.91 ? 980  VAL   A CG1  1 1 
ATOM   4592 C  CG2  . VAL   A 1 290 ? 6.089   31.436  -38.543 1   26.11 ? 980  VAL   A CG2  1 1 
ATOM   4593 H  H    . VAL   A 1 290 ? 4.923   30.029  -35.978 0   23.21 ? 980  VAL   A H    1 1 
ATOM   4594 H  HA   . VAL   A 1 290 ? 6.71    32.399  -36.068 0   26.62 ? 980  VAL   A HA   1 1 
ATOM   4595 H  HB   . VAL   A 1 290 ? 4.19    31.731  -37.602 0   27.73 ? 980  VAL   A HB   1 1 
ATOM   4596 H  HG11 . VAL   A 1 290 ? 4.885   33.781  -38.912 0   30.51 ? 980  VAL   A HG11 1 1 
ATOM   4597 H  HG12 . VAL   A 1 290 ? 4.261   34.096  -37.285 0   30.51 ? 980  VAL   A HG12 1 1 
ATOM   4598 H  HG13 . VAL   A 1 290 ? 6.022   34.143  -37.586 0   30.91 ? 980  VAL   A HG13 1 1 
ATOM   4599 H  HG21 . VAL   A 1 290 ? 5.855   31.785  -39.548 0   28.96 ? 980  VAL   A HG21 1 1 
ATOM   4600 H  HG22 . VAL   A 1 290 ? 7.131   31.65   -38.308 0   29.33 ? 980  VAL   A HG22 1 1 
ATOM   4601 H  HG23 . VAL   A 1 290 ? 5.909   30.364  -38.486 0   28.43 ? 980  VAL   A HG23 1 1 
ATOM   4602 N  N    . ILE   A 1 291 ? 5.493   33.307  -34.118 1   24.38 ? 981  ILE   A N    1 1 
ATOM   4603 C  CA   . ILE   A 1 291 ? 4.846   33.944  -32.97  1   26.19 ? 981  ILE   A CA   1 1 
ATOM   4604 C  C    . ILE   A 1 291 ? 5.174   35.447  -32.966 1   28.96 ? 981  ILE   A C    1 1 
ATOM   4605 O  O    . ILE   A 1 291 ? 6.35    35.82   -32.918 1   28.97 ? 981  ILE   A O    1 1 
ATOM   4606 C  CB   . ILE   A 1 291 ? 5.313   33.256  -31.65  1   25.96 ? 981  ILE   A CB   1 1 
ATOM   4607 C  CG1  . ILE   A 1 291 ? 4.774   31.803  -31.567 1   25.94 ? 981  ILE   A CG1  1 1 
ATOM   4608 C  CG2  . ILE   A 1 291 ? 4.835   34.064  -30.422 1   26.66 ? 981  ILE   A CG2  1 1 
ATOM   4609 C  CD1  . ILE   A 1 291 ? 5.524   30.906  -30.59  1   26.82 ? 981  ILE   A CD1  1 1 
ATOM   4610 H  H    . ILE   A 1 291 ? 6.495   33.472  -34.123 0   27.97 ? 981  ILE   A H    1 1 
ATOM   4611 H  HA   . ILE   A 1 291 ? 3.766   33.829  -33.034 0   29.35 ? 981  ILE   A HA   1 1 
ATOM   4612 H  HB   . ILE   A 1 291 ? 6.401   33.227  -31.639 0   29.37 ? 981  ILE   A HB   1 1 
ATOM   4613 H  HG12 . ILE   A 1 291 ? 3.738   31.842  -31.233 0   28.17 ? 981  ILE   A HG12 1 1 
ATOM   4614 H  HG13 . ILE   A 1 291 ? 4.824   31.332  -32.547 0   28.16 ? 981  ILE   A HG13 1 1 
ATOM   4615 H  HG21 . ILE   A 1 291 ? 4.98    33.489  -29.509 0   29.97 ? 981  ILE   A HG21 1 1 
ATOM   4616 H  HG22 . ILE   A 1 291 ? 5.406   34.988  -30.339 0   30.73 ? 981  ILE   A HG22 1 1 
ATOM   4617 H  HG23 . ILE   A 1 291 ? 3.777   34.293  -30.545 0   29.96 ? 981  ILE   A HG23 1 1 
ATOM   4618 H  HD11 . ILE   A 1 291 ? 5.26    29.868  -30.79  0   28.48 ? 981  ILE   A HD11 1 1 
ATOM   4619 H  HD12 . ILE   A 1 291 ? 6.594   31.048  -30.727 0   29.19 ? 981  ILE   A HD12 1 1 
ATOM   4620 H  HD13 . ILE   A 1 291 ? 5.241   31.163  -29.571 0   29.15 ? 981  ILE   A HD13 1 1 
ATOM   4621 N  N    . GLN   A 1 292 ? 4.14    36.3    -33.004 1   30.97 ? 982  GLN   A N    1 1 
ATOM   4622 C  CA   . GLN   A 1 292 ? 4.321   37.76   -33.005 1   33.71 ? 982  GLN   A CA   1 1 
ATOM   4623 C  C    . GLN   A 1 292 ? 4.993   38.206  -31.694 1   33.97 ? 982  GLN   A C    1 1 
ATOM   4624 O  O    . GLN   A 1 292 ? 4.562   37.799  -30.608 1   33.89 ? 982  GLN   A O    1 1 
ATOM   4625 C  CB   . GLN   A 1 292 ? 2.949   38.454  -33.201 1   38.14 ? 982  GLN   A CB   1 1 
ATOM   4626 C  CG   . GLN   A 1 292 ? 2.946   39.997  -33.134 1   45.95 ? 982  GLN   A CG   1 1 
ATOM   4627 C  CD   . GLN   A 1 292 ? 3.764   40.657  -34.224 1   55.36 ? 982  GLN   A CD   1 1 
ATOM   4628 O  OE1  . GLN   A 1 292 ? 3.308   40.818  -35.366 1   59    ? 982  GLN   A OE1  1 1 
ATOM   4629 N  NE2  . GLN   A 1 292 ? 4.997   41.063  -33.904 1   56.98 ? 982  GLN   A NE2  1 1 
ATOM   4630 H  H    . GLN   A 1 292 ? 3.166   36.016  -33.037 0   35.16 ? 982  GLN   A H    1 1 
ATOM   4631 H  HA   . GLN   A 1 292 ? 4.962   38.029  -33.842 0   39.42 ? 982  GLN   A HA   1 1 
ATOM   4632 H  HB2  . GLN   A 1 292 ? 2.558   38.17   -34.177 0   43.47 ? 982  GLN   A HB2  1 1 
ATOM   4633 H  HB3  . GLN   A 1 292 ? 2.272   38.102  -32.424 0   43.36 ? 982  GLN   A HB3  1 1 
ATOM   4634 H  HG2  . GLN   A 1 292 ? 1.919   40.334  -33.261 0   52.54 ? 982  GLN   A HG2  1 1 
ATOM   4635 H  HG3  . GLN   A 1 292 ? 3.31    40.333  -32.164 0   52.72 ? 982  GLN   A HG3  1 1 
ATOM   4636 H  HE21 . GLN   A 1 292 ? 5.364   40.922  -32.968 0   64.61 ? 982  GLN   A HE21 1 1 
ATOM   4637 H  HE22 . GLN   A 1 292 ? 5.576   41.51   -34.608 0   65.11 ? 982  GLN   A HE22 1 1 
ATOM   4638 N  N    . GLY   A 1 293 ? 6.084   38.96   -31.814 1   34.15 ? 983  GLY   A N    1 1 
ATOM   4639 C  CA   . GLY   A 1 293 ? 6.846   39.454  -30.67  1   35.19 ? 983  GLY   A CA   1 1 
ATOM   4640 C  C    . GLY   A 1 293 ? 7.625   38.376  -29.939 1   36.19 ? 983  GLY   A C    1 1 
ATOM   4641 O  O    . GLY   A 1 293 ? 7.933   38.533  -28.755 1   36.49 ? 983  GLY   A O    1 1 
ATOM   4642 H  H    . GLY   A 1 293 ? 6.476   39.256  -32.702 0   40.97 ? 983  GLY   A H    1 1 
ATOM   4643 H  HA2  . GLY   A 1 293 ? 7.552   40.209  -31.012 0   42.94 ? 983  GLY   A HA2  1 1 
ATOM   4644 H  HA3  . GLY   A 1 293 ? 6.164   39.92   -29.961 0   42.35 ? 983  GLY   A HA3  1 1 
ATOM   4645 N  N    . ASP   A 1 294 ? 7.972   37.279  -30.649 1   36.23 ? 984  ASP   A N    1 1 
ATOM   4646 C  CA   . ASP   A 1 294 ? 8.687   36.126  -30.08  1   36.07 ? 984  ASP   A CA   1 1 
ATOM   4647 C  C    . ASP   A 1 294 ? 10.014  36.521  -29.386 1   37.55 ? 984  ASP   A C    1 1 
ATOM   4648 O  O    . ASP   A 1 294 ? 10.231  36.134  -28.236 1   37.14 ? 984  ASP   A O    1 1 
ATOM   4649 C  CB   . ASP   A 1 294 ? 8.953   35.083  -31.192 1   35.53 ? 984  ASP   A CB   1 1 
ATOM   4650 C  CG   . ASP   A 1 294 ? 9.341   33.698  -30.714 1   37.4  ? 984  ASP   A CG   1 1 
ATOM   4651 O  OD1  . ASP   A 1 294 ? 9.519   33.518  -29.505 1   36.76 ? 984  ASP   A OD1  1 1 
ATOM   4652 O  OD2  . ASP   A 1 294 ? 9.476   32.797  -31.561 1   39    ? 984  ASP   A OD2  1 1 
ATOM   4653 H  H    . ASP   A 1 294 ? 7.793   37.186  -31.643 0   42.14 ? 984  ASP   A H    1 1 
ATOM   4654 H  HA   . ASP   A 1 294 ? 8.044   35.667  -29.33  0   41.24 ? 984  ASP   A HA   1 1 
ATOM   4655 H  HB2  . ASP   A 1 294 ? 8.047   34.962  -31.785 0   40.32 ? 984  ASP   A HB2  1 1 
ATOM   4656 H  HB3  . ASP   A 1 294 ? 9.759   35.449  -31.827 0   41.15 ? 984  ASP   A HB3  1 1 
ATOM   4657 N  N    . GLU   A 1 295 ? 10.896  37.278  -30.068 1   39.08 ? 985  GLU   A N    1 1 
ATOM   4658 C  CA   . GLU   A 1 295 ? 12.196  37.648  -29.464 1   41.5  ? 985  GLU   A CA   1 1 
ATOM   4659 C  C    . GLU   A 1 295 ? 12.084  38.557  -28.204 1   42.58 ? 985  GLU   A C    1 1 
ATOM   4660 O  O    . GLU   A 1 295 ? 13.028  38.556  -27.408 1   43.23 ? 985  GLU   A O    1 1 
ATOM   4661 C  CB   . GLU   A 1 295 ? 13.232  38.224  -30.473 1   45.46 ? 985  GLU   A CB   1 1 
ATOM   4662 C  CG   . GLU   A 1 295 ? 12.815  39.336  -31.42  1   53.97 ? 985  GLU   A CG   1 1 
ATOM   4663 C  CD   . GLU   A 1 295 ? 13.322  39.098  -32.835 1   66.35 ? 985  GLU   A CD   1 1 
ATOM   4664 O  OE1  . GLU   A 1 295 ? 14.56   38.998  -33.011 1   69.36 ? 985  GLU   A OE1  1 1 
ATOM   4665 O  OE2  . GLU   A 1 295 ? 12.489  39      -33.767 1   69.51 ? 985  GLU   A OE2  1 1 
ATOM   4666 H  H    . GLU   A 1 295 ? 10.732  37.6    -31.016 0   46.36 ? 985  GLU   A H    1 1 
ATOM   4667 H  HA   . GLU   A 1 295 ? 12.644  36.721  -29.11  0   49.04 ? 985  GLU   A HA   1 1 
ATOM   4668 H  HB2  . GLU   A 1 295 ? 14.075  38.605  -29.899 0   54.93 ? 985  GLU   A HB2  1 1 
ATOM   4669 H  HB3  . GLU   A 1 295 ? 13.574  37.398  -31.094 0   53.92 ? 985  GLU   A HB3  1 1 
ATOM   4670 H  HG2  . GLU   A 1 295 ? 11.731  39.429  -31.456 0   62.81 ? 985  GLU   A HG2  1 1 
ATOM   4671 H  HG3  . GLU   A 1 295 ? 13.248  40.272  -31.069 0   64.11 ? 985  GLU   A HG3  1 1 
ATOM   4672 N  N    A ARG   A 1 296 ? 10.934  39.252  -28.025 0.5 42.83 ? 986  ARG   A N    1 1 
ATOM   4673 N  N    B ARG   A 1 296 ? 10.972  39.278  -27.979 0.5 42.78 ? 986  ARG   A N    1 1 
ATOM   4674 C  CA   A ARG   A 1 296 ? 10.647  40.116  -26.875 0.5 43.72 ? 986  ARG   A CA   1 1 
ATOM   4675 C  CA   B ARG   A 1 296 ? 10.835  40.09   -26.754 0.5 43.66 ? 986  ARG   A CA   1 1 
ATOM   4676 C  C    A ARG   A 1 296 ? 9.961   39.376  -25.703 0.5 43.9  ? 986  ARG   A C    1 1 
ATOM   4677 C  C    B ARG   A 1 296 ? 10.246  39.285  -25.569 0.5 43.83 ? 986  ARG   A C    1 1 
ATOM   4678 O  O    A ARG   A 1 296 ? 9.627   40.023  -24.709 0.5 44.41 ? 986  ARG   A O    1 1 
ATOM   4679 O  O    B ARG   A 1 296 ? 10.26   39.785  -24.443 0.5 44.23 ? 986  ARG   A O    1 1 
ATOM   4680 C  CB   A ARG   A 1 296 ? 9.744   41.296  -27.312 0.5 45.83 ? 986  ARG   A CB   1 1 
ATOM   4681 C  CB   B ARG   A 1 296 ? 9.969   41.337  -27.007 0.5 45.77 ? 986  ARG   A CB   1 1 
ATOM   4682 C  CG   A ARG   A 1 296 ? 10.352  42.287  -28.328 0.5 49.81 ? 986  ARG   A CG   1 1 
ATOM   4683 C  CG   B ARG   A 1 296 ? 10.539  42.324  -28.023 0.5 50.04 ? 986  ARG   A CG   1 1 
ATOM   4684 C  CD   A ARG   A 1 296 ? 11.682  42.927  -27.918 0.5 53.45 ? 986  ARG   A CD   1 1 
ATOM   4685 C  CD   B ARG   A 1 296 ? 11.61   43.251  -27.459 0.5 53.98 ? 986  ARG   A CD   1 1 
ATOM   4686 N  NE   A ARG   A 1 296 ? 11.7    43.343  -26.506 0.5 56.21 ? 986  ARG   A NE   1 1 
ATOM   4687 N  NE   B ARG   A 1 296 ? 12.147  44.125  -28.505 0.5 57.21 ? 986  ARG   A NE   1 1 
ATOM   4688 C  CZ   A ARG   A 1 296 ? 12.763  43.357  -25.699 0.5 58.31 ? 986  ARG   A CZ   1 1 
ATOM   4689 C  CZ   B ARG   A 1 296 ? 11.597  45.262  -28.934 0.5 60.02 ? 986  ARG   A CZ   1 1 
ATOM   4690 N  NH1  A ARG   A 1 296 ? 12.638  43.741  -24.433 0.5 57.65 ? 986  ARG   A NH1  1 1 
ATOM   4691 N  NH1  B ARG   A 1 296 ? 12.169  45.955  -29.912 0.5 59.64 ? 986  ARG   A NH1  1 1 
ATOM   4692 N  NH2  A ARG   A 1 296 ? 13.962  42.987  -26.148 0.5 58.31 ? 986  ARG   A NH2  1 1 
ATOM   4693 N  NH2  B ARG   A 1 296 ? 10.468  45.714  -28.392 0.5 60.32 ? 986  ARG   A NH2  1 1 
ATOM   4694 H  H    A ARG   A 1 296 ? 10.165  39.238  -28.686 0   50.88 ? 986  ARG   A H    1 1 
ATOM   4695 H  H    B ARG   A 1 296 ? 10.169  39.328  -28.598 0   50.89 ? 986  ARG   A H    1 1 
ATOM   4696 H  HA   A ARG   A 1 296 ? 11.581  40.512  -26.481 0   53.29 ? 986  ARG   A HA   1 1 
ATOM   4697 H  HA   B ARG   A 1 296 ? 11.816  40.443  -26.44  0   53.28 ? 986  ARG   A HA   1 1 
ATOM   4698 H  HB2  A ARG   A 1 296 ? 8.839   40.89   -27.761 0   54.49 ? 986  ARG   A HB2  1 1 
ATOM   4699 H  HB2  B ARG   A 1 296 ? 8.995   41.015  -27.371 0   54.61 ? 986  ARG   A HB2  1 1 
ATOM   4700 H  HB3  A ARG   A 1 296 ? 9.466   41.876  -26.433 0   55.46 ? 986  ARG   A HB3  1 1 
ATOM   4701 H  HB3  B ARG   A 1 296 ? 9.847   41.874  -26.067 0   55.57 ? 986  ARG   A HB3  1 1 
ATOM   4702 H  HG2  A ARG   A 1 296 ? 10.522  41.755  -29.263 0   59.71 ? 986  ARG   A HG2  1 1 
ATOM   4703 H  HG2  B ARG   A 1 296 ? 10.977  41.781  -28.86  0   60.17 ? 986  ARG   A HG2  1 1 
ATOM   4704 H  HG3  A ARG   A 1 296 ? 9.639   43.094  -28.492 0   60.33 ? 986  ARG   A HG3  1 1 
ATOM   4705 H  HG3  B ARG   A 1 296 ? 9.725   42.951  -28.385 0   60.53 ? 986  ARG   A HG3  1 1 
ATOM   4706 H  HD2  A ARG   A 1 296 ? 12.451  42.185  -28.12  0   64.61 ? 986  ARG   A HD2  1 1 
ATOM   4707 H  HD2  B ARG   A 1 296 ? 11.208  43.839  -26.636 0   65.82 ? 986  ARG   A HD2  1 1 
ATOM   4708 H  HD3  A ARG   A 1 296 ? 11.851  43.812  -28.53  0   65.49 ? 986  ARG   A HD3  1 1 
ATOM   4709 H  HD3  B ARG   A 1 296 ? 12.442  42.649  -27.097 0   65.46 ? 986  ARG   A HD3  1 1 
ATOM   4710 H  HE   A ARG   A 1 296 ? 10.821  43.659  -26.109 0   67.78 ? 986  ARG   A HE   1 1 
ATOM   4711 H  HE   B ARG   A 1 296 ? 13.003  43.818  -28.957 0   69.89 ? 986  ARG   A HE   1 1 
ATOM   4712 H  HH11 A ARG   A 1 296 ? 11.738  44.043  -24.075 0   70.04 ? 986  ARG   A HH11 1 1 
ATOM   4713 H  HH11 B ARG   A 1 296 ? 13.032  45.627  -30.333 0   73.77 ? 986  ARG   A HH11 1 1 
ATOM   4714 H  HH12 A ARG   A 1 296 ? 13.448  43.762  -23.822 0   70.65 ? 986  ARG   A HH12 1 1 
ATOM   4715 H  HH12 B ARG   A 1 296 ? 11.755  46.823  -30.235 0   74.15 ? 986  ARG   A HH12 1 1 
ATOM   4716 H  HH21 A ARG   A 1 296 ? 14.153  42.681  -27.095 0   70.61 ? 986  ARG   A HH21 1 1 
ATOM   4717 H  HH21 B ARG   A 1 296 ? 9.968   45.228  -27.655 0   72.7  ? 986  ARG   A HH21 1 1 
ATOM   4718 H  HH22 A ARG   A 1 296 ? 14.744  43.009  -25.501 0   71.29 ? 986  ARG   A HH22 1 1 
ATOM   4719 H  HH22 B ARG   A 1 296 ? 10.07   46.58   -28.74  0   73.86 ? 986  ARG   A HH22 1 1 
ATOM   4720 N  N    . MET   A 1 297 ? 9.759   38.046  -25.796 1   43.14 ? 987  MET   A N    1 1 
ATOM   4721 C  CA   . MET   A 1 297 ? 9.132   37.259  -24.723 1   42.12 ? 987  MET   A CA   1 1 
ATOM   4722 C  C    . MET   A 1 297 ? 10.166  36.625  -23.792 1   42.06 ? 987  MET   A C    1 1 
ATOM   4723 O  O    . MET   A 1 297 ? 11.224  36.184  -24.245 1   42.57 ? 987  MET   A O    1 1 
ATOM   4724 C  CB   . MET   A 1 297 ? 8.255   36.144  -25.309 1   41.06 ? 987  MET   A CB   1 1 
ATOM   4725 C  CG   . MET   A 1 297 ? 7.085   36.65   -26.105 1   40.35 ? 987  MET   A CG   1 1 
ATOM   4726 S  SD   . MET   A 1 297 ? 6.14    35.287  -26.788 1   36.64 ? 987  MET   A SD   1 1 
ATOM   4727 C  CE   . MET   A 1 297 ? 4.841   36.187  -27.571 1   31.34 ? 987  MET   A CE   1 1 
ATOM   4728 H  H    A MET   A 1 297 ? 10.024  37.472  -26.591 0   50.11 ? 987  MET   A H    1 1 
ATOM   4729 H  H    B MET   A 1 297 ? 9.809   37.552  -26.682 0   50.08 ? 987  MET   A H    1 1 
ATOM   4730 H  HA   . MET   A 1 297 ? 8.469   37.892  -24.135 0   48.97 ? 987  MET   A HA   1 1 
ATOM   4731 H  HB2  . MET   A 1 297 ? 8.859   35.513  -25.96  0   46.5  ? 987  MET   A HB2  1 1 
ATOM   4732 H  HB3  . MET   A 1 297 ? 7.86    35.547  -24.488 0   46.27 ? 987  MET   A HB3  1 1 
ATOM   4733 H  HG2  . MET   A 1 297 ? 6.435   37.256  -25.477 0   46.08 ? 987  MET   A HG2  1 1 
ATOM   4734 H  HG3  . MET   A 1 297 ? 7.449   37.245  -26.941 0   46.31 ? 987  MET   A HG3  1 1 
ATOM   4735 H  HE1  . MET   A 1 297 ? 4.161   35.484  -28.05  0   35.46 ? 987  MET   A HE1  1 1 
ATOM   4736 H  HE2  . MET   A 1 297 ? 4.309   36.766  -26.818 0   36.24 ? 987  MET   A HE2  1 1 
ATOM   4737 H  HE3  . MET   A 1 297 ? 5.272   36.854  -28.317 0   36.43 ? 987  MET   A HE3  1 1 
ATOM   4738 N  N    . HIS   A 1 298 ? 9.837   36.532  -22.497 1   41.1  ? 988  HIS   A N    1 1 
ATOM   4739 C  CA   . HIS   A 1 298 ? 10.724  35.913  -21.519 1   40.68 ? 988  HIS   A CA   1 1 
ATOM   4740 C  C    . HIS   A 1 298 ? 9.894   35.285  -20.403 1   38.36 ? 988  HIS   A C    1 1 
ATOM   4741 O  O    . HIS   A 1 298 ? 8.88    35.847  -19.985 1   37.84 ? 988  HIS   A O    1 1 
ATOM   4742 C  CB   . HIS   A 1 298 ? 11.725  36.94   -20.939 1   43.23 ? 988  HIS   A CB   1 1 
ATOM   4743 C  CG   . HIS   A 1 298 ? 12.513  36.429  -19.762 1   48.36 ? 988  HIS   A CG   1 1 
ATOM   4744 N  ND1  . HIS   A 1 298 ? 12.242  36.857  -18.467 1   51.12 ? 988  HIS   A ND1  1 1 
ATOM   4745 C  CD2  . HIS   A 1 298 ? 13.506  35.508  -19.716 1   50.24 ? 988  HIS   A CD2  1 1 
ATOM   4746 C  CE1  . HIS   A 1 298 ? 13.092  36.205  -17.684 1   51.9  ? 988  HIS   A CE1  1 1 
ATOM   4747 N  NE2  . HIS   A 1 298 ? 13.862  35.37   -18.389 1   51.74 ? 988  HIS   A NE2  1 1 
ATOM   4748 H  H    . HIS   A 1 298 ? 8.966   36.87   -22.1   0   47.63 ? 988  HIS   A H    1 1 
ATOM   4749 H  HA   . HIS   A 1 298 ? 11.298  35.119  -21.994 0   47.1  ? 988  HIS   A HA   1 1 
ATOM   4750 H  HB2  . HIS   A 1 298 ? 12.435  37.217  -21.718 0   51.38 ? 988  HIS   A HB2  1 1 
ATOM   4751 H  HB3  . HIS   A 1 298 ? 11.174  37.821  -20.613 0   51.31 ? 988  HIS   A HB3  1 1 
ATOM   4752 H  HD2  . HIS   A 1 298 ? 13.935  34.984  -20.553 0   57.94 ? 988  HIS   A HD2  1 1 
ATOM   4753 H  HE1  . HIS   A 1 298 ? 13.154  36.332  -16.616 0   60.45 ? 988  HIS   A HE1  1 1 
ATOM   4754 H  HE2  . HIS   A 1 298 ? 14.576  34.751  -18.019 0   59.92 ? 988  HIS   A HE2  1 1 
ATOM   4755 N  N    . LEU   A 1 299 ? 10.314  34.113  -19.945 1   37.07 ? 989  LEU   A N    1 1 
ATOM   4756 C  CA   . LEU   A 1 299 ? 9.677   33.431  -18.836 1   36.73 ? 989  LEU   A CA   1 1 
ATOM   4757 C  C    . LEU   A 1 299 ? 10.755  33.213  -17.754 1   37.25 ? 989  LEU   A C    1 1 
ATOM   4758 O  O    . LEU   A 1 299 ? 11.935  33.017  -18.092 1   37.4  ? 989  LEU   A O    1 1 
ATOM   4759 C  CB   . LEU   A 1 299 ? 9.059   32.088  -19.272 1   36.5  ? 989  LEU   A CB   1 1 
ATOM   4760 C  CG   . LEU   A 1 299 ? 7.879   32.178  -20.27  1   37.15 ? 989  LEU   A CG   1 1 
ATOM   4761 C  CD1  . LEU   A 1 299 ? 7.572   30.822  -20.866 1   37.36 ? 989  LEU   A CD1  1 1 
ATOM   4762 C  CD2  . LEU   A 1 299 ? 6.616   32.762  -19.62  1   37.41 ? 989  LEU   A CD2  1 1 
ATOM   4763 H  H    . LEU   A 1 299 ? 11.107  33.602  -20.321 0   42.78 ? 989  LEU   A H    1 1 
ATOM   4764 H  HA   . LEU   A 1 299 ? 8.885   34.066  -18.446 0   42.05 ? 989  LEU   A HA   1 1 
ATOM   4765 H  HB2  . LEU   A 1 299 ? 9.839   31.49   -19.741 0   40.79 ? 989  LEU   A HB2  1 1 
ATOM   4766 H  HB3  . LEU   A 1 299 ? 8.694   31.574  -18.384 0   40.61 ? 989  LEU   A HB3  1 1 
ATOM   4767 H  HG   . LEU   A 1 299 ? 8.16    32.838  -21.089 0   41.39 ? 989  LEU   A HG   1 1 
ATOM   4768 H  HD11 . LEU   A 1 299 ? 6.746   30.922  -21.569 0   40.29 ? 989  LEU   A HD11 1 1 
ATOM   4769 H  HD12 . LEU   A 1 299 ? 8.455   30.458  -21.389 0   40.58 ? 989  LEU   A HD12 1 1 
ATOM   4770 H  HD13 . LEU   A 1 299 ? 7.302   30.128  -20.073 0   40.27 ? 989  LEU   A HD13 1 1 
ATOM   4771 H  HD21 . LEU   A 1 299 ? 5.772   32.626  -20.295 0   41.08 ? 989  LEU   A HD21 1 1 
ATOM   4772 H  HD22 . LEU   A 1 299 ? 6.426   32.248  -18.679 0   41.07 ? 989  LEU   A HD22 1 1 
ATOM   4773 H  HD23 . LEU   A 1 299 ? 6.759   33.827  -19.439 0   41.91 ? 989  LEU   A HD23 1 1 
ATOM   4774 N  N    . PRO   A 1 300 ? 10.398  33.262  -16.45  1   36.89 ? 990  PRO   A N    1 1 
ATOM   4775 C  CA   . PRO   A 1 300 ? 11.437  33.077  -15.411 1   36.88 ? 990  PRO   A CA   1 1 
ATOM   4776 C  C    . PRO   A 1 300 ? 12.288  31.807  -15.577 1   36.92 ? 990  PRO   A C    1 1 
ATOM   4777 O  O    . PRO   A 1 300 ? 11.747  30.748  -15.865 1   36.34 ? 990  PRO   A O    1 1 
ATOM   4778 C  CB   . PRO   A 1 300 ? 10.642  33.025  -14.103 1   37.74 ? 990  PRO   A CB   1 1 
ATOM   4779 C  CG   . PRO   A 1 300 ? 9.322   33.639  -14.4   1   38.13 ? 990  PRO   A CG   1 1 
ATOM   4780 C  CD   . PRO   A 1 300 ? 9.061   33.505  -15.865 1   36.48 ? 990  PRO   A CD   1 1 
ATOM   4781 H  HA   . PRO   A 1 300 ? 12.089  33.949  -15.39  0   43.81 ? 990  PRO   A HA   1 1 
ATOM   4782 H  HB2  . PRO   A 1 300 ? 10.52   31.99   -13.79  0   43.37 ? 990  PRO   A HB2  1 1 
ATOM   4783 H  HB3  . PRO   A 1 300 ? 11.165  33.596  -13.337 0   44.44 ? 990  PRO   A HB3  1 1 
ATOM   4784 H  HG2  . PRO   A 1 300 ? 8.551   33.118  -13.834 0   43.62 ? 990  PRO   A HG2  1 1 
ATOM   4785 H  HG3  . PRO   A 1 300 ? 9.346   34.691  -14.119 0   44.6  ? 990  PRO   A HG3  1 1 
ATOM   4786 H  HD2  . PRO   A 1 300 ? 8.398   32.663  -16.059 0   41.32 ? 990  PRO   A HD2  1 1 
ATOM   4787 H  HD3  . PRO   A 1 300 ? 8.634   34.444  -16.215 0   42.21 ? 990  PRO   A HD3  1 1 
ATOM   4788 N  N    . SER   A 1 301 ? 13.62   31.924  -15.406 1   37.19 ? 991  SER   A N    1 1 
ATOM   4789 C  CA   . SER   A 1 301 ? 14.573  30.81   -15.521 1   37.95 ? 991  SER   A CA   1 1 
ATOM   4790 C  C    . SER   A 1 301 ? 15.428  30.701  -14.245 1   37.93 ? 991  SER   A C    1 1 
ATOM   4791 O  O    . SER   A 1 301 ? 15.809  31.748  -13.74  1   37.7  ? 991  SER   A O    1 1 
ATOM   4792 C  CB   . SER   A 1 301 ? 15.506  31.039  -16.71  1   40.04 ? 991  SER   A CB   1 1 
ATOM   4793 O  OG   . SER   A 1 301 ? 16.556  30.081  -16.735 1   42.95 ? 991  SER   A OG   1 1 
ATOM   4794 H  H    . SER   A 1 301 ? 14.078  32.802  -15.182 0   44.51 ? 991  SER   A H    1 1 
ATOM   4795 H  HA   . SER   A 1 301 ? 14.03   29.884  -15.7   0   43.83 ? 991  SER   A HA   1 1 
ATOM   4796 H  HB2  . SER   A 1 301 ? 14.932  30.954  -17.631 0   46.59 ? 991  SER   A HB2  1 1 
ATOM   4797 H  HB3  . SER   A 1 301 ? 15.94   32.035  -16.634 0   47.75 ? 991  SER   A HB3  1 1 
ATOM   4798 H  HG   . SER   A 1 301 ? 17.215  30.316  -17.439 0   50.52 ? 991  SER   A HG   1 1 
ATOM   4799 N  N    . PRO   A 1 302 ? 15.818  29.497  -13.742 1   37.94 ? 992  PRO   A N    1 1 
ATOM   4800 C  CA   . PRO   A 1 302 ? 16.671  29.455  -12.539 1   38.1  ? 992  PRO   A CA   1 1 
ATOM   4801 C  C    . PRO   A 1 302 ? 17.976  30.247  -12.63  1   38.71 ? 992  PRO   A C    1 1 
ATOM   4802 O  O    . PRO   A 1 302 ? 18.495  30.651  -11.591 1   39.2  ? 992  PRO   A O    1 1 
ATOM   4803 C  CB   . PRO   A 1 302 ? 16.955  27.96   -12.344 1   38.68 ? 992  PRO   A CB   1 1 
ATOM   4804 C  CG   . PRO   A 1 302 ? 15.862  27.271  -13.021 1   39.09 ? 992  PRO   A CG   1 1 
ATOM   4805 C  CD   . PRO   A 1 302 ? 15.479  28.13   -14.192 1   37.45 ? 992  PRO   A CD   1 1 
ATOM   4806 H  HA   . PRO   A 1 302 ? 16.107  29.817  -11.68  0   45.78 ? 992  PRO   A HA   1 1 
ATOM   4807 H  HB2  . PRO   A 1 302 ? 17.911  27.706  -12.8   0   46.29 ? 992  PRO   A HB2  1 1 
ATOM   4808 H  HB3  . PRO   A 1 302 ? 16.96   27.723  -11.281 0   46.03 ? 992  PRO   A HB3  1 1 
ATOM   4809 H  HG2  . PRO   A 1 302 ? 16.198  26.29   -13.356 0   45.1  ? 992  PRO   A HG2  1 1 
ATOM   4810 H  HG3  . PRO   A 1 302 ? 15.026  27.178  -12.331 0   44.97 ? 992  PRO   A HG3  1 1 
ATOM   4811 H  HD2  . PRO   A 1 302 ? 16.062  27.861  -15.071 0   43.65 ? 992  PRO   A HD2  1 1 
ATOM   4812 H  HD3  . PRO   A 1 302 ? 14.409  28.027  -14.371 0   42.99 ? 992  PRO   A HD3  1 1 
ATOM   4813 N  N    . THR   A 1 303 ? 18.507  30.469  -13.85  1   38.57 ? 993  THR   A N    1 1 
ATOM   4814 C  CA   . THR   A 1 303 ? 19.739  31.246  -14.05  1   38.98 ? 993  THR   A CA   1 1 
ATOM   4815 C  C    . THR   A 1 303 ? 19.506  32.755  -13.88  1   37.97 ? 993  THR   A C    1 1 
ATOM   4816 O  O    . THR   A 1 303 ? 20.486  33.492  -13.764 1   38.71 ? 993  THR   A O    1 1 
ATOM   4817 C  CB   . THR   A 1 303 ? 20.349  30.954  -15.439 1   41.73 ? 993  THR   A CB   1 1 
ATOM   4818 O  OG1  . THR   A 1 303 ? 19.358  31.174  -16.44  1   43.69 ? 993  THR   A OG1  1 1 
ATOM   4819 C  CG2  . THR   A 1 303 ? 20.897  29.529  -15.558 1   42.38 ? 993  THR   A CG2  1 1 
ATOM   4820 H  H    . THR   A 1 303 ? 18.1    30.138  -14.719 0   46.95 ? 993  THR   A H    1 1 
ATOM   4821 H  HA   . THR   A 1 303 ? 20.473  30.942  -13.305 0   49.52 ? 993  THR   A HA   1 1 
ATOM   4822 H  HB   . THR   A 1 303 ? 21.178  31.64   -15.612 0   52.78 ? 993  THR   A HB   1 1 
ATOM   4823 H  HG1  . THR   A 1 303 ? 19.738  30.991  -17.339 0   53.06 ? 993  THR   A HG1  1 1 
ATOM   4824 H  HG21 . THR   A 1 303 ? 21.333  29.38   -16.545 0   52.35 ? 993  THR   A HG21 1 1 
ATOM   4825 H  HG22 . THR   A 1 303 ? 21.665  29.363  -14.804 0   52.88 ? 993  THR   A HG22 1 1 
ATOM   4826 H  HG23 . THR   A 1 303 ? 20.096  28.805  -15.413 0   51.42 ? 993  THR   A HG23 1 1 
ATOM   4827 N  N    . ASP   A 1 304 ? 18.24   33.234  -13.901 1   36.55 ? 994  ASP   A N    1 1 
ATOM   4828 C  CA   . ASP   A 1 304 ? 17.94   34.647  -13.677 1   35.98 ? 994  ASP   A CA   1 1 
ATOM   4829 C  C    . ASP   A 1 304 ? 18.183  34.937  -12.22  1   36.58 ? 994  ASP   A C    1 1 
ATOM   4830 O  O    . ASP   A 1 304 ? 17.775  34.149  -11.368 1   36.45 ? 994  ASP   A O    1 1 
ATOM   4831 C  CB   . ASP   A 1 304 ? 16.461  34.967  -13.955 1   36.6  ? 994  ASP   A CB   1 1 
ATOM   4832 C  CG   . ASP   A 1 304 ? 16.028  34.764  -15.388 1   39.45 ? 994  ASP   A CG   1 1 
ATOM   4833 O  OD1  . ASP   A 1 304 ? 16.912  34.665  -16.263 1   40.62 ? 994  ASP   A OD1  1 1 
ATOM   4834 O  OD2  . ASP   A 1 304 ? 14.804  34.694  -15.629 1   39.84 ? 994  ASP   A OD2  1 1 
ATOM   4835 H  H    . ASP   A 1 304 ? 17.41   32.675  -14.069 0   45.81 ? 994  ASP   A H    1 1 
ATOM   4836 H  HA   . ASP   A 1 304 ? 18.576  35.28   -14.295 0   47.3  ? 994  ASP   A HA   1 1 
ATOM   4837 H  HB2  . ASP   A 1 304 ? 15.841  34.326  -13.33  0   45.92 ? 994  ASP   A HB2  1 1 
ATOM   4838 H  HB3  . ASP   A 1 304 ? 16.28   36.011  -13.702 0   47.04 ? 994  ASP   A HB3  1 1 
ATOM   4839 N  N    . SER   A 1 305 ? 18.807  36.073  -11.922 1   37.02 ? 995  SER   A N    1 1 
ATOM   4840 C  CA   . SER   A 1 305 ? 19.065  36.471  -10.537 1   37.87 ? 995  SER   A CA   1 1 
ATOM   4841 C  C    . SER   A 1 305 ? 17.796  36.547  -9.702  1   37.61 ? 995  SER   A C    1 1 
ATOM   4842 O  O    . SER   A 1 305 ? 17.815  36.155  -8.536  1   37.93 ? 995  SER   A O    1 1 
ATOM   4843 C  CB   . SER   A 1 305 ? 19.732  37.836  -10.505 1   40.43 ? 995  SER   A CB   1 1 
ATOM   4844 O  OG   . SER   A 1 305 ? 21.07   37.741  -10.969 1   44.05 ? 995  SER   A OG   1 1 
ATOM   4845 H  H    . SER   A 1 305 ? 19.154  36.732  -12.612 0   49.89 ? 995  SER   A H    1 1 
ATOM   4846 H  HA   . SER   A 1 305 ? 19.719  35.734  -10.071 0   50.98 ? 995  SER   A HA   1 1 
ATOM   4847 H  HB2  . SER   A 1 305 ? 19.186  38.517  -11.156 0   54.77 ? 995  SER   A HB2  1 1 
ATOM   4848 H  HB3  . SER   A 1 305 ? 19.678  38.204  -9.48   0   55.29 ? 995  SER   A HB3  1 1 
ATOM   4849 H  HG   . SER   A 1 305 ? 21.69   38.2    -10.345 0   60.13 ? 995  SER   A HG   1 1 
ATOM   4850 N  N    . ASN   A 1 306 ? 16.705  37.035  -10.297 1   36.81 ? 996  ASN   A N    1 1 
ATOM   4851 C  CA   . ASN   A 1 306 ? 15.432  37.171  -9.603  1   36.81 ? 996  ASN   A CA   1 1 
ATOM   4852 C  C    . ASN   A 1 306 ? 14.493  35.959  -9.764  1   36.08 ? 996  ASN   A C    1 1 
ATOM   4853 O  O    . ASN   A 1 306 ? 13.287  36.137  -9.591  1   36.63 ? 996  ASN   A O    1 1 
ATOM   4854 C  CB   . ASN   A 1 306 ? 14.735  38.462  -10.08  1   37.85 ? 996  ASN   A CB   1 1 
ATOM   4855 C  CG   . ASN   A 1 306 ? 14.192  38.387  -11.491 1   41.63 ? 996  ASN   A CG   1 1 
ATOM   4856 O  OD1  . ASN   A 1 306 ? 14.624  37.556  -12.301 1   42.81 ? 996  ASN   A OD1  1 1 
ATOM   4857 N  ND2  . ASN   A 1 306 ? 13.229  39.235  -11.812 1   42.75 ? 996  ASN   A ND2  1 1 
ATOM   4858 H  H    . ASN   A 1 306 ? 16.683  37.356  -11.26  0   48.75 ? 996  ASN   A H    1 1 
ATOM   4859 H  HA   . ASN   A 1 306 ? 15.612  37.298  -8.537  0   48.67 ? 996  ASN   A HA   1 1 
ATOM   4860 H  HB2  . ASN   A 1 306 ? 13.909  38.687  -9.408  0   49.5  ? 996  ASN   A HB2  1 1 
ATOM   4861 H  HB3  . ASN   A 1 306 ? 15.459  39.275  -10.051 0   50.57 ? 996  ASN   A HB3  1 1 
ATOM   4862 H  HD21 . ASN   A 1 306 ? 12.838  39.218  -12.748 0   53.54 ? 996  ASN   A HD21 1 1 
ATOM   4863 H  HD22 . ASN   A 1 306 ? 12.879  39.903  -11.132 0   54.35 ? 996  ASN   A HD22 1 1 
ATOM   4864 N  N    . PHE   A 1 307 ? 14.997  34.742  -10.085 1   35.37 ? 997  PHE   A N    1 1 
ATOM   4865 C  CA   . PHE   A 1 307 ? 14.094  33.585  -10.276 1   35.59 ? 997  PHE   A CA   1 1 
ATOM   4866 C  C    . PHE   A 1 307 ? 13.259  33.308  -9.031  1   36.21 ? 997  PHE   A C    1 1 
ATOM   4867 O  O    . PHE   A 1 307 ? 12.083  32.968  -9.153  1   35.52 ? 997  PHE   A O    1 1 
ATOM   4868 C  CB   . PHE   A 1 307 ? 14.852  32.308  -10.671 1   35.49 ? 997  PHE   A CB   1 1 
ATOM   4869 C  CG   . PHE   A 1 307 ? 13.959  31.093  -10.853 1   36.22 ? 997  PHE   A CG   1 1 
ATOM   4870 C  CD1  . PHE   A 1 307 ? 13.038  31.036  -11.89  1   37.15 ? 997  PHE   A CD1  1 1 
ATOM   4871 C  CD2  . PHE   A 1 307 ? 14.046  30.009  -9.991  1   37.14 ? 997  PHE   A CD2  1 1 
ATOM   4872 C  CE1  . PHE   A 1 307 ? 12.257  29.895  -12.091 1   37.74 ? 997  PHE   A CE1  1 1 
ATOM   4873 C  CE2  . PHE   A 1 307 ? 13.261  28.874  -10.191 1   38    ? 997  PHE   A CE2  1 1 
ATOM   4874 C  CZ   . PHE   A 1 307 ? 12.361  28.832  -11.231 1   37.61 ? 997  PHE   A CZ   1 1 
ATOM   4875 H  H    . PHE   A 1 307 ? 15.981  34.521  -10.204 0   45.49 ? 997  PHE   A H    1 1 
ATOM   4876 H  HA   . PHE   A 1 307 ? 13.404  33.827  -11.083 0   43.85 ? 997  PHE   A HA   1 1 
ATOM   4877 H  HB2  . PHE   A 1 307 ? 15.363  32.486  -11.616 0   43.96 ? 997  PHE   A HB2  1 1 
ATOM   4878 H  HB3  . PHE   A 1 307 ? 15.582  32.081  -9.896  0   44.21 ? 997  PHE   A HB3  1 1 
ATOM   4879 H  HD1  . PHE   A 1 307 ? 12.959  31.858  -12.581 0   43.93 ? 997  PHE   A HD1  1 1 
ATOM   4880 H  HD2  . PHE   A 1 307 ? 14.758  30.02   -9.183  0   44.65 ? 997  PHE   A HD2  1 1 
ATOM   4881 H  HE1  . PHE   A 1 307 ? 11.545  29.866  -12.898 0   42.99 ? 997  PHE   A HE1  1 1 
ATOM   4882 H  HE2  . PHE   A 1 307 ? 13.344  28.038  -9.519  0   43.99 ? 997  PHE   A HE2  1 1 
ATOM   4883 H  HZ   . PHE   A 1 307 ? 11.739  27.964  -11.37  0   42.51 ? 997  PHE   A HZ   1 1 
ATOM   4884 N  N    . TYR   A 1 308 ? 13.868  33.462  -7.83   1   37.05 ? 998  TYR   A N    1 1 
ATOM   4885 C  CA   . TYR   A 1 308 ? 13.172  33.269  -6.556  1   38.26 ? 998  TYR   A CA   1 1 
ATOM   4886 C  C    . TYR   A 1 308 ? 11.87   34.096  -6.458  1   39.32 ? 998  TYR   A C    1 1 
ATOM   4887 O  O    . TYR   A 1 308 ? 10.963  33.668  -5.749  1   39.35 ? 998  TYR   A O    1 1 
ATOM   4888 C  CB   . TYR   A 1 308 ? 14.11   33.607  -5.375  1   38.35 ? 998  TYR   A CB   1 1 
ATOM   4889 C  CG   . TYR   A 1 308 ? 14.46   35.078  -5.265  1   39.11 ? 998  TYR   A CG   1 1 
ATOM   4890 C  CD1  . TYR   A 1 308 ? 13.805  35.902  -4.363  1   39.99 ? 998  TYR   A CD1  1 1 
ATOM   4891 C  CD2  . TYR   A 1 308 ? 15.446  35.643  -6.064  1   39.97 ? 998  TYR   A CD2  1 1 
ATOM   4892 C  CE1  . TYR   A 1 308 ? 14.15   37.241  -4.224  1   40.91 ? 998  TYR   A CE1  1 1 
ATOM   4893 C  CE2  . TYR   A 1 308 ? 15.798  36.983  -5.936  1   40.91 ? 998  TYR   A CE2  1 1 
ATOM   4894 C  CZ   . TYR   A 1 308 ? 15.146  37.781  -5.016  1   41.8  ? 998  TYR   A CZ   1 1 
ATOM   4895 O  OH   . TYR   A 1 308 ? 15.489  39.105  -4.895  1   43.49 ? 998  TYR   A OH   1 1 
ATOM   4896 H  H    . TYR   A 1 308 ? 14.851  33.687  -7.72   0   46.67 ? 998  TYR   A H    1 1 
ATOM   4897 H  HA   . TYR   A 1 308 ? 12.899  32.219  -6.468  0   46.48 ? 998  TYR   A HA   1 1 
ATOM   4898 H  HB2  . TYR   A 1 308 ? 13.617  33.313  -4.45   0   47.96 ? 998  TYR   A HB2  1 1 
ATOM   4899 H  HB3  . TYR   A 1 308 ? 15.039  33.051  -5.486  0   48.26 ? 998  TYR   A HB3  1 1 
ATOM   4900 H  HD1  . TYR   A 1 308 ? 13.041  35.489  -3.726  0   50.65 ? 998  TYR   A HD1  1 1 
ATOM   4901 H  HD2  . TYR   A 1 308 ? 15.978  35.025  -6.766  0   51.1  ? 998  TYR   A HD2  1 1 
ATOM   4902 H  HE1  . TYR   A 1 308 ? 13.628  37.852  -3.506  0   53.32 ? 998  TYR   A HE1  1 1 
ATOM   4903 H  HE2  . TYR   A 1 308 ? 16.576  37.398  -6.556  0   53.84 ? 998  TYR   A HE2  1 1 
ATOM   4904 H  HH   . TYR   A 1 308 ? 14.935  39.555  -4.205  0   57.66 ? 998  TYR   A HH   1 1 
ATOM   4905 N  N    . ARG   A 1 309 ? 11.769  35.249  -7.166  1   40.28 ? 999  ARG   A N    1 1 
ATOM   4906 C  CA   . ARG   A 1 309 ? 10.56   36.082  -7.152  1   42.72 ? 999  ARG   A CA   1 1 
ATOM   4907 C  C    . ARG   A 1 309 ? 9.371   35.337  -7.772  1   45.74 ? 999  ARG   A C    1 1 
ATOM   4908 O  O    . ARG   A 1 309 ? 8.237   35.544  -7.339  1   46.33 ? 999  ARG   A O    1 1 
ATOM   4909 C  CB   . ARG   A 1 309 ? 10.756  37.403  -7.93   1   43.66 ? 999  ARG   A CB   1 1 
ATOM   4910 C  CG   . ARG   A 1 309 ? 11.825  38.371  -7.401  1   45.9  ? 999  ARG   A CG   1 1 
ATOM   4911 C  CD   . ARG   A 1 309 ? 11.422  39.093  -6.137  1   47.41 ? 999  ARG   A CD   1 1 
ATOM   4912 N  NE   . ARG   A 1 309 ? 12.491  39.987  -5.704  1   48.87 ? 999  ARG   A NE   1 1 
ATOM   4913 C  CZ   . ARG   A 1 309 ? 12.623  40.496  -4.479  1   49.24 ? 999  ARG   A CZ   1 1 
ATOM   4914 N  NH1  . ARG   A 1 309 ? 11.749  40.191  -3.522  1   46.7  ? 999  ARG   A NH1  1 1 
ATOM   4915 N  NH2  . ARG   A 1 309 ? 13.642  41.299  -4.197  1   49.29 ? 999  ARG   A NH2  1 1 
ATOM   4916 H  H    . ARG   A 1 309 ? 12.501  35.611  -7.767  0   49.78 ? 999  ARG   A H    1 1 
ATOM   4917 H  HA   . ARG   A 1 309 ? 10.303  36.315  -6.12   0   52.12 ? 999  ARG   A HA   1 1 
ATOM   4918 H  HB2  . ARG   A 1 309 ? 11.027  37.156  -8.956  0   53.11 ? 999  ARG   A HB2  1 1 
ATOM   4919 H  HB3  . ARG   A 1 309 ? 9.809   37.94   -7.929  0   53.35 ? 999  ARG   A HB3  1 1 
ATOM   4920 H  HG2  . ARG   A 1 309 ? 12.743  37.822  -7.199  0   56.9  ? 999  ARG   A HG2  1 1 
ATOM   4921 H  HG3  . ARG   A 1 309 ? 12.006  39.131  -8.16   0   57.17 ? 999  ARG   A HG3  1 1 
ATOM   4922 H  HD2  . ARG   A 1 309 ? 10.521  39.677  -6.314  0   58.89 ? 999  ARG   A HD2  1 1 
ATOM   4923 H  HD3  . ARG   A 1 309 ? 11.256  38.349  -5.36   0   58.57 ? 999  ARG   A HD3  1 1 
ATOM   4924 H  HE   . ARG   A 1 309 ? 13.198  40.227  -6.392  0   61.87 ? 999  ARG   A HE   1 1 
ATOM   4925 H  HH11 . ARG   A 1 309 ? 10.926  39.624  -3.689  0   58.96 ? 999  ARG   A HH11 1 1 
ATOM   4926 H  HH12 . ARG   A 1 309 ? 11.858  40.614  -2.606  0   60.33 ? 999  ARG   A HH12 1 1 
ATOM   4927 H  HH21 . ARG   A 1 309 ? 14.336  41.518  -4.905  0   64.12 ? 999  ARG   A HH21 1 1 
ATOM   4928 H  HH22 . ARG   A 1 309 ? 13.749  41.684  -3.264  0   64.38 ? 999  ARG   A HH22 1 1 
ATOM   4929 N  N    . ALA   A 1 310 ? 9.612   34.504  -8.8    1   47.27 ? 1000 ALA   A N    1 1 
ATOM   4930 C  CA   . ALA   A 1 310 ? 8.541   33.741  -9.438  1   49.53 ? 1000 ALA   A CA   1 1 
ATOM   4931 C  C    . ALA   A 1 310 ? 8.029   32.613  -8.529  1   52.68 ? 1000 ALA   A C    1 1 
ATOM   4932 O  O    . ALA   A 1 310 ? 6.848   32.273  -8.603  1   53    ? 1000 ALA   A O    1 1 
ATOM   4933 C  CB   . ALA   A 1 310 ? 9.024   33.165  -10.756 1   49.18 ? 1000 ALA   A CB   1 1 
ATOM   4934 H  H    . ALA   A 1 310 ? 10.52   34.349  -9.226  0   54.95 ? 1000 ALA   A H    1 1 
ATOM   4935 H  HA   . ALA   A 1 310 ? 7.705   34.405  -9.656  0   56.24 ? 1000 ALA   A HA   1 1 
ATOM   4936 H  HB1  . ALA   A 1 310 ? 8.206   32.621  -11.226 0   54.8  ? 1000 ALA   A HB1  1 1 
ATOM   4937 H  HB2  . ALA   A 1 310 ? 9.349   33.979  -11.402 0   55.78 ? 1000 ALA   A HB2  1 1 
ATOM   4938 H  HB3  . ALA   A 1 310 ? 9.857   32.489  -10.564 0   55.42 ? 1000 ALA   A HB3  1 1 
ATOM   4939 N  N    . LEU   A 1 311 ? 8.896   32.045  -7.664  1   54.8  ? 1001 LEU   A N    1 1 
ATOM   4940 C  CA   . LEU   A 1 311 ? 8.499   30.959  -6.755  1   57.38 ? 1001 LEU   A CA   1 1 
ATOM   4941 C  C    . LEU   A 1 311 ? 7.752   31.445  -5.493  1   60.02 ? 1001 LEU   A C    1 1 
ATOM   4942 O  O    . LEU   A 1 311 ? 7.448   30.615  -4.634  1   60.37 ? 1001 LEU   A O    1 1 
ATOM   4943 C  CB   . LEU   A 1 311 ? 9.739   30.149  -6.315  1   57.64 ? 1001 LEU   A CB   1 1 
ATOM   4944 C  CG   . LEU   A 1 311 ? 10.562  29.43   -7.4    1   59.4  ? 1001 LEU   A CG   1 1 
ATOM   4945 C  CD1  . LEU   A 1 311 ? 11.871  28.94   -6.824  1   60.17 ? 1001 LEU   A CD1  1 1 
ATOM   4946 C  CD2  . LEU   A 1 311 ? 9.819   28.24   -7.984  1   59.69 ? 1001 LEU   A CD2  1 1 
ATOM   4947 H  H    . LEU   A 1 311 ? 9.867   32.32   -7.56   0   61.62 ? 1001 LEU   A H    1 1 
ATOM   4948 H  HA   . LEU   A 1 311 ? 7.824   30.285  -7.279  0   62.78 ? 1001 LEU   A HA   1 1 
ATOM   4949 H  HB2  . LEU   A 1 311 ? 10.41   30.834  -5.796  0   64.43 ? 1001 LEU   A HB2  1 1 
ATOM   4950 H  HB3  . LEU   A 1 311 ? 9.422   29.374  -5.616  0   63.57 ? 1001 LEU   A HB3  1 1 
ATOM   4951 H  HG   . LEU   A 1 311 ? 10.784  30.125  -8.209  0   65.44 ? 1001 LEU   A HG   1 1 
ATOM   4952 H  HD11 . LEU   A 1 311 ? 12.438  28.433  -7.602  0   66.33 ? 1001 LEU   A HD11 1 1 
ATOM   4953 H  HD12 . LEU   A 1 311 ? 12.438  29.792  -6.453  0   67.13 ? 1001 LEU   A HD12 1 1 
ATOM   4954 H  HD13 . LEU   A 1 311 ? 11.661  28.251  -6.008  0   66.33 ? 1001 LEU   A HD13 1 1 
ATOM   4955 H  HD21 . LEU   A 1 311 ? 10.479  27.717  -8.674  0   64.6  ? 1001 LEU   A HD21 1 1 
ATOM   4956 H  HD22 . LEU   A 1 311 ? 9.526   27.572  -7.176  0   64.6  ? 1001 LEU   A HD22 1 1 
ATOM   4957 H  HD23 . LEU   A 1 311 ? 8.937   28.583  -8.522  0   64.46 ? 1001 LEU   A HD23 1 1 
ATOM   4958 N  N    . MET   A 1 312 ? 7.435   32.752  -5.371  1   61.75 ? 1002 MET   A N    1 1 
ATOM   4959 C  CA   . MET   A 1 312 ? 6.749   33.257  -4.174  1   63.89 ? 1002 MET   A CA   1 1 
ATOM   4960 C  C    . MET   A 1 312 ? 5.296   32.782  -4.119  1   64.81 ? 1002 MET   A C    1 1 
ATOM   4961 O  O    . MET   A 1 312 ? 4.966   31.925  -3.295  1   65.29 ? 1002 MET   A O    1 1 
ATOM   4962 C  CB   . MET   A 1 312 ? 6.805   34.795  -4.114  1   65.58 ? 1002 MET   A CB   1 1 
ATOM   4963 C  CG   . MET   A 1 312 ? 8.183   35.332  -3.828  1   69.23 ? 1002 MET   A CG   1 1 
ATOM   4964 S  SD   . MET   A 1 312 ? 8.214   37.132  -3.631  1   79.4  ? 1002 MET   A SD   1 1 
ATOM   4965 C  CE   . MET   A 1 312 ? 9.736   37.309  -2.866  1   77.47 ? 1002 MET   A CE   1 1 
ATOM   4966 H  H    . MET   A 1 312 ? 7.611   33.459  -6.077  0   68.79 ? 1002 MET   A H    1 1 
ATOM   4967 H  HA   . MET   A 1 312 ? 7.26    32.872  -3.292  0   71.27 ? 1002 MET   A HA   1 1 
ATOM   4968 H  HB2  . MET   A 1 312 ? 6.471   35.206  -5.066  0   73.47 ? 1002 MET   A HB2  1 1 
ATOM   4969 H  HB3  . MET   A 1 312 ? 6.146   35.134  -3.316  0   73.84 ? 1002 MET   A HB3  1 1 
ATOM   4970 H  HG2  . MET   A 1 312 ? 8.547   34.879  -2.907  0   78.09 ? 1002 MET   A HG2  1 1 
ATOM   4971 H  HG3  . MET   A 1 312 ? 8.841   35.072  -4.656  0   77.78 ? 1002 MET   A HG3  1 1 
ATOM   4972 H  HE1  . MET   A 1 312 ? 9.817   38.315  -2.461  0   88.83 ? 1002 MET   A HE1  1 1 
ATOM   4973 H  HE2  . MET   A 1 312 ? 9.805   36.595  -2.046  0   88.04 ? 1002 MET   A HE2  1 1 
ATOM   4974 H  HE3  . MET   A 1 312 ? 10.529  37.109  -3.584  0   87.91 ? 1002 MET   A HE3  1 1 
ATOM   4975 N  N    . ASP   A 1 324 ? -16.996 16.207  -19.555 1   48.23 ? 1014 ASP   A N    1 1 
ATOM   4976 C  CA   . ASP   A 1 324 ? -16.089 15.211  -18.981 1   48.5  ? 1014 ASP   A CA   1 1 
ATOM   4977 C  C    . ASP   A 1 324 ? -15.12  14.658  -20.043 1   46.65 ? 1014 ASP   A C    1 1 
ATOM   4978 O  O    . ASP   A 1 324 ? -15.548 14.127  -21.073 1   46.69 ? 1014 ASP   A O    1 1 
ATOM   4979 C  CB   . ASP   A 1 324 ? -16.878 14.055  -18.33  1   51.9  ? 1014 ASP   A CB   1 1 
ATOM   4980 C  CG   . ASP   A 1 324 ? -17.561 14.402  -17.015 1   59.5  ? 1014 ASP   A CG   1 1 
ATOM   4981 O  OD1  . ASP   A 1 324 ? -17.447 15.572  -16.573 1   61.27 ? 1014 ASP   A OD1  1 1 
ATOM   4982 O  OD2  . ASP   A 1 324 ? -18.215 13.505  -16.428 1   62.16 ? 1014 ASP   A OD2  1 1 
ATOM   4983 H  HA   . ASP   A 1 324 ? -15.493 15.692  -18.207 0   52.88 ? 1014 ASP   A HA   1 1 
ATOM   4984 H  HB2  . ASP   A 1 324 ? -17.649 13.727  -19.025 0   57.66 ? 1014 ASP   A HB2  1 1 
ATOM   4985 H  HB3  . ASP   A 1 324 ? -16.191 13.233  -18.135 0   56.95 ? 1014 ASP   A HB3  1 1 
ATOM   4986 N  N    . GLU   A 1 325 ? -13.81  14.779  -19.78  1   44.62 ? 1015 GLU   A N    1 1 
ATOM   4987 C  CA   . GLU   A 1 325 ? -12.781 14.303  -20.705 1   42.76 ? 1015 GLU   A CA   1 1 
ATOM   4988 C  C    . GLU   A 1 325 ? -12.691 12.771  -20.725 1   40.28 ? 1015 GLU   A C    1 1 
ATOM   4989 O  O    . GLU   A 1 325 ? -12.233 12.223  -21.725 1   39.85 ? 1015 GLU   A O    1 1 
ATOM   4990 C  CB   . GLU   A 1 325 ? -11.403 14.889  -20.352 1   45.38 ? 1015 GLU   A CB   1 1 
ATOM   4991 C  CG   . GLU   A 1 325 ? -11.285 16.396  -20.532 1   52.12 ? 1015 GLU   A CG   1 1 
ATOM   4992 C  CD   . GLU   A 1 325 ? -11.844 17.243  -19.403 1   62.01 ? 1015 GLU   A CD   1 1 
ATOM   4993 O  OE1  . GLU   A 1 325 ? -11.669 16.862  -18.221 1   64.8  ? 1015 GLU   A OE1  1 1 
ATOM   4994 O  OE2  . GLU   A 1 325 ? -12.446 18.298  -19.704 1   64.9  ? 1015 GLU   A OE2  1 1 
ATOM   4995 H  H    . GLU   A 1 325 ? -13.436 15.178  -18.926 0   47.8  ? 1015 GLU   A H    1 1 
ATOM   4996 H  HA   . GLU   A 1 325 ? -13.029 14.634  -21.713 0   45.4  ? 1015 GLU   A HA   1 1 
ATOM   4997 H  HB2  . GLU   A 1 325 ? -11.162 14.634  -19.322 0   47.45 ? 1015 GLU   A HB2  1 1 
ATOM   4998 H  HB3  . GLU   A 1 325 ? -10.666 14.434  -21.013 0   47.03 ? 1015 GLU   A HB3  1 1 
ATOM   4999 H  HG2  . GLU   A 1 325 ? -10.231 16.647  -20.637 0   53.56 ? 1015 GLU   A HG2  1 1 
ATOM   5000 H  HG3  . GLU   A 1 325 ? -11.818 16.676  -21.44  0   54.13 ? 1015 GLU   A HG3  1 1 
ATOM   5001 N  N    . TYR   A 1 326 ? -13.124 12.081  -19.639 1   38.33 ? 1016 TYR   A N    1 1 
ATOM   5002 C  CA   . TYR   A 1 326 ? -13.074 10.624  -19.528 1   37.3  ? 1016 TYR   A CA   1 1 
ATOM   5003 C  C    . TYR   A 1 326 ? -14.474 10.072  -19.631 1   38.72 ? 1016 TYR   A C    1 1 
ATOM   5004 O  O    . TYR   A 1 326 ? -15.357 10.497  -18.874 1   38.56 ? 1016 TYR   A O    1 1 
ATOM   5005 C  CB   . TYR   A 1 326 ? -12.472 10.217  -18.168 1   35.5  ? 1016 TYR   A CB   1 1 
ATOM   5006 C  CG   . TYR   A 1 326 ? -11.081 10.764  -17.939 1   33.72 ? 1016 TYR   A CG   1 1 
ATOM   5007 C  CD1  . TYR   A 1 326 ? -10.89  12.028  -17.4   1   33.23 ? 1016 TYR   A CD1  1 1 
ATOM   5008 C  CD2  . TYR   A 1 326 ? -9.957  10.009  -18.244 1   33.26 ? 1016 TYR   A CD2  1 1 
ATOM   5009 C  CE1  . TYR   A 1 326 ? -9.616  12.551  -17.218 1   32.89 ? 1016 TYR   A CE1  1 1 
ATOM   5010 C  CE2  . TYR   A 1 326 ? -8.675  10.512  -18.045 1   33.27 ? 1016 TYR   A CE2  1 1 
ATOM   5011 C  CZ   . TYR   A 1 326 ? -8.507  11.794  -17.545 1   32.91 ? 1016 TYR   A CZ   1 1 
ATOM   5012 O  OH   . TYR   A 1 326 ? -7.25   12.297  -17.259 1   31.26 ? 1016 TYR   A OH   1 1 
ATOM   5013 H  H    . TYR   A 1 326 ? -13.505 12.509  -18.802 0   41.83 ? 1016 TYR   A H    1 1 
ATOM   5014 H  HA   . TYR   A 1 326 ? -12.452 10.193  -20.311 0   40.41 ? 1016 TYR   A HA   1 1 
ATOM   5015 H  HB2  . TYR   A 1 326 ? -13.115 10.579  -17.366 0   39.36 ? 1016 TYR   A HB2  1 1 
ATOM   5016 H  HB3  . TYR   A 1 326 ? -12.396 9.132   -18.127 0   39.18 ? 1016 TYR   A HB3  1 1 
ATOM   5017 H  HD1  . TYR   A 1 326 ? -11.747 12.638  -17.168 0   36.13 ? 1016 TYR   A HD1  1 1 
ATOM   5018 H  HD2  . TYR   A 1 326 ? -10.078 9.022   -18.659 0   35.79 ? 1016 TYR   A HD2  1 1 
ATOM   5019 H  HE1  . TYR   A 1 326 ? -9.491  13.532  -16.791 0   34.78 ? 1016 TYR   A HE1  1 1 
ATOM   5020 H  HE2  . TYR   A 1 326 ? -7.816  9.909   -18.284 0   34.82 ? 1016 TYR   A HE2  1 1 
ATOM   5021 H  HH   . TYR   A 1 326 ? -6.581  11.914  -17.883 0   32.16 ? 1016 TYR   A HH   1 1 
ATOM   5022 N  N    . LEU   A 1 327 ? -14.689 9.109   -20.54  1   39.59 ? 1017 LEU   A N    1 1 
ATOM   5023 C  CA   . LEU   A 1 327 ? -16.011 8.527   -20.734 1   41.22 ? 1017 LEU   A CA   1 1 
ATOM   5024 C  C    . LEU   A 1 327 ? -15.966 7.017   -20.894 1   41.88 ? 1017 LEU   A C    1 1 
ATOM   5025 O  O    . LEU   A 1 327 ? -14.941 6.457   -21.293 1   41.08 ? 1017 LEU   A O    1 1 
ATOM   5026 C  CB   . LEU   A 1 327 ? -16.692 9.172   -21.96  1   42.31 ? 1017 LEU   A CB   1 1 
ATOM   5027 C  CG   . LEU   A 1 327 ? -17.042 10.677  -21.824 1   44.68 ? 1017 LEU   A CG   1 1 
ATOM   5028 C  CD1  . LEU   A 1 327 ? -17.248 11.301  -23.152 1   45.29 ? 1017 LEU   A CD1  1 1 
ATOM   5029 C  CD2  . LEU   A 1 327 ? -18.295 10.899  -20.976 1   45.69 ? 1017 LEU   A CD2  1 1 
ATOM   5030 H  H    . LEU   A 1 327 ? -13.973 8.711   -21.142 0   43.71 ? 1017 LEU   A H    1 1 
ATOM   5031 H  HA   . LEU   A 1 327 ? -16.628 8.718   -19.858 0   47.08 ? 1017 LEU   A HA   1 1 
ATOM   5032 H  HB2  . LEU   A 1 327 ? -16.027 9.049   -22.813 0   47.36 ? 1017 LEU   A HB2  1 1 
ATOM   5033 H  HB3  . LEU   A 1 327 ? -17.622 8.638   -22.151 0   48.56 ? 1017 LEU   A HB3  1 1 
ATOM   5034 H  HG   . LEU   A 1 327 ? -16.218 11.2    -21.341 0   49.55 ? 1017 LEU   A HG   1 1 
ATOM   5035 H  HD11 . LEU   A 1 327 ? -17.471 12.359  -23.022 0   50.57 ? 1017 LEU   A HD11 1 1 
ATOM   5036 H  HD12 . LEU   A 1 327 ? -16.342 11.187  -23.745 0   49.97 ? 1017 LEU   A HD12 1 1 
ATOM   5037 H  HD13 . LEU   A 1 327 ? -18.08  10.805  -23.649 0   51.18 ? 1017 LEU   A HD13 1 1 
ATOM   5038 H  HD21 . LEU   A 1 327 ? -18.544 11.959  -20.978 0   51.97 ? 1017 LEU   A HD21 1 1 
ATOM   5039 H  HD22 . LEU   A 1 327 ? -19.118 10.324  -21.399 0   52.67 ? 1017 LEU   A HD22 1 1 
ATOM   5040 H  HD23 . LEU   A 1 327 ? -18.104 10.576  -19.954 0   52.13 ? 1017 LEU   A HD23 1 1 
ATOM   5041 N  N    . ILE   A 1 328 ? -17.107 6.361   -20.583 1   42.65 ? 1018 ILE   A N    1 1 
ATOM   5042 C  CA   . ILE   A 1 328 ? -17.264 4.908   -20.702 1   44.25 ? 1018 ILE   A CA   1 1 
ATOM   5043 C  C    . ILE   A 1 328 ? -17.133 4.542   -22.187 1   45.73 ? 1018 ILE   A C    1 1 
ATOM   5044 O  O    . ILE   A 1 328 ? -17.736 5.251   -23.001 1   45.53 ? 1018 ILE   A O    1 1 
ATOM   5045 C  CB   . ILE   A 1 328 ? -18.654 4.451   -20.12  1   45.27 ? 1018 ILE   A CB   1 1 
ATOM   5046 C  CG1  . ILE   A 1 328 ? -18.717 4.604   -18.572 1   46.55 ? 1018 ILE   A CG1  1 1 
ATOM   5047 C  CG2  . ILE   A 1 328 ? -19.034 3.029   -20.558 1   45.91 ? 1018 ILE   A CG2  1 1 
ATOM   5048 C  CD1  . ILE   A 1 328 ? -17.822 3.654   -17.677 1   48.24 ? 1018 ILE   A CD1  1 1 
ATOM   5049 H  H    . ILE   A 1 328 ? -17.948 6.837   -20.27  0   49.87 ? 1018 ILE   A H    1 1 
ATOM   5050 H  HA   . ILE   A 1 328 ? -16.465 4.458   -20.119 0   51.33 ? 1018 ILE   A HA   1 1 
ATOM   5051 H  HB   . ILE   A 1 328 ? -19.421 5.104   -20.534 0   54.06 ? 1018 ILE   A HB   1 1 
ATOM   5052 H  HG12 . ILE   A 1 328 ? -18.445 5.627   -18.318 0   54.82 ? 1018 ILE   A HG12 1 1 
ATOM   5053 H  HG13 . ILE   A 1 328 ? -19.749 4.432   -18.27  0   56.21 ? 1018 ILE   A HG13 1 1 
ATOM   5054 H  HG21 . ILE   A 1 328 ? -19.798 2.645   -19.885 0   56.13 ? 1018 ILE   A HG21 1 1 
ATOM   5055 H  HG22 . ILE   A 1 328 ? -19.43  3.054   -21.574 0   55.12 ? 1018 ILE   A HG22 1 1 
ATOM   5056 H  HG23 . ILE   A 1 328 ? -18.157 2.386   -20.515 0   55    ? 1018 ILE   A HG23 1 1 
ATOM   5057 H  HD11 . ILE   A 1 328 ? -17.97  3.93    -16.634 0   57.09 ? 1018 ILE   A HD11 1 1 
ATOM   5058 H  HD12 . ILE   A 1 328 ? -18.122 2.616   -17.814 0   57.45 ? 1018 ILE   A HD12 1 1 
ATOM   5059 H  HD13 . ILE   A 1 328 ? -16.77  3.775   -17.931 0   56.05 ? 1018 ILE   A HD13 1 1 
ATOM   5060 N  N    . PRO   A 1 329 ? -16.354 3.503   -22.601 1   47.2  ? 1019 PRO   A N    1 1 
ATOM   5061 C  CA   . PRO   A 1 329 ? -16.272 3.209   -24.042 1   48.56 ? 1019 PRO   A CA   1 1 
ATOM   5062 C  C    . PRO   A 1 329 ? -17.577 2.668   -24.624 1   50.57 ? 1019 PRO   A C    1 1 
ATOM   5063 O  O    . PRO   A 1 329 ? -18.263 1.869   -23.982 1   50.97 ? 1019 PRO   A O    1 1 
ATOM   5064 C  CB   . PRO   A 1 329 ? -15.176 2.143   -24.14  1   49.14 ? 1019 PRO   A CB   1 1 
ATOM   5065 C  CG   . PRO   A 1 329 ? -14.596 2.011   -22.805 1   49.28 ? 1019 PRO   A CG   1 1 
ATOM   5066 C  CD   . PRO   A 1 329 ? -15.549 2.542   -21.817 1   47.01 ? 1019 PRO   A CD   1 1 
ATOM   5067 H  HA   . PRO   A 1 329 ? -15.956 4.093   -24.593 0   54.9  ? 1019 PRO   A HA   1 1 
ATOM   5068 H  HB2  . PRO   A 1 329 ? -15.615 1.199   -24.459 0   56.32 ? 1019 PRO   A HB2  1 1 
ATOM   5069 H  HB3  . PRO   A 1 329 ? -14.416 2.467   -24.848 0   55.05 ? 1019 PRO   A HB3  1 1 
ATOM   5070 H  HG2  . PRO   A 1 329 ? -14.406 0.957   -22.605 0   56.05 ? 1019 PRO   A HG2  1 1 
ATOM   5071 H  HG3  . PRO   A 1 329 ? -13.663 2.57    -22.765 0   54.96 ? 1019 PRO   A HG3  1 1 
ATOM   5072 H  HD2  . PRO   A 1 329 ? -16.162 1.728   -21.433 0   54.73 ? 1019 PRO   A HD2  1 1 
ATOM   5073 H  HD3  . PRO   A 1 329 ? -14.974 3.023   -21.026 0   53.56 ? 1019 PRO   A HD3  1 1 
ATOM   5074 N  N    . GLN   A 1 330 ? -17.898 3.086   -25.852 1   51.63 ? 1020 GLN   A N    1 1 
ATOM   5075 C  CA   . GLN   A 1 330 ? -19.08  2.616   -26.577 1   53.42 ? 1020 GLN   A CA   1 1 
ATOM   5076 C  C    . GLN   A 1 330 ? -18.743 1.493   -27.581 1   54.75 ? 1020 GLN   A C    1 1 
ATOM   5077 O  O    . GLN   A 1 330 ? -19.666 0.849   -28.075 1   55.06 ? 1020 GLN   A O    1 1 
ATOM   5078 C  CB   . GLN   A 1 330 ? -19.745 3.784   -27.321 1   55.58 ? 1020 GLN   A CB   1 1 
ATOM   5079 C  CG   . GLN   A 1 330 ? -20.486 4.744   -26.393 1   60.73 ? 1020 GLN   A CG   1 1 
ATOM   5080 C  CD   . GLN   A 1 330 ? -21.034 5.975   -27.079 1   66.57 ? 1020 GLN   A CD   1 1 
ATOM   5081 O  OE1  . GLN   A 1 330 ? -20.904 7.085   -26.561 1   68.54 ? 1020 GLN   A OE1  1 1 
ATOM   5082 N  NE2  . GLN   A 1 330 ? -21.695 5.829   -28.229 1   67.91 ? 1020 GLN   A NE2  1 1 
ATOM   5083 H  H    . GLN   A 1 330 ? -17.343 3.749   -26.383 0   58.77 ? 1020 GLN   A H    1 1 
ATOM   5084 H  HA   . GLN   A 1 330 ? -19.808 2.206   -25.878 0   62.98 ? 1020 GLN   A HA   1 1 
ATOM   5085 H  HB2  . GLN   A 1 330 ? -18.99  4.35    -27.864 0   63.57 ? 1020 GLN   A HB2  1 1 
ATOM   5086 H  HB3  . GLN   A 1 330 ? -20.471 3.379   -28.025 0   65.05 ? 1020 GLN   A HB3  1 1 
ATOM   5087 H  HG2  . GLN   A 1 330 ? -21.319 4.216   -25.932 0   70.58 ? 1020 GLN   A HG2  1 1 
ATOM   5088 H  HG3  . GLN   A 1 330 ? -19.797 5.084   -25.622 0   69.1  ? 1020 GLN   A HG3  1 1 
ATOM   5089 H  HE21 . GLN   A 1 330 ? -21.873 4.915   -28.631 0   77.72 ? 1020 GLN   A HE21 1 1 
ATOM   5090 H  HE22 . GLN   A 1 330 ? -22.073 6.649   -28.692 0   77.47 ? 1020 GLN   A HE22 1 1 
ATOM   5091 N  N    . GLN   A 1 331 ? -17.441 1.267   -27.9   1   55.14 ? 1021 GLN   A N    1 1 
ATOM   5092 C  CA   . GLN   A 1 331 ? -17.003 0.255   -28.868 1   55.98 ? 1021 GLN   A CA   1 1 
ATOM   5093 C  C    . GLN   A 1 331 ? -15.907 -0.654  -28.281 1   56.62 ? 1021 GLN   A C    1 1 
ATOM   5094 O  O    . GLN   A 1 331 ? -15.302 -0.336  -27.255 1   56.77 ? 1021 GLN   A O    1 1 
ATOM   5095 C  CB   . GLN   A 1 331 ? -16.484 0.949   -30.146 1   57.23 ? 1021 GLN   A CB   1 1 
ATOM   5096 C  CG   . GLN   A 1 331 ? -17.466 1.972   -30.722 1   59.32 ? 1021 GLN   A CG   1 1 
ATOM   5097 C  CD   . GLN   A 1 331 ? -17.029 2.54    -32.041 1   61.79 ? 1021 GLN   A CD   1 1 
ATOM   5098 O  OE1  . GLN   A 1 331 ? -16.553 3.681   -32.114 1   61.87 ? 1021 GLN   A OE1  1 1 
ATOM   5099 N  NE2  . GLN   A 1 331 ? -17.209 1.772   -33.115 1   61.81 ? 1021 GLN   A NE2  1 1 
ATOM   5100 H  H    . GLN   A 1 331 ? -16.655 1.776   -27.509 0   62.52 ? 1021 GLN   A H    1 1 
ATOM   5101 H  HA   . GLN   A 1 331 ? -17.835 -0.386  -29.156 0   65.05 ? 1021 GLN   A HA   1 1 
ATOM   5102 H  HB2  . GLN   A 1 331 ? -15.555 1.467   -29.914 0   63.87 ? 1021 GLN   A HB2  1 1 
ATOM   5103 H  HB3  . GLN   A 1 331 ? -16.305 0.192   -30.908 0   64.85 ? 1021 GLN   A HB3  1 1 
ATOM   5104 H  HG2  . GLN   A 1 331 ? -18.433 1.493   -30.866 0   67.85 ? 1021 GLN   A HG2  1 1 
ATOM   5105 H  HG3  . GLN   A 1 331 ? -17.564 2.809   -30.033 0   66.74 ? 1021 GLN   A HG3  1 1 
ATOM   5106 H  HE21 . GLN   A 1 331 ? -17.622 0.848   -33.029 0   69.99 ? 1021 GLN   A HE21 1 1 
ATOM   5107 H  HE22 . GLN   A 1 331 ? -16.93  2.114   -34.029 0   68.98 ? 1021 GLN   A HE22 1 1 
HETATM 5108 NA NA   . NA    B 2 .   ? -6.888  9.224   -11.451 1   34.68 1 1101 NA    A NA   1 1 
HETATM 5109 NA NA   . NA    C 2 .   ? 8.243   4.728   -39.369 1   48.81 1 1102 NA    A NA   1 1 
HETATM 5110 C  C1   . GOL   D 3 .   ? 8.342   24.876  -42.74  1   53.71 ? 1103 GOL   A C1   1 1 
HETATM 5111 O  O1   . GOL   D 3 .   ? 8.016   24.1    -41.597 1   52.85 ? 1103 GOL   A O1   1 1 
HETATM 5112 C  C2   . GOL   D 3 .   ? 9.722   25.475  -42.6   1   54.34 ? 1103 GOL   A C2   1 1 
HETATM 5113 O  O2   . GOL   D 3 .   ? 10.693  24.442  -42.398 1   54.45 ? 1103 GOL   A O2   1 1 
HETATM 5114 C  C3   . GOL   D 3 .   ? 10.111  26.316  -43.793 1   54.71 ? 1103 GOL   A C3   1 1 
HETATM 5115 O  O3   . GOL   D 3 .   ? 11.46   26.743  -43.678 1   55.17 ? 1103 GOL   A O3   1 1 
HETATM 5116 C  C1   . EDO   E 4 .   ? -0.607  12.165  -44.92  0.5 27.54 ? 1104 EDO   A C1   1 1 
HETATM 5117 O  O1   . EDO   E 4 .   ? 0.606   11.457  -45.123 0.5 27.74 ? 1104 EDO   A O1   1 1 
HETATM 5118 C  C2   . EDO   E 4 .   ? -0.846  12.343  -43.43  0.5 28    ? 1104 EDO   A C2   1 1 
HETATM 5119 O  O2   . EDO   E 4 .   ? -2.019  11.656  -43.039 0.5 27.81 ? 1104 EDO   A O2   1 1 
HETATM 5120 N  N1   . A1IMT F 5 .   ? 0.425   14.664  -9.609  1   22.75 ? 1105 A1IMT A N1   1 1 
HETATM 5121 N  N3   . A1IMT F 5 .   ? -3.326  21.792  -10.575 1   24.95 ? 1105 A1IMT A N3   1 1 
HETATM 5122 C  C4   . A1IMT F 5 .   ? 1.204   13.103  -5.796  1   26.32 ? 1105 A1IMT A C4   1 1 
HETATM 5123 C  C5   . A1IMT F 5 .   ? 0.555   14.317  -5.894  1   25.66 ? 1105 A1IMT A C5   1 1 
HETATM 5124 C  C6   . A1IMT F 5 .   ? 0.258   14.859  -7.133  1   24.93 ? 1105 A1IMT A C6   1 1 
HETATM 5125 C  C7   . A1IMT F 5 .   ? 0.731   14.225  -8.292  1   24.39 ? 1105 A1IMT A C7   1 1 
HETATM 5126 C  C8   . A1IMT F 5 .   ? -0.247  15.759  -10.094 1   22.02 ? 1105 A1IMT A C8   1 1 
HETATM 5127 C  C10  . A1IMT F 5 .   ? 0.701   17.907  -8.996  1   21.15 ? 1105 A1IMT A C10  1 1 
HETATM 5128 C  C13  . A1IMT F 5 .   ? 1.712   19.999  -8.306  1   22.06 ? 1105 A1IMT A C13  1 1 
HETATM 5129 C  C15  . A1IMT F 5 .   ? -0.592  20.052  -9.064  1   22.86 ? 1105 A1IMT A C15  1 1 
HETATM 5130 C  C17  . A1IMT F 5 .   ? -2.897  21.382  -9.223  1   25.1  ? 1105 A1IMT A C17  1 1 
HETATM 5131 C  C20  . A1IMT F 5 .   ? -3.934  23.14   -10.565 1   25.24 ? 1105 A1IMT A C20  1 1 
HETATM 5132 C  C21  . A1IMT F 5 .   ? -3.224  21.034  -11.715 1   25.1  ? 1105 A1IMT A C21  1 1 
HETATM 5133 C  C22  . A1IMT F 5 .   ? -3.967  21.525  -12.889 1   25.31 ? 1105 A1IMT A C22  1 1 
HETATM 5134 C  C24  . A1IMT F 5 .   ? -4.936  20.942  -15.123 1   25.36 ? 1105 A1IMT A C24  1 1 
HETATM 5135 C  C26  . A1IMT F 5 .   ? -7.136  20.165  -15.732 1   26.95 ? 1105 A1IMT A C26  1 1 
HETATM 5136 C  C28  . A1IMT F 5 .   ? -2.024  16.736  -11.084 1   21.27 ? 1105 A1IMT A C28  1 1 
HETATM 5137 C  C1   . A1IMT F 5 .   ? 1.346   11.062  -9.547  1   25.81 ? 1105 A1IMT A C1   1 1 
HETATM 5138 O  O1   . A1IMT F 5 .   ? 1.727   12.413  -9.374  1   25.48 ? 1105 A1IMT A O1   1 1 
HETATM 5139 C  C2   . A1IMT F 5 .   ? 1.458   13.03   -8.185  1   25.43 ? 1105 A1IMT A C2   1 1 
HETATM 5140 C  C3   . A1IMT F 5 .   ? 1.559   12.423  -6.94   1   27.32 ? 1105 A1IMT A C3   1 1 
HETATM 5141 C  C9   . A1IMT F 5 .   ? -0.332  17.084  -9.659  1   21.59 ? 1105 A1IMT A C9   1 1 
HETATM 5142 C  C11  . A1IMT F 5 .   ? 1.947   17.337  -8.746  1   20.87 ? 1105 A1IMT A C11  1 1 
HETATM 5143 C  C12  . A1IMT F 5 .   ? 2.969   18.106  -8.228  1   21.83 ? 1105 A1IMT A C12  1 1 
HETATM 5144 N  N2   . A1IMT F 5 .   ? 2.86    19.411  -7.976  1   22.32 ? 1105 A1IMT A N2   1 1 
HETATM 5145 C  C14  . A1IMT F 5 .   ? 0.622   19.312  -8.828  1   21.77 ? 1105 A1IMT A C14  1 1 
HETATM 5146 C  C16  . A1IMT F 5 .   ? -1.625  20.648  -9.135  1   23.92 ? 1105 A1IMT A C16  1 1 
HETATM 5147 C  C18  . A1IMT F 5 .   ? -2.732  22.754  -8.586  1   25.6  ? 1105 A1IMT A C18  1 1 
HETATM 5148 C  C19  . A1IMT F 5 .   ? -3.897  23.552  -9.104  1   25.81 ? 1105 A1IMT A C19  1 1 
HETATM 5149 O  O2   . A1IMT F 5 .   ? -2.622  19.966  -11.727 1   24.48 ? 1105 A1IMT A O2   1 1 
HETATM 5150 C  C23  . A1IMT F 5 .   ? -3.882  20.932  -14.067 1   24.82 ? 1105 A1IMT A C23  1 1 
HETATM 5151 N  N4   . A1IMT F 5 .   ? -6.127  20.201  -14.674 1   26.06 ? 1105 A1IMT A N4   1 1 
HETATM 5152 C  C25  . A1IMT F 5 .   ? -5.83   18.804  -14.285 1   26.15 ? 1105 A1IMT A C25  1 1 
HETATM 5153 C  C27  . A1IMT F 5 .   ? -3.995  20.506  -8.635  1   25.47 ? 1105 A1IMT A C27  1 1 
HETATM 5154 N  N5   . A1IMT F 5 .   ? -1.333  17.675  -10.403 1   21.56 ? 1105 A1IMT A N5   1 1 
HETATM 5155 C  C29  . A1IMT F 5 .   ? -1.399  15.53   -10.9   1   21.18 ? 1105 A1IMT A C29  1 1 
HETATM 5156 C  C30  . A1IMT F 5 .   ? -1.99   14.298  -11.415 1   20.9  ? 1105 A1IMT A C30  1 1 
HETATM 5157 O  O3   . A1IMT F 5 .   ? -1.576  13.162  -11.14  1   20.93 ? 1105 A1IMT A O3   1 1 
HETATM 5158 N  N6   . A1IMT F 5 .   ? -3.084  14.474  -12.192 1   20.72 ? 1105 A1IMT A N6   1 1 
HETATM 5159 C  C31  . A1IMT F 5 .   ? -3.45   15.746  -12.804 1   21.27 ? 1105 A1IMT A C31  1 1 
HETATM 5160 C  C32  . A1IMT F 5 .   ? -3.276  16.947  -11.879 1   21.26 ? 1105 A1IMT A C32  1 1 
HETATM 5161 CL CL1  . A1IMT F 5 .   ? 2.501   10.978  -6.812  1   29.56 ? 1105 A1IMT A CL1  1 1 
HETATM 5162 O  O    . HOH   G 6 .   ? 8.991   33.068  -23.614 1   40.37 ? 1201 HOH   A O    1 ? 
HETATM 5163 O  O    . HOH   G 6 .   ? -0.756  7.214   9.342   1   49.93 ? 1202 HOH   A O    1 ? 
HETATM 5164 O  O    . HOH   G 6 .   ? 6.897   4.193   -37.664 1   40.08 ? 1203 HOH   A O    1 ? 
HETATM 5165 O  O    . HOH   G 6 .   ? -0.099  28.524  -14.376 1   46.83 ? 1204 HOH   A O    1 ? 
HETATM 5166 O  O    . HOH   G 6 .   ? 2.863   33.245  -27.37  1   32.36 ? 1205 HOH   A O    1 ? 
HETATM 5167 O  O    . HOH   G 6 .   ? 2.047   6.997   6.515   1   40.6  ? 1206 HOH   A O    1 ? 
HETATM 5168 O  O    . HOH   G 6 .   ? -13.638 17.675  -38.013 1   32.55 ? 1207 HOH   A O    1 ? 
HETATM 5169 O  O    . HOH   G 6 .   ? 10.038  19.808  -3.242  1   45.14 ? 1208 HOH   A O    1 ? 
HETATM 5170 O  O    . HOH   G 6 .   ? -2.421  0.861   -13.725 1   42.49 ? 1209 HOH   A O    1 ? 
HETATM 5171 O  O    . HOH   G 6 .   ? 11.178  8.252   -5.763  1   47.43 ? 1210 HOH   A O    1 ? 
HETATM 5172 O  O    . HOH   G 6 .   ? -6.16   10.284  -9.611  1   36.31 ? 1211 HOH   A O    1 ? 
HETATM 5173 O  O    . HOH   G 6 .   ? -14.645 3.146   -27.306 1   51.74 ? 1212 HOH   A O    1 ? 
HETATM 5174 O  O    . HOH   G 6 .   ? -0.351  13.384  4.641   1   49.11 ? 1213 HOH   A O    1 ? 
HETATM 5175 O  O    . HOH   G 6 .   ? -19.32  8.687   -25.388 1   45.39 ? 1214 HOH   A O    1 ? 
HETATM 5176 O  O    . HOH   G 6 .   ? 8.569   6.873   -9.1    1   29.71 ? 1215 HOH   A O    1 ? 
HETATM 5177 O  O    . HOH   G 6 .   ? -5.543  13.96   -15.107 1   29.35 ? 1216 HOH   A O    1 ? 
HETATM 5178 O  O    . HOH   G 6 .   ? -1.998  0.673   -31.119 1   35.47 ? 1217 HOH   A O    1 ? 
HETATM 5179 O  O    . HOH   G 6 .   ? -7.766  15.401  -43.288 1   29.25 ? 1218 HOH   A O    1 ? 
HETATM 5180 O  O    . HOH   G 6 .   ? 16.371  4.933   -25.189 1   51.2  ? 1219 HOH   A O    1 ? 
HETATM 5181 O  O    . HOH   G 6 .   ? -6.918  7.979   -1.932  1   32.51 ? 1220 HOH   A O    1 ? 
HETATM 5182 O  O    . HOH   G 6 .   ? -4.667  8.994   -11.501 1   26.58 ? 1221 HOH   A O    1 ? 
HETATM 5183 O  O    . HOH   G 6 .   ? 1.552   33.831  -35.545 1   37.84 ? 1222 HOH   A O    1 ? 
HETATM 5184 O  O    . HOH   G 6 .   ? -5.141  18.203  -21.269 1   16.37 ? 1223 HOH   A O    1 ? 
HETATM 5185 O  O    . HOH   G 6 .   ? 17.257  25.902  -40.255 1   32.34 ? 1224 HOH   A O    1 ? 
HETATM 5186 O  O    . HOH   G 6 .   ? 9.589   29.241  -41.688 1   41.73 ? 1225 HOH   A O    1 ? 
HETATM 5187 O  O    . HOH   G 6 .   ? -12.402 13.138  -24.151 1   19.99 ? 1226 HOH   A O    1 ? 
HETATM 5188 O  O    . HOH   G 6 .   ? -12.851 19.03   -25.988 1   29.66 ? 1227 HOH   A O    1 ? 
HETATM 5189 O  O    . HOH   G 6 .   ? -17.047 4.874   -36.025 1   40.07 ? 1228 HOH   A O    1 ? 
HETATM 5190 O  O    . HOH   G 6 .   ? -0.374  -4.864  -19.254 1   46.91 ? 1229 HOH   A O    1 ? 
HETATM 5191 O  O    . HOH   G 6 .   ? 7.394   5.135   -29.866 1   20.97 ? 1230 HOH   A O    1 ? 
HETATM 5192 O  O    . HOH   G 6 .   ? -6.41   0.565   -11.526 1   48.8  ? 1231 HOH   A O    1 ? 
HETATM 5193 O  O    . HOH   G 6 .   ? -8.591  -1.442  -18.15  1   41.26 ? 1232 HOH   A O    1 ? 
HETATM 5194 O  O    . HOH   G 6 .   ? 9.804   33.441  -37.777 1   45.95 ? 1233 HOH   A O    1 ? 
HETATM 5195 O  O    . HOH   G 6 .   ? 0.04    26.076  -14.226 1   26.25 ? 1234 HOH   A O    1 ? 
HETATM 5196 O  O    . HOH   G 6 .   ? -9.436  10.481  -30.496 1   15.19 ? 1235 HOH   A O    1 ? 
HETATM 5197 O  O    . HOH   G 6 .   ? 11.388  18.489  -39.832 1   47.57 ? 1236 HOH   A O    1 ? 
HETATM 5198 O  O    . HOH   G 6 .   ? 13.527  21.595  0.824   1   57.01 ? 1237 HOH   A O    1 ? 
HETATM 5199 O  O    . HOH   G 6 .   ? -5.068  6.396   -9.146  1   38.5  ? 1238 HOH   A O    1 ? 
HETATM 5200 O  O    . HOH   G 6 .   ? 3.109   -3.103  -39.424 1   62.87 ? 1239 HOH   A O    1 ? 
HETATM 5201 O  O    . HOH   G 6 .   ? 0.036   -0.928  -37.444 1   36.43 ? 1240 HOH   A O    1 ? 
HETATM 5202 O  O    . HOH   G 6 .   ? -5.506  29.428  -29.321 1   47.18 ? 1241 HOH   A O    1 ? 
HETATM 5203 O  O    . HOH   G 6 .   ? 8.373   33.016  -33.963 1   26.26 ? 1242 HOH   A O    1 ? 
HETATM 5204 O  O    . HOH   G 6 .   ? -3.114  13.337  8.009   1   60.8  ? 1243 HOH   A O    1 ? 
HETATM 5205 O  O    . HOH   G 6 .   ? 7.762   17.202  -40.117 1   24.19 ? 1244 HOH   A O    1 ? 
HETATM 5206 O  O    . HOH   G 6 .   ? -23.829 9.446   -30.114 1   31.18 ? 1245 HOH   A O    1 ? 
HETATM 5207 O  O    . HOH   G 6 .   ? -22.174 16.725  -33.672 1   21.31 ? 1246 HOH   A O    1 ? 
HETATM 5208 O  O    . HOH   G 6 .   ? -10.774 1.401   -23.699 1   26.05 ? 1247 HOH   A O    1 ? 
HETATM 5209 O  O    . HOH   G 6 .   ? 11.665  32.26   -28.554 1   38.23 ? 1248 HOH   A O    1 ? 
HETATM 5210 O  O    . HOH   G 6 .   ? 6.041   31.856  -15.138 1   28.93 ? 1249 HOH   A O    1 ? 
HETATM 5211 O  O    . HOH   G 6 .   ? 13.882  3.865   -27.211 1   48.69 ? 1250 HOH   A O    1 ? 
HETATM 5212 O  O    . HOH   G 6 .   ? -14.745 14.978  -44.183 1   49.96 ? 1251 HOH   A O    1 ? 
HETATM 5213 O  O    . HOH   G 6 .   ? 4.667   4.329   -23.936 1   22.42 ? 1252 HOH   A O    1 ? 
HETATM 5214 O  O    . HOH   G 6 .   ? 15.361  5.202   -34.89  1   48.47 ? 1253 HOH   A O    1 ? 
HETATM 5215 O  O    . HOH   G 6 .   ? -4.979  3.404   -10.997 1   33.76 ? 1254 HOH   A O    1 ? 
HETATM 5216 O  O    . HOH   G 6 .   ? 8.014   14.139  -39.465 1   46.18 ? 1255 HOH   A O    1 ? 
HETATM 5217 O  O    . HOH   G 6 .   ? 9.701   12.641  -35.853 1   38.1  ? 1256 HOH   A O    1 ? 
HETATM 5218 O  O    . HOH   G 6 .   ? -6.395  11.016  -12.691 1   27.37 ? 1257 HOH   A O    1 ? 
HETATM 5219 O  O    . HOH   G 6 .   ? 12.95   17.173  -9.601  1   64.92 ? 1258 HOH   A O    1 ? 
HETATM 5220 O  O    . HOH   G 6 .   ? 14.475  9.178   -23.066 1   24.53 ? 1259 HOH   A O    1 ? 
HETATM 5221 O  O    . HOH   G 6 .   ? 3.023   -0.843  -40.966 1   32.84 ? 1260 HOH   A O    1 ? 
HETATM 5222 O  O    . HOH   G 6 .   ? 5.298   8.798   -39.464 1   25    ? 1261 HOH   A O    1 ? 
HETATM 5223 O  O    . HOH   G 6 .   ? 6.966   1.946   -30.479 1   30.09 ? 1262 HOH   A O    1 ? 
HETATM 5224 O  O    . HOH   G 6 .   ? 11.456  32.412  -3.435  1   51.35 ? 1263 HOH   A O    1 ? 
HETATM 5225 O  O    . HOH   G 6 .   ? -22.27  20.986  -29.764 1   23.12 ? 1264 HOH   A O    1 ? 
HETATM 5226 O  O    . HOH   G 6 .   ? -1.536  25.764  -44.161 1   19.56 ? 1265 HOH   A O    1 ? 
HETATM 5227 O  O    . HOH   G 6 .   ? -5.483  30.085  -24.745 1   39.38 ? 1266 HOH   A O    1 ? 
HETATM 5228 O  O    . HOH   G 6 .   ? -12.205 1.914   -39.003 1   42.67 ? 1267 HOH   A O    1 ? 
HETATM 5229 O  O    . HOH   G 6 .   ? -12.772 10.939  -11.426 1   68.13 ? 1268 HOH   A O    1 ? 
HETATM 5230 O  O    . HOH   G 6 .   ? 19.155  33.898  -7.942  1   33.73 ? 1269 HOH   A O    1 ? 
HETATM 5231 O  O    . HOH   G 6 .   ? -18.257 7.652   -33.768 1   26.54 ? 1270 HOH   A O    1 ? 
HETATM 5232 O  O    . HOH   G 6 .   ? -4.923  8.698   -15.444 1   22.02 ? 1271 HOH   A O    1 ? 
HETATM 5233 O  O    . HOH   G 6 .   ? 13.335  26.231  -22.713 1   43.49 ? 1272 HOH   A O    1 ? 
HETATM 5234 O  O    . HOH   G 6 .   ? 3.434   -1.505  -27.743 1   29.35 ? 1273 HOH   A O    1 ? 
HETATM 5235 O  O    . HOH   G 6 .   ? 16.498  8.503   -17.715 1   40.45 ? 1274 HOH   A O    1 ? 
HETATM 5236 O  O    . HOH   G 6 .   ? 8.227   7.453   -11.696 1   49.84 ? 1275 HOH   A O    1 ? 
HETATM 5237 O  O    . HOH   G 6 .   ? -5.703  28.475  -16.53  1   45.28 ? 1276 HOH   A O    1 ? 
HETATM 5238 O  O    . HOH   G 6 .   ? -6.002  3.183   -36.066 1   21.03 ? 1277 HOH   A O    1 ? 
HETATM 5239 O  O    . HOH   G 6 .   ? 16.338  30.69   -28.308 1   62.73 ? 1278 HOH   A O    1 ? 
HETATM 5240 O  O    . HOH   G 6 .   ? -9.008  9.853   -11.101 1   56.94 ? 1279 HOH   A O    1 ? 
HETATM 5241 O  O    . HOH   G 6 .   ? -7.055  21.165  -23.861 1   19.09 ? 1280 HOH   A O    1 ? 
HETATM 5242 O  O    . HOH   G 6 .   ? -21.975 16.361  -36.971 1   32.38 ? 1281 HOH   A O    1 ? 
HETATM 5243 O  O    . HOH   G 6 .   ? 9.523   -1.353  -24.999 1   42.61 ? 1282 HOH   A O    1 ? 
HETATM 5244 O  O    . HOH   G 6 .   ? 12.955  33.202  -21.549 1   53.27 ? 1283 HOH   A O    1 ? 
HETATM 5245 O  O    . HOH   G 6 .   ? 13.822  20.817  -41.63  1   59.43 ? 1284 HOH   A O    1 ? 
HETATM 5246 O  O    . HOH   G 6 .   ? 6.554   15.778  -8.847  1   28.53 ? 1285 HOH   A O    1 ? 
HETATM 5247 O  O    . HOH   G 6 .   ? -17.56  5.788   -39.734 1   41.2  ? 1286 HOH   A O    1 ? 
HETATM 5248 O  O    . HOH   G 6 .   ? 15.4    30.75   -34.937 1   39.57 ? 1287 HOH   A O    1 ? 
HETATM 5249 O  O    . HOH   G 6 .   ? 0.31    28.15   -39.893 1   45.22 ? 1288 HOH   A O    1 ? 
HETATM 5250 O  O    . HOH   G 6 .   ? 16.594  23.242  -39.419 1   33.2  ? 1289 HOH   A O    1 ? 
HETATM 5251 O  O    . HOH   G 6 .   ? 2.146   37.086  -29.586 1   48.81 ? 1290 HOH   A O    1 ? 
HETATM 5252 O  O    . HOH   G 6 .   ? 0.062   -2.552  -40.477 1   48.92 ? 1291 HOH   A O    1 ? 
HETATM 5253 O  O    . HOH   G 6 .   ? -2.146  4.648   -25.232 1   18.66 ? 1292 HOH   A O    1 ? 
HETATM 5254 O  O    . HOH   G 6 .   ? 9.569   21.647  -5.243  1   52.63 ? 1293 HOH   A O    1 ? 
HETATM 5255 O  O    . HOH   G 6 .   ? 9.289   13.583  -6.67   1   34.08 ? 1294 HOH   A O    1 ? 
HETATM 5256 O  O    . HOH   G 6 .   ? -17.053 7.95    -40.795 1   32.04 ? 1295 HOH   A O    1 ? 
HETATM 5257 O  O    . HOH   G 6 .   ? 16.358  17.434  -20.855 1   41.88 ? 1296 HOH   A O    1 ? 
HETATM 5258 O  O    . HOH   G 6 .   ? -7.776  28.501  -26.83  1   57.25 ? 1297 HOH   A O    1 ? 
HETATM 5259 O  O    . HOH   G 6 .   ? -3.713  6.843   -25.478 1   21.13 ? 1298 HOH   A O    1 ? 
HETATM 5260 O  O    . HOH   G 6 .   ? 9.908   4.26    -37.8   1   34.91 ? 1299 HOH   A O    1 ? 
HETATM 5261 O  O    . HOH   G 6 .   ? -7.65   12.507  -30.951 1   16.24 ? 1300 HOH   A O    1 ? 
HETATM 5262 O  O    . HOH   G 6 .   ? -18.692 16.001  -37.663 1   36.28 ? 1301 HOH   A O    1 ? 
HETATM 5263 O  O    . HOH   G 6 .   ? -7.169  7.185   -10.58  1   36.02 ? 1302 HOH   A O    1 ? 
HETATM 5264 O  O    . HOH   G 6 .   ? -10.844 24.293  -29.675 1   45.77 ? 1303 HOH   A O    1 ? 
HETATM 5265 O  O    . HOH   G 6 .   ? -3.287  12.621  -39.628 1   14.19 ? 1304 HOH   A O    1 ? 
HETATM 5266 O  O    . HOH   G 6 .   ? 9.194   -0.523  -27.744 1   37.7  ? 1305 HOH   A O    1 ? 
HETATM 5267 O  O    . HOH   G 6 .   ? 10.869  34.149  -26.474 1   45.05 ? 1306 HOH   A O    1 ? 
HETATM 5268 O  O    . HOH   G 6 .   ? -6.35   25.399  -11.938 1   59.06 ? 1307 HOH   A O    1 ? 
HETATM 5269 O  O    . HOH   G 6 .   ? -4.23   27.101  -12.296 1   62.39 ? 1308 HOH   A O    1 ? 
HETATM 5270 O  O    . HOH   G 6 .   ? -15.398 -1.409  -32.882 1   42.28 ? 1309 HOH   A O    1 ? 
HETATM 5271 O  O    . HOH   G 6 .   ? -9.709  6.759   -42.4   1   31.03 ? 1310 HOH   A O    1 ? 
HETATM 5272 O  O    . HOH   G 6 .   ? 3.744   3.398   -43.927 1   26.71 ? 1311 HOH   A O    1 ? 
HETATM 5273 O  O    . HOH   G 6 .   ? -14.215 12.23   -45.675 1   51.7  ? 1312 HOH   A O    1 ? 
HETATM 5274 O  O    . HOH   G 6 .   ? -24.351 5.165   -28.1   1   53.66 ? 1313 HOH   A O    1 ? 
HETATM 5275 O  O    . HOH   G 6 .   ? -18.833 11.692  -38.725 1   35.12 ? 1314 HOH   A O    1 ? 
HETATM 5276 O  O    . HOH   G 6 .   ? -11.823 1.098   -21.096 1   27.52 ? 1315 HOH   A O    1 ? 
HETATM 5277 O  O    . HOH   G 6 .   ? 17.708  17.173  -27.194 1   26.93 ? 1316 HOH   A O    1 ? 
HETATM 5278 O  O    . HOH   G 6 .   ? 7.219   -2.632  -24.408 1   32.13 ? 1317 HOH   A O    1 ? 
HETATM 5279 O  O    . HOH   G 6 .   ? 17.816  23.101  -37.066 1   27.06 ? 1318 HOH   A O    1 ? 
HETATM 5280 O  O    . HOH   G 6 .   ? 6.638   5.55    -40.695 1   29.78 ? 1319 HOH   A O    1 ? 
HETATM 5281 O  O    . HOH   G 6 .   ? -5.057  8.498   -23.854 1   29.56 ? 1320 HOH   A O    1 ? 
HETATM 5282 O  O    . HOH   G 6 .   ? 12.142  13.215  -12.136 1   32.17 ? 1321 HOH   A O    1 ? 
HETATM 5283 O  O    . HOH   G 6 .   ? -5.181  5.562   -27.365 1   20.21 ? 1322 HOH   A O    1 ? 
HETATM 5284 O  O    . HOH   G 6 .   ? -4.451  11.018  -41.908 1   47.44 ? 1323 HOH   A O    1 ? 
HETATM 5285 O  O    . HOH   G 6 .   ? -2.311  2.674   -12.293 1   31.85 ? 1324 HOH   A O    1 ? 
HETATM 5286 O  O    . HOH   G 6 .   ? 13.64   11.858  -36.374 1   29.46 ? 1325 HOH   A O    1 ? 
HETATM 5287 O  O    . HOH   G 6 .   ? -15.027 26.396  -25.33  1   51.78 ? 1326 HOH   A O    1 ? 
HETATM 5288 O  O    . HOH   G 6 .   ? 15.054  24.417  -15.021 1   35.89 ? 1327 HOH   A O    1 ? 
HETATM 5289 O  O    . HOH   G 6 .   ? -19.768 6.042   -30.514 1   39.53 ? 1328 HOH   A O    1 ? 
HETATM 5290 O  O    . HOH   G 6 .   ? -11.051 -1.635  -37.192 1   51.59 ? 1329 HOH   A O    1 ? 
HETATM 5291 O  O    . HOH   G 6 .   ? 8.446   6.835   -38.425 1   35.82 ? 1330 HOH   A O    1 ? 
HETATM 5292 O  O    . HOH   G 6 .   ? 4.172   23.198  0.243   1   46.78 ? 1331 HOH   A O    1 ? 
HETATM 5293 O  O    . HOH   G 6 .   ? 12.767  -3.055  -20.453 1   62.44 ? 1332 HOH   A O    1 ? 
HETATM 5294 O  O    . HOH   G 6 .   ? -6.992  26.332  -17.151 1   30.3  ? 1333 HOH   A O    1 ? 
HETATM 5295 O  O    . HOH   G 6 .   ? -1.67   28.715  -32.471 1   21.95 ? 1334 HOH   A O    1 ? 
HETATM 5296 O  O    . HOH   G 6 .   ? 2.442   -6.586  -16.74  1   48.31 ? 1335 HOH   A O    1 ? 
HETATM 5297 O  O    . HOH   G 6 .   ? 15.458  13.644  -12.045 1   40.71 ? 1336 HOH   A O    1 ? 
HETATM 5298 O  O    . HOH   G 6 .   ? -14.958 21.98   -33.085 1   47.02 ? 1337 HOH   A O    1 ? 
HETATM 5299 O  O    . HOH   G 6 .   ? -8.714  19.869  -39.595 1   39.23 ? 1338 HOH   A O    1 ? 
HETATM 5300 O  O    . HOH   G 6 .   ? 17.526  30.024  -9.05   1   42.09 ? 1339 HOH   A O    1 ? 
HETATM 5301 O  O    . HOH   G 6 .   ? 12.342  9.702   -0.959  1   45.55 ? 1340 HOH   A O    1 ? 
HETATM 5302 O  O    . HOH   G 6 .   ? -15.072 14.401  -23.814 1   41.58 ? 1341 HOH   A O    1 ? 
HETATM 5303 O  O    . HOH   G 6 .   ? -7.773  21.326  -12.714 1   30.03 ? 1342 HOH   A O    1 ? 
HETATM 5304 O  O    . HOH   G 6 .   ? 9.988   6.017   5.489   1   62.15 ? 1343 HOH   A O    1 ? 
HETATM 5305 O  O    . HOH   G 6 .   ? -7.729  24.048  -14.656 1   65.48 ? 1344 HOH   A O    1 ? 
HETATM 5306 O  O    . HOH   G 6 .   ? 6.546   18.625  -44.116 1   30.28 ? 1345 HOH   A O    1 ? 
HETATM 5307 O  O    . HOH   G 6 .   ? -21.215 12.38   -37.796 1   38.95 ? 1346 HOH   A O    1 ? 
HETATM 5308 O  O    . HOH   G 6 .   ? 15.457  22.185  -13.628 1   43.61 ? 1347 HOH   A O    1 ? 
HETATM 5309 O  O    . HOH   G 6 .   ? -1.94   7.002   -16.75  1   20.18 ? 1348 HOH   A O    1 ? 
HETATM 5310 O  O    . HOH   G 6 .   ? 2.349   24.011  2.539   1   43.46 ? 1349 HOH   A O    1 ? 
HETATM 5311 O  O    . HOH   G 6 .   ? 6.129   -4.506  -25.831 1   42.77 ? 1350 HOH   A O    1 ? 
HETATM 5312 O  O    . HOH   G 6 .   ? -16.008 7.889   -30.766 1   22.14 ? 1351 HOH   A O    1 ? 
HETATM 5313 O  O    . HOH   G 6 .   ? -7.881  26.385  -31.337 1   37.81 ? 1352 HOH   A O    1 ? 
HETATM 5314 O  O    . HOH   G 6 .   ? 7.863   5.829   8.399   1   51.38 ? 1353 HOH   A O    1 ? 
HETATM 5315 O  O    . HOH   G 6 .   ? 10.294  7.247   -13.284 1   47.09 ? 1354 HOH   A O    1 ? 
HETATM 5316 O  O    . HOH   G 6 .   ? -6.633  14.761  -34.749 1   15.4  ? 1355 HOH   A O    1 ? 
HETATM 5317 O  O    . HOH   G 6 .   ? -5.591  23.261  5.276   1   35.73 ? 1356 HOH   A O    1 ? 
HETATM 5318 O  O    . HOH   G 6 .   ? -0.976  -6.411  -21.421 1   49.8  ? 1357 HOH   A O    1 ? 
HETATM 5319 O  O    . HOH   G 6 .   ? 5.547   -0.11   -33.908 1   45.21 ? 1358 HOH   A O    1 ? 
HETATM 5320 O  O    . HOH   G 6 .   ? -6.452  26.441  -36.185 1   38.64 ? 1359 HOH   A O    1 ? 
HETATM 5321 O  O    . HOH   G 6 .   ? 1.585   23.781  -7.8    1   36.02 ? 1360 HOH   A O    1 ? 
HETATM 5322 O  O    . HOH   G 6 .   ? -9.691  1.404   -19.29  1   29.61 ? 1361 HOH   A O    1 ? 
HETATM 5323 O  O    . HOH   G 6 .   ? -7.811  -1.05   -15.064 1   43.24 ? 1362 HOH   A O    1 ? 
HETATM 5324 O  O    . HOH   G 6 .   ? 11.642  35.675  -11.869 1   50.3  ? 1363 HOH   A O    1 ? 
HETATM 5325 O  O    . HOH   G 6 .   ? -3.84   27.477  -39.652 1   35.6  ? 1364 HOH   A O    1 ? 
HETATM 5326 O  O    . HOH   G 6 .   ? 14.793  16.253  -12.234 1   56.35 ? 1365 HOH   A O    1 ? 
HETATM 5327 O  O    . HOH   G 6 .   ? -1.472  8.275   -23.784 1   13.53 ? 1366 HOH   A O    1 ? 
HETATM 5328 O  O    . HOH   G 6 .   ? -9.953  21.86   -20.483 1   25.29 ? 1367 HOH   A O    1 ? 
HETATM 5329 O  O    . HOH   G 6 .   ? -7.495  1.15    -16.835 1   38.02 ? 1368 HOH   A O    1 ? 
HETATM 5330 O  O    . HOH   G 6 .   ? 3.437   -3.645  -33.846 1   51.55 ? 1369 HOH   A O    1 ? 
HETATM 5331 O  O    . HOH   G 6 .   ? -17.74  -3.315  -21.794 1   52.72 ? 1370 HOH   A O    1 ? 
HETATM 5332 O  O    . HOH   G 6 .   ? 15.777  18.365  -23.334 1   41.63 ? 1371 HOH   A O    1 ? 
HETATM 5333 O  O    . HOH   G 6 .   ? 11.461  9.524   -13.092 1   30.34 ? 1372 HOH   A O    1 ? 
HETATM 5334 O  O    . HOH   G 6 .   ? -15.001 17.025  -24.451 1   34.42 ? 1373 HOH   A O    1 ? 
HETATM 5335 O  O    . HOH   G 6 .   ? -13.602 -5.163  -23.103 1   63.53 ? 1374 HOH   A O    1 ? 
HETATM 5336 O  O    . HOH   G 6 .   ? 10.902  1.345   -6.39   1   32.7  ? 1375 HOH   A O    1 ? 
HETATM 5337 O  O    . HOH   G 6 .   ? 11.311  22.101  -7.824  1   59.06 ? 1376 HOH   A O    1 ? 
HETATM 5338 O  O    . HOH   G 6 .   ? 4.507   26.568  -43.318 1   24.43 ? 1377 HOH   A O    1 ? 
HETATM 5339 O  O    . HOH   G 6 .   ? -6.511  23.785  -40.233 1   21    ? 1378 HOH   A O    1 ? 
HETATM 5340 O  O    . HOH   G 6 .   ? -7.809  8.812   -41.696 1   20.95 ? 1379 HOH   A O    1 ? 
HETATM 5341 O  O    . HOH   G 6 .   ? -12.153 2.366   -25.749 1   26.43 ? 1380 HOH   A O    1 ? 
HETATM 5342 O  O    . HOH   G 6 .   ? 20.04   32.781  -10.219 1   37.83 ? 1381 HOH   A O    1 ? 
HETATM 5343 O  O    . HOH   G 6 .   ? 20.18   20.869  -37.745 1   39.52 ? 1382 HOH   A O    1 ? 
HETATM 5344 O  O    . HOH   G 6 .   ? -10.676 26.842  -20.99  1   55.19 ? 1383 HOH   A O    1 ? 
HETATM 5345 O  O    . HOH   G 6 .   ? 0.401   -3.022  -15.346 1   28.94 ? 1384 HOH   A O    1 ? 
HETATM 5346 O  O    . HOH   G 6 .   ? -3.52   20.809  7.57    1   30.45 ? 1385 HOH   A O    1 ? 
HETATM 5347 O  O    . HOH   G 6 .   ? 1.929   28.526  -9.972  1   68.09 ? 1386 HOH   A O    1 ? 
HETATM 5348 O  O    . HOH   G 6 .   ? -2.991  0.319   -36.695 1   26.92 ? 1387 HOH   A O    1 ? 
HETATM 5349 O  O    . HOH   G 6 .   ? 1.488   35.14   -32.766 1   41.19 ? 1388 HOH   A O    1 ? 
HETATM 5350 O  O    . HOH   G 6 .   ? 16.16   12.214  -20.609 1   33.33 ? 1389 HOH   A O    1 ? 
HETATM 5351 O  O    . HOH   G 6 .   ? -16.405 19.549  -26.235 1   49.04 ? 1390 HOH   A O    1 ? 
HETATM 5352 O  O    . HOH   G 6 .   ? -10.238 3.156   -17.354 1   34.63 ? 1391 HOH   A O    1 ? 
HETATM 5353 O  O    . HOH   G 6 .   ? 12.048  0.545   -10.031 1   47.87 ? 1392 HOH   A O    1 ? 
HETATM 5354 O  O    . HOH   G 6 .   ? -17.523 25.755  -27.043 1   49.57 ? 1393 HOH   A O    1 ? 
HETATM 5355 O  O    . HOH   G 6 .   ? -4.115  -7.015  -21.907 1   34.23 ? 1394 HOH   A O    1 ? 
HETATM 5356 O  O    . HOH   G 6 .   ? 10.829  5.401   -28.9   1   23.81 ? 1395 HOH   A O    1 ? 
HETATM 5357 O  O    . HOH   G 6 .   ? 9.864   38.399  -32.64  1   48.19 ? 1396 HOH   A O    1 ? 
HETATM 5358 O  O    . HOH   G 6 .   ? -5.034  11.219  -22.511 1   19.02 ? 1397 HOH   A O    1 ? 
HETATM 5359 O  O    . HOH   G 6 .   ? -7.741  18.33   -20.383 1   20.81 ? 1398 HOH   A O    1 ? 
HETATM 5360 O  O    . HOH   G 6 .   ? -10.87  7.084   -15.666 1   45.54 ? 1399 HOH   A O    1 ? 
HETATM 5361 O  O    . HOH   G 6 .   ? 16.605  11.576  -13.322 1   54.29 ? 1400 HOH   A O    1 ? 
HETATM 5362 O  O    . HOH   G 6 .   ? 19.659  37.733  -14.193 1   45.62 ? 1401 HOH   A O    1 ? 
HETATM 5363 O  O    . HOH   G 6 .   ? 21.824  22.891  -36.122 1   52.13 ? 1402 HOH   A O    1 ? 
HETATM 5364 O  O    . HOH   G 6 .   ? -16.331 5.167   -27.253 1   46.66 ? 1403 HOH   A O    1 ? 
HETATM 5365 O  O    . HOH   G 6 .   ? -11.532 18.175  -36.354 1   37.67 ? 1404 HOH   A O    1 ? 
HETATM 5366 O  O    . HOH   G 6 .   ? -10.547 17.709  -13.904 1   29.11 ? 1405 HOH   A O    1 ? 
HETATM 5367 O  O    . HOH   G 6 .   ? -20.016 11.191  -25.952 1   42.38 ? 1406 HOH   A O    1 ? 
HETATM 5368 O  O    . HOH   G 6 .   ? 1.23    22.778  10.248  1   52.88 ? 1407 HOH   A O    1 ? 
HETATM 5369 O  O    . HOH   G 6 .   ? -11.067 25.783  -26.52  1   33.38 ? 1408 HOH   A O    1 ? 
HETATM 5370 O  O    . HOH   G 6 .   ? -13.714 4.207   -14.598 1   49.67 ? 1409 HOH   A O    1 ? 
HETATM 5371 O  O    . HOH   G 6 .   ? -1.876  5.033   -42.116 1   18.85 ? 1410 HOH   A O    1 ? 
HETATM 5372 O  O    . HOH   G 6 .   ? -6.615  1.874   -14.513 1   47.55 ? 1411 HOH   A O    1 ? 
HETATM 5373 O  O    . HOH   G 6 .   ? -18.005 14.68   -25.135 1   33.76 ? 1412 HOH   A O    1 ? 
HETATM 5374 O  O    . HOH   G 6 .   ? 6.276   40.146  -26.838 1   45.62 ? 1413 HOH   A O    1 ? 
HETATM 5375 O  O    . HOH   G 6 .   ? 14.87   20.952  -23.472 1   29.67 ? 1414 HOH   A O    1 ? 
HETATM 5376 O  O    . HOH   G 6 .   ? -17.431 6.981   -25.449 1   45.95 ? 1415 HOH   A O    1 ? 
HETATM 5377 O  O    . HOH   G 6 .   ? -11.774 22.637  -31.14  1   49.61 ? 1416 HOH   A O    1 ? 
HETATM 5378 O  O    . HOH   G 6 .   ? 9.689   0.88    -31.944 1   54.24 ? 1417 HOH   A O    1 ? 
HETATM 5379 O  O    . HOH   G 6 .   ? -1.101  35.58   -21.16  1   45.52 ? 1418 HOH   A O    1 ? 
HETATM 5380 O  O    . HOH   G 6 .   ? -16.972 5.48    -29.716 1   38.85 ? 1419 HOH   A O    1 ? 
HETATM 5381 O  O    . HOH   G 6 .   ? 9.655   5.617   -2.339  1   49.98 ? 1420 HOH   A O    1 ? 
HETATM 5382 O  O    . HOH   G 6 .   ? 9.045   14.351  -9.447  1   25.03 ? 1421 HOH   A O    1 ? 
HETATM 5383 O  O    . HOH   G 6 .   ? 7.025   0.061   -36.922 1   62.17 ? 1422 HOH   A O    1 ? 
HETATM 5384 O  O    . HOH   G 6 .   ? -1.677  24.95   -12.593 1   32.16 ? 1423 HOH   A O    1 ? 
HETATM 5385 O  O    . HOH   G 6 .   ? 11.558  3.732   -5.432  1   59.38 ? 1424 HOH   A O    1 ? 
HETATM 5386 O  O    . HOH   G 6 .   ? 1.661   -0.545  -32.625 1   39.31 ? 1425 HOH   A O    1 ? 
HETATM 5387 O  O    . HOH   G 6 .   ? 19.859  28.763  -35.649 1   53.61 ? 1426 HOH   A O    1 ? 
HETATM 5388 O  O    . HOH   G 6 .   ? 12.648  10.545  -5.565  1   59.47 ? 1427 HOH   A O    1 ? 
HETATM 5389 O  O    . HOH   G 6 .   ? -10.526 22.933  -7.214  1   61.91 ? 1428 HOH   A O    1 ? 
HETATM 5390 O  O    . HOH   G 6 .   ? -10.703 21.243  -32.623 1   26.77 ? 1429 HOH   A O    1 ? 
HETATM 5391 O  O    . HOH   G 6 .   ? -19.146 8.046   -19.011 1   59.48 ? 1430 HOH   A O    1 ? 
HETATM 5392 O  O    . HOH   G 6 .   ? 7.874   21.673  -46.144 1   39.4  ? 1431 HOH   A O    1 ? 
HETATM 5393 O  O    . HOH   G 6 .   ? 10.891  25.152  -22.225 1   45.66 ? 1432 HOH   A O    1 ? 
HETATM 5394 O  O    . HOH   G 6 .   ? -9.273  17.691  -41.011 1   25.96 ? 1433 HOH   A O    1 ? 
HETATM 5395 O  O    . HOH   G 6 .   ? -14.018 5.344   -43.705 1   73.67 ? 1434 HOH   A O    1 ? 
HETATM 5396 O  O    . HOH   G 6 .   ? -9.171  27.093  -23.516 1   42.44 ? 1435 HOH   A O    1 ? 
HETATM 5397 O  O    . HOH   G 6 .   ? 9.677   -4.842  -26.883 1   63.08 ? 1436 HOH   A O    1 ? 
HETATM 5398 O  O    . HOH   G 6 .   ? 13.148  35.557  -26.631 1   51.44 ? 1437 HOH   A O    1 ? 
HETATM 5399 O  O    . HOH   G 6 .   ? -7.118  22.898  2.996   1   35.77 ? 1438 HOH   A O    1 ? 
HETATM 5400 O  O    . HOH   G 6 .   ? 8.448   10.252  -41.904 1   38.66 ? 1439 HOH   A O    1 ? 
HETATM 5401 O  O    . HOH   G 6 .   ? -7.798  21.71   -10.055 1   34.82 ? 1440 HOH   A O    1 ? 
HETATM 5402 O  O    . HOH   G 6 .   ? -1.776  -8.848  -24.639 1   83.7  ? 1441 HOH   A O    1 ? 
HETATM 5403 O  O    . HOH   G 6 .   ? 9.069   4.636   -4.747  1   49.52 ? 1442 HOH   A O    1 ? 
HETATM 5404 O  O    . HOH   G 6 .   ? -23.955 7.958   -27.753 1   33.7  ? 1443 HOH   A O    1 ? 
HETATM 5405 O  O    . HOH   G 6 .   ? -3.565  -0.087  -40.481 1   36.46 ? 1444 HOH   A O    1 ? 
HETATM 5406 O  O    . HOH   G 6 .   ? 7.794   -6.642  -26.944 1   74.64 ? 1445 HOH   A O    1 ? 
HETATM 5407 O  O    . HOH   G 6 .   ? -7.968  12.204  -14.194 1   36.54 ? 1446 HOH   A O    1 ? 
HETATM 5408 O  O    . HOH   G 6 .   ? -9.165  18.787  -18.096 1   39.1  ? 1447 HOH   A O    1 ? 
HETATM 5409 O  O    . HOH   G 6 .   ? 10.605  8.733   6.246   1   54.73 ? 1448 HOH   A O    1 ? 
HETATM 5410 O  O    . HOH   G 6 .   ? 3.253   35.893  -18.957 1   41.76 ? 1449 HOH   A O    1 ? 
HETATM 5411 O  O    . HOH   G 6 .   ? -22.375 11.638  -26.372 1   35.84 ? 1450 HOH   A O    1 ? 
HETATM 5412 O  O    . HOH   G 6 .   ? 4.919   29.744  -8.658  1   59.39 ? 1451 HOH   A O    1 ? 
HETATM 5413 O  O    . HOH   G 6 .   ? -11.033 -0.829  -16.973 1   53.33 ? 1452 HOH   A O    1 ? 
HETATM 5414 O  O    . HOH   G 6 .   ? -3.481  7.761   -42.23  1   14.11 ? 1453 HOH   A O    1 ? 
HETATM 5415 O  O    . HOH   G 6 .   ? -3.743  26.598  -6.236  1   43.69 ? 1454 HOH   A O    1 ? 
HETATM 5416 O  O    . HOH   G 6 .   ? 0.423   1.317   -43.688 0.5 24.75 ? 1455 HOH   A O    1 ? 
HETATM 5417 O  O    . HOH   G 6 .   ? 0.012   -8.637  -26.753 1   51.1  ? 1456 HOH   A O    1 ? 
HETATM 5418 O  O    . HOH   G 6 .   ? 12.003  -4.365  -22.845 1   58.71 ? 1457 HOH   A O    1 ? 
HETATM 5419 O  O    . HOH   G 6 .   ? -17.871 24.506  -31.443 1   47.77 ? 1458 HOH   A O    1 ? 
HETATM 5420 O  O    . HOH   G 6 .   ? 11.327  31.277  -26.383 1   51.9  ? 1459 HOH   A O    1 ? 
HETATM 5421 O  O    . HOH   G 6 .   ? 2.29    29.134  -12.638 1   51.16 ? 1460 HOH   A O    1 ? 
HETATM 5422 O  O    . HOH   G 6 .   ? 8.272   -4.284  -10.4   1   52.48 ? 1461 HOH   A O    1 ? 
HETATM 5423 O  O    . HOH   G 6 .   ? 0.983   34.786  -28.731 1   47.91 ? 1462 HOH   A O    1 ? 
HETATM 5424 O  O    . HOH   G 6 .   ? -9.379  22.264  -17.741 1   43.64 ? 1463 HOH   A O    1 ? 
HETATM 5425 O  O    . HOH   G 6 .   ? 7.695   2.609   -39.841 1   40.27 ? 1464 HOH   A O    1 ? 
HETATM 5426 O  O    . HOH   G 6 .   ? -4.561  26.103  -41.712 1   30.11 ? 1465 HOH   A O    1 ? 
HETATM 5427 O  O    . HOH   G 6 .   ? 12.533  14.247  -8.662  1   50.81 ? 1466 HOH   A O    1 ? 
HETATM 5428 O  O    . HOH   G 6 .   ? 0.346   4.115   -43.534 0.5 21.48 ? 1467 HOH   A O    1 ? 
HETATM 5429 O  O    . HOH   G 6 .   ? 10.249  14.057  -41.199 1   67.08 ? 1468 HOH   A O    1 ? 
HETATM 5430 O  O    . HOH   G 6 .   ? -20.325 18.448  -27.185 1   49.98 ? 1469 HOH   A O    1 ? 
HETATM 5431 O  O    . HOH   G 6 .   ? -4.882  4.041   4.688   1   50.32 ? 1470 HOH   A O    1 ? 
HETATM 5432 O  O    . HOH   G 6 .   ? 1.714   7.312   10.002  1   49.79 ? 1471 HOH   A O    1 ? 
HETATM 5433 O  O    . HOH   G 6 .   ? 9.1     35.321  -35.294 1   49.75 ? 1472 HOH   A O    1 ? 
HETATM 5434 O  O    . HOH   G 6 .   ? -10.288 8.397   -44.968 1   54.14 ? 1473 HOH   A O    1 ? 
HETATM 5435 O  O    . HOH   G 6 .   ? -8.157  -0.903  -35.916 1   52.57 ? 1474 HOH   A O    1 ? 
HETATM 5436 O  O    . HOH   G 6 .   ? -9.14   16.963  -15.93  1   39.28 ? 1475 HOH   A O    1 ? 
HETATM 5437 O  O    . HOH   G 6 .   ? 3.778   -0.173  -30.066 1   34.28 ? 1476 HOH   A O    1 ? 
HETATM 5438 O  O    . HOH   G 6 .   ? -13.811 14.191  -16.388 1   57.69 ? 1477 HOH   A O    1 ? 
HETATM 5439 O  O    . HOH   G 6 .   ? 0.19    33.6    -30.951 1   50.06 ? 1478 HOH   A O    1 ? 
HETATM 5440 O  O    . HOH   G 6 .   ? 2.126   -3.686  -31.139 1   62.04 ? 1479 HOH   A O    1 ? 
HETATM 5441 O  O    . HOH   G 6 .   ? 14.733  31.867  -38.808 1   55.31 ? 1480 HOH   A O    1 ? 
HETATM 5442 O  O    . HOH   G 6 .   ? 15.89   20.063  -17.786 1   58.58 ? 1481 HOH   A O    1 ? 
HETATM 5443 O  O    . HOH   G 6 .   ? -20.979 7.857   -34.589 1   33.79 ? 1482 HOH   A O    1 ? 
HETATM 5444 O  O    . HOH   G 6 .   ? 18.609  23.581  -28.826 1   38.2  ? 1483 HOH   A O    1 ? 
HETATM 5445 O  O    . HOH   G 6 .   ? -7.861  15.097  -14.509 1   34.52 ? 1484 HOH   A O    1 ? 
HETATM 5446 O  O    . HOH   G 6 .   ? 5.787   1.382   -41.204 1   47.42 ? 1485 HOH   A O    1 ? 
HETATM 5447 O  O    . HOH   G 6 .   ? 9.145   10.557  -37.796 1   37.87 ? 1486 HOH   A O    1 ? 
HETATM 5448 O  O    . HOH   G 6 .   ? 8.464   17.274  -42.568 1   43.31 ? 1487 HOH   A O    1 ? 
HETATM 5449 O  O    . HOH   G 6 .   ? 17.1    14.716  -19.974 1   50.2  ? 1488 HOH   A O    1 ? 
HETATM 5450 O  O    . HOH   G 6 .   ? 2.829   29.704  -5.188  1   50.61 ? 1489 HOH   A O    1 ? 
HETATM 5451 O  O    . HOH   G 6 .   ? -12.588 19.146  -40.065 1   63.79 ? 1490 HOH   A O    1 ? 
HETATM 5452 O  O    . HOH   G 6 .   ? -22.014 9.729   -36.691 1   35.83 ? 1491 HOH   A O    1 ? 
HETATM 5453 O  O    . HOH   G 6 .   ? -22.838 7.468   -32.272 1   31.98 ? 1492 HOH   A O    1 ? 
HETATM 5454 O  O    . HOH   G 6 .   ? -11.823 26.582  -28.988 1   60.83 ? 1493 HOH   A O    1 ? 
HETATM 5455 O  O    . HOH   G 6 .   ? 14.291  32.33   -29.928 1   55.05 ? 1494 HOH   A O    1 ? 
HETATM 5456 O  O    . HOH   G 6 .   ? -5.212  -0.2    -38.238 1   61.71 ? 1495 HOH   A O    1 ? 
HETATM 5457 O  O    . HOH   G 6 .   ? -18.824 23.639  -26.322 1   63.43 ? 1496 HOH   A O    1 ? 
HETATM 5458 O  O    . HOH   G 6 .   ? 2.863   -5.211  -13.847 1   60.53 ? 1497 HOH   A O    1 ? 
HETATM 5459 O  O    . HOH   G 6 .   ? 2.397   25.756  -5.523  1   48.42 ? 1498 HOH   A O    1 ? 
HETATM 5460 O  O    . HOH   G 6 .   ? 2.881   29.627  -40.386 1   58.33 ? 1499 HOH   A O    1 ? 
HETATM 5461 O  O    . HOH   G 6 .   ? 16.872  20.319  -27.435 1   47.12 ? 1500 HOH   A O    1 ? 
HETATM 5462 O  O    . HOH   G 6 .   ? -16.472 18.617  -37.449 1   48.96 ? 1501 HOH   A O    1 ? 
HETATM 5463 O  O    . HOH   G 6 .   ? 2.4     -0.455  -43.803 1   46.84 ? 1502 HOH   A O    1 ? 
HETATM 5464 O  O    . HOH   G 6 .   ? -10.374 9.753   -14.369 1   59    ? 1503 HOH   A O    1 ? 
HETATM 5465 O  O    . HOH   G 6 .   ? 15.392  7.502   -34.107 1   31.92 ? 1504 HOH   A O    1 ? 
HETATM 5466 O  O    . HOH   G 6 .   ? -0.285  25.962  -9.574  1   47.5  ? 1505 HOH   A O    1 ? 
HETATM 5467 O  O    . HOH   G 6 .   ? 15.833  15.768  -37.853 1   47.92 ? 1506 HOH   A O    1 ? 
HETATM 5468 O  O    . HOH   G 6 .   ? 4.695   37.164  -36.675 1   48.12 ? 1507 HOH   A O    1 ? 
HETATM 5469 O  O    . HOH   G 6 .   ? -11.497 19.055  -23.348 1   24.81 ? 1508 HOH   A O    1 ? 
HETATM 5470 O  O    . HOH   G 6 .   ? -10.657 18.864  0.653   1   59.8  ? 1509 HOH   A O    1 ? 
HETATM 5471 O  O    . HOH   G 6 .   ? -1.172  -3.309  -38.057 1   67.08 ? 1510 HOH   A O    1 ? 
HETATM 5472 O  O    . HOH   G 6 .   ? -8.963  20.138  -22.271 1   19.98 ? 1511 HOH   A O    1 ? 
HETATM 5473 O  O    . HOH   G 6 .   ? 12.424  28.656  9.731   1   51.84 ? 1512 HOH   A O    1 ? 
HETATM 5474 O  O    . HOH   G 6 .   ? 20.059  24.839  -36.895 1   49.08 ? 1513 HOH   A O    1 ? 
HETATM 5475 O  O    . HOH   G 6 .   ? 11.886  13.321  -6.248  1   45.08 ? 1514 HOH   A O    1 ? 
HETATM 5476 O  O    . HOH   G 6 .   ? -6.829  8.028   -13.517 1   38.38 ? 1515 HOH   A O    1 ? 
HETATM 5477 O  O    . HOH   G 6 .   ? 15.131  28.117  -22.769 1   49.1  ? 1516 HOH   A O    1 ? 
HETATM 5478 O  O    . HOH   G 6 .   ? 5.782   -2.986  -27.786 1   39.46 ? 1517 HOH   A O    1 ? 
HETATM 5479 O  O    . HOH   G 6 .   ? -12.501 3.628   -42.384 1   58.16 ? 1518 HOH   A O    1 ? 
HETATM 5480 O  O    . HOH   G 6 .   ? -10.257 20.544  -13.244 1   45.53 ? 1519 HOH   A O    1 ? 
HETATM 5481 O  O    . HOH   G 6 .   ? -7.953  1.517   -36.734 1   37.9  ? 1520 HOH   A O    1 ? 
HETATM 5482 O  O    . HOH   G 6 .   ? -19.772 21.129  -25.64  1   52.9  ? 1521 HOH   A O    1 ? 
HETATM 5483 O  O    . HOH   G 6 .   ? 14.343  13.737  -37.99  1   39.08 ? 1522 HOH   A O    1 ? 
HETATM 5484 O  O    . HOH   G 6 .   ? -1.471  -5.065  -16.402 1   53.24 ? 1523 HOH   A O    1 ? 
HETATM 5485 O  O    . HOH   G 6 .   ? 5.717   9.241   -42.108 1   45.31 ? 1524 HOH   A O    1 ? 
HETATM 5486 O  O    . HOH   G 6 .   ? 18.624  10.583  -15.629 1   59.87 ? 1525 HOH   A O    1 ? 
HETATM 5487 O  O    . HOH   G 6 .   ? -21.388 7.983   -38.701 1   43.22 ? 1526 HOH   A O    1 ? 
HETATM 5488 O  O    . HOH   G 6 .   ? -2.341  31.5    -31.766 1   43.77 ? 1527 HOH   A O    1 ? 
HETATM 5489 O  O    . HOH   G 6 .   ? -19.689 5.166   -38.02  1   62.78 ? 1528 HOH   A O    1 ? 
HETATM 5490 O  O    . HOH   G 6 .   ? -1.934  28.656  -40.972 1   47.82 ? 1529 HOH   A O    1 ? 
HETATM 5491 O  O    . HOH   G 6 .   ? 2.274   36.328  -36.743 1   53.89 ? 1530 HOH   A O    1 ? 
HETATM 5492 O  O    . HOH   G 6 .   ? 7.821   9.219   -39.369 1   32.24 ? 1531 HOH   A O    1 ? 
HETATM 5493 O  O    . HOH   G 6 .   ? 6.301   -0.221  -31.2   1   45.87 ? 1532 HOH   A O    1 ? 
HETATM 5494 O  O    . HOH   G 6 .   ? 17.705  18.484  -16.16  1   54.24 ? 1533 HOH   A O    1 ? 
HETATM 5495 O  O    . HOH   G 6 .   ? 11.759  11.115  -38.181 1   39.02 ? 1534 HOH   A O    1 ? 
HETATM 5496 O  O    . HOH   G 6 .   ? -21.344 16.825  -39.488 1   51.11 ? 1535 HOH   A O    1 ? 
HETATM 5497 O  O    . HOH   G 6 .   ? -0.99   -1.528  -32.89  1   42.85 ? 1536 HOH   A O    1 ? 
HETATM 5498 O  O    . HOH   G 6 .   ? -10.11  4.128   -41.121 1   46.07 ? 1537 HOH   A O    1 ? 
HETATM 5499 O  O    . HOH   G 6 .   ? -11.945 20.269  -34.631 1   44.23 ? 1538 HOH   A O    1 ? 
HETATM 5500 O  O    . HOH   G 6 .   ? 4.188   1.038   -44.908 1   33.94 ? 1539 HOH   A O    1 ? 
HETATM 5501 O  O    . HOH   G 6 .   ? -7.813  -5.568  -34.206 1   55.79 ? 1540 HOH   A O    1 ? 
HETATM 5502 O  O    . HOH   G 6 .   ? 5.815   5.403   -43.334 1   44.12 ? 1541 HOH   A O    1 ? 
HETATM 5503 O  O    . HOH   G 6 .   ? -1.238  -2.137  -35.379 1   54.56 ? 1542 HOH   A O    1 ? 
HETATM 5504 O  O    . HOH   G 6 .   ? -3.483  -1.051  -34.582 1   39.07 ? 1543 HOH   A O    1 ? 
HETATM 5505 O  O    . HOH   G 6 .   ? 7.798   -2.14   -29.303 1   55.97 ? 1544 HOH   A O    1 ? 
HETATM 5506 O  O    . HOH   G 6 .   ? 17.268  31.012  -32.924 1   52.78 ? 1545 HOH   A O    1 ? 
HETATM 5507 O  O    . HOH   G 6 .   ? -5.297  28.565  -32.061 1   57.03 ? 1546 HOH   A O    1 ? 
HETATM 5508 O  O    . HOH   G 6 .   ? 12.231  -4.373  -26.886 1   57.4  ? 1547 HOH   A O    1 ? 
HETATM 5509 O  O    . HOH   G 6 .   ? 1.434   41.339  -24.56  1   52.05 ? 1548 HOH   A O    1 ? 
HETATM 5510 O  O    . HOH   G 6 .   ? -13.627 11.273  -14.518 1   63.76 ? 1549 HOH   A O    1 ? 
HETATM 5511 O  O    . HOH   G 6 .   ? -19.322 24.973  -29.316 1   52.47 ? 1550 HOH   A O    1 ? 
HETATM 5512 O  O    . HOH   G 6 .   ? -4.958  26.793  -9.709  1   58    ? 1551 HOH   A O    1 ? 
HETATM 5513 O  O    . HOH   G 6 .   ? -23.456 13.032  -39.146 1   57.89 ? 1552 HOH   A O    1 ? 
HETATM 5514 O  O    . HOH   G 6 .   ? -6.336  26.585  -33.575 1   36.74 ? 1553 HOH   A O    1 ? 
HETATM 5515 O  O    . HOH   G 6 .   ? 9.686   5.345   -40.964 1   46.96 ? 1554 HOH   A O    1 ? 
HETATM 5516 O  O    . HOH   G 6 .   ? 16.563  10.94   -23.437 1   39    ? 1555 HOH   A O    1 ? 
HETATM 5517 O  O    . HOH   G 6 .   ? 3.12    23.329  11.596  1   48.32 ? 1556 HOH   A O    1 ? 
HETATM 5518 O  O    . HOH   G 6 .   ? 15.566  9.631   -36.236 1   30.64 ? 1557 HOH   A O    1 ? 
HETATM 5519 O  O    . HOH   G 6 .   ? -2.049  33.347  -34.152 1   55.71 ? 1558 HOH   A O    1 ? 
HETATM 5520 O  O    . HOH   G 6 .   ? 5.801   25.136  -0.25   1   58.44 ? 1559 HOH   A O    1 ? 
HETATM 5521 O  O    . HOH   G 6 .   ? 24.6    21.46   -36.802 1   65.53 ? 1560 HOH   A O    1 ? 
HETATM 5522 O  O    . HOH   G 6 .   ? 4.286   29.088  -42.514 1   50.42 ? 1561 HOH   A O    1 ? 
HETATM 5523 O  O    . HOH   G 6 .   ? -8.598  25.853  -39.316 1   43.94 ? 1562 HOH   A O    1 ? 
HETATM 5524 O  O    . HOH   G 6 .   ? -9.338  24.706  -32.729 1   47.44 ? 1563 HOH   A O    1 ? 
HETATM 5525 O  O    . HOH   G 6 .   ? -9.545  2.288   -39.365 1   37    ? 1564 HOH   A O    1 ? 
HETATM 5526 O  O    . HOH   G 6 .   ? 17.792  16.979  -14.02  1   52.35 ? 1565 HOH   A O    1 ? 
HETATM 5527 O  O    . HOH   G 6 .   ? 14.187  31.475  -25.445 1   47.03 ? 1566 HOH   A O    1 ? 
HETATM 5528 O  O    . HOH   G 6 .   ? -10.996 21.594  -15.654 1   50.39 ? 1567 HOH   A O    1 ? 
HETATM 5529 O  O    . HOH   G 6 .   ? -3.543  -7.538  -18.487 1   57.22 ? 1568 HOH   A O    1 ? 
HETATM 5530 O  O    . HOH   G 6 .   ? -9.409  26.094  -36.868 1   43.31 ? 1569 HOH   A O    1 ? 
HETATM 5531 O  O    . HOH   G 6 .   ? 6.775   1.129   -44.649 1   62.74 ? 1570 HOH   A O    1 ? 
HETATM 5532 O  O    . HOH   G 6 .   ? -6.378  31.625  -33.426 1   54.96 ? 1571 HOH   A O    1 ? 
HETATM 5533 O  O    . HOH   G 6 .   ? -2.197  30.192  -43.186 1   66.09 ? 1572 HOH   A O    1 ? 
HETATM 5534 O  O    . HOH   G 6 .   ? -9.576  28.737  -34.62  1   61.45 ? 1573 HOH   A O    1 ? 
HETATM 5535 O  O    . HOH   G 6 .   ? -19.076 6.418   -44.605 1   60.31 ? 1574 HOH   A O    1 ? 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.pdbx_PDB_ins_code 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1    N  N   . GLN   A 8   ? 0.8478 0.6411 0.6039 0.1418  0.0104  0.0094  701  GLN   A N   
2    C  CA  . GLN   A 8   ? 0.8656 0.6282 0.6028 0.1401  0.0169  0.0098  701  GLN   A CA  
3    C  C   . GLN   A 8   ? 0.8446 0.6115 0.5937 0.1306  0.017   0.0113  701  GLN   A C   
4    O  O   . GLN   A 8   ? 0.8446 0.6256 0.6016 0.1334  0.0103  0.0116  701  GLN   A O   
5    C  CB  . GLN   A 8   ? 0.9168 0.6583 0.6273 0.1553  0.0159  0.009   701  GLN   A CB  
6    C  CG  . GLN   A 8   ? 0.9762 0.7353 0.6906 0.1658  0.0067  0.0086  701  GLN   A CG  
7    C  CD  . GLN   A 8   ? 1.0746 0.8096 0.761  0.1804  0.0062  0.0077  701  GLN   A CD  
8    O  OE1 . GLN   A 8   ? 1.1138 0.8274 0.7779 0.1888  0.0099  0.0068  701  GLN   A OE1 
9    N  NE2 . GLN   A 8   ? 1.0923 0.8287 0.7773 0.1842  0.0015  0.0079  701  GLN   A NE2 
17   N  N   . ALA   A 9   ? 0.8245 0.5804 0.5751 0.1192  0.0243  0.0121  702  ALA   A N   
18   C  CA  . ALA   A 9   ? 0.8079 0.567  0.5687 0.1107  0.0254  0.0135  702  ALA   A CA  
19   C  C   . ALA   A 9   ? 0.8138 0.5545 0.5575 0.1173  0.0255  0.0141  702  ALA   A C   
20   O  O   . ALA   A 9   ? 0.8349 0.5492 0.5567 0.1211  0.0313  0.0141  702  ALA   A O   
21   C  CB  . ALA   A 9   ? 0.808  0.5606 0.5732 0.0983  0.0336  0.014   702  ALA   A CB  
27   N  N   . LEU   A 10  ? 0.7928 0.5461 0.5453 0.1186  0.019   0.0147  703  LEU   A N   
28   C  CA  . LEU   A 10  ? 0.8056 0.544  0.5439 0.1247  0.0178  0.0153  703  LEU   A CA  
29   C  C   . LEU   A 10  ? 0.8022 0.5467 0.5527 0.1156  0.0184  0.0168  703  LEU   A C   
30   O  O   . LEU   A 10  ? 0.7858 0.5507 0.5569 0.107   0.0165  0.017   703  LEU   A O   
31   C  CB  . LEU   A 10  ? 0.809  0.5578 0.5453 0.1358  0.0078  0.0142  703  LEU   A CB  
32   C  CG  . LEU   A 10  ? 0.8547 0.5862 0.5675 0.15    0.0074  0.013   703  LEU   A CG  
33   C  CD1 . LEU   A 10  ? 0.8645 0.5935 0.5732 0.1517  0.0112  0.012   703  LEU   A CD1 
34   C  CD2 . LEU   A 10  ? 0.8637 0.6098 0.5774 0.1603  -0.0032 0.0119  703  LEU   A CD2 
46   N  N   . LEU   A 11  ? 0.8114 0.5368 0.5479 0.1177  0.0216  0.0178  704  LEU   A N   
47   C  CA  . LEU   A 11  ? 0.8187 0.5467 0.5631 0.1109  0.0229  0.0194  704  LEU   A CA  
48   C  C   . LEU   A 11  ? 0.8251 0.5428 0.5571 0.1185  0.0182  0.0198  704  LEU   A C   
49   O  O   . LEU   A 11  ? 0.8433 0.5379 0.5543 0.1254  0.022   0.02    704  LEU   A O   
50   C  CB  . LEU   A 11  ? 0.8382 0.5507 0.5767 0.1042  0.0344  0.0206  704  LEU   A CB  
51   C  CG  . LEU   A 11  ? 0.8553 0.5822 0.6123 0.0922  0.039   0.0208  704  LEU   A CG  
52   C  CD1 . LEU   A 11  ? 0.871  0.582  0.6197 0.0865  0.0503  0.022   704  LEU   A CD1 
53   C  CD2 . LEU   A 11  ? 0.8525 0.6002 0.6284 0.0875  0.0333  0.0213  704  LEU   A CD2 
65   N  N   . ARG   A 12  ? 0.8104 0.5434 0.5536 0.1173  0.0098  0.02    705  ARG   A N   
66   C  CA  . ARG   A 12  ? 0.8234 0.5464 0.5546 0.1239  0.0046  0.0203  705  ARG   A CA  
67   C  C   . ARG   A 12  ? 0.8231 0.5327 0.5491 0.1201  0.0113  0.0222  705  ARG   A C   
68   O  O   . ARG   A 12  ? 0.8108 0.5328 0.5513 0.1123  0.011   0.0229  705  ARG   A O   
69   C  CB  . ARG   A 12  ? 0.8392 0.5824 0.5833 0.1225  -0.007  0.0198  705  ARG   A CB  
70   C  CG  . ARG   A 12  ? 0.8888 0.6458 0.6354 0.1286  -0.0155 0.018   705  ARG   A CG  
71   C  CD  . ARG   A 12  ? 0.9356 0.7109 0.693  0.126   -0.0268 0.0177  705  ARG   A CD  
72   N  NE  . ARG   A 12  ? 1.0009 0.7617 0.7444 0.1305  -0.0312 0.018   705  ARG   A NE  
73   C  CZ  . ARG   A 12  ? 1.0404 0.8109 0.7885 0.128   -0.041  0.0179  705  ARG   A CZ  
74   N  NH1 . ARG   A 12  ? 1.0367 0.791  0.7697 0.1327  -0.0448 0.018   705  ARG   A NH1 
75   N  NH2 . ARG   A 12  ? 1.023  0.8186 0.79   0.1204  -0.0472 0.0176  705  ARG   A NH2 
89   N  N   . ILE   A 13  ? 0.8291 0.5137 0.5342 0.126   0.0174  0.0229  706  ILE   A N   
90   C  CA  . ILE   A 13  ? 0.8376 0.5103 0.5372 0.1233  0.0242  0.0249  706  ILE   A CA  
91   C  C   . ILE   A 13  ? 0.8361 0.5066 0.5306 0.128   0.0159  0.0252  706  ILE   A C   
92   O  O   . ILE   A 13  ? 0.847  0.5065 0.5267 0.1371  0.0104  0.0245  706  ILE   A O   
93   C  CB  . ILE   A 13  ? 0.8638 0.5111 0.5435 0.126   0.0353  0.026   706  ILE   A CB  
94   C  CG1 . ILE   A 13  ? 0.8742 0.5223 0.5577 0.1199  0.0432  0.0256  706  ILE   A CG1 
95   C  CG2 . ILE   A 13  ? 0.8768 0.5164 0.5533 0.1232  0.042   0.0283  706  ILE   A CG2 
96   C  CD1 . ILE   A 13  ? 0.9156 0.5361 0.5748 0.1247  0.0513  0.026   706  ILE   A CD1 
108  N  N   . LEU   A 14  ? 0.8154 0.4956 0.5211 0.122   0.0148  0.0262  707  LEU   A N   
109  C  CA  . LEU   A 14  ? 0.8166 0.4947 0.5178 0.125   0.0066  0.0265  707  LEU   A CA  
110  C  C   . LEU   A 14  ? 0.8228 0.4816 0.5096 0.1277  0.014   0.0286  707  LEU   A C   
111  O  O   . LEU   A 14  ? 0.8205 0.481  0.513  0.1224  0.0235  0.0299  707  LEU   A O   
112  C  CB  . LEU   A 14  ? 0.8079 0.5083 0.5291 0.1168  -0.0002 0.0263  707  LEU   A CB  
113  C  CG  . LEU   A 14  ? 0.8163 0.5392 0.5553 0.112   -0.0049 0.0247  707  LEU   A CG  
114  C  CD1 . LEU   A 14  ? 0.8141 0.5558 0.5701 0.1038  -0.0108 0.0248  707  LEU   A CD1 
115  C  CD2 . LEU   A 14  ? 0.8267 0.5507 0.5596 0.119   -0.0132 0.023   707  LEU   A CD2 
127  N  N   . LYS   A 15  ? 0.823  0.4637 0.4906 0.1364  0.0102  0.0288  708  LYS   A N   
128  C  CA  . LYS   A 15  ? 0.835  0.4559 0.4865 0.1405  0.0172  0.0308  708  LYS   A CA  
129  C  C   . LYS   A 15  ? 0.8236 0.4525 0.4836 0.1359  0.0166  0.032   708  LYS   A C   
130  O  O   . LYS   A 15  ? 0.8135 0.4525 0.4806 0.134   0.0062  0.0311  708  LYS   A O   
131  C  CB  . LYS   A 15  ? 0.8746 0.475  0.5036 0.1512  0.0112  0.0305  708  LYS   A CB  
132  C  CG  . LYS   A 15  ? 0.9483 0.5362 0.5635 0.1585  0.0118  0.0293  708  LYS   A CG  
133  C  CD  . LYS   A 15  ? 1.0297 0.5929 0.6192 0.17    0.0088  0.0294  708  LYS   A CD  
134  C  CE  . LYS   A 15  ? 1.0917 0.6604 0.6802 0.174   -0.0064 0.0275  708  LYS   A CE  
135  N  NZ  . LYS   A 15  ? 1.1486 0.6926 0.7112 0.1856  -0.0097 0.0273  708  LYS   A NZ  
149  N  N   . GLU   A 16  ? 0.8259 0.4497 0.4838 0.1347  0.0274  0.0341  709  GLU   A N   
150  C  CA  . GLU   A 16  ? 0.8298 0.4598 0.4932 0.1323  0.0271  0.0352  709  GLU   A CA  
151  C  C   . GLU   A 16  ? 0.8306 0.448  0.4793 0.139   0.0172  0.0353  709  GLU   A C   
152  O  O   . GLU   A 16  ? 0.8248 0.4499 0.4796 0.1362  0.0115  0.0353  709  GLU   A O   
153  C  CB  . GLU   A 16  ? 0.8754 0.5031 0.5379 0.1313  0.0407  0.0374  709  GLU   A CB  
154  C  CG  . GLU   A 16  ? 0.9826 0.5865 0.6226 0.1392  0.0482  0.0392  709  GLU   A CG  
155  C  CD  . GLU   A 16  ? 1.09   0.6967 0.733  0.1359  0.0627  0.0413  709  GLU   A CD  
156  O  OE1 . GLU   A 16  ? 1.1094 0.7069 0.7455 0.1351  0.0717  0.0419  709  GLU   A OE1 
157  O  OE2 . GLU   A 16  ? 1.1176 0.7359 0.7695 0.1339  0.065   0.0422  709  GLU   A OE2 
164  N  N   . THR   A 17  ? 0.8349 0.4323 0.4636 0.1475  0.0145  0.0351  710  THR   A N   
165  C  CA  . THR   A 17  ? 0.8446 0.4279 0.4571 0.1541  0.0042  0.0349  710  THR   A CA  
166  C  C   . THR   A 17  ? 0.8344 0.4321 0.4577 0.1494  -0.0101 0.0328  710  THR   A C   
167  O  O   . THR   A 17  ? 0.8442 0.4356 0.4595 0.1507  -0.0189 0.0327  710  THR   A O   
168  C  CB  . THR   A 17  ? 0.8791 0.4382 0.4679 0.1644  0.0054  0.0349  710  THR   A CB  
169  O  OG1 . THR   A 17  ? 0.8876 0.4504 0.4798 0.1643  0.0062  0.0335  710  THR   A OG1 
170  C  CG2 . THR   A 17  ? 0.8996 0.4408 0.4732 0.1697  0.0184  0.0376  710  THR   A CG2 
178  N  N   . GLU   A 18  ? 0.8121 0.4293 0.4533 0.1432  -0.012  0.0312  711  GLU   A N   
179  C  CA  . GLU   A 18  ? 0.7987 0.4333 0.4529 0.1374  -0.0242 0.0295  711  GLU   A CA  
180  C  C   . GLU   A 18  ? 0.7782 0.4266 0.4466 0.1288  -0.0255 0.0301  711  GLU   A C   
181  O  O   . GLU   A 18  ? 0.7724 0.4323 0.4489 0.1234  -0.0356 0.0291  711  GLU   A O   
182  C  CB  . GLU   A 18  ? 0.8228 0.4737 0.4906 0.1348  -0.0247 0.0278  711  GLU   A CB  
183  C  CG  . GLU   A 18  ? 0.8947 0.534  0.5482 0.1438  -0.0268 0.0266  711  GLU   A CG  
184  C  CD  . GLU   A 18  ? 0.9763 0.6267 0.6389 0.1435  -0.0236 0.0254  711  GLU   A CD  
185  O  OE1 . GLU   A 18  ? 0.9676 0.6393 0.6503 0.1355  -0.0236 0.025   711  GLU   A OE1 
186  O  OE2 . GLU   A 18  ? 1.0218 0.658  0.6697 0.1519  -0.021  0.0249  711  GLU   A OE2 
193  N  N   . PHE   A 19  ? 0.7649 0.4122 0.4357 0.1277  -0.0155 0.0318  712  PHE   A N   
194  C  CA  . PHE   A 19  ? 0.7488 0.4078 0.4311 0.1211  -0.0164 0.0323  712  PHE   A CA  
195  C  C   . PHE   A 19  ? 0.7634 0.406  0.4296 0.1261  -0.0167 0.0338  712  PHE   A C   
196  O  O   . PHE   A 19  ? 0.7806 0.4083 0.4334 0.1332  -0.0088 0.0352  712  PHE   A O   
197  C  CB  . PHE   A 19  ? 0.7269 0.4005 0.4257 0.1162  -0.0054 0.0328  712  PHE   A CB  
198  C  CG  . PHE   A 19  ? 0.713  0.4018 0.4269 0.1114  -0.0042 0.0315  712  PHE   A CG  
199  C  CD1 . PHE   A 19  ? 0.7236 0.4047 0.4314 0.1153  0.0021  0.0313  712  PHE   A CD1 
200  C  CD2 . PHE   A 19  ? 0.6999 0.409  0.4322 0.1034  -0.0091 0.0304  712  PHE   A CD2 
201  C  CE1 . PHE   A 19  ? 0.7215 0.4144 0.4406 0.112   0.0027  0.03    712  PHE   A CE1 
202  C  CE2 . PHE   A 19  ? 0.697  0.4193 0.4417 0.1     -0.0078 0.0291  712  PHE   A CE2 
203  C  CZ  . PHE   A 19  ? 0.6992 0.4132 0.437  0.1045  -0.0021 0.0289  712  PHE   A CZ  
213  N  N   . LYS   A 20  ? 0.7527 0.3975 0.4194 0.1223  -0.0254 0.0336  713  LYS   A N   
214  C  CA  . LYS   A 20  ? 0.764  0.3925 0.4141 0.1271  -0.0267 0.0349  713  LYS   A CA  
215  C  C   . LYS   A 20  ? 0.7536 0.3938 0.4142 0.1208  -0.0285 0.035   713  LYS   A C   
216  O  O   . LYS   A 20  ? 0.7413 0.4014 0.4212 0.1122  -0.0302 0.034   713  LYS   A O   
217  C  CB  . LYS   A 20  ? 0.7947 0.4039 0.4245 0.1311  -0.0383 0.0343  713  LYS   A CB  
218  C  CG  . LYS   A 20  ? 0.8494 0.4435 0.4648 0.1394  -0.0369 0.0342  713  LYS   A CG  
219  C  CD  . LYS   A 20  ? 0.9197 0.4953 0.5183 0.1495  -0.0262 0.0362  713  LYS   A CD  
220  C  CE  . LYS   A 20  ? 0.9857 0.5497 0.5738 0.1563  -0.0228 0.036   713  LYS   A CE  
221  N  NZ  . LYS   A 20  ? 1.0297 0.5791 0.6047 0.1645  -0.0101 0.0383  713  LYS   A NZ  
235  N  N   . LYS   A 21  ? 0.747  0.3743 0.3937 0.126   -0.0272 0.0363  714  LYS   A N   
236  C  CA  . LYS   A 21  ? 0.7356 0.3697 0.3873 0.1224  -0.0287 0.0365  714  LYS   A CA  
237  C  C   . LYS   A 21  ? 0.6978 0.3564 0.3736 0.1168  -0.0204 0.0363  714  LYS   A C   
238  O  O   . LYS   A 21  ? 0.6858 0.3562 0.3724 0.1099  -0.0245 0.0356  714  LYS   A O   
239  C  CB  . LYS   A 21  ? 0.7733 0.4047 0.4217 0.1155  -0.0426 0.0355  714  LYS   A CB  
240  C  CG  . LYS   A 21  ? 0.8742 0.4814 0.4984 0.12    -0.0519 0.0354  714  LYS   A CG  
241  C  CD  . LYS   A 21  ? 0.9557 0.5563 0.572  0.1133  -0.0646 0.0348  714  LYS   A CD  
242  C  CE  . LYS   A 21  ? 1.0335 0.6185 0.6338 0.1131  -0.076  0.034   714  LYS   A CE  
243  N  NZ  . LYS   A 21  ? 1.084  0.6622 0.676  0.1048  -0.0884 0.0335  714  LYS   A NZ  
257  N  N   . ILE   A 22  ? 0.6822 0.3473 0.3651 0.1194  -0.0087 0.0369  715  ILE   A N   
258  C  CA  . ILE   A 22  ? 0.6673 0.3549 0.3722 0.1138  -0.0008 0.0365  715  ILE   A CA  
259  C  C   . ILE   A 22  ? 0.6644 0.3547 0.368  0.117   0.0028  0.0374  715  ILE   A C   
260  O  O   . ILE   A 22  ? 0.6708 0.3489 0.3597 0.1258  0.0076  0.0388  715  ILE   A O   
261  C  CB  . ILE   A 22  ? 0.6687 0.3615 0.3806 0.1143  0.0103  0.0368  715  ILE   A CB  
262  C  CG1 . ILE   A 22  ? 0.6768 0.3676 0.3898 0.1117  0.0061  0.0357  715  ILE   A CG1 
263  C  CG2 . ILE   A 22  ? 0.6639 0.3793 0.3971 0.1082  0.0183  0.0364  715  ILE   A CG2 
264  C  CD1 . ILE   A 22  ? 0.6983 0.3849 0.4093 0.1143  0.016   0.0362  715  ILE   A CD1 
276  N  N   . LYS   A 23  ? 0.6427 0.3487 0.3605 0.1107  0.0003  0.0364  716  LYS   A N   
277  C  CA  . LYS   A 23  ? 0.6492 0.36   0.3669 0.1137  0.0028  0.0368  716  LYS   A CA  
278  C  C   . LYS   A 23  ? 0.6168 0.3532 0.3592 0.1062  0.0074  0.0356  716  LYS   A C   
279  O  O   . LYS   A 23  ? 0.5909 0.3369 0.3458 0.0978  0.0028  0.0344  716  LYS   A O   
280  C  CB  . LYS   A 23  ? 0.7047 0.4033 0.4091 0.1137  -0.0084 0.0366  716  LYS   A CB  
281  C  CG  . LYS   A 23  ? 0.8164 0.4899 0.4978 0.1173  -0.0173 0.0371  716  LYS   A CG  
282  C  CD  . LYS   A 23  ? 0.915  0.569  0.574  0.1296  -0.0136 0.0387  716  LYS   A CD  
283  C  CE  . LYS   A 23  ? 0.991  0.6193 0.6268 0.1332  -0.0221 0.0391  716  LYS   A CE  
284  N  NZ  . LYS   A 23  ? 1.0438 0.6592 0.6668 0.1295  -0.0348 0.0385  716  LYS   A NZ  
298  N  N   . VAL   A 24  ? 0.6119 0.3597 0.3605 0.1095  0.0157  0.0359  717  VAL   A N   
299  C  CA  . VAL   A 24  ? 0.6038 0.3758 0.375  0.1027  0.0197  0.0346  717  VAL   A CA  
300  C  C   . VAL   A 24  ? 0.5879 0.3632 0.3623 0.098   0.0103  0.0335  717  VAL   A C   
301  O  O   . VAL   A 24  ? 0.5907 0.3527 0.3495 0.1028  0.0044  0.034   717  VAL   A O   
302  C  CB  . VAL   A 24  ? 0.6255 0.4111 0.4028 0.1073  0.0296  0.035   717  VAL   A CB  
303  C  CG1 . VAL   A 24  ? 0.6289 0.4393 0.4297 0.0994  0.0327  0.0333  717  VAL   A CG1 
304  C  CG2 . VAL   A 24  ? 0.6429 0.4251 0.4156 0.1119  0.0396  0.0365  717  VAL   A CG2 
314  N  N   . LEU   A 25  ? 0.5645 0.356  0.3575 0.0887  0.0091  0.0321  718  LEU   A N   
315  C  CA  . LEU   A 25  ? 0.5595 0.3573 0.3583 0.0831  0.0017  0.031   718  LEU   A CA  
316  C  C   . LEU   A 25  ? 0.5472 0.3639 0.36   0.0829  0.0072  0.03    718  LEU   A C   
317  O  O   . LEU   A 25  ? 0.556  0.3727 0.3652 0.0844  0.0032  0.0296  718  LEU   A O   
318  C  CB  . LEU   A 25  ? 0.5554 0.3607 0.3664 0.0736  -0.0028 0.0301  718  LEU   A CB  
319  C  CG  . LEU   A 25  ? 0.5877 0.3795 0.3879 0.071   -0.0125 0.0304  718  LEU   A CG  
320  C  CD1 . LEU   A 25  ? 0.5795 0.3838 0.3946 0.0628  -0.0148 0.0295  718  LEU   A CD1 
321  C  CD2 . LEU   A 25  ? 0.6054 0.3865 0.3929 0.0707  -0.0212 0.0307  718  LEU   A CD2 
333  N  N   . GLY   A 26  ? 0.5266 0.3587 0.3545 0.0806  0.0159  0.0295  719  GLY   A N   
334  C  CA  . GLY   A 26  ? 0.5188 0.3707 0.3613 0.0796  0.0211  0.0283  719  GLY   A CA  
335  C  C   . GLY   A 26  ? 0.509  0.3751 0.3661 0.0758  0.0306  0.0278  719  GLY   A C   
336  O  O   . GLY   A 26  ? 0.5156 0.3764 0.3728 0.0726  0.0326  0.0282  719  GLY   A O   
340  N  N   . SER   A 27  ? 0.497  0.3811 0.3658 0.0759  0.0361  0.0268  720  SER   A N   
341  C  CA  . SER   A 27  ? 0.4936 0.3931 0.3767 0.0711  0.0453  0.0262  720  SER   A CA  
342  C  C   . SER   A 27  ? 0.4765 0.3974 0.3775 0.0657  0.0455  0.024   720  SER   A C   
343  O  O   . SER   A 27  ? 0.4827 0.4071 0.3833 0.0684  0.0401  0.0232  720  SER   A O   
344  C  CB  . SER   A 27  ? 0.519  0.4203 0.3968 0.078   0.0538  0.0275  720  SER   A CB  
345  O  OG  . SER   A 27  ? 0.5768 0.4606 0.4413 0.0807  0.0565  0.0295  720  SER   A OG  
351  N  N   . GLY   A 28  ? 0.4565 0.3899 0.3715 0.0581  0.0514  0.023   721  GLY   A N   
352  C  CA  . GLY   A 28  ? 0.4455 0.3994 0.3777 0.0524  0.0519  0.0207  721  GLY   A CA  
353  C  C   . GLY   A 28  ? 0.4399 0.4017 0.3835 0.0432  0.0581  0.0198  721  GLY   A C   
354  O  O   . GLY   A 28  ? 0.4482 0.4024 0.3867 0.0423  0.0642  0.0212  721  GLY   A O   
358  N  N   . ALA   A 29  ? 0.4233 0.3985 0.3808 0.0363  0.0565  0.0176  722  ALA   A N   
359  C  CA  . ALA   A 29  ? 0.4131 0.3938 0.3799 0.0269  0.0616  0.0166  722  ALA   A CA  
360  C  C   . ALA   A 29  ? 0.4147 0.3767 0.3723 0.0247  0.0613  0.0178  722  ALA   A C   
361  O  O   . ALA   A 29  ? 0.4297 0.3897 0.3885 0.0189  0.0672  0.0177  722  ALA   A O   
362  C  CB  . ALA   A 29  ? 0.4061 0.401  0.3867 0.021   0.0581  0.014   722  ALA   A CB  
368  N  N   . PHE   A 30  ? 0.3985 0.3467 0.3464 0.029   0.0542  0.0188  723  PHE   A N   
369  C  CA  . PHE   A 30  ? 0.3914 0.3229 0.3299 0.0286  0.0526  0.0198  723  PHE   A CA  
370  C  C   . PHE   A 30  ? 0.4101 0.3268 0.335  0.0332  0.0577  0.0219  723  PHE   A C   
371  O  O   . PHE   A 30  ? 0.4296 0.3323 0.3459 0.0333  0.0574  0.0226  723  PHE   A O   
372  C  CB  . PHE   A 30  ? 0.377  0.3018 0.3109 0.0313  0.0428  0.0201  723  PHE   A CB  
373  C  CG  . PHE   A 30  ? 0.3677 0.2874 0.2928 0.0382  0.0384  0.0212  723  PHE   A CG  
374  C  CD1 . PHE   A 30  ? 0.3777 0.2811 0.2876 0.0442  0.038   0.023   723  PHE   A CD1 
375  C  CD2 . PHE   A 30  ? 0.3605 0.2898 0.2905 0.0392  0.0347  0.0203  723  PHE   A CD2 
376  C  CE1 . PHE   A 30  ? 0.39   0.2866 0.2896 0.0508  0.0341  0.024   723  PHE   A CE1 
377  C  CE2 . PHE   A 30  ? 0.3709 0.2929 0.29   0.046   0.0308  0.0213  723  PHE   A CE2 
378  C  CZ  . PHE   A 30  ? 0.3806 0.2859 0.2844 0.0517  0.0304  0.0232  723  PHE   A CZ  
388  N  N   . GLY   A 31  ? 0.4021 0.3217 0.324  0.0378  0.0621  0.0228  724  GLY   A N   
389  C  CA  . GLY   A 31  ? 0.4152 0.321  0.3234 0.043   0.0671  0.025   724  GLY   A CA  
390  C  C   . GLY   A 31  ? 0.4168 0.3127 0.3129 0.0521  0.0613  0.0262  724  GLY   A C   
391  O  O   . GLY   A 31  ? 0.4098 0.3148 0.3093 0.0552  0.0583  0.0257  724  GLY   A O   
395  N  N   . THR   A 32  ? 0.4253 0.3013 0.3057 0.0567  0.0594  0.0278  725  THR   A N   
396  C  CA  . THR   A 32  ? 0.4356 0.2985 0.3017 0.065   0.0532  0.029   725  THR   A CA  
397  C  C   . THR   A 32  ? 0.4301 0.2794 0.2888 0.0645  0.0449  0.029   725  THR   A C   
398  O  O   . THR   A 32  ? 0.4386 0.281  0.295  0.0623  0.0467  0.029   725  THR   A O   
399  C  CB  . THR   A 32  ? 0.4739 0.3255 0.3258 0.0724  0.0596  0.0311  725  THR   A CB  
400  O  OG1 . THR   A 32  ? 0.4933 0.3608 0.3542 0.0717  0.0687  0.0311  725  THR   A OG1 
401  C  CG2 . THR   A 32  ? 0.4789 0.3167 0.3147 0.0816  0.0534  0.0322  725  THR   A CG2 
409  N  N   . VAL   A 33  ? 0.4223 0.2676 0.2762 0.0667  0.0358  0.0289  726  VAL   A N   
410  C  CA  . VAL   A 33  ? 0.4304 0.2646 0.2774 0.0661  0.0271  0.0289  726  VAL   A CA  
411  C  C   . VAL   A 33  ? 0.4581 0.2752 0.2866 0.0734  0.022   0.0303  726  VAL   A C   
412  O  O   . VAL   A 33  ? 0.468  0.2853 0.2925 0.0772  0.0212  0.0306  726  VAL   A O   
413  C  CB  . VAL   A 33  ? 0.4256 0.2716 0.2846 0.0595  0.0201  0.0275  726  VAL   A CB  
414  C  CG1 . VAL   A 33  ? 0.4334 0.27   0.285  0.0589  0.0103  0.0277  726  VAL   A CG1 
415  C  CG2 . VAL   A 33  ? 0.418  0.2781 0.2929 0.0529  0.0247  0.0261  726  VAL   A CG2 
425  N  N   . TYR   A 34  ? 0.4645 0.2661 0.2806 0.0761  0.0188  0.0309  727  TYR   A N   
426  C  CA  . TYR   A 34  ? 0.4843 0.2673 0.2813 0.0824  0.0128  0.032   727  TYR   A CA  
427  C  C   . TYR   A 34  ? 0.4917 0.2704 0.2864 0.0786  0.0019  0.0314  727  TYR   A C   
428  O  O   . TYR   A 34  ? 0.4825 0.2709 0.2885 0.0731  0.0007  0.0304  727  TYR   A O   
429  C  CB  . TYR   A 34  ? 0.4968 0.2638 0.2791 0.0892  0.018   0.0334  727  TYR   A CB  
430  C  CG  . TYR   A 34  ? 0.515  0.2869 0.3003 0.0916  0.0303  0.0342  727  TYR   A CG  
431  C  CD1 . TYR   A 34  ? 0.5417 0.3074 0.3164 0.0992  0.0346  0.0356  727  TYR   A CD1 
432  C  CD2 . TYR   A 34  ? 0.5202 0.3014 0.317  0.0865  0.0376  0.0337  727  TYR   A CD2 
433  C  CE1 . TYR   A 34  ? 0.5552 0.328  0.3336 0.1008  0.0463  0.0365  727  TYR   A CE1 
434  C  CE2 . TYR   A 34  ? 0.5385 0.3253 0.3385 0.0869  0.049   0.0344  727  TYR   A CE2 
435  C  CZ  . TYR   A 34  ? 0.5646 0.348  0.3559 0.094   0.0534  0.0359  727  TYR   A CZ  
436  O  OH  . TYR   A 34  ? 0.5878 0.3782 0.3823 0.0943  0.065   0.0369  727  TYR   A OH  
446  N  N   . LYS   A 35  ? 0.5071 0.2711 0.2863 0.0817  -0.0059 0.032   728  LYS   A N   
447  C  CA  . LYS   A 35  ? 0.5282 0.2867 0.3027 0.0783  -0.0164 0.0316  728  LYS   A CA  
448  C  C   . LYS   A 35  ? 0.5684 0.3075 0.3247 0.0854  -0.0174 0.0323  728  LYS   A C   
449  O  O   . LYS   A 35  ? 0.584  0.3114 0.3284 0.0928  -0.0118 0.0335  728  LYS   A O   
450  C  CB  . LYS   A 35  ? 0.5508 0.3061 0.3202 0.0748  -0.0257 0.0316  728  LYS   A CB  
451  C  CG  . LYS   A 35  ? 0.621  0.3565 0.3693 0.0816  -0.0279 0.0327  728  LYS   A CG  
452  C  CD  . LYS   A 35  ? 0.696  0.426  0.4373 0.0769  -0.0377 0.0326  728  LYS   A CD  
453  C  CE  . LYS   A 35  ? 0.772  0.4807 0.4904 0.0843  -0.0398 0.0336  728  LYS   A CE  
454  N  NZ  . LYS   A 35  ? 0.8403 0.5278 0.5388 0.0901  -0.0435 0.0342  728  LYS   A NZ  
468  N  N   . GLY   A 36  ? 0.5857 0.3221 0.3397 0.0835  -0.0244 0.0317  729  GLY   A N   
469  C  CA  . GLY   A 36  ? 0.6254 0.3435 0.3619 0.0902  -0.0266 0.0321  729  GLY   A CA  
470  C  C   . GLY   A 36  ? 0.652  0.3699 0.3865 0.0868  -0.0376 0.0311  729  GLY   A C   
471  O  O   . GLY   A 36  ? 0.6358 0.3677 0.3822 0.0788  -0.0437 0.0303  729  GLY   A O   
475  N  N   . LEU   A 37  ? 0.6849 0.3872 0.404  0.0931  -0.0403 0.0311  730  LEU   A N   
476  C  CA  . LEU   A 37  ? 0.7159 0.4182 0.4319 0.0912  -0.0509 0.0299  730  LEU   A CA  
477  C  C   . LEU   A 37  ? 0.7404 0.4401 0.4541 0.0973  -0.0471 0.0294  730  LEU   A C   
478  O  O   . LEU   A 37  ? 0.7536 0.4356 0.4519 0.1056  -0.0424 0.0302  730  LEU   A O   
479  C  CB  . LEU   A 37  ? 0.7399 0.422  0.4349 0.0936  -0.06   0.0303  730  LEU   A CB  
480  C  CG  . LEU   A 37  ? 0.7708 0.4515 0.4636 0.0872  -0.0662 0.0307  730  LEU   A CG  
481  C  CD1 . LEU   A 37  ? 0.7956 0.4503 0.4628 0.0919  -0.0729 0.0313  730  LEU   A CD1 
482  C  CD2 . LEU   A 37  ? 0.7729 0.4719 0.4801 0.0759  -0.0749 0.0296  730  LEU   A CD2 
494  N  N   . TRP   A 38  ? 0.7418 0.4585 0.4696 0.0938  -0.0486 0.0281  731  TRP   A N   
495  C  CA  . TRP   A 38  ? 0.7648 0.479  0.4894 0.1001  -0.0455 0.0274  731  TRP   A CA  
496  C  C   . TRP   A 38  ? 0.7983 0.5093 0.5141 0.1024  -0.057  0.0261  731  TRP   A C   
497  O  O   . TRP   A 38  ? 0.7903 0.5165 0.5159 0.0958  -0.0659 0.0252  731  TRP   A O   
498  C  CB  . TRP   A 38  ? 0.7476 0.4812 0.4908 0.0963  -0.0401 0.0266  731  TRP   A CB  
499  C  CG  . TRP   A 38  ? 0.753  0.4848 0.4924 0.1025  -0.0386 0.0256  731  TRP   A CG  
500  C  CD1 . TRP   A 38  ? 0.7755 0.488  0.4981 0.1115  -0.0337 0.0259  731  TRP   A CD1 
501  C  CD2 . TRP   A 38  ? 0.7464 0.4957 0.4976 0.101   -0.0418 0.0241  731  TRP   A CD2 
502  N  NE1 . TRP   A 38  ? 0.7788 0.4944 0.501  0.1158  -0.0341 0.0246  731  TRP   A NE1 
503  C  CE2 . TRP   A 38  ? 0.764  0.5027 0.5038 0.1099  -0.0391 0.0234  731  TRP   A CE2 
504  C  CE3 . TRP   A 38  ? 0.7395 0.5122 0.5092 0.0934  -0.0463 0.0234  731  TRP   A CE3 
505  C  CZ2 . TRP   A 38  ? 0.7668 0.5175 0.5126 0.1123  -0.0411 0.0219  731  TRP   A CZ2 
506  C  CZ3 . TRP   A 38  ? 0.7425 0.5284 0.5191 0.0954  -0.0479 0.0221  731  TRP   A CZ3 
507  C  CH2 . TRP   A 38  ? 0.7512 0.5261 0.5158 0.1051  -0.0454 0.0213  731  TRP   A CH2 
518  N  N   . ILE   A 39  ? 0.8369 0.5284 0.534  0.1117  -0.057  0.0261  732  ILE   A N   
519  C  CA  . ILE   A 39  ? 0.8738 0.5604 0.5604 0.1155  -0.0676 0.0247  732  ILE   A CA  
520  C  C   . ILE   A 39  ? 0.9001 0.5868 0.585  0.1232  -0.0632 0.0237  732  ILE   A C   
521  O  O   . ILE   A 39  ? 0.9137 0.5807 0.5831 0.1315  -0.0562 0.0244  732  ILE   A O   
522  C  CB  . ILE   A 39  ? 0.9039 0.5647 0.567  0.1213  -0.0713 0.0254  732  ILE   A CB  
523  C  CG1 . ILE   A 39  ? 0.9168 0.5733 0.5784 0.1151  -0.0734 0.0266  732  ILE   A CG1 
524  C  CG2 . ILE   A 39  ? 0.9211 0.5782 0.5738 0.1245  -0.0838 0.0235  732  ILE   A CG2 
525  C  CD1 . ILE   A 39  ? 0.937  0.5797 0.5914 0.1194  -0.0618 0.0287  732  ILE   A CD1 
537  N  N   . PRO   A 40  ? 0.9067 0.6142 0.6062 0.1209  -0.0659 0.0222  733  PRO   A N   
538  C  CA  . PRO   A 40  ? 0.9285 0.6331 0.6231 0.1296  -0.0616 0.0212  733  PRO   A CA  
539  C  C   . PRO   A 40  ? 0.9665 0.6529 0.6398 0.14    -0.0673 0.0203  733  PRO   A C   
540  O  O   . PRO   A 40  ? 0.9688 0.6562 0.6381 0.1388  -0.0785 0.0195  733  PRO   A O   
541  C  CB  . PRO   A 40  ? 0.9193 0.651  0.6324 0.1256  -0.0663 0.0197  733  PRO   A CB  
542  C  CG  . PRO   A 40  ? 0.908  0.6573 0.6377 0.1136  -0.0707 0.0202  733  PRO   A CG  
543  C  CD  . PRO   A 40  ? 0.8899 0.6233 0.6089 0.1111  -0.0732 0.0215  733  PRO   A CD  
551  N  N   . GLU   A 41  ? 0.9966 0.6649 0.6549 0.1497  -0.0596 0.0205  734  GLU   A N   
552  C  CA  . GLU   A 41  ? 1.036  0.6849 0.6721 0.1607  -0.0644 0.0195  734  GLU   A CA  
553  C  C   . GLU   A 41  ? 1.0414 0.7062 0.6813 0.1637  -0.0763 0.0169  734  GLU   A C   
554  O  O   . GLU   A 41  ? 1.0319 0.7163 0.6859 0.1624  -0.0759 0.0159  734  GLU   A O   
555  C  CB  . GLU   A 41  ? 1.0908 0.7171 0.7097 0.1702  -0.0531 0.0203  734  GLU   A CB  
556  C  CG  . GLU   A 41  ? 1.1706 0.7753 0.7776 0.1707  -0.0432 0.0228  734  GLU   A CG  
557  C  CD  . GLU   A 41  ? 1.2728 0.859  0.8619 0.1752  -0.0492 0.0232  734  GLU   A CD  
558  O  OE1 . GLU   A 41  ? 1.2982 0.8775 0.8746 0.1824  -0.0585 0.0215  734  GLU   A OE1 
559  O  OE2 . GLU   A 41  ? 1.3021 0.8807 0.8891 0.1719  -0.0446 0.0252  734  GLU   A OE2 
566  N  N   . GLY   A 42  ? 1.0537 0.7106 0.6809 0.1678  -0.0868 0.0158  735  GLY   A N   
567  C  CA  . GLY   A 42  ? 1.0583 0.7319 0.6889 0.1704  -0.0994 0.0131  735  GLY   A CA  
568  C  C   . GLY   A 42  ? 1.0484 0.7517 0.7017 0.1578  -0.108  0.0126  735  GLY   A C   
569  O  O   . GLY   A 42  ? 1.0406 0.7665 0.7041 0.1582  -0.1159 0.0106  735  GLY   A O   
573  N  N   . GLU   A 43  ? 1.0449 0.7487 0.7059 0.1467  -0.1063 0.0144  736  GLU   A N   
574  C  CA  . GLU   A 43  ? 1.0339 0.762  0.7143 0.1334  -0.1134 0.0144  736  GLU   A CA  
575  C  C   . GLU   A 43  ? 1.0344 0.7475 0.7058 0.1266  -0.1176 0.0156  736  GLU   A C   
576  O  O   . GLU   A 43  ? 1.0508 0.7379 0.7055 0.1318  -0.1118 0.0169  736  GLU   A O   
577  C  CB  . GLU   A 43  ? 1.062  0.8076 0.763  0.1265  -0.1044 0.0155  736  GLU   A CB  
578  C  CG  . GLU   A 43  ? 1.137  0.8989 0.8475 0.132   -0.101  0.0143  736  GLU   A CG  
579  C  CD  . GLU   A 43  ? 1.2282 1.0174 0.9503 0.1308  -0.1119 0.0123  736  GLU   A CD  
580  O  OE1 . GLU   A 43  ? 1.2468 1.0385 0.9632 0.1416  -0.1135 0.0105  736  GLU   A OE1 
581  O  OE2 . GLU   A 43  ? 1.2519 1.0599 0.9879 0.1192  -0.1188 0.0124  736  GLU   A OE2 
588  N  N   . LYS   A 44  ? 1.017  0.746  0.6986 0.1152  -0.1275 0.0152  737  LYS   A N   
589  C  CA  . LYS   A 44  ? 1.0244 0.7391 0.6964 0.1079  -0.133  0.0162  737  LYS   A CA  
590  C  C   . LYS   A 44  ? 1.0008 0.7239 0.6863 0.0961  -0.1288 0.018   737  LYS   A C   
591  O  O   . LYS   A 44  ? 1.0154 0.7229 0.6906 0.0915  -0.1312 0.0192  737  LYS   A O   
592  C  CB  . LYS   A 44  ? 1.061  0.7828 0.7296 0.1028  -0.1488 0.0144  737  LYS   A CB  
593  C  CG  . LYS   A 44  ? 1.1056 0.8602 0.7968 0.0895  -0.1557 0.0138  737  LYS   A CG  
594  C  CD  . LYS   A 44  ? 1.1636 0.9327 0.8549 0.0874  -0.17   0.0114  737  LYS   A CD  
595  C  CE  . LYS   A 44  ? 1.2037 0.9944 0.9052 0.0963  -0.1699 0.0095  737  LYS   A CE  
596  N  NZ  . LYS   A 44  ? 1.2265 1.0345 0.9295 0.0944  -0.1842 0.007   737  LYS   A NZ  
610  N  N   . VAL   A 45  ? 0.9616 0.7079 0.6685 0.092   -0.123  0.0183  738  VAL   A N   
611  C  CA  . VAL   A 45  ? 0.9331 0.6897 0.6539 0.0809  -0.1198 0.0197  738  VAL   A CA  
612  C  C   . VAL   A 45  ? 0.9043 0.6451 0.621  0.0843  -0.1073 0.0215  738  VAL   A C   
613  O  O   . VAL   A 45  ? 0.9106 0.6485 0.6278 0.0923  -0.0977 0.0217  738  VAL   A O   
614  C  CB  . VAL   A 45  ? 0.9302 0.7191 0.6752 0.075   -0.1194 0.0191  738  VAL   A CB  
615  C  CG1 . VAL   A 45  ? 0.9323 0.7318 0.6909 0.0632  -0.117  0.0205  738  VAL   A CG1 
616  C  CG2 . VAL   A 45  ? 0.9326 0.7403 0.6826 0.0721  -0.1315 0.0173  738  VAL   A CG2 
626  N  N   . LYS   A 46  ? 0.8708 0.6018 0.583  0.0782  -0.1075 0.0229  739  LYS   A N   
627  C  CA  . LYS   A 46  ? 0.8458 0.5661 0.5562 0.0807  -0.0964 0.0246  739  LYS   A CA  
628  C  C   . LYS   A 46  ? 0.7896 0.5321 0.5219 0.0721  -0.0922 0.0249  739  LYS   A C   
629  O  O   . LYS   A 46  ? 0.7884 0.5391 0.5262 0.0622  -0.0987 0.0251  739  LYS   A O   
630  C  CB  . LYS   A 46  ? 0.8896 0.5876 0.5821 0.08    -0.0994 0.0257  739  LYS   A CB  
631  C  CG  . LYS   A 46  ? 0.9723 0.6448 0.6406 0.0892  -0.1028 0.0256  739  LYS   A CG  
632  C  CD  . LYS   A 46  ? 1.0549 0.7038 0.7038 0.0899  -0.1047 0.0269  739  LYS   A CD  
633  C  CE  . LYS   A 46  ? 1.1176 0.7616 0.7578 0.0813  -0.1187 0.0262  739  LYS   A CE  
634  N  NZ  . LYS   A 46  ? 1.1671 0.7854 0.7858 0.0828  -0.1204 0.0275  739  LYS   A NZ  
648  N  N   . ILE   A 47  ? 0.7409 0.4921 0.4846 0.0753  -0.0817 0.0251  740  ILE   A N   
649  C  CA  . ILE   A 47  ? 0.6974 0.4696 0.4616 0.068   -0.0775 0.0252  740  ILE   A CA  
650  C  C   . ILE   A 47  ? 0.6579 0.424  0.4231 0.0671  -0.0688 0.0266  740  ILE   A C   
651  O  O   . ILE   A 47  ? 0.655  0.4121 0.416  0.074   -0.0595 0.027   740  ILE   A O   
652  C  CB  . ILE   A 47  ? 0.6953 0.4819 0.4712 0.0718  -0.0722 0.0243  740  ILE   A CB  
653  C  CG1 . ILE   A 47  ? 0.7101 0.5063 0.4862 0.0734  -0.0813 0.0228  740  ILE   A CG1 
654  C  CG2 . ILE   A 47  ? 0.6813 0.4882 0.4774 0.065   -0.0673 0.0244  740  ILE   A CG2 
655  C  CD1 . ILE   A 47  ? 0.7373 0.5346 0.5125 0.0827  -0.0767 0.0217  740  ILE   A CD1 
667  N  N   . PRO   A 48  ? 0.6294 0.4012 0.4005 0.059   -0.0712 0.0271  741  PRO   A N   
668  C  CA  . PRO   A 48  ? 0.6115 0.3799 0.3843 0.0595  -0.0628 0.0281  741  PRO   A CA  
669  C  C   . PRO   A 48  ? 0.564  0.3477 0.3535 0.0599  -0.0532 0.0277  741  PRO   A C   
670  O  O   . PRO   A 48  ? 0.5478 0.35   0.3523 0.055   -0.0546 0.0269  741  PRO   A O   
671  C  CB  . PRO   A 48  ? 0.6228 0.3952 0.398  0.0506  -0.0688 0.0285  741  PRO   A CB  
672  C  CG  . PRO   A 48  ? 0.6392 0.4108 0.4087 0.0455  -0.0805 0.0281  741  PRO   A CG  
673  C  CD  . PRO   A 48  ? 0.6164 0.3981 0.3921 0.0489  -0.0811 0.027   741  PRO   A CD  
681  N  N   . VAL   A 49  ? 0.5366 0.3124 0.3229 0.0658  -0.0434 0.0282  742  VAL   A N   
682  C  CA  . VAL   A 49  ? 0.511  0.2978 0.3102 0.0661  -0.0338 0.0279  742  VAL   A CA  
683  C  C   . VAL   A 49  ? 0.4843 0.2718 0.2872 0.0659  -0.0258 0.0285  742  VAL   A C   
684  O  O   . VAL   A 49  ? 0.4911 0.2668 0.2829 0.0688  -0.0259 0.0294  742  VAL   A O   
685  C  CB  . VAL   A 49  ? 0.528  0.3055 0.3195 0.0735  -0.0286 0.0277  742  VAL   A CB  
686  C  CG1 . VAL   A 49  ? 0.536  0.317  0.3264 0.0746  -0.0359 0.0266  742  VAL   A CG1 
687  C  CG2 . VAL   A 49  ? 0.546  0.302  0.3189 0.0811  -0.0252 0.0288  742  VAL   A CG2 
697  N  N   . ALA   A 50  ? 0.4528 0.2546 0.2708 0.0627  -0.0192 0.0279  743  ALA   A N   
698  C  CA  . ALA   A 50  ? 0.4427 0.2484 0.2664 0.0625  -0.0107 0.0282  743  ALA   A CA  
699  C  C   . ALA   A 50  ? 0.4412 0.2439 0.2645 0.0658  -0.0013 0.0282  743  ALA   A C   
700  O  O   . ALA   A 50  ? 0.4377 0.2419 0.2628 0.0658  -0.0015 0.0275  743  ALA   A O   
701  C  CB  . ALA   A 50  ? 0.4244 0.2487 0.2654 0.0553  -0.011  0.0274  743  ALA   A CB  
707  N  N   . ILE   A 51  ? 0.4369 0.2344 0.2562 0.069   0.0069  0.029   744  ILE   A N   
708  C  CA  . ILE   A 51  ? 0.448  0.2401 0.2643 0.0715  0.0165  0.0293  744  ILE   A CA  
709  C  C   . ILE   A 51  ? 0.4418 0.246  0.2698 0.0678  0.0253  0.0292  744  ILE   A C   
710  O  O   . ILE   A 51  ? 0.4417 0.2481 0.2694 0.0693  0.0265  0.0298  744  ILE   A O   
711  C  CB  . ILE   A 51  ? 0.4699 0.2418 0.2665 0.0796  0.0182  0.0308  744  ILE   A CB  
712  C  CG1 . ILE   A 51  ? 0.4964 0.2562 0.2806 0.0833  0.0084  0.0307  744  ILE   A CG1 
713  C  CG2 . ILE   A 51  ? 0.4785 0.2434 0.2703 0.0817  0.0289  0.0314  744  ILE   A CG2 
714  C  CD1 . ILE   A 51  ? 0.5347 0.2746 0.2984 0.0911  0.0062  0.0321  744  ILE   A CD1 
726  N  N   . LYS   A 52  ? 0.4392 0.2508 0.2764 0.0634  0.0311  0.0284  745  LYS   A N   
727  C  CA  . LYS   A 52  ? 0.4442 0.2691 0.2938 0.0586  0.0387  0.0279  745  LYS   A CA  
728  C  C   . LYS   A 52  ? 0.4809 0.2995 0.3258 0.0586  0.0495  0.0286  745  LYS   A C   
729  O  O   . LYS   A 52  ? 0.4863 0.2944 0.3239 0.0591  0.0514  0.0286  745  LYS   A O   
730  C  CB  . LYS   A 52  ? 0.4303 0.2711 0.2961 0.0515  0.0365  0.0262  745  LYS   A CB  
731  C  CG  . LYS   A 52  ? 0.4465 0.3021 0.3256 0.0461  0.0432  0.0254  745  LYS   A CG  
732  C  CD  . LYS   A 52  ? 0.4554 0.3273 0.3502 0.0399  0.0395  0.0236  745  LYS   A CD  
733  C  CE  . LYS   A 52  ? 0.461  0.3323 0.3582 0.0366  0.0394  0.0226  745  LYS   A CE  
734  N  NZ  . LYS   A 52  ? 0.4313 0.3182 0.3435 0.03    0.0396  0.0209  745  LYS   A NZ  
748  N  N   . GLU   A 53  ? 0.5135 0.34   0.3631 0.0576  0.0566  0.0291  746  GLU   A N   
749  C  CA  . GLU   A 53  ? 0.561  0.3857 0.4088 0.0555  0.0678  0.0299  746  GLU   A CA  
750  C  C   . GLU   A 53  ? 0.5971 0.4427 0.462  0.0488  0.0727  0.0289  746  GLU   A C   
751  O  O   . GLU   A 53  ? 0.5787 0.4369 0.452  0.0496  0.0686  0.0283  746  GLU   A O   
752  C  CB  . GLU   A 53  ? 0.5948 0.4096 0.4297 0.0626  0.0726  0.032   746  GLU   A CB  
753  C  CG  . GLU   A 53  ? 0.6778 0.4736 0.4953 0.071   0.0663  0.0331  746  GLU   A CG  
754  C  CD  . GLU   A 53  ? 0.7384 0.5239 0.5423 0.0783  0.0718  0.0352  746  GLU   A CD  
755  O  OE1 . GLU   A 53  ? 0.7386 0.5358 0.5486 0.0782  0.0783  0.0358  746  GLU   A OE1 
756  O  OE2 . GLU   A 53  ? 0.7837 0.5497 0.5705 0.0848  0.0692  0.0362  746  GLU   A OE2 
763  N  N   . LEU   A 54  ? 0.6441 0.4921 0.5118 0.043   0.0818  0.0289  747  LEU   A N   
764  C  CA  . LEU   A 54  ? 0.695  0.5635 0.5782 0.0364  0.0874  0.0279  747  LEU   A CA  
765  C  C   . LEU   A 54  ? 0.7579 0.6302 0.638  0.0399  0.0951  0.0297  747  LEU   A C   
766  O  O   . LEU   A 54  ? 0.7739 0.63   0.6386 0.0457  0.0983  0.0317  747  LEU   A O   
767  C  CB  . LEU   A 54  ? 0.7016 0.5709 0.5892 0.0266  0.093   0.0269  747  LEU   A CB  
768  C  CG  . LEU   A 54  ? 0.7251 0.5944 0.6179 0.0229  0.0864  0.0249  747  LEU   A CG  
769  C  CD1 . LEU   A 54  ? 0.7385 0.5989 0.6271 0.0157  0.092   0.0244  747  LEU   A CD1 
770  C  CD2 . LEU   A 54  ? 0.7226 0.6135 0.6333 0.0193  0.0817  0.023   747  LEU   A CD2 
782  N  N   . ARG   A 55  ? 0.7906 0.6847 0.6848 0.0372  0.0982  0.0289  748  ARG   A N   
783  C  CA  . ARG   A 55  ? 0.8357 0.7377 0.729  0.0404  0.1065  0.0305  748  ARG   A CA  
784  C  C   . ARG   A 55  ? 0.8647 0.7679 0.7597 0.0309  0.1172  0.031   748  ARG   A C   
785  O  O   . ARG   A 55  ? 0.8603 0.7788 0.7695 0.0212  0.1192  0.0292  748  ARG   A O   
786  C  CB  . ARG   A 55  ? 0.862  0.7886 0.7699 0.0418  0.1052  0.0293  748  ARG   A CB  
787  C  CG  . ARG   A 55  ? 0.9335 0.8564 0.836  0.0517  0.0956  0.0292  748  ARG   A CG  
788  C  CD  . ARG   A 55  ? 0.9891 0.9315 0.9068 0.0498  0.0901  0.0268  748  ARG   A CD  
789  N  NE  . ARG   A 55  ? 1.0479 0.9911 0.9601 0.06    0.0845  0.027   748  ARG   A NE  
790  C  CZ  . ARG   A 55  ? 1.0842 1.0421 1.0058 0.061   0.0796  0.0252  748  ARG   A CZ  
791  N  NH1 . ARG   A 55  ? 1.0737 1.048  1.0118 0.0523  0.0793  0.0229  748  ARG   A NH1 
792  N  NH2 . ARG   A 55  ? 1.0936 1.0482 1.0064 0.0709  0.0748  0.0256  748  ARG   A NH2 
806  N  N   . GLU   A 56  ? 0.8929 0.778  0.7721 0.0332  0.1236  0.0333  749  GLU   A N   
807  C  CA  . GLU   A 56  ? 0.9172 0.7988 0.7943 0.0237  0.1339  0.034   749  GLU   A CA  
808  C  C   . GLU   A 56  ? 0.9163 0.8223 0.8064 0.0181  0.1432  0.0343  749  GLU   A C   
809  O  O   . GLU   A 56  ? 0.9094 0.8365 0.817  0.0101  0.1427  0.0322  749  GLU   A O   
810  C  CB  . GLU   A 56  ? 0.972  0.8263 0.8267 0.0287  0.1384  0.0366  749  GLU   A CB  
811  C  CG  . GLU   A 56  ? 1.0623 0.8928 0.9032 0.0341  0.1298  0.0362  749  GLU   A CG  
812  C  CD  . GLU   A 56  ? 1.1648 0.9891 1.0073 0.026   0.1275  0.0343  749  GLU   A CD  
813  O  OE1 . GLU   A 56  ? 1.1719 1.0072 1.0267 0.024   0.1196  0.0321  749  GLU   A OE1 
814  O  OE2 . GLU   A 56  ? 1.2095 1.0164 1.0392 0.0222  0.1337  0.0351  749  GLU   A OE2 
821  N  N   . ALA   A 62  ? 0.8649 0.6853 0.7196 -0.0206 0.138   0.0276  755  ALA   A N   
822  C  CA  . ALA   A 62  ? 0.8629 0.694  0.725  -0.0096 0.1304  0.0278  755  ALA   A CA  
823  C  C   . ALA   A 62  ? 0.8683 0.6792 0.7159 0.0012  0.1226  0.0281  755  ALA   A C   
824  O  O   . ALA   A 62  ? 0.8674 0.6862 0.723  0.0058  0.1131  0.0267  755  ALA   A O   
825  C  CB  . ALA   A 62  ? 0.8661 0.7051 0.7288 -0.0057 0.1362  0.0301  755  ALA   A CB  
830  N  N   . ASN   A 63  ? 0.8713 0.6565 0.6975 0.0049  0.1265  0.0297  756  ASN   A N   
831  C  CA  . ASN   A 63  ? 0.8733 0.6398 0.6852 0.0151  0.119   0.0296  756  ASN   A CA  
832  C  C   . ASN   A 63  ? 0.8509 0.6127 0.6625 0.0123  0.1142  0.0274  756  ASN   A C   
833  O  O   . ASN   A 63  ? 0.8557 0.6125 0.6635 0.0201  0.1057  0.0267  756  ASN   A O   
834  C  CB  . ASN   A 63  ? 0.9113 0.6511 0.6992 0.0208  0.1243  0.0318  756  ASN   A CB  
835  C  CG  . ASN   A 63  ? 0.9641 0.7027 0.7473 0.0298  0.1243  0.0338  756  ASN   A CG  
836  O  OD1 . ASN   A 63  ? 0.9696 0.7252 0.7655 0.0334  0.119   0.0337  756  ASN   A OD1 
837  N  ND2 . ASN   A 63  ? 0.9945 0.7108 0.757  0.0342  0.13    0.0358  756  ASN   A ND2 
844  N  N   . LYS   A 64  ? 0.8256 0.589  0.6403 0.0012  0.1195  0.0263  757  LYS   A N   
845  C  CA  . LYS   A 64  ? 0.8064 0.5664 0.6211 -0.0022 0.1156  0.0241  757  LYS   A CA  
846  C  C   . LYS   A 64  ? 0.762  0.5442 0.5961 0.0002  0.1059  0.0224  757  LYS   A C   
847  O  O   . LYS   A 64  ? 0.766  0.5439 0.5972 0.0054  0.0988  0.0213  757  LYS   A O   
848  C  CB  . LYS   A 64  ? 0.8331 0.5932 0.6492 -0.0162 0.1234  0.0234  757  LYS   A CB  
849  C  CG  . LYS   A 64  ? 0.8809 0.6456 0.7035 -0.0221 0.1194  0.0207  757  LYS   A CG  
850  C  CD  . LYS   A 64  ? 0.9539 0.6955 0.758  -0.016  0.1156  0.02    757  LYS   A CD  
851  C  CE  . LYS   A 64  ? 0.9971 0.7397 0.804  -0.0233 0.1139  0.0176  757  LYS   A CE  
852  N  NZ  . LYS   A 64  ? 1.0339 0.7563 0.8233 -0.0154 0.1095  0.0167  757  LYS   A NZ  
866  N  N   . GLU   A 65  ? 0.7161 0.522  0.5692 -0.0033 0.1057  0.0222  758  GLU   A N   
867  C  CA  . GLU   A 65  ? 0.681  0.5068 0.5513 -0.0015 0.097   0.0207  758  GLU   A CA  
868  C  C   . GLU   A 65  ? 0.6411 0.4626 0.5069 0.0097  0.0882  0.0212  758  GLU   A C   
869  O  O   . GLU   A 65  ? 0.6352 0.4604 0.505  0.0116  0.0812  0.0199  758  GLU   A O   
870  C  CB  . GLU   A 65  ? 0.7074 0.557  0.5954 -0.0046 0.0983  0.0207  758  GLU   A CB  
871  C  CG  . GLU   A 65  ? 0.7709 0.6391 0.6753 -0.0145 0.0993  0.0186  758  GLU   A CG  
872  C  CD  . GLU   A 65  ? 0.854  0.7465 0.7754 -0.0144 0.0981  0.0183  758  GLU   A CD  
873  O  OE1 . GLU   A 65  ? 0.8576 0.7567 0.7838 -0.0073 0.0906  0.0182  758  GLU   A OE1 
874  O  OE2 . GLU   A 65  ? 0.8846 0.7896 0.8139 -0.0214 0.1046  0.0181  758  GLU   A OE2 
881  N  N   . ILE   A 66  ? 0.6095 0.4232 0.4665 0.0168  0.0885  0.0231  759  ILE   A N   
882  C  CA  . ILE   A 66  ? 0.584  0.3948 0.4373 0.0263  0.0797  0.0235  759  ILE   A CA  
883  C  C   . ILE   A 66  ? 0.5482 0.3418 0.3871 0.0315  0.0764  0.0231  759  ILE   A C   
884  O  O   . ILE   A 66  ? 0.5194 0.3177 0.3612 0.0362  0.0678  0.0224  759  ILE   A O   
885  C  CB  . ILE   A 66  ? 0.6071 0.4147 0.4548 0.0327  0.08    0.0255  759  ILE   A CB  
886  C  CG1 . ILE   A 66  ? 0.6251 0.4379 0.4758 0.0393  0.0693  0.0254  759  ILE   A CG1 
887  C  CG2 . ILE   A 66  ? 0.6314 0.4162 0.4588 0.0372  0.0857  0.0272  759  ILE   A CG2 
888  C  CD1 . ILE   A 66  ? 0.6423 0.4609 0.495  0.043   0.0681  0.0266  759  ILE   A CD1 
900  N  N   . LEU   A 67  ? 0.5444 0.319  0.3678 0.0304  0.0831  0.0234  760  LEU   A N   
901  C  CA  . LEU   A 67  ? 0.5445 0.3022 0.3527 0.0364  0.0801  0.0228  760  LEU   A CA  
902  C  C   . LEU   A 67  ? 0.5149 0.2811 0.3312 0.0333  0.0762  0.0208  760  LEU   A C   
903  O  O   . LEU   A 67  ? 0.5119 0.275  0.3233 0.0402  0.0698  0.0201  760  LEU   A O   
904  C  CB  . LEU   A 67  ? 0.5676 0.3001 0.3545 0.0361  0.0886  0.0237  760  LEU   A CB  
905  C  CG  . LEU   A 67  ? 0.6021 0.3211 0.3756 0.0416  0.0922  0.0259  760  LEU   A CG  
906  C  CD1 . LEU   A 67  ? 0.6249 0.3232 0.3814 0.0373  0.103   0.027   760  LEU   A CD1 
907  C  CD2 . LEU   A 67  ? 0.6219 0.3303 0.3833 0.054   0.0844  0.026   760  LEU   A CD2 
919  N  N   . ASP   A 68  ? 0.4943 0.2721 0.323  0.0235  0.0797  0.0198  761  ASP   A N   
920  C  CA  . ASP   A 68  ? 0.4877 0.2746 0.325  0.0205  0.0758  0.0179  761  ASP   A CA  
921  C  C   . ASP   A 68  ? 0.4511 0.2562 0.3021 0.0253  0.0662  0.0175  761  ASP   A C   
922  O  O   . ASP   A 68  ? 0.4473 0.2535 0.2973 0.0294  0.0609  0.0165  761  ASP   A O   
923  C  CB  . ASP   A 68  ? 0.5224 0.321  0.3724 0.0088  0.0807  0.0169  761  ASP   A CB  
924  C  CG  . ASP   A 68  ? 0.6291 0.4108 0.4662 0.0014  0.0894  0.0168  761  ASP   A CG  
925  O  OD1 . ASP   A 68  ? 0.6517 0.4097 0.4679 0.0059  0.092   0.0175  761  ASP   A OD1 
926  O  OD2 . ASP   A 68  ? 0.6693 0.461  0.5166 -0.009  0.0935  0.0159  761  ASP   A OD2 
931  N  N   . GLU   A 69  ? 0.4298 0.248  0.2917 0.0251  0.0642  0.0183  762  GLU   A N   
932  C  CA  . GLU   A 69  ? 0.4142 0.2476 0.2872 0.0287  0.0553  0.0182  762  GLU   A CA  
933  C  C   . GLU   A 69  ? 0.4142 0.2383 0.2759 0.038   0.0495  0.0187  762  GLU   A C   
934  O  O   . GLU   A 69  ? 0.4001 0.2334 0.2672 0.0407  0.0426  0.0181  762  GLU   A O   
935  C  CB  . GLU   A 69  ? 0.4116 0.2559 0.2939 0.0274  0.055   0.0191  762  GLU   A CB  
936  C  CG  . GLU   A 69  ? 0.4122 0.2702 0.3043 0.0296  0.046   0.019   762  GLU   A CG  
937  C  CD  . GLU   A 69  ? 0.3986 0.2686 0.3006 0.0276  0.0451  0.0195  762  GLU   A CD  
938  O  OE1 . GLU   A 69  ? 0.3818 0.2524 0.2849 0.0249  0.0517  0.0198  762  GLU   A OE1 
939  O  OE2 . GLU   A 69  ? 0.3892 0.2683 0.2974 0.0288  0.0379  0.0195  762  GLU   A OE2 
946  N  N   . ALA   A 70  ? 0.4287 0.235  0.2743 0.0431  0.0524  0.0199  763  ALA   A N   
947  C  CA  . ALA   A 70  ? 0.4449 0.2417 0.2784 0.0525  0.0468  0.0202  763  ALA   A CA  
948  C  C   . ALA   A 70  ? 0.4512 0.2442 0.279  0.0558  0.045   0.0188  763  ALA   A C   
949  O  O   . ALA   A 70  ? 0.4446 0.2452 0.2746 0.0612  0.0375  0.0183  763  ALA   A O   
950  C  CB  . ALA   A 70  ? 0.4652 0.2411 0.2805 0.0573  0.0513  0.0215  763  ALA   A CB  
956  N  N   . TYR   A 71  ? 0.4669 0.2481 0.2868 0.0525  0.0519  0.0182  764  TYR   A N   
957  C  CA  . TYR   A 71  ? 0.4923 0.2665 0.3035 0.0563  0.051   0.0169  764  TYR   A CA  
958  C  C   . TYR   A 71  ? 0.4781 0.2737 0.3057 0.0553  0.0446  0.0158  764  TYR   A C   
959  O  O   . TYR   A 71  ? 0.4814 0.2798 0.3057 0.0629  0.0391  0.0152  764  TYR   A O   
960  C  CB  . TYR   A 71  ? 0.5207 0.2787 0.3214 0.0503  0.0597  0.0165  764  TYR   A CB  
961  C  CG  . TYR   A 71  ? 0.5697 0.3198 0.3609 0.0539  0.0587  0.015   764  TYR   A CG  
962  C  CD1 . TYR   A 71  ? 0.6063 0.3407 0.3785 0.0652  0.0564  0.0148  764  TYR   A CD1 
963  C  CD2 . TYR   A 71  ? 0.5852 0.3462 0.3872 0.0477  0.0585  0.0137  764  TYR   A CD2 
964  C  CE1 . TYR   A 71  ? 0.6297 0.3571 0.3918 0.0702  0.0552  0.0134  764  TYR   A CE1 
965  C  CE2 . TYR   A 71  ? 0.6091 0.3634 0.4018 0.0523  0.057   0.0124  764  TYR   A CE2 
966  C  CZ  . TYR   A 71  ? 0.644  0.3807 0.416  0.0637  0.0557  0.0123  764  TYR   A CZ  
967  O  OH  . TYR   A 71  ? 0.6867 0.4174 0.4485 0.0701  0.0538  0.011   764  TYR   A OH  
977  N  N   . VAL   A 72  ? 0.4575 0.2686 0.3021 0.0465  0.0456  0.0155  765  VAL   A N   
978  C  CA  . VAL   A 72  ? 0.4456 0.2762 0.3053 0.0448  0.0404  0.0145  765  VAL   A CA  
979  C  C   . VAL   A 72  ? 0.4202 0.2647 0.2869 0.0503  0.0317  0.0151  765  VAL   A C   
980  O  O   . VAL   A 72  ? 0.4141 0.2669 0.2829 0.0545  0.027   0.0144  765  VAL   A O   
981  C  CB  . VAL   A 72  ? 0.4603 0.3041 0.3362 0.0344  0.043   0.0141  765  VAL   A CB  
982  C  CG1 . VAL   A 72  ? 0.4677 0.333  0.3603 0.033   0.0367  0.0135  765  VAL   A CG1 
983  C  CG2 . VAL   A 72  ? 0.4724 0.3058 0.3428 0.0282  0.0501  0.013   765  VAL   A CG2 
993  N  N   . MET   A 73  ? 0.4127 0.2591 0.2818 0.0502  0.0298  0.0162  766  MET   A N   
994  C  CA  . MET   A 73  ? 0.4113 0.2694 0.2858 0.0537  0.0215  0.0168  766  MET   A CA  
995  C  C   . MET   A 73  ? 0.4302 0.2818 0.2927 0.0633  0.0175  0.0166  766  MET   A C   
996  O  O   . MET   A 73  ? 0.4266 0.2926 0.2956 0.066   0.0109  0.0164  766  MET   A O   
997  C  CB  . MET   A 73  ? 0.4107 0.2676 0.2864 0.052   0.0205  0.0181  766  MET   A CB  
998  C  CG  . MET   A 73  ? 0.4198 0.2883 0.3094 0.044   0.0221  0.0182  766  MET   A CG  
999  S  SD  . MET   A 73  ? 0.4301 0.2959 0.3186 0.0436  0.021   0.0196  766  MET   A SD  
1000 C  CE  . MET   A 73  ? 0.3872 0.264  0.2803 0.0452  0.01    0.02    766  MET   A CE  
1010 N  N   . ALA   A 74  ? 0.4465 0.2773 0.2913 0.0686  0.0216  0.0167  767  ALA   A N   
1011 C  CA  . ALA   A 74  ? 0.4687 0.2917 0.2998 0.0791  0.018   0.0163  767  ALA   A CA  
1012 C  C   . ALA   A 74  ? 0.4755 0.3043 0.3066 0.0828  0.017   0.015   767  ALA   A C   
1013 O  O   . ALA   A 74  ? 0.4758 0.3141 0.3069 0.09    0.0106  0.0146  767  ALA   A O   
1014 C  CB  . ALA   A 74  ? 0.4908 0.2877 0.301  0.0837  0.0237  0.0167  767  ALA   A CB  
1020 N  N   . SER   A 75  ? 0.4762 0.2999 0.3072 0.0778  0.0231  0.0144  768  SER   A N   
1021 C  CA  . SER   A 75  ? 0.4866 0.313  0.3159 0.081   0.023   0.0132  768  SER   A CA  
1022 C  C   . SER   A 75  ? 0.4742 0.327  0.3209 0.0809  0.0164  0.013   768  SER   A C   
1023 O  O   . SER   A 75  ? 0.4821 0.3389 0.3253 0.0874  0.0147  0.0121  768  SER   A O   
1024 C  CB  . SER   A 75  ? 0.5225 0.3398 0.3507 0.0731  0.0303  0.0126  768  SER   A CB  
1025 O  OG  . SER   A 75  ? 0.5808 0.3724 0.3904 0.0731  0.0371  0.0127  768  SER   A OG  
1031 N  N   . VAL   A 76  ? 0.4548 0.325  0.3191 0.0735  0.0133  0.0138  769  VAL   A N   
1032 C  CA  . VAL   A 76  ? 0.4444 0.3394 0.3252 0.0719  0.0074  0.0138  769  VAL   A CA  
1033 C  C   . VAL   A 76  ? 0.4523 0.3597 0.3381 0.0742  -0.0002 0.0147  769  VAL   A C   
1034 O  O   . VAL   A 76  ? 0.4243 0.3526 0.3241 0.0711  -0.0052 0.0151  769  VAL   A O   
1035 C  CB  . VAL   A 76  ? 0.4391 0.3448 0.3356 0.0611  0.0094  0.0139  769  VAL   A CB  
1036 C  CG1 . VAL   A 76  ? 0.4574 0.3521 0.349  0.0585  0.0161  0.0127  769  VAL   A CG1 
1037 C  CG2 . VAL   A 76  ? 0.4362 0.3413 0.3385 0.0543  0.0097  0.0148  769  VAL   A CG2 
1047 N  N   . ASP   A 77  ? 0.4864 0.3808 0.3597 0.0797  -0.0014 0.015   770  ASP   A N   
1048 C  CA  . ASP   A 77  ? 0.518  0.4213 0.3938 0.0815  -0.009  0.0156  770  ASP   A CA  
1049 C  C   . ASP   A 77  ? 0.5393 0.4595 0.4177 0.0885  -0.0156 0.0151  770  ASP   A C   
1050 O  O   . ASP   A 77  ? 0.5425 0.4771 0.4285 0.0867  -0.0225 0.0156  770  ASP   A O   
1051 C  CB  . ASP   A 77  ? 0.5722 0.4527 0.4311 0.0861  -0.007  0.0159  770  ASP   A CB  
1052 C  CG  . ASP   A 77  ? 0.6614 0.5482 0.5231 0.0853  -0.0143 0.0166  770  ASP   A CG  
1053 O  OD1 . ASP   A 77  ? 0.679  0.5691 0.5488 0.0772  -0.0148 0.0175  770  ASP   A OD1 
1054 O  OD2 . ASP   A 77  ? 0.7029 0.5899 0.5569 0.0931  -0.0196 0.0161  770  ASP   A OD2 
1059 N  N   . ASN   A 78  A 0.5558 0.4749 0.4274 0.0965  -0.0137 0.0141  770  ASN   A N   
1060 C  CA  . ASN   A 78  A 0.5705 0.5076 0.4444 0.1047  -0.0195 0.0135  770  ASN   A CA  
1061 C  C   . ASN   A 78  A 0.5557 0.5107 0.4411 0.1032  -0.0186 0.0133  770  ASN   A C   
1062 O  O   . ASN   A 78  A 0.5753 0.5183 0.4534 0.1052  -0.0128 0.0127  770  ASN   A O   
1063 C  CB  . ASN   A 78  A 0.6263 0.5436 0.4783 0.1178  -0.0177 0.0124  770  ASN   A CB  
1064 C  CG  . ASN   A 78  A 0.7015 0.6396 0.5557 0.1281  -0.0241 0.0116  770  ASN   A CG  
1065 O  OD1 . ASN   A 78  A 0.7161 0.6754 0.5816 0.1265  -0.0314 0.012   770  ASN   A OD1 
1066 N  ND2 . ASN   A 78  A 0.7308 0.6636 0.5738 0.1384  -0.0215 0.0105  770  ASN   A ND2 
1073 N  N   . PRO   A 79  B 0.5201 0.5027 0.4214 0.1005  -0.0242 0.0139  770  PRO   A N   
1074 C  CA  . PRO   A 79  B 0.502  0.5014 0.4128 0.0966  -0.0319 0.0147  770  PRO   A CA  
1075 C  C   . PRO   A 79  B 0.4936 0.4892 0.4116 0.0841  -0.0324 0.0159  770  PRO   A C   
1076 O  O   . PRO   A 79  B 0.5049 0.5068 0.4257 0.081   -0.0385 0.0165  770  PRO   A O   
1077 C  CB  . PRO   A 79  B 0.4972 0.5267 0.4228 0.0962  -0.0355 0.0151  770  PRO   A CB  
1078 C  CG  . PRO   A 79  B 0.5074 0.5352 0.4364 0.0937  -0.0293 0.0151  770  PRO   A CG  
1079 C  CD  . PRO   A 79  B 0.5045 0.5036 0.4156 0.0999  -0.0229 0.0139  770  PRO   A CD  
1087 N  N   . GLY   A 80  C 0.4732 0.4587 0.3933 0.0774  -0.0264 0.0161  770  GLY   A N   
1088 C  CA  . GLY   A 80  C 0.4533 0.436  0.3801 0.0666  -0.0263 0.0171  770  GLY   A CA  
1089 C  C   . GLY   A 80  C 0.4097 0.4149 0.353  0.0583  -0.0297 0.018   770  GLY   A C   
1090 O  O   . GLY   A 80  C 0.4014 0.4251 0.3515 0.0608  -0.0317 0.018   770  GLY   A O   
1094 N  N   . ASN   A 81  ? 0.3754 0.379  0.3241 0.0489  -0.0303 0.019   771  ASN   A N   
1095 C  CA  . ASN   A 81  ? 0.3394 0.3611 0.3017 0.0402  -0.0331 0.0199  771  ASN   A CA  
1096 C  C   . ASN   A 81  ? 0.326  0.3434 0.2886 0.0319  -0.0371 0.021   771  ASN   A C   
1097 O  O   . ASN   A 81  ? 0.3311 0.3303 0.2857 0.0319  -0.0347 0.0209  771  ASN   A O   
1098 C  CB  . ASN   A 81  ? 0.3404 0.3623 0.3081 0.0377  -0.0271 0.0195  771  ASN   A CB  
1099 C  CG  . ASN   A 81  ? 0.3349 0.3738 0.3152 0.0298  -0.029  0.0205  771  ASN   A CG  
1100 O  OD1 . ASN   A 81  ? 0.332  0.3677 0.3149 0.0222  -0.0297 0.0211  771  ASN   A OD1 
1101 N  ND2 . ASN   A 81  ? 0.3262 0.3831 0.3133 0.0317  -0.03   0.0207  771  ASN   A ND2 
1108 N  N   . PRO   A 82  ? 0.3121 0.3449 0.2826 0.0246  -0.0429 0.0222  772  PRO   A N   
1109 C  CA  . PRO   A 82  ? 0.3064 0.3313 0.2739 0.0169  -0.0468 0.0232  772  PRO   A CA  
1110 C  C   . PRO   A 82  ? 0.2908 0.3031 0.2573 0.0129  -0.0422 0.0233  772  PRO   A C   
1111 O  O   . PRO   A 82  ? 0.2953 0.2952 0.255  0.0098  -0.0441 0.0238  772  PRO   A O   
1112 C  CB  . PRO   A 82  ? 0.3133 0.3578 0.2897 0.0087  -0.0527 0.0244  772  PRO   A CB  
1113 C  CG  . PRO   A 82  ? 0.3205 0.3851 0.3047 0.0133  -0.0527 0.0241  772  PRO   A CG  
1114 C  CD  . PRO   A 82  ? 0.2962 0.3535 0.2773 0.0229  -0.0461 0.0228  772  PRO   A CD  
1122 N  N   . HIS   A 83  ? 0.2602 0.2763 0.233  0.0133  -0.0365 0.0226  773  HIS   A N   
1123 C  CA  . HIS   A 83  ? 0.2469 0.2544 0.2203 0.0097  -0.0324 0.0224  773  HIS   A CA  
1124 C  C   . HIS   A 83  ? 0.2484 0.2421 0.2167 0.0151  -0.0255 0.0211  773  HIS   A C   
1125 O  O   . HIS   A 83  ? 0.2326 0.2239 0.2041 0.0131  -0.0211 0.0205  773  HIS   A O   
1126 C  CB  . HIS   A 83  ? 0.2407 0.2627 0.2248 0.0046  -0.0319 0.0227  773  HIS   A CB  
1127 C  CG  . HIS   A 83  ? 0.2503 0.2851 0.2383 -0.0018 -0.0382 0.0242  773  HIS   A CG  
1128 N  ND1 . HIS   A 83  ? 0.2732 0.3007 0.2556 -0.0075 -0.0429 0.0252  773  HIS   A ND1 
1129 C  CD2 . HIS   A 83  ? 0.2551 0.3087 0.2505 -0.0027 -0.0407 0.0248  773  HIS   A CD2 
1130 C  CE1 . HIS   A 83  ? 0.2706 0.3123 0.2576 -0.0134 -0.048  0.0265  773  HIS   A CE1 
1131 N  NE2 . HIS   A 83  ? 0.2613 0.3204 0.2571 -0.0107 -0.0467 0.0263  773  HIS   A NE2 
1139 N  N   . VAL   A 84  ? 0.2576 0.2418 0.2172 0.0217  -0.0247 0.0208  774  VAL   A N   
1140 C  CA  . VAL   A 84  ? 0.2677 0.2374 0.2207 0.0261  -0.018  0.0198  774  VAL   A CA  
1141 C  C   . VAL   A 84  ? 0.2881 0.2428 0.229  0.03    -0.0192 0.0203  774  VAL   A C   
1142 O  O   . VAL   A 84  ? 0.2904 0.2459 0.2265 0.0338  -0.0237 0.0205  774  VAL   A O   
1143 C  CB  . VAL   A 84  ? 0.2674 0.2383 0.2195 0.0315  -0.0141 0.0187  774  VAL   A CB  
1144 C  CG1 . VAL   A 84  ? 0.2844 0.2371 0.2263 0.0353  -0.0076 0.0179  774  VAL   A CG1 
1145 C  CG2 . VAL   A 84  ? 0.2527 0.236  0.2151 0.0283  -0.0123 0.0181  774  VAL   A CG2 
1155 N  N   A CYS   A 85  ? 0.2995 0.2416 0.2356 0.0292  -0.0154 0.0204  775  CYS   A N   
1156 N  N   B CYS   A 85  ? 0.2936 0.2353 0.2292 0.0295  -0.0154 0.0204  775  CYS   A N   
1157 C  CA  A CYS   A 85  ? 0.3297 0.2556 0.2534 0.033   -0.0151 0.0209  775  CYS   A CA  
1158 C  CA  B CYS   A 85  ? 0.3167 0.2429 0.2397 0.0337  -0.0158 0.0209  775  CYS   A CA  
1159 C  C   A CYS   A 85  ? 0.3518 0.2685 0.2662 0.0402  -0.0126 0.0204  775  CYS   A C   
1160 C  C   B CYS   A 85  ? 0.3437 0.2613 0.2576 0.041   -0.0135 0.0203  775  CYS   A C   
1161 O  O   A CYS   A 85  ? 0.3462 0.2612 0.2611 0.0416  -0.0068 0.0195  775  CYS   A O   
1162 O  O   B CYS   A 85  ? 0.3385 0.2557 0.2535 0.0426  -0.0082 0.0195  775  CYS   A O   
1163 C  CB  A CYS   A 85  ? 0.3518 0.2693 0.2741 0.0314  -0.0093 0.021   775  CYS   A CB  
1164 C  CB  B CYS   A 85  ? 0.3264 0.2421 0.2461 0.0327  -0.0106 0.0211  775  CYS   A CB  
1165 S  SG  A CYS   A 85  ? 0.4455 0.3436 0.3525 0.0362  -0.0082 0.0219  775  CYS   A SG  
1166 S  SG  B CYS   A 85  ? 0.3493 0.2679 0.2718 0.0272  -0.0151 0.022   775  CYS   A SG  
1177 N  N   A ARG   A 86  ? 0.3721 0.2818 0.2767 0.0448  -0.0172 0.0208  776  ARG   A N   
1178 N  N   B ARG   A 86  ? 0.3683 0.2781 0.2722 0.0456  -0.0178 0.0208  776  ARG   A N   
1179 C  CA  A ARG   A 86  ? 0.393  0.2928 0.2866 0.0528  -0.0158 0.0203  776  ARG   A CA  
1180 C  CA  B ARG   A 86  ? 0.3934 0.2932 0.2861 0.0537  -0.0165 0.0202  776  ARG   A CA  
1181 C  C   A ARG   A 86  ? 0.4106 0.2897 0.2902 0.0565  -0.0117 0.0208  776  ARG   A C   
1182 C  C   B ARG   A 86  ? 0.4123 0.2914 0.291  0.0573  -0.0126 0.0208  776  ARG   A C   
1183 O  O   A ARG   A 86  ? 0.4101 0.2838 0.2864 0.055   -0.014  0.0217  776  ARG   A O   
1184 O  O   B ARG   A 86  ? 0.415  0.2888 0.2897 0.0563  -0.0158 0.0216  776  ARG   A O   
1185 C  CB  A ARG   A 86  ? 0.4192 0.3268 0.3112 0.0562  -0.0242 0.0202  776  ARG   A CB  
1186 C  CB  B ARG   A 86  ? 0.4248 0.3327 0.316  0.057   -0.0251 0.0201  776  ARG   A CB  
1187 C  CG  A ARG   A 86  ? 0.472  0.4007 0.3763 0.0544  -0.0275 0.0197  776  ARG   A CG  
1188 C  CG  B ARG   A 86  ? 0.4855 0.4121 0.3861 0.0579  -0.0275 0.0194  776  ARG   A CG  
1189 C  CD  A ARG   A 86  ? 0.5271 0.468  0.4324 0.056   -0.0365 0.0198  776  ARG   A CD  
1190 C  CD  B ARG   A 86  ? 0.5452 0.4809 0.4442 0.0611  -0.0362 0.0193  776  ARG   A CD  
1191 N  NE  A ARG   A 86  ? 0.589  0.5221 0.4823 0.066   -0.0378 0.0189  776  ARG   A NE  
1192 N  NE  B ARG   A 86  ? 0.5853 0.54   0.4919 0.064   -0.0386 0.0187  776  ARG   A NE  
1193 C  CZ  A ARG   A 86  ? 0.6256 0.5621 0.5167 0.0735  -0.0359 0.0179  776  ARG   A CZ  
1194 C  CZ  B ARG   A 86  ? 0.6034 0.5794 0.5245 0.0579  -0.0415 0.0191  776  ARG   A CZ  
1195 N  NH1 A ARG   A 86  ? 0.6167 0.5638 0.5168 0.072   -0.0322 0.0176  776  ARG   A NH1 
1196 N  NH1 B ARG   A 86  ? 0.5999 0.5797 0.5289 0.0481  -0.0423 0.0201  776  ARG   A NH1 
1197 N  NH2 A ARG   A 86  ? 0.6387 0.5665 0.517  0.0833  -0.0376 0.0171  776  ARG   A NH2 
1198 N  NH2 B ARG   A 86  ? 0.5983 0.5916 0.525  0.0621  -0.0432 0.0186  776  ARG   A NH2 
1225 N  N   . LEU   A 87  ? 0.4239 0.2904 0.294  0.0617  -0.0056 0.0203  777  LEU   A N   
1226 C  CA  . LEU   A 87  ? 0.4615 0.3079 0.3173 0.0655  -0.0007 0.021   777  LEU   A CA  
1227 C  C   . LEU   A 87  ? 0.4896 0.3275 0.3326 0.0732  -0.0064 0.0209  777  LEU   A C   
1228 O  O   . LEU   A 87  ? 0.4944 0.3348 0.3345 0.0783  -0.0088 0.02    777  LEU   A O   
1229 C  CB  . LEU   A 87  ? 0.4674 0.3032 0.3175 0.0665  0.0086  0.0205  777  LEU   A CB  
1230 C  CG  . LEU   A 87  ? 0.497  0.3117 0.3319 0.0696  0.0158  0.0213  777  LEU   A CG  
1231 C  CD1 . LEU   A 87  ? 0.5011 0.3161 0.3407 0.0643  0.02    0.0223  777  LEU   A CD1 
1232 C  CD2 . LEU   A 87  ? 0.5055 0.3095 0.333  0.0703  0.0235  0.0207  777  LEU   A CD2 
1245 N  N   . LEU   A 88  ? 0.5046 0.3333 0.3398 0.0744  -0.0094 0.0219  778  LEU   A N   
1246 C  CA  . LEU   A 88  ? 0.5344 0.3528 0.3557 0.0819  -0.015  0.0217  778  LEU   A CA  
1247 C  C   . LEU   A 88  ? 0.5596 0.3563 0.3635 0.0894  -0.0081 0.0218  778  LEU   A C   
1248 O  O   . LEU   A 88  ? 0.5743 0.3632 0.3664 0.0972  -0.0116 0.0212  778  LEU   A O   
1249 C  CB  . LEU   A 88  ? 0.5425 0.3564 0.3596 0.0805  -0.0209 0.0227  778  LEU   A CB  
1250 C  CG  . LEU   A 88  ? 0.5545 0.3856 0.3836 0.0736  -0.0297 0.0227  778  LEU   A CG  
1251 C  CD1 . LEU   A 88  ? 0.5634 0.385  0.3854 0.0718  -0.0334 0.0237  778  LEU   A CD1 
1252 C  CD2 . LEU   A 88  ? 0.5631 0.4063 0.3945 0.0756  -0.0385 0.0216  778  LEU   A CD2 
1264 N  N   . GLY   A 89  ? 0.5603 0.3477 0.3622 0.0869  0.0014  0.0226  779  GLY   A N   
1265 C  CA  . GLY   A 89  ? 0.5786 0.3451 0.3641 0.092   0.0093  0.023   779  GLY   A CA  
1266 C  C   . GLY   A 89  ? 0.5832 0.3435 0.3691 0.0873  0.0186  0.0243  779  GLY   A C   
1267 O  O   . GLY   A 89  ? 0.5689 0.3423 0.3688 0.0804  0.0191  0.0246  779  GLY   A O   
1271 N  N   . ILE   A 90  ? 0.5885 0.3292 0.3588 0.091   0.0263  0.0251  780  ILE   A N   
1272 C  CA  . ILE   A 90  ? 0.5969 0.332  0.3664 0.0869  0.0359  0.0265  780  ILE   A CA  
1273 C  C   . ILE   A 90  ? 0.6161 0.3322 0.3676 0.0938  0.0371  0.028   780  ILE   A C   
1274 O  O   . ILE   A 90  ? 0.6213 0.3257 0.3592 0.1016  0.032   0.0276  780  ILE   A O   
1275 C  CB  . ILE   A 90  ? 0.6038 0.3344 0.3727 0.0822  0.0462  0.0264  780  ILE   A CB  
1276 C  CG1 . ILE   A 90  ? 0.6354 0.3438 0.3834 0.0888  0.0493  0.0262  780  ILE   A CG1 
1277 C  CG2 . ILE   A 90  ? 0.5977 0.3475 0.3847 0.0752  0.0445  0.0249  780  ILE   A CG2 
1278 C  CD1 . ILE   A 90  ? 0.6691 0.365  0.4095 0.0841  0.0611  0.0269  780  ILE   A CD1 
1290 N  N   . CYS   A 91  ? 0.6252 0.3391 0.3766 0.0915  0.0438  0.0295  781  CYS   A N   
1291 C  CA  . CYS   A 91  ? 0.6478 0.3434 0.3817 0.0981  0.0465  0.0311  781  CYS   A CA  
1292 C  C   . CYS   A 91  ? 0.6649 0.3534 0.3946 0.0951  0.0596  0.0327  781  CYS   A C   
1293 O  O   . CYS   A 91  ? 0.6398 0.343  0.3841 0.0875  0.0648  0.0328  781  CYS   A O   
1294 C  CB  . CYS   A 91  ? 0.6521 0.3524 0.3882 0.0999  0.0401  0.0318  781  CYS   A CB  
1295 S  SG  . CYS   A 91  ? 0.7311 0.4072 0.4434 0.1096  0.042   0.0337  781  CYS   A SG  
1301 N  N   . LEU   A 92  ? 0.7004 0.3667 0.4097 0.1009  0.065   0.0338  782  LEU   A N   
1302 C  CA  . LEU   A 92  ? 0.7321 0.39   0.435  0.0978  0.0781  0.0356  782  LEU   A CA  
1303 C  C   . LEU   A 92  ? 0.7659 0.416  0.4592 0.1031  0.0812  0.0378  782  LEU   A C   
1304 O  O   . LEU   A 92  ? 0.7886 0.4193 0.4628 0.112   0.079   0.0385  782  LEU   A O   
1305 C  CB  . LEU   A 92  ? 0.7479 0.3839 0.4321 0.1003  0.0832  0.0356  782  LEU   A CB  
1306 C  CG  . LEU   A 92  ? 0.7697 0.4075 0.4566 0.0988  0.0789  0.0334  782  LEU   A CG  
1307 C  CD1 . LEU   A 92  ? 0.7956 0.4072 0.4589 0.1036  0.0837  0.0336  782  LEU   A CD1 
1308 C  CD2 . LEU   A 92  ? 0.762  0.4185 0.4685 0.0874  0.0826  0.0326  782  LEU   A CD2 
1320 N  N   . THR   A 93  ? 0.7664 0.4321 0.4727 0.0985  0.0855  0.0387  783  THR   A N   
1321 C  CA  . THR   A 93  ? 0.7851 0.4468 0.4842 0.1037  0.0893  0.0409  783  THR   A CA  
1322 C  C   . THR   A 93  ? 0.7902 0.4591 0.4948 0.0968  0.1034  0.0424  783  THR   A C   
1323 O  O   . THR   A 93  ? 0.7994 0.4629 0.5017 0.0911  0.1099  0.0423  783  THR   A O   
1324 C  CB  . THR   A 93  ? 0.7949 0.4709 0.5048 0.1053  0.0797  0.0402  783  THR   A CB  
1325 O  OG1 . THR   A 93  ? 0.791  0.4912 0.5233 0.0966  0.0811  0.0392  783  THR   A OG1 
1326 C  CG2 . THR   A 93  ? 0.8048 0.4761 0.5113 0.1093  0.0662  0.0385  783  THR   A CG2 
1334 N  N   . SER   A 94  ? 0.7848 0.4663 0.4964 0.0968  0.1082  0.0438  784  SER   A N   
1335 C  CA  . SER   A 94  ? 0.7866 0.4803 0.5069 0.089   0.1208  0.045   784  SER   A CA  
1336 C  C   . SER   A 94  ? 0.7664 0.4783 0.5068 0.0772  0.1207  0.0428  784  SER   A C   
1337 O  O   . SER   A 94  ? 0.7752 0.4896 0.5183 0.0688  0.1303  0.0432  784  SER   A O   
1338 C  CB  . SER   A 94  ? 0.8126 0.5204 0.5388 0.0923  0.1243  0.0464  784  SER   A CB  
1339 O  OG  . SER   A 94  ? 0.8574 0.5836 0.5994 0.092   0.1155  0.0447  784  SER   A OG  
1345 N  N   . THR   A 95  ? 0.7363 0.4588 0.4887 0.0765  0.1096  0.0405  785  THR   A N   
1346 C  CA  . THR   A 95  ? 0.7095 0.447  0.4788 0.067   0.1075  0.0383  785  THR   A CA  
1347 C  C   . THR   A 95  ? 0.6799 0.4081 0.445  0.0697  0.0972  0.0365  785  THR   A C   
1348 O  O   . THR   A 95  ? 0.6908 0.405  0.4428 0.0783  0.0906  0.0368  785  THR   A O   
1349 C  CB  . THR   A 95  ? 0.7229 0.4864 0.513  0.0639  0.1041  0.0373  785  THR   A CB  
1350 O  OG1 . THR   A 95  ? 0.7385 0.5009 0.527  0.0713  0.093   0.0368  785  THR   A OG1 
1351 C  CG2 . THR   A 95  ? 0.727  0.5034 0.5228 0.0627  0.1135  0.0388  785  THR   A CG2 
1359 N  N   . VAL   A 96  ? 0.6381 0.3754 0.4145 0.0624  0.0954  0.0346  786  VAL   A N   
1360 C  CA  . VAL   A 96  ? 0.6085 0.3417 0.3835 0.0649  0.0859  0.0329  786  VAL   A CA  
1361 C  C   . VAL   A 96  ? 0.5703 0.3228 0.3616 0.0646  0.0765  0.0317  786  VAL   A C   
1362 O  O   . VAL   A 96  ? 0.5615 0.3326 0.3691 0.0583  0.0784  0.0312  786  VAL   A O   
1363 C  CB  . VAL   A 96  ? 0.6156 0.3471 0.3922 0.0583  0.0892  0.0315  786  VAL   A CB  
1364 C  CG1 . VAL   A 96  ? 0.6186 0.35   0.3958 0.0616  0.0792  0.0297  786  VAL   A CG1 
1365 C  CG2 . VAL   A 96  ? 0.6325 0.3418 0.39   0.0582  0.0988  0.0328  786  VAL   A CG2 
1375 N  N   . GLN   A 97  ? 0.5489 0.297  0.3353 0.071   0.0664  0.0313  787  GLN   A N   
1376 C  CA  . GLN   A 97  ? 0.537  0.3008 0.3363 0.0702  0.0572  0.0304  787  GLN   A CA  
1377 C  C   . GLN   A 97  ? 0.5191 0.2869 0.3225 0.0699  0.0485  0.0288  787  GLN   A C   
1378 O  O   . GLN   A 97  ? 0.5306 0.2854 0.322  0.0747  0.0465  0.0286  787  GLN   A O   
1379 C  CB  . GLN   A 97  ? 0.5608 0.317  0.3503 0.0774  0.0519  0.0316  787  GLN   A CB  
1380 C  CG  . GLN   A 97  ? 0.6122 0.3553 0.3881 0.0823  0.0597  0.0336  787  GLN   A CG  
1381 C  CD  . GLN   A 97  ? 0.6533 0.3879 0.4186 0.0897  0.0532  0.0346  787  GLN   A CD  
1382 O  OE1 . GLN   A 97  ? 0.6805 0.4027 0.4343 0.0947  0.0458  0.0343  787  GLN   A OE1 
1383 N  NE2 . GLN   A 97  ? 0.6573 0.3982 0.4253 0.0908  0.0553  0.0355  787  GLN   A NE2 
1392 N  N   . LEU   A 98  ? 0.4919 0.2782 0.3119 0.065   0.0432  0.0276  788  LEU   A N   
1393 C  CA  . LEU   A 98  ? 0.4733 0.2661 0.2983 0.0646  0.0349  0.0263  788  LEU   A CA  
1394 C  C   . LEU   A 98  ? 0.4538 0.2483 0.2775 0.0676  0.0249  0.0265  788  LEU   A C   
1395 O  O   . LEU   A 98  ? 0.447  0.2444 0.2727 0.0669  0.024   0.0272  788  LEU   A O   
1396 C  CB  . LEU   A 98  ? 0.4704 0.2817 0.3134 0.0571  0.0352  0.0249  788  LEU   A CB  
1397 C  CG  . LEU   A 98  ? 0.5012 0.3139 0.3483 0.0517  0.0448  0.0245  788  LEU   A CG  
1398 C  CD1 . LEU   A 98  ? 0.5012 0.3325 0.3658 0.0448  0.0433  0.0231  788  LEU   A CD1 
1399 C  CD2 . LEU   A 98  ? 0.5265 0.3234 0.3605 0.0541  0.0487  0.0243  788  LEU   A CD2 
1411 N  N   . ILE   A 99  ? 0.453  0.2461 0.2728 0.0707  0.0173  0.0259  789  ILE   A N   
1412 C  CA  . ILE   A 99  ? 0.4678 0.2623 0.2856 0.0722  0.0071  0.026   789  ILE   A CA  
1413 C  C   . ILE   A 99  ? 0.4579 0.2701 0.2891 0.0677  -0.0004 0.0249  789  ILE   A C   
1414 O  O   . ILE   A 99  ? 0.4615 0.2783 0.2955 0.0685  -0.0005 0.0239  789  ILE   A O   
1415 C  CB  . ILE   A 99  ? 0.4939 0.2712 0.2937 0.0803  0.0034  0.0263  789  ILE   A CB  
1416 C  CG1 . ILE   A 99  ? 0.5268 0.2846 0.3112 0.0856  0.0124  0.0275  789  ILE   A CG1 
1417 C  CG2 . ILE   A 99  ? 0.4983 0.2745 0.2938 0.0811  -0.0068 0.0266  789  ILE   A CG2 
1418 C  CD1 . ILE   A 99  ? 0.5502 0.3036 0.332  0.0853  0.017   0.029   789  ILE   A CD1 
1430 N  N   . THR   A 100 ? 0.4421 0.2628 0.2795 0.0637  -0.0067 0.0251  790  THR   A N   
1431 C  CA  . THR   A 100 ? 0.4353 0.2726 0.2845 0.0589  -0.014  0.0244  790  THR   A CA  
1432 C  C   . THR   A 100 ? 0.4597 0.2958 0.3049 0.0571  -0.0231 0.025   790  THR   A C   
1433 O  O   . THR   A 100 ? 0.4778 0.3004 0.312  0.0594  -0.0232 0.0259  790  THR   A O   
1434 C  CB  . THR   A 100 ? 0.4214 0.2739 0.2867 0.0522  -0.0101 0.024   790  THR   A CB  
1435 O  OG1 . THR   A 100 ? 0.4073 0.2758 0.2834 0.0485  -0.0157 0.0233  790  THR   A OG1 
1436 C  CG2 . THR   A 100 ? 0.4214 0.2747 0.289  0.0489  -0.0099 0.0246  790  THR   A CG2 
1444 N  N   . GLN   A 101 ? 0.4598 0.3094 0.3128 0.0527  -0.0309 0.0246  791  GLN   A N   
1445 C  CA  . GLN   A 101 ? 0.4779 0.3273 0.3275 0.0487  -0.04   0.0251  791  GLN   A CA  
1446 C  C   . GLN   A 101 ? 0.4678 0.3158 0.3194 0.0443  -0.0382 0.0258  791  GLN   A C   
1447 O  O   . GLN   A 101 ? 0.457  0.3158 0.3206 0.041   -0.0333 0.0255  791  GLN   A O   
1448 C  CB  . GLN   A 101 ? 0.5242 0.3924 0.3849 0.0434  -0.0471 0.0246  791  GLN   A CB  
1449 C  CG  . GLN   A 101 ? 0.6281 0.4986 0.487  0.0365  -0.0566 0.0252  791  GLN   A CG  
1450 C  CD  . GLN   A 101 ? 0.7414 0.6338 0.6136 0.0303  -0.0621 0.0249  791  GLN   A CD  
1451 O  OE1 . GLN   A 101 ? 0.7659 0.6718 0.6474 0.0327  -0.0597 0.0241  791  GLN   A OE1 
1452 N  NE2 . GLN   A 101 ? 0.7617 0.6577 0.6339 0.022   -0.0695 0.0255  791  GLN   A NE2 
1461 N  N   . LEU   A 102 ? 0.466  0.3001 0.3047 0.045   -0.0424 0.0267  792  LEU   A N   
1462 C  CA  . LEU   A 102 ? 0.4721 0.303  0.3096 0.0424  -0.0413 0.0273  792  LEU   A CA  
1463 C  C   . LEU   A 102 ? 0.4615 0.3071 0.3103 0.0335  -0.0461 0.0272  792  LEU   A C   
1464 O  O   . LEU   A 102 ? 0.4612 0.3128 0.3115 0.0288  -0.0537 0.0271  792  LEU   A O   
1465 C  CB  . LEU   A 102 ? 0.4884 0.2989 0.3065 0.0457  -0.0459 0.0282  792  LEU   A CB  
1466 C  CG  . LEU   A 102 ? 0.5136 0.3165 0.3253 0.0454  -0.0454 0.0289  792  LEU   A CG  
1467 C  CD1 . LEU   A 102 ? 0.5194 0.3235 0.3349 0.0505  -0.035  0.0289  792  LEU   A CD1 
1468 C  CD2 . LEU   A 102 ? 0.5396 0.3203 0.3294 0.0489  -0.0516 0.0297  792  LEU   A CD2 
1480 N  N   . MET   A 103 ? 0.4424 0.2949 0.2995 0.0311  -0.0416 0.027   793  MET   A N   
1481 C  CA  . MET   A 103 ? 0.4282 0.2926 0.2945 0.0232  -0.0452 0.027   793  MET   A CA  
1482 C  C   . MET   A 103 ? 0.4469 0.2969 0.2999 0.0231  -0.048  0.0278  793  MET   A C   
1483 O  O   . MET   A 103 ? 0.445  0.2908 0.2961 0.0275  -0.0423 0.0277  793  MET   A O   
1484 C  CB  . MET   A 103 ? 0.4167 0.2966 0.2992 0.0219  -0.0381 0.0262  793  MET   A CB  
1485 C  CG  . MET   A 103 ? 0.4287 0.3199 0.3212 0.0228  -0.0355 0.0254  793  MET   A CG  
1486 S  SD  . MET   A 103 ? 0.464  0.3697 0.3635 0.0167  -0.0437 0.0256  793  MET   A SD  
1487 C  CE  . MET   A 103 ? 0.4828 0.3812 0.3731 0.023   -0.0464 0.0254  793  MET   A CE  
1497 N  N   . PRO   A 104 ? 0.4647 0.3052 0.3061 0.0191  -0.0568 0.0286  794  PRO   A N   
1498 C  CA  . PRO   A 104 ? 0.4753 0.2965 0.2988 0.021   -0.0597 0.0293  794  PRO   A CA  
1499 C  C   . PRO   A 104 ? 0.4601 0.2823 0.2843 0.0188  -0.0584 0.0294  794  PRO   A C   
1500 O  O   . PRO   A 104 ? 0.4764 0.2827 0.2857 0.0235  -0.0585 0.0298  794  PRO   A O   
1501 C  CB  . PRO   A 104 ? 0.5007 0.3122 0.312  0.0155  -0.07   0.0299  794  PRO   A CB  
1502 C  CG  . PRO   A 104 ? 0.5014 0.3324 0.328  0.0086  -0.0728 0.0296  794  PRO   A CG  
1503 C  CD  . PRO   A 104 ? 0.4665 0.3123 0.3089 0.0135  -0.0646 0.0287  794  PRO   A CD  
1511 N  N   . PHE   A 105 ? 0.4227 0.2626 0.2629 0.0125  -0.0573 0.0289  795  PHE   A N   
1512 C  CA  . PHE   A 105 ? 0.4092 0.2503 0.25   0.0107  -0.0562 0.0288  795  PHE   A CA  
1513 C  C   . PHE   A 105 ? 0.3997 0.2508 0.2519 0.0167  -0.047  0.0277  795  PHE   A C   
1514 O  O   . PHE   A 105 ? 0.4119 0.2662 0.2662 0.0161  -0.0457 0.0273  795  PHE   A O   
1515 C  CB  . PHE   A 105 ? 0.399  0.2514 0.248  0.0002  -0.0608 0.0291  795  PHE   A CB  
1516 C  CG  . PHE   A 105 ? 0.4175 0.2594 0.2537 -0.0071 -0.0701 0.0303  795  PHE   A CG  
1517 C  CD1 . PHE   A 105 ? 0.4271 0.2755 0.2672 -0.0108 -0.0741 0.0305  795  PHE   A CD1 
1518 C  CD2 . PHE   A 105 ? 0.446  0.271  0.2652 -0.0103 -0.075  0.0311  795  PHE   A CD2 
1519 C  CE1 . PHE   A 105 ? 0.4415 0.2818 0.2706 -0.0185 -0.083  0.0314  795  PHE   A CE1 
1520 C  CE2 . PHE   A 105 ? 0.4662 0.2806 0.2727 -0.0186 -0.0838 0.0321  795  PHE   A CE2 
1521 C  CZ  . PHE   A 105 ? 0.4508 0.2739 0.2632 -0.0231 -0.0878 0.0322  795  PHE   A CZ  
1531 N  N   . GLY   A 106 ? 0.3849 0.2401 0.2432 0.0221  -0.0409 0.0272  796  GLY   A N   
1532 C  CA  . GLY   A 106 ? 0.3748 0.2385 0.2424 0.0269  -0.0323 0.0262  796  GLY   A CA  
1533 C  C   . GLY   A 106 ? 0.3504 0.2337 0.2371 0.0223  -0.0288 0.0251  796  GLY   A C   
1534 O  O   . GLY   A 106 ? 0.3474 0.2395 0.2423 0.017   -0.0313 0.0251  796  GLY   A O   
1538 N  N   . CYS   A 107 ? 0.3324 0.2232 0.2261 0.0249  -0.0229 0.024   797  CYS   A N   
1539 C  CA  . CYS   A 107 ? 0.3185 0.2267 0.2293 0.0208  -0.0196 0.0227  797  CYS   A CA  
1540 C  C   . CYS   A 107 ? 0.3079 0.2207 0.2208 0.0161  -0.0239 0.0225  797  CYS   A C   
1541 O  O   . CYS   A 107 ? 0.3162 0.2194 0.2178 0.0175  -0.0274 0.023   797  CYS   A O   
1542 C  CB  . CYS   A 107 ? 0.3209 0.2368 0.2398 0.0244  -0.0114 0.0214  797  CYS   A CB  
1543 S  SG  . CYS   A 107 ? 0.3617 0.2761 0.2751 0.0302  -0.0095 0.0209  797  CYS   A SG  
1548 N  N   . LEU   A 108 ? 0.2869 0.2134 0.213  0.011   -0.0234 0.0219  798  LEU   A N   
1549 C  CA  . LEU   A 108 ? 0.2801 0.2115 0.2086 0.006   -0.027  0.0218  798  LEU   A CA  
1550 C  C   . LEU   A 108 ? 0.273  0.2059 0.2014 0.009   -0.0249 0.0206  798  LEU   A C   
1551 O  O   . LEU   A 108 ? 0.2972 0.2247 0.2182 0.0073  -0.0291 0.021   798  LEU   A O   
1552 C  CB  . LEU   A 108 ? 0.2698 0.2159 0.2123 0.0008  -0.0264 0.0215  798  LEU   A CB  
1553 C  CG  . LEU   A 108 ? 0.2792 0.2315 0.2247 -0.0054 -0.0302 0.0219  798  LEU   A CG  
1554 C  CD1 . LEU   A 108 ? 0.2961 0.2374 0.2287 -0.0095 -0.0372 0.0237  798  LEU   A CD1 
1555 C  CD2 . LEU   A 108 ? 0.2785 0.2455 0.237  -0.009  -0.029  0.0217  798  LEU   A CD2 
1567 N  N   . LEU   A 109 ? 0.2668 0.2056 0.2014 0.0137  -0.0188 0.0192  799  LEU   A N   
1568 C  CA  . LEU   A 109 ? 0.2742 0.2166 0.2091 0.0175  -0.0171 0.0177  799  LEU   A CA  
1569 C  C   . LEU   A 109 ? 0.2889 0.2156 0.2057 0.0228  -0.0206 0.0187  799  LEU   A C   
1570 O  O   . LEU   A 109 ? 0.2898 0.2134 0.2005 0.0235  -0.0237 0.0183  799  LEU   A O   
1571 C  CB  . LEU   A 109 ? 0.2694 0.2222 0.2143 0.021   -0.0097 0.0161  799  LEU   A CB  
1572 C  CG  . LEU   A 109 ? 0.2844 0.2441 0.231  0.0258  -0.0076 0.0144  799  LEU   A CG  
1573 C  CD1 . LEU   A 109 ? 0.2852 0.2532 0.2382 0.0225  -0.0101 0.0131  799  LEU   A CD1 
1574 C  CD2 . LEU   A 109 ? 0.2936 0.2643 0.25   0.028   -0.0003 0.0131  799  LEU   A CD2 
1586 N  N   . ASP   A 110 ? 0.3022 0.2175 0.2088 0.027   -0.0203 0.0198  800  ASP   A N   
1587 C  CA  . ASP   A 110 ? 0.3316 0.2293 0.2184 0.0325  -0.024  0.0208  800  ASP   A CA  
1588 C  C   . ASP   A 110 ? 0.3462 0.2317 0.2216 0.0267  -0.0318 0.0221  800  ASP   A C   
1589 O  O   . ASP   A 110 ? 0.3621 0.2363 0.2233 0.0294  -0.0353 0.0222  800  ASP   A O   
1590 C  CB  . ASP   A 110 ? 0.3673 0.2537 0.2445 0.0373  -0.0227 0.022   800  ASP   A CB  
1591 C  CG  . ASP   A 110 ? 0.4214 0.3157 0.3046 0.044   -0.0148 0.0212  800  ASP   A CG  
1592 O  OD1 . ASP   A 110 ? 0.4249 0.3344 0.32   0.045   -0.0106 0.0196  800  ASP   A OD1 
1593 O  OD2 . ASP   A 110 ? 0.4503 0.3353 0.3252 0.0482  -0.0131 0.0223  800  ASP   A OD2 
1598 N  N   . TYR   A 111 ? 0.335  0.2227 0.2155 0.0189  -0.0346 0.023   801  TYR   A N   
1599 C  CA  . TYR   A 111 ? 0.3507 0.2288 0.2214 0.0116  -0.0419 0.0245  801  TYR   A CA  
1600 C  C   . TYR   A 111 ? 0.3581 0.2387 0.2288 0.0081  -0.0438 0.0241  801  TYR   A C   
1601 O  O   . TYR   A 111 ? 0.3762 0.2412 0.23   0.0063  -0.0491 0.025   801  TYR   A O   
1602 C  CB  . TYR   A 111 ? 0.3421 0.2285 0.2225 0.0043  -0.0436 0.0253  801  TYR   A CB  
1603 C  CG  . TYR   A 111 ? 0.3685 0.2449 0.2378 -0.0035 -0.0514 0.0269  801  TYR   A CG  
1604 C  CD1 . TYR   A 111 ? 0.3841 0.2667 0.2572 -0.0118 -0.0542 0.0274  801  TYR   A CD1 
1605 C  CD2 . TYR   A 111 ? 0.3986 0.2581 0.252  -0.0028 -0.056  0.028   801  TYR   A CD2 
1606 C  CE1 . TYR   A 111 ? 0.4082 0.2815 0.2703 -0.0202 -0.0612 0.0291  801  TYR   A CE1 
1607 C  CE2 . TYR   A 111 ? 0.4205 0.2704 0.2628 -0.0111 -0.0635 0.0294  801  TYR   A CE2 
1608 C  CZ  . TYR   A 111 ? 0.4361 0.2933 0.283  -0.0202 -0.066  0.03    801  TYR   A CZ  
1609 O  OH  . TYR   A 111 ? 0.4778 0.3258 0.3134 -0.0296 -0.0732 0.0315  801  TYR   A OH  
1619 N  N   . VAL   A 112 ? 0.3341 0.2327 0.222  0.007   -0.0397 0.0226  802  VAL   A N   
1620 C  CA  . VAL   A 112 ? 0.3289 0.2304 0.2172 0.0041  -0.0411 0.0221  802  VAL   A CA  
1621 C  C   . VAL   A 112 ? 0.3586 0.2497 0.2335 0.0121  -0.0413 0.0212  802  VAL   A C   
1622 O  O   . VAL   A 112 ? 0.3711 0.2536 0.2353 0.0102  -0.045  0.0215  802  VAL   A O   
1623 C  CB  . VAL   A 112 ? 0.312  0.2343 0.2208 0.0008  -0.0373 0.0208  802  VAL   A CB  
1624 C  CG1 . VAL   A 112 ? 0.3051 0.2365 0.2243 -0.0065 -0.0379 0.0219  802  VAL   A CG1 
1625 C  CG2 . VAL   A 112 ? 0.292  0.2261 0.2126 0.0073  -0.0309 0.0186  802  VAL   A CG2 
1635 N  N   . ARG   A 113 ? 0.3746 0.2669 0.2494 0.0212  -0.0373 0.0201  803  ARG   A N   
1636 C  CA  . ARG   A 113 ? 0.4022 0.2863 0.2641 0.0305  -0.0374 0.0192  803  ARG   A CA  
1637 C  C   . ARG   A 113 ? 0.4485 0.3065 0.284  0.0325  -0.0432 0.0209  803  ARG   A C   
1638 O  O   . ARG   A 113 ? 0.4649 0.3104 0.2844 0.0361  -0.0463 0.0207  803  ARG   A O   
1639 C  CB  . ARG   A 113 ? 0.4062 0.3003 0.2754 0.0395  -0.0312 0.0178  803  ARG   A CB  
1640 C  CG  . ARG   A 113 ? 0.3961 0.3141 0.2884 0.038   -0.0257 0.0157  803  ARG   A CG  
1641 C  CD  . ARG   A 113 ? 0.3917 0.32   0.2919 0.0443  -0.0193 0.0147  803  ARG   A CD  
1642 N  NE  . ARG   A 113 ? 0.3703 0.3204 0.2906 0.0426  -0.0146 0.0125  803  ARG   A NE  
1643 C  CZ  . ARG   A 113 ? 0.378  0.3413 0.3097 0.0447  -0.0083 0.0114  803  ARG   A CZ  
1644 N  NH1 . ARG   A 113 ? 0.3633 0.3207 0.289  0.0492  -0.0053 0.0126  803  ARG   A NH1 
1645 N  NH2 . ARG   A 113 ? 0.3718 0.3536 0.3204 0.042   -0.0049 0.0092  803  ARG   A NH2 
1659 N  N   . GLU   A 114 ? 0.4681 0.3169 0.298  0.0302  -0.0449 0.0225  804  GLU   A N   
1660 C  CA  . GLU   A 114 ? 0.5058 0.3287 0.31   0.0319  -0.0506 0.0241  804  GLU   A CA  
1661 C  C   . GLU   A 114 ? 0.5337 0.3432 0.326  0.0215  -0.0576 0.0256  804  GLU   A C   
1662 O  O   . GLU   A 114 ? 0.5655 0.3517 0.3333 0.0234  -0.0625 0.0264  804  GLU   A O   
1663 C  CB  . GLU   A 114 ? 0.5439 0.3617 0.3459 0.0339  -0.0498 0.025   804  GLU   A CB  
1664 C  CG  . GLU   A 114 ? 0.6295 0.4542 0.4358 0.0453  -0.0432 0.024   804  GLU   A CG  
1665 C  CD  . GLU   A 114 ? 0.7551 0.5804 0.565  0.0471  -0.0403 0.0247  804  GLU   A CD  
1666 O  OE1 . GLU   A 114 ? 0.7927 0.6098 0.5984 0.0407  -0.0445 0.026   804  GLU   A OE1 
1667 O  OE2 . GLU   A 114 ? 0.7714 0.6057 0.5879 0.0548  -0.0337 0.0239  804  GLU   A OE2 
1674 N  N   . HIS   A 115 ? 0.5127 0.3361 0.3208 0.0105  -0.0581 0.026   805  HIS   A N   
1675 C  CA  . HIS   A 115 ? 0.5197 0.3332 0.3182 -0.0008 -0.0643 0.0277  805  HIS   A CA  
1676 C  C   . HIS   A 115 ? 0.5298 0.3525 0.3355 -0.0062 -0.0638 0.0273  805  HIS   A C   
1677 O  O   . HIS   A 115 ? 0.5288 0.3519 0.3347 -0.0175 -0.0671 0.0288  805  HIS   A O   
1678 C  CB  . HIS   A 115 ? 0.5045 0.3251 0.3122 -0.0098 -0.0663 0.0289  805  HIS   A CB  
1679 C  CG  . HIS   A 115 ? 0.5311 0.3412 0.3304 -0.0049 -0.0674 0.0293  805  HIS   A CG  
1680 N  ND1 . HIS   A 115 ? 0.5414 0.3638 0.3544 0.0019  -0.0618 0.0283  805  HIS   A ND1 
1681 C  CD2 . HIS   A 115 ? 0.5604 0.3475 0.3375 -0.006  -0.0734 0.0305  805  HIS   A CD2 
1682 C  CE1 . HIS   A 115 ? 0.5603 0.3675 0.3596 0.0053  -0.0644 0.0291  805  HIS   A CE1 
1683 N  NE2 . HIS   A 115 ? 0.5776 0.3635 0.3553 0.0008  -0.0715 0.0303  805  HIS   A NE2 
1691 N  N   . LYS   A 116 ? 0.5381 0.3678 0.3485 0.0017  -0.0598 0.0255  806  LYS   A N   
1692 C  CA  . LYS   A 116 ? 0.5649 0.4029 0.3814 -0.0018 -0.0591 0.0248  806  LYS   A CA  
1693 C  C   . LYS   A 116 ? 0.6049 0.4248 0.4025 -0.0107 -0.0648 0.0267  806  LYS   A C   
1694 O  O   . LYS   A 116 ? 0.6132 0.4426 0.4197 -0.0197 -0.0649 0.0274  806  LYS   A O   
1695 C  CB  . LYS   A 116 ? 0.5952 0.4361 0.411  0.01    -0.0558 0.0224  806  LYS   A CB  
1696 C  CG  . LYS   A 116 ? 0.6695 0.517  0.4892 0.0081  -0.0554 0.0215  806  LYS   A CG  
1697 C  CD  . LYS   A 116 ? 0.7444 0.5955 0.5628 0.0203  -0.053  0.0188  806  LYS   A CD  
1698 C  CE  . LYS   A 116 ? 0.7987 0.6593 0.6242 0.0188  -0.0522 0.0175  806  LYS   A CE  
1699 N  NZ  . LYS   A 116 ? 0.8538 0.6965 0.6612 0.0119  -0.0567 0.0192  806  LYS   A NZ  
1713 N  N   . ASP   A 117 ? 0.6259 0.4191 0.3967 -0.0084 -0.0695 0.0276  807  ASP   A N   
1714 C  CA  . ASP   A 117 ? 0.6524 0.424  0.401  -0.0169 -0.0751 0.0294  807  ASP   A CA  
1715 C  C   . ASP   A 117 ? 0.6319 0.4048 0.3833 -0.0326 -0.0787 0.0318  807  ASP   A C   
1716 O  O   . ASP   A 117 ? 0.6482 0.4074 0.3849 -0.0421 -0.0826 0.0335  807  ASP   A O   
1717 C  CB  . ASP   A 117 ? 0.7205 0.4606 0.4368 -0.0089 -0.0791 0.0296  807  ASP   A CB  
1718 C  CG  . ASP   A 117 ? 0.8198 0.5591 0.5314 0.0067  -0.0759 0.0272  807  ASP   A CG  
1719 O  OD1 . ASP   A 117 ? 0.8224 0.5743 0.5441 0.008   -0.0732 0.026   807  ASP   A OD1 
1720 O  OD2 . ASP   A 117 ? 0.8819 0.6092 0.58   0.0181  -0.0761 0.0266  807  ASP   A OD2 
1725 N  N   . ASN   A 118 ? 0.5953 0.3848 0.3648 -0.0354 -0.0776 0.032   808  ASN   A N   
1726 C  CA  . ASN   A 118 ? 0.5721 0.3676 0.3471 -0.0496 -0.0811 0.0341  808  ASN   A CA  
1727 C  C   . ASN   A 118 ? 0.5135 0.3409 0.3191 -0.053  -0.0767 0.0337  808  ASN   A C   
1728 O  O   . ASN   A 118 ? 0.5082 0.345  0.3213 -0.0632 -0.0792 0.0352  808  ASN   A O   
1729 C  CB  . ASN   A 118 ? 0.6181 0.3974 0.3787 -0.0513 -0.0863 0.035   808  ASN   A CB  
1730 C  CG  . ASN   A 118 ? 0.7081 0.4558 0.4371 -0.057  -0.093  0.0365  808  ASN   A CG  
1731 O  OD1 . ASN   A 118 ? 0.7136 0.4581 0.4373 -0.0708 -0.0966 0.0383  808  ASN   A OD1 
1732 N  ND2 . ASN   A 118 ? 0.753  0.4764 0.4595 -0.0467 -0.0947 0.0359  808  ASN   A ND2 
1739 N  N   . ILE   A 119 ? 0.468  0.3121 0.2905 -0.0452 -0.0707 0.0319  809  ILE   A N   
1740 C  CA  . ILE   A 119 ? 0.4297 0.3014 0.2786 -0.0476 -0.0666 0.0315  809  ILE   A CA  
1741 C  C   . ILE   A 119 ? 0.4232 0.3044 0.278  -0.0556 -0.0659 0.0323  809  ILE   A C   
1742 O  O   . ILE   A 119 ? 0.4278 0.3076 0.2809 -0.0513 -0.0635 0.0312  809  ILE   A O   
1743 C  CB  . ILE   A 119 ? 0.4068 0.291  0.2704 -0.0361 -0.0605 0.029   809  ILE   A CB  
1744 C  CG1 . ILE   A 119 ? 0.4042 0.2821 0.2645 -0.0302 -0.0607 0.0288  809  ILE   A CG1 
1745 C  CG2 . ILE   A 119 ? 0.3883 0.2981 0.2762 -0.0383 -0.0562 0.0285  809  ILE   A CG2 
1746 C  CD1 . ILE   A 119 ? 0.4142 0.2966 0.2808 -0.0188 -0.0554 0.0267  809  ILE   A CD1 
1758 N  N   . GLY   A 120 ? 0.4061 0.2966 0.2665 -0.0669 -0.0681 0.0343  810  GLY   A N   
1759 C  CA  . GLY   A 120 ? 0.3915 0.2929 0.2583 -0.075  -0.067  0.0354  810  GLY   A CA  
1760 C  C   . GLY   A 120 ? 0.3586 0.287  0.2503 -0.0723 -0.0616 0.0344  810  GLY   A C   
1761 O  O   . GLY   A 120 ? 0.3452 0.2839 0.2492 -0.0655 -0.0591 0.033   810  GLY   A O   
1765 N  N   . SER   A 121 ? 0.3457 0.2843 0.2433 -0.0779 -0.0598 0.0353  811  SER   A N   
1766 C  CA  . SER   A 121 ? 0.3252 0.2877 0.2439 -0.0755 -0.0549 0.0346  811  SER   A CA  
1767 C  C   . SER   A 121 ? 0.306  0.2873 0.2397 -0.0777 -0.0548 0.0352  811  SER   A C   
1768 O  O   . SER   A 121 ? 0.2939 0.2897 0.2426 -0.071  -0.0508 0.0337  811  SER   A O   
1769 C  CB  . SER   A 121 ? 0.3322 0.3    0.2513 -0.0819 -0.0535 0.0359  811  SER   A CB  
1770 O  OG  . SER   A 121 ? 0.3517 0.3184 0.2641 -0.0946 -0.0571 0.0389  811  SER   A OG  
1776 N  N   . GLN   A 122 ? 0.3056 0.2866 0.2349 -0.0868 -0.0593 0.0373  812  GLN   A N   
1777 C  CA  . GLN   A 122 ? 0.3007 0.3009 0.244  -0.088  -0.0597 0.0378  812  GLN   A CA  
1778 C  C   . GLN   A 122 ? 0.2985 0.296  0.2449 -0.0777 -0.0588 0.0357  812  GLN   A C   
1779 O  O   . GLN   A 122 ? 0.3009 0.315  0.2617 -0.073  -0.0559 0.0349  812  GLN   A O   
1780 C  CB  . GLN   A 122 ? 0.3384 0.3382 0.2752 -0.1    -0.0656 0.0402  812  GLN   A CB  
1781 C  CG  . GLN   A 122 ? 0.3838 0.4072 0.3359 -0.1016 -0.0664 0.0407  812  GLN   A CG  
1782 C  CD  . GLN   A 122 ? 0.4629 0.5113 0.4307 -0.1043 -0.0626 0.0417  812  GLN   A CD  
1783 O  OE1 . GLN   A 122 ? 0.5079 0.5621 0.4742 -0.1153 -0.0638 0.044   812  GLN   A OE1 
1784 N  NE2 . GLN   A 122 ? 0.4508 0.514  0.4328 -0.0947 -0.0579 0.0402  812  GLN   A NE2 
1793 N  N   . TYR   A 123 ? 0.3018 0.2779 0.2338 -0.0737 -0.0608 0.0349  813  TYR   A N   
1794 C  CA  . TYR   A 123 ? 0.3159 0.2887 0.2499 -0.064  -0.0592 0.0331  813  TYR   A CA  
1795 C  C   . TYR   A 123 ? 0.2903 0.2721 0.2365 -0.0548 -0.0528 0.031   813  TYR   A C   
1796 O  O   . TYR   A 123 ? 0.2809 0.2719 0.2369 -0.0496 -0.0502 0.03    813  TYR   A O   
1797 C  CB  . TYR   A 123 ? 0.3525 0.3006 0.2677 -0.0608 -0.0621 0.0328  813  TYR   A CB  
1798 C  CG  . TYR   A 123 ? 0.4027 0.3405 0.3058 -0.0676 -0.0687 0.0344  813  TYR   A CG  
1799 C  CD1 . TYR   A 123 ? 0.4316 0.3697 0.3358 -0.0643 -0.0703 0.0341  813  TYR   A CD1 
1800 C  CD2 . TYR   A 123 ? 0.4441 0.3732 0.3351 -0.0785 -0.0734 0.0363  813  TYR   A CD2 
1801 C  CE1 . TYR   A 123 ? 0.4641 0.3931 0.3572 -0.0707 -0.0769 0.0353  813  TYR   A CE1 
1802 C  CE2 . TYR   A 123 ? 0.4752 0.3953 0.3552 -0.0861 -0.08   0.0377  813  TYR   A CE2 
1803 C  CZ  . TYR   A 123 ? 0.4948 0.4154 0.3762 -0.082  -0.0819 0.0371  813  TYR   A CZ  
1804 O  OH  . TYR   A 123 ? 0.5486 0.4608 0.4193 -0.0892 -0.0888 0.0382  813  TYR   A OH  
1814 N  N   . LEU   A 124 ? 0.2821 0.2595 0.226  -0.0528 -0.0504 0.0301  814  LEU   A N   
1815 C  CA  . LEU   A 124 ? 0.264  0.249  0.2184 -0.0451 -0.0448 0.0278  814  LEU   A CA  
1816 C  C   . LEU   A 124 ? 0.2407 0.246  0.2114 -0.0455 -0.0417 0.0277  814  LEU   A C   
1817 O  O   . LEU   A 124 ? 0.2225 0.2339 0.2017 -0.0394 -0.0382 0.0261  814  LEU   A O   
1818 C  CB  . LEU   A 124 ? 0.2717 0.2497 0.2202 -0.0436 -0.0438 0.0269  814  LEU   A CB  
1819 C  CG  . LEU   A 124 ? 0.2974 0.2562 0.2306 -0.0385 -0.0454 0.0261  814  LEU   A CG  
1820 C  CD1 . LEU   A 124 ? 0.3143 0.264  0.2371 -0.039  -0.0464 0.0259  814  LEU   A CD1 
1821 C  CD2 . LEU   A 124 ? 0.2977 0.2585 0.2368 -0.0291 -0.0414 0.0237  814  LEU   A CD2 
1833 N  N   . LEU   A 125 ? 0.2296 0.2448 0.2036 -0.0527 -0.043  0.0294  815  LEU   A N   
1834 C  CA  . LEU   A 125 ? 0.2185 0.2534 0.2069 -0.0522 -0.04   0.0295  815  LEU   A CA  
1835 C  C   . LEU   A 125 ? 0.2144 0.2578 0.2084 -0.0505 -0.0408 0.0298  815  LEU   A C   
1836 O  O   . LEU   A 125 ? 0.2023 0.2555 0.2056 -0.0448 -0.0373 0.0286  815  LEU   A O   
1837 C  CB  . LEU   A 125 ? 0.2123 0.2568 0.2025 -0.0601 -0.0407 0.0315  815  LEU   A CB  
1838 C  CG  . LEU   A 125 ? 0.2156 0.2519 0.1999 -0.0606 -0.0394 0.031   815  LEU   A CG  
1839 C  CD1 . LEU   A 125 ? 0.2189 0.2591 0.1999 -0.0703 -0.0409 0.0337  815  LEU   A CD1 
1840 C  CD2 . LEU   A 125 ? 0.2023 0.2459 0.1961 -0.0533 -0.0345 0.0287  815  LEU   A CD2 
1852 N  N   . ASN   A 126 ? 0.2321 0.2701 0.2192 -0.0549 -0.0457 0.0312  816  ASN   A N   
1853 C  CA  . ASN   A 126 ? 0.2321 0.2772 0.2234 -0.0523 -0.0469 0.0312  816  ASN   A CA  
1854 C  C   . ASN   A 126 ? 0.2163 0.253  0.2071 -0.0425 -0.0436 0.029   816  ASN   A C   
1855 O  O   . ASN   A 126 ? 0.2011 0.2466 0.1987 -0.0374 -0.0416 0.0283  816  ASN   A O   
1856 C  CB  . ASN   A 126 ? 0.2771 0.3164 0.2596 -0.0591 -0.0533 0.0328  816  ASN   A CB  
1857 C  CG  . ASN   A 126 ? 0.3541 0.4075 0.3401 -0.0695 -0.0566 0.0351  816  ASN   A CG  
1858 O  OD1 . ASN   A 126 ? 0.3846 0.4514 0.3786 -0.0719 -0.0538 0.0358  816  ASN   A OD1 
1859 N  ND2 . ASN   A 126 ? 0.3847 0.435  0.364  -0.0765 -0.0625 0.0364  816  ASN   A ND2 
1866 N  N   . TRP   A 127 ? 0.2127 0.2329 0.1952 -0.0396 -0.0426 0.0279  817  TRP   A N   
1867 C  CA  . TRP   A 127 ? 0.2115 0.2251 0.194  -0.0313 -0.0388 0.0261  817  TRP   A CA  
1868 C  C   . TRP   A 127 ? 0.194  0.218  0.1874 -0.0271 -0.0333 0.0245  817  TRP   A C   
1869 O  O   . TRP   A 127 ? 0.1865 0.212  0.1829 -0.0218 -0.0305 0.0235  817  TRP   A O   
1870 C  CB  . TRP   A 127 ? 0.2215 0.2185 0.194  -0.0288 -0.0385 0.0253  817  TRP   A CB  
1871 C  CG  . TRP   A 127 ? 0.2465 0.2293 0.2053 -0.0313 -0.0438 0.0266  817  TRP   A CG  
1872 C  CD1 . TRP   A 127 ? 0.2664 0.2477 0.2214 -0.033  -0.0477 0.0277  817  TRP   A CD1 
1873 C  CD2 . TRP   A 127 ? 0.2592 0.2259 0.2047 -0.0313 -0.0458 0.0268  817  TRP   A CD2 
1874 N  NE1 . TRP   A 127 ? 0.281  0.2454 0.2209 -0.0352 -0.0523 0.0286  817  TRP   A NE1 
1875 C  CE2 . TRP   A 127 ? 0.2807 0.2353 0.2139 -0.0338 -0.0511 0.0281  817  TRP   A CE2 
1876 C  CE3 . TRP   A 127 ? 0.2717 0.2327 0.2135 -0.029  -0.0439 0.0258  817  TRP   A CE3 
1877 C  CZ2 . TRP   A 127 ? 0.3006 0.236  0.2167 -0.0337 -0.0543 0.0286  817  TRP   A CZ2 
1878 C  CZ3 . TRP   A 127 ? 0.2979 0.2412 0.2234 -0.0285 -0.0472 0.0263  817  TRP   A CZ3 
1879 C  CH2 . TRP   A 127 ? 0.3033 0.2331 0.2155 -0.0306 -0.0521 0.0277  817  TRP   A CH2 
1890 N  N   . CYS   A 128 ? 0.1736 0.204  0.1714 -0.0297 -0.032  0.0243  818  CYS   A N   
1891 C  CA  . CYS   A 128 ? 0.1688 0.2087 0.1759 -0.0262 -0.0274 0.0228  818  CYS   A CA  
1892 C  C   . CYS   A 128 ? 0.1588 0.2113 0.1723 -0.0246 -0.0269 0.0234  818  CYS   A C   
1893 O  O   . CYS   A 128 ? 0.1624 0.2161 0.179  -0.0191 -0.0233 0.022   818  CYS   A O   
1894 C  CB  . CYS   A 128 ? 0.1862 0.2299 0.1953 -0.0294 -0.0269 0.0228  818  CYS   A CB  
1895 S  SG  . CYS   A 128 ? 0.2209 0.2507 0.2224 -0.0284 -0.0269 0.0214  818  CYS   A SG  
1901 N  N   . VAL   A 129 ? 0.1537 0.215  0.1681 -0.0292 -0.0306 0.0255  819  VAL   A N   
1902 C  CA  . VAL   A 129 ? 0.1546 0.2302 0.1751 -0.0269 -0.0306 0.0261  819  VAL   A CA  
1903 C  C   . VAL   A 129 ? 0.1519 0.2209 0.1689 -0.0206 -0.0304 0.0251  819  VAL   A C   
1904 O  O   . VAL   A 129 ? 0.1549 0.2276 0.1744 -0.0142 -0.0274 0.0241  819  VAL   A O   
1905 C  CB  . VAL   A 129 ? 0.1564 0.2444 0.1788 -0.0342 -0.0352 0.0285  819  VAL   A CB  
1906 C  CG1 . VAL   A 129 ? 0.167  0.2705 0.1949 -0.0306 -0.0361 0.029   819  VAL   A CG1 
1907 C  CG2 . VAL   A 129 ? 0.1557 0.2517 0.1817 -0.0398 -0.0343 0.0296  819  VAL   A CG2 
1917 N  N   . GLN   A 130 ? 0.1494 0.2065 0.1587 -0.0221 -0.0335 0.0255  820  GLN   A N   
1918 C  CA  . GLN   A 130 ? 0.1737 0.2235 0.1781 -0.0166 -0.0337 0.0249  820  GLN   A CA  
1919 C  C   . GLN   A 130 ? 0.176  0.2165 0.179  -0.0099 -0.0281 0.0229  820  GLN   A C   
1920 O  O   . GLN   A 130 ? 0.196  0.2359 0.1977 -0.004  -0.0265 0.0223  820  GLN   A O   
1921 C  CB  . GLN   A 130 ? 0.2108 0.2484 0.2058 -0.0199 -0.0384 0.0258  820  GLN   A CB  
1922 C  CG  . GLN   A 130 ? 0.2541 0.301  0.2495 -0.0273 -0.0447 0.0277  820  GLN   A CG  
1923 C  CD  . GLN   A 130 ? 0.3034 0.3356 0.2873 -0.0312 -0.0497 0.0285  820  GLN   A CD  
1924 O  OE1 . GLN   A 130 ? 0.3102 0.3272 0.2861 -0.0263 -0.0489 0.0277  820  GLN   A OE1 
1925 N  NE2 . GLN   A 130 ? 0.3352 0.3714 0.3173 -0.0401 -0.0549 0.0302  820  GLN   A NE2 
1934 N  N   . ILE   A 131 ? 0.163  0.1961 0.1656 -0.0108 -0.0251 0.0219  821  ILE   A N   
1935 C  CA  . ILE   A 131 ? 0.1678 0.1934 0.1698 -0.006  -0.0196 0.0201  821  ILE   A CA  
1936 C  C   . ILE   A 131 ? 0.1596 0.194  0.1672 -0.0031 -0.0165 0.0192  821  ILE   A C   
1937 O  O   . ILE   A 131 ? 0.1607 0.1895 0.1652 0.0018  -0.0132 0.0181  821  ILE   A O   
1938 C  CB  . ILE   A 131 ? 0.1706 0.1898 0.1721 -0.0079 -0.0176 0.0191  821  ILE   A CB  
1939 C  CG1 . ILE   A 131 ? 0.1823 0.1901 0.1753 -0.0087 -0.0205 0.0199  821  ILE   A CG1 
1940 C  CG2 . ILE   A 131 ? 0.1792 0.1943 0.1823 -0.0046 -0.0117 0.017   821  ILE   A CG2 
1941 C  CD1 . ILE   A 131 ? 0.2076 0.2115 0.1991 -0.0105 -0.0204 0.0194  821  ILE   A CD1 
1953 N  N   . ALA   A 132 ? 0.1601 0.2068 0.174  -0.0059 -0.0174 0.0197  822  ALA   A N   
1954 C  CA  . ALA   A 132 ? 0.1701 0.2246 0.1879 -0.0023 -0.0146 0.0189  822  ALA   A CA  
1955 C  C   . ALA   A 132 ? 0.1863 0.2454 0.202  0.0031  -0.0156 0.0194  822  ALA   A C   
1956 O  O   . ALA   A 132 ? 0.1929 0.249  0.2059 0.0089  -0.0124 0.0183  822  ALA   A O   
1957 C  CB  . ALA   A 132 ? 0.153  0.2198 0.1772 -0.0061 -0.0155 0.0196  822  ALA   A CB  
1963 N  N   . LYS   A 133 ? 0.1907 0.2551 0.206  0.0015  -0.0202 0.021   823  LYS   A N   
1964 C  CA  . LYS   A 133 ? 0.1936 0.263  0.2067 0.0072  -0.0219 0.0214  823  LYS   A CA  
1965 C  C   . LYS   A 133 ? 0.2014 0.2544 0.2053 0.0133  -0.0194 0.0201  823  LYS   A C   
1966 O  O   . LYS   A 133 ? 0.2104 0.2629 0.2107 0.0205  -0.0175 0.0193  823  LYS   A O   
1967 C  CB  . LYS   A 133 ? 0.1978 0.2767 0.2125 0.0029  -0.028  0.0232  823  LYS   A CB  
1968 C  CG  . LYS   A 133 ? 0.2163 0.3155 0.2399 -0.0019 -0.0301 0.0247  823  LYS   A CG  
1969 C  CD  . LYS   A 133 ? 0.2687 0.3772 0.2937 -0.0085 -0.0364 0.0266  823  LYS   A CD  
1970 C  CE  . LYS   A 133 ? 0.3289 0.4605 0.3633 -0.0124 -0.0376 0.0282  823  LYS   A CE  
1971 N  NZ  . LYS   A 133 ? 0.3753 0.5163 0.4113 -0.0214 -0.0436 0.0301  823  LYS   A NZ  
1985 N  N   . GLY   A 134 ? 0.2037 0.2429 0.2029 0.0109  -0.0191 0.0199  824  GLY   A N   
1986 C  CA  . GLY   A 134 ? 0.2118 0.2348 0.2019 0.0159  -0.0161 0.0189  824  GLY   A CA  
1987 C  C   . GLY   A 134 ? 0.2114 0.2278 0.1998 0.0188  -0.01   0.0173  824  GLY   A C   
1988 O  O   . GLY   A 134 ? 0.2108 0.2187 0.1915 0.0248  -0.0075 0.0165  824  GLY   A O   
1992 N  N   . MET   A 135 ? 0.1964 0.216  0.191  0.0144  -0.0079 0.0166  825  MET   A N   
1993 C  CA  . MET   A 135 ? 0.2018 0.2152 0.195  0.0156  -0.0027 0.0149  825  MET   A CA  
1994 C  C   . MET   A 135 ? 0.2236 0.242  0.215  0.0212  -0.002  0.0145  825  MET   A C   
1995 O  O   . MET   A 135 ? 0.2393 0.2467 0.223  0.0251  0.0018  0.0132  825  MET   A O   
1996 C  CB  . MET   A 135 ? 0.192  0.2091 0.1925 0.0098  -0.0015 0.0141  825  MET   A CB  
1997 C  CG  . MET   A 135 ? 0.206  0.216  0.2061 0.0061  -0.0008 0.0139  825  MET   A CG  
1998 S  SD  . MET   A 135 ? 0.2487 0.2422 0.2402 0.0084  0.0045  0.0129  825  MET   A SD  
1999 C  CE  . MET   A 135 ? 0.2598 0.2516 0.2528 0.0069  0.0094  0.0107  825  MET   A CE  
2009 N  N   . ASN   A 136 ? 0.218  0.2521 0.2153 0.0218  -0.0055 0.0156  826  ASN   A N   
2010 C  CA  . ASN   A 136 ? 0.235  0.2756 0.2302 0.0286  -0.0051 0.0154  826  ASN   A CA  
2011 C  C   . ASN   A 136 ? 0.2527 0.2853 0.2375 0.0366  -0.0051 0.0152  826  ASN   A C   
2012 O  O   . ASN   A 136 ? 0.2683 0.2939 0.2448 0.0435  -0.0023 0.0142  826  ASN   A O   
2013 C  CB  . ASN   A 136 ? 0.2346 0.2961 0.2389 0.0273  -0.0088 0.0171  826  ASN   A CB  
2014 C  CG  . ASN   A 136 ? 0.2906 0.3614 0.2934 0.0351  -0.0082 0.017   826  ASN   A CG  
2015 O  OD1 . ASN   A 136 ? 0.2916 0.3584 0.2918 0.0376  -0.0048 0.0158  826  ASN   A OD1 
2016 N  ND2 . ASN   A 136 ? 0.3071 0.3909 0.311  0.0395  -0.0116 0.0181  826  ASN   A ND2 
2023 N  N   . TYR   A 137 ? 0.2427 0.274  0.2261 0.0362  -0.0083 0.0162  827  TYR   A N   
2024 C  CA  . TYR   A 137 ? 0.2673 0.2892 0.2396 0.044   -0.0086 0.0159  827  TYR   A CA  
2025 C  C   . TYR   A 137 ? 0.286  0.2854 0.2468 0.0459  -0.0029 0.0145  827  TYR   A C   
2026 O  O   . TYR   A 137 ? 0.3079 0.2977 0.2574 0.0538  -0.0009 0.0136  827  TYR   A O   
2027 C  CB  . TYR   A 137 ? 0.2691 0.292  0.2416 0.042   -0.0133 0.017   827  TYR   A CB  
2028 C  CG  . TYR   A 137 ? 0.3022 0.312  0.2619 0.0499  -0.0133 0.0165  827  TYR   A CG  
2029 C  CD1 . TYR   A 137 ? 0.3286 0.3182 0.2792 0.0493  -0.0101 0.0162  827  TYR   A CD1 
2030 C  CD2 . TYR   A 137 ? 0.3275 0.3444 0.2829 0.0589  -0.0157 0.0164  827  TYR   A CD2 
2031 C  CE1 . TYR   A 137 ? 0.3573 0.3329 0.2944 0.0569  -0.0096 0.0158  827  TYR   A CE1 
2032 C  CE2 . TYR   A 137 ? 0.3531 0.3563 0.2948 0.0672  -0.0157 0.0157  827  TYR   A CE2 
2033 C  CZ  . TYR   A 137 ? 0.3813 0.3627 0.3133 0.066   -0.0125 0.0155  827  TYR   A CZ  
2034 O  OH  . TYR   A 137 ? 0.4313 0.3973 0.3482 0.0743  -0.012  0.0149  827  TYR   A OH  
2044 N  N   . LEU   A 138 ? 0.2749 0.266  0.238  0.0388  -0.0002 0.0142  828  LEU   A N   
2045 C  CA  . LEU   A 138 ? 0.2784 0.2502 0.2319 0.0386  0.0054  0.013   828  LEU   A CA  
2046 C  C   . LEU   A 138 ? 0.2848 0.2519 0.2341 0.0405  0.0091  0.0115  828  LEU   A C   
2047 O  O   . LEU   A 138 ? 0.3019 0.2522 0.2379 0.0444  0.0128  0.0106  828  LEU   A O   
2048 C  CB  . LEU   A 138 ? 0.273  0.2416 0.232  0.0307  0.0073  0.013   828  LEU   A CB  
2049 C  CG  . LEU   A 138 ? 0.2764 0.2429 0.2346 0.0299  0.0045  0.0143  828  LEU   A CG  
2050 C  CD1 . LEU   A 138 ? 0.2815 0.2467 0.245  0.0232  0.0063  0.0143  828  LEU   A CD1 
2051 C  CD2 . LEU   A 138 ? 0.2918 0.2421 0.2357 0.0361  0.0061  0.0144  828  LEU   A CD2 
2063 N  N   . GLU   A 139 ? 0.2597 0.24   0.2185 0.0379  0.0081  0.0113  829  GLU   A N   
2064 C  CA  . GLU   A 139 ? 0.2717 0.2476 0.2257 0.0399  0.011   0.0099  829  GLU   A CA  
2065 C  C   . GLU   A 139 ? 0.3047 0.2766 0.2467 0.0508  0.0105  0.0099  829  GLU   A C   
2066 O  O   . GLU   A 139 ? 0.3225 0.278  0.2511 0.0545  0.014   0.0086  829  GLU   A O   
2067 C  CB  . GLU   A 139 ? 0.2478 0.24   0.2142 0.036   0.0092  0.01    829  GLU   A CB  
2068 C  CG  . GLU   A 139 ? 0.2831 0.2708 0.2439 0.0388  0.0117  0.0085  829  GLU   A CG  
2069 C  CD  . GLU   A 139 ? 0.3163 0.3164 0.2876 0.0343  0.0108  0.0083  829  GLU   A CD  
2070 O  OE1 . GLU   A 139 ? 0.3195 0.3317 0.3027 0.0286  0.0085  0.0092  829  GLU   A OE1 
2071 O  OE2 . GLU   A 139 ? 0.3267 0.3227 0.2926 0.037   0.0124  0.0071  829  GLU   A OE2 
2078 N  N   . ASP   A 140 ? 0.3126 0.2992 0.2586 0.056   0.0061  0.0112  830  ASP   A N   
2079 C  CA  . ASP   A 140 ? 0.3459 0.3318 0.2812 0.0676  0.005   0.0111  830  ASP   A CA  
2080 C  C   . ASP   A 140 ? 0.383  0.3458 0.3006 0.073   0.0074  0.0104  830  ASP   A C   
2081 O  O   . ASP   A 140 ? 0.4088 0.3619 0.312  0.0826  0.0086  0.0096  830  ASP   A O   
2082 C  CB  . ASP   A 140 ? 0.3668 0.3753 0.3116 0.0706  -0.0007 0.0126  830  ASP   A CB  
2083 C  CG  . ASP   A 140 ? 0.4321 0.4638 0.3902 0.0688  -0.0027 0.0135  830  ASP   A CG  
2084 O  OD1 . ASP   A 140 ? 0.4474 0.4773 0.405  0.0685  0.0001  0.0128  830  ASP   A OD1 
2085 O  OD2 . ASP   A 140 ? 0.4646 0.516  0.433  0.0673  -0.0072 0.015   830  ASP   A OD2 
2090 N  N   . ARG   A 141 ? 0.3848 0.3376 0.302  0.0672  0.0086  0.0107  831  ARG   A N   
2091 C  CA  . ARG   A 141 ? 0.4087 0.3381 0.3091 0.0707  0.0117  0.0102  831  ARG   A CA  
2092 C  C   . ARG   A 141 ? 0.4089 0.3178 0.3003 0.0653  0.0182  0.009   831  ARG   A C   
2093 O  O   . ARG   A 141 ? 0.4266 0.3156 0.3052 0.0654  0.0218  0.0088  831  ARG   A O   
2094 C  CB  . ARG   A 141 ? 0.439  0.3683 0.3432 0.0671  0.0099  0.0113  831  ARG   A CB  
2095 C  CG  . ARG   A 141 ? 0.4964 0.4444 0.409  0.0701  0.0031  0.0125  831  ARG   A CG  
2096 C  CD  . ARG   A 141 ? 0.5632 0.516  0.4679 0.0821  -0.0002 0.0123  831  ARG   A CD  
2097 N  NE  . ARG   A 141 ? 0.6525 0.5817 0.5363 0.0905  0.0032  0.0113  831  ARG   A NE  
2098 C  CZ  . ARG   A 141 ? 0.7141 0.6291 0.5865 0.0943  0.003   0.0115  831  ARG   A CZ  
2099 N  NH1 . ARG   A 141 ? 0.7293 0.6212 0.581  0.102   0.0066  0.0106  831  ARG   A NH1 
2100 N  NH2 . ARG   A 141 ? 0.7148 0.6371 0.5947 0.0908  -0.0009 0.0125  831  ARG   A NH2 
2114 N  N   . ARG   A 142 ? 0.3936 0.3076 0.2918 0.0601  0.0196  0.0081  832  ARG   A N   
2115 C  CA  . ARG   A 142 ? 0.4024 0.3007 0.2946 0.0533  0.0248  0.0067  832  ARG   A CA  
2116 C  C   . ARG   A 142 ? 0.3886 0.2832 0.2869 0.0434  0.0277  0.0069  832  ARG   A C   
2117 O  O   . ARG   A 142 ? 0.4081 0.2864 0.2979 0.0384  0.0327  0.006   832  ARG   A O   
2118 C  CB  . ARG   A 142 ? 0.4445 0.3177 0.3132 0.0598  0.0284  0.0057  832  ARG   A CB  
2119 C  CG  . ARG   A 142 ? 0.4895 0.3653 0.3495 0.0721  0.0256  0.0055  832  ARG   A CG  
2120 C  CD  . ARG   A 142 ? 0.5568 0.405  0.3908 0.0788  0.0291  0.0043  832  ARG   A CD  
2121 N  NE  . ARG   A 142 ? 0.6092 0.4432 0.4373 0.0709  0.0331  0.0028  832  ARG   A NE  
2122 C  CZ  . ARG   A 142 ? 0.6454 0.4856 0.4768 0.0705  0.0322  0.0019  832  ARG   A CZ  
2123 N  NH1 . ARG   A 142 ? 0.628  0.4895 0.4693 0.0777  0.028   0.0025  832  ARG   A NH1 
2124 N  NH2 . ARG   A 142 ? 0.6643 0.4901 0.4894 0.0625  0.0355  0.0004  832  ARG   A NH2 
2138 N  N   . LEU   A 143 ? 0.3546 0.2642 0.2669 0.0404  0.0246  0.0081  833  LEU   A N   
2139 C  CA  . LEU   A 143 ? 0.3485 0.2559 0.266  0.0328  0.0271  0.0084  833  LEU   A CA  
2140 C  C   . LEU   A 143 ? 0.3289 0.2502 0.2621 0.0242  0.0269  0.0078  833  LEU   A C   
2141 O  O   . LEU   A 143 ? 0.3141 0.2521 0.2587 0.0243  0.0224  0.0082  833  LEU   A O   
2142 C  CB  . LEU   A 143 ? 0.3515 0.2645 0.2718 0.0359  0.0234  0.0101  833  LEU   A CB  
2143 C  CG  . LEU   A 143 ? 0.3959 0.3043 0.3176 0.0314  0.0255  0.0109  833  LEU   A CG  
2144 C  CD1 . LEU   A 143 ? 0.3926 0.3154 0.3301 0.0238  0.0245  0.0109  833  LEU   A CD1 
2145 C  CD2 . LEU   A 143 ? 0.4329 0.3221 0.3422 0.0297  0.0321  0.0104  833  LEU   A CD2 
2157 N  N   . VAL   A 144 ? 0.3167 0.2312 0.2502 0.0168  0.0315  0.0067  834  VAL   A N   
2158 C  CA  . VAL   A 144 ? 0.2975 0.225  0.2454 0.009   0.0314  0.0058  834  VAL   A CA  
2159 C  C   . VAL   A 144 ? 0.2814 0.2111 0.2339 0.0064  0.0324  0.0069  834  VAL   A C   
2160 O  O   . VAL   A 144 ? 0.2927 0.21   0.2372 0.005   0.037   0.0071  834  VAL   A O   
2161 C  CB  . VAL   A 144 ? 0.3094 0.2303 0.2551 0.0026  0.0355  0.0038  834  VAL   A CB  
2162 C  CG1 . VAL   A 144 ? 0.3101 0.2464 0.2713 -0.0044 0.0345  0.0027  834  VAL   A CG1 
2163 C  CG2 . VAL   A 144 ? 0.3158 0.2294 0.2522 0.0066  0.0348  0.0028  834  VAL   A CG2 
2173 N  N   . HIS   A 145 ? 0.2508 0.1948 0.2144 0.0063  0.0281  0.0078  835  HIS   A N   
2174 C  CA  . HIS   A 145 ? 0.2447 0.1897 0.2106 0.0055  0.0281  0.0089  835  HIS   A CA  
2175 C  C   . HIS   A 145 ? 0.2456 0.192  0.2163 -0.0008 0.0328  0.0079  835  HIS   A C   
2176 O  O   . HIS   A 145 ? 0.2583 0.1976 0.2242 -0.0009 0.0364  0.0086  835  HIS   A O   
2177 C  CB  . HIS   A 145 ? 0.2357 0.1936 0.2098 0.0067  0.022   0.01    835  HIS   A CB  
2178 C  CG  . HIS   A 145 ? 0.231  0.1876 0.2043 0.0075  0.021   0.0113  835  HIS   A CG  
2179 N  ND1 . HIS   A 145 ? 0.2466 0.2066 0.2249 0.004   0.0232  0.0109  835  HIS   A ND1 
2180 C  CD2 . HIS   A 145 ? 0.2435 0.1959 0.211  0.0116  0.0177  0.013   835  HIS   A CD2 
2181 C  CE1 . HIS   A 145 ? 0.2515 0.2077 0.2256 0.0068  0.0217  0.0124  835  HIS   A CE1 
2182 N  NE2 . HIS   A 145 ? 0.2523 0.2035 0.2199 0.0109  0.0181  0.0136  835  HIS   A NE2 
2190 N  N   . ARG   A 146 ? 0.2345 0.1909 0.2145 -0.0056 0.0326  0.0062  836  ARG   A N   
2191 C  CA  . ARG   A 146 ? 0.2331 0.1947 0.2196 -0.0118 0.0363  0.0047  836  ARG   A CA  
2192 C  C   . ARG   A 146 ? 0.2357 0.2065 0.229  -0.0116 0.0356  0.0054  836  ARG   A C   
2193 O  O   . ARG   A 146 ? 0.2454 0.2238 0.2455 -0.0159 0.0383  0.0041  836  ARG   A O   
2194 C  CB  . ARG   A 146 ? 0.2545 0.2033 0.2324 -0.0155 0.043   0.0042  836  ARG   A CB  
2195 C  CG  . ARG   A 146 ? 0.2887 0.2267 0.258  -0.0163 0.044   0.0031  836  ARG   A CG  
2196 C  CD  . ARG   A 146 ? 0.3277 0.2512 0.287  -0.0215 0.0506  0.0025  836  ARG   A CD  
2197 N  NE  . ARG   A 146 ? 0.3332 0.266  0.3016 -0.03   0.0542  0.0012  836  ARG   A NE  
2198 C  CZ  . ARG   A 146 ? 0.3543 0.2852 0.3216 -0.0343 0.0598  0.0017  836  ARG   A CZ  
2199 N  NH1 . ARG   A 146 ? 0.3634 0.2807 0.3193 -0.0306 0.063   0.0037  836  ARG   A NH1 
2200 N  NH2 . ARG   A 146 ? 0.3226 0.266  0.3003 -0.042  0.0624  0.0002  836  ARG   A NH2 
2214 N  N   . ASP   A 147 ? 0.2192 0.1896 0.2105 -0.0065 0.0317  0.0073  837  ASP   A N   
2215 C  CA  . ASP   A 147 ? 0.2125 0.1893 0.2076 -0.0054 0.0305  0.0079  837  ASP   A CA  
2216 C  C   . ASP   A 147 ? 0.2126 0.193  0.2084 -0.0021 0.0237  0.0091  837  ASP   A C   
2217 O  O   . ASP   A 147 ? 0.2142 0.1922 0.2064 0.0009  0.022   0.0105  837  ASP   A O   
2218 C  CB  . ASP   A 147 ? 0.2316 0.1996 0.2194 -0.0033 0.0347  0.0092  837  ASP   A CB  
2219 C  CG  . ASP   A 147 ? 0.257  0.2327 0.2491 -0.0029 0.0361  0.0092  837  ASP   A CG  
2220 O  OD1 . ASP   A 147 ? 0.2431 0.231  0.2439 -0.0041 0.0335  0.008   837  ASP   A OD1 
2221 O  OD2 . ASP   A 147 ? 0.2855 0.2547 0.2713 -0.0003 0.0393  0.0105  837  ASP   A OD2 
2226 N  N   . LEU   A 148 ? 0.1948 0.1808 0.1946 -0.003  0.02    0.0087  838  LEU   A N   
2227 C  CA  . LEU   A 148 ? 0.1928 0.1829 0.1934 -0.0015 0.0139  0.0099  838  LEU   A CA  
2228 C  C   . LEU   A 148 ? 0.18   0.1773 0.1855 -0.0024 0.0124  0.0093  838  LEU   A C   
2229 O  O   . LEU   A 148 ? 0.1589 0.1638 0.1712 -0.0049 0.0139  0.0074  838  LEU   A O   
2230 C  CB  . LEU   A 148 ? 0.1816 0.177  0.1853 -0.0022 0.0109  0.0098  838  LEU   A CB  
2231 C  CG  . LEU   A 148 ? 0.2056 0.2063 0.2102 -0.002  0.0048  0.0114  838  LEU   A CG  
2232 C  CD1 . LEU   A 148 ? 0.2158 0.2098 0.213  0.0006  0.0019  0.0134  838  LEU   A CD1 
2233 C  CD2 . LEU   A 148 ? 0.2158 0.2234 0.224  -0.0025 0.0032  0.0113  838  LEU   A CD2 
2245 N  N   . ALA   A 149 ? 0.1817 0.1754 0.1821 0       0.0092  0.0108  839  ALA   A N   
2246 C  CA  . ALA   A 149 ? 0.1814 0.1787 0.1825 0.0009  0.0073  0.0105  839  ALA   A CA  
2247 C  C   . ALA   A 149 ? 0.1893 0.1784 0.1812 0.0032  0.0024  0.0126  839  ALA   A C   
2248 O  O   . ALA   A 149 ? 0.2016 0.1829 0.1873 0.0045  0.0016  0.0141  839  ALA   A O   
2249 C  CB  . ALA   A 149 ? 0.1801 0.1791 0.1824 0.0023  0.0122  0.0094  839  ALA   A CB  
2255 N  N   . ALA   A 150 ? 0.1809 0.1706 0.1703 0.0038  -0.0013 0.0128  840  ALA   A N   
2256 C  CA  . ALA   A 150 ? 0.2036 0.1834 0.1822 0.0051  -0.0064 0.0147  840  ALA   A CA  
2257 C  C   . ALA   A 150 ? 0.2127 0.1818 0.1821 0.0096  -0.0048 0.0157  840  ALA   A C   
2258 O  O   . ALA   A 150 ? 0.2185 0.1778 0.1786 0.0101  -0.0087 0.0174  840  ALA   A O   
2259 C  CB  . ALA   A 150 ? 0.2152 0.1947 0.1901 0.0056  -0.0099 0.0145  840  ALA   A CB  
2265 N  N   . ARG   A 151 ? 0.2126 0.1839 0.1843 0.0125  0.0009  0.0147  841  ARG   A N   
2266 C  CA  . ARG   A 151 ? 0.2266 0.1885 0.1898 0.017   0.0037  0.0157  841  ARG   A CA  
2267 C  C   . ARG   A 151 ? 0.2403 0.1953 0.2006 0.0164  0.0046  0.0167  841  ARG   A C   
2268 O  O   . ARG   A 151 ? 0.2645 0.2084 0.2147 0.0202  0.0049  0.018   841  ARG   A O   
2269 C  CB  . ARG   A 151 ? 0.2331 0.2022 0.2015 0.0192  0.0105  0.0144  841  ARG   A CB  
2270 C  CG  . ARG   A 151 ? 0.2441 0.2224 0.2238 0.0146  0.016   0.0129  841  ARG   A CG  
2271 C  CD  . ARG   A 151 ? 0.263  0.2498 0.2483 0.0152  0.0228  0.0116  841  ARG   A CD  
2272 N  NE  . ARG   A 151 ? 0.2556 0.25   0.2507 0.0092  0.0266  0.01    841  ARG   A NE  
2273 C  CZ  . ARG   A 151 ? 0.2443 0.2503 0.2494 0.0054  0.0256  0.0079  841  ARG   A CZ  
2274 N  NH1 . ARG   A 151 ? 0.2249 0.2376 0.2322 0.0074  0.0215  0.0071  841  ARG   A NH1 
2275 N  NH2 . ARG   A 151 ? 0.2206 0.2303 0.232  -0.0001 0.0288  0.0065  841  ARG   A NH2 
2289 N  N   . ASN   A 152 ? 0.2194 0.1804 0.1874 0.0125  0.0054  0.0161  842  ASN   A N   
2290 C  CA  . ASN   A 152 ? 0.2241 0.1793 0.1889 0.0129  0.0062  0.0167  842  ASN   A CA  
2291 C  C   . ASN   A 152 ? 0.2395 0.1954 0.2035 0.0112  -0.0001 0.0176  842  ASN   A C   
2292 O  O   . ASN   A 152 ? 0.2543 0.2105 0.219  0.0113  0.0002  0.0177  842  ASN   A O   
2293 C  CB  . ASN   A 152 ? 0.2246 0.1839 0.1958 0.0109  0.0123  0.0153  842  ASN   A CB  
2294 C  CG  . ASN   A 152 ? 0.2552 0.2135 0.2262 0.0119  0.0189  0.0148  842  ASN   A CG  
2295 O  OD1 . ASN   A 152 ? 0.2789 0.2301 0.2423 0.0157  0.0198  0.0159  842  ASN   A OD1 
2296 N  ND2 . ASN   A 152 ? 0.2211 0.1863 0.1996 0.0083  0.0238  0.0132  842  ASN   A ND2 
2303 N  N   . VAL   A 153 ? 0.237  0.1927 0.1983 0.01    -0.0059 0.0185  843  VAL   A N   
2304 C  CA  . VAL   A 153 ? 0.2424 0.1991 0.202  0.0075  -0.0121 0.0196  843  VAL   A CA  
2305 C  C   . VAL   A 153 ? 0.2615 0.2056 0.2084 0.0094  -0.0164 0.021   843  VAL   A C   
2306 O  O   . VAL   A 153 ? 0.2776 0.2162 0.2192 0.011   -0.0164 0.021   843  VAL   A O   
2307 C  CB  . VAL   A 153 ? 0.2442 0.2116 0.2113 0.0027  -0.0151 0.0194  843  VAL   A CB  
2308 C  CG1 . VAL   A 153 ? 0.2445 0.2142 0.2098 -0.0007 -0.0214 0.0209  843  VAL   A CG1 
2309 C  CG2 . VAL   A 153 ? 0.2347 0.2129 0.2129 0.0015  -0.0108 0.0179  843  VAL   A CG2 
2319 N  N   . LEU   A 154 ? 0.2563 0.1956 0.1975 0.0099  -0.0202 0.022   844  LEU   A N   
2320 C  CA  . LEU   A 154 ? 0.2837 0.2096 0.2114 0.0114  -0.0249 0.0233  844  LEU   A CA  
2321 C  C   . LEU   A 154 ? 0.292  0.2198 0.2175 0.0059  -0.0328 0.0243  844  LEU   A C   
2322 O  O   . LEU   A 154 ? 0.2934 0.2342 0.2284 0.0018  -0.0343 0.0243  844  LEU   A O   
2323 C  CB  . LEU   A 154 ? 0.3036 0.2205 0.2243 0.0166  -0.0232 0.0235  844  LEU   A CB  
2324 C  CG  . LEU   A 154 ? 0.3449 0.2589 0.2664 0.0212  -0.0148 0.0227  844  LEU   A CG  
2325 C  CD1 . LEU   A 154 ? 0.3745 0.2782 0.2875 0.0261  -0.0134 0.0231  844  LEU   A CD1 
2326 C  CD2 . LEU   A 154 ? 0.3627 0.2715 0.28   0.0235  -0.012  0.0227  844  LEU   A CD2 
2338 N  N   . VAL   A 155 ? 0.297  0.2119 0.2096 0.0054  -0.0377 0.0253  845  VAL   A N   
2339 C  CA  . VAL   A 155 ? 0.3021 0.2165 0.2104 -0.0014 -0.0454 0.0264  845  VAL   A CA  
2340 C  C   . VAL   A 155 ? 0.3258 0.2315 0.2241 -0.001  -0.0509 0.0272  845  VAL   A C   
2341 O  O   . VAL   A 155 ? 0.3404 0.2292 0.2244 0.0028  -0.0523 0.0276  845  VAL   A O   
2342 C  CB  . VAL   A 155 ? 0.3081 0.2123 0.2068 -0.003  -0.0475 0.0268  845  VAL   A CB  
2343 C  CG1 . VAL   A 155 ? 0.3224 0.2248 0.2155 -0.0118 -0.0552 0.0281  845  VAL   A CG1 
2344 C  CG2 . VAL   A 155 ? 0.3001 0.2131 0.2084 -0.002  -0.042  0.0257  845  VAL   A CG2 
2354 N  N   . LYS   A 156 ? 0.3266 0.244  0.2319 -0.0042 -0.054  0.0273  846  LYS   A N   
2355 C  CA  . LYS   A 156 ? 0.3429 0.2543 0.2396 -0.004  -0.0601 0.0278  846  LYS   A CA  
2356 C  C   . LYS   A 156 ? 0.3508 0.2546 0.2374 -0.0121 -0.0682 0.0289  846  LYS   A C   
2357 O  O   . LYS   A 156 ? 0.3698 0.257  0.2411 -0.0111 -0.0729 0.0293  846  LYS   A O   
2358 C  CB  . LYS   A 156 ? 0.3589 0.2881 0.2671 -0.0044 -0.061  0.0273  846  LYS   A CB  
2359 C  CG  . LYS   A 156 ? 0.4203 0.3462 0.3209 -0.0038 -0.0678 0.0275  846  LYS   A CG  
2360 C  CD  . LYS   A 156 ? 0.4865 0.4336 0.3994 -0.0046 -0.0696 0.0271  846  LYS   A CD  
2361 C  CE  . LYS   A 156 ? 0.5645 0.5103 0.4702 -0.0046 -0.0774 0.0271  846  LYS   A CE  
2362 N  NZ  . LYS   A 156 ? 0.6014 0.5694 0.5186 -0.0039 -0.0794 0.0266  846  LYS   A NZ  
2376 N  N   . THR   A 157 ? 0.3448 0.2603 0.2391 -0.0203 -0.0699 0.0295  847  THR   A N   
2377 C  CA  . THR   A 157 ? 0.357  0.2654 0.2421 -0.0295 -0.0762 0.0307  847  THR   A CA  
2378 C  C   . THR   A 157 ? 0.3572 0.2719 0.2494 -0.0324 -0.0721 0.0308  847  THR   A C   
2379 O  O   . THR   A 157 ? 0.3442 0.2744 0.2514 -0.0296 -0.0663 0.0299  847  THR   A O   
2380 C  CB  . THR   A 157 ? 0.3673 0.2886 0.2566 -0.039  -0.0834 0.0315  847  THR   A CB  
2381 O  OG1 . THR   A 157 ? 0.3674 0.3123 0.2746 -0.0428 -0.0806 0.0316  847  THR   A OG1 
2382 C  CG2 . THR   A 157 ? 0.373  0.2951 0.2602 -0.0353 -0.0871 0.031   847  THR   A CG2 
2390 N  N   . PRO   A 158 ? 0.3662 0.2698 0.2476 -0.0383 -0.0753 0.0317  848  PRO   A N   
2391 C  CA  . PRO   A 158 ? 0.3599 0.2706 0.2482 -0.0407 -0.0717 0.0316  848  PRO   A CA  
2392 C  C   . PRO   A 158 ? 0.3519 0.2877 0.2592 -0.0459 -0.07   0.0318  848  PRO   A C   
2393 O  O   . PRO   A 158 ? 0.3463 0.2909 0.2629 -0.0448 -0.0652 0.0313  848  PRO   A O   
2394 C  CB  . PRO   A 158 ? 0.3807 0.2739 0.2513 -0.0477 -0.0773 0.0329  848  PRO   A CB  
2395 C  CG  . PRO   A 158 ? 0.4035 0.2749 0.2555 -0.0441 -0.0814 0.033   848  PRO   A CG  
2396 C  CD  . PRO   A 158 ? 0.3762 0.2582 0.2368 -0.0425 -0.0824 0.0327  848  PRO   A CD  
2404 N  N   . GLN   A 159 ? 0.3446 0.2926 0.2577 -0.0508 -0.0739 0.0325  849  GLN   A N   
2405 C  CA  . GLN   A 159 ? 0.3468 0.32   0.2774 -0.0547 -0.0725 0.0328  849  GLN   A CA  
2406 C  C   . GLN   A 159 ? 0.3432 0.3301 0.2867 -0.0457 -0.0677 0.0314  849  GLN   A C   
2407 O  O   . GLN   A 159 ? 0.3524 0.3598 0.3089 -0.0474 -0.0669 0.0316  849  GLN   A O   
2408 C  CB  . GLN   A 159 ? 0.3743 0.3565 0.3047 -0.0652 -0.0796 0.0343  849  GLN   A CB  
2409 C  CG  . GLN   A 159 ? 0.451  0.4204 0.368  -0.0764 -0.0847 0.0359  849  GLN   A CG  
2410 C  CD  . GLN   A 159 ? 0.5339 0.4756 0.4297 -0.0753 -0.0893 0.0358  849  GLN   A CD  
2411 O  OE1 . GLN   A 159 ? 0.5636 0.4993 0.4551 -0.0699 -0.0913 0.0351  849  GLN   A OE1 
2412 N  NE2 . GLN   A 159 ? 0.5439 0.4666 0.4244 -0.0797 -0.091  0.0366  849  GLN   A NE2 
2421 N  N   . HIS   A 160 ? 0.3325 0.308  0.2712 -0.0364 -0.0648 0.0302  850  HIS   A N   
2422 C  CA  . HIS   A 160 ? 0.3207 0.3053 0.268  -0.0285 -0.0608 0.029   850  HIS   A CA  
2423 C  C   . HIS   A 160 ? 0.3131 0.2848 0.2566 -0.0199 -0.0546 0.0277  850  HIS   A C   
2424 O  O   . HIS   A 160 ? 0.3227 0.2773 0.254  -0.0165 -0.0556 0.0277  850  HIS   A O   
2425 C  CB  . HIS   A 160 ? 0.3454 0.3309 0.2887 -0.0277 -0.0662 0.0291  850  HIS   A CB  
2426 C  CG  . HIS   A 160 ? 0.3919 0.3859 0.3414 -0.0194 -0.0633 0.028   850  HIS   A CG  
2427 N  ND1 . HIS   A 160 ? 0.432  0.4335 0.3813 -0.0186 -0.0684 0.028   850  HIS   A ND1 
2428 C  CD2 . HIS   A 160 ? 0.4014 0.3957 0.3554 -0.0116 -0.0562 0.0268  850  HIS   A CD2 
2429 C  CE1 . HIS   A 160 ? 0.434  0.4392 0.3868 -0.0095 -0.0641 0.0268  850  HIS   A CE1 
2430 N  NE2 . HIS   A 160 ? 0.424  0.4244 0.3793 -0.0056 -0.0567 0.0262  850  HIS   A NE2 
2438 N  N   . VAL   A 161 ? 0.2872 0.2675 0.2408 -0.0164 -0.0483 0.0266  851  VAL   A N   
2439 C  CA  . VAL   A 161 ? 0.2762 0.2479 0.2287 -0.0097 -0.0418 0.0254  851  VAL   A CA  
2440 C  C   . VAL   A 161 ? 0.2669 0.2444 0.2251 -0.0038 -0.0373 0.0243  851  VAL   A C   
2441 O  O   . VAL   A 161 ? 0.2638 0.2547 0.2291 -0.0043 -0.0385 0.0244  851  VAL   A O   
2442 C  CB  . VAL   A 161 ? 0.2689 0.2421 0.2256 -0.0114 -0.0382 0.0248  851  VAL   A CB  
2443 C  CG1 . VAL   A 161 ? 0.2809 0.2438 0.2278 -0.0157 -0.0425 0.0257  851  VAL   A CG1 
2444 C  CG2 . VAL   A 161 ? 0.2588 0.2492 0.2284 -0.0144 -0.0365 0.0245  851  VAL   A CG2 
2454 N  N   . LYS   A 162 ? 0.2609 0.2278 0.2149 0.002   -0.0322 0.0234  852  LYS   A N   
2455 C  CA  . LYS   A 162 ? 0.2595 0.2269 0.2152 0.0077  -0.0275 0.0224  852  LYS   A CA  
2456 C  C   . LYS   A 162 ? 0.2553 0.2184 0.2129 0.0098  -0.0201 0.0212  852  LYS   A C   
2457 O  O   . LYS   A 162 ? 0.2582 0.2124 0.2109 0.0103  -0.0185 0.0213  852  LYS   A O   
2458 C  CB  . LYS   A 162 ? 0.287  0.2427 0.2318 0.0127  -0.029  0.0228  852  LYS   A CB  
2459 C  CG  . LYS   A 162 ? 0.3307 0.2905 0.2728 0.0109  -0.0368 0.0237  852  LYS   A CG  
2460 C  CD  . LYS   A 162 ? 0.3897 0.3392 0.3217 0.0176  -0.0377 0.0235  852  LYS   A CD  
2461 C  CE  . LYS   A 162 ? 0.4646 0.4168 0.3926 0.0157  -0.0462 0.0242  852  LYS   A CE  
2462 N  NZ  . LYS   A 162 ? 0.5059 0.4757 0.4417 0.0163  -0.0491 0.0239  852  LYS   A NZ  
2476 N  N   . ILE   A 163 ? 0.2463 0.2144 0.2092 0.0116  -0.0156 0.0202  853  ILE   A N   
2477 C  CA  . ILE   A 163 ? 0.2465 0.2107 0.2109 0.0127  -0.0086 0.0189  853  ILE   A CA  
2478 C  C   . ILE   A 163 ? 0.2652 0.2151 0.2196 0.0174  -0.0051 0.019   853  ILE   A C   
2479 O  O   . ILE   A 163 ? 0.2735 0.2187 0.2218 0.0214  -0.0062 0.0193  853  ILE   A O   
2480 C  CB  . ILE   A 163 ? 0.2428 0.2151 0.214  0.0127  -0.0056 0.0178  853  ILE   A CB  
2481 C  CG1 . ILE   A 163 ? 0.2409 0.2272 0.2217 0.0081  -0.0085 0.0178  853  ILE   A CG1 
2482 C  CG2 . ILE   A 163 ? 0.2442 0.2107 0.2154 0.0129  0.0015  0.0164  853  ILE   A CG2 
2483 C  CD1 . ILE   A 163 ? 0.2416 0.2367 0.2269 0.0094  -0.008  0.0173  853  ILE   A CD1 
2495 N  N   . THR   A 164 ? 0.2631 0.2071 0.2159 0.0174  -0.0004 0.0187  854  THR   A N   
2496 C  CA  . THR   A 164 ? 0.2799 0.2106 0.2231 0.0215  0.0041  0.0189  854  THR   A CA  
2497 C  C   . THR   A 164 ? 0.2788 0.2095 0.2257 0.0198  0.0121  0.0178  854  THR   A C   
2498 O  O   . THR   A 164 ? 0.2671 0.2079 0.2236 0.0159  0.0134  0.0165  854  THR   A O   
2499 C  CB  . THR   A 164 ? 0.299  0.2211 0.234  0.0235  0.0016  0.0202  854  THR   A CB  
2500 O  OG1 . THR   A 164 ? 0.3288 0.2372 0.2528 0.0283  0.0051  0.0207  854  THR   A OG1 
2501 C  CG2 . THR   A 164 ? 0.3002 0.2256 0.239  0.0218  0.0041  0.0199  854  THR   A CG2 
2509 N  N   . ASP   A 165 ? 0.2826 0.2019 0.2212 0.0225  0.0174  0.0181  855  ASP   A N   
2510 C  CA  . ASP   A 165 ? 0.2889 0.2072 0.2292 0.0203  0.0253  0.0174  855  ASP   A CA  
2511 C  C   . ASP   A 165 ? 0.2968 0.2159 0.2397 0.0174  0.0289  0.0161  855  ASP   A C   
2512 O  O   . ASP   A 165 ? 0.2831 0.2129 0.236  0.0131  0.0291  0.0147  855  ASP   A O   
2513 C  CB  . ASP   A 165 ? 0.2998 0.2283 0.2486 0.0176  0.0263  0.0169  855  ASP   A CB  
2514 C  CG  . ASP   A 165 ? 0.3266 0.2535 0.2748 0.0166  0.0344  0.0167  855  ASP   A CG  
2515 O  OD1 . ASP   A 165 ? 0.3229 0.2451 0.2692 0.0143  0.0398  0.0162  855  ASP   A OD1 
2516 O  OD2 . ASP   A 165 ? 0.3346 0.2641 0.2829 0.0184  0.0353  0.0172  855  ASP   A OD2 
2521 N  N   . PHE   A 166 ? 0.3089 0.2149 0.241  0.0204  0.0318  0.0164  856  PHE   A N   
2522 C  CA  . PHE   A 166 ? 0.3249 0.2269 0.2549 0.0186  0.0353  0.0152  856  PHE   A CA  
2523 C  C   . PHE   A 166 ? 0.3347 0.2289 0.2608 0.0147  0.044   0.0149  856  PHE   A C   
2524 O  O   . PHE   A 166 ? 0.3458 0.2291 0.2636 0.0141  0.0478  0.0144  856  PHE   A O   
2525 C  CB  . PHE   A 166 ? 0.3411 0.2334 0.2603 0.0249  0.0323  0.0157  856  PHE   A CB  
2526 C  CG  . PHE   A 166 ? 0.3455 0.2497 0.2712 0.0269  0.0243  0.0157  856  PHE   A CG  
2527 C  CD1 . PHE   A 166 ? 0.3584 0.267  0.2856 0.0286  0.0185  0.0169  856  PHE   A CD1 
2528 C  CD2 . PHE   A 166 ? 0.3571 0.269  0.288  0.0261  0.0228  0.0147  856  PHE   A CD2 
2529 C  CE1 . PHE   A 166 ? 0.3567 0.2778 0.291  0.0284  0.0115  0.017   856  PHE   A CE1 
2530 C  CE2 . PHE   A 166 ? 0.3521 0.2775 0.2904 0.027   0.0161  0.0149  856  PHE   A CE2 
2531 C  CZ  . PHE   A 166 ? 0.3449 0.2751 0.2851 0.0276  0.0107  0.0161  856  PHE   A CZ  
2541 N  N   . GLY   A 167 ? 0.3269 0.2279 0.2593 0.0116  0.0469  0.0151  857  GLY   A N   
2542 C  CA  . GLY   A 167 ? 0.3334 0.2311 0.2643 0.0069  0.0553  0.0149  857  GLY   A CA  
2543 C  C   . GLY   A 167 ? 0.3273 0.2289 0.2635 -0.0006 0.0587  0.013   857  GLY   A C   
2544 O  O   . GLY   A 167 ? 0.3376 0.2307 0.2678 -0.005  0.0656  0.0129  857  GLY   A O   
2548 N  N   . LEU   A 168 ? 0.3007 0.2145 0.2475 -0.0026 0.054   0.0116  858  LEU   A N   
2549 C  CA  . LEU   A 168 ? 0.3019 0.2185 0.2528 -0.0094 0.0562  0.0096  858  LEU   A CA  
2550 C  C   . LEU   A 168 ? 0.3132 0.2216 0.2573 -0.0069 0.0531  0.009   858  LEU   A C   
2551 O  O   . LEU   A 168 ? 0.3234 0.2306 0.2678 -0.0117 0.0547  0.0073  858  LEU   A O   
2552 C  CB  . LEU   A 168 ? 0.2877 0.2244 0.255  -0.0133 0.0536  0.0081  858  LEU   A CB  
2553 C  CG  . LEU   A 168 ? 0.31   0.2575 0.2848 -0.0158 0.0572  0.0082  858  LEU   A CG  
2554 C  CD1 . LEU   A 168 ? 0.3008 0.2677 0.2906 -0.0185 0.054   0.0064  858  LEU   A CD1 
2555 C  CD2 . LEU   A 168 ? 0.328  0.2701 0.299  -0.0224 0.0656  0.0079  858  LEU   A CD2 
2567 N  N   . ALA   A 169 ? 0.3143 0.2176 0.2521 0.0008  0.0486  0.0102  859  ALA   A N   
2568 C  CA  . ALA   A 169 ? 0.3192 0.2182 0.2517 0.0048  0.0451  0.0097  859  ALA   A CA  
2569 C  C   . ALA   A 169 ? 0.3475 0.2278 0.2646 0.0049  0.0497  0.0091  859  ALA   A C   
2570 O  O   . ALA   A 169 ? 0.3522 0.2176 0.2576 0.0051  0.0546  0.0099  859  ALA   A O   
2571 C  CB  . ALA   A 169 ? 0.3159 0.2161 0.2459 0.0127  0.0393  0.0111  859  ALA   A CB  
2577 N  N   . LYS   A 170 ? 0.3537 0.2333 0.2693 0.005   0.0482  0.0078  860  LYS   A N   
2578 C  CA  . LYS   A 170 ? 0.3867 0.2468 0.2856 0.0054  0.0519  0.007   860  LYS   A CA  
2579 C  C   . LYS   A 170 ? 0.4155 0.2736 0.3079 0.0141  0.0473  0.0067  860  LYS   A C   
2580 O  O   . LYS   A 170 ? 0.4086 0.2827 0.3125 0.0153  0.0425  0.0064  860  LYS   A O   
2581 C  CB  . LYS   A 170 ? 0.399  0.2584 0.3006 -0.0045 0.0557  0.0051  860  LYS   A CB  
2582 C  CG  . LYS   A 170 ? 0.4217 0.287  0.3317 -0.0135 0.0604  0.0051  860  LYS   A CG  
2583 C  CD  . LYS   A 170 ? 0.469  0.315  0.3638 -0.0155 0.0674  0.0062  860  LYS   A CD  
2584 C  CE  . LYS   A 170 ? 0.5107 0.3673 0.4159 -0.0221 0.0716  0.0068  860  LYS   A CE  
2585 N  NZ  . LYS   A 170 ? 0.5696 0.4088 0.461  -0.0264 0.0794  0.0077  860  LYS   A NZ  
2599 N  N   . LEU   A 171 ? 0.4371 0.2755 0.3102 0.0205  0.049   0.007   861  LEU   A N   
2600 C  CA  . LEU   A 171 ? 0.465  0.3001 0.3291 0.0301  0.0452  0.0067  861  LEU   A CA  
2601 C  C   . LEU   A 171 ? 0.4975 0.3199 0.3514 0.0272  0.048   0.0049  861  LEU   A C   
2602 O  O   . LEU   A 171 ? 0.5155 0.3198 0.3578 0.0212  0.0537  0.0044  861  LEU   A O   
2603 C  CB  . LEU   A 171 ? 0.4836 0.3026 0.3299 0.04    0.0453  0.0077  861  LEU   A CB  
2604 C  CG  . LEU   A 171 ? 0.5055 0.3358 0.3595 0.0445  0.0411  0.0092  861  LEU   A CG  
2605 C  CD1 . LEU   A 171 ? 0.523  0.3328 0.3579 0.051   0.0433  0.0101  861  LEU   A CD1 
2606 C  CD2 . LEU   A 171 ? 0.5035 0.3529 0.3667 0.0516  0.0338  0.0094  861  LEU   A CD2 
2618 N  N   . LEU   A 172 ? 0.4985 0.3298 0.356  0.0311  0.0443  0.0041  862  LEU   A N   
2619 C  CA  . LEU   A 172 ? 0.5317 0.35   0.3778 0.0295  0.0462  0.0024  862  LEU   A CA  
2620 C  C   . LEU   A 172 ? 0.585  0.3828 0.4072 0.041   0.0464  0.0023  862  LEU   A C   
2621 O  O   . LEU   A 172 ? 0.5819 0.3879 0.4041 0.0519  0.0423  0.0032  862  LEU   A O   
2622 C  CB  . LEU   A 172 ? 0.5096 0.3468 0.3699 0.029   0.0422  0.0015  862  LEU   A CB  
2623 C  CG  . LEU   A 172 ? 0.4956 0.3541 0.3789 0.0195  0.041   0.0014  862  LEU   A CG  
2624 C  CD1 . LEU   A 172 ? 0.4879 0.3635 0.3826 0.0211  0.0368  0.0008  862  LEU   A CD1 
2625 C  CD2 . LEU   A 172 ? 0.4956 0.3464 0.3792 0.0074  0.0457  0.0001  862  LEU   A CD2 
2637 N  N   . GLY   A 173 ? 0.6281 0.3996 0.4297 0.0383  0.0509  0.0013  863  GLY   A N   
2638 C  CA  . GLY   A 173 ? 0.6741 0.4222 0.4491 0.0496  0.0513  0.001   863  GLY   A CA  
2639 C  C   . GLY   A 173 ? 0.6962 0.4517 0.4701 0.0586  0.0471  0.0001  863  GLY   A C   
2640 O  O   . GLY   A 173 ? 0.6846 0.4568 0.4743 0.0533  0.0452  -0.0005 863  GLY   A O   
2644 N  N   . ALA   A 174 ? 0.7283 0.4716 0.4827 0.073   0.0457  0.0002  864  ALA   A N   
2645 C  CA  . ALA   A 174 ? 0.7429 0.4927 0.4931 0.0845  0.042   -0.0004 864  ALA   A CA  
2646 C  C   . ALA   A 174 ? 0.7519 0.4983 0.5013 0.0787  0.0426  -0.002  864  ALA   A C   
2647 O  O   . ALA   A 174 ? 0.7469 0.5125 0.5072 0.0834  0.0391  -0.0021 864  ALA   A O   
2648 C  CB  . ALA   A 174 ? 0.7691 0.4961 0.4904 0.0998  0.0422  -0.0007 864  ALA   A CB  
2654 N  N   . GLU   A 175 ? 0.767  0.4895 0.5032 0.0682  0.047   -0.0032 865  GLU   A N   
2655 C  CA  . GLU   A 175 ? 0.781  0.4977 0.5144 0.0619  0.0473  -0.005  865  GLU   A CA  
2656 C  C   . GLU   A 175 ? 0.7687 0.4985 0.5236 0.0442  0.0486  -0.0055 865  GLU   A C   
2657 O  O   . GLU   A 175 ? 0.7832 0.4985 0.5302 0.0345  0.0507  -0.0072 865  GLU   A O   
2658 C  CB  . GLU   A 175 ? 0.8449 0.522  0.5432 0.0634  0.0506  -0.0063 865  GLU   A CB  
2659 C  CG  . GLU   A 175 ? 0.9352 0.5952 0.6081 0.0817  0.0498  -0.0059 865  GLU   A CG  
2660 C  CD  . GLU   A 175 ? 1.0378 0.715  0.7139 0.0969  0.0451  -0.0059 865  GLU   A CD  
2661 O  OE1 . GLU   A 175 ? 1.0665 0.7401 0.7378 0.0968  0.0442  -0.0071 865  GLU   A OE1 
2662 O  OE2 . GLU   A 175 ? 1.0634 0.7579 0.7465 0.1088  0.0423  -0.0046 865  GLU   A OE2 
2669 N  N   . GLU   A 176 ? 0.7344 0.4914 0.5158 0.0403  0.0471  -0.0042 866  GLU   A N   
2670 C  CA  . GLU   A 176 ? 0.7089 0.4806 0.5113 0.0254  0.0481  -0.0047 866  GLU   A CA  
2671 C  C   . GLU   A 176 ? 0.6674 0.4718 0.4965 0.0262  0.0435  -0.0041 866  GLU   A C   
2672 O  O   . GLU   A 176 ? 0.6601 0.4796 0.4981 0.0338  0.0409  -0.0024 866  GLU   A O   
2673 C  CB  . GLU   A 176 ? 0.7442 0.5126 0.5493 0.0186  0.0519  -0.0036 866  GLU   A CB  
2674 C  CG  . GLU   A 176 ? 0.8347 0.5717 0.616  0.0129  0.0575  -0.0042 866  GLU   A CG  
2675 C  CD  . GLU   A 176 ? 0.926  0.6595 0.7087 0.0074  0.0618  -0.0027 866  GLU   A CD  
2676 O  OE1 . GLU   A 176 ? 0.9136 0.6667 0.7129 0.0105  0.0599  -0.0012 866  GLU   A OE1 
2677 O  OE2 . GLU   A 176 ? 0.9882 0.6982 0.754  -0.0001 0.0672  -0.0031 866  GLU   A OE2 
2684 N  N   . LYS   A 177 ? 0.6408 0.4554 0.4821 0.0177  0.0426  -0.0055 867  LYS   A N   
2685 C  CA  . LYS   A 177 ? 0.6099 0.4533 0.4753 0.017   0.0387  -0.0051 867  LYS   A CA  
2686 C  C   . LYS   A 177 ? 0.5647 0.4224 0.4493 0.0054  0.0395  -0.0052 867  LYS   A C   
2687 O  O   . LYS   A 177 ? 0.5479 0.428  0.4514 0.0049  0.0364  -0.0046 867  LYS   A O   
2688 C  CB  . LYS   A 177 ? 0.6542 0.5006 0.5194 0.018   0.0363  -0.0066 867  LYS   A CB  
2689 C  CG  . LYS   A 177 ? 0.7425 0.5764 0.6024 0.0069  0.0381  -0.0092 867  LYS   A CG  
2690 C  CD  . LYS   A 177 ? 0.8269 0.6598 0.6821 0.0101  0.0355  -0.0108 867  LYS   A CD  
2691 C  CE  . LYS   A 177 ? 0.9084 0.7162 0.7364 0.0194  0.0362  -0.0112 867  LYS   A CE  
2692 N  NZ  . LYS   A 177 ? 0.9522 0.7606 0.7757 0.0246  0.0335  -0.0123 867  LYS   A NZ  
2706 N  N   . GLU   A 178 ? 0.5438 0.3889 0.4231 -0.0036 0.0439  -0.0058 868  GLU   A N   
2707 C  CA  . GLU   A 178 ? 0.5212 0.3804 0.4178 -0.0136 0.0451  -0.006  868  GLU   A CA  
2708 C  C   . GLU   A 178 ? 0.5046 0.3511 0.3938 -0.0189 0.0503  -0.0053 868  GLU   A C   
2709 O  O   . GLU   A 178 ? 0.5127 0.3356 0.3813 -0.0171 0.0535  -0.0052 868  GLU   A O   
2710 C  CB  . GLU   A 178 ? 0.5435 0.4087 0.4478 -0.023  0.0444  -0.0085 868  GLU   A CB  
2711 C  CG  . GLU   A 178 ? 0.6147 0.458  0.5022 -0.0303 0.0474  -0.0106 868  GLU   A CG  
2712 C  CD  . GLU   A 178 ? 0.6909 0.5411 0.5855 -0.0377 0.0452  -0.0133 868  GLU   A CD  
2713 O  OE1 . GLU   A 178 ? 0.7037 0.5695 0.6092 -0.0331 0.0408  -0.0135 868  GLU   A OE1 
2714 O  OE2 . GLU   A 178 ? 0.7321 0.5719 0.6207 -0.0486 0.0478  -0.0151 868  GLU   A OE2 
2721 N  N   . TYR   A 179 ? 0.4705 0.3325 0.3758 -0.0243 0.0512  -0.0047 869  TYR   A N   
2722 C  CA  . TYR   A 179 ? 0.4633 0.318  0.3652 -0.0299 0.0566  -0.0039 869  TYR   A CA  
2723 C  C   . TYR   A 179 ? 0.4537 0.3181 0.3669 -0.0428 0.0589  -0.0057 869  TYR   A C   
2724 O  O   . TYR   A 179 ? 0.4221 0.3077 0.3532 -0.0445 0.0555  -0.0065 869  TYR   A O   
2725 C  CB  . TYR   A 179 ? 0.4534 0.3198 0.3645 -0.0244 0.0556  -0.0016 869  TYR   A CB  
2726 C  CG  . TYR   A 179 ? 0.4614 0.3236 0.3714 -0.0303 0.0613  -0.0007 869  TYR   A CG  
2727 C  CD1 . TYR   A 179 ? 0.4571 0.3376 0.3841 -0.0367 0.0623  -0.0009 869  TYR   A CD1 
2728 C  CD2 . TYR   A 179 ? 0.4871 0.3261 0.3777 -0.0299 0.0662  0.0002  869  TYR   A CD2 
2729 C  CE1 . TYR   A 179 ? 0.473  0.351  0.399  -0.042  0.0681  0       869  TYR   A CE1 
2730 C  CE2 . TYR   A 179 ? 0.5004 0.335  0.3892 -0.0363 0.0722  0.0011  869  TYR   A CE2 
2731 C  CZ  . TYR   A 179 ? 0.501  0.3561 0.4081 -0.0424 0.0733  0.001   869  TYR   A CZ  
2732 O  OH  . TYR   A 179 ? 0.5303 0.3821 0.4353 -0.0477 0.0797  0.0022  869  TYR   A OH  
2742 N  N   A HIS   A 180 ? 0.4701 0.3193 0.3725 -0.0517 0.0645  -0.0063 870  HIS   A N   
2743 N  N   B HIS   A 180 ? 0.4675 0.3168 0.37   -0.0519 0.0644  -0.0064 870  HIS   A N   
2744 C  CA  A HIS   A 180 ? 0.4772 0.3359 0.3895 -0.0649 0.0672  -0.008  870  HIS   A CA  
2745 C  CA  B HIS   A 180 ? 0.4703 0.3309 0.3842 -0.065  0.0668  -0.0081 870  HIS   A CA  
2746 C  C   A HIS   A 180 ? 0.475  0.3396 0.3928 -0.0685 0.0723  -0.0063 870  HIS   A C   
2747 C  C   B HIS   A 180 ? 0.472  0.3368 0.3901 -0.069  0.0722  -0.0065 870  HIS   A C   
2748 O  O   A HIS   A 180 ? 0.4906 0.3362 0.3928 -0.0682 0.0771  -0.0048 870  HIS   A O   
2749 O  O   B HIS   A 180 ? 0.4876 0.3327 0.3895 -0.0698 0.0772  -0.0051 870  HIS   A O   
2750 C  CB  A HIS   A 180 ? 0.5076 0.3446 0.4026 -0.0739 0.0701  -0.0098 870  HIS   A CB  
2751 C  CB  B HIS   A 180 ? 0.4908 0.3336 0.3907 -0.0746 0.0688  -0.0103 870  HIS   A CB  
2752 C  CG  A HIS   A 180 ? 0.5513 0.3764 0.435  -0.0685 0.0657  -0.0112 870  HIS   A CG  
2753 C  CG  B HIS   A 180 ? 0.5083 0.3652 0.4211 -0.0886 0.0708  -0.0124 870  HIS   A CG  
2754 N  ND1 A HIS   A 180 ? 0.5668 0.4053 0.4615 -0.071  0.0611  -0.0135 870  HIS   A ND1 
2755 N  ND1 B HIS   A 180 ? 0.5206 0.3964 0.4488 -0.0916 0.066   -0.0148 870  HIS   A ND1 
2756 C  CD2 A HIS   A 180 ? 0.5849 0.3855 0.4461 -0.0606 0.0656  -0.0106 870  HIS   A CD2 
2757 C  CD2 B HIS   A 180 ? 0.5209 0.3769 0.4336 -0.0999 0.0769  -0.0123 870  HIS   A CD2 
2758 C  CE1 A HIS   A 180 ? 0.5869 0.4092 0.466  -0.0645 0.0586  -0.014  870  HIS   A CE1 
2759 C  CE1 B HIS   A 180 ? 0.5195 0.4059 0.4567 -0.1044 0.069   -0.0163 870  HIS   A CE1 
2760 N  NE2 A HIS   A 180 ? 0.5996 0.3993 0.4583 -0.0577 0.0611  -0.0124 870  HIS   A NE2 
2761 N  NE2 B HIS   A 180 ? 0.5218 0.3978 0.4507 -0.1101 0.0757  -0.0147 870  HIS   A NE2 
2776 N  N   . ALA   A 181 ? 0.4564 0.3462 0.3949 -0.0709 0.0714  -0.0065 871  ALA   A N   
2777 C  CA  . ALA   A 181 ? 0.4691 0.3664 0.4133 -0.073  0.0762  -0.0049 871  ALA   A CA  
2778 C  C   . ALA   A 181 ? 0.4954 0.3951 0.4415 -0.0872 0.0824  -0.006  871  ALA   A C   
2779 O  O   . ALA   A 181 ? 0.4967 0.3986 0.445  -0.0961 0.0815  -0.0086 871  ALA   A O   
2780 C  CB  . ALA   A 181 ? 0.4495 0.3715 0.4127 -0.0672 0.0722  -0.0044 871  ALA   A CB  
2787 N  N   . GLU   A 182 ? 0.5117 0.411  0.4565 -0.0892 0.0886  -0.0041 872  GLU   A N   
2788 C  CA  . GLU   A 182 ? 0.5324 0.4387 0.4815 -0.1022 0.0952  -0.0045 872  GLU   A CA  
2789 C  C   . GLU   A 182 ? 0.5138 0.453  0.4868 -0.1014 0.0942  -0.0049 872  GLU   A C   
2790 O  O   . GLU   A 182 ? 0.5079 0.4616 0.4926 -0.0953 0.0874  -0.0061 872  GLU   A O   
2791 C  CB  . GLU   A 182 ? 0.6028 0.4872 0.5339 -0.1042 0.1031  -0.002  872  GLU   A CB  
2792 C  CG  . GLU   A 182 ? 0.7276 0.5786 0.6333 -0.104  0.1039  -0.0019 872  GLU   A CG  
2793 C  CD  . GLU   A 182 ? 0.853  0.6958 0.7531 -0.1141 0.1024  -0.0047 872  GLU   A CD  
2794 O  OE1 . GLU   A 182 ? 0.878  0.7302 0.7849 -0.1283 0.1059  -0.0062 872  GLU   A OE1 
2795 O  OE2 . GLU   A 182 ? 0.9083 0.7359 0.797  -0.1077 0.0976  -0.0056 872  GLU   A OE2 
2802 N  N   . GLY   A 183 ? 0.5008 0.4513 0.4799 -0.1069 0.1006  -0.0038 873  GLY   A N   
2803 C  CA  . GLY   A 183 ? 0.4818 0.4633 0.4819 -0.1057 0.0998  -0.0044 873  GLY   A CA  
2804 C  C   . GLY   A 183 ? 0.4728 0.4628 0.4776 -0.0933 0.0991  -0.0021 873  GLY   A C   
2805 O  O   . GLY   A 183 ? 0.4713 0.4847 0.4902 -0.0932 0.1006  -0.0023 873  GLY   A O   
2809 N  N   . GLY   A 184 ? 0.4652 0.4377 0.4583 -0.0826 0.0964  -0.0001 874  GLY   A N   
2810 C  CA  . GLY   A 184 ? 0.4502 0.4284 0.4457 -0.0711 0.095   0.0021  874  GLY   A CA  
2811 C  C   . GLY   A 184 ? 0.4213 0.4209 0.4322 -0.0648 0.0881  0.0008  874  GLY   A C   
2812 O  O   . GLY   A 184 ? 0.4213 0.428  0.4392 -0.0673 0.0831  -0.0016 874  GLY   A O   
2816 N  N   . LYS   A 185 ? 0.3909 0.3993 0.4054 -0.0562 0.0877  0.0024  875  LYS   A N   
2817 C  CA  . LYS   A 185 ? 0.3602 0.3865 0.3864 -0.0496 0.0813  0.0014  875  LYS   A CA  
2818 C  C   . LYS   A 185 ? 0.3341 0.3501 0.3558 -0.0431 0.0733  0.0014  875  LYS   A C   
2819 O  O   . LYS   A 185 ? 0.3398 0.3375 0.3493 -0.0385 0.0726  0.0033  875  LYS   A O   
2820 C  CB  . LYS   A 185 ? 0.3876 0.4222 0.4152 -0.0415 0.0829  0.0032  875  LYS   A CB  
2821 C  CG  . LYS   A 185 ? 0.4593 0.5111 0.4948 -0.0464 0.0903  0.0031  875  LYS   A CG  
2822 C  CD  . LYS   A 185 ? 0.5369 0.5935 0.5704 -0.0365 0.0921  0.0052  875  LYS   A CD  
2823 C  CE  . LYS   A 185 ? 0.6041 0.677  0.6439 -0.0408 0.1007  0.0056  875  LYS   A CE  
2824 N  NZ  . LYS   A 185 ? 0.6487 0.7253 0.6849 -0.0299 0.1027  0.0079  875  LYS   A NZ  
2838 N  N   . VAL   A 186 ? 0.3089 0.3373 0.3404 -0.0428 0.0674  -0.0007 876  VAL   A N   
2839 C  CA  . VAL   A 186 ? 0.2957 0.3169 0.3242 -0.0381 0.0603  -0.0008 876  VAL   A CA  
2840 C  C   . VAL   A 186 ? 0.2796 0.3154 0.3169 -0.0324 0.0542  -0.0016 876  VAL   A C   
2841 O  O   . VAL   A 186 ? 0.2721 0.3253 0.3195 -0.0337 0.0548  -0.0032 876  VAL   A O   
2842 C  CB  . VAL   A 186 ? 0.3024 0.3173 0.3295 -0.0448 0.0594  -0.0027 876  VAL   A CB  
2843 C  CG1 . VAL   A 186 ? 0.3136 0.3072 0.3265 -0.0474 0.0637  -0.0015 876  VAL   A CG1 
2844 C  CG2 . VAL   A 186 ? 0.304  0.3345 0.3422 -0.0534 0.0607  -0.0057 876  VAL   A CG2 
2854 N  N   . PRO   A 187 ? 0.2611 0.2902 0.2941 -0.0261 0.0482  -0.0005 877  PRO   A N   
2855 C  CA  . PRO   A 187 ? 0.2369 0.2766 0.2753 -0.021  0.0426  -0.001  877  PRO   A CA  
2856 C  C   . PRO   A 187 ? 0.2102 0.2603 0.2571 -0.0242 0.0388  -0.0037 877  PRO   A C   
2857 O  O   . PRO   A 187 ? 0.2061 0.2518 0.2511 -0.0226 0.034   -0.0035 877  PRO   A O   
2858 C  CB  . PRO   A 187 ? 0.2599 0.2867 0.289  -0.0148 0.0383  0.0015  877  PRO   A CB  
2859 C  CG  . PRO   A 187 ? 0.2682 0.2823 0.2913 -0.0176 0.0392  0.002   877  PRO   A CG  
2860 C  CD  . PRO   A 187 ? 0.2612 0.2731 0.2836 -0.0235 0.0463  0.0013  877  PRO   A CD  
2868 N  N   . ILE   A 188 ? 0.1929 0.258  0.2494 -0.0285 0.0408  -0.0061 878  ILE   A N   
2869 C  CA  . ILE   A 188 ? 0.1965 0.2718 0.261  -0.0323 0.0376  -0.0091 878  ILE   A CA  
2870 C  C   . ILE   A 188 ? 0.1759 0.252  0.2401 -0.0266 0.0306  -0.0092 878  ILE   A C   
2871 O  O   . ILE   A 188 ? 0.1703 0.2438 0.2348 -0.0289 0.0277  -0.0103 878  ILE   A O   
2872 C  CB  . ILE   A 188 ? 0.2039 0.2992 0.2796 -0.0359 0.04    -0.0117 878  ILE   A CB  
2873 C  CG1 . ILE   A 188 ? 0.2273 0.3226 0.3038 -0.0444 0.0474  -0.0119 878  ILE   A CG1 
2874 C  CG2 . ILE   A 188 ? 0.2079 0.3147 0.2917 -0.0384 0.0355  -0.0151 878  ILE   A CG2 
2875 C  CD1 . ILE   A 188 ? 0.2676 0.3506 0.3396 -0.0535 0.0491  -0.0128 878  ILE   A CD1 
2887 N  N   . LYS   A 189 ? 0.164  0.2425 0.2263 -0.0194 0.0281  -0.008  879  LYS   A N   
2888 C  CA  . LYS   A 189 ? 0.1601 0.2389 0.221  -0.0149 0.0219  -0.0081 879  LYS   A CA  
2889 C  C   . LYS   A 189 ? 0.1681 0.2328 0.2214 -0.014  0.0187  -0.0059 879  LYS   A C   
2890 O  O   . LYS   A 189 ? 0.1728 0.2376 0.225  -0.0119 0.014   -0.0059 879  LYS   A O   
2891 C  CB  . LYS   A 189 ? 0.1561 0.2396 0.2149 -0.0074 0.0201  -0.0076 879  LYS   A CB  
2892 C  CG  . LYS   A 189 ? 0.1714 0.2736 0.2394 -0.007  0.0218  -0.0104 879  LYS   A CG  
2893 C  CD  . LYS   A 189 ? 0.1799 0.2865 0.2441 0.002   0.0198  -0.0101 879  LYS   A CD  
2894 C  CE  . LYS   A 189 ? 0.1936 0.3214 0.2678 0.0033  0.0208  -0.0133 879  LYS   A CE  
2895 N  NZ  . LYS   A 189 ? 0.1991 0.3311 0.268  0.0139  0.019   -0.013  879  LYS   A NZ  
2909 N  N   . TRP   A 190 ? 0.1657 0.2194 0.2137 -0.0155 0.0215  -0.0041 880  TRP   A N   
2910 C  CA  . TRP   A 190 ? 0.175  0.218  0.2169 -0.0148 0.019   -0.0022 880  TRP   A CA  
2911 C  C   . TRP   A 190 ? 0.1856 0.2252 0.228  -0.0194 0.0208  -0.0032 880  TRP   A C   
2912 O  O   . TRP   A 190 ? 0.1892 0.2221 0.2273 -0.0183 0.0189  -0.002  880  TRP   A O   
2913 C  CB  . TRP   A 190 ? 0.1711 0.203  0.2045 -0.0117 0.0201  0.0007  880  TRP   A CB  
2914 C  CG  . TRP   A 190 ? 0.1789 0.2095 0.208  -0.0067 0.0166  0.0022  880  TRP   A CG  
2915 C  CD1 . TRP   A 190 ? 0.1939 0.2191 0.2177 -0.0046 0.0117  0.004   880  TRP   A CD1 
2916 C  CD2 . TRP   A 190 ? 0.1844 0.2197 0.2135 -0.0032 0.0174  0.0019  880  TRP   A CD2 
2917 N  NE1 . TRP   A 190 ? 0.2044 0.2279 0.2233 -0.0006 0.0093  0.0049  880  TRP   A NE1 
2918 C  CE2 . TRP   A 190 ? 0.199  0.2286 0.2207 0.0012  0.0126  0.0035  880  TRP   A CE2 
2919 C  CE3 . TRP   A 190 ? 0.1865 0.2307 0.2207 -0.0034 0.0218  0.0004  880  TRP   A CE3 
2920 C  CZ2 . TRP   A 190 ? 0.2119 0.2422 0.2294 0.0065  0.012   0.0037  880  TRP   A CZ2 
2921 C  CZ3 . TRP   A 190 ? 0.1983 0.246  0.2301 0.0022  0.0215  0.0006  880  TRP   A CZ3 
2922 C  CH2 . TRP   A 190 ? 0.2067 0.2468 0.2296 0.0077  0.0164  0.0022  880  TRP   A CH2 
2933 N  N   . MET   A 191 ? 0.178  0.2223 0.2251 -0.0245 0.0242  -0.0056 881  MET   A N   
2934 C  CA  . MET   A 191 ? 0.1867 0.2243 0.2313 -0.029  0.0263  -0.0067 881  MET   A CA  
2935 C  C   . MET   A 191 ? 0.1959 0.2379 0.244  -0.031  0.0231  -0.0088 881  MET   A C   
2936 O  O   . MET   A 191 ? 0.1948 0.2485 0.2502 -0.0314 0.0207  -0.0107 881  MET   A O   
2937 C  CB  . MET   A 191 ? 0.1906 0.2285 0.2364 -0.0351 0.032   -0.008  881  MET   A CB  
2938 C  CG  . MET   A 191 ? 0.2189 0.2464 0.2572 -0.034  0.0364  -0.0056 881  MET   A CG  
2939 S  SD  . MET   A 191 ? 0.27   0.3033 0.3121 -0.0404 0.0433  -0.0066 881  MET   A SD  
2940 C  CE  . MET   A 191 ? 0.223  0.2527 0.2645 -0.0501 0.0451  -0.0094 881  MET   A CE  
2950 N  N   . ALA   A 192 ? 0.1952 0.2272 0.2369 -0.0316 0.0233  -0.0086 882  ALA   A N   
2951 C  CA  . ALA   A 192 ? 0.1929 0.2261 0.2354 -0.0333 0.021   -0.0106 882  ALA   A CA  
2952 C  C   . ALA   A 192 ? 0.1936 0.2314 0.2405 -0.0404 0.0229  -0.0139 882  ALA   A C   
2953 O  O   . ALA   A 192 ? 0.1964 0.2321 0.2427 -0.0449 0.0272  -0.0142 882  ALA   A O   
2954 C  CB  . ALA   A 192 ? 0.1965 0.2167 0.2293 -0.0316 0.0216  -0.0096 882  ALA   A CB  
2960 N  N   . LEU   A 193 ? 0.1973 0.2418 0.2484 -0.0419 0.0197  -0.0163 883  LEU   A N   
2961 C  CA  . LEU   A 193 ? 0.2055 0.2558 0.2613 -0.0492 0.0207  -0.0197 883  LEU   A CA  
2962 C  C   . LEU   A 193 ? 0.2183 0.2548 0.2656 -0.0558 0.0249  -0.0203 883  LEU   A C   
2963 O  O   . LEU   A 193 ? 0.2278 0.2681 0.2784 -0.0629 0.0281  -0.0217 883  LEU   A O   
2964 C  CB  . LEU   A 193 ? 0.2036 0.26   0.2627 -0.049  0.016   -0.0223 883  LEU   A CB  
2965 C  CG  . LEU   A 193 ? 0.2261 0.2901 0.2905 -0.0569 0.0157  -0.0263 883  LEU   A CG  
2966 C  CD1 . LEU   A 193 ? 0.2227 0.3036 0.2981 -0.059  0.0169  -0.0273 883  LEU   A CD1 
2967 C  CD2 . LEU   A 193 ? 0.2293 0.2967 0.2947 -0.0555 0.0108  -0.0286 883  LEU   A CD2 
2979 N  N   . GLU   A 194 ? 0.2244 0.2451 0.2603 -0.0534 0.025   -0.0192 884  GLU   A N   
2980 C  CA  . GLU   A 194 ? 0.2456 0.2496 0.2699 -0.0588 0.0289  -0.0197 884  GLU   A CA  
2981 C  C   . GLU   A 194 ? 0.2607 0.2598 0.2823 -0.0612 0.0342  -0.0179 884  GLU   A C   
2982 O  O   . GLU   A 194 ? 0.2786 0.2689 0.2943 -0.0689 0.0381  -0.019  884  GLU   A O   
2983 C  CB  . GLU   A 194 ? 0.2755 0.2629 0.2861 -0.0536 0.0279  -0.0188 884  GLU   A CB  
2984 C  CG  . GLU   A 194 ? 0.2846 0.2673 0.2904 -0.0447 0.028   -0.0153 884  GLU   A CG  
2985 C  CD  . GLU   A 194 ? 0.2888 0.2839 0.3025 -0.0377 0.0238  -0.0138 884  GLU   A CD  
2986 O  OE1 . GLU   A 194 ? 0.2516 0.2432 0.2609 -0.031  0.0234  -0.0112 884  GLU   A OE1 
2987 O  OE2 . GLU   A 194 ? 0.2771 0.2852 0.3005 -0.0389 0.0208  -0.0153 884  GLU   A OE2 
2994 N  N   . SER   A 195 ? 0.2407 0.2449 0.266  -0.0551 0.0345  -0.0153 885  SER   A N   
2995 C  CA  . SER   A 195 ? 0.2383 0.2381 0.2608 -0.0565 0.0394  -0.0136 885  SER   A CA  
2996 C  C   . SER   A 195 ? 0.2376 0.2523 0.271  -0.0634 0.0419  -0.0152 885  SER   A C   
2997 O  O   . SER   A 195 ? 0.2488 0.2583 0.2785 -0.0694 0.0473  -0.015  885  SER   A O   
2998 C  CB  . SER   A 195 ? 0.2304 0.2311 0.2528 -0.0477 0.0382  -0.0105 885  SER   A CB  
2999 O  OG  . SER   A 195 ? 0.2437 0.2348 0.2581 -0.0415 0.0355  -0.0092 885  SER   A OG  
3005 N  N   . ILE   A 196 ? 0.222  0.2552 0.268  -0.0625 0.0383  -0.0168 886  ILE   A N   
3006 C  CA  . ILE   A 196 ? 0.2379 0.2885 0.2952 -0.0679 0.0402  -0.0186 886  ILE   A CA  
3007 C  C   . ILE   A 196 ? 0.2643 0.3141 0.3215 -0.0793 0.042   -0.0215 886  ILE   A C   
3008 O  O   . ILE   A 196 ? 0.264  0.3191 0.3243 -0.0868 0.0467  -0.022  886  ILE   A O   
3009 C  CB  . ILE   A 196 ? 0.2303 0.3005 0.2997 -0.0628 0.0352  -0.0198 886  ILE   A CB  
3010 C  CG1 . ILE   A 196 ? 0.2387 0.3084 0.3067 -0.0526 0.0334  -0.0168 886  ILE   A CG1 
3011 C  CG2 . ILE   A 196 ? 0.2207 0.3113 0.3022 -0.0682 0.0371  -0.0222 886  ILE   A CG2 
3012 C  CD1 . ILE   A 196 ? 0.2461 0.3269 0.32   -0.0467 0.0275  -0.0177 886  ILE   A CD1 
3024 N  N   . LEU   A 197 ? 0.2834 0.3266 0.3365 -0.0808 0.0383  -0.0234 887  LEU   A N   
3025 C  CA  . LEU   A 197 ? 0.3134 0.3545 0.365  -0.0918 0.0389  -0.0266 887  LEU   A CA  
3026 C  C   . LEU   A 197 ? 0.3496 0.3681 0.3857 -0.0985 0.0439  -0.0257 887  LEU   A C   
3027 O  O   . LEU   A 197 ? 0.3628 0.3818 0.399  -0.11   0.0468  -0.0276 887  LEU   A O   
3028 C  CB  . LEU   A 197 ? 0.3232 0.3623 0.3732 -0.0903 0.0329  -0.0289 887  LEU   A CB  
3029 C  CG  . LEU   A 197 ? 0.3345 0.3929 0.3971 -0.0848 0.0273  -0.0304 887  LEU   A CG  
3030 C  CD1 . LEU   A 197 ? 0.3434 0.395  0.4008 -0.0836 0.0223  -0.0324 887  LEU   A CD1 
3031 C  CD2 . LEU   A 197 ? 0.3357 0.4172 0.4129 -0.0908 0.0272  -0.0332 887  LEU   A CD2 
3043 N  N   . HIS   A 198 ? 0.3581 0.3564 0.3802 -0.0917 0.0445  -0.0232 888  HIS   A N   
3044 C  CA  . HIS   A 198 ? 0.3739 0.3472 0.3778 -0.0962 0.0485  -0.0226 888  HIS   A CA  
3045 C  C   . HIS   A 198 ? 0.372  0.3323 0.3663 -0.0913 0.0531  -0.0192 888  HIS   A C   
3046 O  O   . HIS   A 198 ? 0.3819 0.3194 0.3589 -0.0938 0.0563  -0.0186 888  HIS   A O   
3047 C  CB  . HIS   A 198 ? 0.4015 0.3585 0.3926 -0.0925 0.0447  -0.0235 888  HIS   A CB  
3048 C  CG  . HIS   A 198 ? 0.4344 0.4015 0.4327 -0.0967 0.0399  -0.0269 888  HIS   A CG  
3049 N  ND1 . HIS   A 198 ? 0.4618 0.4328 0.4629 -0.1095 0.0408  -0.0299 888  HIS   A ND1 
3050 C  CD2 . HIS   A 198 ? 0.4391 0.4146 0.443  -0.0897 0.0343  -0.0277 888  HIS   A CD2 
3051 C  CE1 . HIS   A 198 ? 0.4615 0.442  0.469  -0.1094 0.0353  -0.0327 888  HIS   A CE1 
3052 N  NE2 . HIS   A 198 ? 0.4531 0.4359 0.462  -0.0975 0.0315  -0.0314 888  HIS   A NE2 
3060 N  N   . ARG   A 199 ? 0.3569 0.3295 0.3603 -0.0842 0.0533  -0.017  889  ARG   A N   
3061 C  CA  . ARG   A 199 ? 0.3648 0.3251 0.3589 -0.0791 0.0572  -0.0138 889  ARG   A CA  
3062 C  C   . ARG   A 199 ? 0.3647 0.3046 0.3429 -0.0707 0.0555  -0.0123 889  ARG   A C   
3063 O  O   . ARG   A 199 ? 0.3743 0.2972 0.3391 -0.0684 0.0591  -0.0104 889  ARG   A O   
3064 C  CB  . ARG   A 199 ? 0.3888 0.3414 0.3769 -0.0889 0.0645  -0.0135 889  ARG   A CB  
3065 C  CG  . ARG   A 199 ? 0.4298 0.4059 0.4348 -0.0969 0.0664  -0.0149 889  ARG   A CG  
3066 C  CD  . ARG   A 199 ? 0.4894 0.4607 0.4898 -0.1062 0.0743  -0.0141 889  ARG   A CD  
3067 N  NE  . ARG   A 199 ? 0.5198 0.5175 0.538  -0.113  0.0761  -0.0154 889  ARG   A NE  
3068 C  CZ  . ARG   A 199 ? 0.5636 0.5653 0.5828 -0.1221 0.0831  -0.0149 889  ARG   A CZ  
3069 N  NH1 . ARG   A 199 ? 0.5775 0.556  0.5797 -0.1262 0.0892  -0.013  889  ARG   A NH1 
3070 N  NH2 . ARG   A 199 ? 0.5523 0.5814 0.5892 -0.127  0.0843  -0.0162 889  ARG   A NH2 
3084 N  N   . ILE   A 200 ? 0.3543 0.297  0.3341 -0.0654 0.05    -0.0131 890  ILE   A N   
3085 C  CA  . ILE   A 200 ? 0.3663 0.2943 0.3331 -0.0566 0.0478  -0.0119 890  ILE   A CA  
3086 C  C   . ILE   A 200 ? 0.3423 0.2814 0.3168 -0.0466 0.0444  -0.0096 890  ILE   A C   
3087 O  O   . ILE   A 200 ? 0.332  0.2891 0.3205 -0.0458 0.0408  -0.0101 890  ILE   A O   
3088 C  CB  . ILE   A 200 ? 0.3927 0.3184 0.3569 -0.0574 0.044   -0.0143 890  ILE   A CB  
3089 C  CG1 . ILE   A 200 ? 0.4365 0.3472 0.3896 -0.0678 0.0469  -0.0167 890  ILE   A CG1 
3090 C  CG2 . ILE   A 200 ? 0.407  0.3244 0.3617 -0.0465 0.041   -0.013  890  ILE   A CG2 
3091 C  CD1 . ILE   A 200 ? 0.4793 0.3654 0.4128 -0.0695 0.0519  -0.0157 890  ILE   A CD1 
3103 N  N   . TYR   A 201 ? 0.3231 0.2509 0.2872 -0.0391 0.045   -0.0073 891  TYR   A N   
3104 C  CA  . TYR   A 201 ? 0.3061 0.243  0.2757 -0.0304 0.0415  -0.0051 891  TYR   A CA  
3105 C  C   . TYR   A 201 ? 0.3097 0.2368 0.2681 -0.0219 0.0393  -0.0042 891  TYR   A C   
3106 O  O   . TYR   A 201 ? 0.3278 0.2363 0.2703 -0.0204 0.0419  -0.0042 891  TYR   A O   
3107 C  CB  . TYR   A 201 ? 0.2952 0.2314 0.265  -0.0292 0.0442  -0.0031 891  TYR   A CB  
3108 C  CG  . TYR   A 201 ? 0.2836 0.2315 0.2646 -0.0362 0.0466  -0.0038 891  TYR   A CG  
3109 C  CD1 . TYR   A 201 ? 0.2853 0.2271 0.2629 -0.0447 0.052   -0.005  891  TYR   A CD1 
3110 C  CD2 . TYR   A 201 ? 0.2794 0.2436 0.2728 -0.0338 0.0438  -0.0031 891  TYR   A CD2 
3111 C  CE1 . TYR   A 201 ? 0.2828 0.2381 0.2715 -0.0505 0.0545  -0.0056 891  TYR   A CE1 
3112 C  CE2 . TYR   A 201 ? 0.2789 0.2548 0.2819 -0.0386 0.0461  -0.0038 891  TYR   A CE2 
3113 C  CZ  . TYR   A 201 ? 0.2917 0.2646 0.2932 -0.0467 0.0515  -0.005  891  TYR   A CZ  
3114 O  OH  . TYR   A 201 ? 0.2934 0.2805 0.3052 -0.0509 0.054   -0.0056 891  TYR   A OH  
3124 N  N   . THR   A 202 ? 0.2799 0.2196 0.2459 -0.0163 0.0346  -0.0034 892  THR   A N   
3125 C  CA  . THR   A 202 ? 0.2716 0.2077 0.2301 -0.0078 0.032   -0.0024 892  THR   A CA  
3126 C  C   . THR   A 202 ? 0.2562 0.2076 0.2245 -0.0026 0.0279  -0.0003 892  THR   A C   
3127 O  O   . THR   A 202 ? 0.2394 0.2019 0.2188 -0.006  0.0268  0.0001  892  THR   A O   
3128 C  CB  . THR   A 202 ? 0.28   0.2179 0.2384 -0.0083 0.0302  -0.0042 892  THR   A CB  
3129 O  OG1 . THR   A 202 ? 0.2782 0.2344 0.2523 -0.0112 0.0271  -0.0046 892  THR   A OG1 
3130 C  CG2 . THR   A 202 ? 0.29   0.2126 0.2382 -0.0143 0.0333  -0.0066 892  THR   A CG2 
3138 N  N   . HIS   A 203 ? 0.2452 0.1985 0.2095 0.0052  0.0253  0.0009  893  HIS   A N   
3139 C  CA  . HIS   A 203 ? 0.2413 0.2104 0.2153 0.0082  0.0211  0.0028  893  HIS   A CA  
3140 C  C   . HIS   A 203 ? 0.2151 0.1986 0.2021 0.0036  0.0187  0.0022  893  HIS   A C   
3141 O  O   . HIS   A 203 ? 0.2    0.1941 0.1959 0.0021  0.0162  0.0034  893  HIS   A O   
3142 C  CB  . HIS   A 203 ? 0.2505 0.2217 0.2188 0.0169  0.019   0.004   893  HIS   A CB  
3143 C  CG  . HIS   A 203 ? 0.2885 0.2448 0.2426 0.0227  0.0209  0.0044  893  HIS   A CG  
3144 N  ND1 . HIS   A 203 ? 0.3035 0.256  0.2561 0.023   0.0212  0.0056  893  HIS   A ND1 
3145 C  CD2 . HIS   A 203 ? 0.3159 0.2594 0.2553 0.0291  0.0224  0.0038  893  HIS   A CD2 
3146 C  CE1 . HIS   A 203 ? 0.3302 0.2677 0.2677 0.0291  0.023   0.0055  893  HIS   A CE1 
3147 N  NE2 . HIS   A 203 ? 0.3281 0.2594 0.2568 0.0331  0.0238  0.0044  893  HIS   A NE2 
3155 N  N   . GLN   A 204 ? 0.2046 0.1866 0.1912 0.001   0.0195  0.0001  894  GLN   A N   
3156 C  CA  . GLN   A 204 ? 0.2012 0.1956 0.1987 -0.0027 0.0172  -0.0007 894  GLN   A CA  
3157 C  C   . GLN   A 204 ? 0.1888 0.1871 0.1943 -0.0093 0.0179  -0.0018 894  GLN   A C   
3158 O  O   . GLN   A 204 ? 0.1775 0.1872 0.192  -0.0109 0.0152  -0.0017 894  GLN   A O   
3159 C  CB  . GLN   A 204 ? 0.2186 0.2102 0.2121 -0.0023 0.0172  -0.0025 894  GLN   A CB  
3160 C  CG  . GLN   A 204 ? 0.2515 0.2437 0.2387 0.0059  0.0161  -0.0011 894  GLN   A CG  
3161 C  CD  . GLN   A 204 ? 0.2855 0.2936 0.2812 0.0087  0.013   0.0014  894  GLN   A CD  
3162 O  OE1 . GLN   A 204 ? 0.294  0.304  0.2886 0.0122  0.0123  0.0033  894  GLN   A OE1 
3163 N  NE2 . GLN   A 204 ? 0.2736 0.2929 0.2774 0.0066  0.0109  0.0014  894  GLN   A NE2 
3172 N  N   . SER   A 205 ? 0.1899 0.1793 0.1918 -0.0128 0.0214  -0.0026 895  SER   A N   
3173 C  CA  . SER   A 205 ? 0.1835 0.1791 0.1934 -0.0177 0.0222  -0.0032 895  SER   A CA  
3174 C  C   . SER   A 205 ? 0.1772 0.1771 0.1897 -0.0145 0.0206  -0.0007 895  SER   A C   
3175 O  O   . SER   A 205 ? 0.1781 0.1867 0.198  -0.016  0.0192  -0.0007 895  SER   A O   
3176 C  CB  . SER   A 205 ? 0.213  0.1999 0.219  -0.0231 0.0269  -0.0047 895  SER   A CB  
3177 O  OG  . SER   A 205 ? 0.2388 0.2125 0.2343 -0.0209 0.03    -0.0033 895  SER   A OG  
3183 N  N   . ASP   A 206 ? 0.172  0.1657 0.1775 -0.0096 0.0203  0.0013  896  ASP   A N   
3184 C  CA  . ASP   A 206 ? 0.1674 0.165  0.1746 -0.0069 0.0177  0.0036  896  ASP   A CA  
3185 C  C   . ASP   A 206 ? 0.1538 0.1637 0.1683 -0.0066 0.0129  0.0043  896  ASP   A C   
3186 O  O   . ASP   A 206 ? 0.1561 0.1704 0.1737 -0.0069 0.0105  0.0055  896  ASP   A O   
3187 C  CB  . ASP   A 206 ? 0.1886 0.1786 0.1871 -0.0015 0.0174  0.0054  896  ASP   A CB  
3188 C  CG  . ASP   A 206 ? 0.2383 0.2151 0.2281 -0.0008 0.0214  0.0056  896  ASP   A CG  
3189 O  OD1 . ASP   A 206 ? 0.2311 0.2059 0.2227 -0.005  0.0245  0.0048  896  ASP   A OD1 
3190 O  OD2 . ASP   A 206 ? 0.2649 0.2338 0.2459 0.0042  0.0214  0.0065  896  ASP   A OD2 
3195 N  N   . VAL   A 207 ? 0.143  0.1572 0.1587 -0.0059 0.0118  0.0038  897  VAL   A N   
3196 C  CA  . VAL   A 207 ? 0.1326 0.158  0.1544 -0.0062 0.008   0.0045  897  VAL   A CA  
3197 C  C   . VAL   A 207 ? 0.1368 0.1667 0.1646 -0.01   0.0073  0.0032  897  VAL   A C   
3198 O  O   . VAL   A 207 ? 0.1438 0.1789 0.1743 -0.0104 0.0042  0.0043  897  VAL   A O   
3199 C  CB  . VAL   A 207 ? 0.1361 0.1648 0.1572 -0.0041 0.0075  0.0042  897  VAL   A CB  
3200 C  CG1 . VAL   A 207 ? 0.1373 0.1767 0.1645 -0.0056 0.0045  0.0047  897  VAL   A CG1 
3201 C  CG2 . VAL   A 207 ? 0.1373 0.165  0.1529 0.0012  0.0073  0.0059  897  VAL   A CG2 
3211 N  N   . TRP   A 208 ? 0.1418 0.1695 0.1709 -0.0127 0.0099  0.0006  898  TRP   A N   
3212 C  CA  . TRP   A 208 ? 0.1398 0.1735 0.1749 -0.0154 0.0093  -0.001  898  TRP   A CA  
3213 C  C   . TRP   A 208 ? 0.1346 0.1681 0.1695 -0.0145 0.0087  0.0005  898  TRP   A C   
3214 O  O   . TRP   A 208 ? 0.1357 0.174  0.1726 -0.0139 0.0057  0.0009  898  TRP   A O   
3215 C  CB  . TRP   A 208 ? 0.1469 0.1793 0.1836 -0.0192 0.0125  -0.0038 898  TRP   A CB  
3216 C  CG  . TRP   A 208 ? 0.1439 0.1854 0.1876 -0.0212 0.0114  -0.0058 898  TRP   A CG  
3217 C  CD1 . TRP   A 208 ? 0.1449 0.1903 0.1912 -0.0206 0.0115  -0.0055 898  TRP   A CD1 
3218 C  CD2 . TRP   A 208 ? 0.1385 0.1859 0.1866 -0.0236 0.0103  -0.0086 898  TRP   A CD2 
3219 N  NE1 . TRP   A 208 ? 0.1464 0.2012 0.1987 -0.0217 0.0103  -0.008  898  TRP   A NE1 
3220 C  CE2 . TRP   A 208 ? 0.1403 0.1966 0.1942 -0.0241 0.0095  -0.01   898  TRP   A CE2 
3221 C  CE3 . TRP   A 208 ? 0.152  0.1975 0.1988 -0.0252 0.01    -0.0103 898  TRP   A CE3 
3222 C  CZ2 . TRP   A 208 ? 0.1437 0.2083 0.203  -0.026  0.0079  -0.0131 898  TRP   A CZ2 
3223 C  CZ3 . TRP   A 208 ? 0.1513 0.2036 0.2029 -0.0277 0.0084  -0.0133 898  TRP   A CZ3 
3224 C  CH2 . TRP   A 208 ? 0.1449 0.2073 0.2031 -0.0281 0.0072  -0.0147 898  TRP   A CH2 
3235 N  N   . SER   A 209 ? 0.1248 0.151  0.1553 -0.0138 0.0114  0.0014  899  SER   A N   
3236 C  CA  . SER   A 209 ? 0.1257 0.1499 0.1542 -0.0121 0.0111  0.0029  899  SER   A CA  
3237 C  C   . SER   A 209 ? 0.137  0.1616 0.163  -0.01   0.0064  0.0052  899  SER   A C   
3238 O  O   . SER   A 209 ? 0.1411 0.1658 0.1658 -0.0091 0.0043  0.006   899  SER   A O   
3239 C  CB  . SER   A 209 ? 0.1536 0.1685 0.1764 -0.0113 0.0148  0.0036  899  SER   A CB  
3240 O  OG  . SER   A 209 ? 0.1847 0.1986 0.209  -0.0146 0.0194  0.0016  899  SER   A OG  
3246 N  N   . TYR   A 210 ? 0.1374 0.1621 0.1619 -0.0092 0.0048  0.0065  900  TYR   A N   
3247 C  CA  . TYR   A 210 ? 0.1395 0.1668 0.1626 -0.0088 0.0003  0.0087  900  TYR   A CA  
3248 C  C   . TYR   A 210 ? 0.1306 0.1635 0.1566 -0.0107 -0.0025 0.0083  900  TYR   A C   
3249 O  O   . TYR   A 210 ? 0.1341 0.1652 0.1568 -0.011  -0.0056 0.0097  900  TYR   A O   
3250 C  CB  . TYR   A 210 ? 0.1342 0.1645 0.157  -0.0075 -0.0004 0.0097  900  TYR   A CB  
3251 C  CG  . TYR   A 210 ? 0.1418 0.1779 0.1647 -0.0085 -0.0048 0.0119  900  TYR   A CG  
3252 C  CD1 . TYR   A 210 ? 0.142  0.1857 0.1686 -0.0107 -0.0066 0.0121  900  TYR   A CD1 
3253 C  CD2 . TYR   A 210 ? 0.1461 0.1799 0.165  -0.0078 -0.0072 0.0139  900  TYR   A CD2 
3254 C  CE1 . TYR   A 210 ? 0.1524 0.2017 0.1788 -0.0129 -0.0102 0.0144  900  TYR   A CE1 
3255 C  CE2 . TYR   A 210 ? 0.1619 0.202  0.1812 -0.0101 -0.0114 0.016   900  TYR   A CE2 
3256 C  CZ  . TYR   A 210 ? 0.1657 0.2135 0.1888 -0.0131 -0.0127 0.0163  900  TYR   A CZ  
3257 O  OH  . TYR   A 210 ? 0.1787 0.2325 0.2017 -0.0167 -0.0164 0.0185  900  TYR   A OH  
3267 N  N   . GLY   A 211 ? 0.1236 0.1615 0.1541 -0.0117 -0.0015 0.0064  901  GLY   A N   
3268 C  CA  . GLY   A 211 ? 0.131  0.1731 0.1632 -0.0127 -0.004  0.0057  901  GLY   A CA  
3269 C  C   . GLY   A 211 ? 0.1338 0.1735 0.1641 -0.0117 -0.0046 0.0051  901  GLY   A C   
3270 O  O   . GLY   A 211 ? 0.1454 0.1836 0.1716 -0.0114 -0.0078 0.006   901  GLY   A O   
3274 N  N   . VAL   A 212 ? 0.1328 0.1713 0.1645 -0.0109 -0.0013 0.0037  902  VAL   A N   
3275 C  CA  . VAL   A 212 ? 0.1414 0.179  0.1712 -0.0087 -0.0013 0.0032  902  VAL   A CA  
3276 C  C   . VAL   A 212 ? 0.1501 0.1794 0.1715 -0.0069 -0.0037 0.0058  902  VAL   A C   
3277 O  O   . VAL   A 212 ? 0.1594 0.186  0.1756 -0.0048 -0.0063 0.0061  902  VAL   A O   
3278 C  CB  . VAL   A 212 ? 0.1468 0.1868 0.1806 -0.0087 0.0033  0.0013  902  VAL   A CB  
3279 C  CG1 . VAL   A 212 ? 0.1567 0.1977 0.1884 -0.0052 0.0035  0.001   902  VAL   A CG1 
3280 C  CG2 . VAL   A 212 ? 0.1442 0.1922 0.1856 -0.0116 0.005   -0.0016 902  VAL   A CG2 
3290 N  N   . THR   A 213 ? 0.146  0.1703 0.1648 -0.0073 -0.0031 0.0076  903  THR   A N   
3291 C  CA  . THR   A 213 ? 0.1593 0.1753 0.1697 -0.0062 -0.006  0.01    903  THR   A CA  
3292 C  C   . THR   A 213 ? 0.1668 0.182  0.1732 -0.0081 -0.011  0.0115  903  THR   A C   
3293 O  O   . THR   A 213 ? 0.1761 0.1838 0.1741 -0.007  -0.0139 0.0125  903  THR   A O   
3294 C  CB  . THR   A 213 ? 0.1804 0.1932 0.1897 -0.0063 -0.0049 0.0113  903  THR   A CB  
3295 O  OG1 . THR   A 213 ? 0.1731 0.1845 0.1843 -0.005  0.0002  0.01    903  THR   A OG1 
3296 C  CG2 . THR   A 213 ? 0.2034 0.2078 0.2038 -0.0055 -0.0086 0.0137  903  THR   A CG2 
3304 N  N   . VAL   A 214 ? 0.157  0.1789 0.1682 -0.011  -0.0119 0.0115  904  VAL   A N   
3305 C  CA  . VAL   A 214 ? 0.1647 0.1865 0.1721 -0.0139 -0.0161 0.013   904  VAL   A CA  
3306 C  C   . VAL   A 214 ? 0.1597 0.1779 0.1623 -0.0123 -0.0176 0.012   904  VAL   A C   
3307 O  O   . VAL   A 214 ? 0.1655 0.1757 0.1586 -0.0132 -0.0212 0.0135  904  VAL   A O   
3308 C  CB  . VAL   A 214 ? 0.1756 0.2069 0.1895 -0.0166 -0.0159 0.0133  904  VAL   A CB  
3309 C  CG1 . VAL   A 214 ? 0.1811 0.2124 0.191  -0.02   -0.0193 0.0146  904  VAL   A CG1 
3310 C  CG2 . VAL   A 214 ? 0.1868 0.2215 0.2029 -0.0172 -0.0156 0.0148  904  VAL   A CG2 
3320 N  N   . TRP   A 215 ? 0.1606 0.184  0.1687 -0.0099 -0.015  0.0093  905  TRP   A N   
3321 C  CA  . TRP   A 215 ? 0.1711 0.1928 0.1751 -0.0068 -0.0163 0.0078  905  TRP   A CA  
3322 C  C   . TRP   A 215 ? 0.1712 0.1832 0.1654 -0.003  -0.0174 0.0086  905  TRP   A C   
3323 O  O   . TRP   A 215 ? 0.1718 0.1759 0.1556 -0.0013 -0.0207 0.0091  905  TRP   A O   
3324 C  CB  . TRP   A 215 ? 0.1663 0.1976 0.1794 -0.0049 -0.0133 0.0046  905  TRP   A CB  
3325 C  CG  . TRP   A 215 ? 0.1781 0.2103 0.1879 -0.001  -0.015  0.0027  905  TRP   A CG  
3326 C  CD1 . TRP   A 215 ? 0.1858 0.2197 0.1942 -0.0009 -0.0173 0.0017  905  TRP   A CD1 
3327 C  CD2 . TRP   A 215 ? 0.1828 0.2148 0.1897 0.0044  -0.0143 0.0015  905  TRP   A CD2 
3328 N  NE1 . TRP   A 215 ? 0.1913 0.2255 0.1956 0.0046  -0.0186 -0.0002 905  TRP   A NE1 
3329 C  CE2 . TRP   A 215 ? 0.1913 0.2254 0.1952 0.008   -0.0167 -0.0004 905  TRP   A CE2 
3330 C  CE3 . TRP   A 215 ? 0.1893 0.2193 0.1949 0.0071  -0.012  0.0019  905  TRP   A CE3 
3331 C  CZ2 . TRP   A 215 ? 0.2005 0.2362 0.2007 0.0148  -0.0169 -0.002  905  TRP   A CZ2 
3332 C  CZ3 . TRP   A 215 ? 0.2002 0.2314 0.202  0.0134  -0.0119 0.0006  905  TRP   A CZ3 
3333 C  CH2 . TRP   A 215 ? 0.2029 0.2381 0.2027 0.0174  -0.0142 -0.0014 905  TRP   A CH2 
3344 N  N   . GLU   A 216 ? 0.163  0.1738 0.1586 -0.0016 -0.0147 0.0088  906  GLU   A N   
3345 C  CA  . GLU   A 216 ? 0.1644 0.1652 0.1498 0.0026  -0.0155 0.0098  906  GLU   A CA  
3346 C  C   . GLU   A 216 ? 0.1957 0.184  0.1685 0.0005  -0.0205 0.0124  906  GLU   A C   
3347 O  O   . GLU   A 216 ? 0.2177 0.1957 0.1782 0.0038  -0.0232 0.0129  906  GLU   A O   
3348 C  CB  . GLU   A 216 ? 0.1747 0.1755 0.1632 0.0037  -0.0115 0.0101  906  GLU   A CB  
3349 C  CG  . GLU   A 216 ? 0.1971 0.2079 0.1952 0.0054  -0.0063 0.0076  906  GLU   A CG  
3350 C  CD  . GLU   A 216 ? 0.2158 0.2234 0.2139 0.0061  -0.0023 0.0084  906  GLU   A CD  
3351 O  OE1 . GLU   A 216 ? 0.2487 0.2518 0.2407 0.0106  -0.0011 0.0088  906  GLU   A OE1 
3352 O  OE2 . GLU   A 216 ? 0.192  0.2002 0.1942 0.0028  -0.0007 0.0088  906  GLU   A OE2 
3359 N  N   . LEU   A 217 ? 0.1884 0.1777 0.1635 -0.005  -0.022  0.0141  907  LEU   A N   
3360 C  CA  . LEU   A 217 ? 0.2108 0.1897 0.1747 -0.0087 -0.027  0.0166  907  LEU   A CA  
3361 C  C   . LEU   A 217 ? 0.2207 0.195  0.1769 -0.0106 -0.0303 0.0169  907  LEU   A C   
3362 O  O   . LEU   A 217 ? 0.2302 0.1903 0.1713 -0.0104 -0.0341 0.0181  907  LEU   A O   
3363 C  CB  . LEU   A 217 ? 0.1978 0.1824 0.1674 -0.0142 -0.0278 0.0183  907  LEU   A CB  
3364 C  CG  . LEU   A 217 ? 0.206  0.194  0.1817 -0.0121 -0.0247 0.0181  907  LEU   A CG  
3365 C  CD1 . LEU   A 217 ? 0.2007 0.1951 0.1808 -0.0165 -0.0264 0.0196  907  LEU   A CD1 
3366 C  CD2 . LEU   A 217 ? 0.2195 0.1955 0.1855 -0.0079 -0.0249 0.0185  907  LEU   A CD2 
3378 N  N   . MET   A 218 ? 0.2034 0.1878 0.1681 -0.0123 -0.029  0.0158  908  MET   A N   
3379 C  CA  . MET   A 218 ? 0.2174 0.1974 0.1746 -0.0143 -0.0318 0.0161  908  MET   A CA  
3380 C  C   . MET   A 218 ? 0.2308 0.2013 0.1769 -0.0079 -0.0329 0.0147  908  MET   A C   
3381 O  O   . MET   A 218 ? 0.2517 0.2126 0.1858 -0.009  -0.036  0.0153  908  MET   A O   
3382 C  CB  . MET   A 218 ? 0.2194 0.2127 0.1885 -0.0165 -0.0296 0.0151  908  MET   A CB  
3383 C  CG  . MET   A 218 ? 0.2423 0.2448 0.2203 -0.0221 -0.0288 0.0167  908  MET   A CG  
3384 S  SD  . MET   A 218 ? 0.2974 0.2938 0.2663 -0.0302 -0.0332 0.0204  908  MET   A SD  
3385 C  CE  . MET   A 218 ? 0.2663 0.2789 0.2497 -0.0329 -0.0311 0.0214  908  MET   A CE  
3395 N  N   . THR   A 219 ? 0.222  0.1961 0.1719 -0.001  -0.0302 0.0126  909  THR   A N   
3396 C  CA  . THR   A 219 ? 0.2452 0.2129 0.1853 0.0069  -0.031  0.011   909  THR   A CA  
3397 C  C   . THR   A 219 ? 0.2773 0.2305 0.2033 0.0107  -0.0326 0.0125  909  THR   A C   
3398 O  O   . THR   A 219 ? 0.2974 0.2461 0.2153 0.0188  -0.0326 0.0112  909  THR   A O   
3399 C  CB  . THR   A 219 ? 0.2336 0.2167 0.1869 0.0124  -0.0268 0.0079  909  THR   A CB  
3400 O  OG1 . THR   A 219 ? 0.2414 0.2305 0.2039 0.0122  -0.023  0.0079  909  THR   A OG1 
3401 C  CG2 . THR   A 219 ? 0.2336 0.2295 0.1988 0.0098  -0.0257 0.006   909  THR   A CG2 
3409 N  N   . PHE   A 220 ? 0.2776 0.2242 0.2006 0.0056  -0.0339 0.0149  910  PHE   A N   
3410 C  CA  . PHE   A 220 ? 0.3056 0.2377 0.2151 0.0087  -0.0357 0.0162  910  PHE   A CA  
3411 C  C   . PHE   A 220 ? 0.3055 0.2428 0.2193 0.0169  -0.0314 0.0147  910  PHE   A C   
3412 O  O   . PHE   A 220 ? 0.3222 0.2478 0.2222 0.0237  -0.0324 0.0149  910  PHE   A O   
3413 C  CB  . PHE   A 220 ? 0.3303 0.242  0.2171 0.0097  -0.0409 0.0174  910  PHE   A CB  
3414 C  CG  . PHE   A 220 ? 0.3441 0.2512 0.227  -0.0001 -0.0445 0.0192  910  PHE   A CG  
3415 C  CD1 . PHE   A 220 ? 0.3561 0.2593 0.2374 -0.0083 -0.0471 0.0216  910  PHE   A CD1 
3416 C  CD2 . PHE   A 220 ? 0.3504 0.2596 0.2327 -0.0013 -0.0451 0.0184  910  PHE   A CD2 
3417 C  CE1 . PHE   A 220 ? 0.3687 0.2709 0.248  -0.0181 -0.05   0.0233  910  PHE   A CE1 
3418 C  CE2 . PHE   A 220 ? 0.3623 0.2683 0.2412 -0.0108 -0.0477 0.0204  910  PHE   A CE2 
3419 C  CZ  . PHE   A 220 ? 0.3588 0.2621 0.2367 -0.0195 -0.05   0.0228  910  PHE   A CZ  
3429 N  N   . GLY   A 221 ? 0.282  0.236  0.214  0.016   -0.0265 0.0134  911  GLY   A N   
3430 C  CA  . GLY   A 221 ? 0.2891 0.2499 0.2273 0.0214  -0.0216 0.0122  911  GLY   A CA  
3431 C  C   . GLY   A 221 ? 0.2823 0.2541 0.2259 0.0279  -0.0187 0.0096  911  GLY   A C   
3432 O  O   . GLY   A 221 ? 0.2842 0.258  0.227  0.034   -0.0155 0.0091  911  GLY   A O   
3436 N  N   . SER   A 222 ? 0.2703 0.251  0.2202 0.0266  -0.0195 0.0078  912  SER   A N   
3437 C  CA  . SER   A 222 ? 0.2705 0.2648 0.2277 0.0323  -0.017  0.0049  912  SER   A CA  
3438 C  C   . SER   A 222 ? 0.256  0.2662 0.2305 0.0297  -0.0112 0.0036  912  SER   A C   
3439 O  O   . SER   A 222 ? 0.2431 0.2544 0.2249 0.023   -0.0096 0.0045  912  SER   A O   
3440 C  CB  . SER   A 222 ? 0.2913 0.291  0.2512 0.0312  -0.0195 0.0031  912  SER   A CB  
3441 O  OG  . SER   A 222 ? 0.3525 0.3365 0.2945 0.034   -0.0245 0.0041  912  SER   A OG  
3447 N  N   . LYS   A 223 ? 0.2409 0.2634 0.2211 0.0351  -0.008  0.0014  913  LYS   A N   
3448 C  CA  . LYS   A 223 ? 0.2407 0.2782 0.2364 0.0318  -0.0023 0.0001  913  LYS   A CA  
3449 C  C   . LYS   A 223 ? 0.2326 0.2828 0.2409 0.0267  -0.0026 -0.0024 913  LYS   A C   
3450 O  O   . LYS   A 223 ? 0.2413 0.2964 0.2486 0.0303  -0.0055 -0.0043 913  LYS   A O   
3451 C  CB  . LYS   A 223 ? 0.2722 0.3199 0.2695 0.0389  0.0013  -0.0012 913  LYS   A CB  
3452 C  CG  . LYS   A 223 ? 0.3599 0.3949 0.3444 0.0444  0.0024  0.0013  913  LYS   A CG  
3453 C  CD  . LYS   A 223 ? 0.4436 0.4909 0.43   0.0524  0.0064  0.0001  913  LYS   A CD  
3454 C  CE  . LYS   A 223 ? 0.5372 0.5724 0.5113 0.0581  0.0084  0.0026  913  LYS   A CE  
3455 N  NZ  . LYS   A 223 ? 0.605  0.6219 0.5585 0.0662  0.0029  0.004   913  LYS   A NZ  
3469 N  N   . PRO   A 224 ? 0.2214 0.2755 0.2397 0.0191  0.0001  -0.0026 914  PRO   A N   
3470 C  CA  . PRO   A 224 ? 0.2039 0.268  0.2322 0.0146  -0.0006 -0.005  914  PRO   A CA  
3471 C  C   . PRO   A 224 ? 0.1948 0.2767 0.2338 0.0157  0.0019  -0.0083 914  PRO   A C   
3472 O  O   . PRO   A 224 ? 0.1943 0.2828 0.2377 0.0158  0.0064  -0.0085 914  PRO   A O   
3473 C  CB  . PRO   A 224 ? 0.2189 0.2798 0.252  0.0073  0.0018  -0.0039 914  PRO   A CB  
3474 C  CG  . PRO   A 224 ? 0.2304 0.2855 0.2604 0.0079  0.0054  -0.002  914  PRO   A CG  
3475 C  CD  . PRO   A 224 ? 0.2197 0.2673 0.2385 0.0148  0.0033  -0.0006 914  PRO   A CD  
3483 N  N   . TYR   A 225 ? 0.1893 0.2795 0.232  0.0164  -0.0011 -0.0109 915  TYR   A N   
3484 C  CA  . TYR   A 225 ? 0.1875 0.2968 0.2411 0.0172  0.0001  -0.0145 915  TYR   A CA  
3485 C  C   . TYR   A 225 ? 0.2073 0.324  0.2591 0.0248  0.0021  -0.0147 915  TYR   A C   
3486 O  O   . TYR   A 225 ? 0.2061 0.3372 0.2678 0.0231  0.0064  -0.016  915  TYR   A O   
3487 C  CB  . TYR   A 225 ? 0.1689 0.2865 0.2348 0.0082  0.0043  -0.0158 915  TYR   A CB  
3488 C  CG  . TYR   A 225 ? 0.1609 0.2685 0.2264 0.0015  0.0036  -0.0149 915  TYR   A CG  
3489 C  CD1 . TYR   A 225 ? 0.1755 0.2727 0.2386 -0.0027 0.0068  -0.0124 915  TYR   A CD1 
3490 C  CD2 . TYR   A 225 ? 0.1575 0.2672 0.2251 -0.0003 0.0002  -0.0168 915  TYR   A CD2 
3491 C  CE1 . TYR   A 225 ? 0.1828 0.2723 0.2453 -0.0076 0.0064  -0.0117 915  TYR   A CE1 
3492 C  CE2 . TYR   A 225 ? 0.1709 0.2728 0.2381 -0.0056 0.0001  -0.016  915  TYR   A CE2 
3493 C  CZ  . TYR   A 225 ? 0.1829 0.2747 0.2472 -0.0088 0.003   -0.0134 915  TYR   A CZ  
3494 O  OH  . TYR   A 225 ? 0.1855 0.2704 0.2488 -0.0129 0.0031  -0.0127 915  TYR   A OH  
3504 N  N   . ASP   A 226 ? 0.2283 0.3339 0.2663 0.0331  -0.0009 -0.0131 916  ASP   A N   
3505 C  CA  . ASP   A 226 ? 0.2529 0.362  0.2857 0.0418  0.0007  -0.0127 916  ASP   A CA  
3506 C  C   . ASP   A 226 ? 0.2419 0.3737 0.2841 0.0467  0.0011  -0.0164 916  ASP   A C   
3507 O  O   . ASP   A 226 ? 0.2415 0.3782 0.2844 0.0488  -0.0031 -0.0188 916  ASP   A O   
3508 C  CB  . ASP   A 226 ? 0.3018 0.3916 0.3151 0.0498  -0.0037 -0.0106 916  ASP   A CB  
3509 C  CG  . ASP   A 226 ? 0.3901 0.4775 0.3938 0.0594  -0.0021 -0.0095 916  ASP   A CG  
3510 O  OD1 . ASP   A 226 ? 0.3802 0.4748 0.3905 0.0581  0.0033  -0.0088 916  ASP   A OD1 
3511 O  OD2 . ASP   A 226 ? 0.4661 0.5424 0.4538 0.0684  -0.0062 -0.0091 916  ASP   A OD2 
3516 N  N   . GLY   A 227 ? 0.243  0.3899 0.2935 0.0475  0.0063  -0.0169 917  GLY   A N   
3517 C  CA  . GLY   A 227 ? 0.2379 0.4103 0.2994 0.0515  0.0072  -0.0204 917  GLY   A CA  
3518 C  C   . GLY   A 227 ? 0.2269 0.4168 0.3061 0.0411  0.0084  -0.0234 917  GLY   A C   
3519 O  O   . GLY   A 227 ? 0.2211 0.4344 0.311  0.043   0.0086  -0.0267 917  GLY   A O   
3523 N  N   . ILE   A 228 ? 0.2151 0.3943 0.2969 0.0302  0.0089  -0.0225 918  ILE   A N   
3524 C  CA  . ILE   A 228 ? 0.2    0.3916 0.2959 0.0197  0.0101  -0.0252 918  ILE   A CA  
3525 C  C   . ILE   A 228 ? 0.2003 0.3946 0.3028 0.0112  0.0173  -0.0238 918  ILE   A C   
3526 O  O   . ILE   A 228 ? 0.2087 0.3846 0.3031 0.0095  0.0195  -0.0204 918  ILE   A O   
3527 C  CB  . ILE   A 228 ? 0.2045 0.3815 0.2971 0.0141  0.0063  -0.0251 918  ILE   A CB  
3528 C  CG1 . ILE   A 228 ? 0.2333 0.409  0.3198 0.0217  -0.0004 -0.0268 918  ILE   A CG1 
3529 C  CG2 . ILE   A 228 ? 0.1934 0.3796 0.2983 0.0026  0.0082  -0.0275 918  ILE   A CG2 
3530 C  CD1 . ILE   A 228 ? 0.2713 0.4294 0.3505 0.0186  -0.0042 -0.0257 918  ILE   A CD1 
3542 N  N   . PRO   A 229 ? 0.1842 0.3998 0.3003 0.0053  0.021   -0.0262 919  PRO   A N   
3543 C  CA  . PRO   A 229 ? 0.1883 0.4037 0.3083 -0.0032 0.0283  -0.0245 919  PRO   A CA  
3544 C  C   . PRO   A 229 ? 0.1918 0.3897 0.3092 -0.0136 0.029   -0.0236 919  PRO   A C   
3545 O  O   . PRO   A 229 ? 0.1808 0.3773 0.3004 -0.0176 0.0249  -0.0257 919  PRO   A O   
3546 C  CB  . PRO   A 229 ? 0.1822 0.4267 0.3177 -0.0078 0.0314  -0.0277 919  PRO   A CB  
3547 C  CG  . PRO   A 229 ? 0.1807 0.4388 0.3218 -0.0048 0.025   -0.0316 919  PRO   A CG  
3548 C  CD  . PRO   A 229 ? 0.1712 0.4122 0.2992 0.0059  0.0187  -0.0305 919  PRO   A CD  
3556 N  N   . ALA   A 230 ? 0.2039 0.387  0.3151 -0.0169 0.034   -0.0204 920  ALA   A N   
3557 C  CA  . ALA   A 230 ? 0.2222 0.3874 0.3289 -0.0253 0.0347  -0.0194 920  ALA   A CA  
3558 C  C   . ALA   A 230 ? 0.1989 0.3727 0.3145 -0.0366 0.0355  -0.0225 920  ALA   A C   
3559 O  O   . ALA   A 230 ? 0.1977 0.3588 0.3096 -0.0412 0.0334  -0.0229 920  ALA   A O   
3560 C  CB  . ALA   A 230 ? 0.2414 0.3922 0.3406 -0.0268 0.0405  -0.016  920  ALA   A CB  
3566 N  N   . SER   A 231 ? 0.1789 0.3746 0.3059 -0.0409 0.0384  -0.0249 921  SER   A N   
3567 C  CA  . SER   A 231 ? 0.1784 0.3832 0.3137 -0.0528 0.0389  -0.028  921  SER   A CA  
3568 C  C   . SER   A 231 ? 0.1798 0.3889 0.3183 -0.0522 0.0315  -0.0314 921  SER   A C   
3569 O  O   . SER   A 231 ? 0.1941 0.4047 0.3362 -0.0621 0.0309  -0.0339 921  SER   A O   
3570 C  CB  . SER   A 231 ? 0.1869 0.4174 0.3347 -0.0576 0.0433  -0.0298 921  SER   A CB  
3571 O  OG  . SER   A 231 ? 0.2155 0.4665 0.3698 -0.0472 0.0403  -0.0312 921  SER   A OG  
3577 N  N   . GLU   A 232 ? 0.1641 0.3744 0.3001 -0.0409 0.0261  -0.0315 922  GLU   A N   
3578 C  CA  . GLU   A 232 ? 0.1595 0.3719 0.2966 -0.039  0.0191  -0.0343 922  GLU   A CA  
3579 C  C   . GLU   A 232 ? 0.1565 0.3448 0.2823 -0.0379 0.0161  -0.0324 922  GLU   A C   
3580 O  O   . GLU   A 232 ? 0.1436 0.3305 0.2691 -0.038  0.0112  -0.0345 922  GLU   A O   
3581 C  CB  . GLU   A 232 ? 0.1773 0.4018 0.3152 -0.0266 0.0149  -0.0352 922  GLU   A CB  
3582 C  CG  . GLU   A 232 ? 0.2065 0.4418 0.3488 -0.0248 0.0084  -0.0393 922  GLU   A CG  
3583 C  CD  . GLU   A 232 ? 0.262  0.5065 0.4024 -0.0117 0.004   -0.0402 922  GLU   A CD  
3584 O  OE1 . GLU   A 232 ? 0.2629 0.5075 0.3991 -0.0038 0.0062  -0.0379 922  GLU   A OE1 
3585 O  OE2 . GLU   A 232 ? 0.2682 0.519  0.41   -0.0088 -0.0017 -0.0434 922  GLU   A OE2 
3592 N  N   . ILE   A 233 ? 0.155  0.3252 0.2717 -0.0365 0.019   -0.0286 923  ILE   A N   
3593 C  CA  . ILE   A 233 ? 0.151  0.3013 0.2575 -0.034  0.0162  -0.0264 923  ILE   A CA  
3594 C  C   . ILE   A 233 ? 0.1627 0.3048 0.2678 -0.0412 0.0149  -0.0279 923  ILE   A C   
3595 O  O   . ILE   A 233 ? 0.1655 0.3019 0.2669 -0.0381 0.0104  -0.0282 923  ILE   A O   
3596 C  CB  . ILE   A 233 ? 0.1562 0.291  0.254  -0.0316 0.0197  -0.0222 923  ILE   A CB  
3597 C  CG1 . ILE   A 233 ? 0.1406 0.2794 0.2362 -0.0224 0.0195  -0.0205 923  ILE   A CG1 
3598 C  CG2 . ILE   A 233 ? 0.1657 0.2817 0.2542 -0.0307 0.0175  -0.02   923  ILE   A CG2 
3599 C  CD1 . ILE   A 233 ? 0.154  0.2917 0.245  -0.0138 0.0134  -0.0205 923  ILE   A CD1 
3611 N  N   . SER   A 234 ? 0.1662 0.307  0.2731 -0.0506 0.0189  -0.0289 924  SER   A N   
3612 C  CA  . SER   A 234 ? 0.192  0.3226 0.295  -0.057  0.0176  -0.0303 924  SER   A CA  
3613 C  C   . SER   A 234 ? 0.1958 0.3376 0.3044 -0.0572 0.0121  -0.0342 924  SER   A C   
3614 O  O   . SER   A 234 ? 0.2028 0.3345 0.3057 -0.0561 0.0088  -0.0345 924  SER   A O   
3615 C  CB  . SER   A 234 ? 0.2159 0.3415 0.3177 -0.0675 0.0229  -0.0307 924  SER   A CB  
3616 O  OG  . SER   A 234 ? 0.2305 0.3745 0.3428 -0.0745 0.0246  -0.0335 924  SER   A OG  
3622 N  N   . SER   A 235 ? 0.1926 0.3555 0.3118 -0.0572 0.0108  -0.037  925  SER   A N   
3623 C  CA  . SER   A 235 ? 0.1995 0.3742 0.324  -0.0565 0.0051  -0.0409 925  SER   A CA  
3624 C  C   . SER   A 235 ? 0.1923 0.3619 0.3113 -0.0457 0.0001  -0.0399 925  SER   A C   
3625 O  O   . SER   A 235 ? 0.1868 0.3531 0.3032 -0.045  -0.0043 -0.0418 925  SER   A O   
3626 C  CB  . SER   A 235 ? 0.214  0.4144 0.3512 -0.058  0.005   -0.044  925  SER   A CB  
3627 O  OG  . SER   A 235 ? 0.2587 0.4685 0.3978 -0.0477 0.0048  -0.0427 925  SER   A OG  
3633 N  N   . ILE   A 236 ? 0.1857 0.3533 0.3015 -0.0376 0.0009  -0.037  926  ILE   A N   
3634 C  CA  . ILE   A 236 ? 0.1897 0.3505 0.2985 -0.0283 -0.0032 -0.0355 926  ILE   A CA  
3635 C  C   . ILE   A 236 ? 0.1769 0.3187 0.2768 -0.0296 -0.0038 -0.0333 926  ILE   A C   
3636 O  O   . ILE   A 236 ? 0.1751 0.3136 0.2713 -0.0266 -0.0079 -0.0341 926  ILE   A O   
3637 C  CB  . ILE   A 236 ? 0.208  0.3681 0.3134 -0.0209 -0.0016 -0.0325 926  ILE   A CB  
3638 C  CG1 . ILE   A 236 ? 0.2177 0.398  0.3305 -0.0164 -0.0024 -0.035  926  ILE   A CG1 
3639 C  CG2 . ILE   A 236 ? 0.2273 0.3737 0.322  -0.0135 -0.0049 -0.0298 926  ILE   A CG2 
3640 C  CD1 . ILE   A 236 ? 0.2478 0.4278 0.3572 -0.0099 0.0001  -0.0324 926  ILE   A CD1 
3652 N  N   . LEU   A 237 ? 0.1623 0.2925 0.2585 -0.0338 0.0005  -0.0308 927  LEU   A N   
3653 C  CA  . LEU   A 237 ? 0.1628 0.2768 0.2506 -0.0341 0.0002  -0.0287 927  LEU   A CA  
3654 C  C   . LEU   A 237 ? 0.1743 0.2866 0.2618 -0.0387 -0.0018 -0.0316 927  LEU   A C   
3655 O  O   . LEU   A 237 ? 0.1693 0.2743 0.2512 -0.0358 -0.0044 -0.0311 927  LEU   A O   
3656 C  CB  . LEU   A 237 ? 0.163  0.2652 0.2461 -0.0368 0.005   -0.0257 927  LEU   A CB  
3657 C  CG  . LEU   A 237 ? 0.1691 0.2697 0.2503 -0.0322 0.0069  -0.0225 927  LEU   A CG  
3658 C  CD1 . LEU   A 237 ? 0.1774 0.2676 0.2545 -0.0355 0.0119  -0.0203 927  LEU   A CD1 
3659 C  CD2 . LEU   A 237 ? 0.1642 0.2596 0.2399 -0.0255 0.0034  -0.0201 927  LEU   A CD2 
3671 N  N   . GLU   A 238 ? 0.1813 0.3011 0.2745 -0.0458 -0.0008 -0.0349 928  GLU   A N   
3672 C  CA  . GLU   A 238 ? 0.1943 0.3115 0.2859 -0.0507 -0.0033 -0.038  928  GLU   A CA  
3673 C  C   . GLU   A 238 ? 0.2111 0.336  0.3045 -0.0457 -0.0091 -0.0404 928  GLU   A C   
3674 O  O   . GLU   A 238 ? 0.2333 0.3507 0.3213 -0.0461 -0.0117 -0.0417 928  GLU   A O   
3675 C  CB  . GLU   A 238 ? 0.2006 0.3243 0.2976 -0.0608 -0.0012 -0.041  928  GLU   A CB  
3676 C  CG  . GLU   A 238 ? 0.2706 0.3803 0.3613 -0.0665 0.0044  -0.0387 928  GLU   A CG  
3677 C  CD  . GLU   A 238 ? 0.3793 0.4954 0.4749 -0.0771 0.0079  -0.0407 928  GLU   A CD  
3678 O  OE1 . GLU   A 238 ? 0.3862 0.5225 0.4933 -0.0791 0.0071  -0.043  928  GLU   A OE1 
3679 O  OE2 . GLU   A 238 ? 0.4294 0.5304 0.5167 -0.0833 0.0116  -0.0398 928  GLU   A OE2 
3686 N  N   . LYS   A 239 ? 0.204  0.3421 0.303  -0.0402 -0.011  -0.041  929  LYS   A N   
3687 C  CA  . LYS   A 239 ? 0.223  0.3668 0.3216 -0.0339 -0.0166 -0.043  929  LYS   A CA  
3688 C  C   . LYS   A 239 ? 0.228  0.3588 0.3169 -0.0269 -0.0178 -0.0397 929  LYS   A C   
3689 O  O   . LYS   A 239 ? 0.2412 0.3737 0.3274 -0.0216 -0.022  -0.0409 929  LYS   A O   
3690 C  CB  . LYS   A 239 ? 0.2634 0.4247 0.3691 -0.029  -0.0182 -0.0447 929  LYS   A CB  
3691 C  CG  . LYS   A 239 ? 0.3551 0.5352 0.4712 -0.0335 -0.02   -0.0495 929  LYS   A CG  
3692 C  CD  . LYS   A 239 ? 0.4355 0.6337 0.5603 -0.031  -0.0182 -0.0499 929  LYS   A CD  
3693 C  CE  . LYS   A 239 ? 0.5033 0.7055 0.6246 -0.0189 -0.021  -0.0492 929  LYS   A CE  
3694 N  NZ  . LYS   A 239 ? 0.5321 0.7424 0.6564 -0.0151 -0.0174 -0.0474 929  LYS   A NZ  
3708 N  N   . GLY   A 240 ? 0.208  0.3267 0.2917 -0.027  -0.0144 -0.0356 930  GLY   A N   
3709 C  CA  . GLY   A 240 ? 0.2021 0.3104 0.2775 -0.0219 -0.0153 -0.0323 930  GLY   A CA  
3710 C  C   . GLY   A 240 ? 0.1914 0.3005 0.2648 -0.0162 -0.0157 -0.0297 930  GLY   A C   
3711 O  O   . GLY   A 240 ? 0.2098 0.3108 0.2763 -0.0129 -0.0166 -0.0268 930  GLY   A O   
3715 N  N   . GLU   A 241 ? 0.1576 0.2758 0.2361 -0.0153 -0.0149 -0.0305 931  GLU   A N   
3716 C  CA  . GLU   A 241 ? 0.1559 0.2729 0.2303 -0.0093 -0.0154 -0.0282 931  GLU   A CA  
3717 C  C   . GLU   A 241 ? 0.1412 0.2486 0.2123 -0.0108 -0.0119 -0.0241 931  GLU   A C   
3718 O  O   . GLU   A 241 ? 0.1372 0.2437 0.2117 -0.0156 -0.0082 -0.0238 931  GLU   A O   
3719 C  CB  . GLU   A 241 ? 0.1792 0.31   0.2593 -0.0064 -0.0159 -0.0307 931  GLU   A CB  
3720 C  CG  . GLU   A 241 ? 0.2699 0.4111 0.3524 -0.003  -0.0203 -0.0347 931  GLU   A CG  
3721 C  CD  . GLU   A 241 ? 0.3645 0.523  0.4543 0.0001  -0.0207 -0.0376 931  GLU   A CD  
3722 O  OE1 . GLU   A 241 ? 0.4008 0.5721 0.4966 0       -0.0236 -0.0417 931  GLU   A OE1 
3723 O  OE2 . GLU   A 241 ? 0.3775 0.5373 0.4667 0.003   -0.0182 -0.0357 931  GLU   A OE2 
3730 N  N   . ARG   A 242 ? 0.1376 0.2372 0.2009 -0.0066 -0.0131 -0.0211 932  ARG   A N   
3731 C  CA  . ARG   A 242 ? 0.1366 0.2272 0.1958 -0.0074 -0.0108 -0.0172 932  ARG   A CA  
3732 C  C   . ARG   A 242 ? 0.1579 0.2448 0.2102 -0.0022 -0.0124 -0.0154 932  ARG   A C   
3733 O  O   . ARG   A 242 ? 0.162  0.2516 0.2111 0.0026  -0.0154 -0.0169 932  ARG   A O   
3734 C  CB  . ARG   A 242 ? 0.1354 0.2173 0.1901 -0.0094 -0.0111 -0.0148 932  ARG   A CB  
3735 C  CG  . ARG   A 242 ? 0.1389 0.2212 0.1973 -0.0136 -0.0094 -0.0162 932  ARG   A CG  
3736 C  CD  . ARG   A 242 ? 0.1553 0.2363 0.2169 -0.0172 -0.0053 -0.016  932  ARG   A CD  
3737 N  NE  . ARG   A 242 ? 0.1548 0.2324 0.2164 -0.0207 -0.0038 -0.0171 932  ARG   A NE  
3738 C  CZ  . ARG   A 242 ? 0.1668 0.2481 0.2319 -0.024  -0.0037 -0.0205 932  ARG   A CZ  
3739 N  NH1 . ARG   A 242 ? 0.1509 0.2424 0.2217 -0.0244 -0.0053 -0.0235 932  ARG   A NH1 
3740 N  NH2 . ARG   A 242 ? 0.1453 0.2202 0.2074 -0.0268 -0.0024 -0.0211 932  ARG   A NH2 
3754 N  N   . LEU   A 243 ? 0.1649 0.2436 0.2127 -0.0026 -0.0109 -0.0121 933  LEU   A N   
3755 C  CA  . LEU   A 243 ? 0.1628 0.2344 0.2014 0.0018  -0.0128 -0.0101 933  LEU   A CA  
3756 C  C   . LEU   A 243 ? 0.1821 0.2469 0.2118 0.0036  -0.0169 -0.0092 933  LEU   A C   
3757 O  O   . LEU   A 243 ? 0.1883 0.2517 0.2186 0.0003  -0.0174 -0.0086 933  LEU   A O   
3758 C  CB  . LEU   A 243 ? 0.1563 0.2195 0.1915 -0.0001 -0.0108 -0.0068 933  LEU   A CB  
3759 C  CG  . LEU   A 243 ? 0.165  0.2324 0.2059 -0.0007 -0.0066 -0.0073 933  LEU   A CG  
3760 C  CD1 . LEU   A 243 ? 0.1613 0.2197 0.1989 -0.003  -0.0047 -0.0042 933  LEU   A CD1 
3761 C  CD2 . LEU   A 243 ? 0.1773 0.2488 0.2164 0.005   -0.0065 -0.0083 933  LEU   A CD2 
3773 N  N   . PRO   A 244 ? 0.1885 0.2488 0.2089 0.0091  -0.0196 -0.0092 934  PRO   A N   
3774 C  CA  . PRO   A 244 ? 0.1931 0.2452 0.2031 0.0106  -0.0233 -0.0085 934  PRO   A CA  
3775 C  C   . PRO   A 244 ? 0.1889 0.2289 0.1906 0.0064  -0.0242 -0.0044 934  PRO   A C   
3776 O  O   . PRO   A 244 ? 0.1916 0.2284 0.1937 0.0038  -0.0227 -0.0022 934  PRO   A O   
3777 C  CB  . PRO   A 244 ? 0.2102 0.2595 0.2109 0.0186  -0.0258 -0.0097 934  PRO   A CB  
3778 C  CG  . PRO   A 244 ? 0.2145 0.2637 0.216  0.02    -0.0235 -0.0087 934  PRO   A CG  
3779 C  CD  . PRO   A 244 ? 0.1915 0.2528 0.2088 0.0149  -0.0194 -0.0098 934  PRO   A CD  
3787 N  N   . GLN   A 245 ? 0.1888 0.2227 0.1828 0.0055  -0.0266 -0.0036 935  GLN   A N   
3788 C  CA  . GLN   A 245 ? 0.1998 0.2238 0.1857 0.0006  -0.0275 0.0002  935  GLN   A CA  
3789 C  C   . GLN   A 245 ? 0.235  0.2456 0.2071 0.0024  -0.0298 0.0022  935  GLN   A C   
3790 O  O   . GLN   A 245 ? 0.2534 0.2558 0.2134 0.0073  -0.0324 0.0014  935  GLN   A O   
3791 C  CB  . GLN   A 245 ? 0.2023 0.2228 0.1822 -0.0009 -0.0292 0.0007  935  GLN   A CB  
3792 C  CG  . GLN   A 245 ? 0.2142 0.2268 0.1869 -0.0075 -0.0298 0.0049  935  GLN   A CG  
3793 C  CD  . GLN   A 245 ? 0.2261 0.2375 0.1947 -0.0098 -0.0302 0.0055  935  GLN   A CD  
3794 O  OE1 . GLN   A 245 ? 0.2242 0.237  0.1918 -0.0055 -0.0309 0.0029  935  GLN   A OE1 
3795 N  NE2 . GLN   A 245 ? 0.2315 0.2413 0.198  -0.0166 -0.0297 0.009   935  GLN   A NE2 
3804 N  N   . PRO   A 246 ? 0.2489 0.2553 0.2201 -0.0013 -0.0293 0.0049  936  PRO   A N   
3805 C  CA  . PRO   A 246 ? 0.2666 0.2576 0.222  0.0001  -0.032  0.0067  936  PRO   A CA  
3806 C  C   . PRO   A 246 ? 0.2982 0.276  0.2382 -0.0029 -0.0353 0.0087  936  PRO   A C   
3807 O  O   . PRO   A 246 ? 0.2931 0.2745 0.2368 -0.0092 -0.0349 0.0102  936  PRO   A O   
3808 C  CB  . PRO   A 246 ? 0.2716 0.2624 0.2307 -0.0044 -0.031  0.0091  936  PRO   A CB  
3809 C  CG  . PRO   A 246 ? 0.2589 0.2652 0.2358 -0.0051 -0.0269 0.0076  936  PRO   A CG  
3810 C  CD  . PRO   A 246 ? 0.2317 0.2454 0.2141 -0.0061 -0.0266 0.0061  936  PRO   A CD  
3818 N  N   . PRO   A 247 ? 0.3224 0.2847 0.2443 0.0016  -0.0384 0.0087  937  PRO   A N   
3819 C  CA  . PRO   A 247 ? 0.3393 0.287  0.2446 -0.0017 -0.0413 0.0105  937  PRO   A CA  
3820 C  C   . PRO   A 247 ? 0.3279 0.2693 0.2289 -0.0126 -0.0422 0.0144  937  PRO   A C   
3821 O  O   . PRO   A 247 ? 0.3429 0.2792 0.2369 -0.0176 -0.043  0.0159  937  PRO   A O   
3822 C  CB  . PRO   A 247 ? 0.3724 0.3025 0.2572 0.0064  -0.0445 0.0097  937  PRO   A CB  
3823 C  CG  . PRO   A 247 ? 0.38   0.3141 0.2697 0.0115  -0.0434 0.0088  937  PRO   A CG  
3824 C  CD  . PRO   A 247 ? 0.3368 0.2937 0.2511 0.0107  -0.0393 0.0071  937  PRO   A CD  
3832 N  N   . ILE   A 248 ? 0.3072 0.2507 0.2133 -0.0165 -0.0419 0.0161  938  ILE   A N   
3833 C  CA  . ILE   A 248 ? 0.2975 0.2385 0.2014 -0.0271 -0.0431 0.0197  938  ILE   A CA  
3834 C  C   . ILE   A 248 ? 0.2862 0.2465 0.2085 -0.0323 -0.04   0.0202  938  ILE   A C   
3835 O  O   . ILE   A 248 ? 0.2936 0.2553 0.2153 -0.041  -0.0406 0.023   938  ILE   A O   
3836 C  CB  . ILE   A 248 ? 0.2987 0.2341 0.1996 -0.0294 -0.0447 0.0213  938  ILE   A CB  
3837 C  CG1 . ILE   A 248 ? 0.2833 0.2351 0.2034 -0.0262 -0.0414 0.0199  938  ILE   A CG1 
3838 C  CG2 . ILE   A 248 ? 0.3187 0.2327 0.1987 -0.024  -0.048  0.021   938  ILE   A CG2 
3839 C  CD1 . ILE   A 248 ? 0.2895 0.2393 0.2096 -0.0306 -0.0428 0.022   938  ILE   A CD1 
3851 N  N   . CYS   A 249 ? 0.265  0.2402 0.203  -0.0273 -0.0367 0.0176  939  CYS   A N   
3852 C  CA  . CYS   A 249 ? 0.2468 0.2387 0.2005 -0.0308 -0.0337 0.018   939  CYS   A CA  
3853 C  C   . CYS   A 249 ? 0.2433 0.2376 0.1958 -0.0329 -0.0331 0.0182  939  CYS   A C   
3854 O  O   . CYS   A 249 ? 0.2401 0.2331 0.1909 -0.0273 -0.0328 0.0157  939  CYS   A O   
3855 C  CB  . CYS   A 249 ? 0.2456 0.2497 0.2142 -0.0252 -0.0306 0.0151  939  CYS   A CB  
3856 S  SG  . CYS   A 249 ? 0.2867 0.2901 0.2586 -0.0235 -0.0302 0.0152  939  CYS   A SG  
3862 N  N   . THR   A 250 ? 0.2292 0.2299 0.1847 -0.0402 -0.0323 0.0211  940  THR   A N   
3863 C  CA  . THR   A 250 ? 0.2361 0.242  0.1928 -0.0419 -0.0306 0.0214  940  THR   A CA  
3864 C  C   . THR   A 250 ? 0.2154 0.2362 0.188  -0.0365 -0.0274 0.0188  940  THR   A C   
3865 O  O   . THR   A 250 ? 0.2058 0.2324 0.1875 -0.0335 -0.0264 0.0174  940  THR   A O   
3866 C  CB  . THR   A 250 ? 0.2524 0.2627 0.2081 -0.0514 -0.0303 0.0254  940  THR   A CB  
3867 O  OG1 . THR   A 250 ? 0.2383 0.2645 0.2084 -0.053  -0.0286 0.0263  940  THR   A OG1 
3868 C  CG2 . THR   A 250 ? 0.2799 0.274  0.2186 -0.0584 -0.0338 0.028   940  THR   A CG2 
3876 N  N   . ILE   A 251 ? 0.2036 0.2285 0.1775 -0.0353 -0.0258 0.0181  941  ILE   A N   
3877 C  CA  . ILE   A 251 ? 0.1908 0.2265 0.1765 -0.0303 -0.0233 0.0154  941  ILE   A CA  
3878 C  C   . ILE   A 251 ? 0.1738 0.2224 0.172  -0.0313 -0.0208 0.0162  941  ILE   A C   
3879 O  O   . ILE   A 251 ? 0.1682 0.221  0.1742 -0.027  -0.0195 0.0136  941  ILE   A O   
3880 C  CB  . ILE   A 251 ? 0.1985 0.235  0.1812 -0.0291 -0.0223 0.0148  941  ILE   A CB  
3881 C  CG1 . ILE   A 251 ? 0.2052 0.2496 0.1974 -0.0234 -0.0206 0.0113  941  ILE   A CG1 
3882 C  CG2 . ILE   A 251 ? 0.2074 0.2492 0.1892 -0.0352 -0.0206 0.0187  941  ILE   A CG2 
3883 C  CD1 . ILE   A 251 ? 0.2043 0.2469 0.1993 -0.0183 -0.0219 0.0074  941  ILE   A CD1 
3895 N  N   . ASP   A 252 ? 0.1677 0.2225 0.1674 -0.0368 -0.0202 0.0197  942  ASP   A N   
3896 C  CA  . ASP   A 252 ? 0.1735 0.2409 0.1841 -0.0361 -0.018  0.0203  942  ASP   A CA  
3897 C  C   . ASP   A 252 ? 0.1622 0.2271 0.176  -0.034  -0.0187 0.019   942  ASP   A C   
3898 O  O   . ASP   A 252 ? 0.1555 0.2261 0.1768 -0.0301 -0.0166 0.0175  942  ASP   A O   
3899 C  CB  . ASP   A 252 ? 0.2115 0.2888 0.2238 -0.042  -0.0174 0.0241  942  ASP   A CB  
3900 C  CG  . ASP   A 252 ? 0.332  0.4144 0.3425 -0.0437 -0.0155 0.0256  942  ASP   A CG  
3901 O  OD1 . ASP   A 252 ? 0.3586 0.4378 0.3678 -0.039  -0.0144 0.0232  942  ASP   A OD1 
3902 O  OD2 . ASP   A 252 ? 0.3772 0.4666 0.3872 -0.0498 -0.0151 0.0289  942  ASP   A OD2 
3907 N  N   . VAL   A 253 ? 0.1568 0.2115 0.1634 -0.0359 -0.0214 0.0195  943  VAL   A N   
3908 C  CA  . VAL   A 253 ? 0.1675 0.2187 0.1757 -0.0335 -0.0219 0.0185  943  VAL   A CA  
3909 C  C   . VAL   A 253 ? 0.1581 0.2077 0.1697 -0.0275 -0.0204 0.0148  943  VAL   A C   
3910 O  O   . VAL   A 253 ? 0.1555 0.2086 0.1735 -0.0249 -0.0184 0.0135  943  VAL   A O   
3911 C  CB  . VAL   A 253 ? 0.1987 0.238  0.1964 -0.0365 -0.0254 0.02    943  VAL   A CB  
3912 C  CG1 . VAL   A 253 ? 0.2071 0.2423 0.206  -0.0328 -0.0254 0.0187  943  VAL   A CG1 
3913 C  CG2 . VAL   A 253 ? 0.2294 0.2714 0.2244 -0.044  -0.0272 0.0236  943  VAL   A CG2 
3923 N  N   . TYR   A 254 ? 0.1527 0.197  0.1594 -0.0254 -0.0213 0.013   944  TYR   A N   
3924 C  CA  . TYR   A 254 ? 0.1531 0.1983 0.164  -0.0203 -0.0202 0.0093  944  TYR   A CA  
3925 C  C   . TYR   A 254 ? 0.1481 0.2022 0.1681 -0.019  -0.0173 0.0077  944  TYR   A C   
3926 O  O   . TYR   A 254 ? 0.1498 0.2058 0.1752 -0.0167 -0.0157 0.0053  944  TYR   A O   
3927 C  CB  . TYR   A 254 ? 0.158  0.1973 0.1617 -0.0177 -0.0222 0.0076  944  TYR   A CB  
3928 C  CG  . TYR   A 254 ? 0.1659 0.2082 0.1743 -0.0127 -0.0216 0.0036  944  TYR   A CG  
3929 C  CD1 . TYR   A 254 ? 0.1744 0.2165 0.1854 -0.0106 -0.0209 0.0025  944  TYR   A CD1 
3930 C  CD2 . TYR   A 254 ? 0.1791 0.2255 0.1899 -0.0105 -0.0216 0.0009  944  TYR   A CD2 
3931 C  CE1 . TYR   A 254 ? 0.1696 0.2168 0.1858 -0.0069 -0.0201 -0.001  944  TYR   A CE1 
3932 C  CE2 . TYR   A 254 ? 0.1767 0.2275 0.1923 -0.0067 -0.0216 -0.0029 944  TYR   A CE2 
3933 C  CZ  . TYR   A 254 ? 0.1786 0.2308 0.1975 -0.0053 -0.0206 -0.0038 944  TYR   A CZ  
3934 O  OH  . TYR   A 254 ? 0.1808 0.2399 0.2057 -0.0025 -0.0203 -0.0075 944  TYR   A OH  
3944 N  N   . MET   A 255 ? 0.1428 0.2017 0.1636 -0.0207 -0.0166 0.0092  945  MET   A N   
3945 C  CA  . MET   A 255 ? 0.1487 0.2143 0.1758 -0.0187 -0.014  0.0078  945  MET   A CA  
3946 C  C   . MET   A 255 ? 0.1342 0.2027 0.1662 -0.0181 -0.012  0.0082  945  MET   A C   
3947 O  O   . MET   A 255 ? 0.1268 0.1963 0.1623 -0.0157 -0.0101 0.006   945  MET   A O   
3948 C  CB  . MET   A 255 ? 0.1586 0.2288 0.1842 -0.0197 -0.0134 0.0096  945  MET   A CB  
3949 C  CG  . MET   A 255 ? 0.207  0.2734 0.2274 -0.0188 -0.0147 0.0082  945  MET   A CG  
3950 S  SD  . MET   A 255 ? 0.2757 0.3399 0.2981 -0.0143 -0.0154 0.0031  945  MET   A SD  
3951 C  CE  . MET   A 255 ? 0.223  0.2925 0.2521 -0.0127 -0.0124 0.0018  945  MET   A CE  
3961 N  N   . ILE   A 256 ? 0.1329 0.2014 0.1641 -0.0202 -0.0127 0.0108  946  ILE   A N   
3962 C  CA  . ILE   A 256 ? 0.1365 0.2063 0.1708 -0.0188 -0.0111 0.0111  946  ILE   A CA  
3963 C  C   . ILE   A 256 ? 0.1392 0.2031 0.1744 -0.0169 -0.0101 0.0083  946  ILE   A C   
3964 O  O   . ILE   A 256 ? 0.138  0.2018 0.1756 -0.015  -0.0077 0.0068  946  ILE   A O   
3965 C  CB  . ILE   A 256 ? 0.1501 0.2205 0.1826 -0.0215 -0.0129 0.0141  946  ILE   A CB  
3966 C  CG1 . ILE   A 256 ? 0.1662 0.2461 0.1997 -0.0241 -0.0134 0.017   946  ILE   A CG1 
3967 C  CG2 . ILE   A 256 ? 0.1645 0.2334 0.1986 -0.0189 -0.0115 0.0138  946  ILE   A CG2 
3968 C  CD1 . ILE   A 256 ? 0.1846 0.2663 0.2163 -0.0282 -0.0159 0.0199  946  ILE   A CD1 
3980 N  N   . MET   A 257 ? 0.1409 0.1997 0.1732 -0.0174 -0.0118 0.0077  947  MET   A N   
3981 C  CA  . MET   A 257 ? 0.1492 0.205  0.1832 -0.0156 -0.0105 0.0051  947  MET   A CA  
3982 C  C   . MET   A 257 ? 0.1392 0.1982 0.1774 -0.0147 -0.0088 0.0019  947  MET   A C   
3983 O  O   . MET   A 257 ? 0.1366 0.195  0.1777 -0.0144 -0.0063 0.0002  947  MET   A O   
3984 C  CB  . MET   A 257 ? 0.1715 0.2227 0.2009 -0.0149 -0.0127 0.0048  947  MET   A CB  
3985 C  CG  . MET   A 257 ? 0.2338 0.2789 0.2576 -0.0156 -0.0142 0.0073  947  MET   A CG  
3986 S  SD  . MET   A 257 ? 0.2996 0.3366 0.3138 -0.0138 -0.0175 0.0072  947  MET   A SD  
3987 C  CE  . MET   A 257 ? 0.3008 0.3332 0.3073 -0.0181 -0.0208 0.0106  947  MET   A CE  
3997 N  N   . ARG   A 258 ? 0.1198 0.1812 0.1575 -0.0145 -0.0103 0.0011  948  ARG   A N   
3998 C  CA  . ARG   A 258 ? 0.113  0.1769 0.1539 -0.0138 -0.0094 -0.0022 948  ARG   A CA  
3999 C  C   . ARG   A 258 ? 0.1255 0.1896 0.1678 -0.0137 -0.0068 -0.0024 948  ARG   A C   
4000 O  O   . ARG   A 258 ? 0.1345 0.1976 0.1788 -0.0142 -0.0053 -0.0051 948  ARG   A O   
4001 C  CB  . ARG   A 258 ? 0.1132 0.1784 0.1516 -0.0129 -0.0117 -0.003  948  ARG   A CB  
4002 C  CG  . ARG   A 258 ? 0.1423 0.2056 0.1773 -0.0116 -0.0144 -0.0036 948  ARG   A CG  
4003 C  CD  . ARG   A 258 ? 0.1526 0.2185 0.1915 -0.0102 -0.0143 -0.0069 948  ARG   A CD  
4004 N  NE  . ARG   A 258 ? 0.1693 0.2399 0.2123 -0.01   -0.0144 -0.0104 948  ARG   A NE  
4005 C  CZ  . ARG   A 258 ? 0.1919 0.2658 0.2348 -0.0077 -0.0168 -0.0133 948  ARG   A CZ  
4006 N  NH1 . ARG   A 258 ? 0.2139 0.292  0.2605 -0.0082 -0.0172 -0.0165 948  ARG   A NH1 
4007 N  NH2 . ARG   A 258 ? 0.1758 0.2482 0.2137 -0.0044 -0.0192 -0.0131 948  ARG   A NH2 
4021 N  N   . LYS   A 259 ? 0.1171 0.1821 0.1577 -0.0132 -0.0063 0.0004  949  LYS   A N   
4022 C  CA  . LYS   A 259 ? 0.1233 0.1875 0.1632 -0.0116 -0.0039 0.0004  949  LYS   A CA  
4023 C  C   . LYS   A 259 ? 0.1301 0.1893 0.1699 -0.0117 -0.0017 -0.0002 949  LYS   A C   
4024 O  O   . LYS   A 259 ? 0.1391 0.1939 0.177  -0.011  0.0004  -0.0018 949  LYS   A O   
4025 C  CB  . LYS   A 259 ? 0.137  0.2062 0.1756 -0.0101 -0.0039 0.0036  949  LYS   A CB  
4026 C  CG  . LYS   A 259 ? 0.1696 0.2431 0.2073 -0.0097 -0.0048 0.004   949  LYS   A CG  
4027 C  CD  . LYS   A 259 ? 0.2637 0.3448 0.3011 -0.009  -0.0045 0.0075  949  LYS   A CD  
4028 C  CE  . LYS   A 259 ? 0.3492 0.4343 0.3851 -0.0091 -0.0048 0.0082  949  LYS   A CE  
4029 N  NZ  . LYS   A 259 ? 0.4167 0.5117 0.4532 -0.0094 -0.0041 0.0119  949  LYS   A NZ  
4043 N  N   . CYS   A 260 ? 0.1124 0.1705 0.1525 -0.0126 -0.0022 0.0012  950  CYS   A N   
4044 C  CA  . CYS   A 260 ? 0.1225 0.175  0.1618 -0.0127 0.0001  0.0008  950  CYS   A CA  
4045 C  C   . CYS   A 260 ? 0.1248 0.1751 0.166  -0.0147 0.0018  -0.0025 950  CYS   A C   
4046 O  O   . CYS   A 260 ? 0.1384 0.1832 0.178  -0.0155 0.0046  -0.0032 950  CYS   A O   
4047 C  CB  . CYS   A 260 ? 0.1346 0.186  0.173  -0.0129 -0.0012 0.0029  950  CYS   A CB  
4048 S  SG  . CYS   A 260 ? 0.172  0.2259 0.208  -0.0118 -0.003  0.0066  950  CYS   A SG  
4054 N  N   . TRP   A 261 ? 0.1206 0.1756 0.1651 -0.0158 0       -0.0044 951  TRP   A N   
4055 C  CA  . TRP   A 261 ? 0.1325 0.1889 0.1805 -0.0182 0.001   -0.0076 951  TRP   A CA  
4056 C  C   . TRP   A 261 ? 0.1388 0.1956 0.187  -0.0194 0.0008  -0.0103 951  TRP   A C   
4057 O  O   . TRP   A 261 ? 0.1356 0.1966 0.1876 -0.0215 0.0001  -0.0133 951  TRP   A O   
4058 C  CB  . TRP   A 261 ? 0.1286 0.1905 0.1797 -0.0177 -0.0009 -0.0084 951  TRP   A CB  
4059 C  CG  . TRP   A 261 ? 0.1259 0.1854 0.1747 -0.0161 -0.0011 -0.0058 951  TRP   A CG  
4060 C  CD1 . TRP   A 261 ? 0.1309 0.1852 0.1775 -0.0161 0.0012  -0.0041 951  TRP   A CD1 
4061 C  CD2 . TRP   A 261 ? 0.1229 0.1833 0.1694 -0.0139 -0.0042 -0.0047 951  TRP   A CD2 
4062 N  NE1 . TRP   A 261 ? 0.1337 0.1862 0.1773 -0.0142 -0.0004 -0.002  951  TRP   A NE1 
4063 C  CE2 . TRP   A 261 ? 0.1296 0.1851 0.1726 -0.013  -0.0037 -0.0023 951  TRP   A CE2 
4064 C  CE3 . TRP   A 261 ? 0.1303 0.1934 0.1756 -0.0124 -0.0074 -0.0055 951  TRP   A CE3 
4065 C  CZ2 . TRP   A 261 ? 0.1462 0.199  0.1842 -0.011  -0.0063 -0.0009 951  TRP   A CZ2 
4066 C  CZ3 . TRP   A 261 ? 0.1467 0.2068 0.1866 -0.0102 -0.0098 -0.004  951  TRP   A CZ3 
4067 C  CH2 . TRP   A 261 ? 0.1499 0.2043 0.1858 -0.0097 -0.0094 -0.0016 951  TRP   A CH2 
4078 N  N   . MET   A 262 ? 0.1446 0.1973 0.1883 -0.0178 0.0012  -0.0095 952  MET   A N   
4079 C  CA  . MET   A 262 ? 0.1634 0.2138 0.2049 -0.0185 0.001   -0.012  952  MET   A CA  
4080 C  C   . MET   A 262 ? 0.1823 0.2264 0.2222 -0.0225 0.0036  -0.0143 952  MET   A C   
4081 O  O   . MET   A 262 ? 0.1807 0.2194 0.2183 -0.0232 0.0063  -0.0132 952  MET   A O   
4082 C  CB  . MET   A 262 ? 0.1729 0.2201 0.2085 -0.0146 0.0012  -0.0101 952  MET   A CB  
4083 C  CG  . MET   A 262 ? 0.1873 0.2413 0.2244 -0.0122 -0.0012 -0.0084 952  MET   A CG  
4084 S  SD  . MET   A 262 ? 0.2126 0.2669 0.2443 -0.0073 -0.0002 -0.0054 952  MET   A SD  
4085 C  CE  . MET   A 262 ? 0.2337 0.2836 0.2605 -0.006  -0.0007 -0.0085 952  MET   A CE  
4095 N  N   . ILE   A 263 ? 0.1978 0.242  0.2381 -0.0254 0.0025  -0.0177 953  ILE   A N   
4096 C  CA  . ILE   A 263 ? 0.2167 0.2544 0.2545 -0.0309 0.0047  -0.0202 953  ILE   A CA  
4097 C  C   . ILE   A 263 ? 0.2207 0.2442 0.2474 -0.0293 0.0073  -0.019  953  ILE   A C   
4098 O  O   . ILE   A 263 ? 0.2287 0.2444 0.2516 -0.0325 0.0104  -0.019  953  ILE   A O   
4099 C  CB  . ILE   A 263 ? 0.2325 0.2729 0.2719 -0.0345 0.0021  -0.0242 953  ILE   A CB  
4100 C  CG1 . ILE   A 263 ? 0.244  0.2991 0.294  -0.0357 -0.0005 -0.026  953  ILE   A CG1 
4101 C  CG2 . ILE   A 263 ? 0.247  0.2779 0.281  -0.0411 0.0041  -0.0267 953  ILE   A CG2 
4102 C  CD1 . ILE   A 263 ? 0.2517 0.3141 0.309  -0.0395 0.0016  -0.0264 953  ILE   A CD1 
4114 N  N   . ASP   A 264 ? 0.2193 0.2393 0.2399 -0.0239 0.0062  -0.0178 954  ASP   A N   
4115 C  CA  . ASP   A 264 ? 0.2341 0.2409 0.2428 -0.0206 0.0084  -0.0167 954  ASP   A CA  
4116 C  C   . ASP   A 264 ? 0.2212 0.2285 0.2294 -0.0164 0.0101  -0.0133 954  ASP   A C   
4117 O  O   . ASP   A 264 ? 0.2147 0.2304 0.2264 -0.0118 0.0087  -0.0108 954  ASP   A O   
4118 C  CB  . ASP   A 264 ? 0.2653 0.2697 0.2676 -0.0154 0.0067  -0.0168 954  ASP   A CB  
4119 C  CG  . ASP   A 264 ? 0.3546 0.3447 0.3427 -0.0107 0.0089  -0.0161 954  ASP   A CG  
4120 O  OD1 . ASP   A 264 ? 0.3792 0.3557 0.3589 -0.0144 0.0107  -0.0178 954  ASP   A OD1 
4121 O  OD2 . ASP   A 264 ? 0.3906 0.3831 0.3754 -0.0033 0.0088  -0.0138 954  ASP   A OD2 
4126 N  N   . ALA   A 265 ? 0.2193 0.2177 0.2229 -0.0183 0.0131  -0.013  955  ALA   A N   
4127 C  CA  . ALA   A 265 ? 0.2271 0.2252 0.2297 -0.0143 0.0144  -0.01   955  ALA   A CA  
4128 C  C   . ALA   A 265 ? 0.2331 0.2315 0.2301 -0.006  0.0136  -0.0076 955  ALA   A C   
4129 O  O   . ALA   A 265 ? 0.2215 0.2289 0.2235 -0.0029 0.0125  -0.0051 955  ALA   A O   
4130 C  CB  . ALA   A 265 ? 0.2409 0.2256 0.2356 -0.017  0.0181  -0.0103 955  ALA   A CB  
4136 N  N   . ASP   A 266 ? 0.2459 0.2351 0.2324 -0.0025 0.0141  -0.0085 956  ASP   A N   
4137 C  CA  . ASP   A 266 ? 0.2617 0.2524 0.2423 0.0064  0.0138  -0.0065 956  ASP   A CA  
4138 C  C   . ASP   A 266 ? 0.2476 0.2548 0.2374 0.0087  0.0113  -0.0049 956  ASP   A C   
4139 O  O   . ASP   A 266 ? 0.2635 0.2773 0.2522 0.0151  0.011   -0.0026 956  ASP   A O   
4140 C  CB  . ASP   A 266 ? 0.3183 0.2932 0.283  0.0105  0.015   -0.008  956  ASP   A CB  
4141 C  CG  . ASP   A 266 ? 0.4453 0.4009 0.3967 0.0095  0.0178  -0.009  956  ASP   A CG  
4142 O  OD1 . ASP   A 266 ? 0.4537 0.4091 0.4067 0.0093  0.0191  -0.0076 956  ASP   A OD1 
4143 O  OD2 . ASP   A 266 ? 0.5247 0.4639 0.4628 0.0088  0.0187  -0.0111 956  ASP   A OD2 
4148 N  N   . SER   A 267 ? 0.2168 0.2308 0.2149 0.0035  0.0095  -0.0062 957  SER   A N   
4149 C  CA  . SER   A 267 ? 0.2048 0.2324 0.2103 0.0047  0.0073  -0.0048 957  SER   A CA  
4150 C  C   . SER   A 267 ? 0.1882 0.2267 0.2034 0.0024  0.0061  -0.0025 957  SER   A C   
4151 O  O   . SER   A 267 ? 0.184  0.2329 0.2038 0.0031  0.0046  -0.0006 957  SER   A O   
4152 C  CB  . SER   A 267 ? 0.217  0.2451 0.2251 0.0009  0.0057  -0.0074 957  SER   A CB  
4153 O  OG  . SER   A 267 ? 0.2704 0.2887 0.2687 0.0033  0.0061  -0.0094 957  SER   A OG  
4159 N  N   . ARG   A 268 ? 0.1828 0.218  0.2    -0.0009 0.0068  -0.0026 958  ARG   A N   
4160 C  CA  . ARG   A 268 ? 0.171  0.2136 0.1949 -0.0027 0.0054  -0.0005 958  ARG   A CA  
4161 C  C   . ARG   A 268 ? 0.1758 0.2244 0.1988 0.0017  0.0049  0.0026  958  ARG   A C   
4162 O  O   . ARG   A 268 ? 0.1734 0.218  0.1898 0.0067  0.0064  0.0029  958  ARG   A O   
4163 C  CB  . ARG   A 268 ? 0.1653 0.2015 0.1894 -0.0057 0.0068  -0.0012 958  ARG   A CB  
4164 C  CG  . ARG   A 268 ? 0.1702 0.2046 0.1975 -0.0107 0.0071  -0.0042 958  ARG   A CG  
4165 C  CD  . ARG   A 268 ? 0.1813 0.2098 0.2081 -0.0136 0.0095  -0.0048 958  ARG   A CD  
4166 N  NE  . ARG   A 268 ? 0.1684 0.1959 0.1974 -0.0185 0.0104  -0.008  958  ARG   A NE  
4167 C  CZ  . ARG   A 268 ? 0.1962 0.2167 0.2227 -0.0223 0.0134  -0.0094 958  ARG   A CZ  
4168 N  NH1 . ARG   A 268 ? 0.1732 0.1951 0.2025 -0.0275 0.0138  -0.0124 958  ARG   A NH1 
4169 N  NH2 . ARG   A 268 ? 0.1899 0.202  0.2107 -0.0212 0.0161  -0.0079 958  ARG   A NH2 
4183 N  N   . PRO   A 269 ? 0.1713 0.2285 0.1996 0       0.0028  0.005   959  PRO   A N   
4184 C  CA  . PRO   A 269 ? 0.1651 0.2295 0.1933 0.0032  0.0021  0.0078  959  PRO   A CA  
4185 C  C   . PRO   A 269 ? 0.1716 0.2288 0.1946 0.0065  0.0034  0.0079  959  PRO   A C   
4186 O  O   . PRO   A 269 ? 0.179  0.2258 0.1995 0.0047  0.0048  0.0063  959  PRO   A O   
4187 C  CB  . PRO   A 269 ? 0.1725 0.2437 0.2059 -0.0013 -0.0007 0.0098  959  PRO   A CB  
4188 C  CG  . PRO   A 269 ? 0.1768 0.2464 0.2125 -0.0052 -0.0015 0.0082  959  PRO   A CG  
4189 C  CD  . PRO   A 269 ? 0.1662 0.2264 0.1996 -0.0048 0.0007  0.0051  959  PRO   A CD  
4197 N  N   . LYS   A 270 ? 0.1658 0.2292 0.187  0.0115  0.003   0.0097  960  LYS   A N   
4198 C  CA  . LYS   A 270 ? 0.1806 0.2382 0.1962 0.0155  0.0036  0.0101  960  LYS   A CA  
4199 C  C   . LYS   A 270 ? 0.1724 0.237  0.1928 0.0127  0.0007  0.0122  960  LYS   A C   
4200 O  O   . LYS   A 270 ? 0.1627 0.2391 0.1896 0.0092  -0.0017 0.0139  960  LYS   A O   
4201 C  CB  . LYS   A 270 ? 0.2134 0.2742 0.2231 0.0241  0.0045  0.0106  960  LYS   A CB  
4202 C  CG  . LYS   A 270 ? 0.2926 0.3457 0.2954 0.0275  0.0069  0.0087  960  LYS   A CG  
4203 C  CD  . LYS   A 270 ? 0.3828 0.4159 0.3768 0.0261  0.0094  0.0061  960  LYS   A CD  
4204 C  CE  . LYS   A 270 ? 0.462  0.4856 0.4478 0.0283  0.0112  0.004   960  LYS   A CE  
4205 N  NZ  . LYS   A 270 ? 0.4907 0.5181 0.4834 0.0222  0.0105  0.0028  960  LYS   A NZ  
4219 N  N   . PHE   A 271 ? 0.1725 0.2292 0.1887 0.0141  0.0007  0.0123  961  PHE   A N   
4220 C  CA  . PHE   A 271 ? 0.1771 0.239  0.1963 0.0116  -0.0026 0.0142  961  PHE   A CA  
4221 C  C   . PHE   A 271 ? 0.191  0.2697 0.2143 0.0133  -0.0054 0.0164  961  PHE   A C   
4222 O  O   . PHE   A 271 ? 0.1824 0.2697 0.2109 0.008   -0.0086 0.0181  961  PHE   A O   
4223 C  CB  . PHE   A 271 ? 0.1809 0.2308 0.1935 0.0138  -0.002  0.0139  961  PHE   A CB  
4224 C  CG  . PHE   A 271 ? 0.1835 0.2207 0.1945 0.0099  0.0004  0.0123  961  PHE   A CG  
4225 C  CD1 . PHE   A 271 ? 0.1821 0.2207 0.1977 0.0043  -0.0012 0.0127  961  PHE   A CD1 
4226 C  CD2 . PHE   A 271 ? 0.1913 0.215  0.195  0.0121  0.0043  0.0106  961  PHE   A CD2 
4227 C  CE1 . PHE   A 271 ? 0.1904 0.2199 0.2052 0.0017  0.0011  0.0112  961  PHE   A CE1 
4228 C  CE2 . PHE   A 271 ? 0.197  0.2118 0.2004 0.008   0.0068  0.0094  961  PHE   A CE2 
4229 C  CZ  . PHE   A 271 ? 0.1913 0.2103 0.2009 0.0032  0.0052  0.0096  961  PHE   A CZ  
4239 N  N   A ARG   A 272 ? 0.1962 0.2799 0.2166 0.0206  -0.0042 0.0164  962  ARG   A N   
4240 N  N   B ARG   A 272 ? 0.1995 0.2832 0.2199 0.0206  -0.0042 0.0164  962  ARG   A N   
4241 C  CA  A ARG   A 272 ? 0.2069 0.31   0.2324 0.0227  -0.0064 0.0184  962  ARG   A CA  
4242 C  CA  B ARG   A 272 ? 0.2131 0.3162 0.2386 0.0227  -0.0065 0.0184  962  ARG   A CA  
4243 C  C   A ARG   A 272 ? 0.2016 0.3173 0.2351 0.0165  -0.0072 0.0198  962  ARG   A C   
4244 C  C   B ARG   A 272 ? 0.2036 0.3192 0.2372 0.0163  -0.0072 0.0198  962  ARG   A C   
4245 O  O   A ARG   A 272 ? 0.2051 0.336  0.2447 0.0128  -0.0099 0.022   962  ARG   A O   
4246 O  O   B ARG   A 272 ? 0.2072 0.3376 0.2468 0.0125  -0.01   0.022   962  ARG   A O   
4247 C  CB  A ARG   A 272 ? 0.222  0.328  0.2415 0.0334  -0.0046 0.018   962  ARG   A CB  
4248 C  CB  B ARG   A 272 ? 0.238  0.3442 0.2577 0.0333  -0.0046 0.018   962  ARG   A CB  
4249 C  CG  A ARG   A 272 ? 0.2602 0.3599 0.2751 0.0371  -0.001  0.0164  962  ARG   A CG  
4250 C  CG  B ARG   A 272 ? 0.297  0.3957 0.3118 0.0368  -0.001  0.0164  962  ARG   A CG  
4251 C  CD  A ARG   A 272 ? 0.3063 0.4037 0.3113 0.0489  0.0006  0.0158  962  ARG   A CD  
4252 C  CD  B ARG   A 272 ? 0.3627 0.4628 0.3693 0.0483  0.0005  0.016   962  ARG   A CD  
4253 N  NE  A ARG   A 272 ? 0.3422 0.42   0.3358 0.0526  0.0017  0.0142  962  ARG   A NE  
4254 N  NE  B ARG   A 272 ? 0.4134 0.5102 0.4162 0.0511  0.0033  0.015   962  ARG   A NE  
4255 C  CZ  A ARG   A 272 ? 0.3722 0.4291 0.3567 0.0519  0.0047  0.0121  962  ARG   A CZ  
4256 C  CZ  B ARG   A 272 ? 0.4567 0.5337 0.4499 0.0519  0.0058  0.0126  962  ARG   A CZ  
4257 N  NH1 A ARG   A 272 ? 0.3721 0.4248 0.3577 0.0479  0.0065  0.0109  962  ARG   A NH1 
4258 N  NH1 B ARG   A 272 ? 0.4671 0.5261 0.4537 0.05    0.0067  0.0111  962  ARG   A NH1 
4259 N  NH2 A ARG   A 272 ? 0.3728 0.4127 0.3467 0.0547  0.0059  0.0111  962  ARG   A NH2 
4260 N  NH2 B ARG   A 272 ? 0.4574 0.5325 0.4471 0.0543  0.0076  0.0118  962  ARG   A NH2 
4287 N  N   . GLU   A 273 ? 0.1921 0.3011 0.2252 0.0146  -0.0049 0.0184  963  GLU   A N   
4288 C  CA  . GLU   A 273 ? 0.1816 0.2996 0.2204 0.0093  -0.0052 0.0195  963  GLU   A CA  
4289 C  C   . GLU   A 273 ? 0.189  0.3043 0.2306 0.0004  -0.0079 0.0203  963  GLU   A C   
4290 O  O   . GLU   A 273 ? 0.1954 0.3206 0.241  -0.005  -0.0095 0.0223  963  GLU   A O   
4291 C  CB  . GLU   A 273 ? 0.2052 0.3149 0.2412 0.0109  -0.0024 0.0174  963  GLU   A CB  
4292 C  CG  . GLU   A 273 ? 0.2361 0.3471 0.2672 0.0197  0.0002  0.0167  963  GLU   A CG  
4293 C  CD  . GLU   A 273 ? 0.2932 0.3912 0.3188 0.0212  0.0026  0.014   963  GLU   A CD  
4294 O  OE1 . GLU   A 273 ? 0.2286 0.3163 0.2546 0.0159  0.0025  0.0123  963  GLU   A OE1 
4295 O  OE2 . GLU   A 273 ? 0.3548 0.4531 0.3751 0.028   0.0045  0.0135  963  GLU   A OE2 
4303 N  N   . LEU   A 274 ? 0.1802 0.2813 0.2185 -0.0009 -0.0081 0.0189  964  LEU   A N   
4304 C  CA  . LEU   A 274 ? 0.171  0.2668 0.2094 -0.0077 -0.0106 0.0194  964  LEU   A CA  
4305 C  C   . LEU   A 274 ? 0.167  0.2701 0.2064 -0.011  -0.0144 0.0218  964  LEU   A C   
4306 O  O   . LEU   A 274 ? 0.1681 0.2722 0.2077 -0.0176 -0.017  0.0233  964  LEU   A O   
4307 C  CB  . LEU   A 274 ? 0.1638 0.2441 0.1981 -0.0068 -0.0094 0.0173  964  LEU   A CB  
4308 C  CG  . LEU   A 274 ? 0.1679 0.2414 0.2019 -0.006  -0.0065 0.0147  964  LEU   A CG  
4309 C  CD1 . LEU   A 274 ? 0.1666 0.2276 0.1971 -0.0049 -0.0045 0.0128  964  LEU   A CD1 
4310 C  CD2 . LEU   A 274 ? 0.1771 0.2522 0.2133 -0.0106 -0.0077 0.0146  964  LEU   A CD2 
4322 N  N   . ILE   A 275 ? 0.1682 0.2759 0.207  -0.0064 -0.0149 0.0223  965  ILE   A N   
4323 C  CA  . ILE   A 275 ? 0.1704 0.2873 0.2108 -0.0095 -0.019  0.0244  965  ILE   A CA  
4324 C  C   . ILE   A 275 ? 0.165  0.2989 0.2113 -0.0149 -0.0202 0.0266  965  ILE   A C   
4325 O  O   . ILE   A 275 ? 0.1715 0.307  0.2179 -0.0229 -0.0235 0.0283  965  ILE   A O   
4326 C  CB  . ILE   A 275 ? 0.1793 0.3012 0.2184 -0.002  -0.0194 0.0242  965  ILE   A CB  
4327 C  CG1 . ILE   A 275 ? 0.1853 0.2893 0.217  0.0023  -0.0184 0.0225  965  ILE   A CG1 
4328 C  CG2 . ILE   A 275 ? 0.1919 0.3294 0.2349 -0.0056 -0.024  0.0264  965  ILE   A CG2 
4329 C  CD1 . ILE   A 275 ? 0.207  0.3129 0.2347 0.0122  -0.0176 0.0218  965  ILE   A CD1 
4341 N  N   . ILE   A 276 ? 0.159  0.3036 0.2089 -0.0107 -0.0173 0.0266  966  ILE   A N   
4342 C  CA  . ILE   A 276 ? 0.1637 0.3261 0.2194 -0.015  -0.0174 0.0289  966  ILE   A CA  
4343 C  C   . ILE   A 276 ? 0.1537 0.3097 0.2081 -0.0233 -0.0176 0.0296  966  ILE   A C   
4344 O  O   . ILE   A 276 ? 0.1497 0.3135 0.2058 -0.0316 -0.02   0.0319  966  ILE   A O   
4345 C  CB  . ILE   A 276 ? 0.1807 0.3546 0.2387 -0.0065 -0.0137 0.0287  966  ILE   A CB  
4346 C  CG1 . ILE   A 276 ? 0.2032 0.3871 0.2617 0.0016  -0.0144 0.0287  966  ILE   A CG1 
4347 C  CG2 . ILE   A 276 ? 0.1913 0.3814 0.2545 -0.011  -0.0126 0.031   966  ILE   A CG2 
4348 C  CD1 . ILE   A 276 ? 0.2205 0.4093 0.2772 0.0125  -0.0109 0.0277  966  ILE   A CD1 
4360 N  N   . GLU   A 277 ? 0.1404 0.2818 0.1911 -0.0214 -0.0154 0.0274  967  GLU   A N   
4361 C  CA  . GLU   A 277 ? 0.1405 0.2756 0.1889 -0.0276 -0.0158 0.0277  967  GLU   A CA  
4362 C  C   . GLU   A 277 ? 0.142  0.2674 0.1857 -0.0348 -0.0196 0.0286  967  GLU   A C   
4363 O  O   . GLU   A 277 ? 0.1542 0.2808 0.1958 -0.0422 -0.0212 0.0305  967  GLU   A O   
4364 C  CB  . GLU   A 277 ? 0.1808 0.304  0.2267 -0.0235 -0.0131 0.0249  967  GLU   A CB  
4365 C  CG  . GLU   A 277 ? 0.2562 0.3758 0.2996 -0.0283 -0.0133 0.0252  967  GLU   A CG  
4366 C  CD  . GLU   A 277 ? 0.3357 0.4479 0.3777 -0.0243 -0.011  0.0225  967  GLU   A CD  
4367 O  OE1 . GLU   A 277 ? 0.3307 0.4386 0.3732 -0.0187 -0.0092 0.0202  967  GLU   A OE1 
4368 O  OE2 . GLU   A 277 ? 0.3536 0.4633 0.3929 -0.0272 -0.0111 0.0227  967  GLU   A OE2 
4375 N  N   . PHE   A 278 ? 0.1406 0.2546 0.1809 -0.0327 -0.021  0.0273  968  PHE   A N   
4376 C  CA  . PHE   A 278 ? 0.157  0.2605 0.1909 -0.0386 -0.0248 0.0281  968  PHE   A CA  
4377 C  C   . PHE   A 278 ? 0.1743 0.288  0.2091 -0.045  -0.0285 0.0308  968  PHE   A C   
4378 O  O   . PHE   A 278 ? 0.1919 0.2989 0.2206 -0.0526 -0.0317 0.0323  968  PHE   A O   
4379 C  CB  . PHE   A 278 ? 0.1597 0.2485 0.1889 -0.0345 -0.0251 0.0262  968  PHE   A CB  
4380 C  CG  . PHE   A 278 ? 0.1632 0.24   0.1895 -0.032  -0.023  0.0239  968  PHE   A CG  
4381 C  CD1 . PHE   A 278 ? 0.1761 0.2437 0.196  -0.036  -0.0248 0.0242  968  PHE   A CD1 
4382 C  CD2 . PHE   A 278 ? 0.1735 0.2482 0.2025 -0.0258 -0.0193 0.0215  968  PHE   A CD2 
4383 C  CE1 . PHE   A 278 ? 0.184  0.2429 0.2017 -0.0329 -0.0231 0.0219  968  PHE   A CE1 
4384 C  CE2 . PHE   A 278 ? 0.1825 0.2483 0.2098 -0.0241 -0.0177 0.0193  968  PHE   A CE2 
4385 C  CZ  . PHE   A 278 ? 0.1783 0.2378 0.2008 -0.0273 -0.0197 0.0194  968  PHE   A CZ  
4395 N  N   . SER   A 279 ? 0.164  0.2936 0.2055 -0.0421 -0.0282 0.0315  969  SER   A N   
4396 C  CA  . SER   A 279 ? 0.1745 0.3176 0.2186 -0.0486 -0.0319 0.034   969  SER   A CA  
4397 C  C   . SER   A 279 ? 0.1876 0.3402 0.2333 -0.0572 -0.0317 0.0363  969  SER   A C   
4398 O  O   . SER   A 279 ? 0.2019 0.3542 0.2441 -0.067  -0.0354 0.0383  969  SER   A O   
4399 C  CB  . SER   A 279 ? 0.1727 0.3331 0.224  -0.0421 -0.0315 0.034   969  SER   A CB  
4400 O  OG  . SER   A 279 ? 0.1897 0.3397 0.2372 -0.0358 -0.0325 0.0322  969  SER   A OG  
4406 N  N   . LYS   A 280 ? 0.1869 0.3457 0.2363 -0.0541 -0.0275 0.0362  970  LYS   A N   
4407 C  CA  . LYS   A 280 ? 0.1956 0.3613 0.2452 -0.0616 -0.0265 0.0384  970  LYS   A CA  
4408 C  C   . LYS   A 280 ? 0.2157 0.3618 0.2544 -0.0692 -0.0287 0.0387  970  LYS   A C   
4409 O  O   . LYS   A 280 ? 0.227  0.3753 0.2623 -0.0796 -0.0308 0.0412  970  LYS   A O   
4410 C  CB  . LYS   A 280 ? 0.2074 0.379  0.2609 -0.0549 -0.0214 0.0376  970  LYS   A CB  
4411 C  CG  . LYS   A 280 ? 0.2535 0.4291 0.3054 -0.0618 -0.0197 0.0397  970  LYS   A CG  
4412 C  CD  . LYS   A 280 ? 0.3439 0.5183 0.3963 -0.0547 -0.0154 0.0383  970  LYS   A CD  
4413 C  CE  . LYS   A 280 ? 0.399  0.5513 0.4438 -0.052  -0.0155 0.0355  970  LYS   A CE  
4414 N  NZ  . LYS   A 280 ? 0.4409 0.5934 0.4864 -0.0454 -0.0117 0.034   970  LYS   A NZ  
4428 N  N   . MET   A 281 ? 0.2119 0.3386 0.2443 -0.0643 -0.0285 0.0362  971  MET   A N   
4429 C  CA  . MET   A 281 ? 0.2184 0.3257 0.239  -0.0692 -0.0308 0.0362  971  MET   A CA  
4430 C  C   . MET   A 281 ? 0.2369 0.3363 0.25   -0.0766 -0.0358 0.0376  971  MET   A C   
4431 O  O   . MET   A 281 ? 0.2547 0.3437 0.2576 -0.0847 -0.0382 0.0392  971  MET   A O   
4432 C  CB  . MET   A 281 ? 0.2165 0.3083 0.2335 -0.0611 -0.0293 0.0329  971  MET   A CB  
4433 C  CG  . MET   A 281 ? 0.2333 0.3298 0.2551 -0.0554 -0.0251 0.0314  971  MET   A CG  
4434 S  SD  . MET   A 281 ? 0.2578 0.3389 0.2766 -0.0473 -0.0237 0.0275  971  MET   A SD  
4435 C  CE  . MET   A 281 ? 0.2356 0.3226 0.2579 -0.044  -0.0201 0.0263  971  MET   A CE  
4445 N  N   . ALA   A 282 ? 0.2262 0.3293 0.2428 -0.0738 -0.0378 0.0371  972  ALA   A N   
4446 C  CA  . ALA   A 282 ? 0.2388 0.3351 0.2484 -0.0803 -0.0431 0.0383  972  ALA   A CA  
4447 C  C   . ALA   A 282 ? 0.2594 0.3698 0.2708 -0.0921 -0.0457 0.0415  972  ALA   A C   
4448 O  O   . ALA   A 282 ? 0.2756 0.3778 0.2786 -0.1001 -0.0506 0.0427  972  ALA   A O   
4449 C  CB  . ALA   A 282 ? 0.2329 0.3322 0.2468 -0.0735 -0.0441 0.037   972  ALA   A CB  
4455 N  N   . ARG   A 283 ? 0.2591 0.3906 0.281  -0.0933 -0.0424 0.0428  973  ARG   A N   
4456 C  CA  . ARG   A 283 ? 0.2738 0.4215 0.2987 -0.105  -0.0439 0.0459  973  ARG   A CA  
4457 C  C   . ARG   A 283 ? 0.3019 0.4359 0.3149 -0.1151 -0.044  0.0477  973  ARG   A C   
4458 O  O   . ARG   A 283 ? 0.3165 0.4569 0.3273 -0.1275 -0.0462 0.0505  973  ARG   A O   
4459 C  CB  . ARG   A 283 ? 0.2688 0.4454 0.309  -0.1012 -0.0398 0.0467  973  ARG   A CB  
4460 C  CG  . ARG   A 283 ? 0.266  0.4586 0.3161 -0.0936 -0.041  0.0456  973  ARG   A CG  
4461 C  CD  . ARG   A 283 ? 0.2313 0.4552 0.2951 -0.0922 -0.0384 0.0472  973  ARG   A CD  
4462 N  NE  . ARG   A 283 ? 0.22   0.4492 0.2879 -0.0841 -0.0322 0.0467  973  ARG   A NE  
4463 C  CZ  . ARG   A 283 ? 0.2222 0.4495 0.2926 -0.0707 -0.0291 0.0442  973  ARG   A CZ  
4464 N  NH1 . ARG   A 283 ? 0.2183 0.4378 0.2874 -0.0633 -0.0311 0.042   973  ARG   A NH1 
4465 N  NH2 . ARG   A 283 ? 0.2191 0.4507 0.2919 -0.0648 -0.0241 0.0439  973  ARG   A NH2 
4479 N  N   . ASP   A 284 ? 0.3084 0.4242 0.3135 -0.11   -0.0416 0.0462  974  ASP   A N   
4480 C  CA  . ASP   A 284 ? 0.3156 0.4145 0.3065 -0.1176 -0.0418 0.0475  974  ASP   A CA  
4481 C  C   . ASP   A 284 ? 0.3198 0.3926 0.2988 -0.1097 -0.0426 0.0448  974  ASP   A C   
4482 O  O   . ASP   A 284 ? 0.3221 0.3894 0.2999 -0.1034 -0.0394 0.0433  974  ASP   A O   
4483 C  CB  . ASP   A 284 ? 0.3351 0.4466 0.3316 -0.1177 -0.0366 0.0487  974  ASP   A CB  
4484 C  CG  . ASP   A 284 ? 0.4053 0.5019 0.387  -0.1268 -0.0365 0.0506  974  ASP   A CG  
4485 O  OD1 . ASP   A 284 ? 0.4309 0.5061 0.3966 -0.1334 -0.0408 0.0512  974  ASP   A OD1 
4486 O  OD2 . ASP   A 284 ? 0.4156 0.5204 0.4002 -0.1268 -0.0322 0.0516  974  ASP   A OD2 
4491 N  N   . PRO   A 285 ? 0.3171 0.3754 0.2882 -0.109  -0.0469 0.0439  975  PRO   A N   
4492 C  CA  . PRO   A 285 ? 0.321  0.3593 0.2838 -0.0994 -0.047  0.0411  975  PRO   A CA  
4493 C  C   . PRO   A 285 ? 0.3297 0.3475 0.2772 -0.0991 -0.0469 0.0406  975  PRO   A C   
4494 O  O   . PRO   A 285 ? 0.3132 0.3251 0.2609 -0.0893 -0.0446 0.038   975  PRO   A O   
4495 C  CB  . PRO   A 285 ? 0.3406 0.3681 0.2961 -0.1008 -0.0519 0.041   975  PRO   A CB  
4496 C  CG  . PRO   A 285 ? 0.3474 0.3817 0.301  -0.1141 -0.0555 0.044   975  PRO   A CG  
4497 C  CD  . PRO   A 285 ? 0.3107 0.3722 0.2811 -0.1158 -0.0517 0.0452  975  PRO   A CD  
4505 N  N   . GLN   A 286 ? 0.3423 0.3495 0.276  -0.1098 -0.0493 0.0431  976  GLN   A N   
4506 C  CA  . GLN   A 286 ? 0.3686 0.3538 0.2843 -0.1095 -0.0496 0.0429  976  GLN   A CA  
4507 C  C   . GLN   A 286 ? 0.3665 0.3598 0.2881 -0.1058 -0.0448 0.0423  976  GLN   A C   
4508 O  O   . GLN   A 286 ? 0.3936 0.3704 0.3028 -0.1014 -0.0446 0.0411  976  GLN   A O   
4509 C  CB  . GLN   A 286 ? 0.4133 0.3818 0.3098 -0.1228 -0.0538 0.0458  976  GLN   A CB  
4510 C  CG  . GLN   A 286 ? 0.4839 0.4396 0.371  -0.1254 -0.0592 0.0459  976  GLN   A CG  
4511 C  CD  . GLN   A 286 ? 0.6139 0.5492 0.4789 -0.1387 -0.0638 0.0486  976  GLN   A CD  
4512 O  OE1 . GLN   A 286 ? 0.6625 0.5767 0.5085 -0.1398 -0.064  0.049   976  GLN   A OE1 
4513 N  NE2 . GLN   A 286 ? 0.6395 0.5791 0.5048 -0.1488 -0.0678 0.0503  976  GLN   A NE2 
4522 N  N   . ARG   A 287 ? 0.3334 0.3514 0.2729 -0.1062 -0.0411 0.043   977  ARG   A N   
4523 C  CA  . ARG   A 287 ? 0.3166 0.3425 0.2622 -0.1011 -0.0365 0.0422  977  ARG   A CA  
4524 C  C   . ARG   A 287 ? 0.2916 0.3157 0.2432 -0.0872 -0.0349 0.0381  977  ARG   A C   
4525 O  O   . ARG   A 287 ? 0.2865 0.3063 0.2356 -0.0819 -0.0329 0.0365  977  ARG   A O   
4526 C  CB  . ARG   A 287 ? 0.3206 0.3737 0.2831 -0.1044 -0.0331 0.044   977  ARG   A CB  
4527 C  CG  . ARG   A 287 ? 0.3688 0.43   0.3372 -0.0983 -0.0283 0.0431  977  ARG   A CG  
4528 C  CD  . ARG   A 287 ? 0.4134 0.5009 0.397  -0.0997 -0.0245 0.045   977  ARG   A CD  
4529 N  NE  . ARG   A 287 ? 0.462  0.5553 0.4517 -0.0903 -0.0204 0.043   977  ARG   A NE  
4530 C  CZ  . ARG   A 287 ? 0.4971 0.6099 0.4969 -0.089  -0.0163 0.0443  977  ARG   A CZ  
4531 N  NH1 . ARG   A 287 ? 0.4902 0.6216 0.4967 -0.0966 -0.0155 0.0476  977  ARG   A NH1 
4532 N  NH2 . ARG   A 287 ? 0.4967 0.6111 0.4997 -0.08   -0.0132 0.0422  977  ARG   A NH2 
4546 N  N   . TYR   A 288 ? 0.2725 0.301  0.2324 -0.082  -0.0357 0.0365  978  TYR   A N   
4547 C  CA  . TYR   A 288 ? 0.2608 0.2908 0.2283 -0.0706 -0.0336 0.0329  978  TYR   A CA  
4548 C  C   . TYR   A 288 ? 0.2545 0.266  0.2116 -0.0647 -0.0359 0.0306  978  TYR   A C   
4549 O  O   . TYR   A 288 ? 0.2454 0.257  0.2065 -0.0563 -0.034  0.0276  978  TYR   A O   
4550 C  CB  . TYR   A 288 ? 0.2491 0.2967 0.2325 -0.0677 -0.032  0.0325  978  TYR   A CB  
4551 C  CG  . TYR   A 288 ? 0.2587 0.326  0.2528 -0.0702 -0.029  0.0342  978  TYR   A CG  
4552 C  CD1 . TYR   A 288 ? 0.2675 0.3415 0.2675 -0.0646 -0.0252 0.0327  978  TYR   A CD1 
4553 C  CD2 . TYR   A 288 ? 0.2676 0.3466 0.2646 -0.0785 -0.0301 0.0373  978  TYR   A CD2 
4554 C  CE1 . TYR   A 288 ? 0.2771 0.3682 0.2851 -0.0661 -0.0223 0.0344  978  TYR   A CE1 
4555 C  CE2 . TYR   A 288 ? 0.2706 0.369  0.2768 -0.0804 -0.027  0.0391  978  TYR   A CE2 
4556 C  CZ  . TYR   A 288 ? 0.2857 0.3898 0.2972 -0.0736 -0.023  0.0376  978  TYR   A CZ  
4557 O  OH  . TYR   A 288 ? 0.3027 0.4259 0.3225 -0.0744 -0.0198 0.0394  978  TYR   A OH  
4567 N  N   . LEU   A 289 ? 0.2539 0.2506 0.1978 -0.0688 -0.0398 0.0318  979  LEU   A N   
4568 C  CA  . LEU   A 289 ? 0.2716 0.2503 0.2036 -0.0624 -0.0418 0.0299  979  LEU   A CA  
4569 C  C   . LEU   A 289 ? 0.3131 0.2707 0.2233 -0.0678 -0.0455 0.0316  979  LEU   A C   
4570 O  O   . LEU   A 289 ? 0.3409 0.2956 0.2451 -0.0779 -0.0478 0.0345  979  LEU   A O   
4571 C  CB  . LEU   A 289 ? 0.2654 0.2431 0.2001 -0.0597 -0.0432 0.0294  979  LEU   A CB  
4572 C  CG  . LEU   A 289 ? 0.2702 0.2657 0.2238 -0.0545 -0.0397 0.0278  979  LEU   A CG  
4573 C  CD1 . LEU   A 289 ? 0.2784 0.2707 0.2317 -0.053  -0.0413 0.0279  979  LEU   A CD1 
4574 C  CD2 . LEU   A 289 ? 0.2613 0.2598 0.2212 -0.0454 -0.0363 0.0245  979  LEU   A CD2 
4586 N  N   . VAL   A 290 ? 0.3243 0.2674 0.2223 -0.0613 -0.046  0.0298  980  VAL   A N   
4587 C  CA  . VAL   A 290 ? 0.3651 0.2848 0.2391 -0.0648 -0.0494 0.0311  980  VAL   A CA  
4588 C  C   . VAL   A 290 ? 0.3797 0.281  0.2391 -0.0584 -0.0525 0.03    980  VAL   A C   
4589 O  O   . VAL   A 290 ? 0.3815 0.2814 0.2413 -0.0472 -0.0516 0.027   980  VAL   A O   
4590 C  CB  . VAL   A 290 ? 0.3918 0.3081 0.2604 -0.0612 -0.0477 0.03    980  VAL   A CB  
4591 C  CG1 . VAL   A 290 ? 0.4309 0.3201 0.2716 -0.0642 -0.0511 0.0314  980  VAL   A CG1 
4592 C  CG2 . VAL   A 290 ? 0.3911 0.3266 0.2745 -0.0669 -0.0442 0.0313  980  VAL   A CG2 
4602 N  N   . ILE   A 291 ? 0.3965 0.2855 0.2442 -0.0653 -0.0562 0.0322  981  ILE   A N   
4603 C  CA  . ILE   A 291 ? 0.4308 0.3011 0.2631 -0.06   -0.0596 0.0316  981  ILE   A CA  
4604 C  C   . ILE   A 291 ? 0.4848 0.327  0.2884 -0.0668 -0.0643 0.0338  981  ILE   A C   
4605 O  O   . ILE   A 291 ? 0.4866 0.3273 0.2867 -0.0799 -0.0663 0.0366  981  ILE   A O   
4606 C  CB  . ILE   A 291 ? 0.4204 0.3011 0.2651 -0.0615 -0.0599 0.032   981  ILE   A CB  
4607 C  CG1 . ILE   A 291 ? 0.4045 0.3079 0.2734 -0.0531 -0.0552 0.0295  981  ILE   A CG1 
4608 C  CG2 . ILE   A 291 ? 0.443  0.3015 0.2685 -0.0576 -0.0639 0.0319  981  ILE   A CG2 
4609 C  CD1 . ILE   A 291 ? 0.4057 0.3235 0.2897 -0.056  -0.0547 0.0301  981  ILE   A CD1 
4621 N  N   . GLN   A 292 ? 0.5249 0.3449 0.3071 -0.058  -0.0662 0.0324  982  GLN   A N   
4622 C  CA  . GLN   A 292 ? 0.5805 0.3692 0.331  -0.0628 -0.0708 0.0342  982  GLN   A CA  
4623 C  C   . GLN   A 292 ? 0.591  0.3679 0.3318 -0.0701 -0.0751 0.0361  982  GLN   A C   
4624 O  O   . GLN   A 292 ? 0.5871 0.3671 0.3335 -0.063  -0.0754 0.0349  982  GLN   A O   
4625 C  CB  . GLN   A 292 ? 0.65   0.4188 0.3803 -0.0484 -0.0718 0.0318  982  GLN   A CB  
4626 C  CG  . GLN   A 292 ? 0.7739 0.5054 0.4666 -0.0504 -0.0768 0.0333  982  GLN   A CG  
4627 C  CD  . GLN   A 292 ? 0.9007 0.6218 0.581  -0.0627 -0.0774 0.0357  982  GLN   A CD  
4628 O  OE1 . GLN   A 292 ? 0.9489 0.668  0.6247 -0.0581 -0.0755 0.0347  982  GLN   A OE1 
4629 N  NE2 . GLN   A 292 ? 0.9255 0.6399 0.5995 -0.0789 -0.0799 0.039   982  GLN   A NE2 
4638 N  N   . GLY   A 293 ? 0.6014 0.3669 0.3294 -0.085  -0.0783 0.0392  983  GLY   A N   
4639 C  CA  . GLY   A 293 ? 0.6219 0.3757 0.3394 -0.0942 -0.0832 0.0411  983  GLY   A CA  
4640 C  C   . GLY   A 293 ? 0.6162 0.3978 0.361  -0.0988 -0.0821 0.0414  983  GLY   A C   
4641 O  O   . GLY   A 293 ? 0.624  0.3988 0.3636 -0.1011 -0.0859 0.0419  983  GLY   A O   
4645 N  N   . ASP   A 294 ? 0.5975 0.4094 0.3698 -0.0997 -0.0772 0.0411  984  ASP   A N   
4646 C  CA  . ASP   A 294 ? 0.5772 0.4171 0.3761 -0.1021 -0.0756 0.0412  984  ASP   A CA  
4647 C  C   . ASP   A 294 ? 0.5969 0.437  0.3927 -0.1169 -0.0803 0.0439  984  ASP   A C   
4648 O  O   . ASP   A 294 ? 0.5882 0.433  0.3899 -0.1156 -0.0824 0.0435  984  ASP   A O   
4649 C  CB  . ASP   A 294 ? 0.5528 0.421  0.3763 -0.102  -0.0699 0.0409  984  ASP   A CB  
4650 C  CG  . ASP   A 294 ? 0.558  0.4544 0.4085 -0.0992 -0.0671 0.0401  984  ASP   A CG  
4651 O  OD1 . ASP   A 294 ? 0.5497 0.4457 0.4015 -0.0984 -0.0696 0.0399  984  ASP   A OD1 
4652 O  OD2 . ASP   A 294 ? 0.565  0.4826 0.434  -0.0974 -0.0625 0.0396  984  ASP   A OD2 
4657 N  N   . GLU   A 295 ? 0.6211 0.4564 0.4075 -0.1312 -0.082  0.0465  985  GLU   A N   
4658 C  CA  . GLU   A 295 ? 0.6513 0.4896 0.4361 -0.1468 -0.0866 0.049   985  GLU   A CA  
4659 C  C   . GLU   A 295 ? 0.6824 0.4924 0.4431 -0.1486 -0.0935 0.0491  985  GLU   A C   
4660 O  O   . GLU   A 295 ? 0.6871 0.504  0.4514 -0.1582 -0.0975 0.0503  985  GLU   A O   
4661 C  CB  . GLU   A 295 ? 0.7012 0.5433 0.4826 -0.1635 -0.0864 0.0521  985  GLU   A CB  
4662 C  CG  . GLU   A 295 ? 0.8267 0.6416 0.5824 -0.1666 -0.0864 0.0531  985  GLU   A CG  
4663 C  CD  . GLU   A 295 ? 0.9738 0.8063 0.7407 -0.1729 -0.0812 0.0547  985  GLU   A CD  
4664 O  OE1 . GLU   A 295 ? 1.0018 0.8536 0.7799 -0.1872 -0.0811 0.0573  985  GLU   A OE1 
4665 O  OE2 . GLU   A 295 ? 1.0163 0.8441 0.7808 -0.1634 -0.0773 0.0534  985  GLU   A OE2 
4672 N  N   A ARG   A 296 ? 0.7031 0.4836 0.4406 -0.1384 -0.0947 0.0478  986  ARG   A N   
4673 N  N   B ARG   A 296 ? 0.7029 0.4829 0.4398 -0.1388 -0.095  0.0478  986  ARG   A N   
4674 C  CA  A ARG   A 296 ? 0.7328 0.4835 0.4447 -0.1371 -0.1008 0.0476  986  ARG   A CA  
4675 C  CA  B ARG   A 296 ? 0.7311 0.4835 0.4442 -0.1389 -0.1014 0.0478  986  ARG   A CA  
4676 C  C   A ARG   A 296 ? 0.7303 0.4861 0.4514 -0.123  -0.1004 0.0453  986  ARG   A C   
4677 C  C   B ARG   A 296 ? 0.7272 0.4869 0.4514 -0.1255 -0.101  0.0456  986  ARG   A C   
4678 O  O   A ARG   A 296 ? 0.7519 0.4835 0.4521 -0.1199 -0.1051 0.0451  986  ARG   A O   
4679 O  O   B ARG   A 296 ? 0.7438 0.4849 0.4519 -0.1255 -0.1062 0.0456  986  ARG   A O   
4680 C  CB  A ARG   A 296 ? 0.7825 0.4972 0.4616 -0.1318 -0.1023 0.0474  986  ARG   A CB  
4681 C  CB  B ARG   A 296 ? 0.7823 0.4962 0.4606 -0.1345 -0.1037 0.0477  986  ARG   A CB  
4682 C  CG  A ARG   A 296 ? 0.8442 0.5436 0.5049 -0.1461 -0.1036 0.0499  986  ARG   A CG  
4683 C  CG  B ARG   A 296 ? 0.8477 0.5462 0.5075 -0.1487 -0.1051 0.0502  986  ARG   A CG  
4684 C  CD  A ARG   A 296 ? 0.8953 0.5888 0.5468 -0.1667 -0.1092 0.0528  986  ARG   A CD  
4685 C  CD  B ARG   A 296 ? 0.9091 0.5912 0.5506 -0.1672 -0.112  0.0528  986  ARG   A CD  
4686 N  NE  A ARG   A 296 ? 0.9419 0.6163 0.5775 -0.1667 -0.1157 0.0524  986  ARG   A NE  
4687 N  NE  B ARG   A 296 ? 0.9603 0.6287 0.5849 -0.1817 -0.1124 0.0553  986  ARG   A NE  
4688 C  CZ  A ARG   A 296 ? 0.9642 0.6464 0.6048 -0.1797 -0.1205 0.0537  986  ARG   A CZ  
4689 C  CZ  B ARG   A 296 ? 1.02   0.6509 0.6097 -0.181  -0.1144 0.0558  986  ARG   A CZ  
4690 N  NH1 A ARG   A 296 ? 0.9683 0.6302 0.5921 -0.1775 -0.1264 0.0531  986  ARG   A NH1 
4691 N  NH1 B ARG   A 296 ? 1.0231 0.6437 0.5992 -0.1952 -0.1141 0.0583  986  ARG   A NH1 
4692 N  NH2 A ARG   A 296 ? 0.9476 0.6583 0.6095 -0.1944 -0.1194 0.0555  986  ARG   A NH2 
4693 N  NH2 B ARG   A 296 ? 1.0405 0.6436 0.6078 -0.1656 -0.1166 0.0538  986  ARG   A NH2 
4720 N  N   . MET   A 297 ? 0.7012 0.4866 0.4515 -0.1146 -0.0948 0.0437  987  MET   A N   
4721 C  CA  . MET   A 297 ? 0.683  0.4744 0.4429 -0.1019 -0.0936 0.0417  987  MET   A CA  
4722 C  C   . MET   A 297 ? 0.6716 0.4802 0.4464 -0.1082 -0.0959 0.0423  987  MET   A C   
4723 O  O   . MET   A 297 ? 0.6647 0.4961 0.4566 -0.1181 -0.0953 0.0435  987  MET   A O   
4724 C  CB  . MET   A 297 ? 0.6556 0.4674 0.437  -0.0893 -0.0863 0.0395  987  MET   A CB  
4725 C  CG  . MET   A 297 ? 0.6557 0.4531 0.4242 -0.0803 -0.0841 0.0382  987  MET   A CG  
4726 S  SD  . MET   A 297 ? 0.5911 0.4148 0.3864 -0.0677 -0.0762 0.0355  987  MET   A SD  
4727 C  CE  . MET   A 297 ? 0.5379 0.3405 0.3124 -0.0579 -0.0757 0.0341  987  MET   A CE  
4738 N  N   . HIS   A 298 ? 0.6647 0.4636 0.4333 -0.1012 -0.0983 0.0414  988  HIS   A N   
4739 C  CA  . HIS   A 298 ? 0.6503 0.4638 0.4314 -0.1051 -0.1008 0.0416  988  HIS   A CA  
4740 C  C   . HIS   A 298 ? 0.6214 0.4317 0.4042 -0.0906 -0.099  0.0397  988  HIS   A C   
4741 O  O   . HIS   A 298 ? 0.6288 0.416  0.3929 -0.0815 -0.0993 0.0389  988  HIS   A O   
4742 C  CB  . HIS   A 298 ? 0.6938 0.4919 0.4569 -0.1193 -0.1091 0.0434  988  HIS   A CB  
4743 C  CG  . HIS   A 298 ? 0.7524 0.5612 0.524  -0.1216 -0.1129 0.0433  988  HIS   A CG  
4744 N  ND1 . HIS   A 298 ? 0.8009 0.5873 0.5541 -0.1172 -0.1179 0.0427  988  HIS   A ND1 
4745 C  CD2 . HIS   A 298 ? 0.758  0.5972 0.5535 -0.1263 -0.1124 0.0434  988  HIS   A CD2 
4746 C  CE1 . HIS   A 298 ? 0.8007 0.6042 0.5673 -0.12   -0.1204 0.0425  988  HIS   A CE1 
4747 N  NE2 . HIS   A 298 ? 0.7792 0.6151 0.5715 -0.1251 -0.1172 0.0429  988  HIS   A NE2 
4755 N  N   . LEU   A 299 ? 0.5902 0.4237 0.3945 -0.0881 -0.0968 0.039   989  LEU   A N   
4756 C  CA  . LEU   A 299 ? 0.5857 0.4175 0.3924 -0.0758 -0.0949 0.0374  989  LEU   A CA  
4757 C  C   . LEU   A 299 ? 0.5899 0.4266 0.3987 -0.0813 -0.1002 0.0379  989  LEU   A C   
4758 O  O   . LEU   A 299 ? 0.5817 0.4367 0.4024 -0.092  -0.1024 0.0389  989  LEU   A O   
4759 C  CB  . LEU   A 299 ? 0.5677 0.4215 0.3975 -0.0661 -0.0867 0.0358  989  LEU   A CB  
4760 C  CG  . LEU   A 299 ? 0.577  0.4281 0.4064 -0.0592 -0.0814 0.0348  989  LEU   A CG  
4761 C  CD1 . LEU   A 299 ? 0.5633 0.4392 0.4172 -0.0537 -0.0743 0.0334  989  LEU   A CD1 
4762 C  CD2 . LEU   A 299 ? 0.5943 0.4222 0.4049 -0.0483 -0.0812 0.0339  989  LEU   A CD2 
4774 N  N   . PRO   A 300 ? 0.5944 0.4158 0.3916 -0.0741 -0.1025 0.0373  990  PRO   A N   
4775 C  CA  . PRO   A 300 ? 0.5926 0.4181 0.3907 -0.079  -0.1082 0.0375  990  PRO   A CA  
4776 C  C   . PRO   A 300 ? 0.5733 0.4313 0.3982 -0.0802 -0.1056 0.0371  990  PRO   A C   
4777 O  O   . PRO   A 300 ? 0.5561 0.428  0.3966 -0.0712 -0.0985 0.036   990  PRO   A O   
4778 C  CB  . PRO   A 300 ? 0.6142 0.4207 0.3989 -0.067  -0.1083 0.0366  990  PRO   A CB  
4779 C  CG  . PRO   A 300 ? 0.6308 0.4173 0.4006 -0.0588 -0.105  0.0363  990  PRO   A CG  
4780 C  CD  . PRO   A 300 ? 0.6011 0.4014 0.3833 -0.061  -0.1    0.0363  990  PRO   A CD  
4788 N  N   . SER   A 301 ? 0.5713 0.4412 0.4006 -0.0915 -0.1116 0.038   991  SER   A N   
4789 C  CA  . SER   A 301 ? 0.5627 0.4638 0.4156 -0.0925 -0.1103 0.0377  991  SER   A CA  
4790 C  C   . SER   A 301 ? 0.5629 0.4652 0.4128 -0.0939 -0.1171 0.0373  991  SER   A C   
4791 O  O   . SER   A 301 ? 0.5713 0.4571 0.4041 -0.1025 -0.1247 0.0381  991  SER   A O   
4792 C  CB  . SER   A 301 ? 0.5788 0.4998 0.4429 -0.1056 -0.1109 0.0392  991  SER   A CB  
4793 O  OG  . SER   A 301 ? 0.5987 0.55   0.4833 -0.1069 -0.1108 0.039   991  SER   A OG  
4799 N  N   . PRO   A 302 ? 0.5519 0.4729 0.4168 -0.0865 -0.1153 0.0361  992  PRO   A N   
4800 C  CA  . PRO   A 302 ? 0.5549 0.4768 0.4158 -0.0878 -0.1226 0.0356  992  PRO   A CA  
4801 C  C   . PRO   A 302 ? 0.5597 0.4911 0.4199 -0.104  -0.1312 0.0368  992  PRO   A C   
4802 O  O   . PRO   A 302 ? 0.5725 0.4953 0.4217 -0.1072 -0.139  0.0364  992  PRO   A O   
4803 C  CB  . PRO   A 302 ? 0.5485 0.4932 0.4281 -0.0777 -0.1182 0.0343  992  PRO   A CB  
4804 C  CG  . PRO   A 302 ? 0.5516 0.4958 0.4379 -0.0683 -0.1085 0.0338  992  PRO   A CG  
4805 C  CD  . PRO   A 302 ? 0.5333 0.4727 0.417  -0.0762 -0.1069 0.0351  992  PRO   A CD  
4813 N  N   . THR   A 303 ? 0.5483 0.4977 0.4196 -0.1145 -0.1299 0.0382  993  THR   A N   
4814 C  CA  . THR   A 303 ? 0.5498 0.5102 0.4213 -0.1317 -0.1373 0.0396  993  THR   A CA  
4815 C  C   . THR   A 303 ? 0.5559 0.4851 0.4017 -0.1426 -0.1433 0.0407  993  THR   A C   
4816 O  O   . THR   A 303 ? 0.5657 0.4983 0.4069 -0.1576 -0.1509 0.0417  993  THR   A O   
4817 C  CB  . THR   A 303 ? 0.5682 0.5578 0.4595 -0.139  -0.1329 0.0409  993  THR   A CB  
4818 O  OG1 . THR   A 303 ? 0.5983 0.5758 0.4861 -0.1364 -0.126  0.0415  993  THR   A OG1 
4819 C  CG2 . THR   A 303 ? 0.5573 0.5802 0.4727 -0.1303 -0.1288 0.0399  993  THR   A CG2 
4827 N  N   . ASP   A 304 ? 0.5537 0.453  0.3821 -0.1355 -0.1402 0.0406  994  ASP   A N   
4828 C  CA  . ASP   A 304 ? 0.567  0.4328 0.3674 -0.1433 -0.1458 0.0415  994  ASP   A CA  
4829 C  C   . ASP   A 304 ? 0.5851 0.4346 0.3702 -0.1423 -0.1539 0.0406  994  ASP   A C   
4830 O  O   . ASP   A 304 ? 0.5826 0.4316 0.3707 -0.1285 -0.1519 0.039   994  ASP   A O   
4831 C  CB  . ASP   A 304 ? 0.5885 0.4278 0.3742 -0.1324 -0.1402 0.0413  994  ASP   A CB  
4832 C  CG  . ASP   A 304 ? 0.6173 0.4674 0.4142 -0.1321 -0.1325 0.042   994  ASP   A CG  
4833 O  OD1 . ASP   A 304 ? 0.6196 0.4927 0.4311 -0.1431 -0.1322 0.0431  994  ASP   A OD1 
4834 O  OD2 . ASP   A 304 ? 0.6287 0.4651 0.4199 -0.1206 -0.1269 0.0413  994  ASP   A OD2 
4839 N  N   . SER   A 305 ? 0.6017 0.4359 0.3688 -0.1568 -0.1628 0.0415  995  SER   A N   
4840 C  CA  . SER   A 305 ? 0.6245 0.4403 0.3741 -0.1571 -0.1716 0.0406  995  SER   A CA  
4841 C  C   . SER   A 305 ? 0.6387 0.4221 0.368  -0.1409 -0.1697 0.0396  995  SER   A C   
4842 O  O   . SER   A 305 ? 0.6459 0.4243 0.3712 -0.1329 -0.1728 0.0382  995  SER   A O   
4843 C  CB  . SER   A 305 ? 0.6694 0.4682 0.3987 -0.1764 -0.1811 0.042   995  SER   A CB  
4844 O  OG  . SER   A 305 ? 0.698  0.5294 0.4464 -0.192  -0.1843 0.0428  995  SER   A OG  
4850 N  N   . ASN   A 306 ? 0.6398 0.4025 0.3565 -0.1356 -0.1645 0.0402  996  ASN   A N   
4851 C  CA  . ASN   A 306 ? 0.6558 0.3895 0.3534 -0.1199 -0.1619 0.0394  996  ASN   A CA  
4852 C  C   . ASN   A 306 ? 0.6353 0.3839 0.3516 -0.1026 -0.1512 0.0383  996  ASN   A C   
4853 O  O   . ASN   A 306 ? 0.6534 0.3816 0.3566 -0.0904 -0.1469 0.038   996  ASN   A O   
4854 C  CB  . ASN   A 306 ? 0.689  0.3899 0.3592 -0.1229 -0.163  0.0405  996  ASN   A CB  
4855 C  CG  . ASN   A 306 ? 0.7302 0.4408 0.4109 -0.1221 -0.1551 0.0412  996  ASN   A CG  
4856 O  OD1 . ASN   A 306 ? 0.725  0.4682 0.4335 -0.1249 -0.1502 0.0413  996  ASN   A OD1 
4857 N  ND2 . ASN   A 306 ? 0.7612 0.4437 0.4194 -0.1175 -0.1537 0.0417  996  ASN   A ND2 
4864 N  N   . PHE   A 307 ? 0.6051 0.388  0.3506 -0.101  -0.1467 0.0378  997  PHE   A N   
4865 C  CA  . PHE   A 307 ? 0.5984 0.3936 0.3601 -0.0859 -0.1366 0.0368  997  PHE   A CA  
4866 C  C   . PHE   A 307 ? 0.6167 0.3931 0.3661 -0.0712 -0.1352 0.0357  997  PHE   A C   
4867 O  O   . PHE   A 307 ? 0.6097 0.3805 0.3593 -0.0594 -0.1275 0.0353  997  PHE   A O   
4868 C  CB  . PHE   A 307 ? 0.5752 0.4069 0.3664 -0.0861 -0.1331 0.0362  997  PHE   A CB  
4869 C  CG  . PHE   A 307 ? 0.576  0.4183 0.382  -0.0717 -0.123  0.0351  997  PHE   A CG  
4870 C  CD1 . PHE   A 307 ? 0.5858 0.429  0.3968 -0.0682 -0.1156 0.0353  997  PHE   A CD1 
4871 C  CD2 . PHE   A 307 ? 0.5822 0.4328 0.3962 -0.062  -0.1211 0.0339  997  PHE   A CD2 
4872 C  CE1 . PHE   A 307 ? 0.585  0.439  0.41   -0.0567 -0.1067 0.0343  997  PHE   A CE1 
4873 C  CE2 . PHE   A 307 ? 0.5858 0.4455 0.4126 -0.0504 -0.1119 0.033   997  PHE   A CE2 
4874 C  CZ  . PHE   A 307 ? 0.5784 0.4398 0.4108 -0.0482 -0.1048 0.0332  997  PHE   A CZ  
4884 N  N   . TYR   A 308 ? 0.634  0.4012 0.3726 -0.0722 -0.1426 0.0352  998  TYR   A N   
4885 C  CA  . TYR   A 308 ? 0.6606 0.4081 0.3849 -0.0587 -0.1419 0.0344  998  TYR   A CA  
4886 C  C   . TYR   A 308 ? 0.6918 0.4089 0.3932 -0.0507 -0.1393 0.0349  998  TYR   A C   
4887 O  O   . TYR   A 308 ? 0.697  0.4048 0.3935 -0.0367 -0.1342 0.0343  998  TYR   A O   
4888 C  CB  . TYR   A 308 ? 0.6691 0.4074 0.3808 -0.0633 -0.1523 0.0339  998  TYR   A CB  
4889 C  CG  . TYR   A 308 ? 0.6954 0.4087 0.382  -0.0752 -0.1619 0.0348  998  TYR   A CG  
4890 C  CD1 . TYR   A 308 ? 0.7284 0.4059 0.3851 -0.0689 -0.1653 0.0349  998  TYR   A CD1 
4891 C  CD2 . TYR   A 308 ? 0.7009 0.4254 0.3923 -0.0927 -0.1673 0.0357  998  TYR   A CD2 
4892 C  CE1 . TYR   A 308 ? 0.7573 0.4089 0.3882 -0.0799 -0.1746 0.0356  998  TYR   A CE1 
4893 C  CE2 . TYR   A 308 ? 0.7293 0.4291 0.396  -0.1048 -0.1763 0.0365  998  TYR   A CE2 
4894 C  CZ  . TYR   A 308 ? 0.7633 0.4257 0.399  -0.0984 -0.1802 0.0364  998  TYR   A CZ  
4895 O  OH  . TYR   A 308 ? 0.8026 0.4382 0.4116 -0.1107 -0.1894 0.0372  998  TYR   A OH  
4905 N  N   . ARG   A 309 ? 0.7138 0.416  0.4008 -0.059  -0.1424 0.0359  999  ARG   A N   
4906 C  CA  . ARG   A 309 ? 0.7618 0.4354 0.4257 -0.0506 -0.1402 0.0363  999  ARG   A CA  
4907 C  C   . ARG   A 309 ? 0.7911 0.4769 0.4698 -0.0383 -0.1289 0.0358  999  ARG   A C   
4908 O  O   . ARG   A 309 ? 0.809  0.4774 0.4738 -0.0257 -0.1251 0.0356  999  ARG   A O   
4909 C  CB  . ARG   A 309 ? 0.7855 0.4418 0.4315 -0.0623 -0.1455 0.0375  999  ARG   A CB  
4910 C  CG  . ARG   A 309 ? 0.8261 0.4653 0.4525 -0.0766 -0.1573 0.0381  999  ARG   A CG  
4911 C  CD  . ARG   A 309 ? 0.8679 0.4713 0.4623 -0.0696 -0.1629 0.0379  999  ARG   A CD  
4912 N  NE  . ARG   A 309 ? 0.8973 0.4856 0.474  -0.0848 -0.1747 0.0383  999  ARG   A NE  
4913 C  CZ  . ARG   A 309 ? 0.9189 0.4809 0.4709 -0.0828 -0.1822 0.0379  999  ARG   A CZ  
4914 N  NH1 . ARG   A 309 ? 0.8951 0.4425 0.4367 -0.0652 -0.1788 0.0373  999  ARG   A NH1 
4915 N  NH2 . ARG   A 309 ? 0.9283 0.4788 0.4658 -0.0986 -0.1932 0.0382  999  ARG   A NH2 
4929 N  N   . ALA   A 310 ? 0.7915 0.507  0.4974 -0.0421 -0.1236 0.0356  1000 ALA   A N   
4930 C  CA  . ALA   A 310 ? 0.8108 0.5394 0.5319 -0.032  -0.1133 0.035   1000 ALA   A CA  
4931 C  C   . ALA   A 310 ? 0.8455 0.5807 0.5754 -0.0195 -0.1074 0.034   1000 ALA   A C   
4932 O  O   . ALA   A 310 ? 0.849  0.5838 0.581  -0.0086 -0.0998 0.0336  1000 ALA   A O   
4933 C  CB  . ALA   A 310 ? 0.7886 0.5455 0.5346 -0.0398 -0.1099 0.035   1000 ALA   A CB  
4939 N  N   . LEU   A 311 ? 0.8689 0.61   0.6031 -0.0209 -0.1109 0.0337  1001 LEU   A N   
4940 C  CA  . LEU   A 311 ? 0.8981 0.6435 0.6386 -0.0095 -0.1055 0.0329  1001 LEU   A CA  
4941 C  C   . LEU   A 311 ? 0.9487 0.6665 0.6652 0.001   -0.1062 0.0331  1001 LEU   A C   
4942 O  O   . LEU   A 311 ? 0.952  0.6707 0.671  0.0103  -0.1018 0.0326  1001 LEU   A O   
4943 C  CB  . LEU   A 311 ? 0.8917 0.6537 0.6448 -0.0138 -0.1092 0.0324  1001 LEU   A CB  
4944 C  CG  . LEU   A 311 ? 0.8954 0.6878 0.6737 -0.0219 -0.1078 0.0322  1001 LEU   A CG  
4945 C  CD1 . LEU   A 311 ? 0.8986 0.7037 0.6837 -0.0259 -0.1136 0.0317  1001 LEU   A CD1 
4946 C  CD2 . LEU   A 311 ? 0.8873 0.6964 0.6844 -0.0144 -0.0972 0.0315  1001 LEU   A CD2 
4958 N  N   . MET   A 312 ? 0.9872 0.6796 0.6793 0.0003  -0.1111 0.0338  1002 MET   A N   
4959 C  CA  . MET   A 312 ? 1.0318 0.6968 0.6991 0.011   -0.112  0.034   1002 MET   A CA  
4960 C  C   . MET   A 312 ? 1.0423 0.7081 0.7121 0.0252  -0.1014 0.0339  1002 MET   A C   
4961 O  O   . MET   A 312 ? 1.046  0.7147 0.7199 0.034   -0.0962 0.0336  1002 MET   A O   
4962 C  CB  . MET   A 312 ? 1.0725 0.7084 0.7107 0.0066  -0.1205 0.0347  1002 MET   A CB  
4963 C  CG  . MET   A 312 ? 1.1228 0.7537 0.754  -0.0071 -0.1317 0.0349  1002 MET   A CG  
4964 S  SD  . MET   A 312 ? 1.2772 0.8692 0.8703 -0.0129 -0.1419 0.0358  1002 MET   A SD  
4965 C  CE  . MET   A 312 ? 1.2543 0.8455 0.8438 -0.0265 -0.1536 0.0355  1002 MET   A CE  
4975 N  N   . ASP   A 324 ? 0.5551 0.6735 0.6039 0.0228  0.0528  -0.0007 1014 ASP   A N   
4976 C  CA  . ASP   A 324 ? 0.5657 0.6671 0.6101 0.0154  0.0554  0.0011  1014 ASP   A CA  
4977 C  C   . ASP   A 324 ? 0.5438 0.6381 0.5907 0.0084  0.0505  -0.0001 1014 ASP   A C   
4978 O  O   . ASP   A 324 ? 0.5359 0.6437 0.5942 0.0024  0.0498  -0.0028 1014 ASP   A O   
4979 C  CB  . ASP   A 324 ? 0.6036 0.7138 0.6547 0.0077  0.0643  0.0012  1014 ASP   A CB  
4980 C  CG  . ASP   A 324 ? 0.7012 0.8127 0.7466 0.014   0.0705  0.0035  1014 ASP   A CG  
4981 O  OD1 . ASP   A 324 ? 0.7294 0.8341 0.7647 0.0252  0.0675  0.0049  1014 ASP   A OD1 
4982 O  OD2 . ASP   A 324 ? 0.7311 0.8495 0.7811 0.0076  0.0784  0.0039  1014 ASP   A OD2 
4986 N  N   . GLU   A 325 ? 0.5284 0.6021 0.5647 0.0094  0.0469  0.0018  1015 GLU   A N   
4987 C  CA  . GLU   A 325 ? 0.5067 0.5736 0.5443 0.0041  0.0425  0.001   1015 GLU   A CA  
4988 C  C   . GLU   A 325 ? 0.4745 0.5396 0.5163 -0.0056 0.047   0.0005  1015 GLU   A C   
4989 O  O   . GLU   A 325 ? 0.4676 0.533  0.5135 -0.0106 0.0444  -0.0011 1015 GLU   A O   
4990 C  CB  . GLU   A 325 ? 0.5504 0.5982 0.5758 0.008   0.0374  0.0034  1015 GLU   A CB  
4991 C  CG  . GLU   A 325 ? 0.639  0.6842 0.6573 0.0162  0.0318  0.004   1015 GLU   A CG  
4992 C  CD  . GLU   A 325 ? 0.7686 0.8096 0.7778 0.0241  0.0339  0.0057  1015 GLU   A CD  
4993 O  OE1 . GLU   A 325 ? 0.8074 0.8421 0.8128 0.0236  0.039   0.0072  1015 GLU   A OE1 
4994 O  OE2 . GLU   A 325 ? 0.8064 0.849  0.8107 0.0313  0.0305  0.0055  1015 GLU   A OE2 
5001 N  N   . TYR   A 326 ? 0.4517 0.5137 0.491  -0.008  0.054   0.0017  1016 TYR   A N   
5002 C  CA  . TYR   A 326 ? 0.4403 0.4969 0.48   -0.0171 0.0589  0.0014  1016 TYR   A CA  
5003 C  C   . TYR   A 326 ? 0.4489 0.5232 0.499  -0.0235 0.0648  -0.0003 1016 TYR   A C   
5004 O  O   . TYR   A 326 ? 0.4434 0.5267 0.4949 -0.0202 0.069   0.0005  1016 TYR   A O   
5005 C  CB  . TYR   A 326 ? 0.4282 0.4657 0.455  -0.0154 0.0626  0.0043  1016 TYR   A CB  
5006 C  CG  . TYR   A 326 ? 0.4145 0.4357 0.431  -0.0092 0.0567  0.006   1016 TYR   A CG  
5007 C  CD1 . TYR   A 326 ? 0.4112 0.4294 0.4219 -0.0006 0.0534  0.0076  1016 TYR   A CD1 
5008 C  CD2 . TYR   A 326 ? 0.4142 0.4232 0.4262 -0.0119 0.0544  0.0061  1016 TYR   A CD2 
5009 C  CE1 . TYR   A 326 ? 0.4144 0.419  0.4162 0.0037  0.0475  0.009   1016 TYR   A CE1 
5010 C  CE2 . TYR   A 326 ? 0.4208 0.4182 0.4249 -0.0067 0.0488  0.0076  1016 TYR   A CE2 
5011 C  CZ  . TYR   A 326 ? 0.4184 0.414  0.4179 0.0004  0.0452  0.009   1016 TYR   A CZ  
5012 O  OH  . TYR   A 326 ? 0.4041 0.3884 0.3954 0.0045  0.0397  0.0106  1016 TYR   A OH  
5022 N  N   . LEU   A 327 ? 0.4557 0.5355 0.5129 -0.0328 0.0652  -0.0027 1017 LEU   A N   
5023 C  CA  . LEU   A 327 ? 0.4667 0.5647 0.5346 -0.0409 0.0702  -0.0047 1017 LEU   A CA  
5024 C  C   . LEU   A 327 ? 0.4787 0.568  0.5446 -0.0528 0.074   -0.0055 1017 LEU   A C   
5025 O  O   . LEU   A 327 ? 0.4766 0.5492 0.5351 -0.0542 0.071   -0.0055 1017 LEU   A O   
5026 C  CB  . LEU   A 327 ? 0.4688 0.5889 0.5498 -0.0398 0.0654  -0.0078 1017 LEU   A CB  
5027 C  CG  . LEU   A 327 ? 0.4949 0.6256 0.5773 -0.0278 0.0623  -0.0073 1017 LEU   A CG  
5028 C  CD1 . LEU   A 327 ? 0.4953 0.6396 0.5858 -0.0253 0.0557  -0.0102 1017 LEU   A CD1 
5029 C  CD2 . LEU   A 327 ? 0.5005 0.6476 0.5877 -0.0259 0.0687  -0.0068 1017 LEU   A CD2 
5041 N  N   . ILE   A 328 ? 0.4825 0.5835 0.5544 -0.0615 0.0807  -0.0062 1018 ILE   A N   
5042 C  CA  . ILE   A 328 ? 0.5064 0.5993 0.5754 -0.0745 0.0849  -0.0071 1018 ILE   A CA  
5043 C  C   . ILE   A 328 ? 0.5218 0.619  0.5968 -0.0797 0.0789  -0.0105 1018 ILE   A C   
5044 O  O   . ILE   A 328 ? 0.5079 0.6264 0.5956 -0.0776 0.0749  -0.0127 1018 ILE   A O   
5045 C  CB  . ILE   A 328 ? 0.5114 0.6208 0.5878 -0.0835 0.0932  -0.0072 1018 ILE   A CB  
5046 C  CG1 . ILE   A 328 ? 0.5335 0.6343 0.6008 -0.0791 0.1003  -0.0035 1018 ILE   A CG1 
5047 C  CG2 . ILE   A 328 ? 0.5211 0.6264 0.5967 -0.0992 0.0964  -0.009  1018 ILE   A CG2 
5048 C  CD1 . ILE   A 328 ? 0.5719 0.6409 0.62   -0.0811 0.1042  -0.0009 1018 ILE   A CD1 
5060 N  N   . PRO   A 329 ? 0.5503 0.6275 0.6154 -0.0851 0.0777  -0.0109 1019 PRO   A N   
5061 C  CA  . PRO   A 329 ? 0.5645 0.646  0.6347 -0.0892 0.0719  -0.0142 1019 PRO   A CA  
5062 C  C   . PRO   A 329 ? 0.5799 0.6801 0.6614 -0.1013 0.0739  -0.0173 1019 PRO   A C   
5063 O  O   . PRO   A 329 ? 0.5859 0.6852 0.6656 -0.1112 0.0806  -0.0169 1019 PRO   A O   
5064 C  CB  . PRO   A 329 ? 0.5862 0.6402 0.6406 -0.0913 0.0714  -0.0135 1019 PRO   A CB  
5065 C  CG  . PRO   A 329 ? 0.5983 0.6343 0.6399 -0.0871 0.076   -0.0101 1019 PRO   A CG  
5066 C  CD  . PRO   A 329 ? 0.5629 0.6125 0.6108 -0.0871 0.0815  -0.0087 1019 PRO   A CD  
5074 N  N   . GLN   A 330 ? 0.584  0.7009 0.6768 -0.1009 0.0678  -0.0204 1020 GLN   A N   
5075 C  CA  . GLN   A 330 ? 0.5963 0.7327 0.7007 -0.1122 0.068   -0.0239 1020 GLN   A CA  
5076 C  C   . GLN   A 330 ? 0.62   0.7424 0.7178 -0.1215 0.065   -0.0264 1020 GLN   A C   
5077 O  O   . GLN   A 330 ? 0.6182 0.7516 0.7224 -0.1335 0.0658  -0.0292 1020 GLN   A O   
5078 C  CB  . GLN   A 330 ? 0.609  0.7734 0.7292 -0.1056 0.0628  -0.0263 1020 GLN   A CB  
5079 C  CG  . GLN   A 330 ? 0.666  0.8481 0.7934 -0.098  0.0663  -0.0246 1020 GLN   A CG  
5080 C  CD  . GLN   A 330 ? 0.7274 0.9347 0.8675 -0.0892 0.061   -0.0268 1020 GLN   A CD  
5081 O  OE1 . GLN   A 330 ? 0.751  0.9626 0.8907 -0.0773 0.0608  -0.0249 1020 GLN   A OE1 
5082 N  NE2 . GLN   A 330 ? 0.7352 0.9595 0.8857 -0.0943 0.0567  -0.0308 1020 GLN   A NE2 
5091 N  N   . GLN   A 331 ? 0.6372 0.7359 0.722  -0.1158 0.0615  -0.0254 1021 GLN   A N   
5092 C  CA  . GLN   A 331 ? 0.6559 0.7391 0.732  -0.1221 0.0583  -0.0275 1021 GLN   A CA  
5093 C  C   . GLN   A 331 ? 0.6815 0.7327 0.7373 -0.1216 0.0611  -0.025  1021 GLN   A C   
5094 O  O   . GLN   A 331 ? 0.6887 0.7303 0.7381 -0.114  0.0638  -0.0218 1021 GLN   A O   
5095 C  CB  . GLN   A 331 ? 0.6682 0.7571 0.749  -0.1139 0.0501  -0.0293 1021 GLN   A CB  
5096 C  CG  . GLN   A 331 ? 0.6787 0.7977 0.7775 -0.1116 0.0466  -0.0317 1021 GLN   A CG  
5097 C  CD  . GLN   A 331 ? 0.7077 0.8305 0.8094 -0.105  0.0388  -0.0337 1021 GLN   A CD  
5098 O  OE1 . GLN   A 331 ? 0.7065 0.8337 0.8105 -0.0935 0.0357  -0.0325 1021 GLN   A OE1 
5099 N  NE2 . GLN   A 331 ? 0.7092 0.8297 0.8097 -0.1125 0.0355  -0.037  1021 GLN   A NE2 
5108 NA NA  . NA    B .   ? 0.4862 0.4049 0.4266 0.0115  0.0621  0.0177  1101 NA    A NA  
5109 NA NA  . NA    C .   ? 0.5955 0.6564 0.6027 0.0229  0.0074  0.0051  1102 NA    A NA  
5110 C  C1  . GOL   D .   ? 0.6734 0.7191 0.6484 -0.0573 -0.022  0.0291  1103 GOL   A C1  
5111 O  O1  . GOL   D .   ? 0.658  0.7081 0.642  -0.0532 -0.0225 0.0273  1103 GOL   A O1  
5112 C  C2  . GOL   D .   ? 0.68   0.7314 0.6534 -0.0676 -0.0221 0.0334  1103 GOL   A C2  
5113 O  O2  . GOL   D .   ? 0.6695 0.7416 0.6576 -0.0677 -0.0196 0.0345  1103 GOL   A O2  
5114 C  C3  . GOL   D .   ? 0.69   0.7359 0.6527 -0.0731 -0.021  0.0356  1103 GOL   A C3  
5115 O  O3  . GOL   D .   ? 0.6927 0.7475 0.656  -0.0837 -0.0205 0.0397  1103 GOL   A O3  
5116 C  C1  . EDO   E .   ? 0.315  0.3818 0.3497 -0.0082 -0.0104 -0.0094 1104 EDO   A C1  
5117 O  O1  . EDO   E .   ? 0.3186 0.3851 0.3504 -0.0063 -0.0082 -0.0072 1104 EDO   A O1  
5118 C  C2  . EDO   E .   ? 0.3195 0.3866 0.3578 -0.0103 -0.0095 -0.0083 1104 EDO   A C2  
5119 O  O2  . EDO   E .   ? 0.3157 0.3834 0.3577 -0.0117 -0.0103 -0.0116 1104 EDO   A O2  
5120 N  N1  . A1IMT F .   ? 0.3602 0.243  0.2613 0.0371  0.0089  0.023   1105 A1IMT A N1  
5121 N  N3  . A1IMT F .   ? 0.3989 0.2735 0.2755 0.0485  -0.0029 0.0246  1105 A1IMT A N3  
5122 C  C4  . A1IMT F .   ? 0.4333 0.2717 0.295  0.0531  0.0136  0.0251  1105 A1IMT A C4  
5123 C  C5  . A1IMT F .   ? 0.424  0.2644 0.2864 0.0526  0.012   0.0257  1105 A1IMT A C5  
5124 C  C6  . A1IMT F .   ? 0.4056 0.2607 0.281  0.0474  0.0106  0.025   1105 A1IMT A C6  
5125 C  C7  . A1IMT F .   ? 0.3902 0.2583 0.2783 0.0423  0.0099  0.0238  1105 A1IMT A C7  
5126 C  C8  . A1IMT F .   ? 0.3484 0.2359 0.2523 0.036   0.0075  0.023   1105 A1IMT A C8  
5127 C  C10 . A1IMT F .   ? 0.3501 0.2199 0.2338 0.04    -0.0053 0.025   1105 A1IMT A C10 
5128 C  C13 . A1IMT F .   ? 0.3737 0.2267 0.238  0.0404  -0.0192 0.0265  1105 A1IMT A C13 
5129 C  C15 . A1IMT F .   ? 0.3781 0.2401 0.2506 0.0435  -0.0079 0.0258  1105 A1IMT A C15 
5130 C  C17 . A1IMT F .   ? 0.4086 0.2701 0.2749 0.0516  -0.0023 0.0258  1105 A1IMT A C17 
5131 C  C20 . A1IMT F .   ? 0.4092 0.276  0.2737 0.0537  -0.0058 0.0249  1105 A1IMT A C20 
5132 C  C21 . A1IMT F .   ? 0.3897 0.2806 0.2833 0.0423  -0.0011 0.0232  1105 A1IMT A C21 
5133 C  C22 . A1IMT F .   ? 0.3862 0.2884 0.2872 0.0416  -0.0008 0.022   1105 A1IMT A C22 
5134 C  C24 . A1IMT F .   ? 0.3687 0.2999 0.295  0.0358  0.0032  0.0188  1105 A1IMT A C24 
5135 C  C26 . A1IMT F .   ? 0.3751 0.3304 0.3186 0.038   0.0138  0.0162  1105 A1IMT A C26 
5136 C  C28 . A1IMT F .   ? 0.3321 0.2315 0.2446 0.0349  0.0113  0.0223  1105 A1IMT A C28 
5137 C  C1  . A1IMT F .   ? 0.4011 0.2784 0.3012 0.0378  0.0185  0.0213  1105 A1IMT A C1  
5138 O  O1  . A1IMT F .   ? 0.3968 0.2755 0.2958 0.0386  0.0115  0.0221  1105 A1IMT A O1  
5139 C  C2  . A1IMT F .   ? 0.4042 0.2705 0.2914 0.043   0.0111  0.0233  1105 A1IMT A C2  
5140 C  C3  . A1IMT F .   ? 0.4377 0.2887 0.3115 0.0484  0.0137  0.0239  1105 A1IMT A C3  
5141 C  C9  . A1IMT F .   ? 0.3483 0.2286 0.2433 0.0386  0.0029  0.024   1105 A1IMT A C9  
5142 C  C11 . A1IMT F .   ? 0.3468 0.2161 0.2299 0.0391  -0.0092 0.0249  1105 A1IMT A C11 
5143 C  C12 . A1IMT F .   ? 0.3643 0.2266 0.2386 0.0391  -0.0176 0.0256  1105 A1IMT A C12 
5144 N  N2  . A1IMT F .   ? 0.3764 0.2303 0.2413 0.0392  -0.0226 0.0264  1105 A1IMT A N2  
5145 C  C14 . A1IMT F .   ? 0.3636 0.2257 0.2378 0.0411  -0.0108 0.0257  1105 A1IMT A C14 
5146 C  C16 . A1IMT F .   ? 0.3925 0.2539 0.2624 0.0468  -0.0054 0.0258  1105 A1IMT A C16 
5147 C  C18 . A1IMT F .   ? 0.4273 0.2711 0.2743 0.0562  -0.0087 0.0269  1105 A1IMT A C18 
5148 C  C19 . A1IMT F .   ? 0.4288 0.2768 0.2749 0.0605  -0.0066 0.0264  1105 A1IMT A C19 
5149 O  O2  . A1IMT F .   ? 0.378  0.2731 0.279  0.0385  0.0005  0.023   1105 A1IMT A O2  
5150 C  C23 . A1IMT F .   ? 0.3701 0.2868 0.2859 0.0359  0.0001  0.0206  1105 A1IMT A C23 
5151 N  N4  . A1IMT F .   ? 0.3732 0.312  0.3051 0.0386  0.0113  0.0182  1105 A1IMT A N4  
5152 C  C25 . A1IMT F .   ? 0.3717 0.3122 0.3099 0.0347  0.016   0.0182  1105 A1IMT A C25 
5153 C  C27 . A1IMT F .   ? 0.4109 0.2763 0.2805 0.0557  0.0076  0.0258  1105 A1IMT A C27 
5154 N  N5  . A1IMT F .   ? 0.3435 0.2316 0.2442 0.0376  0.0048  0.0235  1105 A1IMT A N5  
5155 C  C29 . A1IMT F .   ? 0.3309 0.229  0.245  0.0335  0.0133  0.022   1105 A1IMT A C29 
5156 C  C30 . A1IMT F .   ? 0.3218 0.2275 0.245  0.0303  0.0203  0.0209  1105 A1IMT A C30 
5157 O  O3  . A1IMT F .   ? 0.3242 0.2255 0.2456 0.0299  0.0231  0.0207  1105 A1IMT A O3  
5158 N  N6  . A1IMT F .   ? 0.3127 0.2296 0.2451 0.0278  0.0237  0.0199  1105 A1IMT A N6  
5159 C  C31 . A1IMT F .   ? 0.3166 0.2399 0.2516 0.0284  0.0197  0.0197  1105 A1IMT A C31 
5160 C  C32 . A1IMT F .   ? 0.325  0.2361 0.2465 0.0338  0.0154  0.0212  1105 A1IMT A C32 
5161 CL CL1 . A1IMT F .   ? 0.4688 0.3156 0.3387 0.0508  0.0145  0.0231  1105 A1IMT A CL1 
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