data_9I2O
# 
_entry.id   9I2O 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.401 
_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   9I2O         pdb_00009i2o 10.2210/pdb9i2o/pdb 
WWPDB D_1292144375 ?            ?                   
# 
_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       2025-01-29 
# 
_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                        9I2O 
_pdbx_database_status.recvd_initial_deposition_date   2025-01-21 
_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           Y 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              alke.meents@desy.de 
_pdbx_contact_author.name_first         Alke 
_pdbx_contact_author.name_last          Meents 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0001-6078-4095 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Falke, S.'   1 0000-0003-3409-1791 
'Lewe, P.'    2 ?                   
'Witt, S.'    3 0000-0001-9102-1517 
'Wrenger, C.' 4 0000-0001-5987-1749 
'Meents, A.'  5 0000-0001-6078-4095 
# 
_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                     'PB2 cap-binding domain of human pathogenic influenza A virus H5N1 in complex with m7GTP' 
_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 'Falke, S.'   1 0000-0003-3409-1791 
primary 'Lewe, P.'    2 ?                   
primary 'Witt, S.'    3 0000-0001-9102-1517 
primary 'Wrenger, C.' 4 0000-0001-5987-1749 
primary 'Meents, A.'  5 0000-0001-6078-4095 
# 
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 'Polymerase basic protein 2'                 21374.643 1  ? ? ? ? 
2 non-polymer syn "7N-METHYL-8-HYDROGUANOSINE-5'-TRIPHOSPHATE" 539.223   1  ? ? ? ? 
3 water       nat water                                        18.015    71 ? ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'RNA-directed RNA polymerase subunit P3' 
# 
_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       
;MGSSHHHHHHSSGENLYFQGHMRISSSFSFGGFTFKRTSGSSVKKEEEVLTGNLQTLKIRVHEGYEEFTMVGRRATAILR
KATRRLIQLIVSGRDEQSIAEAIIVAMVFSQEDCMIKAVRGDLNFVNRANQRLNPMHQLLRHFQKDAKVLFQNWGIEPID
NVMGMIGILPDMTPSTEMSLRGVRVSKM
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MGSSHHHHHHSSGENLYFQGHMRISSSFSFGGFTFKRTSGSSVKKEEEVLTGNLQTLKIRVHEGYEEFTMVGRRATAILR
KATRRLIQLIVSGRDEQSIAEAIIVAMVFSQEDCMIKAVRGDLNFVNRANQRLNPMHQLLRHFQKDAKVLFQNWGIEPID
NVMGMIGILPDMTPSTEMSLRGVRVSKM
;
_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 "7N-METHYL-8-HYDROGUANOSINE-5'-TRIPHOSPHATE" MGT 
3 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   GLY n 
1 3   SER n 
1 4   SER n 
1 5   HIS n 
1 6   HIS n 
1 7   HIS n 
1 8   HIS n 
1 9   HIS n 
1 10  HIS n 
1 11  SER n 
1 12  SER n 
1 13  GLY n 
1 14  GLU n 
1 15  ASN n 
1 16  LEU n 
1 17  TYR n 
1 18  PHE n 
1 19  GLN n 
1 20  GLY n 
1 21  HIS n 
1 22  MET n 
1 23  ARG n 
1 24  ILE n 
1 25  SER n 
1 26  SER n 
1 27  SER n 
1 28  PHE n 
1 29  SER n 
1 30  PHE n 
1 31  GLY n 
1 32  GLY n 
1 33  PHE n 
1 34  THR n 
1 35  PHE n 
1 36  LYS n 
1 37  ARG n 
1 38  THR n 
1 39  SER n 
1 40  GLY n 
1 41  SER n 
1 42  SER n 
1 43  VAL n 
1 44  LYS n 
1 45  LYS n 
1 46  GLU n 
1 47  GLU n 
1 48  GLU n 
1 49  VAL n 
1 50  LEU n 
1 51  THR n 
1 52  GLY n 
1 53  ASN n 
1 54  LEU n 
1 55  GLN n 
1 56  THR n 
1 57  LEU n 
1 58  LYS n 
1 59  ILE n 
1 60  ARG n 
1 61  VAL n 
1 62  HIS n 
1 63  GLU n 
1 64  GLY n 
1 65  TYR n 
1 66  GLU n 
1 67  GLU n 
1 68  PHE n 
1 69  THR n 
1 70  MET n 
1 71  VAL n 
1 72  GLY n 
1 73  ARG n 
1 74  ARG n 
1 75  ALA n 
1 76  THR n 
1 77  ALA n 
1 78  ILE n 
1 79  LEU n 
1 80  ARG n 
1 81  LYS n 
1 82  ALA n 
1 83  THR n 
1 84  ARG n 
1 85  ARG n 
1 86  LEU n 
1 87  ILE n 
1 88  GLN n 
1 89  LEU n 
1 90  ILE n 
1 91  VAL n 
1 92  SER n 
1 93  GLY n 
1 94  ARG n 
1 95  ASP n 
1 96  GLU n 
1 97  GLN n 
1 98  SER n 
1 99  ILE n 
1 100 ALA n 
1 101 GLU n 
1 102 ALA n 
1 103 ILE n 
1 104 ILE n 
1 105 VAL n 
1 106 ALA n 
1 107 MET n 
1 108 VAL n 
1 109 PHE n 
1 110 SER n 
1 111 GLN n 
1 112 GLU n 
1 113 ASP n 
1 114 CYS n 
1 115 MET n 
1 116 ILE n 
1 117 LYS n 
1 118 ALA n 
1 119 VAL n 
1 120 ARG n 
1 121 GLY n 
1 122 ASP n 
1 123 LEU n 
1 124 ASN n 
1 125 PHE n 
1 126 VAL n 
1 127 ASN n 
1 128 ARG n 
1 129 ALA n 
1 130 ASN n 
1 131 GLN n 
1 132 ARG n 
1 133 LEU n 
1 134 ASN n 
1 135 PRO n 
1 136 MET n 
1 137 HIS n 
1 138 GLN n 
1 139 LEU n 
1 140 LEU n 
1 141 ARG n 
1 142 HIS n 
1 143 PHE n 
1 144 GLN n 
1 145 LYS n 
1 146 ASP n 
1 147 ALA n 
1 148 LYS n 
1 149 VAL n 
1 150 LEU n 
1 151 PHE n 
1 152 GLN n 
1 153 ASN n 
1 154 TRP n 
1 155 GLY n 
1 156 ILE n 
1 157 GLU n 
1 158 PRO n 
1 159 ILE n 
1 160 ASP n 
1 161 ASN n 
1 162 VAL n 
1 163 MET n 
1 164 GLY n 
1 165 MET n 
1 166 ILE n 
1 167 GLY n 
1 168 ILE n 
1 169 LEU n 
1 170 PRO n 
1 171 ASP n 
1 172 MET n 
1 173 THR n 
1 174 PRO n 
1 175 SER n 
1 176 THR n 
1 177 GLU n 
1 178 MET n 
1 179 SER n 
1 180 LEU n 
1 181 ARG n 
1 182 GLY n 
1 183 VAL n 
1 184 ARG n 
1 185 VAL n 
1 186 SER n 
1 187 LYS n 
1 188 MET 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                   188 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 PB2 
_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      'Influenza A virus' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     11320 
_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      'Escherichia coli BL21(DE3)' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     469008 
_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 
ALA 'L-peptide linking' y ALANINE                                      ? 'C3 H7 N O2'        89.093  
ARG 'L-peptide linking' y ARGININE                                     ? 'C6 H15 N4 O2 1'    175.209 
ASN 'L-peptide linking' y ASPARAGINE                                   ? 'C4 H8 N2 O3'       132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID'                              ? 'C4 H7 N O4'        133.103 
CYS 'L-peptide linking' y CYSTEINE                                     ? 'C3 H7 N O2 S'      121.158 
GLN 'L-peptide linking' y GLUTAMINE                                    ? 'C5 H10 N2 O3'      146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'                              ? 'C5 H9 N O4'        147.129 
GLY 'peptide linking'   y GLYCINE                                      ? 'C2 H5 N O2'        75.067  
HIS 'L-peptide linking' y HISTIDINE                                    ? 'C6 H10 N3 O2 1'    156.162 
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 
MGT non-polymer         n "7N-METHYL-8-HYDROGUANOSINE-5'-TRIPHOSPHATE" ? 'C11 H20 N5 O14 P3' 539.223 
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   296 ?   ?   ?   A . n 
A 1 2   GLY 2   297 ?   ?   ?   A . n 
A 1 3   SER 3   298 ?   ?   ?   A . n 
A 1 4   SER 4   299 ?   ?   ?   A . n 
A 1 5   HIS 5   300 ?   ?   ?   A . n 
A 1 6   HIS 6   301 ?   ?   ?   A . n 
A 1 7   HIS 7   302 ?   ?   ?   A . n 
A 1 8   HIS 8   303 ?   ?   ?   A . n 
A 1 9   HIS 9   304 ?   ?   ?   A . n 
A 1 10  HIS 10  305 ?   ?   ?   A . n 
A 1 11  SER 11  306 ?   ?   ?   A . n 
A 1 12  SER 12  307 ?   ?   ?   A . n 
A 1 13  GLY 13  308 ?   ?   ?   A . n 
A 1 14  GLU 14  309 ?   ?   ?   A . n 
A 1 15  ASN 15  310 ?   ?   ?   A . n 
A 1 16  LEU 16  311 ?   ?   ?   A . n 
A 1 17  TYR 17  312 ?   ?   ?   A . n 
A 1 18  PHE 18  313 ?   ?   ?   A . n 
A 1 19  GLN 19  314 ?   ?   ?   A . n 
A 1 20  GLY 20  315 ?   ?   ?   A . n 
A 1 21  HIS 21  316 ?   ?   ?   A . n 
A 1 22  MET 22  317 ?   ?   ?   A . n 
A 1 23  ARG 23  318 ?   ?   ?   A . n 
A 1 24  ILE 24  319 ?   ?   ?   A . n 
A 1 25  SER 25  320 ?   ?   ?   A . n 
A 1 26  SER 26  321 321 SER SER A . n 
A 1 27  SER 27  322 322 SER SER A . n 
A 1 28  PHE 28  323 323 PHE PHE A . n 
A 1 29  SER 29  324 324 SER SER A . n 
A 1 30  PHE 30  325 325 PHE PHE A . n 
A 1 31  GLY 31  326 326 GLY GLY A . n 
A 1 32  GLY 32  327 327 GLY GLY A . n 
A 1 33  PHE 33  328 328 PHE PHE A . n 
A 1 34  THR 34  329 329 THR THR A . n 
A 1 35  PHE 35  330 330 PHE PHE A . n 
A 1 36  LYS 36  331 331 LYS LYS A . n 
A 1 37  ARG 37  332 332 ARG ARG A . n 
A 1 38  THR 38  333 333 THR THR A . n 
A 1 39  SER 39  334 334 SER SER A . n 
A 1 40  GLY 40  335 335 GLY GLY A . n 
A 1 41  SER 41  336 336 SER SER A . n 
A 1 42  SER 42  337 337 SER SER A . n 
A 1 43  VAL 43  338 338 VAL VAL A . n 
A 1 44  LYS 44  339 339 LYS LYS A . n 
A 1 45  LYS 45  340 340 LYS LYS A . n 
A 1 46  GLU 46  341 341 GLU GLU A . n 
A 1 47  GLU 47  342 342 GLU GLU A . n 
A 1 48  GLU 48  343 343 GLU GLU A . n 
A 1 49  VAL 49  344 344 VAL VAL A . n 
A 1 50  LEU 50  345 345 LEU LEU A . n 
A 1 51  THR 51  346 346 THR THR A . n 
A 1 52  GLY 52  347 347 GLY GLY A . n 
A 1 53  ASN 53  348 348 ASN ASN A . n 
A 1 54  LEU 54  349 349 LEU LEU A . n 
A 1 55  GLN 55  350 350 GLN GLN A . n 
A 1 56  THR 56  351 351 THR THR A . n 
A 1 57  LEU 57  352 352 LEU LEU A . n 
A 1 58  LYS 58  353 353 LYS LYS A . n 
A 1 59  ILE 59  354 354 ILE ILE A . n 
A 1 60  ARG 60  355 355 ARG ARG A . n 
A 1 61  VAL 61  356 356 VAL VAL A . n 
A 1 62  HIS 62  357 357 HIS HIS A . n 
A 1 63  GLU 63  358 358 GLU GLU A . n 
A 1 64  GLY 64  359 359 GLY GLY A . n 
A 1 65  TYR 65  360 360 TYR TYR A . n 
A 1 66  GLU 66  361 361 GLU GLU A . n 
A 1 67  GLU 67  362 362 GLU GLU A . n 
A 1 68  PHE 68  363 363 PHE PHE A . n 
A 1 69  THR 69  364 364 THR THR A . n 
A 1 70  MET 70  365 365 MET MET A . n 
A 1 71  VAL 71  366 366 VAL VAL A . n 
A 1 72  GLY 72  367 367 GLY GLY A . n 
A 1 73  ARG 73  368 368 ARG ARG A . n 
A 1 74  ARG 74  369 369 ARG ARG A . n 
A 1 75  ALA 75  370 370 ALA ALA A . n 
A 1 76  THR 76  371 371 THR THR A . n 
A 1 77  ALA 77  372 372 ALA ALA A . n 
A 1 78  ILE 78  373 373 ILE ILE A . n 
A 1 79  LEU 79  374 374 LEU LEU A . n 
A 1 80  ARG 80  375 375 ARG ARG A . n 
A 1 81  LYS 81  376 376 LYS LYS A . n 
A 1 82  ALA 82  377 377 ALA ALA A . n 
A 1 83  THR 83  378 378 THR THR A . n 
A 1 84  ARG 84  379 379 ARG ARG A . n 
A 1 85  ARG 85  380 380 ARG ARG A . n 
A 1 86  LEU 86  381 381 LEU LEU A . n 
A 1 87  ILE 87  382 382 ILE ILE A . n 
A 1 88  GLN 88  383 383 GLN GLN A . n 
A 1 89  LEU 89  384 384 LEU LEU A . n 
A 1 90  ILE 90  385 385 ILE ILE A . n 
A 1 91  VAL 91  386 386 VAL VAL A . n 
A 1 92  SER 92  387 387 SER SER A . n 
A 1 93  GLY 93  388 388 GLY GLY A . n 
A 1 94  ARG 94  389 389 ARG ARG A . n 
A 1 95  ASP 95  390 390 ASP ASP A . n 
A 1 96  GLU 96  391 391 GLU GLU A . n 
A 1 97  GLN 97  392 392 GLN GLN A . n 
A 1 98  SER 98  393 393 SER SER A . n 
A 1 99  ILE 99  394 394 ILE ILE A . n 
A 1 100 ALA 100 395 395 ALA ALA A . n 
A 1 101 GLU 101 396 396 GLU GLU A . n 
A 1 102 ALA 102 397 397 ALA ALA A . n 
A 1 103 ILE 103 398 398 ILE ILE A . n 
A 1 104 ILE 104 399 399 ILE ILE A . n 
A 1 105 VAL 105 400 400 VAL VAL A . n 
A 1 106 ALA 106 401 401 ALA ALA A . n 
A 1 107 MET 107 402 402 MET MET A . n 
A 1 108 VAL 108 403 403 VAL VAL A . n 
A 1 109 PHE 109 404 404 PHE PHE A . n 
A 1 110 SER 110 405 405 SER SER A . n 
A 1 111 GLN 111 406 406 GLN GLN A . n 
A 1 112 GLU 112 407 407 GLU GLU A . n 
A 1 113 ASP 113 408 408 ASP ASP A . n 
A 1 114 CYS 114 409 409 CYS CYS A . n 
A 1 115 MET 115 410 410 MET MET A . n 
A 1 116 ILE 116 411 411 ILE ILE A . n 
A 1 117 LYS 117 412 412 LYS LYS A . n 
A 1 118 ALA 118 413 413 ALA ALA A . n 
A 1 119 VAL 119 414 414 VAL VAL A . n 
A 1 120 ARG 120 415 415 ARG ARG A . n 
A 1 121 GLY 121 416 416 GLY GLY A . n 
A 1 122 ASP 122 417 417 ASP ASP A . n 
A 1 123 LEU 123 418 418 LEU LEU A . n 
A 1 124 ASN 124 419 419 ASN ASN A . n 
A 1 125 PHE 125 420 420 PHE PHE A . n 
A 1 126 VAL 126 421 421 VAL VAL A . n 
A 1 127 ASN 127 422 422 ASN ASN A . n 
A 1 128 ARG 128 423 423 ARG ARG A . n 
A 1 129 ALA 129 424 424 ALA ALA A . n 
A 1 130 ASN 130 425 425 ASN ASN A . n 
A 1 131 GLN 131 426 426 GLN GLN A . n 
A 1 132 ARG 132 427 427 ARG ARG A . n 
A 1 133 LEU 133 428 428 LEU LEU A . n 
A 1 134 ASN 134 429 429 ASN ASN A . n 
A 1 135 PRO 135 430 430 PRO PRO A . n 
A 1 136 MET 136 431 431 MET MET A . n 
A 1 137 HIS 137 432 432 HIS HIS A . n 
A 1 138 GLN 138 433 433 GLN GLN A . n 
A 1 139 LEU 139 434 434 LEU LEU A . n 
A 1 140 LEU 140 435 435 LEU LEU A . n 
A 1 141 ARG 141 436 436 ARG ARG A . n 
A 1 142 HIS 142 437 437 HIS HIS A . n 
A 1 143 PHE 143 438 438 PHE PHE A . n 
A 1 144 GLN 144 439 439 GLN GLN A . n 
A 1 145 LYS 145 440 440 LYS LYS A . n 
A 1 146 ASP 146 441 441 ASP ASP A . n 
A 1 147 ALA 147 442 442 ALA ALA A . n 
A 1 148 LYS 148 443 443 LYS LYS A . n 
A 1 149 VAL 149 444 444 VAL VAL A . n 
A 1 150 LEU 150 445 445 LEU LEU A . n 
A 1 151 PHE 151 446 446 PHE PHE A . n 
A 1 152 GLN 152 447 447 GLN GLN A . n 
A 1 153 ASN 153 448 448 ASN ASN A . n 
A 1 154 TRP 154 449 449 TRP TRP A . n 
A 1 155 GLY 155 450 450 GLY GLY A . n 
A 1 156 ILE 156 451 451 ILE ILE A . n 
A 1 157 GLU 157 452 452 GLU GLU A . n 
A 1 158 PRO 158 453 453 PRO PRO A . n 
A 1 159 ILE 159 454 454 ILE ILE A . n 
A 1 160 ASP 160 455 455 ASP ASP A . n 
A 1 161 ASN 161 456 456 ASN ASN A . n 
A 1 162 VAL 162 457 457 VAL VAL A . n 
A 1 163 MET 163 458 458 MET MET A . n 
A 1 164 GLY 164 459 459 GLY GLY A . n 
A 1 165 MET 165 460 460 MET MET A . n 
A 1 166 ILE 166 461 461 ILE ILE A . n 
A 1 167 GLY 167 462 462 GLY GLY A . n 
A 1 168 ILE 168 463 463 ILE ILE A . n 
A 1 169 LEU 169 464 464 LEU LEU A . n 
A 1 170 PRO 170 465 465 PRO PRO A . n 
A 1 171 ASP 171 466 466 ASP ASP A . n 
A 1 172 MET 172 467 467 MET MET A . n 
A 1 173 THR 173 468 468 THR THR A . n 
A 1 174 PRO 174 469 469 PRO PRO A . n 
A 1 175 SER 175 470 470 SER SER A . n 
A 1 176 THR 176 471 471 THR THR A . n 
A 1 177 GLU 177 472 472 GLU GLU A . n 
A 1 178 MET 178 473 473 MET MET A . n 
A 1 179 SER 179 474 474 SER SER A . n 
A 1 180 LEU 180 475 475 LEU LEU A . n 
A 1 181 ARG 181 476 476 ARG ARG A . n 
A 1 182 GLY 182 477 477 GLY GLY A . n 
A 1 183 VAL 183 478 478 VAL VAL A . n 
A 1 184 ARG 184 479 479 ARG ARG A . n 
A 1 185 VAL 185 480 480 VAL VAL A . n 
A 1 186 SER 186 481 481 SER SER A . n 
A 1 187 LYS 187 482 482 LYS LYS A . n 
A 1 188 MET 188 483 483 MET MET A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        MGT 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   MGT 
_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 MGT 1  501 501 MGT MGT A . 
C 3 HOH 1  601 60  HOH HOH A . 
C 3 HOH 2  602 75  HOH HOH A . 
C 3 HOH 3  603 32  HOH HOH A . 
C 3 HOH 4  604 26  HOH HOH A . 
C 3 HOH 5  605 6   HOH HOH A . 
C 3 HOH 6  606 45  HOH HOH A . 
C 3 HOH 7  607 70  HOH HOH A . 
C 3 HOH 8  608 42  HOH HOH A . 
C 3 HOH 9  609 23  HOH HOH A . 
C 3 HOH 10 610 37  HOH HOH A . 
C 3 HOH 11 611 7   HOH HOH A . 
C 3 HOH 12 612 55  HOH HOH A . 
C 3 HOH 13 613 51  HOH HOH A . 
C 3 HOH 14 614 5   HOH HOH A . 
C 3 HOH 15 615 86  HOH HOH A . 
C 3 HOH 16 616 40  HOH HOH A . 
C 3 HOH 17 617 22  HOH HOH A . 
C 3 HOH 18 618 21  HOH HOH A . 
C 3 HOH 19 619 54  HOH HOH A . 
C 3 HOH 20 620 44  HOH HOH A . 
C 3 HOH 21 621 36  HOH HOH A . 
C 3 HOH 22 622 61  HOH HOH A . 
C 3 HOH 23 623 14  HOH HOH A . 
C 3 HOH 24 624 77  HOH HOH A . 
C 3 HOH 25 625 48  HOH HOH A . 
C 3 HOH 26 626 57  HOH HOH A . 
C 3 HOH 27 627 46  HOH HOH A . 
C 3 HOH 28 628 28  HOH HOH A . 
C 3 HOH 29 629 41  HOH HOH A . 
C 3 HOH 30 630 24  HOH HOH A . 
C 3 HOH 31 631 43  HOH HOH A . 
C 3 HOH 32 632 56  HOH HOH A . 
C 3 HOH 33 633 58  HOH HOH A . 
C 3 HOH 34 634 47  HOH HOH A . 
C 3 HOH 35 635 1   HOH HOH A . 
C 3 HOH 36 636 17  HOH HOH A . 
C 3 HOH 37 637 76  HOH HOH A . 
C 3 HOH 38 638 30  HOH HOH A . 
C 3 HOH 39 639 72  HOH HOH A . 
C 3 HOH 40 640 59  HOH HOH A . 
C 3 HOH 41 641 9   HOH HOH A . 
C 3 HOH 42 642 68  HOH HOH A . 
C 3 HOH 43 643 62  HOH HOH A . 
C 3 HOH 44 644 67  HOH HOH A . 
C 3 HOH 45 645 35  HOH HOH A . 
C 3 HOH 46 646 20  HOH HOH A . 
C 3 HOH 47 647 81  HOH HOH A . 
C 3 HOH 48 648 65  HOH HOH A . 
C 3 HOH 49 649 15  HOH HOH A . 
C 3 HOH 50 650 3   HOH HOH A . 
C 3 HOH 51 651 80  HOH HOH A . 
C 3 HOH 52 652 74  HOH HOH A . 
C 3 HOH 53 653 10  HOH HOH A . 
C 3 HOH 54 654 33  HOH HOH A . 
C 3 HOH 55 655 50  HOH HOH A . 
C 3 HOH 56 656 71  HOH HOH A . 
C 3 HOH 57 657 83  HOH HOH A . 
C 3 HOH 58 658 49  HOH HOH A . 
C 3 HOH 59 659 19  HOH HOH A . 
C 3 HOH 60 660 2   HOH HOH A . 
C 3 HOH 61 661 13  HOH HOH A . 
C 3 HOH 62 662 63  HOH HOH A . 
C 3 HOH 63 663 4   HOH HOH A . 
C 3 HOH 64 664 29  HOH HOH A . 
C 3 HOH 65 665 79  HOH HOH A . 
C 3 HOH 66 666 53  HOH HOH A . 
C 3 HOH 67 667 82  HOH HOH A . 
C 3 HOH 68 668 85  HOH HOH A . 
C 3 HOH 69 669 38  HOH HOH A . 
C 3 HOH 70 670 39  HOH HOH A . 
C 3 HOH 71 671 84  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       ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.21.2-5419_9999 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .                2 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.21.2-5419_9999 3 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XSCALE ? ? ? .                4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9I2O 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     81.750 
_cell.length_a_esd                 ? 
_cell.length_b                     81.750 
_cell.length_b_esd                 ? 
_cell.length_c                     55.009 
_cell.length_c_esd                 ? 
_cell.volume                       318375.694 
_cell.volume_esd                   ? 
_cell.Z_PDB                        6 
_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                         9I2O 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                170 
_symmetry.space_group_name_Hall            'P 65' 
_symmetry.space_group_name_H-M             'P 65' 
_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                   9I2O 
_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             2.48 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          50.45 
_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' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    
;The PB2 cap-binding domain (8 mg/ml) in complex with m7GTP was mixed with crystallization solution (20% w/v PEG 6000, 1 M lithium chloride, 0.1 M tri-sodium citrate at pH 4.0) at a ratio of 3:2 and incubated in a sitting drop vapor diffusion plate.
;
_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 EIGER2 X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2024-08-04 
_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   1.033270 
_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                        'PETRA III, DESY BEAMLINE P11' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.033270 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   P11 
_diffrn_source.pdbx_synchrotron_site       'PETRA III, DESY' 
# 
_reflns.B_iso_Wilson_estimate                          29.70 
_reflns.entry_id                                       9I2O 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.72 
_reflns.d_resolution_low                               43.44 
_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                                     43754 
_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                           100 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                10.4 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          9.54 
_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                                0.014 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.999 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.72 
_reflns_shell.d_res_low                                     1.82 
_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                             3589 
_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                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.618 
_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               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               36.79 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_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                                 9I2O 
_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                            1.72 
_refine.ls_d_res_low                             43.44 
_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                     43708 
_refine.ls_number_reflns_R_free                  3934 
_refine.ls_number_reflns_R_work                  39774 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.83 
_refine.ls_percent_reflns_R_free                 9.00 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1846 
_refine.ls_R_factor_R_free                       0.2059 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1824 
_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                    'FLAT BULK SOLVENT MODEL' 
_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                          1.35 
_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               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'GeoStd + Monomer Library + CDL v1.2' 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.1000 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.9000 
_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                 26.4893 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.2888 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.72 
_refine_hist.d_res_low                        43.44 
_refine_hist.number_atoms_solvent             71 
_refine_hist.number_atoms_total               1394 
_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        1290 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         33 
_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' ? 0.0076  ? 1386 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.7940  ? 1872 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0598  ? 207  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0079  ? 244  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 16.4443 ? 547  ? f_dihedral_angle_d ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.72 1.74  . . 139 1349 96.81  . . . . 0.4170 . . . . . . . . . . . 0.4029 
'X-RAY DIFFRACTION' 1.74 1.76  . . 136 1446 99.50  . . . . 0.3760 . . . . . . . . . . . 0.4312 
'X-RAY DIFFRACTION' 1.76 1.78  . . 142 1423 99.55  . . . . 0.3387 . . . . . . . . . . . 0.3644 
'X-RAY DIFFRACTION' 1.78 1.81  . . 142 1412 100.00 . . . . 0.3219 . . . . . . . . . . . 0.3336 
'X-RAY DIFFRACTION' 1.81 1.84  . . 140 1424 99.94  . . . . 0.3066 . . . . . . . . . . . 0.3240 
'X-RAY DIFFRACTION' 1.84 1.86  . . 140 1447 100.00 . . . . 0.2787 . . . . . . . . . . . 0.3116 
'X-RAY DIFFRACTION' 1.86 1.89  . . 140 1413 100.00 . . . . 0.2797 . . . . . . . . . . . 0.3019 
'X-RAY DIFFRACTION' 1.89 1.92  . . 138 1387 100.00 . . . . 0.2878 . . . . . . . . . . . 0.2726 
'X-RAY DIFFRACTION' 1.92 1.96  . . 146 1433 99.87  . . . . 0.2493 . . . . . . . . . . . 0.2562 
'X-RAY DIFFRACTION' 1.96 1.99  . . 140 1443 100.00 . . . . 0.2358 . . . . . . . . . . . 0.2736 
'X-RAY DIFFRACTION' 1.99 2.03  . . 141 1420 100.00 . . . . 0.1925 . . . . . . . . . . . 0.2613 
'X-RAY DIFFRACTION' 2.03 2.07  . . 142 1401 100.00 . . . . 0.1971 . . . . . . . . . . . 0.2190 
'X-RAY DIFFRACTION' 2.07 2.12  . . 143 1421 99.94  . . . . 0.1860 . . . . . . . . . . . 0.1963 
'X-RAY DIFFRACTION' 2.12 2.17  . . 137 1421 100.00 . . . . 0.1694 . . . . . . . . . . . 0.2810 
'X-RAY DIFFRACTION' 2.17 2.22  . . 142 1441 99.87  . . . . 0.1829 . . . . . . . . . . . 0.2764 
'X-RAY DIFFRACTION' 2.22 2.28  . . 142 1417 100.00 . . . . 0.1779 . . . . . . . . . . . 0.2171 
'X-RAY DIFFRACTION' 2.28 2.35  . . 130 1439 100.00 . . . . 0.1678 . . . . . . . . . . . 0.2017 
'X-RAY DIFFRACTION' 2.35 2.42  . . 141 1415 100.00 . . . . 0.1825 . . . . . . . . . . . 0.2372 
'X-RAY DIFFRACTION' 2.42 2.51  . . 133 1408 100.00 . . . . 0.1831 . . . . . . . . . . . 0.1635 
'X-RAY DIFFRACTION' 2.51 2.61  . . 146 1444 100.00 . . . . 0.1785 . . . . . . . . . . . 0.2162 
'X-RAY DIFFRACTION' 2.61 2.73  . . 150 1433 100.00 . . . . 0.1787 . . . . . . . . . . . 0.2058 
'X-RAY DIFFRACTION' 2.73 2.87  . . 136 1393 100.00 . . . . 0.1970 . . . . . . . . . . . 0.2339 
'X-RAY DIFFRACTION' 2.87 3.05  . . 144 1438 99.87  . . . . 0.1823 . . . . . . . . . . . 0.2239 
'X-RAY DIFFRACTION' 3.05 3.28  . . 132 1419 100.00 . . . . 0.1784 . . . . . . . . . . . 0.1829 
'X-RAY DIFFRACTION' 3.29 3.62  . . 127 1440 100.00 . . . . 0.1700 . . . . . . . . . . . 0.1858 
'X-RAY DIFFRACTION' 3.62 4.14  . . 150 1410 100.00 . . . . 0.1493 . . . . . . . . . . . 0.1602 
'X-RAY DIFFRACTION' 4.14 5.21  . . 149 1414 99.94  . . . . 0.1428 . . . . . . . . . . . 0.1562 
'X-RAY DIFFRACTION' 5.22 43.44 . . 146 1423 100.00 . . . . 0.1662 . . . . . . . . . . . 0.1836 
# 
_struct.entry_id                     9I2O 
_struct.title                        'PB2 cap-binding domain of human pathogenic influenza A virus H5N1 in complex with m7GTP' 
_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        9I2O 
_struct_keywords.text            'avian influenza, RNA capping, polymerase complex, drug development, RNA BINDING PROTEIN' 
_struct_keywords.pdbx_keywords   'RNA BINDING PROTEIN' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    PB2_I02A6 
_struct_ref.pdbx_db_accession          Q6DNL8 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;RISSSFSFGGFTFKRTSGSSVKKEEEVLTGNLQTLKIRVHEGYEEFTMVGRRATAILRKATRRLIQLIVSGRDEQSIAEA
IIVAMVFSQEDCMIKAVRGDLNFVNRANQRLNPMHQLLRHFQKDAKVLFQNWGIEPIDNVMGMIGILPDMTPSTEMSLRG
VRVSKM
;
_struct_ref.pdbx_align_begin           318 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9I2O 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 23 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 188 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             Q6DNL8 
_struct_ref_seq.db_align_beg                  318 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  483 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       318 
_struct_ref_seq.pdbx_auth_seq_align_end       483 
# 
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 9I2O MET A 1  ? UNP Q6DNL8 ? ? 'initiating methionine' 296 1  
1 9I2O GLY A 2  ? UNP Q6DNL8 ? ? 'expression tag'        297 2  
1 9I2O SER A 3  ? UNP Q6DNL8 ? ? 'expression tag'        298 3  
1 9I2O SER A 4  ? UNP Q6DNL8 ? ? 'expression tag'        299 4  
1 9I2O HIS A 5  ? UNP Q6DNL8 ? ? 'expression tag'        300 5  
1 9I2O HIS A 6  ? UNP Q6DNL8 ? ? 'expression tag'        301 6  
1 9I2O HIS A 7  ? UNP Q6DNL8 ? ? 'expression tag'        302 7  
1 9I2O HIS A 8  ? UNP Q6DNL8 ? ? 'expression tag'        303 8  
1 9I2O HIS A 9  ? UNP Q6DNL8 ? ? 'expression tag'        304 9  
1 9I2O HIS A 10 ? UNP Q6DNL8 ? ? 'expression tag'        305 10 
1 9I2O SER A 11 ? UNP Q6DNL8 ? ? 'expression tag'        306 11 
1 9I2O SER A 12 ? UNP Q6DNL8 ? ? 'expression tag'        307 12 
1 9I2O GLY A 13 ? UNP Q6DNL8 ? ? 'expression tag'        308 13 
1 9I2O GLU A 14 ? UNP Q6DNL8 ? ? 'expression tag'        309 14 
1 9I2O ASN A 15 ? UNP Q6DNL8 ? ? 'expression tag'        310 15 
1 9I2O LEU A 16 ? UNP Q6DNL8 ? ? 'expression tag'        311 16 
1 9I2O TYR A 17 ? UNP Q6DNL8 ? ? 'expression tag'        312 17 
1 9I2O PHE A 18 ? UNP Q6DNL8 ? ? 'expression tag'        313 18 
1 9I2O GLN A 19 ? UNP Q6DNL8 ? ? 'expression tag'        314 19 
1 9I2O GLY A 20 ? UNP Q6DNL8 ? ? 'expression tag'        315 20 
1 9I2O HIS A 21 ? UNP Q6DNL8 ? ? 'expression tag'        316 21 
1 9I2O MET A 22 ? UNP Q6DNL8 ? ? 'expression tag'        317 22 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_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)' 830  ? 
1 MORE         -3   ? 
1 'SSA (A^2)'  8890 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'light scattering' 
_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 ASP A 95  ? GLN A 111 ? ASP A 390 GLN A 406 1 ? 17 
HELX_P HELX_P2 AA2 GLU A 112 ? LYS A 117 ? GLU A 407 LYS A 412 1 ? 6  
HELX_P HELX_P3 AA3 ASN A 127 ? GLN A 131 ? ASN A 422 GLN A 426 5 ? 5  
HELX_P HELX_P4 AA4 ASN A 134 ? ASP A 146 ? ASN A 429 ASP A 441 1 ? 13 
HELX_P HELX_P5 AA5 ALA A 147 ? GLY A 155 ? ALA A 442 GLY A 450 1 ? 9  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 8 ? 
AA2 ? 2 ? 
AA3 ? 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 
AA1 5 6 ? parallel      
AA1 6 7 ? anti-parallel 
AA1 7 8 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA3 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 SER A 27  ? PHE A 30  ? SER A 322 PHE A 325 
AA1 2 PHE A 33  ? GLY A 40  ? PHE A 328 GLY A 335 
AA1 3 GLU A 66  ? VAL A 71  ? GLU A 361 VAL A 366 
AA1 4 ALA A 75  ? ALA A 82  ? ALA A 370 ALA A 377 
AA1 5 ARG A 85  ? GLY A 93  ? ARG A 380 GLY A 388 
AA1 6 VAL A 183 ? SER A 186 ? VAL A 478 SER A 481 
AA1 7 MET A 165 ? ILE A 168 ? MET A 460 ILE A 463 
AA1 8 PRO A 174 ? SER A 175 ? PRO A 469 SER A 470 
AA2 1 VAL A 43  ? LEU A 50  ? VAL A 338 LEU A 345 
AA2 2 THR A 56  ? GLU A 63  ? THR A 351 GLU A 358 
AA3 1 ILE A 156 ? PRO A 158 ? ILE A 451 PRO A 453 
AA3 2 MET A 178 ? LEU A 180 ? MET A 473 LEU A 475 
# 
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 PHE A 28  ? N PHE A 323 O PHE A 35  ? O PHE A 330 
AA1 2 3 N THR A 34  ? N THR A 329 O VAL A 71  ? O VAL A 366 
AA1 3 4 N PHE A 68  ? N PHE A 363 O LEU A 79  ? O LEU A 374 
AA1 4 5 N ARG A 80  ? N ARG A 375 O GLN A 88  ? O GLN A 383 
AA1 5 6 N VAL A 91  ? N VAL A 386 O SER A 186 ? O SER A 481 
AA1 6 7 O VAL A 185 ? O VAL A 480 N ILE A 166 ? N ILE A 461 
AA1 7 8 N GLY A 167 ? N GLY A 462 O SER A 175 ? O SER A 470 
AA2 1 2 N VAL A 43  ? N VAL A 338 O GLU A 63  ? O GLU A 358 
AA3 1 2 N GLU A 157 ? N GLU A 452 O SER A 179 ? O SER A 474 
# 
_pdbx_entry_details.entry_id                   9I2O 
_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   N 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z         
2 x-y,x,z+5/6   
3 y,-x+y,z+1/6  
4 -y,x-y,z+2/3  
5 -x+y,-x,z+1/3 
6 -x,-y,z+1/2   
# 
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 296 ? A MET 1  
2  1 Y 1 A GLY 297 ? A GLY 2  
3  1 Y 1 A SER 298 ? A SER 3  
4  1 Y 1 A SER 299 ? A SER 4  
5  1 Y 1 A HIS 300 ? A HIS 5  
6  1 Y 1 A HIS 301 ? A HIS 6  
7  1 Y 1 A HIS 302 ? A HIS 7  
8  1 Y 1 A HIS 303 ? A HIS 8  
9  1 Y 1 A HIS 304 ? A HIS 9  
10 1 Y 1 A HIS 305 ? A HIS 10 
11 1 Y 1 A SER 306 ? A SER 11 
12 1 Y 1 A SER 307 ? A SER 12 
13 1 Y 1 A GLY 308 ? A GLY 13 
14 1 Y 1 A GLU 309 ? A GLU 14 
15 1 Y 1 A ASN 310 ? A ASN 15 
16 1 Y 1 A LEU 311 ? A LEU 16 
17 1 Y 1 A TYR 312 ? A TYR 17 
18 1 Y 1 A PHE 313 ? A PHE 18 
19 1 Y 1 A GLN 314 ? A GLN 19 
20 1 Y 1 A GLY 315 ? A GLY 20 
21 1 Y 1 A HIS 316 ? A HIS 21 
22 1 Y 1 A MET 317 ? A MET 22 
23 1 Y 1 A ARG 318 ? A ARG 23 
24 1 Y 1 A ILE 319 ? A ILE 24 
25 1 Y 1 A SER 320 ? A SER 25 
# 
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 
ALA N      N N N 1   
ALA CA     C N S 2   
ALA C      C N N 3   
ALA O      O N N 4   
ALA CB     C N N 5   
ALA OXT    O N N 6   
ALA H      H N N 7   
ALA H2     H N N 8   
ALA HA     H N N 9   
ALA HB1    H N N 10  
ALA HB2    H N N 11  
ALA HB3    H N N 12  
ALA HXT    H N N 13  
ARG N      N N N 14  
ARG CA     C N S 15  
ARG C      C N N 16  
ARG O      O N N 17  
ARG CB     C N N 18  
ARG CG     C N N 19  
ARG CD     C N N 20  
ARG NE     N N N 21  
ARG CZ     C N N 22  
ARG NH1    N N N 23  
ARG NH2    N N N 24  
ARG OXT    O N N 25  
ARG H      H N N 26  
ARG H2     H N N 27  
ARG HA     H N N 28  
ARG HB2    H N N 29  
ARG HB3    H N N 30  
ARG HG2    H N N 31  
ARG HG3    H N N 32  
ARG HD2    H N N 33  
ARG HD3    H N N 34  
ARG HE     H N N 35  
ARG HH11   H N N 36  
ARG HH12   H N N 37  
ARG HH21   H N N 38  
ARG HH22   H N N 39  
ARG HXT    H N N 40  
ASN N      N N N 41  
ASN CA     C N S 42  
ASN C      C N N 43  
ASN O      O N N 44  
ASN CB     C N N 45  
ASN CG     C N N 46  
ASN OD1    O N N 47  
ASN ND2    N N N 48  
ASN OXT    O N N 49  
ASN H      H N N 50  
ASN H2     H N N 51  
ASN HA     H N N 52  
ASN HB2    H N N 53  
ASN HB3    H N N 54  
ASN HD21   H N N 55  
ASN HD22   H N N 56  
ASN HXT    H N N 57  
ASP N      N N N 58  
ASP CA     C N S 59  
ASP C      C N N 60  
ASP O      O N N 61  
ASP CB     C N N 62  
ASP CG     C N N 63  
ASP OD1    O N N 64  
ASP OD2    O N N 65  
ASP OXT    O N N 66  
ASP H      H N N 67  
ASP H2     H N N 68  
ASP HA     H N N 69  
ASP HB2    H N N 70  
ASP HB3    H N N 71  
ASP HD2    H N N 72  
ASP HXT    H N N 73  
CYS N      N N N 74  
CYS CA     C N R 75  
CYS C      C N N 76  
CYS O      O N N 77  
CYS CB     C N N 78  
CYS SG     S N N 79  
CYS OXT    O N N 80  
CYS H      H N N 81  
CYS H2     H N N 82  
CYS HA     H N N 83  
CYS HB2    H N N 84  
CYS HB3    H N N 85  
CYS HG     H N N 86  
CYS HXT    H N N 87  
GLN N      N N N 88  
GLN CA     C N S 89  
GLN C      C N N 90  
GLN O      O N N 91  
GLN CB     C N N 92  
GLN CG     C N N 93  
GLN CD     C N N 94  
GLN OE1    O N N 95  
GLN NE2    N N N 96  
GLN OXT    O N N 97  
GLN H      H N N 98  
GLN H2     H N N 99  
GLN HA     H N N 100 
GLN HB2    H N N 101 
GLN HB3    H N N 102 
GLN HG2    H N N 103 
GLN HG3    H N N 104 
GLN HE21   H N N 105 
GLN HE22   H N N 106 
GLN HXT    H N N 107 
GLU N      N N N 108 
GLU CA     C N S 109 
GLU C      C N N 110 
GLU O      O N N 111 
GLU CB     C N N 112 
GLU CG     C N N 113 
GLU CD     C N N 114 
GLU OE1    O N N 115 
GLU OE2    O N N 116 
GLU OXT    O N N 117 
GLU H      H N N 118 
GLU H2     H N N 119 
GLU HA     H N N 120 
GLU HB2    H N N 121 
GLU HB3    H N N 122 
GLU HG2    H N N 123 
GLU HG3    H N N 124 
GLU HE2    H N N 125 
GLU HXT    H N N 126 
GLY N      N N N 127 
GLY CA     C N N 128 
GLY C      C N N 129 
GLY O      O N N 130 
GLY OXT    O N N 131 
GLY H      H N N 132 
GLY H2     H N N 133 
GLY HA2    H N N 134 
GLY HA3    H N N 135 
GLY HXT    H N N 136 
HIS N      N N N 137 
HIS CA     C N S 138 
HIS C      C N N 139 
HIS O      O N N 140 
HIS CB     C N N 141 
HIS CG     C Y N 142 
HIS ND1    N Y N 143 
HIS CD2    C Y N 144 
HIS CE1    C Y N 145 
HIS NE2    N Y N 146 
HIS OXT    O N N 147 
HIS H      H N N 148 
HIS H2     H N N 149 
HIS HA     H N N 150 
HIS HB2    H N N 151 
HIS HB3    H N N 152 
HIS HD1    H N N 153 
HIS HD2    H N N 154 
HIS HE1    H N N 155 
HIS HE2    H N N 156 
HIS HXT    H N N 157 
HOH O      O N N 158 
HOH H1     H N N 159 
HOH H2     H N N 160 
ILE N      N N N 161 
ILE CA     C N S 162 
ILE C      C N N 163 
ILE O      O N N 164 
ILE CB     C N S 165 
ILE CG1    C N N 166 
ILE CG2    C N N 167 
ILE CD1    C N N 168 
ILE OXT    O N N 169 
ILE H      H N N 170 
ILE H2     H N N 171 
ILE HA     H N N 172 
ILE HB     H N N 173 
ILE HG12   H N N 174 
ILE HG13   H N N 175 
ILE HG21   H N N 176 
ILE HG22   H N N 177 
ILE HG23   H N N 178 
ILE HD11   H N N 179 
ILE HD12   H N N 180 
ILE HD13   H N N 181 
ILE HXT    H N N 182 
LEU N      N N N 183 
LEU CA     C N S 184 
LEU C      C N N 185 
LEU O      O N N 186 
LEU CB     C N N 187 
LEU CG     C N N 188 
LEU CD1    C N N 189 
LEU CD2    C N N 190 
LEU OXT    O N N 191 
LEU H      H N N 192 
LEU H2     H N N 193 
LEU HA     H N N 194 
LEU HB2    H N N 195 
LEU HB3    H N N 196 
LEU HG     H N N 197 
LEU HD11   H N N 198 
LEU HD12   H N N 199 
LEU HD13   H N N 200 
LEU HD21   H N N 201 
LEU HD22   H N N 202 
LEU HD23   H N N 203 
LEU HXT    H N N 204 
LYS N      N N N 205 
LYS CA     C N S 206 
LYS C      C N N 207 
LYS O      O N N 208 
LYS CB     C N N 209 
LYS CG     C N N 210 
LYS CD     C N N 211 
LYS CE     C N N 212 
LYS NZ     N N N 213 
LYS OXT    O N N 214 
LYS H      H N N 215 
LYS H2     H N N 216 
LYS HA     H N N 217 
LYS HB2    H N N 218 
LYS HB3    H N N 219 
LYS HG2    H N N 220 
LYS HG3    H N N 221 
LYS HD2    H N N 222 
LYS HD3    H N N 223 
LYS HE2    H N N 224 
LYS HE3    H N N 225 
LYS HZ1    H N N 226 
LYS HZ2    H N N 227 
LYS HZ3    H N N 228 
LYS HXT    H N N 229 
MET N      N N N 230 
MET CA     C N S 231 
MET C      C N N 232 
MET O      O N N 233 
MET CB     C N N 234 
MET CG     C N N 235 
MET SD     S N N 236 
MET CE     C N N 237 
MET OXT    O N N 238 
MET H      H N N 239 
MET H2     H N N 240 
MET HA     H N N 241 
MET HB2    H N N 242 
MET HB3    H N N 243 
MET HG2    H N N 244 
MET HG3    H N N 245 
MET HE1    H N N 246 
MET HE2    H N N 247 
MET HE3    H N N 248 
MET HXT    H N N 249 
MGT PG     P N N 250 
MGT O1G    O N N 251 
MGT O2G    O N N 252 
MGT O3G    O N N 253 
MGT O3B    O N N 254 
MGT PB     P N R 255 
MGT O1B    O N N 256 
MGT O2B    O N N 257 
MGT O3A    O N N 258 
MGT PA     P N S 259 
MGT O1A    O N N 260 
MGT O2A    O N N 261 
MGT "O5'"  O N N 262 
MGT "C5'"  C N N 263 
MGT "C4'"  C N R 264 
MGT "O4'"  O N N 265 
MGT "C3'"  C N S 266 
MGT "O3'"  O N N 267 
MGT "C2'"  C N R 268 
MGT "O2'"  O N N 269 
MGT "C1'"  C N R 270 
MGT N9     N N N 271 
MGT C8     C N N 272 
MGT N7     N N N 273 
MGT CM7    C N N 274 
MGT C5     C N N 275 
MGT C6     C N N 276 
MGT O6     O N N 277 
MGT N1     N N N 278 
MGT C2     C N N 279 
MGT N2     N N N 280 
MGT N3     N N N 281 
MGT C4     C N N 282 
MGT HOG2   H N N 283 
MGT HOG3   H N N 284 
MGT HOB2   H N N 285 
MGT HOA2   H N N 286 
MGT "H5'1" H N N 287 
MGT "H5'2" H N N 288 
MGT "H4'"  H N N 289 
MGT "H3'"  H N N 290 
MGT "HO3'" H N N 291 
MGT "H2'"  H N N 292 
MGT "HO2'" H N N 293 
MGT "H1'"  H N N 294 
MGT H81    H N N 295 
MGT H82    H N N 296 
MGT HM71   H N N 297 
MGT HM72   H N N 298 
MGT HM73   H N N 299 
MGT HN1    H N N 300 
MGT HN21   H N N 301 
MGT HN22   H N N 302 
PHE N      N N N 303 
PHE CA     C N S 304 
PHE C      C N N 305 
PHE O      O N N 306 
PHE CB     C N N 307 
PHE CG     C Y N 308 
PHE CD1    C Y N 309 
PHE CD2    C Y N 310 
PHE CE1    C Y N 311 
PHE CE2    C Y N 312 
PHE CZ     C Y N 313 
PHE OXT    O N N 314 
PHE H      H N N 315 
PHE H2     H N N 316 
PHE HA     H N N 317 
PHE HB2    H N N 318 
PHE HB3    H N N 319 
PHE HD1    H N N 320 
PHE HD2    H N N 321 
PHE HE1    H N N 322 
PHE HE2    H N N 323 
PHE HZ     H N N 324 
PHE HXT    H N N 325 
PRO N      N N N 326 
PRO CA     C N S 327 
PRO C      C N N 328 
PRO O      O N N 329 
PRO CB     C N N 330 
PRO CG     C N N 331 
PRO CD     C N N 332 
PRO OXT    O N N 333 
PRO H      H N N 334 
PRO HA     H N N 335 
PRO HB2    H N N 336 
PRO HB3    H N N 337 
PRO HG2    H N N 338 
PRO HG3    H N N 339 
PRO HD2    H N N 340 
PRO HD3    H N N 341 
PRO HXT    H N N 342 
SER N      N N N 343 
SER CA     C N S 344 
SER C      C N N 345 
SER O      O N N 346 
SER CB     C N N 347 
SER OG     O N N 348 
SER OXT    O N N 349 
SER H      H N N 350 
SER H2     H N N 351 
SER HA     H N N 352 
SER HB2    H N N 353 
SER HB3    H N N 354 
SER HG     H N N 355 
SER HXT    H N N 356 
THR N      N N N 357 
THR CA     C N S 358 
THR C      C N N 359 
THR O      O N N 360 
THR CB     C N R 361 
THR OG1    O N N 362 
THR CG2    C N N 363 
THR OXT    O N N 364 
THR H      H N N 365 
THR H2     H N N 366 
THR HA     H N N 367 
THR HB     H N N 368 
THR HG1    H N N 369 
THR HG21   H N N 370 
THR HG22   H N N 371 
THR HG23   H N N 372 
THR HXT    H N N 373 
TRP N      N N N 374 
TRP CA     C N S 375 
TRP C      C N N 376 
TRP O      O N N 377 
TRP CB     C N N 378 
TRP CG     C Y N 379 
TRP CD1    C Y N 380 
TRP CD2    C Y N 381 
TRP NE1    N Y N 382 
TRP CE2    C Y N 383 
TRP CE3    C Y N 384 
TRP CZ2    C Y N 385 
TRP CZ3    C Y N 386 
TRP CH2    C Y N 387 
TRP OXT    O N N 388 
TRP H      H N N 389 
TRP H2     H N N 390 
TRP HA     H N N 391 
TRP HB2    H N N 392 
TRP HB3    H N N 393 
TRP HD1    H N N 394 
TRP HE1    H N N 395 
TRP HE3    H N N 396 
TRP HZ2    H N N 397 
TRP HZ3    H N N 398 
TRP HH2    H N N 399 
TRP HXT    H N N 400 
TYR N      N N N 401 
TYR CA     C N S 402 
TYR C      C N N 403 
TYR O      O N N 404 
TYR CB     C N N 405 
TYR CG     C Y N 406 
TYR CD1    C Y N 407 
TYR CD2    C Y N 408 
TYR CE1    C Y N 409 
TYR CE2    C Y N 410 
TYR CZ     C Y N 411 
TYR OH     O N N 412 
TYR OXT    O N N 413 
TYR H      H N N 414 
TYR H2     H N N 415 
TYR HA     H N N 416 
TYR HB2    H N N 417 
TYR HB3    H N N 418 
TYR HD1    H N N 419 
TYR HD2    H N N 420 
TYR HE1    H N N 421 
TYR HE2    H N N 422 
TYR HH     H N N 423 
TYR HXT    H N N 424 
VAL N      N N N 425 
VAL CA     C N S 426 
VAL C      C N N 427 
VAL O      O N N 428 
VAL CB     C N N 429 
VAL CG1    C N N 430 
VAL CG2    C N N 431 
VAL OXT    O N N 432 
VAL H      H N N 433 
VAL H2     H N N 434 
VAL HA     H N N 435 
VAL HB     H N N 436 
VAL HG11   H N N 437 
VAL HG12   H N N 438 
VAL HG13   H N N 439 
VAL HG21   H N N 440 
VAL HG22   H N N 441 
VAL HG23   H N N 442 
VAL HXT    H N N 443 
# 
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 
ALA N     CA     sing N N 1   
ALA N     H      sing N N 2   
ALA N     H2     sing N N 3   
ALA CA    C      sing N N 4   
ALA CA    CB     sing N N 5   
ALA CA    HA     sing N N 6   
ALA C     O      doub N N 7   
ALA C     OXT    sing N N 8   
ALA CB    HB1    sing N N 9   
ALA CB    HB2    sing N N 10  
ALA CB    HB3    sing N N 11  
ALA OXT   HXT    sing N N 12  
ARG N     CA     sing N N 13  
ARG N     H      sing N N 14  
ARG N     H2     sing N N 15  
ARG CA    C      sing N N 16  
ARG CA    CB     sing N N 17  
ARG CA    HA     sing N N 18  
ARG C     O      doub N N 19  
ARG C     OXT    sing N N 20  
ARG CB    CG     sing N N 21  
ARG CB    HB2    sing N N 22  
ARG CB    HB3    sing N N 23  
ARG CG    CD     sing N N 24  
ARG CG    HG2    sing N N 25  
ARG CG    HG3    sing N N 26  
ARG CD    NE     sing N N 27  
ARG CD    HD2    sing N N 28  
ARG CD    HD3    sing N N 29  
ARG NE    CZ     sing N N 30  
ARG NE    HE     sing N N 31  
ARG CZ    NH1    sing N N 32  
ARG CZ    NH2    doub N N 33  
ARG NH1   HH11   sing N N 34  
ARG NH1   HH12   sing N N 35  
ARG NH2   HH21   sing N N 36  
ARG NH2   HH22   sing N N 37  
ARG OXT   HXT    sing N N 38  
ASN N     CA     sing N N 39  
ASN N     H      sing N N 40  
ASN N     H2     sing N N 41  
ASN CA    C      sing N N 42  
ASN CA    CB     sing N N 43  
ASN CA    HA     sing N N 44  
ASN C     O      doub N N 45  
ASN C     OXT    sing N N 46  
ASN CB    CG     sing N N 47  
ASN CB    HB2    sing N N 48  
ASN CB    HB3    sing N N 49  
ASN CG    OD1    doub N N 50  
ASN CG    ND2    sing N N 51  
ASN ND2   HD21   sing N N 52  
ASN ND2   HD22   sing N N 53  
ASN OXT   HXT    sing N N 54  
ASP N     CA     sing N N 55  
ASP N     H      sing N N 56  
ASP N     H2     sing N N 57  
ASP CA    C      sing N N 58  
ASP CA    CB     sing N N 59  
ASP CA    HA     sing N N 60  
ASP C     O      doub N N 61  
ASP C     OXT    sing N N 62  
ASP CB    CG     sing N N 63  
ASP CB    HB2    sing N N 64  
ASP CB    HB3    sing N N 65  
ASP CG    OD1    doub N N 66  
ASP CG    OD2    sing N N 67  
ASP OD2   HD2    sing N N 68  
ASP OXT   HXT    sing N N 69  
CYS N     CA     sing N N 70  
CYS N     H      sing N N 71  
CYS N     H2     sing N N 72  
CYS CA    C      sing N N 73  
CYS CA    CB     sing N N 74  
CYS CA    HA     sing N N 75  
CYS C     O      doub N N 76  
CYS C     OXT    sing N N 77  
CYS CB    SG     sing N N 78  
CYS CB    HB2    sing N N 79  
CYS CB    HB3    sing N N 80  
CYS SG    HG     sing N N 81  
CYS OXT   HXT    sing N N 82  
GLN N     CA     sing N N 83  
GLN N     H      sing N N 84  
GLN N     H2     sing N N 85  
GLN CA    C      sing N N 86  
GLN CA    CB     sing N N 87  
GLN CA    HA     sing N N 88  
GLN C     O      doub N N 89  
GLN C     OXT    sing N N 90  
GLN CB    CG     sing N N 91  
GLN CB    HB2    sing N N 92  
GLN CB    HB3    sing N N 93  
GLN CG    CD     sing N N 94  
GLN CG    HG2    sing N N 95  
GLN CG    HG3    sing N N 96  
GLN CD    OE1    doub N N 97  
GLN CD    NE2    sing N N 98  
GLN NE2   HE21   sing N N 99  
GLN NE2   HE22   sing N N 100 
GLN OXT   HXT    sing N N 101 
GLU N     CA     sing N N 102 
GLU N     H      sing N N 103 
GLU N     H2     sing N N 104 
GLU CA    C      sing N N 105 
GLU CA    CB     sing N N 106 
GLU CA    HA     sing N N 107 
GLU C     O      doub N N 108 
GLU C     OXT    sing N N 109 
GLU CB    CG     sing N N 110 
GLU CB    HB2    sing N N 111 
GLU CB    HB3    sing N N 112 
GLU CG    CD     sing N N 113 
GLU CG    HG2    sing N N 114 
GLU CG    HG3    sing N N 115 
GLU CD    OE1    doub N N 116 
GLU CD    OE2    sing N N 117 
GLU OE2   HE2    sing N N 118 
GLU OXT   HXT    sing N N 119 
GLY N     CA     sing N N 120 
GLY N     H      sing N N 121 
GLY N     H2     sing N N 122 
GLY CA    C      sing N N 123 
GLY CA    HA2    sing N N 124 
GLY CA    HA3    sing N N 125 
GLY C     O      doub N N 126 
GLY C     OXT    sing N N 127 
GLY OXT   HXT    sing N N 128 
HIS N     CA     sing N N 129 
HIS N     H      sing N N 130 
HIS N     H2     sing N N 131 
HIS CA    C      sing N N 132 
HIS CA    CB     sing N N 133 
HIS CA    HA     sing N N 134 
HIS C     O      doub N N 135 
HIS C     OXT    sing N N 136 
HIS CB    CG     sing N N 137 
HIS CB    HB2    sing N N 138 
HIS CB    HB3    sing N N 139 
HIS CG    ND1    sing Y N 140 
HIS CG    CD2    doub Y N 141 
HIS ND1   CE1    doub Y N 142 
HIS ND1   HD1    sing N N 143 
HIS CD2   NE2    sing Y N 144 
HIS CD2   HD2    sing N N 145 
HIS CE1   NE2    sing Y N 146 
HIS CE1   HE1    sing N N 147 
HIS NE2   HE2    sing N N 148 
HIS OXT   HXT    sing N N 149 
HOH O     H1     sing N N 150 
HOH O     H2     sing N N 151 
ILE N     CA     sing N N 152 
ILE N     H      sing N N 153 
ILE N     H2     sing N N 154 
ILE CA    C      sing N N 155 
ILE CA    CB     sing N N 156 
ILE CA    HA     sing N N 157 
ILE C     O      doub N N 158 
ILE C     OXT    sing N N 159 
ILE CB    CG1    sing N N 160 
ILE CB    CG2    sing N N 161 
ILE CB    HB     sing N N 162 
ILE CG1   CD1    sing N N 163 
ILE CG1   HG12   sing N N 164 
ILE CG1   HG13   sing N N 165 
ILE CG2   HG21   sing N N 166 
ILE CG2   HG22   sing N N 167 
ILE CG2   HG23   sing N N 168 
ILE CD1   HD11   sing N N 169 
ILE CD1   HD12   sing N N 170 
ILE CD1   HD13   sing N N 171 
ILE OXT   HXT    sing N N 172 
LEU N     CA     sing N N 173 
LEU N     H      sing N N 174 
LEU N     H2     sing N N 175 
LEU CA    C      sing N N 176 
LEU CA    CB     sing N N 177 
LEU CA    HA     sing N N 178 
LEU C     O      doub N N 179 
LEU C     OXT    sing N N 180 
LEU CB    CG     sing N N 181 
LEU CB    HB2    sing N N 182 
LEU CB    HB3    sing N N 183 
LEU CG    CD1    sing N N 184 
LEU CG    CD2    sing N N 185 
LEU CG    HG     sing N N 186 
LEU CD1   HD11   sing N N 187 
LEU CD1   HD12   sing N N 188 
LEU CD1   HD13   sing N N 189 
LEU CD2   HD21   sing N N 190 
LEU CD2   HD22   sing N N 191 
LEU CD2   HD23   sing N N 192 
LEU OXT   HXT    sing N N 193 
LYS N     CA     sing N N 194 
LYS N     H      sing N N 195 
LYS N     H2     sing N N 196 
LYS CA    C      sing N N 197 
LYS CA    CB     sing N N 198 
LYS CA    HA     sing N N 199 
LYS C     O      doub N N 200 
LYS C     OXT    sing N N 201 
LYS CB    CG     sing N N 202 
LYS CB    HB2    sing N N 203 
LYS CB    HB3    sing N N 204 
LYS CG    CD     sing N N 205 
LYS CG    HG2    sing N N 206 
LYS CG    HG3    sing N N 207 
LYS CD    CE     sing N N 208 
LYS CD    HD2    sing N N 209 
LYS CD    HD3    sing N N 210 
LYS CE    NZ     sing N N 211 
LYS CE    HE2    sing N N 212 
LYS CE    HE3    sing N N 213 
LYS NZ    HZ1    sing N N 214 
LYS NZ    HZ2    sing N N 215 
LYS NZ    HZ3    sing N N 216 
LYS OXT   HXT    sing N N 217 
MET N     CA     sing N N 218 
MET N     H      sing N N 219 
MET N     H2     sing N N 220 
MET CA    C      sing N N 221 
MET CA    CB     sing N N 222 
MET CA    HA     sing N N 223 
MET C     O      doub N N 224 
MET C     OXT    sing N N 225 
MET CB    CG     sing N N 226 
MET CB    HB2    sing N N 227 
MET CB    HB3    sing N N 228 
MET CG    SD     sing N N 229 
MET CG    HG2    sing N N 230 
MET CG    HG3    sing N N 231 
MET SD    CE     sing N N 232 
MET CE    HE1    sing N N 233 
MET CE    HE2    sing N N 234 
MET CE    HE3    sing N N 235 
MET OXT   HXT    sing N N 236 
MGT PG    O1G    doub N N 237 
MGT PG    O2G    sing N N 238 
MGT PG    O3G    sing N N 239 
MGT PG    O3B    sing N N 240 
MGT O2G   HOG2   sing N N 241 
MGT O3G   HOG3   sing N N 242 
MGT O3B   PB     sing N N 243 
MGT PB    O1B    doub N N 244 
MGT PB    O2B    sing N N 245 
MGT PB    O3A    sing N N 246 
MGT O2B   HOB2   sing N N 247 
MGT O3A   PA     sing N N 248 
MGT PA    O1A    doub N N 249 
MGT PA    O2A    sing N N 250 
MGT PA    "O5'"  sing N N 251 
MGT O2A   HOA2   sing N N 252 
MGT "O5'" "C5'"  sing N N 253 
MGT "C5'" "C4'"  sing N N 254 
MGT "C5'" "H5'1" sing N N 255 
MGT "C5'" "H5'2" sing N N 256 
MGT "C4'" "O4'"  sing N N 257 
MGT "C4'" "C3'"  sing N N 258 
MGT "C4'" "H4'"  sing N N 259 
MGT "O4'" "C1'"  sing N N 260 
MGT "C3'" "O3'"  sing N N 261 
MGT "C3'" "C2'"  sing N N 262 
MGT "C3'" "H3'"  sing N N 263 
MGT "O3'" "HO3'" sing N N 264 
MGT "C2'" "O2'"  sing N N 265 
MGT "C2'" "C1'"  sing N N 266 
MGT "C2'" "H2'"  sing N N 267 
MGT "O2'" "HO2'" sing N N 268 
MGT "C1'" N9     sing N N 269 
MGT "C1'" "H1'"  sing N N 270 
MGT N9    C8     sing N N 271 
MGT N9    C4     sing N N 272 
MGT C8    N7     sing N N 273 
MGT C8    H81    sing N N 274 
MGT C8    H82    sing N N 275 
MGT N7    CM7    sing N N 276 
MGT N7    C5     sing N N 277 
MGT CM7   HM71   sing N N 278 
MGT CM7   HM72   sing N N 279 
MGT CM7   HM73   sing N N 280 
MGT C5    C6     sing N N 281 
MGT C5    C4     doub N N 282 
MGT C6    O6     doub N N 283 
MGT C6    N1     sing N N 284 
MGT N1    C2     sing N N 285 
MGT N1    HN1    sing N N 286 
MGT C2    N2     sing N N 287 
MGT C2    N3     doub N N 288 
MGT N2    HN21   sing N N 289 
MGT N2    HN22   sing N N 290 
MGT N3    C4     sing N N 291 
PHE N     CA     sing N N 292 
PHE N     H      sing N N 293 
PHE N     H2     sing N N 294 
PHE CA    C      sing N N 295 
PHE CA    CB     sing N N 296 
PHE CA    HA     sing N N 297 
PHE C     O      doub N N 298 
PHE C     OXT    sing N N 299 
PHE CB    CG     sing N N 300 
PHE CB    HB2    sing N N 301 
PHE CB    HB3    sing N N 302 
PHE CG    CD1    doub Y N 303 
PHE CG    CD2    sing Y N 304 
PHE CD1   CE1    sing Y N 305 
PHE CD1   HD1    sing N N 306 
PHE CD2   CE2    doub Y N 307 
PHE CD2   HD2    sing N N 308 
PHE CE1   CZ     doub Y N 309 
PHE CE1   HE1    sing N N 310 
PHE CE2   CZ     sing Y N 311 
PHE CE2   HE2    sing N N 312 
PHE CZ    HZ     sing N N 313 
PHE OXT   HXT    sing N N 314 
PRO N     CA     sing N N 315 
PRO N     CD     sing N N 316 
PRO N     H      sing N N 317 
PRO CA    C      sing N N 318 
PRO CA    CB     sing N N 319 
PRO CA    HA     sing N N 320 
PRO C     O      doub N N 321 
PRO C     OXT    sing N N 322 
PRO CB    CG     sing N N 323 
PRO CB    HB2    sing N N 324 
PRO CB    HB3    sing N N 325 
PRO CG    CD     sing N N 326 
PRO CG    HG2    sing N N 327 
PRO CG    HG3    sing N N 328 
PRO CD    HD2    sing N N 329 
PRO CD    HD3    sing N N 330 
PRO OXT   HXT    sing N N 331 
SER N     CA     sing N N 332 
SER N     H      sing N N 333 
SER N     H2     sing N N 334 
SER CA    C      sing N N 335 
SER CA    CB     sing N N 336 
SER CA    HA     sing N N 337 
SER C     O      doub N N 338 
SER C     OXT    sing N N 339 
SER CB    OG     sing N N 340 
SER CB    HB2    sing N N 341 
SER CB    HB3    sing N N 342 
SER OG    HG     sing N N 343 
SER OXT   HXT    sing N N 344 
THR N     CA     sing N N 345 
THR N     H      sing N N 346 
THR N     H2     sing N N 347 
THR CA    C      sing N N 348 
THR CA    CB     sing N N 349 
THR CA    HA     sing N N 350 
THR C     O      doub N N 351 
THR C     OXT    sing N N 352 
THR CB    OG1    sing N N 353 
THR CB    CG2    sing N N 354 
THR CB    HB     sing N N 355 
THR OG1   HG1    sing N N 356 
THR CG2   HG21   sing N N 357 
THR CG2   HG22   sing N N 358 
THR CG2   HG23   sing N N 359 
THR OXT   HXT    sing N N 360 
TRP N     CA     sing N N 361 
TRP N     H      sing N N 362 
TRP N     H2     sing N N 363 
TRP CA    C      sing N N 364 
TRP CA    CB     sing N N 365 
TRP CA    HA     sing N N 366 
TRP C     O      doub N N 367 
TRP C     OXT    sing N N 368 
TRP CB    CG     sing N N 369 
TRP CB    HB2    sing N N 370 
TRP CB    HB3    sing N N 371 
TRP CG    CD1    doub Y N 372 
TRP CG    CD2    sing Y N 373 
TRP CD1   NE1    sing Y N 374 
TRP CD1   HD1    sing N N 375 
TRP CD2   CE2    doub Y N 376 
TRP CD2   CE3    sing Y N 377 
TRP NE1   CE2    sing Y N 378 
TRP NE1   HE1    sing N N 379 
TRP CE2   CZ2    sing Y N 380 
TRP CE3   CZ3    doub Y N 381 
TRP CE3   HE3    sing N N 382 
TRP CZ2   CH2    doub Y N 383 
TRP CZ2   HZ2    sing N N 384 
TRP CZ3   CH2    sing Y N 385 
TRP CZ3   HZ3    sing N N 386 
TRP CH2   HH2    sing N N 387 
TRP OXT   HXT    sing N N 388 
TYR N     CA     sing N N 389 
TYR N     H      sing N N 390 
TYR N     H2     sing N N 391 
TYR CA    C      sing N N 392 
TYR CA    CB     sing N N 393 
TYR CA    HA     sing N N 394 
TYR C     O      doub N N 395 
TYR C     OXT    sing N N 396 
TYR CB    CG     sing N N 397 
TYR CB    HB2    sing N N 398 
TYR CB    HB3    sing N N 399 
TYR CG    CD1    doub Y N 400 
TYR CG    CD2    sing Y N 401 
TYR CD1   CE1    sing Y N 402 
TYR CD1   HD1    sing N N 403 
TYR CD2   CE2    doub Y N 404 
TYR CD2   HD2    sing N N 405 
TYR CE1   CZ     doub Y N 406 
TYR CE1   HE1    sing N N 407 
TYR CE2   CZ     sing Y N 408 
TYR CE2   HE2    sing N N 409 
TYR CZ    OH     sing N N 410 
TYR OH    HH     sing N N 411 
TYR OXT   HXT    sing N N 412 
VAL N     CA     sing N N 413 
VAL N     H      sing N N 414 
VAL N     H2     sing N N 415 
VAL CA    C      sing N N 416 
VAL CA    CB     sing N N 417 
VAL CA    HA     sing N N 418 
VAL C     O      doub N N 419 
VAL C     OXT    sing N N 420 
VAL CB    CG1    sing N N 421 
VAL CB    CG2    sing N N 422 
VAL CB    HB     sing N N 423 
VAL CG1   HG11   sing N N 424 
VAL CG1   HG12   sing N N 425 
VAL CG1   HG13   sing N N 426 
VAL CG2   HG21   sing N N 427 
VAL CG2   HG22   sing N N 428 
VAL CG2   HG23   sing N N 429 
VAL OXT   HXT    sing N N 430 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Helmholtz Association'                              Germany ? 1 
'German Federal Ministry for Education and Research' Germany ? 2 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   2VQZ 
_pdbx_initial_refinement_model.details          ? 
# 
_space_group.name_H-M_alt     'P 65' 
_space_group.name_Hall        'P 65' 
_space_group.IT_number        170 
_space_group.crystal_system   hexagonal 
_space_group.id               1 
# 
_atom_sites.entry_id                    9I2O 
_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]   0.012232 
_atom_sites.fract_transf_matrix[1][2]   0.007062 
_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]   0.014125 
_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]   0.018179 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.scat_dispersion_real 
_atom_type.scat_dispersion_imag 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
_atom_type.scat_source 
_atom_type.scat_dispersion_source 
C ? ? 3.54356 2.42580 ? ? 25.62398 1.50364  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
H ? ? 0.51345 0.48472 ? ? 24.73122 6.32584  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
N ? ? 4.01032 2.96436 ? ? 19.97189 1.75589  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O ? ? 4.49882 3.47563 ? ? 15.80542 1.70748  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
P ? ? 9.51135 5.44231 ? ? 1.42069  35.72801 ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
S ? ? 9.55732 6.39887 ? ? 1.23737  29.19336 ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N N      . SER A 1 26  ? -57.47802 0.75283   0.83940   1.000 65.43449  ? 321 SER A N      1 
ATOM   2    C CA     . SER A 1 26  ? -56.38298 1.60088   0.38627   1.000 60.42434  ? 321 SER A CA     1 
ATOM   3    C C      . SER A 1 26  ? -55.51041 2.10039   1.54292   1.000 56.98361  ? 321 SER A C      1 
ATOM   4    O O      . SER A 1 26  ? -54.68364 2.99436   1.33821   1.000 47.16220  ? 321 SER A O      1 
ATOM   5    C CB     . SER A 1 26  ? -56.92615 2.80295   -0.39776  1.000 56.27693  ? 321 SER A CB     1 
ATOM   6    O OG     . SER A 1 26  ? -57.64836 2.38486   -1.54111  1.000 58.29678  ? 321 SER A OG     1 
ATOM   7    N N      . SER A 1 27  ? -55.68077 1.52807   2.74049   1.000 45.72525  ? 322 SER A N      1 
ATOM   8    C CA     . SER A 1 27  ? -54.98029 2.02719   3.92075   1.000 49.87618  ? 322 SER A CA     1 
ATOM   9    C C      . SER A 1 27  ? -54.67128 0.89617   4.89605   1.000 48.59011  ? 322 SER A C      1 
ATOM   10   O O      . SER A 1 27  ? -55.55897 0.11156   5.24118   1.000 48.66232  ? 322 SER A O      1 
ATOM   11   C CB     . SER A 1 27  ? -55.81135 3.10978   4.61421   1.000 52.75050  ? 322 SER A CB     1 
ATOM   12   O OG     . SER A 1 27  ? -55.01423 3.86568   5.50718   1.000 58.03118  ? 322 SER A OG     1 
ATOM   13   N N      . PHE A 1 28  ? -53.42313 0.84100   5.36271   1.000 38.68844  ? 323 PHE A N      1 
ATOM   14   C CA     . PHE A 1 28  ? -52.95008 -0.21205  6.25974   1.000 37.68867  ? 323 PHE A CA     1 
ATOM   15   C C      . PHE A 1 28  ? -51.69708 0.28992   6.97143   1.000 36.85466  ? 323 PHE A C      1 
ATOM   16   O O      . PHE A 1 28  ? -51.17185 1.36296   6.66250   1.000 32.93828  ? 323 PHE A O      1 
ATOM   17   C CB     . PHE A 1 28  ? -52.64162 -1.49222  5.48772   1.000 31.46738  ? 323 PHE A CB     1 
ATOM   18   C CG     . PHE A 1 28  ? -51.68213 -1.27576  4.36079   1.000 34.18779  ? 323 PHE A CG     1 
ATOM   19   C CD1    . PHE A 1 28  ? -52.14345 -0.87054  3.11590   1.000 39.88953  ? 323 PHE A CD1    1 
ATOM   20   C CD2    . PHE A 1 28  ? -50.31749 -1.43266  4.55875   1.000 32.44335  ? 323 PHE A CD2    1 
ATOM   21   C CE1    . PHE A 1 28  ? -51.26984 -0.64071  2.07398   1.000 40.71007  ? 323 PHE A CE1    1 
ATOM   22   C CE2    . PHE A 1 28  ? -49.42903 -1.20011  3.52146   1.000 36.88905  ? 323 PHE A CE2    1 
ATOM   23   C CZ     . PHE A 1 28  ? -49.90866 -0.80701  2.27277   1.000 37.39535  ? 323 PHE A CZ     1 
ATOM   24   N N      . SER A 1 29  ? -51.17494 -0.51931  7.88731   1.000 31.86987  ? 324 SER A N      1 
ATOM   25   C CA     . SER A 1 29  ? -49.97227 -0.11487  8.60386   1.000 32.78633  ? 324 SER A CA     1 
ATOM   26   C C      . SER A 1 29  ? -48.89251 -1.18531  8.49455   1.000 34.50350  ? 324 SER A C      1 
ATOM   27   O O      . SER A 1 29  ? -49.17420 -2.38546  8.43095   1.000 33.43417  ? 324 SER A O      1 
ATOM   28   C CB     . SER A 1 29  ? -50.26441 0.19033   10.07914  1.000 34.67210  ? 324 SER A CB     1 
ATOM   29   O OG     . SER A 1 29  ? -50.57814 -1.00108  10.76376  1.000 56.29546  ? 324 SER A OG     1 
ATOM   30   N N      . PHE A 1 30  ? -47.64357 -0.72961  8.47507   1.000 30.09723  ? 325 PHE A N      1 
ATOM   31   C CA     . PHE A 1 30  ? -46.50022 -1.62379  8.37199   1.000 25.90268  ? 325 PHE A CA     1 
ATOM   32   C C      . PHE A 1 30  ? -45.31164 -0.91981  8.99826   1.000 24.69497  ? 325 PHE A C      1 
ATOM   33   O O      . PHE A 1 30  ? -45.03434 0.22970   8.65508   1.000 23.75361  ? 325 PHE A O      1 
ATOM   34   C CB     . PHE A 1 30  ? -46.19078 -1.99230  6.91023   1.000 24.50920  ? 325 PHE A CB     1 
ATOM   35   C CG     . PHE A 1 30  ? -44.93880 -2.82161  6.75686   1.000 26.78417  ? 325 PHE A CG     1 
ATOM   36   C CD1    . PHE A 1 30  ? -44.88331 -4.11936  7.26201   1.000 34.20403  ? 325 PHE A CD1    1 
ATOM   37   C CD2    . PHE A 1 30  ? -43.81166 -2.29387  6.14502   1.000 24.48764  ? 325 PHE A CD2    1 
ATOM   38   C CE1    . PHE A 1 30  ? -43.71982 -4.88410  7.13911   1.000 33.32371  ? 325 PHE A CE1    1 
ATOM   39   C CE2    . PHE A 1 30  ? -42.66190 -3.02433  6.01391   1.000 25.56550  ? 325 PHE A CE2    1 
ATOM   40   C CZ     . PHE A 1 30  ? -42.60181 -4.33317  6.50959   1.000 33.71010  ? 325 PHE A CZ     1 
ATOM   41   N N      . GLY A 1 31  ? -44.63521 -1.59208  9.92796   1.000 25.60770  ? 326 GLY A N      1 
ATOM   42   C CA     . GLY A 1 31  ? -43.41745 -1.03267  10.50497  1.000 27.27436  ? 326 GLY A CA     1 
ATOM   43   C C      . GLY A 1 31  ? -43.60589 0.28017   11.23630  1.000 29.51380  ? 326 GLY A C      1 
ATOM   44   O O      . GLY A 1 31  ? -42.66929 1.08408   11.31594  1.000 27.10035  ? 326 GLY A O      1 
ATOM   45   N N      . GLY A 1 32  ? -44.78906 0.51833   11.79261  1.000 25.34324  ? 327 GLY A N      1 
ATOM   46   C CA     . GLY A 1 32  ? -45.04472 1.78367   12.46779  1.000 25.98157  ? 327 GLY A CA     1 
ATOM   47   C C      . GLY A 1 32  ? -45.54318 2.91065   11.57791  1.000 27.49288  ? 327 GLY A C      1 
ATOM   48   O O      . GLY A 1 32  ? -45.79952 4.01363   12.08188  1.000 29.61231  ? 327 GLY A O      1 
ATOM   49   N N      . PHE A 1 33  ? -45.67234 2.68731   10.27406  1.000 22.75649  ? 328 PHE A N      1 
ATOM   50   C CA     . PHE A 1 33  ? -46.16184 3.70305   9.35419   1.000 25.31055  ? 328 PHE A CA     1 
ATOM   51   C C      . PHE A 1 33  ? -47.53089 3.30889   8.82810   1.000 27.12839  ? 328 PHE A C      1 
ATOM   52   O O      . PHE A 1 33  ? -47.79069 2.12958   8.56328   1.000 28.91877  ? 328 PHE A O      1 
ATOM   53   C CB     . PHE A 1 33  ? -45.20755 3.90059   8.17027   1.000 25.36736  ? 328 PHE A CB     1 
ATOM   54   C CG     . PHE A 1 33  ? -43.90797 4.53320   8.55928   1.000 26.42362  ? 328 PHE A CG     1 
ATOM   55   C CD1    . PHE A 1 33  ? -42.89404 3.76891   9.11338   1.000 27.81204  ? 328 PHE A CD1    1 
ATOM   56   C CD2    . PHE A 1 33  ? -43.71638 5.89787   8.41972   1.000 26.11920  ? 328 PHE A CD2    1 
ATOM   57   C CE1    . PHE A 1 33  ? -41.70236 4.34442   9.51311   1.000 28.10983  ? 328 PHE A CE1    1 
ATOM   58   C CE2    . PHE A 1 33  ? -42.50604 6.48683   8.83522   1.000 25.60327  ? 328 PHE A CE2    1 
ATOM   59   C CZ     . PHE A 1 33  ? -41.50907 5.70872   9.35374   1.000 25.55588  ? 328 PHE A CZ     1 
ATOM   60   N N      . THR A 1 34  ? -48.38612 4.30798   8.65278   1.000 25.68846  ? 329 THR A N      1 
ATOM   61   C CA     . THR A 1 34  ? -49.64146 4.14263   7.93449   1.000 30.08653  ? 329 THR A CA     1 
ATOM   62   C C      . THR A 1 34  ? -49.39965 4.42289   6.45502   1.000 33.28288  ? 329 THR A C      1 
ATOM   63   O O      . THR A 1 34  ? -48.92611 5.50402   6.09173   1.000 28.23228  ? 329 THR A O      1 
ATOM   64   C CB     . THR A 1 34  ? -50.69588 5.09070   8.50153   1.000 32.54307  ? 329 THR A CB     1 
ATOM   65   O OG1    . THR A 1 34  ? -50.89673 4.78997   9.88250   1.000 31.39147  ? 329 THR A OG1    1 
ATOM   66   C CG2    . THR A 1 34  ? -52.01426 4.94362   7.76154   1.000 37.00275  ? 329 THR A CG2    1 
ATOM   67   N N      . PHE A 1 35  ? -49.71189 3.44674   5.60241   1.000 28.47544  ? 330 PHE A N      1 
ATOM   68   C CA     . PHE A 1 35  ? -49.57144 3.59470   4.16315   1.000 29.46274  ? 330 PHE A CA     1 
ATOM   69   C C      . PHE A 1 35  ? -50.93214 3.96061   3.58740   1.000 34.71014  ? 330 PHE A C      1 
ATOM   70   O O      . PHE A 1 35  ? -51.94201 3.35124   3.95240   1.000 34.72628  ? 330 PHE A O      1 
ATOM   71   C CB     . PHE A 1 35  ? -49.05589 2.30047   3.52286   1.000 26.63685  ? 330 PHE A CB     1 
ATOM   72   C CG     . PHE A 1 35  ? -47.60532 2.03136   3.77923   1.000 28.46818  ? 330 PHE A CG     1 
ATOM   73   C CD1    . PHE A 1 35  ? -47.16553 1.68207   5.06005   1.000 26.11152  ? 330 PHE A CD1    1 
ATOM   74   C CD2    . PHE A 1 35  ? -46.68252 2.10455   2.75191   1.000 26.40111  ? 330 PHE A CD2    1 
ATOM   75   C CE1    . PHE A 1 35  ? -45.83424 1.42656   5.29993   1.000 22.89369  ? 330 PHE A CE1    1 
ATOM   76   C CE2    . PHE A 1 35  ? -45.33564 1.86068   2.98904   1.000 26.41791  ? 330 PHE A CE2    1 
ATOM   77   C CZ     . PHE A 1 35  ? -44.91471 1.51088   4.27476   1.000 25.96096  ? 330 PHE A CZ     1 
ATOM   78   N N      . LYS A 1 36  ? -50.96247 4.96610   2.71183   1.000 31.36615  ? 331 LYS A N      1 
ATOM   79   C CA     . LYS A 1 36  ? -52.18967 5.38134   2.03240   1.000 34.20785  ? 331 LYS A CA     1 
ATOM   80   C C      . LYS A 1 36  ? -51.93541 5.32857   0.53218   1.000 32.99955  ? 331 LYS A C      1 
ATOM   81   O O      . LYS A 1 36  ? -51.13254 6.11149   0.00987   1.000 27.90727  ? 331 LYS A O      1 
ATOM   82   C CB     . LYS A 1 36  ? -52.60535 6.78797   2.46742   1.000 45.33581  ? 331 LYS A CB     1 
ATOM   83   C CG     . LYS A 1 36  ? -54.10631 7.03600   2.42200   1.000 64.58532  ? 331 LYS A CG     1 
ATOM   84   C CD     . LYS A 1 36  ? -54.44683 8.52012   2.30363   1.000 68.67303  ? 331 LYS A CD     1 
ATOM   85   C CE     . LYS A 1 36  ? -53.76773 9.35011   3.38640   1.000 79.01476  ? 331 LYS A CE     1 
ATOM   86   N NZ     . LYS A 1 36  ? -54.48285 10.64269  3.61368   1.000 84.36023  ? 331 LYS A NZ     1 
ATOM   87   N N      . ARG A 1 37  ? -52.60061 4.40947   -0.16508  1.000 29.32578  ? 332 ARG A N      1 
ATOM   88   C CA     . ARG A 1 37  ? -52.38689 4.32050   -1.60181  1.000 31.46232  ? 332 ARG A CA     1 
ATOM   89   C C      . ARG A 1 37  ? -53.05382 5.49856   -2.29256  1.000 34.21395  ? 332 ARG A C      1 
ATOM   90   O O      . ARG A 1 37  ? -54.24259 5.75907   -2.09131  1.000 36.34223  ? 332 ARG A O      1 
ATOM   91   C CB     . ARG A 1 37  ? -52.91980 3.00823   -2.17087  1.000 31.68600  ? 332 ARG A CB     1 
ATOM   92   C CG     . ARG A 1 37  ? -52.53649 2.82522   -3.64345  1.000 32.70958  ? 332 ARG A CG     1 
ATOM   93   C CD     . ARG A 1 37  ? -52.86350 1.42153   -4.12371  1.000 33.91724  ? 332 ARG A CD     1 
ATOM   94   N NE     . ARG A 1 37  ? -54.22990 1.06957   -3.76754  1.000 37.72931  ? 332 ARG A NE     1 
ATOM   95   C CZ     . ARG A 1 37  ? -54.70563 -0.16609  -3.75392  1.000 47.40134  ? 332 ARG A CZ     1 
ATOM   96   N NH1    . ARG A 1 37  ? -53.95585 -1.19843  -4.10767  1.000 43.28347  ? 332 ARG A NH1    1 
ATOM   97   N NH2    . ARG A 1 37  ? -55.96484 -0.37063  -3.37598  1.000 48.85711  ? 332 ARG A NH2    1 
ATOM   98   N N      . THR A 1 38  ? -52.28758 6.21277   -3.11296  1.000 33.70145  ? 333 THR A N      1 
ATOM   99   C CA     . THR A 1 38  ? -52.83355 7.34848   -3.83515  1.000 35.06490  ? 333 THR A CA     1 
ATOM   100  C C      . THR A 1 38  ? -53.00524 7.08471   -5.32737  1.000 36.33100  ? 333 THR A C      1 
ATOM   101  O O      . THR A 1 38  ? -53.73178 7.83062   -5.99451  1.000 37.05892  ? 333 THR A O      1 
ATOM   102  C CB     . THR A 1 38  ? -51.94512 8.58578   -3.62492  1.000 33.63218  ? 333 THR A CB     1 
ATOM   103  O OG1    . THR A 1 38  ? -50.60550 8.29943   -4.04673  1.000 34.60713  ? 333 THR A OG1    1 
ATOM   104  C CG2    . THR A 1 38  ? -51.91869 8.98495   -2.14805  1.000 34.99199  ? 333 THR A CG2    1 
ATOM   105  N N      . SER A 1 39  ? -52.38116 6.04218   -5.86334  1.000 31.83844  ? 334 SER A N      1 
ATOM   106  C CA     . SER A 1 39  ? -52.49717 5.72823   -7.27962  1.000 33.12865  ? 334 SER A CA     1 
ATOM   107  C C      . SER A 1 39  ? -52.08181 4.27936   -7.50506  1.000 36.89843  ? 334 SER A C      1 
ATOM   108  O O      . SER A 1 39  ? -51.31070 3.71183   -6.72280  1.000 33.23591  ? 334 SER A O      1 
ATOM   109  C CB     . SER A 1 39  ? -51.63501 6.66900   -8.13082  1.000 34.69661  ? 334 SER A CB     1 
ATOM   110  O OG     . SER A 1 39  ? -51.90309 6.48918   -9.50185  1.000 55.28438  ? 334 SER A OG     1 
ATOM   111  N N      . GLY A 1 40  ? -52.57957 3.69679   -8.59779  1.000 35.89567  ? 335 GLY A N      1 
ATOM   112  C CA     . GLY A 1 40  ? -52.22688 2.33124   -8.93083  1.000 31.93960  ? 335 GLY A CA     1 
ATOM   113  C C      . GLY A 1 40  ? -53.07377 1.29843   -8.20776  1.000 33.44195  ? 335 GLY A C      1 
ATOM   114  O O      . GLY A 1 40  ? -54.05418 1.60104   -7.51754  1.000 37.74653  ? 335 GLY A O      1 
ATOM   115  N N      . SER A 1 41  ? -52.68231 0.03856   -8.39482  1.000 36.12655  ? 336 SER A N      1 
ATOM   116  C CA     . SER A 1 41  ? -53.33048 -1.09134  -7.73538  1.000 40.74410  ? 336 SER A CA     1 
ATOM   117  C C      . SER A 1 41  ? -52.39416 -2.29188  -7.82205  1.000 34.98581  ? 336 SER A C      1 
ATOM   118  O O      . SER A 1 41  ? -51.35053 -2.24926  -8.48187  1.000 34.49500  ? 336 SER A O      1 
ATOM   119  C CB     . SER A 1 41  ? -54.69097 -1.41520  -8.36186  1.000 47.83732  ? 336 SER A CB     1 
ATOM   120  O OG     . SER A 1 41  ? -54.52551 -1.82231  -9.71505  1.000 44.08243  ? 336 SER A OG     1 
ATOM   121  N N      . SER A 1 42  ? -52.77635 -3.36891  -7.14306  1.000 36.40587  ? 337 SER A N      1 
ATOM   122  C CA     . SER A 1 42  ? -51.92666 -4.55032  -7.14992  1.000 35.31927  ? 337 SER A CA     1 
ATOM   123  C C      . SER A 1 42  ? -52.76968 -5.77086  -6.82478  1.000 38.40161  ? 337 SER A C      1 
ATOM   124  O O      . SER A 1 42  ? -53.87368 -5.66069  -6.28630  1.000 38.71830  ? 337 SER A O      1 
ATOM   125  C CB     . SER A 1 42  ? -50.75305 -4.42017  -6.16078  1.000 38.69980  ? 337 SER A CB     1 
ATOM   126  O OG     . SER A 1 42  ? -51.18782 -4.29317  -4.80955  1.000 37.11394  ? 337 SER A OG     1 
ATOM   127  N N      . VAL A 1 43  ? -52.23677 -6.93819  -7.18152  1.000 32.69445  ? 338 VAL A N      1 
ATOM   128  C CA     . VAL A 1 43  ? -52.76075 -8.21979  -6.72568  1.000 32.37041  ? 338 VAL A CA     1 
ATOM   129  C C      . VAL A 1 43  ? -51.67139 -8.89699  -5.90350  1.000 37.99397  ? 338 VAL A C      1 
ATOM   130  O O      . VAL A 1 43  ? -50.48718 -8.58475  -6.03792  1.000 35.90312  ? 338 VAL A O      1 
ATOM   131  C CB     . VAL A 1 43  ? -53.19730 -9.11412  -7.89542  1.000 34.75326  ? 338 VAL A CB     1 
ATOM   132  C CG1    . VAL A 1 43  ? -54.30744 -8.44130  -8.67360  1.000 48.71154  ? 338 VAL A CG1    1 
ATOM   133  C CG2    . VAL A 1 43  ? -52.00982 -9.36665  -8.81736  1.000 38.65346  ? 338 VAL A CG2    1 
ATOM   134  N N      . LYS A 1 44  ? -52.08345 -9.81417  -5.02649  1.000 32.17022  ? 339 LYS A N      1 
ATOM   135  C CA     . LYS A 1 44  ? -51.16463 -10.49490 -4.11766  1.000 34.32145  ? 339 LYS A CA     1 
ATOM   136  C C      . LYS A 1 44  ? -50.91308 -11.92082 -4.58559  1.000 34.02756  ? 339 LYS A C      1 
ATOM   137  O O      . LYS A 1 44  ? -51.82942 -12.59502 -5.06453  1.000 41.49397  ? 339 LYS A O      1 
ATOM   138  C CB     . LYS A 1 44  ? -51.72229 -10.55401 -2.68946  1.000 40.81035  ? 339 LYS A CB     1 
ATOM   139  C CG     . LYS A 1 44  ? -52.26173 -9.25875  -2.12505  1.000 52.61996  ? 339 LYS A CG     1 
ATOM   140  C CD     . LYS A 1 44  ? -52.80005 -9.47930  -0.70348  1.000 54.61020  ? 339 LYS A CD     1 
ATOM   141  C CE     . LYS A 1 44  ? -53.78560 -8.38241  -0.29295  1.000 67.66439  ? 339 LYS A CE     1 
ATOM   142  N NZ     . LYS A 1 44  ? -55.02680 -8.41589  -1.13482  1.000 81.29015  ? 339 LYS A NZ     1 
ATOM   143  N N      . LYS A 1 45  ? -49.68228 -12.39688 -4.40360  1.000 33.54081  ? 340 LYS A N      1 
ATOM   144  C CA     . LYS A 1 45  ? -49.38942 -13.80188 -4.65881  1.000 35.48587  ? 340 LYS A CA     1 
ATOM   145  C C      . LYS A 1 45  ? -48.20706 -14.21194 -3.79541  1.000 35.70969  ? 340 LYS A C      1 
ATOM   146  O O      . LYS A 1 45  ? -47.29598 -13.41368 -3.56132  1.000 35.38088  ? 340 LYS A O      1 
ATOM   147  C CB     . LYS A 1 45  ? -49.09539 -14.07741 -6.14168  1.000 35.99020  ? 340 LYS A CB     1 
ATOM   148  C CG     . LYS A 1 45  ? -47.69389 -13.68457 -6.60205  1.000 41.83405  ? 340 LYS A CG     1 
ATOM   149  C CD     . LYS A 1 45  ? -47.34898 -14.34211 -7.94506  1.000 51.69847  ? 340 LYS A CD     1 
ATOM   150  C CE     . LYS A 1 45  ? -47.04434 -15.82815 -7.81666  1.000 51.17327  ? 340 LYS A CE     1 
ATOM   151  N NZ     . LYS A 1 45  ? -45.62438 -16.07188 -7.42265  1.000 49.77755  ? 340 LYS A NZ     1 
ATOM   152  N N      . GLU A 1 46  ? -48.23878 -15.44579 -3.30204  1.000 36.49501  ? 341 GLU A N      1 
ATOM   153  C CA     . GLU A 1 46  ? -47.11783 -15.95006 -2.52366  1.000 30.45695  ? 341 GLU A CA     1 
ATOM   154  C C      . GLU A 1 46  ? -45.95786 -16.26273 -3.45913  1.000 34.76586  ? 341 GLU A C      1 
ATOM   155  O O      . GLU A 1 46  ? -46.15090 -16.75366 -4.56934  1.000 32.36406  ? 341 GLU A O      1 
ATOM   156  C CB     . GLU A 1 46  ? -47.52457 -17.20123 -1.74362  1.000 38.61380  ? 341 GLU A CB     1 
ATOM   157  C CG     . GLU A 1 46  ? -48.56854 -16.96159 -0.66980  1.000 47.33671  ? 341 GLU A CG     1 
ATOM   158  C CD     . GLU A 1 46  ? -48.01207 -16.24447 0.55458   1.000 56.53640  ? 341 GLU A CD     1 
ATOM   159  O OE1    . GLU A 1 46  ? -46.79119 -16.33011 0.80372   1.000 56.67362  ? 341 GLU A OE1    1 
ATOM   160  O OE2    . GLU A 1 46  ? -48.79880 -15.59468 1.27593   1.000 66.29541  ? 341 GLU A OE2    1 
ATOM   161  N N      . GLU A 1 47  ? -44.74164 -15.97284 -3.00315  1.000 31.11941  ? 342 GLU A N      1 
ATOM   162  C CA     . GLU A 1 47  ? -43.56137 -16.14638 -3.83854  1.000 29.00862  ? 342 GLU A CA     1 
ATOM   163  C C      . GLU A 1 47  ? -42.37997 -16.53615 -2.96018  1.000 31.51009  ? 342 GLU A C      1 
ATOM   164  O O      . GLU A 1 47  ? -42.25140 -16.05153 -1.83566  1.000 30.34655  ? 342 GLU A O      1 
ATOM   165  C CB     . GLU A 1 47  ? -43.24192 -14.85398 -4.58222  1.000 31.99406  ? 342 GLU A CB     1 
ATOM   166  C CG     . GLU A 1 47  ? -42.23958 -14.97654 -5.69252  1.000 42.96288  ? 342 GLU A CG     1 
ATOM   167  C CD     . GLU A 1 47  ? -42.30932 -13.77113 -6.61076  1.000 48.93011  ? 342 GLU A CD     1 
ATOM   168  O OE1    . GLU A 1 47  ? -43.34356 -13.60862 -7.29173  1.000 47.23786  ? 342 GLU A OE1    1 
ATOM   169  O OE2    . GLU A 1 47  ? -41.35893 -12.96188 -6.62508  1.000 42.69815  ? 342 GLU A OE2    1 
ATOM   170  N N      . GLU A 1 48  ? -41.50332 -17.38157 -3.48769  1.000 28.09231  ? 343 GLU A N      1 
ATOM   171  C CA     . GLU A 1 48  ? -40.26892 -17.72835 -2.79658  1.000 27.56834  ? 343 GLU A CA     1 
ATOM   172  C C      . GLU A 1 48  ? -39.12911 -16.82428 -3.25719  1.000 29.19968  ? 343 GLU A C      1 
ATOM   173  O O      . GLU A 1 48  ? -39.02250 -16.51215 -4.44364  1.000 32.61761  ? 343 GLU A O      1 
ATOM   174  C CB     . GLU A 1 48  ? -39.91019 -19.19601 -3.04310  1.000 32.72841  ? 343 GLU A CB     1 
ATOM   175  C CG     . GLU A 1 48  ? -40.84315 -20.18689 -2.36354  1.000 38.33044  ? 343 GLU A CG     1 
ATOM   176  C CD     . GLU A 1 48  ? -40.36195 -21.63726 -2.46043  1.000 61.84171  ? 343 GLU A CD     1 
ATOM   177  O OE1    . GLU A 1 48  ? -40.67241 -22.43140 -1.54566  1.000 69.71357  ? 343 GLU A OE1    1 
ATOM   178  O OE2    . GLU A 1 48  ? -39.68470 -21.98752 -3.45288  1.000 62.86039  ? 343 GLU A OE2    1 
ATOM   179  N N      . VAL A 1 49  ? -38.27634 -16.40054 -2.31529  1.000 27.29944  ? 344 VAL A N      1 
ATOM   180  C CA     . VAL A 1 49  ? -37.12315 -15.55797 -2.61673  1.000 28.71597  ? 344 VAL A CA     1 
ATOM   181  C C      . VAL A 1 49  ? -35.90837 -16.12668 -1.89019  1.000 27.80158  ? 344 VAL A C      1 
ATOM   182  O O      . VAL A 1 49  ? -36.04319 -16.80769 -0.87797  1.000 28.58869  ? 344 VAL A O      1 
ATOM   183  C CB     . VAL A 1 49  ? -37.36600 -14.08906 -2.20928  1.000 28.75630  ? 344 VAL A CB     1 
ATOM   184  C CG1    . VAL A 1 49  ? -38.62251 -13.56877 -2.89134  1.000 28.49103  ? 344 VAL A CG1    1 
ATOM   185  C CG2    . VAL A 1 49  ? -37.52018 -13.95569 -0.67694  1.000 25.66148  ? 344 VAL A CG2    1 
ATOM   186  N N      . LEU A 1 50  ? -34.71062 -15.85135 -2.42163  1.000 27.29807  ? 345 LEU A N      1 
ATOM   187  C CA     . LEU A 1 50  ? -33.46127 -16.34286 -1.83293  1.000 25.86276  ? 345 LEU A CA     1 
ATOM   188  C C      . LEU A 1 50  ? -32.68473 -15.19951 -1.18343  1.000 28.38028  ? 345 LEU A C      1 
ATOM   189  O O      . LEU A 1 50  ? -32.42293 -14.18128 -1.82822  1.000 27.32434  ? 345 LEU A O      1 
ATOM   190  C CB     . LEU A 1 50  ? -32.57872 -17.01311 -2.89506  1.000 29.51647  ? 345 LEU A CB     1 
ATOM   191  C CG     . LEU A 1 50  ? -32.85940 -18.48438 -3.21163  1.000 34.62261  ? 345 LEU A CG     1 
ATOM   192  C CD1    . LEU A 1 50  ? -32.08032 -18.92887 -4.45323  1.000 39.75332  ? 345 LEU A CD1    1 
ATOM   193  C CD2    . LEU A 1 50  ? -32.52559 -19.38886 -2.00925  1.000 27.21222  ? 345 LEU A CD2    1 
ATOM   194  N N      . THR A 1 51  ? -32.28622 -15.37647 0.07538   1.000 27.05251  ? 346 THR A N      1 
ATOM   195  C CA     . THR A 1 51  ? -31.48832 -14.35700 0.74527   1.000 25.87957  ? 346 THR A CA     1 
ATOM   196  C C      . THR A 1 51  ? -30.03645 -14.42481 0.27103   1.000 28.63473  ? 346 THR A C      1 
ATOM   197  O O      . THR A 1 51  ? -29.64429 -15.30711 -0.49595  1.000 26.88138  ? 346 THR A O      1 
ATOM   198  C CB     . THR A 1 51  ? -31.55575 -14.52928 2.26023   1.000 28.74369  ? 346 THR A CB     1 
ATOM   199  O OG1    . THR A 1 51  ? -30.78536 -15.67537 2.64925   1.000 26.22192  ? 346 THR A OG1    1 
ATOM   200  C CG2    . THR A 1 51  ? -32.99897 -14.71979 2.71580   1.000 25.91070  ? 346 THR A CG2    1 
ATOM   201  N N      . GLY A 1 52  ? -29.21766 -13.48934 0.75236   1.000 26.03271  ? 347 GLY A N      1 
ATOM   202  C CA     . GLY A 1 52  ? -27.78663 -13.53033 0.48492   1.000 30.87173  ? 347 GLY A CA     1 
ATOM   203  C C      . GLY A 1 52  ? -27.09135 -14.76185 1.04953   1.000 32.70577  ? 347 GLY A C      1 
ATOM   204  O O      . GLY A 1 52  ? -26.00586 -15.12871 0.57881   1.000 32.90866  ? 347 GLY A O      1 
ATOM   205  N N      . ASN A 1 53  ? -27.69903 -15.41712 2.03782   1.000 28.02166  ? 348 ASN A N      1 
ATOM   206  C CA     . ASN A 1 53  ? -27.19491 -16.68045 2.56394   1.000 25.74790  ? 348 ASN A CA     1 
ATOM   207  C C      . ASN A 1 53  ? -27.92145 -17.87800 1.96174   1.000 26.24532  ? 348 ASN A C      1 
ATOM   208  O O      . ASN A 1 53  ? -27.87411 -18.97505 2.53064   1.000 27.49361  ? 348 ASN A O      1 
ATOM   209  C CB     . ASN A 1 53  ? -27.30889 -16.71245 4.09256   1.000 28.66698  ? 348 ASN A CB     1 
ATOM   210  C CG     . ASN A 1 53  ? -26.44131 -17.79218 4.70712   1.000 28.78770  ? 348 ASN A CG     1 
ATOM   211  O OD1    . ASN A 1 53  ? -25.28868 -17.96232 4.30969   1.000 34.64319  ? 348 ASN A OD1    1 
ATOM   212  N ND2    . ASN A 1 53  ? -26.99940 -18.55642 5.64180   1.000 34.17786  ? 348 ASN A ND2    1 
ATOM   213  N N      . LEU A 1 54  ? -28.62912 -17.66748 0.84380   1.000 27.27762  ? 349 LEU A N      1 
ATOM   214  C CA     . LEU A 1 54  ? -29.30726 -18.72060 0.09292   1.000 26.51303  ? 349 LEU A CA     1 
ATOM   215  C C      . LEU A 1 54  ? -30.36000 -19.43503 0.93055   1.000 25.17285  ? 349 LEU A C      1 
ATOM   216  O O      . LEU A 1 54  ? -30.62616 -20.62319 0.72418   1.000 26.08370  ? 349 LEU A O      1 
ATOM   217  C CB     . LEU A 1 54  ? -28.30200 -19.71744 -0.49049  1.000 26.85526  ? 349 LEU A CB     1 
ATOM   218  C CG     . LEU A 1 54  ? -27.29783 -19.07884 -1.44735  1.000 34.01036  ? 349 LEU A CG     1 
ATOM   219  C CD1    . LEU A 1 54  ? -26.36375 -20.15163 -2.02838  1.000 33.53267  ? 349 LEU A CD1    1 
ATOM   220  C CD2    . LEU A 1 54  ? -28.03236 -18.32449 -2.57152  1.000 29.77865  ? 349 LEU A CD2    1 
ATOM   221  N N      . GLN A 1 55  ? -30.96541 -18.71312 1.87893   1.000 22.43996  ? 350 GLN A N      1 
ATOM   222  C CA     . GLN A 1 55  ? -32.13720 -19.19175 2.59943   1.000 24.60056  ? 350 GLN A CA     1 
ATOM   223  C C      . GLN A 1 55  ? -33.38227 -18.81648 1.80414   1.000 26.56909  ? 350 GLN A C      1 
ATOM   224  O O      . GLN A 1 55  ? -33.46725 -17.70843 1.26795   1.000 25.73857  ? 350 GLN A O      1 
ATOM   225  C CB     . GLN A 1 55  ? -32.18471 -18.56422 3.99705   1.000 27.18329  ? 350 GLN A CB     1 
ATOM   226  C CG     . GLN A 1 55  ? -33.31328 -19.07109 4.88781   1.000 31.34137  ? 350 GLN A CG     1 
ATOM   227  C CD     . GLN A 1 55  ? -33.27126 -18.44164 6.27123   1.000 37.70698  ? 350 GLN A CD     1 
ATOM   228  O OE1    . GLN A 1 55  ? -32.56901 -17.44977 6.49759   1.000 34.00311  ? 350 GLN A OE1    1 
ATOM   229  N NE2    . GLN A 1 55  ? -34.01920 -19.02006 7.20384   1.000 37.62657  ? 350 GLN A NE2    1 
ATOM   230  N N      . THR A 1 56  ? -34.31785 -19.75708 1.67658   1.000 26.78807  ? 351 THR A N      1 
ATOM   231  C CA     . THR A 1 56  ? -35.56164 -19.49764 0.95750   1.000 25.16120  ? 351 THR A CA     1 
ATOM   232  C C      . THR A 1 56  ? -36.60459 -18.95121 1.92923   1.000 29.95587  ? 351 THR A C      1 
ATOM   233  O O      . THR A 1 56  ? -36.88188 -19.57926 2.95584   1.000 28.13055  ? 351 THR A O      1 
ATOM   234  C CB     . THR A 1 56  ? -36.09830 -20.76894 0.28559   1.000 31.75349  ? 351 THR A CB     1 
ATOM   235  O OG1    . THR A 1 56  ? -35.17322 -21.23725 -0.71214  1.000 30.93861  ? 351 THR A OG1    1 
ATOM   236  C CG2    . THR A 1 56  ? -37.46992 -20.48459 -0.37929  1.000 29.28923  ? 351 THR A CG2    1 
ATOM   237  N N      . LEU A 1 57  ? -37.18601 -17.78878 1.60485   1.000 27.30031  ? 352 LEU A N      1 
ATOM   238  C CA     . LEU A 1 57  ? -38.28963 -17.21795 2.37193   1.000 25.37611  ? 352 LEU A CA     1 
ATOM   239  C C      . LEU A 1 57  ? -39.52656 -17.16147 1.49741   1.000 28.54961  ? 352 LEU A C      1 
ATOM   240  O O      . LEU A 1 57  ? -39.43065 -16.89067 0.29546   1.000 29.12024  ? 352 LEU A O      1 
ATOM   241  C CB     . LEU A 1 57  ? -37.99506 -15.78886 2.85465   1.000 27.32082  ? 352 LEU A CB     1 
ATOM   242  C CG     . LEU A 1 57  ? -36.60525 -15.47489 3.37535   1.000 27.31937  ? 352 LEU A CG     1 
ATOM   243  C CD1    . LEU A 1 57  ? -36.44355 -13.98066 3.58604   1.000 31.92637  ? 352 LEU A CD1    1 
ATOM   244  C CD2    . LEU A 1 57  ? -36.38330 -16.20642 4.67522   1.000 32.82740  ? 352 LEU A CD2    1 
ATOM   245  N N      . LYS A 1 58  ? -40.69455 -17.36716 2.10293   1.000 24.86155  ? 353 LYS A N      1 
ATOM   246  C CA     . LYS A 1 58  ? -41.96085 -17.22697 1.39335   1.000 29.15209  ? 353 LYS A CA     1 
ATOM   247  C C      . LYS A 1 58  ? -42.61065 -15.91125 1.80436   1.000 32.40632  ? 353 LYS A C      1 
ATOM   248  O O      . LYS A 1 58  ? -42.92679 -15.71506 2.98161   1.000 31.48205  ? 353 LYS A O      1 
ATOM   249  C CB     . LYS A 1 58  ? -42.88981 -18.40491 1.68558   1.000 35.63651  ? 353 LYS A CB     1 
ATOM   250  C CG     . LYS A 1 58  ? -42.25167 -19.78445 1.48271   1.000 55.06052  ? 353 LYS A CG     1 
ATOM   251  C CD     . LYS A 1 58  ? -43.28374 -20.91253 1.56031   1.000 61.38638  ? 353 LYS A CD     1 
ATOM   252  C CE     . LYS A 1 58  ? -43.17491 -21.71181 2.86444   1.000 71.16530  ? 353 LYS A CE     1 
ATOM   253  N NZ     . LYS A 1 58  ? -44.51278 -22.16514 3.36929   1.000 68.09809  ? 353 LYS A NZ     1 
ATOM   254  N N      . ILE A 1 59  ? -42.79157 -15.00403 0.84671   1.000 28.95399  ? 354 ILE A N      1 
ATOM   255  C CA     . ILE A 1 59  ? -43.36100 -13.69103 1.12691   1.000 27.11833  ? 354 ILE A CA     1 
ATOM   256  C C      . ILE A 1 59  ? -44.55341 -13.48237 0.21092   1.000 30.13075  ? 354 ILE A C      1 
ATOM   257  O O      . ILE A 1 59  ? -44.60515 -14.01415 -0.90464  1.000 28.04993  ? 354 ILE A O      1 
ATOM   258  C CB     . ILE A 1 59  ? -42.33917 -12.54564 0.93666   1.000 30.30667  ? 354 ILE A CB     1 
ATOM   259  C CG1    . ILE A 1 59  ? -41.81010 -12.53171 -0.49517  1.000 31.22614  ? 354 ILE A CG1    1 
ATOM   260  C CG2    . ILE A 1 59  ? -41.18644 -12.66983 1.94525   1.000 32.57561  ? 354 ILE A CG2    1 
ATOM   261  C CD1    . ILE A 1 59  ? -40.97516 -11.30328 -0.80360  1.000 34.08200  ? 354 ILE A CD1    1 
ATOM   262  N N      . ARG A 1 60  ? -45.50481 -12.68397 0.67815   1.000 25.15995  ? 355 ARG A N      1 
ATOM   263  C CA     . ARG A 1 60  ? -46.66039 -12.31875 -0.13176  1.000 28.94888  ? 355 ARG A CA     1 
ATOM   264  C C      . ARG A 1 60  ? -46.26780 -11.10172 -0.95425  1.000 28.14737  ? 355 ARG A C      1 
ATOM   265  O O      . ARG A 1 60  ? -46.07721 -10.01408 -0.40576  1.000 27.16386  ? 355 ARG A O      1 
ATOM   266  C CB     . ARG A 1 60  ? -47.88436 -12.02640 0.73470   1.000 33.39871  ? 355 ARG A CB     1 
ATOM   267  C CG     . ARG A 1 60  ? -49.20069 -12.42601 0.03295   1.000 44.60892  ? 355 ARG A CG     1 
ATOM   268  C CD     . ARG A 1 60  ? -50.45554 -12.10180 0.84705   1.000 54.68688  ? 355 ARG A CD     1 
ATOM   269  N NE     . ARG A 1 60  ? -50.61712 -12.94235 2.02892   1.000 66.35521  ? 355 ARG A NE     1 
ATOM   270  C CZ     . ARG A 1 60  ? -51.14767 -14.15868 2.01862   1.000 73.72802  ? 355 ARG A CZ     1 
ATOM   271  N NH1    . ARG A 1 60  ? -51.52516 -14.73854 0.88930   1.000 65.58317  ? 355 ARG A NH1    1 
ATOM   272  N NH2    . ARG A 1 60  ? -51.29446 -14.81383 3.16924   1.000 72.71693  ? 355 ARG A NH2    1 
ATOM   273  N N      . VAL A 1 61  ? -46.13436 -11.29204 -2.26477  1.000 26.85635  ? 356 VAL A N      1 
ATOM   274  C CA     . VAL A 1 61  ? -45.68833 -10.24371 -3.17574  1.000 26.14724  ? 356 VAL A CA     1 
ATOM   275  C C      . VAL A 1 61  ? -46.90974 -9.52853  -3.72269  1.000 30.55300  ? 356 VAL A C      1 
ATOM   276  O O      . VAL A 1 61  ? -47.89879 -10.17033 -4.10165  1.000 30.34507  ? 356 VAL A O      1 
ATOM   277  C CB     . VAL A 1 61  ? -44.82879 -10.83228 -4.31026  1.000 26.96348  ? 356 VAL A CB     1 
ATOM   278  C CG1    . VAL A 1 61  ? -44.52760 -9.77101  -5.38802  1.000 25.91067  ? 356 VAL A CG1    1 
ATOM   279  C CG2    . VAL A 1 61  ? -43.52344 -11.39160 -3.73359  1.000 30.03624  ? 356 VAL A CG2    1 
ATOM   280  N N      . HIS A 1 62  ? -46.86388 -8.19539  -3.73230  1.000 26.25483  ? 357 HIS A N      1 
ATOM   281  C CA     . HIS A 1 62  ? -47.90402 -7.38983  -4.35985  1.000 28.97454  ? 357 HIS A CA     1 
ATOM   282  C C      . HIS A 1 62  ? -47.42869 -7.01872  -5.76246  1.000 30.42149  ? 357 HIS A C      1 
ATOM   283  O O      . HIS A 1 62  ? -46.33439 -6.47458  -5.92139  1.000 31.82657  ? 357 HIS A O      1 
ATOM   284  C CB     . HIS A 1 62  ? -48.21726 -6.14562  -3.52889  1.000 30.52601  ? 357 HIS A CB     1 
ATOM   285  C CG     . HIS A 1 62  ? -49.04976 -6.43782  -2.31779  1.000 33.35555  ? 357 HIS A CG     1 
ATOM   286  N ND1    . HIS A 1 62  ? -48.56999 -7.15993  -1.24547  1.000 38.46011  ? 357 HIS A ND1    1 
ATOM   287  C CD2    . HIS A 1 62  ? -50.33915 -6.14260  -2.02652  1.000 36.20001  ? 357 HIS A CD2    1 
ATOM   288  C CE1    . HIS A 1 62  ? -49.51924 -7.27286  -0.33187  1.000 35.93510  ? 357 HIS A CE1    1 
ATOM   289  N NE2    . HIS A 1 62  ? -50.60588 -6.67099  -0.78351  1.000 41.90153  ? 357 HIS A NE2    1 
ATOM   290  N N      . GLU A 1 63  ? -48.22095 -7.36039  -6.77217  1.000 26.91174  ? 358 GLU A N      1 
ATOM   291  C CA     . GLU A 1 63  ? -47.81984 -7.18349  -8.16208  1.000 27.42747  ? 358 GLU A CA     1 
ATOM   292  C C      . GLU A 1 63  ? -48.59341 -6.00192  -8.70574  1.000 29.26149  ? 358 GLU A C      1 
ATOM   293  O O      . GLU A 1 63  ? -49.82378 -6.02104  -8.71148  1.000 29.82706  ? 358 GLU A O      1 
ATOM   294  C CB     . GLU A 1 63  ? -48.11992 -8.42484  -9.00590  1.000 28.13117  ? 358 GLU A CB     1 
ATOM   295  C CG     . GLU A 1 63  ? -47.47101 -9.70735  -8.53836  1.000 31.87199  ? 358 GLU A CG     1 
ATOM   296  C CD     . GLU A 1 63  ? -47.75955 -10.85321 -9.50846  1.000 38.67536  ? 358 GLU A CD     1 
ATOM   297  O OE1    . GLU A 1 63  ? -48.83638 -10.82844 -10.14358 1.000 39.37949  ? 358 GLU A OE1    1 
ATOM   298  O OE2    . GLU A 1 63  ? -46.91420 -11.76051 -9.63587  1.000 40.82857  ? 358 GLU A OE2    1 
ATOM   299  N N      . GLY A 1 64  ? -47.87604 -4.98973  -9.16463  1.000 24.65590  ? 359 GLY A N      1 
ATOM   300  C CA     . GLY A 1 64  ? -48.50643 -3.81039  -9.72623  1.000 26.29106  ? 359 GLY A CA     1 
ATOM   301  C C      . GLY A 1 64  ? -47.77933 -2.54624  -9.31100  1.000 35.98985  ? 359 GLY A C      1 
ATOM   302  O O      . GLY A 1 64  ? -47.12434 -2.48007  -8.26569  1.000 29.52208  ? 359 GLY A O      1 
ATOM   303  N N      . TYR A 1 65  ? -47.90995 -1.52132  -10.13775 1.000 27.47118  ? 360 TYR A N      1 
ATOM   304  C CA     . TYR A 1 65  ? -47.34730 -0.21836  -9.83421  1.000 25.42807  ? 360 TYR A CA     1 
ATOM   305  C C      . TYR A 1 65  ? -48.28891 0.51192   -8.88510  1.000 26.56731  ? 360 TYR A C      1 
ATOM   306  O O      . TYR A 1 65  ? -49.49972 0.56778   -9.12159  1.000 26.13086  ? 360 TYR A O      1 
ATOM   307  C CB     . TYR A 1 65  ? -47.13840 0.57997   -11.13102 1.000 26.63737  ? 360 TYR A CB     1 
ATOM   308  C CG     . TYR A 1 65  ? -46.59812 1.96187   -10.87895 1.000 26.73850  ? 360 TYR A CG     1 
ATOM   309  C CD1    . TYR A 1 65  ? -47.45522 3.02849   -10.62751 1.000 26.25414  ? 360 TYR A CD1    1 
ATOM   310  C CD2    . TYR A 1 65  ? -45.22969 2.19907   -10.87435 1.000 29.84688  ? 360 TYR A CD2    1 
ATOM   311  C CE1    . TYR A 1 65  ? -46.96711 4.29468   -10.39497 1.000 26.54330  ? 360 TYR A CE1    1 
ATOM   312  C CE2    . TYR A 1 65  ? -44.72633 3.47208   -10.61091 1.000 32.47464  ? 360 TYR A CE2    1 
ATOM   313  C CZ     . TYR A 1 65  ? -45.60408 4.51034   -10.36478 1.000 29.67537  ? 360 TYR A CZ     1 
ATOM   314  O OH     . TYR A 1 65  ? -45.11556 5.77696   -10.11557 1.000 31.73029  ? 360 TYR A OH     1 
ATOM   315  N N      . GLU A 1 66  ? -47.73635 1.05399   -7.79631  1.000 27.19300  ? 361 GLU A N      1 
ATOM   316  C CA     . GLU A 1 66  ? -48.52161 1.76353   -6.79494  1.000 25.27185  ? 361 GLU A CA     1 
ATOM   317  C C      . GLU A 1 66  ? -47.74071 2.96527   -6.27400  1.000 26.93848  ? 361 GLU A C      1 
ATOM   318  O O      . GLU A 1 66  ? -46.50782 2.94628   -6.19978  1.000 24.00778  ? 361 GLU A O      1 
ATOM   319  C CB     . GLU A 1 66  ? -48.87359 0.86960   -5.60567  1.000 27.20847  ? 361 GLU A CB     1 
ATOM   320  C CG     . GLU A 1 66  ? -49.59818 -0.41994  -5.95911  1.000 30.08592  ? 361 GLU A CG     1 
ATOM   321  C CD     . GLU A 1 66  ? -49.70750 -1.33339  -4.75763  1.000 31.51552  ? 361 GLU A CD     1 
ATOM   322  O OE1    . GLU A 1 66  ? -48.64158 -1.77503  -4.25468  1.000 30.83840  ? 361 GLU A OE1    1 
ATOM   323  O OE2    . GLU A 1 66  ? -50.85427 -1.58754  -4.31297  1.000 37.21784  ? 361 GLU A OE2    1 
ATOM   324  N N      . GLU A 1 67  ? -48.46682 4.01544   -5.91120  1.000 26.08114  ? 362 GLU A N      1 
ATOM   325  C CA     . GLU A 1 67  ? -47.87708 5.15456   -5.21774  1.000 26.51028  ? 362 GLU A CA     1 
ATOM   326  C C      . GLU A 1 67  ? -48.56000 5.31754   -3.86834  1.000 26.64882  ? 362 GLU A C      1 
ATOM   327  O O      . GLU A 1 67  ? -49.76998 5.08334   -3.74467  1.000 26.44926  ? 362 GLU A O      1 
ATOM   328  C CB     . GLU A 1 67  ? -47.99077 6.43327   -6.05026  1.000 27.82933  ? 362 GLU A CB     1 
ATOM   329  C CG     . GLU A 1 67  ? -47.43113 6.24168   -7.46859  1.000 30.55793  ? 362 GLU A CG     1 
ATOM   330  C CD     . GLU A 1 67  ? -47.35112 7.53406   -8.27693  1.000 41.33282  ? 362 GLU A CD     1 
ATOM   331  O OE1    . GLU A 1 67  ? -46.66841 7.51401   -9.31162  1.000 38.17250  ? 362 GLU A OE1    1 
ATOM   332  O OE2    . GLU A 1 67  ? -47.97326 8.55825   -7.90295  1.000 36.47259  ? 362 GLU A OE2    1 
ATOM   333  N N      . PHE A 1 68  ? -47.77465 5.69841   -2.85311  1.000 22.75821  ? 363 PHE A N      1 
ATOM   334  C CA     . PHE A 1 68  ? -48.25419 5.74861   -1.47359  1.000 23.03688  ? 363 PHE A CA     1 
ATOM   335  C C      . PHE A 1 68  ? -47.81258 7.03747   -0.79709  1.000 29.11506  ? 363 PHE A C      1 
ATOM   336  O O      . PHE A 1 68  ? -46.79913 7.63547   -1.16196  1.000 27.76007  ? 363 PHE A O      1 
ATOM   337  C CB     . PHE A 1 68  ? -47.70612 4.59820   -0.60883  1.000 25.31716  ? 363 PHE A CB     1 
ATOM   338  C CG     . PHE A 1 68  ? -48.13105 3.22597   -1.04628  1.000 24.29265  ? 363 PHE A CG     1 
ATOM   339  C CD1    . PHE A 1 68  ? -49.28487 2.65500   -0.53238  1.000 25.52817  ? 363 PHE A CD1    1 
ATOM   340  C CD2    . PHE A 1 68  ? -47.36213 2.50018   -1.93195  1.000 30.48658  ? 363 PHE A CD2    1 
ATOM   341  C CE1    . PHE A 1 68  ? -49.68418 1.39061   -0.92139  1.000 27.82301  ? 363 PHE A CE1    1 
ATOM   342  C CE2    . PHE A 1 68  ? -47.75612 1.23280   -2.32202  1.000 29.15982  ? 363 PHE A CE2    1 
ATOM   343  C CZ     . PHE A 1 68  ? -48.92161 0.68792   -1.80246  1.000 24.30640  ? 363 PHE A CZ     1 
ATOM   344  N N      . THR A 1 69  ? -48.55447 7.44208   0.23273   1.000 25.94987  ? 364 THR A N      1 
ATOM   345  C CA     . THR A 1 69  ? -47.99845 8.31157   1.26723   1.000 27.49135  ? 364 THR A CA     1 
ATOM   346  C C      . THR A 1 69  ? -47.76264 7.46529   2.50706   1.000 29.54621  ? 364 THR A C      1 
ATOM   347  O O      . THR A 1 69  ? -48.64038 6.69447   2.89928   1.000 30.21741  ? 364 THR A O      1 
ATOM   348  C CB     . THR A 1 69  ? -48.91909 9.48949   1.61345   1.000 35.18714  ? 364 THR A CB     1 
ATOM   349  O OG1    . THR A 1 69  ? -50.16006 8.99371   2.12156   1.000 40.99985  ? 364 THR A OG1    1 
ATOM   350  C CG2    . THR A 1 69  ? -49.18191 10.35888  0.38116   1.000 29.57178  ? 364 THR A CG2    1 
ATOM   351  N N      . MET A 1 70  ? -46.57155 7.58683   3.09897   1.000 27.95880  ? 365 MET A N      1 
ATOM   352  C CA     . MET A 1 70  ? -46.21974 6.92699   4.35559   1.000 26.17646  ? 365 MET A CA     1 
ATOM   353  C C      . MET A 1 70  ? -46.26130 7.96954   5.46543   1.000 25.35580  ? 365 MET A C      1 
ATOM   354  O O      . MET A 1 70  ? -45.57208 8.99214   5.37671   1.000 30.65387  ? 365 MET A O      1 
ATOM   355  C CB     . MET A 1 70  ? -44.81580 6.32045   4.30734   1.000 31.35098  ? 365 MET A CB     1 
ATOM   356  C CG     . MET A 1 70  ? -44.60760 5.15088   3.39164   1.000 37.70347  ? 365 MET A CG     1 
ATOM   357  S SD     . MET A 1 70  ? -42.85283 4.69992   3.31814   1.000 37.57047  ? 365 MET A SD     1 
ATOM   358  C CE     . MET A 1 70  ? -42.36646 4.46580   4.99933   1.000 27.46265  ? 365 MET A CE     1 
ATOM   359  N N      . VAL A 1 71  ? -47.04754 7.71865   6.50646   1.000 24.01422  ? 366 VAL A N      1 
ATOM   360  C CA     . VAL A 1 71  ? -47.18600 8.66406   7.60827   1.000 25.12934  ? 366 VAL A CA     1 
ATOM   361  C C      . VAL A 1 71  ? -46.80502 7.95001   8.88991   1.000 24.10458  ? 366 VAL A C      1 
ATOM   362  O O      . VAL A 1 71  ? -47.45661 6.97450   9.27791   1.000 26.19893  ? 366 VAL A O      1 
ATOM   363  C CB     . VAL A 1 71  ? -48.60636 9.23632   7.70438   1.000 29.07781  ? 366 VAL A CB     1 
ATOM   364  C CG1    . VAL A 1 71  ? -48.72340 10.13100  8.92431   1.000 37.51434  ? 366 VAL A CG1    1 
ATOM   365  C CG2    . VAL A 1 71  ? -48.93944 10.01454  6.43242   1.000 34.56224  ? 366 VAL A CG2    1 
ATOM   366  N N      . GLY A 1 72  ? -45.73673 8.41613   9.53491   1.000 22.88957  ? 367 GLY A N      1 
ATOM   367  C CA     . GLY A 1 72  ? -45.35166 7.92794   10.83562  1.000 25.05495  ? 367 GLY A CA     1 
ATOM   368  C C      . GLY A 1 72  ? -45.41831 9.05307   11.85620  1.000 28.78035  ? 367 GLY A C      1 
ATOM   369  O O      . GLY A 1 72  ? -45.70564 10.20634  11.52780  1.000 24.53199  ? 367 GLY A O      1 
ATOM   370  N N      A ARG A 1 73  ? -45.13226 8.68125   13.10773  0.510 27.30361  ? 368 ARG A N      1 
ATOM   371  N N      B ARG A 1 73  ? -45.11960 8.70100   13.10392  0.490 27.30884  ? 368 ARG A N      1 
ATOM   372  C CA     A ARG A 1 73  ? -45.08848 9.66197   14.18502  0.510 30.97527  ? 368 ARG A CA     1 
ATOM   373  C CA     B ARG A 1 73  ? -45.14184 9.73071   14.13203  0.490 30.93531  ? 368 ARG A CA     1 
ATOM   374  C C      A ARG A 1 73  ? -43.95820 10.66280  13.98728  0.510 30.45891  ? 368 ARG A C      1 
ATOM   375  C C      B ARG A 1 73  ? -43.91899 10.63847  14.08650  0.490 30.43398  ? 368 ARG A C      1 
ATOM   376  O O      A ARG A 1 73  ? -44.09862 11.83780  14.34672  0.510 29.06090  ? 368 ARG A O      1 
ATOM   377  O O      B ARG A 1 73  ? -43.96876 11.74185  14.63977  0.490 29.29708  ? 368 ARG A O      1 
ATOM   378  C CB     A ARG A 1 73  ? -44.91161 8.95236   15.52978  0.510 31.76084  ? 368 ARG A CB     1 
ATOM   379  C CB     B ARG A 1 73  ? -45.27196 9.09863   15.51895  0.490 32.79790  ? 368 ARG A CB     1 
ATOM   380  C CG     A ARG A 1 73  ? -46.09735 8.11132   15.96735  0.510 35.43888  ? 368 ARG A CG     1 
ATOM   381  C CG     B ARG A 1 73  ? -46.71840 8.92356   15.94948  0.490 34.19131  ? 368 ARG A CG     1 
ATOM   382  C CD     A ARG A 1 73  ? -47.09267 8.95583   16.75025  0.510 41.08302  ? 368 ARG A CD     1 
ATOM   383  C CD     B ARG A 1 73  ? -46.84707 8.68623   17.45781  0.490 40.89646  ? 368 ARG A CD     1 
ATOM   384  N NE     A ARG A 1 73  ? -46.47483 9.62421   17.89282  0.510 39.49100  ? 368 ARG A NE     1 
ATOM   385  N NE     B ARG A 1 73  ? -48.07990 9.27890   17.96430  0.490 43.75689  ? 368 ARG A NE     1 
ATOM   386  C CZ     A ARG A 1 73  ? -47.07936 10.54495  18.63152  0.510 33.10598  ? 368 ARG A CZ     1 
ATOM   387  C CZ     B ARG A 1 73  ? -49.25119 8.65993   17.99276  0.490 43.22301  ? 368 ARG A CZ     1 
ATOM   388  N NH1    A ARG A 1 73  ? -48.33282 10.89759  18.40322  0.510 40.02497  ? 368 ARG A NH1    1 
ATOM   389  N NH1    B ARG A 1 73  ? -49.37480 7.39884   17.61525  0.490 45.62061  ? 368 ARG A NH1    1 
ATOM   390  N NH2    A ARG A 1 73  ? -46.40763 11.13054  19.61785  0.510 31.33522  ? 368 ARG A NH2    1 
ATOM   391  N NH2    B ARG A 1 73  ? -50.32552 9.32440   18.40642  0.490 47.64005  ? 368 ARG A NH2    1 
ATOM   392  N N      . ARG A 1 74  ? -42.83084 10.21551  13.43370  1.000 21.92524  ? 369 ARG A N      1 
ATOM   393  C CA     . ARG A 1 74  ? -41.61082 11.01127  13.39258  1.000 23.18305  ? 369 ARG A CA     1 
ATOM   394  C C      . ARG A 1 74  ? -41.10215 11.26230  11.97770  1.000 24.05101  ? 369 ARG A C      1 
ATOM   395  O O      . ARG A 1 74  ? -40.06566 11.91030  11.81865  1.000 22.90672  ? 369 ARG A O      1 
ATOM   396  C CB     . ARG A 1 74  ? -40.50260 10.32475  14.22419  1.000 22.19349  ? 369 ARG A CB     1 
ATOM   397  C CG     . ARG A 1 74  ? -40.97980 9.99935   15.65804  1.000 24.56445  ? 369 ARG A CG     1 
ATOM   398  C CD     . ARG A 1 74  ? -39.91749 9.26128   16.48200  1.000 25.35926  ? 369 ARG A CD     1 
ATOM   399  N NE     . ARG A 1 74  ? -38.79693 10.12674  16.82724  1.000 27.58006  ? 369 ARG A NE     1 
ATOM   400  C CZ     . ARG A 1 74  ? -38.79818 11.00008  17.82807  1.000 33.76324  ? 369 ARG A CZ     1 
ATOM   401  N NH1    . ARG A 1 74  ? -39.87575 11.19955  18.57682  1.000 29.77777  ? 369 ARG A NH1    1 
ATOM   402  N NH2    . ARG A 1 74  ? -37.69501 11.70251  18.07795  1.000 33.12539  ? 369 ARG A NH2    1 
ATOM   403  N N      . ALA A 1 75  ? -41.78603 10.75681  10.96001  1.000 22.07811  ? 370 ALA A N      1 
ATOM   404  C CA     . ALA A 1 75  ? -41.33149 10.90324  9.58042   1.000 22.13566  ? 370 ALA A CA     1 
ATOM   405  C C      . ALA A 1 75  ? -42.51730 10.67460  8.65433   1.000 25.38958  ? 370 ALA A C      1 
ATOM   406  O O      . ALA A 1 75  ? -43.52064 10.07034  9.04048   1.000 25.85539  ? 370 ALA A O      1 
ATOM   407  C CB     . ALA A 1 75  ? -40.19047 9.92674   9.26483   1.000 21.53283  ? 370 ALA A CB     1 
ATOM   408  N N      . THR A 1 76  ? -42.40739 11.19693  7.43754   1.000 26.42114  ? 371 THR A N      1 
ATOM   409  C CA     . THR A 1 76  ? -43.39642 10.90877  6.40216   1.000 26.48577  ? 371 THR A CA     1 
ATOM   410  C C      . THR A 1 76  ? -42.68506 10.83494  5.06509   1.000 26.01814  ? 371 THR A C      1 
ATOM   411  O O      . THR A 1 76  ? -41.59110 11.37580  4.89313   1.000 27.43694  ? 371 THR A O      1 
ATOM   412  C CB     . THR A 1 76  ? -44.52650 11.95689  6.34927   1.000 37.95508  ? 371 THR A CB     1 
ATOM   413  O OG1    . THR A 1 76  ? -44.00124 13.21594  5.91607   1.000 45.28365  ? 371 THR A OG1    1 
ATOM   414  C CG2    . THR A 1 76  ? -45.15854 12.13385  7.72033   1.000 36.03187  ? 371 THR A CG2    1 
ATOM   415  N N      . ALA A 1 77  ? -43.32077 10.17721  4.09398   1.000 23.95763  ? 372 ALA A N      1 
ATOM   416  C CA     . ALA A 1 77  ? -42.63222 10.05556  2.82593   1.000 24.74214  ? 372 ALA A CA     1 
ATOM   417  C C      . ALA A 1 77  ? -43.65490 9.84078   1.72573   1.000 30.71325  ? 372 ALA A C      1 
ATOM   418  O O      . ALA A 1 77  ? -44.80322 9.46641   1.97294   1.000 27.18401  ? 372 ALA A O      1 
ATOM   419  C CB     . ALA A 1 77  ? -41.60704 8.90593   2.86463   1.000 24.61093  ? 372 ALA A CB     1 
ATOM   420  N N      . ILE A 1 78  ? -43.21455 10.09981  0.50584   1.000 27.40156  ? 373 ILE A N      1 
ATOM   421  C CA     . ILE A 1 78  ? -43.93110 9.70421   -0.69369  1.000 24.13014  ? 373 ILE A CA     1 
ATOM   422  C C      . ILE A 1 78  ? -43.16129 8.55685   -1.32709  1.000 22.55166  ? 373 ILE A C      1 
ATOM   423  O O      . ILE A 1 78  ? -41.96017 8.67521   -1.58375  1.000 24.51226  ? 373 ILE A O      1 
ATOM   424  C CB     . ILE A 1 78  ? -44.07563 10.87806  -1.67561  1.000 27.94548  ? 373 ILE A CB     1 
ATOM   425  C CG1    . ILE A 1 78  ? -45.25251 11.78142  -1.26414  1.000 35.03048  ? 373 ILE A CG1    1 
ATOM   426  C CG2    . ILE A 1 78  ? -44.30812 10.34810  -3.07966  1.000 37.44560  ? 373 ILE A CG2    1 
ATOM   427  C CD1    . ILE A 1 78  ? -45.19733 12.27585  0.16496   1.000 47.91486  ? 373 ILE A CD1    1 
ATOM   428  N N      . LEU A 1 79  ? -43.85939 7.46535   -1.62102  1.000 25.67181  ? 374 LEU A N      1 
ATOM   429  C CA     . LEU A 1 79  ? -43.24036 6.26284   -2.15989  1.000 22.58013  ? 374 LEU A CA     1 
ATOM   430  C C      . LEU A 1 79  ? -43.89961 5.89651   -3.48410  1.000 21.75488  ? 374 LEU A C      1 
ATOM   431  O O      . LEU A 1 79  ? -45.12645 5.82166   -3.56677  1.000 24.55790  ? 374 LEU A O      1 
ATOM   432  C CB     . LEU A 1 79  ? -43.36903 5.10426   -1.15608  1.000 26.81784  ? 374 LEU A CB     1 
ATOM   433  C CG     . LEU A 1 79  ? -43.07103 3.69499   -1.65283  1.000 27.80650  ? 374 LEU A CG     1 
ATOM   434  C CD1    . LEU A 1 79  ? -41.62096 3.60815   -2.09858  1.000 29.76959  ? 374 LEU A CD1    1 
ATOM   435  C CD2    . LEU A 1 79  ? -43.33130 2.72332   -0.49933  1.000 30.83322  ? 374 LEU A CD2    1 
ATOM   436  N N      . ARG A 1 80  ? -43.07965 5.65367   -4.50853  1.000 23.85544  ? 375 ARG A N      1 
ATOM   437  C CA     . ARG A 1 80  ? -43.52049 5.06701   -5.77170  1.000 22.56242  ? 375 ARG A CA     1 
ATOM   438  C C      . ARG A 1 80  ? -42.82050 3.72661   -5.94002  1.000 22.07260  ? 375 ARG A C      1 
ATOM   439  O O      . ARG A 1 80  ? -41.58808 3.65741   -5.84419  1.000 24.00340  ? 375 ARG A O      1 
ATOM   440  C CB     . ARG A 1 80  ? -43.18703 5.98396   -6.95219  1.000 25.33337  ? 375 ARG A CB     1 
ATOM   441  C CG     . ARG A 1 80  ? -43.88932 7.32375   -6.88327  1.000 29.70643  ? 375 ARG A CG     1 
ATOM   442  C CD     . ARG A 1 80  ? -43.42461 8.25158   -8.01878  1.000 34.08905  ? 375 ARG A CD     1 
ATOM   443  N NE     . ARG A 1 80  ? -44.09820 9.53858   -7.91811  1.000 37.37198  ? 375 ARG A NE     1 
ATOM   444  C CZ     . ARG A 1 80  ? -43.80843 10.59763  -8.65899  1.000 41.69179  ? 375 ARG A CZ     1 
ATOM   445  N NH1    . ARG A 1 80  ? -42.84470 10.56130  -9.56639  1.000 38.35798  ? 375 ARG A NH1    1 
ATOM   446  N NH2    . ARG A 1 80  ? -44.50500 11.71969  -8.48649  1.000 41.31296  ? 375 ARG A NH2    1 
ATOM   447  N N      . LYS A 1 81  ? -43.59404 2.66914   -6.19674  1.000 23.05585  ? 376 LYS A N      1 
ATOM   448  C CA     . LYS A 1 81  ? -43.01818 1.33540   -6.28333  1.000 22.99868  ? 376 LYS A CA     1 
ATOM   449  C C      . LYS A 1 81  ? -43.68736 0.53155   -7.39193  1.000 29.63937  ? 376 LYS A C      1 
ATOM   450  O O      . LYS A 1 81  ? -44.86350 0.71682   -7.70159  1.000 25.39929  ? 376 LYS A O      1 
ATOM   451  C CB     . LYS A 1 81  ? -43.14360 0.57763   -4.93790  1.000 26.42461  ? 376 LYS A CB     1 
ATOM   452  C CG     . LYS A 1 81  ? -44.53301 0.05790   -4.62860  1.000 31.44754  ? 376 LYS A CG     1 
ATOM   453  C CD     . LYS A 1 81  ? -44.54861 -0.83580  -3.35715  1.000 30.85960  ? 376 LYS A CD     1 
ATOM   454  C CE     . LYS A 1 81  ? -43.85800 -2.17440  -3.57800  1.000 32.41530  ? 376 LYS A CE     1 
ATOM   455  N NZ     . LYS A 1 81  ? -44.74010 -3.16173  -4.29091  1.000 34.54978  ? 376 LYS A NZ     1 
ATOM   456  N N      . ALA A 1 82  ? -42.92253 -0.37264  -7.97694  1.000 29.55761  ? 377 ALA A N      1 
ATOM   457  C CA     . ALA A 1 82  ? -43.45588 -1.38299  -8.87095  1.000 29.95409  ? 377 ALA A CA     1 
ATOM   458  C C      . ALA A 1 82  ? -43.29140 -2.73708  -8.18256  1.000 31.15974  ? 377 ALA A C      1 
ATOM   459  O O      . ALA A 1 82  ? -42.91424 -2.81614  -7.00907  1.000 28.19662  ? 377 ALA A O      1 
ATOM   460  C CB     . ALA A 1 82  ? -42.75045 -1.30454  -10.22171 1.000 30.13488  ? 377 ALA A CB     1 
ATOM   461  N N      . THR A 1 83  ? -43.58297 -3.81162  -8.90883  1.000 26.38209  ? 378 THR A N      1 
ATOM   462  C CA     . THR A 1 83  ? -43.45735 -5.13170  -8.30872  1.000 26.98876  ? 378 THR A CA     1 
ATOM   463  C C      . THR A 1 83  ? -42.01795 -5.33562  -7.87887  1.000 26.18559  ? 378 THR A C      1 
ATOM   464  O O      . THR A 1 83  ? -41.11466 -5.39649  -8.72039  1.000 24.51864  ? 378 THR A O      1 
ATOM   465  C CB     . THR A 1 83  ? -43.88662 -6.21695  -9.29935  1.000 23.30418  ? 378 THR A CB     1 
ATOM   466  O OG1    . THR A 1 83  ? -45.19025 -5.89444  -9.78915  1.000 24.16826  ? 378 THR A OG1    1 
ATOM   467  C CG2    . THR A 1 83  ? -43.94366 -7.56634  -8.59691  1.000 24.90733  ? 378 THR A CG2    1 
ATOM   468  N N      . ARG A 1 84  ? -41.79420 -5.42943  -6.57251  1.000 25.47674  ? 379 ARG A N      1 
ATOM   469  C CA     . ARG A 1 84  ? -40.46589 -5.69890  -6.02184  1.000 23.57932  ? 379 ARG A CA     1 
ATOM   470  C C      . ARG A 1 84  ? -39.41936 -4.68173  -6.49710  1.000 24.13211  ? 379 ARG A C      1 
ATOM   471  O O      . ARG A 1 84  ? -38.24891 -5.00479  -6.68324  1.000 22.96254  ? 379 ARG A O      1 
ATOM   472  C CB     . ARG A 1 84  ? -40.02192 -7.13519  -6.33560  1.000 26.96315  ? 379 ARG A CB     1 
ATOM   473  C CG     . ARG A 1 84  ? -40.98269 -8.18658  -5.78290  1.000 24.79490  ? 379 ARG A CG     1 
ATOM   474  C CD     . ARG A 1 84  ? -40.31219 -9.57313  -5.66442  1.000 31.60904  ? 379 ARG A CD     1 
ATOM   475  N NE     . ARG A 1 84  ? -39.14280 -9.51980  -4.79187  1.000 27.57860  ? 379 ARG A NE     1 
ATOM   476  C CZ     . ARG A 1 84  ? -38.11035 -10.35160 -4.84339  1.000 31.73041  ? 379 ARG A CZ     1 
ATOM   477  N NH1    . ARG A 1 84  ? -38.09695 -11.39382 -5.66554  1.000 29.93931  ? 379 ARG A NH1    1 
ATOM   478  N NH2    . ARG A 1 84  ? -37.06336 -10.13014 -4.05219  1.000 27.43135  ? 379 ARG A NH2    1 
ATOM   479  N N      . ARG A 1 85  ? -39.81358 -3.42490  -6.67484  1.000 22.58484  ? 380 ARG A N      1 
ATOM   480  C CA     . ARG A 1 85  ? -38.84588 -2.41480  -7.08851  1.000 22.06098  ? 380 ARG A CA     1 
ATOM   481  C C      . ARG A 1 85  ? -39.25704 -1.09434  -6.45979  1.000 31.21679  ? 380 ARG A C      1 
ATOM   482  O O      . ARG A 1 85  ? -40.38742 -0.63406  -6.66193  1.000 29.33995  ? 380 ARG A O      1 
ATOM   483  C CB     . ARG A 1 85  ? -38.78296 -2.29420  -8.61977  1.000 28.47799  ? 380 ARG A CB     1 
ATOM   484  C CG     . ARG A 1 85  ? -37.43900 -1.79911  -9.14536  1.000 39.59932  ? 380 ARG A CG     1 
ATOM   485  C CD     . ARG A 1 85  ? -37.20789 -2.18963  -10.61709 1.000 42.08564  ? 380 ARG A CD     1 
ATOM   486  N NE     . ARG A 1 85  ? -38.40950 -1.96847  -11.41229 1.000 38.80723  ? 380 ARG A NE     1 
ATOM   487  C CZ     . ARG A 1 85  ? -38.69467 -0.83483  -12.03722 1.000 39.64422  ? 380 ARG A CZ     1 
ATOM   488  N NH1    . ARG A 1 85  ? -37.84009 0.17992   -12.05652 1.000 33.75140  ? 380 ARG A NH1    1 
ATOM   489  N NH2    . ARG A 1 85  ? -39.87132 -0.70995  -12.64627 1.000 30.67363  ? 380 ARG A NH2    1 
ATOM   490  N N      . LEU A 1 86  ? -38.36604 -0.50060  -5.68026  1.000 27.09194  ? 381 LEU A N      1 
ATOM   491  C CA     . LEU A 1 86  ? -38.58647 0.86394   -5.22436  1.000 26.18239  ? 381 LEU A CA     1 
ATOM   492  C C      . LEU A 1 86  ? -38.14871 1.80384   -6.34720  1.000 26.06976  ? 381 LEU A C      1 
ATOM   493  O O      . LEU A 1 86  ? -37.00956 1.73167   -6.82146  1.000 28.10757  ? 381 LEU A O      1 
ATOM   494  C CB     . LEU A 1 86  ? -37.82541 1.14353   -3.93470  1.000 23.42091  ? 381 LEU A CB     1 
ATOM   495  C CG     . LEU A 1 86  ? -38.03334 2.49758   -3.24823  1.000 24.86870  ? 381 LEU A CG     1 
ATOM   496  C CD1    . LEU A 1 86  ? -37.73903 2.35903   -1.73147  1.000 23.20036  ? 381 LEU A CD1    1 
ATOM   497  C CD2    . LEU A 1 86  ? -37.08400 3.53451   -3.85100  1.000 27.46576  ? 381 LEU A CD2    1 
ATOM   498  N N      . ILE A 1 87  ? -39.05862 2.64982   -6.81034  1.000 25.18811  ? 382 ILE A N      1 
ATOM   499  C CA     . ILE A 1 87  ? -38.74382 3.60965   -7.86963  1.000 25.99462  ? 382 ILE A CA     1 
ATOM   500  C C      . ILE A 1 87  ? -38.34527 4.97257   -7.29561  1.000 29.81304  ? 382 ILE A C      1 
ATOM   501  O O      . ILE A 1 87  ? -37.32536 5.54737   -7.68313  1.000 26.47280  ? 382 ILE A O      1 
ATOM   502  C CB     . ILE A 1 87  ? -39.94195 3.72943   -8.82693  1.000 27.20405  ? 382 ILE A CB     1 
ATOM   503  C CG1    . ILE A 1 87  ? -40.22589 2.34900   -9.43340  1.000 30.88233  ? 382 ILE A CG1    1 
ATOM   504  C CG2    . ILE A 1 87  ? -39.61949 4.74347   -9.92272  1.000 31.44893  ? 382 ILE A CG2    1 
ATOM   505  C CD1    . ILE A 1 87  ? -41.53577 2.31035   -10.20241 1.000 35.55904  ? 382 ILE A CD1    1 
ATOM   506  N N      . GLN A 1 88  ? -39.12608 5.49612   -6.36018  1.000 24.87712  ? 383 GLN A N      1 
ATOM   507  C CA     . GLN A 1 88  ? -38.77523 6.78039   -5.76326  1.000 24.44860  ? 383 GLN A CA     1 
ATOM   508  C C      . GLN A 1 88  ? -39.25600 6.84015   -4.32266  1.000 24.87238  ? 383 GLN A C      1 
ATOM   509  O O      . GLN A 1 88  ? -40.33674 6.34851   -3.99864  1.000 24.54043  ? 383 GLN A O      1 
ATOM   510  C CB     . GLN A 1 88  ? -39.38540 7.94824   -6.55166  1.000 28.82057  ? 383 GLN A CB     1 
ATOM   511  C CG     . GLN A 1 88  ? -38.75475 9.30141   -6.26740  1.000 31.48377  ? 383 GLN A CG     1 
ATOM   512  C CD     . GLN A 1 88  ? -39.44427 10.42727  -7.03779  1.000 50.90970  ? 383 GLN A CD     1 
ATOM   513  O OE1    . GLN A 1 88  ? -40.65924 10.59853  -6.94416  1.000 48.32060  ? 383 GLN A OE1    1 
ATOM   514  N NE2    . GLN A 1 88  ? -38.66972 11.19063  -7.80637  1.000 45.96733  ? 383 GLN A NE2    1 
ATOM   515  N N      . LEU A 1 89  ? -38.46887 7.48009   -3.47021  1.000 20.79699  ? 384 LEU A N      1 
ATOM   516  C CA     . LEU A 1 89  ? -38.86640 7.67480   -2.08060  1.000 20.85325  ? 384 LEU A CA     1 
ATOM   517  C C      . LEU A 1 89  ? -38.35316 9.03889   -1.66539  1.000 22.51418  ? 384 LEU A C      1 
ATOM   518  O O      . LEU A 1 89  ? -37.14471 9.27514   -1.70496  1.000 27.01361  ? 384 LEU A O      1 
ATOM   519  C CB     . LEU A 1 89  ? -38.28610 6.58527   -1.16545  1.000 24.20118  ? 384 LEU A CB     1 
ATOM   520  C CG     . LEU A 1 89  ? -38.59412 6.77634   0.33281   1.000 23.46283  ? 384 LEU A CG     1 
ATOM   521  C CD1    . LEU A 1 89  ? -40.02656 6.41774   0.64394   1.000 26.42600  ? 384 LEU A CD1    1 
ATOM   522  C CD2    . LEU A 1 89  ? -37.60863 5.98087   1.21635   1.000 26.37806  ? 384 LEU A CD2    1 
ATOM   523  N N      . ILE A 1 90  ? -39.26269 9.93985   -1.32803  1.000 22.65835  ? 385 ILE A N      1 
ATOM   524  C CA     . ILE A 1 90  ? -38.91472 11.26811  -0.83345  1.000 23.45530  ? 385 ILE A CA     1 
ATOM   525  C C      . ILE A 1 90  ? -39.36350 11.33201  0.61691   1.000 21.18192  ? 385 ILE A C      1 
ATOM   526  O O      . ILE A 1 90  ? -40.56757 11.27866  0.90540   1.000 25.48076  ? 385 ILE A O      1 
ATOM   527  C CB     . ILE A 1 90  ? -39.56241 12.36912  -1.66968  1.000 25.03138  ? 385 ILE A CB     1 
ATOM   528  C CG1    . ILE A 1 90  ? -39.12623 12.23173  -3.14095  1.000 27.64195  ? 385 ILE A CG1    1 
ATOM   529  C CG2    . ILE A 1 90  ? -39.18826 13.74562  -1.08441  1.000 30.97455  ? 385 ILE A CG2    1 
ATOM   530  C CD1    . ILE A 1 90  ? -39.78068 13.22553  -4.04470  1.000 35.76623  ? 385 ILE A CD1    1 
ATOM   531  N N      A VAL A 1 91  ? -38.40160 11.43504  1.52957   0.378 22.46359  ? 386 VAL A N      1 
ATOM   532  N N      B VAL A 1 91  ? -38.41655 11.46175  1.53826   0.622 22.45573  ? 386 VAL A N      1 
ATOM   533  C CA     A VAL A 1 91  ? -38.65289 11.30930  2.95860   0.378 23.80106  ? 386 VAL A CA     1 
ATOM   534  C CA     B VAL A 1 91  ? -38.69822 11.28506  2.95641   0.622 23.81908  ? 386 VAL A CA     1 
ATOM   535  C C      A VAL A 1 91  ? -38.37144 12.64028  3.64410   0.378 25.08088  ? 386 VAL A C      1 
ATOM   536  C C      B VAL A 1 91  ? -38.31995 12.55256  3.70740   0.622 25.11283  ? 386 VAL A C      1 
ATOM   537  O O      A VAL A 1 91  ? -37.45818 13.38128  3.25672   0.378 25.21475  ? 386 VAL A O      1 
ATOM   538  O O      B VAL A 1 91  ? -37.29402 13.17634  3.41494   0.622 24.78873  ? 386 VAL A O      1 
ATOM   539  C CB     A VAL A 1 91  ? -37.80238 10.19050  3.59475   0.378 23.84602  ? 386 VAL A CB     1 
ATOM   540  C CB     B VAL A 1 91  ? -37.95236 10.05995  3.52283   0.622 23.96302  ? 386 VAL A CB     1 
ATOM   541  C CG1    A VAL A 1 91  ? -38.22872 9.93539   5.03226   0.378 22.98122  ? 386 VAL A CG1    1 
ATOM   542  C CG1    B VAL A 1 91  ? -36.47649 10.08182  3.11457   0.622 23.01032  ? 386 VAL A CG1    1 
ATOM   543  C CG2    A VAL A 1 91  ? -37.87387 8.91165   2.77847   0.378 21.38765  ? 386 VAL A CG2    1 
ATOM   544  C CG2    B VAL A 1 91  ? -38.10994 9.98850   5.03828   0.622 22.97550  ? 386 VAL A CG2    1 
ATOM   545  N N      . SER A 1 92  ? -39.16194 12.93866  4.66753   1.000 24.90572  ? 387 SER A N      1 
ATOM   546  C CA     . SER A 1 92  ? -38.84355 14.01400  5.59421   1.000 28.04307  ? 387 SER A CA     1 
ATOM   547  C C      . SER A 1 92  ? -39.11362 13.52138  7.01876   1.000 28.38079  ? 387 SER A C      1 
ATOM   548  O O      . SER A 1 92  ? -39.86414 12.56703  7.22127   1.000 26.93484  ? 387 SER A O      1 
ATOM   549  C CB     . SER A 1 92  ? -39.63956 15.28943  5.28449   1.000 32.97898  ? 387 SER A CB     1 
ATOM   550  O OG     . SER A 1 92  ? -41.02340 15.11334  5.51542   1.000 37.93350  ? 387 SER A OG     1 
ATOM   551  N N      . GLY A 1 93  ? -38.47269 14.13159  8.00798   1.000 27.69520  ? 388 GLY A N      1 
ATOM   552  C CA     . GLY A 1 93  ? -38.71869 13.68581  9.37183   1.000 23.86923  ? 388 GLY A CA     1 
ATOM   553  C C      . GLY A 1 93  ? -37.99323 14.54578  10.38525  1.000 28.00268  ? 388 GLY A C      1 
ATOM   554  O O      . GLY A 1 93  ? -37.34836 15.54045  10.04064  1.000 26.87361  ? 388 GLY A O      1 
ATOM   555  N N      . ARG A 1 94  ? -38.08167 14.11602  11.65219  1.000 26.63958  ? 389 ARG A N      1 
ATOM   556  C CA     . ARG A 1 94  ? -37.55418 14.93125  12.74551  1.000 25.22511  ? 389 ARG A CA     1 
ATOM   557  C C      . ARG A 1 94  ? -36.03316 15.03197  12.69929  1.000 32.02611  ? 389 ARG A C      1 
ATOM   558  O O      . ARG A 1 94  ? -35.47231 16.10770  12.94693  1.000 29.03178  ? 389 ARG A O      1 
ATOM   559  C CB     . ARG A 1 94  ? -38.01333 14.37206  14.09891  1.000 29.74089  ? 389 ARG A CB     1 
ATOM   560  C CG     . ARG A 1 94  ? -39.50128 14.57983  14.37724  1.000 35.25808  ? 389 ARG A CG     1 
ATOM   561  C CD     . ARG A 1 94  ? -39.89271 14.03468  15.74481  1.000 42.94988  ? 389 ARG A CD     1 
ATOM   562  N NE     . ARG A 1 94  ? -39.35194 14.84484  16.83121  1.000 52.79254  ? 389 ARG A NE     1 
ATOM   563  C CZ     . ARG A 1 94  ? -40.07756 15.66352  17.58043  1.000 54.25740  ? 389 ARG A CZ     1 
ATOM   564  N NH1    . ARG A 1 94  ? -41.38330 15.78531  17.39915  1.000 51.18939  ? 389 ARG A NH1    1 
ATOM   565  N NH2    . ARG A 1 94  ? -39.47849 16.37331  18.53752  1.000 49.41462  ? 389 ARG A NH2    1 
ATOM   566  N N      . ASP A 1 95  ? -35.34125 13.93181  12.40980  1.000 23.50350  ? 390 ASP A N      1 
ATOM   567  C CA     . ASP A 1 95  ? -33.88144 13.93516  12.40501  1.000 22.47449  ? 390 ASP A CA     1 
ATOM   568  C C      . ASP A 1 95  ? -33.40734 12.66940  11.69995  1.000 26.34361  ? 390 ASP A C      1 
ATOM   569  O O      . ASP A 1 95  ? -34.21169 11.88919  11.18088  1.000 25.03656  ? 390 ASP A O      1 
ATOM   570  C CB     . ASP A 1 95  ? -33.31252 14.03771  13.83007  1.000 26.24883  ? 390 ASP A CB     1 
ATOM   571  C CG     . ASP A 1 95  ? -33.90614 12.99018  14.78567  1.000 38.06461  ? 390 ASP A CG     1 
ATOM   572  O OD1    . ASP A 1 95  ? -34.40194 11.93008  14.31724  1.000 30.62746  ? 390 ASP A OD1    1 
ATOM   573  O OD2    . ASP A 1 95  ? -33.90917 13.24902  16.01604  1.000 34.63771  ? 390 ASP A OD2    1 
ATOM   574  N N      . GLU A 1 96  ? -32.08953 12.46385  11.69681  1.000 22.42146  ? 391 GLU A N      1 
ATOM   575  C CA     . GLU A 1 96  ? -31.51500 11.35394  10.94108  1.000 26.70118  ? 391 GLU A CA     1 
ATOM   576  C C      . GLU A 1 96  ? -32.05357 10.00036  11.40368  1.000 27.63937  ? 391 GLU A C      1 
ATOM   577  O O      . GLU A 1 96  ? -32.28613 9.10176   10.58445  1.000 25.12672  ? 391 GLU A O      1 
ATOM   578  C CB     . GLU A 1 96  ? -29.98668 11.38940  11.04371  1.000 30.31161  ? 391 GLU A CB     1 
ATOM   579  C CG     . GLU A 1 96  ? -29.29135 10.22633  10.32626  1.000 31.56071  ? 391 GLU A CG     1 
ATOM   580  C CD     . GLU A 1 96  ? -29.17698 8.97571   11.19271  1.000 41.68914  ? 391 GLU A CD     1 
ATOM   581  O OE1    . GLU A 1 96  ? -29.09582 9.09594   12.43365  1.000 38.94137  ? 391 GLU A OE1    1 
ATOM   582  O OE2    . GLU A 1 96  ? -29.17722 7.85959   10.63288  1.000 45.54257  ? 391 GLU A OE2    1 
ATOM   583  N N      . GLN A 1 97  ? -32.22761 9.81152   12.71007  1.000 26.60732  ? 392 GLN A N      1 
ATOM   584  C CA     . GLN A 1 97  ? -32.66874 8.49682   13.15330  1.000 24.73300  ? 392 GLN A CA     1 
ATOM   585  C C      . GLN A 1 97  ? -34.05131 8.17115   12.60315  1.000 25.60167  ? 392 GLN A C      1 
ATOM   586  O O      . GLN A 1 97  ? -34.29237 7.05492   12.12614  1.000 24.22723  ? 392 GLN A O      1 
ATOM   587  C CB     . GLN A 1 97  ? -32.65226 8.41257   14.67853  1.000 28.79910  ? 392 GLN A CB     1 
ATOM   588  C CG     . GLN A 1 97  ? -32.89747 6.98836   15.20289  1.000 33.21675  ? 392 GLN A CG     1 
ATOM   589  C CD     . GLN A 1 97  ? -34.35408 6.53432   15.13215  1.000 32.19076  ? 392 GLN A CD     1 
ATOM   590  O OE1    . GLN A 1 97  ? -35.28047 7.30018   15.41859  1.000 32.05221  ? 392 GLN A OE1    1 
ATOM   591  N NE2    . GLN A 1 97  ? -34.55679 5.26750   14.76026  1.000 28.73280  ? 392 GLN A NE2    1 
ATOM   592  N N      . SER A 1 98  ? -34.97450 9.13645   12.63733  1.000 21.52387  ? 393 SER A N      1 
ATOM   593  C CA     . SER A 1 98  ? -36.31830 8.82823   12.16399  1.000 24.58131  ? 393 SER A CA     1 
ATOM   594  C C      . SER A 1 98  ? -36.37947 8.74919   10.64066  1.000 23.84534  ? 393 SER A C      1 
ATOM   595  O O      . SER A 1 98  ? -37.16926 7.97310   10.09274  1.000 23.83489  ? 393 SER A O      1 
ATOM   596  C CB     . SER A 1 98  ? -37.31803 9.85877   12.69480  1.000 30.87894  ? 393 SER A CB     1 
ATOM   597  O OG     . SER A 1 98  ? -37.12473 11.13438  12.10046  1.000 34.20378  ? 393 SER A OG     1 
ATOM   598  N N      . ILE A 1 99  ? -35.56599 9.53869   9.94287   1.000 21.23960  ? 394 ILE A N      1 
ATOM   599  C CA     . ILE A 1 99  ? -35.52165 9.44361   8.48526   1.000 19.47897  ? 394 ILE A CA     1 
ATOM   600  C C      . ILE A 1 99  ? -34.93450 8.10419   8.06234   1.000 21.36937  ? 394 ILE A C      1 
ATOM   601  O O      . ILE A 1 99  ? -35.47124 7.43234   7.17274   1.000 22.96412  ? 394 ILE A O      1 
ATOM   602  C CB     . ILE A 1 99  ? -34.72681 10.62149  7.90616   1.000 22.46483  ? 394 ILE A CB     1 
ATOM   603  C CG1    . ILE A 1 99  ? -35.49456 11.92157  8.13090   1.000 23.40314  ? 394 ILE A CG1    1 
ATOM   604  C CG2    . ILE A 1 99  ? -34.42972 10.38394  6.40239   1.000 22.21135  ? 394 ILE A CG2    1 
ATOM   605  C CD1    . ILE A 1 99  ? -34.62569 13.18136  7.94205   1.000 28.77642  ? 394 ILE A CD1    1 
ATOM   606  N N      . ALA A 1 100 ? -33.83609 7.68021   8.70404   1.000 21.57784  ? 395 ALA A N      1 
ATOM   607  C CA     . ALA A 1 100 ? -33.27405 6.36584   8.38799   1.000 24.23064  ? 395 ALA A CA     1 
ATOM   608  C C      . ALA A 1 100 ? -34.28757 5.25614   8.64071   1.000 26.73071  ? 395 ALA A C      1 
ATOM   609  O O      . ALA A 1 100 ? -34.36802 4.28652   7.87290   1.000 24.38645  ? 395 ALA A O      1 
ATOM   610  C CB     . ALA A 1 100 ? -32.00070 6.11241   9.20374   1.000 28.92695  ? 395 ALA A CB     1 
ATOM   611  N N      . GLU A 1 101 ? -35.05863 5.36216   9.72030   1.000 20.94026  ? 396 GLU A N      1 
ATOM   612  C CA     . GLU A 1 101 ? -36.03336 4.31512   10.01187  1.000 23.48410  ? 396 GLU A CA     1 
ATOM   613  C C      . GLU A 1 101 ? -37.09720 4.24962   8.91630   1.000 25.10370  ? 396 GLU A C      1 
ATOM   614  O O      . GLU A 1 101 ? -37.47046 3.16246   8.45439   1.000 23.64754  ? 396 GLU A O      1 
ATOM   615  C CB     . GLU A 1 101 ? -36.65551 4.56281   11.38490  1.000 24.05357  ? 396 GLU A CB     1 
ATOM   616  C CG     . GLU A 1 101 ? -37.75107 3.56692   11.78296  1.000 27.11664  ? 396 GLU A CG     1 
ATOM   617  C CD     . GLU A 1 101 ? -37.25760 2.10673   11.82600  1.000 34.06697  ? 396 GLU A CD     1 
ATOM   618  O OE1    . GLU A 1 101 ? -36.02656 1.87288   11.86140  1.000 39.35746  ? 396 GLU A OE1    1 
ATOM   619  O OE2    . GLU A 1 101 ? -38.11159 1.19044   11.82263  1.000 37.55029  ? 396 GLU A OE2    1 
ATOM   620  N N      . ALA A 1 102 ? -37.55303 5.40795   8.44820   1.000 19.25996  ? 397 ALA A N      1 
ATOM   621  C CA     . ALA A 1 102 ? -38.49131 5.42767   7.32629   1.000 20.81293  ? 397 ALA A CA     1 
ATOM   622  C C      . ALA A 1 102 ? -37.88662 4.80676   6.07137   1.000 21.37087  ? 397 ALA A C      1 
ATOM   623  O O      . ALA A 1 102 ? -38.58534 4.12416   5.31169   1.000 21.78340  ? 397 ALA A O      1 
ATOM   624  C CB     . ALA A 1 102 ? -38.93028 6.86398   7.03481   1.000 22.76402  ? 397 ALA A CB     1 
ATOM   625  N N      . ILE A 1 103 ? -36.61514 5.09523   5.79406   1.000 21.75051  ? 398 ILE A N      1 
ATOM   626  C CA     . ILE A 1 103 ? -35.96079 4.51756   4.61482   1.000 22.60756  ? 398 ILE A CA     1 
ATOM   627  C C      . ILE A 1 103 ? -35.90784 2.99202   4.72438   1.000 22.90096  ? 398 ILE A C      1 
ATOM   628  O O      . ILE A 1 103 ? -36.20135 2.26883   3.76082   1.000 21.10500  ? 398 ILE A O      1 
ATOM   629  C CB     . ILE A 1 103 ? -34.56228 5.12990   4.44584   1.000 23.69472  ? 398 ILE A CB     1 
ATOM   630  C CG1    . ILE A 1 103 ? -34.70708 6.64331   4.19278   1.000 22.68546  ? 398 ILE A CG1    1 
ATOM   631  C CG2    . ILE A 1 103 ? -33.79761 4.42919   3.29080   1.000 23.18461  ? 398 ILE A CG2    1 
ATOM   632  C CD1    . ILE A 1 103 ? -33.38329 7.39742   4.07464   1.000 26.46514  ? 398 ILE A CD1    1 
ATOM   633  N N      . ILE A 1 104 ? -35.53171 2.48363   5.89721   1.000 21.31874  ? 399 ILE A N      1 
ATOM   634  C CA     . ILE A 1 104 ? -35.49429 1.03887   6.11103   1.000 23.75223  ? 399 ILE A CA     1 
ATOM   635  C C      . ILE A 1 104 ? -36.86855 0.43049   5.87470   1.000 22.65358  ? 399 ILE A C      1 
ATOM   636  O O      . ILE A 1 104 ? -37.01077 -0.58293  5.18168   1.000 23.51559  ? 399 ILE A O      1 
ATOM   637  C CB     . ILE A 1 104 ? -34.97940 0.72739   7.52440   1.000 20.63026  ? 399 ILE A CB     1 
ATOM   638  C CG1    . ILE A 1 104 ? -33.49619 1.11013   7.65413   1.000 26.13636  ? 399 ILE A CG1    1 
ATOM   639  C CG2    . ILE A 1 104 ? -35.20162 -0.75258  7.84294   1.000 24.71116  ? 399 ILE A CG2    1 
ATOM   640  C CD1    . ILE A 1 104 ? -33.00729 1.15692   9.12355   1.000 27.80462  ? 399 ILE A CD1    1 
ATOM   641  N N      . VAL A 1 105 ? -37.90435 1.01552   6.48142   1.000 18.51044  ? 400 VAL A N      1 
ATOM   642  C CA     . VAL A 1 105 ? -39.23833 0.44902   6.30858   1.000 19.40289  ? 400 VAL A CA     1 
ATOM   643  C C      . VAL A 1 105 ? -39.61906 0.42219   4.83483   1.000 19.43278  ? 400 VAL A C      1 
ATOM   644  O O      . VAL A 1 105 ? -40.19677 -0.55608  4.33801   1.000 21.19418  ? 400 VAL A O      1 
ATOM   645  C CB     . VAL A 1 105 ? -40.26677 1.22873   7.14265   1.000 21.83483  ? 400 VAL A CB     1 
ATOM   646  C CG1    . VAL A 1 105 ? -41.68386 0.81513   6.75857   1.000 22.72434  ? 400 VAL A CG1    1 
ATOM   647  C CG2    . VAL A 1 105 ? -40.00805 0.99426   8.67243   1.000 24.00912  ? 400 VAL A CG2    1 
ATOM   648  N N      . ALA A 1 106 ? -39.32685 1.50465   4.11358   1.000 19.25842  ? 401 ALA A N      1 
ATOM   649  C CA     . ALA A 1 106 ? -39.68581 1.54568   2.69637   1.000 18.44018  ? 401 ALA A CA     1 
ATOM   650  C C      . ALA A 1 106 ? -38.88523 0.54167   1.88654   1.000 18.40296  ? 401 ALA A C      1 
ATOM   651  O O      . ALA A 1 106 ? -39.40863 -0.04920  0.93878   1.000 20.01753  ? 401 ALA A O      1 
ATOM   652  C CB     . ALA A 1 106 ? -39.47085 2.95448   2.13106   1.000 20.97044  ? 401 ALA A CB     1 
ATOM   653  N N      . MET A 1 107 ? -37.59648 0.38046   2.19949   1.000 21.28459  ? 402 MET A N      1 
ATOM   654  C CA     . MET A 1 107 ? -36.79288 -0.59043  1.46607   1.000 20.66298  ? 402 MET A CA     1 
ATOM   655  C C      . MET A 1 107 ? -37.31242 -2.00374  1.69076   1.000 23.89774  ? 402 MET A C      1 
ATOM   656  O O      . MET A 1 107 ? -37.35286 -2.81214  0.75376   1.000 22.53207  ? 402 MET A O      1 
ATOM   657  C CB     . MET A 1 107 ? -35.33023 -0.48794  1.87828   1.000 21.19352  ? 402 MET A CB     1 
ATOM   658  C CG     . MET A 1 107 ? -34.63027 0.73545   1.31304   1.000 22.49677  ? 402 MET A CG     1 
ATOM   659  S SD     . MET A 1 107 ? -32.94081 0.76707   1.91701   1.000 27.30713  ? 402 MET A SD     1 
ATOM   660  C CE     . MET A 1 107 ? -32.31079 2.19494   1.00830   1.000 29.13516  ? 402 MET A CE     1 
ATOM   661  N N      . VAL A 1 108 ? -37.72931 -2.31855  2.91998   1.000 20.25976  ? 403 VAL A N      1 
ATOM   662  C CA     . VAL A 1 108 ? -38.26724 -3.65321  3.18155   1.000 19.17686  ? 403 VAL A CA     1 
ATOM   663  C C      . VAL A 1 108 ? -39.61483 -3.81650  2.48878   1.000 23.02918  ? 403 VAL A C      1 
ATOM   664  O O      . VAL A 1 108 ? -39.88047 -4.82028  1.80984   1.000 21.77610  ? 403 VAL A O      1 
ATOM   665  C CB     . VAL A 1 108 ? -38.36908 -3.89406  4.69945   1.000 22.29623  ? 403 VAL A CB     1 
ATOM   666  C CG1    . VAL A 1 108 ? -39.08660 -5.20958  4.97002   1.000 21.99346  ? 403 VAL A CG1    1 
ATOM   667  C CG2    . VAL A 1 108 ? -36.97125 -3.90380  5.30900   1.000 21.73640  ? 403 VAL A CG2    1 
ATOM   668  N N      . PHE A 1 109 ? -40.47564 -2.81207  2.63240   1.000 20.35075  ? 404 PHE A N      1 
ATOM   669  C CA     . PHE A 1 109 ? -41.77950 -2.80332  1.97754   1.000 22.11419  ? 404 PHE A CA     1 
ATOM   670  C C      . PHE A 1 109 ? -41.67436 -3.00884  0.46704   1.000 24.71107  ? 404 PHE A C      1 
ATOM   671  O O      . PHE A 1 109 ? -42.54820 -3.64398  -0.13405  1.000 23.38234  ? 404 PHE A O      1 
ATOM   672  C CB     . PHE A 1 109 ? -42.48727 -1.47818  2.28829   1.000 22.74286  ? 404 PHE A CB     1 
ATOM   673  C CG     . PHE A 1 109 ? -43.87335 -1.39439  1.75629   1.000 24.91539  ? 404 PHE A CG     1 
ATOM   674  C CD1    . PHE A 1 109 ? -44.94081 -1.89120  2.48521   1.000 23.43879  ? 404 PHE A CD1    1 
ATOM   675  C CD2    . PHE A 1 109 ? -44.11772 -0.80539  0.52488   1.000 27.59913  ? 404 PHE A CD2    1 
ATOM   676  C CE1    . PHE A 1 109 ? -46.23244 -1.80599  1.98956   1.000 28.40382  ? 404 PHE A CE1    1 
ATOM   677  C CE2    . PHE A 1 109 ? -45.40520 -0.71054  0.02856   1.000 28.58016  ? 404 PHE A CE2    1 
ATOM   678  C CZ     . PHE A 1 109 ? -46.46322 -1.20526  0.75849   1.000 30.58359  ? 404 PHE A CZ     1 
ATOM   679  N N      . SER A 1 110 ? -40.63420 -2.46687  -0.16690  1.000 21.40053  ? 405 SER A N      1 
ATOM   680  C CA     . SER A 1 110 ? -40.50297 -2.58740  -1.61731  1.000 19.66643  ? 405 SER A CA     1 
ATOM   681  C C      . SER A 1 110 ? -40.29476 -4.02220  -2.06308  1.000 26.19200  ? 405 SER A C      1 
ATOM   682  O O      . SER A 1 110 ? -40.56321 -4.33267  -3.23386  1.000 23.53472  ? 405 SER A O      1 
ATOM   683  C CB     . SER A 1 110 ? -39.32853 -1.75646  -2.12835  1.000 20.27455  ? 405 SER A CB     1 
ATOM   684  O OG     . SER A 1 110 ? -38.08575 -2.40446  -1.83875  1.000 26.30320  ? 405 SER A OG     1 
ATOM   685  N N      . GLN A 1 111 ? -39.80002 -4.88500  -1.16775  1.000 21.09676  ? 406 GLN A N      1 
ATOM   686  C CA     . GLN A 1 111 ? -39.50948 -6.28820  -1.46898  1.000 25.33746  ? 406 GLN A CA     1 
ATOM   687  C C      . GLN A 1 111 ? -38.41319 -6.45129  -2.53340  1.000 25.44213  ? 406 GLN A C      1 
ATOM   688  O O      . GLN A 1 111 ? -38.29350 -7.51591  -3.14765  1.000 25.11853  ? 406 GLN A O      1 
ATOM   689  C CB     . GLN A 1 111 ? -40.79214 -7.01627  -1.88561  1.000 24.99727  ? 406 GLN A CB     1 
ATOM   690  C CG     . GLN A 1 111 ? -41.89180 -6.87624  -0.84442  1.000 24.30825  ? 406 GLN A CG     1 
ATOM   691  C CD     . GLN A 1 111 ? -43.14897 -7.66424  -1.17617  1.000 27.80540  ? 406 GLN A CD     1 
ATOM   692  O OE1    . GLN A 1 111 ? -43.68858 -7.54557  -2.26491  1.000 28.92695  ? 406 GLN A OE1    1 
ATOM   693  N NE2    . GLN A 1 111 ? -43.65016 -8.43548  -0.20559  1.000 26.20542  ? 406 GLN A NE2    1 
ATOM   694  N N      . GLU A 1 112 ? -37.58542 -5.42132  -2.73179  1.000 23.34606  ? 407 GLU A N      1 
ATOM   695  C CA     . GLU A 1 112 ? -36.53352 -5.45960  -3.74521  1.000 24.49695  ? 407 GLU A CA     1 
ATOM   696  C C      . GLU A 1 112 ? -35.54340 -6.58828  -3.49279  1.000 26.76610  ? 407 GLU A C      1 
ATOM   697  O O      . GLU A 1 112 ? -35.21634 -6.92855  -2.34755  1.000 25.14051  ? 407 GLU A O      1 
ATOM   698  C CB     . GLU A 1 112 ? -35.76359 -4.13846  -3.78119  1.000 30.08641  ? 407 GLU A CB     1 
ATOM   699  C CG     . GLU A 1 112 ? -36.44234 -3.05800  -4.57619  1.000 36.22985  ? 407 GLU A CG     1 
ATOM   700  C CD     . GLU A 1 112 ? -35.46159 -2.23577  -5.41160  1.000 35.78628  ? 407 GLU A CD     1 
ATOM   701  O OE1    . GLU A 1 112 ? -34.30537 -2.66717  -5.64180  1.000 43.93046  ? 407 GLU A OE1    1 
ATOM   702  O OE2    . GLU A 1 112 ? -35.86090 -1.15392  -5.84811  1.000 35.36851  ? 407 GLU A OE2    1 
ATOM   703  N N      . ASP A 1 113 ? -35.01322 -7.12844  -4.59035  1.000 25.60298  ? 408 ASP A N      1 
ATOM   704  C CA     . ASP A 1 113 ? -34.06984 -8.23434  -4.48706  1.000 27.78938  ? 408 ASP A CA     1 
ATOM   705  C C      . ASP A 1 113 ? -32.80345 -7.83036  -3.73887  1.000 25.86594  ? 408 ASP A C      1 
ATOM   706  O O      . ASP A 1 113 ? -32.22370 -8.64256  -3.01046  1.000 28.17456  ? 408 ASP A O      1 
ATOM   707  C CB     . ASP A 1 113 ? -33.71501 -8.73906  -5.88566  1.000 27.59362  ? 408 ASP A CB     1 
ATOM   708  C CG     . ASP A 1 113 ? -32.67706 -9.84642  -5.86312  1.000 34.93337  ? 408 ASP A CG     1 
ATOM   709  O OD1    . ASP A 1 113 ? -32.99029 -10.93412 -5.35146  1.000 34.37110  ? 408 ASP A OD1    1 
ATOM   710  O OD2    . ASP A 1 113 ? -31.55346 -9.62987  -6.36898  1.000 38.55993  ? 408 ASP A OD2    1 
ATOM   711  N N      . CYS A 1 114 ? -32.32168 -6.60084  -3.93935  1.000 25.53035  ? 409 CYS A N      1 
ATOM   712  C CA     . CYS A 1 114 ? -31.07427 -6.24479  -3.27733  1.000 25.83047  ? 409 CYS A CA     1 
ATOM   713  C C      . CYS A 1 114 ? -31.25831 -6.12145  -1.77139  1.000 28.38596  ? 409 CYS A C      1 
ATOM   714  O O      . CYS A 1 114 ? -30.28804 -6.28513  -1.02675  1.000 27.84460  ? 409 CYS A O      1 
ATOM   715  C CB     . CYS A 1 114 ? -30.48867 -4.95786  -3.84180  1.000 32.18207  ? 409 CYS A CB     1 
ATOM   716  S SG     . CYS A 1 114 ? -31.50917 -3.51188  -3.54137  1.000 36.12490  ? 409 CYS A SG     1 
ATOM   717  N N      . MET A 1 115 ? -32.48846 -5.88834  -1.31229  1.000 26.46275  ? 410 MET A N      1 
ATOM   718  C CA     . MET A 1 115 ? -32.76391 -5.92615  0.11981   1.000 24.27734  ? 410 MET A CA     1 
ATOM   719  C C      . MET A 1 115 ? -32.77976 -7.36715  0.62462   1.000 27.29603  ? 410 MET A C      1 
ATOM   720  O O      . MET A 1 115 ? -32.17380 -7.68173  1.65830   1.000 24.98990  ? 410 MET A O      1 
ATOM   721  C CB     . MET A 1 115 ? -34.08965 -5.21546  0.39280   1.000 23.83156  ? 410 MET A CB     1 
ATOM   722  C CG     . MET A 1 115 ? -34.51901 -5.18632  1.86232   1.000 23.11819  ? 410 MET A CG     1 
ATOM   723  S SD     . MET A 1 115 ? -35.53439 -6.66483  2.24595   1.000 26.32926  ? 410 MET A SD     1 
ATOM   724  C CE     . MET A 1 115 ? -36.84739 -6.61887  1.01831   1.000 25.24023  ? 410 MET A CE     1 
ATOM   725  N N      . ILE A 1 116 ? -33.44549 -8.26674  -0.11108  1.000 23.79456  ? 411 ILE A N      1 
ATOM   726  C CA     . ILE A 1 116 ? -33.43958 -9.67823  0.27429   1.000 26.64366  ? 411 ILE A CA     1 
ATOM   727  C C      . ILE A 1 116 ? -32.01168 -10.20634 0.31449   1.000 23.77403  ? 411 ILE A C      1 
ATOM   728  O O      . ILE A 1 116 ? -31.63747 -10.95310 1.22414   1.000 24.57048  ? 411 ILE A O      1 
ATOM   729  C CB     . ILE A 1 116 ? -34.30958 -10.51365 -0.68311  1.000 29.33983  ? 411 ILE A CB     1 
ATOM   730  C CG1    . ILE A 1 116 ? -35.78753 -10.11273 -0.59271  1.000 30.59132  ? 411 ILE A CG1    1 
ATOM   731  C CG2    . ILE A 1 116 ? -34.14857 -11.99734 -0.39442  1.000 34.24914  ? 411 ILE A CG2    1 
ATOM   732  C CD1    . ILE A 1 116 ? -36.36164 -10.26756 0.78369   1.000 31.67748  ? 411 ILE A CD1    1 
ATOM   733  N N      . LYS A 1 117 ? -31.19415 -9.83969  -0.68335  1.000 25.18895  ? 412 LYS A N      1 
ATOM   734  C CA     . LYS A 1 117 ? -29.82453 -10.33887 -0.77755  1.000 24.71834  ? 412 LYS A CA     1 
ATOM   735  C C      . LYS A 1 117 ? -28.87175 -9.67516  0.20872   1.000 30.90404  ? 412 LYS A C      1 
ATOM   736  O O      . LYS A 1 117 ? -27.74197 -10.14866 0.36399   1.000 28.38080  ? 412 LYS A O      1 
ATOM   737  C CB     . LYS A 1 117 ? -29.27970 -10.15885 -2.20617  1.000 28.15045  ? 412 LYS A CB     1 
ATOM   738  C CG     . LYS A 1 117 ? -29.96732 -11.04017 -3.28498  1.000 28.85691  ? 412 LYS A CG     1 
ATOM   739  C CD     . LYS A 1 117 ? -29.67889 -12.52961 -3.07562  1.000 32.21720  ? 412 LYS A CD     1 
ATOM   740  C CE     . LYS A 1 117 ? -30.27913 -13.38273 -4.19329  1.000 32.13925  ? 412 LYS A CE     1 
ATOM   741  N NZ     . LYS A 1 117 ? -31.76203 -13.26963 -4.31282  1.000 29.89523  ? 412 LYS A NZ     1 
ATOM   742  N N      . ALA A 1 118 ? -29.28505 -8.60029  0.88032   1.000 25.44840  ? 413 ALA A N      1 
ATOM   743  C CA     . ALA A 1 118 ? -28.44945 -8.04187  1.93702   1.000 26.08205  ? 413 ALA A CA     1 
ATOM   744  C C      . ALA A 1 118 ? -28.58433 -8.78330  3.26400   1.000 29.33053  ? 413 ALA A C      1 
ATOM   745  O O      . ALA A 1 118 ? -27.88732 -8.42764  4.21937   1.000 31.79105  ? 413 ALA A O      1 
ATOM   746  C CB     . ALA A 1 118 ? -28.76900 -6.55412  2.14504   1.000 28.90018  ? 413 ALA A CB     1 
ATOM   747  N N      . VAL A 1 119 ? -29.45916 -9.78296  3.35973   1.000 26.38866  ? 414 VAL A N      1 
ATOM   748  C CA     . VAL A 1 119 ? -29.48957 -10.67371 4.51679   1.000 27.00720  ? 414 VAL A CA     1 
ATOM   749  C C      . VAL A 1 119 ? -28.35706 -11.69075 4.34671   1.000 36.31977  ? 414 VAL A C      1 
ATOM   750  O O      . VAL A 1 119 ? -28.40405 -12.52852 3.44466   1.000 31.74687  ? 414 VAL A O      1 
ATOM   751  C CB     . VAL A 1 119 ? -30.84525 -11.37792 4.64947   1.000 30.64828  ? 414 VAL A CB     1 
ATOM   752  C CG1    . VAL A 1 119 ? -30.90504 -12.16069 5.95679   1.000 28.96469  ? 414 VAL A CG1    1 
ATOM   753  C CG2    . VAL A 1 119 ? -31.99956 -10.37827 4.56078   1.000 32.11609  ? 414 VAL A CG2    1 
ATOM   754  N N      . ARG A 1 120 ? -27.33834 -11.62898 5.21464   1.000 35.91896  ? 415 ARG A N      1 
ATOM   755  C CA     . ARG A 1 120 ? -26.13523 -12.44850 5.04481   1.000 40.44680  ? 415 ARG A CA     1 
ATOM   756  C C      . ARG A 1 120 ? -26.05731 -13.64037 5.99391   1.000 44.04606  ? 415 ARG A C      1 
ATOM   757  O O      . ARG A 1 120 ? -25.21962 -14.52856 5.78388   1.000 39.21425  ? 415 ARG A O      1 
ATOM   758  C CB     . ARG A 1 120 ? -24.87467 -11.58769 5.22401   1.000 40.30565  ? 415 ARG A CB     1 
ATOM   759  C CG     . ARG A 1 120 ? -24.72974 -10.54295 4.15465   1.000 44.26922  ? 415 ARG A CG     1 
ATOM   760  C CD     . ARG A 1 120 ? -24.93709 -11.19456 2.81115   1.000 49.06172  ? 415 ARG A CD     1 
ATOM   761  N NE     . ARG A 1 120 ? -25.21652 -10.23101 1.75338   1.000 52.12246  ? 415 ARG A NE     1 
ATOM   762  C CZ     . ARG A 1 120 ? -24.35347 -9.32135  1.32044   1.000 57.92575  ? 415 ARG A CZ     1 
ATOM   763  N NH1    . ARG A 1 120 ? -23.16687 -9.16739  1.89041   1.000 62.07783  ? 415 ARG A NH1    1 
ATOM   764  N NH2    . ARG A 1 120 ? -24.69326 -8.54018  0.29640   1.000 59.71814  ? 415 ARG A NH2    1 
ATOM   765  N N      . GLY A 1 121 ? -26.88488 -13.67816 7.03493   1.000 38.72583  ? 416 GLY A N      1 
ATOM   766  C CA     . GLY A 1 121 ? -26.98652 -14.82593 7.90172   1.000 41.37733  ? 416 GLY A CA     1 
ATOM   767  C C      . GLY A 1 121 ? -28.38610 -15.40185 7.81914   1.000 41.83395  ? 416 GLY A C      1 
ATOM   768  O O      . GLY A 1 121 ? -29.25953 -14.88252 7.13038   1.000 38.59991  ? 416 GLY A O      1 
ATOM   769  N N      . ASP A 1 122 ? -28.58940 -16.49079 8.55961   1.000 40.30731  ? 417 ASP A N      1 
ATOM   770  C CA     . ASP A 1 122 ? -29.88905 -17.14018 8.58020   1.000 35.69604  ? 417 ASP A CA     1 
ATOM   771  C C      . ASP A 1 122 ? -30.88465 -16.33699 9.41439   1.000 41.45995  ? 417 ASP A C      1 
ATOM   772  O O      . ASP A 1 122 ? -30.53687 -15.76692 10.45311  1.000 44.66492  ? 417 ASP A O      1 
ATOM   773  C CB     . ASP A 1 122 ? -29.76949 -18.56750 9.11721   1.000 48.78701  ? 417 ASP A CB     1 
ATOM   774  C CG     . ASP A 1 122 ? -29.43933 -19.58167 8.02256   1.000 51.24130  ? 417 ASP A CG     1 
ATOM   775  O OD1    . ASP A 1 122 ? -29.34870 -19.18274 6.84357   1.000 42.30268  ? 417 ASP A OD1    1 
ATOM   776  O OD2    . ASP A 1 122 ? -29.28722 -20.78264 8.33917   1.000 49.95077  ? 417 ASP A OD2    1 
ATOM   777  N N      . LEU A 1 123 ? -32.12603 -16.27748 8.93828   1.000 36.55509  ? 418 LEU A N      1 
ATOM   778  C CA     . LEU A 1 123 ? -33.21286 -15.64529 9.67357   1.000 41.80607  ? 418 LEU A CA     1 
ATOM   779  C C      . LEU A 1 123 ? -33.82342 -16.66596 10.61887  1.000 46.06564  ? 418 LEU A C      1 
ATOM   780  O O      . LEU A 1 123 ? -34.28128 -17.72885 10.18402  1.000 43.12146  ? 418 LEU A O      1 
ATOM   781  C CB     . LEU A 1 123 ? -34.28228 -15.09925 8.73321   1.000 41.38688  ? 418 LEU A CB     1 
ATOM   782  C CG     . LEU A 1 123 ? -33.92871 -13.79473 8.02966   1.000 38.35156  ? 418 LEU A CG     1 
ATOM   783  C CD1    . LEU A 1 123 ? -35.17752 -13.22505 7.38028   1.000 38.32734  ? 418 LEU A CD1    1 
ATOM   784  C CD2    . LEU A 1 123 ? -33.28016 -12.79698 9.00132   1.000 37.91484  ? 418 LEU A CD2    1 
ATOM   785  N N      . ASN A 1 124 ? -33.82473 -16.33419 11.90471  1.000 48.46273  ? 419 ASN A N      1 
ATOM   786  C CA     . ASN A 1 124 ? -34.34520 -17.20478 12.94846  1.000 51.18238  ? 419 ASN A CA     1 
ATOM   787  C C      . ASN A 1 124 ? -35.86916 -17.15144 12.93469  1.000 53.50439  ? 419 ASN A C      1 
ATOM   788  O O      . ASN A 1 124 ? -36.46977 -16.13101 13.29192  1.000 53.20242  ? 419 ASN A O      1 
ATOM   789  C CB     . ASN A 1 124 ? -33.77392 -16.77014 14.29427  1.000 54.22531  ? 419 ASN A CB     1 
ATOM   790  C CG     . ASN A 1 124 ? -34.34471 -17.55259 15.45935  1.000 60.24188  ? 419 ASN A CG     1 
ATOM   791  O OD1    . ASN A 1 124 ? -35.53427 -17.86714 15.49057  1.000 52.20044  ? 419 ASN A OD1    1 
ATOM   792  N ND2    . ASN A 1 124 ? -33.49479 -17.85798 16.43799  1.000 55.69736  ? 419 ASN A ND2    1 
ATOM   793  N N      A PHE A 1 125 ? -36.50397 -18.24646 12.53396  0.577 46.23234  ? 420 PHE A N      1 
ATOM   794  N N      B PHE A 1 125 ? -36.48726 -18.25631 12.50592  0.423 46.31077  ? 420 PHE A N      1 
ATOM   795  C CA     A PHE A 1 125 ? -37.95521 -18.33185 12.56477  0.577 50.58711  ? 420 PHE A CA     1 
ATOM   796  C CA     B PHE A 1 125 ? -37.93317 -18.43978 12.48820  0.423 50.67314  ? 420 PHE A CA     1 
ATOM   797  C C      A PHE A 1 125 ? -38.45092 -19.29559 13.63618  0.577 54.77655  ? 420 PHE A C      1 
ATOM   798  C C      B PHE A 1 125 ? -38.45951 -19.16301 13.72409  0.423 54.61717  ? 420 PHE A C      1 
ATOM   799  O O      A PHE A 1 125 ? -39.63754 -19.64153 13.64391  0.577 52.68096  ? 420 PHE A O      1 
ATOM   800  O O      B PHE A 1 125 ? -39.67831 -19.21207 13.92165  0.423 53.13427  ? 420 PHE A O      1 
ATOM   801  C CB     A PHE A 1 125 ? -38.49067 -18.73961 11.18888  0.577 49.41820  ? 420 PHE A CB     1 
ATOM   802  C CB     B PHE A 1 125 ? -38.35688 -19.25793 11.25463  0.423 50.39648  ? 420 PHE A CB     1 
ATOM   803  C CG     A PHE A 1 125 ? -38.10127 -20.13040 10.77442  0.577 51.80638  ? 420 PHE A CG     1 
ATOM   804  C CG     B PHE A 1 125 ? -38.24630 -18.53017 9.94058   0.423 50.95823  ? 420 PHE A CG     1 
ATOM   805  C CD1    A PHE A 1 125 ? -36.84486 -20.38607 10.25001  0.577 51.64505  ? 420 PHE A CD1    1 
ATOM   806  C CD1    B PHE A 1 125 ? -37.02479 -18.08470 9.47126   0.423 48.27448  ? 420 PHE A CD1    1 
ATOM   807  C CD2    A PHE A 1 125 ? -38.99332 -21.18190 10.90626  0.577 53.68819  ? 420 PHE A CD2    1 
ATOM   808  C CD2    B PHE A 1 125 ? -39.36881 -18.35248 9.14360   0.423 50.04838  ? 420 PHE A CD2    1 
ATOM   809  C CE1    A PHE A 1 125 ? -36.48279 -21.66551 9.86878   0.577 50.15986  ? 420 PHE A CE1    1 
ATOM   810  C CE1    B PHE A 1 125 ? -36.93069 -17.44015 8.25091   0.423 42.78747  ? 420 PHE A CE1    1 
ATOM   811  C CE2    A PHE A 1 125 ? -38.63609 -22.46605 10.52697  0.577 48.92883  ? 420 PHE A CE2    1 
ATOM   812  C CE2    B PHE A 1 125 ? -39.28178 -17.71061 7.92669   0.423 42.73157  ? 420 PHE A CE2    1 
ATOM   813  C CZ     A PHE A 1 125 ? -37.37885 -22.70580 10.00801  0.577 50.05232  ? 420 PHE A CZ     1 
ATOM   814  C CZ     B PHE A 1 125 ? -38.06128 -17.25544 7.47971   0.423 41.45485  ? 420 PHE A CZ     1 
ATOM   815  N N      . VAL A 1 126 ? -37.57790 -19.73073 14.54665  1.000 48.93883  ? 421 VAL A N      1 
ATOM   816  C CA     . VAL A 1 126 ? -37.94422 -20.75049 15.52221  1.000 48.81640  ? 421 VAL A CA     1 
ATOM   817  C C      . VAL A 1 126 ? -38.06808 -20.23711 16.95717  1.000 56.41623  ? 421 VAL A C      1 
ATOM   818  O O      . VAL A 1 126 ? -38.89619 -20.75619 17.71514  1.000 57.79506  ? 421 VAL A O      1 
ATOM   819  C CB     . VAL A 1 126 ? -36.94558 -21.92262 15.46496  1.000 48.58099  ? 421 VAL A CB     1 
ATOM   820  C CG1    . VAL A 1 126 ? -36.89523 -22.50567 14.05521  1.000 50.48128  ? 421 VAL A CG1    1 
ATOM   821  C CG2    . VAL A 1 126 ? -35.56885 -21.46003 15.89761  1.000 46.54643  ? 421 VAL A CG2    1 
ATOM   822  N N      . ASN A 1 127 ? -37.25948 -19.25196 17.35720  1.000 56.73863  ? 422 ASN A N      1 
ATOM   823  C CA     . ASN A 1 127 ? -37.36610 -18.70818 18.71077  1.000 63.69596  ? 422 ASN A CA     1 
ATOM   824  C C      . ASN A 1 127 ? -38.81764 -18.37697 19.03641  1.000 65.97140  ? 422 ASN A C      1 
ATOM   825  O O      . ASN A 1 127 ? -39.57095 -17.91237 18.17595  1.000 57.44361  ? 422 ASN A O      1 
ATOM   826  C CB     . ASN A 1 127 ? -36.50139 -17.45398 18.86396  1.000 62.70663  ? 422 ASN A CB     1 
ATOM   827  C CG     . ASN A 1 127 ? -35.03140 -17.77258 19.06444  1.000 69.99175  ? 422 ASN A CG     1 
ATOM   828  O OD1    . ASN A 1 127 ? -34.63698 -18.93966 19.13857  1.000 67.32596  ? 422 ASN A OD1    1 
ATOM   829  N ND2    . ASN A 1 127 ? -34.20818 -16.72950 19.14714  1.000 61.14749  ? 422 ASN A ND2    1 
ATOM   830  N N      . ARG A 1 128 ? -39.21048 -18.62494 20.29180  1.000 66.19740  ? 423 ARG A N      1 
ATOM   831  C CA     . ARG A 1 128 ? -40.61439 -18.46748 20.66624  1.000 70.84925  ? 423 ARG A CA     1 
ATOM   832  C C      . ARG A 1 128 ? -41.13252 -17.06492 20.36453  1.000 69.37322  ? 423 ARG A C      1 
ATOM   833  O O      . ARG A 1 128 ? -42.32160 -16.89792 20.06988  1.000 68.79846  ? 423 ARG A O      1 
ATOM   834  C CB     . ARG A 1 128 ? -40.81380 -18.81064 22.14649  1.000 75.98770  ? 423 ARG A CB     1 
ATOM   835  C CG     . ARG A 1 128 ? -41.48567 -20.16900 22.37464  1.000 81.88395  ? 423 ARG A CG     1 
ATOM   836  C CD     . ARG A 1 128 ? -41.34251 -20.67563 23.81740  1.000 90.31689  ? 423 ARG A CD     1 
ATOM   837  N NE     . ARG A 1 128 ? -42.42263 -20.23892 24.69756  1.000 80.17621  ? 423 ARG A NE     1 
ATOM   838  C CZ     . ARG A 1 128 ? -42.25528 -19.52458 25.80439  1.000 79.85324  ? 423 ARG A CZ     1 
ATOM   839  N NH1    . ARG A 1 128 ? -41.05309 -19.14863 26.21314  1.000 82.61008  ? 423 ARG A NH1    1 
ATOM   840  N NH2    . ARG A 1 128 ? -43.32097 -19.18519 26.52469  1.000 68.26084  ? 423 ARG A NH2    1 
ATOM   841  N N      . ALA A 1 129 ? -40.26146 -16.05298 20.40898  1.000 63.50384  ? 424 ALA A N      1 
ATOM   842  C CA     . ALA A 1 129 ? -40.65530 -14.67137 20.15515  1.000 63.29719  ? 424 ALA A CA     1 
ATOM   843  C C      . ALA A 1 129 ? -40.65886 -14.30347 18.67381  1.000 63.85935  ? 424 ALA A C      1 
ATOM   844  O O      . ALA A 1 129 ? -41.04250 -13.17805 18.33217  1.000 57.16831  ? 424 ALA A O      1 
ATOM   845  C CB     . ALA A 1 129 ? -39.73589 -13.71082 20.91704  1.000 49.36671  ? 424 ALA A CB     1 
ATOM   846  N N      . ASN A 1 130 ? -40.24166 -15.21226 17.79130  1.000 60.19391  ? 425 ASN A N      1 
ATOM   847  C CA     . ASN A 1 130 ? -40.32904 -15.00703 16.34922  1.000 63.79328  ? 425 ASN A CA     1 
ATOM   848  C C      . ASN A 1 130 ? -41.40460 -15.87829 15.70609  1.000 63.82441  ? 425 ASN A C      1 
ATOM   849  O O      . ASN A 1 130 ? -41.52665 -15.88817 14.47310  1.000 53.08565  ? 425 ASN A O      1 
ATOM   850  C CB     . ASN A 1 130 ? -38.97165 -15.27524 15.68975  1.000 56.99327  ? 425 ASN A CB     1 
ATOM   851  C CG     . ASN A 1 130 ? -37.87236 -14.36859 16.21779  1.000 61.65131  ? 425 ASN A CG     1 
ATOM   852  O OD1    . ASN A 1 130 ? -38.13188 -13.23777 16.64109  1.000 57.22458  ? 425 ASN A OD1    1 
ATOM   853  N ND2    . ASN A 1 130 ? -36.63238 -14.86149 16.19316  1.000 56.21600  ? 425 ASN A ND2    1 
ATOM   854  N N      . GLN A 1 131 ? -42.19402 -16.59585 16.52011  1.000 66.26956  ? 426 GLN A N      1 
ATOM   855  C CA     . GLN A 1 131 ? -43.15353 -17.58381 16.03112  1.000 68.39329  ? 426 GLN A CA     1 
ATOM   856  C C      . GLN A 1 131 ? -44.32950 -16.96340 15.28951  1.000 65.18388  ? 426 GLN A C      1 
ATOM   857  O O      . GLN A 1 131 ? -45.03024 -17.67784 14.56398  1.000 65.52255  ? 426 GLN A O      1 
ATOM   858  C CB     . GLN A 1 131 ? -43.68474 -18.42082 17.19806  1.000 68.07497  ? 426 GLN A CB     1 
ATOM   859  C CG     . GLN A 1 131 ? -42.62298 -19.22675 17.92818  1.000 76.66739  ? 426 GLN A CG     1 
ATOM   860  C CD     . GLN A 1 131 ? -42.60353 -20.68352 17.50928  1.000 77.21530  ? 426 GLN A CD     1 
ATOM   861  O OE1    . GLN A 1 131 ? -43.46881 -21.13637 16.76003  1.000 83.24161  ? 426 GLN A OE1    1 
ATOM   862  N NE2    . GLN A 1 131 ? -41.61545 -21.42754 17.99561  1.000 70.92427  ? 426 GLN A NE2    1 
ATOM   863  N N      . ARG A 1 132 ? -44.58094 -15.66741 15.46501  1.000 53.91459  ? 427 ARG A N      1 
ATOM   864  C CA     . ARG A 1 132 ? -45.69359 -15.02029 14.78895  1.000 70.17722  ? 427 ARG A CA     1 
ATOM   865  C C      . ARG A 1 132 ? -45.26225 -13.96686 13.77460  1.000 65.34217  ? 427 ARG A C      1 
ATOM   866  O O      . ARG A 1 132 ? -46.11862 -13.44157 13.05323  1.000 60.14127  ? 427 ARG A O      1 
ATOM   867  C CB     . ARG A 1 132 ? -46.64968 -14.39067 15.81385  1.000 66.50040  ? 427 ARG A CB     1 
ATOM   868  C CG     . ARG A 1 132 ? -48.00278 -14.02517 15.22076  1.000 78.00126  ? 427 ARG A CG     1 
ATOM   869  C CD     . ARG A 1 132 ? -48.48629 -15.11550 14.25918  1.000 89.27753  ? 427 ARG A CD     1 
ATOM   870  N NE     . ARG A 1 132 ? -49.68661 -14.73522 13.51712  1.000 99.08844  ? 427 ARG A NE     1 
ATOM   871  C CZ     . ARG A 1 132 ? -49.70021 -14.29831 12.26214  1.000 93.73179  ? 427 ARG A CZ     1 
ATOM   872  N NH1    . ARG A 1 132 ? -48.58430 -14.16750 11.55921  1.000 76.88899  ? 427 ARG A NH1    1 
ATOM   873  N NH2    . ARG A 1 132 ? -50.86430 -13.98487 11.69690  1.000 91.52362  ? 427 ARG A NH2    1 
ATOM   874  N N      . LEU A 1 133 ? -43.97042 -13.65264 13.68716  1.000 59.54637  ? 428 LEU A N      1 
ATOM   875  C CA     . LEU A 1 133 ? -43.48779 -12.75434 12.64510  1.000 51.52927  ? 428 LEU A CA     1 
ATOM   876  C C      . LEU A 1 133 ? -43.48401 -13.48945 11.31438  1.000 44.32456  ? 428 LEU A C      1 
ATOM   877  O O      . LEU A 1 133 ? -42.80070 -14.50944 11.17765  1.000 39.12773  ? 428 LEU A O      1 
ATOM   878  C CB     . LEU A 1 133 ? -42.07521 -12.26152 12.96099  1.000 41.94133  ? 428 LEU A CB     1 
ATOM   879  C CG     . LEU A 1 133 ? -41.75744 -11.50005 14.25104  1.000 51.45134  ? 428 LEU A CG     1 
ATOM   880  C CD1    . LEU A 1 133 ? -40.34190 -10.92466 14.18240  1.000 45.48328  ? 428 LEU A CD1    1 
ATOM   881  C CD2    . LEU A 1 133 ? -42.77576 -10.40274 14.52285  1.000 56.86068  ? 428 LEU A CD2    1 
ATOM   882  N N      . ASN A 1 134 ? -44.22843 -12.97700 10.32976  1.000 37.93184  ? 429 ASN A N      1 
ATOM   883  C CA     . ASN A 1 134 ? -44.07930 -13.48136 8.97437   1.000 34.38496  ? 429 ASN A CA     1 
ATOM   884  C C      . ASN A 1 134 ? -42.72464 -13.03002 8.43309   1.000 34.11256  ? 429 ASN A C      1 
ATOM   885  O O      . ASN A 1 134 ? -42.02602 -12.22738 9.06052   1.000 31.74990  ? 429 ASN A O      1 
ATOM   886  C CB     . ASN A 1 134 ? -45.24350 -13.02620 8.08569   1.000 38.90759  ? 429 ASN A CB     1 
ATOM   887  C CG     . ASN A 1 134 ? -45.31730 -11.50801 7.91108   1.000 40.25662  ? 429 ASN A CG     1 
ATOM   888  O OD1    . ASN A 1 134 ? -44.32140 -10.79623 8.05420   1.000 31.77844  ? 429 ASN A OD1    1 
ATOM   889  N ND2    . ASN A 1 134 ? -46.51041 -11.01208 7.59138   1.000 43.42194  ? 429 ASN A ND2    1 
ATOM   890  N N      . PRO A 1 135 ? -42.30571 -13.55566 7.27703   1.000 31.09574  ? 430 PRO A N      1 
ATOM   891  C CA     . PRO A 1 135 ? -40.96323 -13.21491 6.78188   1.000 29.64651  ? 430 PRO A CA     1 
ATOM   892  C C      . PRO A 1 135 ? -40.77477 -11.72865 6.53508   1.000 26.64615  ? 430 PRO A C      1 
ATOM   893  O O      . PRO A 1 135 ? -39.67496 -11.21465 6.76163   1.000 25.89039  ? 430 PRO A O      1 
ATOM   894  C CB     . PRO A 1 135 ? -40.84922 -14.04134 5.48786   1.000 32.57050  ? 430 PRO A CB     1 
ATOM   895  C CG     . PRO A 1 135 ? -41.72460 -15.24265 5.76492   1.000 36.64950  ? 430 PRO A CG     1 
ATOM   896  C CD     . PRO A 1 135 ? -42.91214 -14.66451 6.51841   1.000 34.30090  ? 430 PRO A CD     1 
ATOM   897  N N      . MET A 1 136 ? -41.81147 -11.01188 6.08744   1.000 28.60881  ? 431 MET A N      1 
ATOM   898  C CA     . MET A 1 136 ? -41.67016 -9.56260  5.92769   1.000 26.45642  ? 431 MET A CA     1 
ATOM   899  C C      . MET A 1 136 ? -41.29355 -8.88566  7.24713   1.000 27.62068  ? 431 MET A C      1 
ATOM   900  O O      . MET A 1 136 ? -40.46844 -7.96448  7.26880   1.000 24.10524  ? 431 MET A O      1 
ATOM   901  C CB     . MET A 1 136 ? -42.95641 -8.95949  5.36721   1.000 28.11930  ? 431 MET A CB     1 
ATOM   902  C CG     . MET A 1 136 ? -43.17747 -9.23080  3.86996   1.000 27.11881  ? 431 MET A CG     1 
ATOM   903  S SD     . MET A 1 136 ? -41.88118 -8.51023  2.83901   1.000 30.55932  ? 431 MET A SD     1 
ATOM   904  C CE     . MET A 1 136 ? -42.18368 -6.75092  3.11531   1.000 26.22635  ? 431 MET A CE     1 
ATOM   905  N N      . HIS A 1 137 ? -41.90621 -9.30815  8.35276   1.000 25.10189  ? 432 HIS A N      1 
ATOM   906  C CA     . HIS A 1 137 ? -41.57974 -8.69460  9.63691   1.000 27.20319  ? 432 HIS A CA     1 
ATOM   907  C C      . HIS A 1 137 ? -40.25151 -9.18887  10.18684  1.000 26.46148  ? 432 HIS A C      1 
ATOM   908  O O      . HIS A 1 137 ? -39.56835 -8.42808  10.86887  1.000 26.64277  ? 432 HIS A O      1 
ATOM   909  C CB     . HIS A 1 137 ? -42.69791 -8.93820  10.64642  1.000 30.54536  ? 432 HIS A CB     1 
ATOM   910  C CG     . HIS A 1 137 ? -43.89980 -8.08319  10.39997  1.000 35.78407  ? 432 HIS A CG     1 
ATOM   911  N ND1    . HIS A 1 137 ? -44.81288 -8.34911  9.40071   1.000 39.68052  ? 432 HIS A ND1    1 
ATOM   912  C CD2    . HIS A 1 137 ? -44.30773 -6.93219  10.98497  1.000 39.38109  ? 432 HIS A CD2    1 
ATOM   913  C CE1    . HIS A 1 137 ? -45.74801 -7.41549  9.39911   1.000 37.85341  ? 432 HIS A CE1    1 
ATOM   914  N NE2    . HIS A 1 137 ? -45.45714 -6.53625  10.34322  1.000 40.20480  ? 432 HIS A NE2    1 
ATOM   915  N N      . GLN A 1 138 ? -39.85040 -10.42936 9.87886   1.000 25.29594  ? 433 GLN A N      1 
ATOM   916  C CA     . GLN A 1 138 ? -38.49655 -10.88895 10.21126  1.000 23.94648  ? 433 GLN A CA     1 
ATOM   917  C C      . GLN A 1 138 ? -37.42659 -10.06807 9.49201   1.000 24.91278  ? 433 GLN A C      1 
ATOM   918  O O      . GLN A 1 138 ? -36.38085 -9.73495  10.07202  1.000 25.59871  ? 433 GLN A O      1 
ATOM   919  C CB     . GLN A 1 138 ? -38.35043 -12.36352 9.83357   1.000 28.30333  ? 433 GLN A CB     1 
ATOM   920  C CG     . GLN A 1 138 ? -39.36330 -13.30499 10.48150  1.000 37.77275  ? 433 GLN A CG     1 
ATOM   921  C CD     . GLN A 1 138 ? -39.19677 -14.73216 9.97421   1.000 52.12901  ? 433 GLN A CD     1 
ATOM   922  O OE1    . GLN A 1 138 ? -40.16252 -15.48164 9.84312   1.000 57.09545  ? 433 GLN A OE1    1 
ATOM   923  N NE2    . GLN A 1 138 ? -37.95981 -15.10571 9.67535   1.000 54.15620  ? 433 GLN A NE2    1 
ATOM   924  N N      . LEU A 1 139 ? -37.65321 -9.77553  8.20634   1.000 25.01297  ? 434 LEU A N      1 
ATOM   925  C CA     . LEU A 1 139 ? -36.74068 -8.91452  7.46719   1.000 22.57701  ? 434 LEU A CA     1 
ATOM   926  C C      . LEU A 1 139 ? -36.68465 -7.53108  8.09248   1.000 22.74097  ? 434 LEU A C      1 
ATOM   927  O O      . LEU A 1 139 ? -35.60692 -6.95931  8.26589   1.000 24.26909  ? 434 LEU A O      1 
ATOM   928  C CB     . LEU A 1 139 ? -37.18296 -8.81673  6.00407   1.000 22.87827  ? 434 LEU A CB     1 
ATOM   929  C CG     . LEU A 1 139 ? -36.98914 -10.05987 5.13888   1.000 27.98569  ? 434 LEU A CG     1 
ATOM   930  C CD1    . LEU A 1 139 ? -37.84388 -9.95370  3.86386   1.000 25.63266  ? 434 LEU A CD1    1 
ATOM   931  C CD2    . LEU A 1 139 ? -35.49146 -10.20812 4.75972   1.000 25.90962  ? 434 LEU A CD2    1 
ATOM   932  N N      . LEU A 1 140 ? -37.84073 -6.97723  8.45369   1.000 24.35280  ? 435 LEU A N      1 
ATOM   933  C CA     . LEU A 1 140 ? -37.83731 -5.64470  9.04462   1.000 19.04115  ? 435 LEU A CA     1 
ATOM   934  C C      . LEU A 1 140 ? -37.00987 -5.62680  10.33405  1.000 25.64923  ? 435 LEU A C      1 
ATOM   935  O O      . LEU A 1 140 ? -36.15110 -4.75824  10.52637  1.000 26.38038  ? 435 LEU A O      1 
ATOM   936  C CB     . LEU A 1 140 ? -39.27159 -5.19578  9.29981   1.000 24.54856  ? 435 LEU A CB     1 
ATOM   937  C CG     . LEU A 1 140 ? -39.39805 -3.79475  9.91923   1.000 30.21464  ? 435 LEU A CG     1 
ATOM   938  C CD1    . LEU A 1 140 ? -38.81817 -2.76321  8.97721   1.000 29.92768  ? 435 LEU A CD1    1 
ATOM   939  C CD2    . LEU A 1 140 ? -40.85600 -3.50868  10.20870  1.000 35.45473  ? 435 LEU A CD2    1 
ATOM   940  N N      . ARG A 1 141 ? -37.26000 -6.57992  11.23145  1.000 22.57676  ? 436 ARG A N      1 
ATOM   941  C CA     . ARG A 1 141 ? -36.49694 -6.63547  12.48401  1.000 22.38128  ? 436 ARG A CA     1 
ATOM   942  C C      . ARG A 1 141 ? -34.99971 -6.77630  12.22271  1.000 26.02960  ? 436 ARG A C      1 
ATOM   943  O O      . ARG A 1 141 ? -34.17232 -6.13283  12.88049  1.000 27.07067  ? 436 ARG A O      1 
ATOM   944  C CB     . ARG A 1 141 ? -37.00978 -7.79827  13.34048  1.000 26.83735  ? 436 ARG A CB     1 
ATOM   945  C CG     . ARG A 1 141 ? -36.13354 -8.11703  14.56157  1.000 27.87019  ? 436 ARG A CG     1 
ATOM   946  C CD     . ARG A 1 141 ? -36.73870 -9.28812  15.32669  1.000 30.86959  ? 436 ARG A CD     1 
ATOM   947  N NE     . ARG A 1 141 ? -35.92661 -9.61279  16.49160  1.000 32.82855  ? 436 ARG A NE     1 
ATOM   948  C CZ     . ARG A 1 141 ? -35.10762 -10.65198 16.56143  1.000 49.34170  ? 436 ARG A CZ     1 
ATOM   949  N NH1    . ARG A 1 141 ? -35.00234 -11.51977 15.56523  1.000 51.01595  ? 436 ARG A NH1    1 
ATOM   950  N NH2    . ARG A 1 141 ? -34.37515 -10.82748 17.65800  1.000 52.47861  ? 436 ARG A NH2    1 
ATOM   951  N N      . HIS A 1 142 ? -34.63238 -7.60157  11.24418  1.000 25.22459  ? 437 HIS A N      1 
ATOM   952  C CA     . HIS A 1 142 ? -33.22763 -7.79343  10.92138  1.000 24.38566  ? 437 HIS A CA     1 
ATOM   953  C C      . HIS A 1 142 ? -32.55285 -6.46976  10.58418  1.000 25.85735  ? 437 HIS A C      1 
ATOM   954  O O      . HIS A 1 142 ? -31.48306 -6.16270  11.10442  1.000 25.90336  ? 437 HIS A O      1 
ATOM   955  C CB     . HIS A 1 142 ? -33.08786 -8.77748  9.75477   1.000 26.52417  ? 437 HIS A CB     1 
ATOM   956  C CG     . HIS A 1 142 ? -31.67697 -8.95433  9.28584   1.000 29.75572  ? 437 HIS A CG     1 
ATOM   957  N ND1    . HIS A 1 142 ? -30.76624 -9.73975  9.96094   1.000 34.20307  ? 437 HIS A ND1    1 
ATOM   958  C CD2    . HIS A 1 142 ? -31.01088 -8.42988  8.22861   1.000 31.68978  ? 437 HIS A CD2    1 
ATOM   959  C CE1    . HIS A 1 142 ? -29.60078 -9.69426  9.34135   1.000 33.64777  ? 437 HIS A CE1    1 
ATOM   960  N NE2    . HIS A 1 142 ? -29.71995 -8.90453  8.28849   1.000 33.97494  ? 437 HIS A NE2    1 
ATOM   961  N N      . PHE A 1 143 ? -33.16090 -5.66899  9.70276   1.000 24.52026  ? 438 PHE A N      1 
ATOM   962  C CA     . PHE A 1 143 ? -32.50247 -4.42765  9.30975   1.000 23.58055  ? 438 PHE A CA     1 
ATOM   963  C C      . PHE A 1 143 ? -32.69960 -3.31235  10.33615  1.000 24.99500  ? 438 PHE A C      1 
ATOM   964  O O      . PHE A 1 143 ? -31.89120 -2.37833  10.37662  1.000 25.05619  ? 438 PHE A O      1 
ATOM   965  C CB     . PHE A 1 143 ? -32.98013 -3.99622  7.91510   1.000 23.78677  ? 438 PHE A CB     1 
ATOM   966  C CG     . PHE A 1 143 ? -32.56725 -4.95784  6.82617   1.000 24.55202  ? 438 PHE A CG     1 
ATOM   967  C CD1    . PHE A 1 143 ? -31.22432 -5.17023  6.56297   1.000 24.93114  ? 438 PHE A CD1    1 
ATOM   968  C CD2    . PHE A 1 143 ? -33.51030 -5.64914  6.08867   1.000 29.36641  ? 438 PHE A CD2    1 
ATOM   969  C CE1    . PHE A 1 143 ? -30.81865 -6.06885  5.56792   1.000 24.40371  ? 438 PHE A CE1    1 
ATOM   970  C CE2    . PHE A 1 143 ? -33.11869 -6.53976  5.09589   1.000 28.93149  ? 438 PHE A CE2    1 
ATOM   971  C CZ     . PHE A 1 143 ? -31.77342 -6.74754  4.83815   1.000 23.88866  ? 438 PHE A CZ     1 
ATOM   972  N N      . GLN A 1 144 ? -33.73336 -3.38930  11.17785  1.000 23.78937  ? 439 GLN A N      1 
ATOM   973  C CA     . GLN A 1 144 ? -33.81102 -2.44191  12.28968  1.000 25.23107  ? 439 GLN A CA     1 
ATOM   974  C C      . GLN A 1 144 ? -32.65882 -2.63989  13.26596  1.000 28.95212  ? 439 GLN A C      1 
ATOM   975  O O      . GLN A 1 144 ? -32.18700 -1.67077  13.87316  1.000 27.44626  ? 439 GLN A O      1 
ATOM   976  C CB     . GLN A 1 144 ? -35.14706 -2.56448  13.01810  1.000 26.06768  ? 439 GLN A CB     1 
ATOM   977  C CG     . GLN A 1 144 ? -36.33228 -1.97854  12.24625  1.000 28.05806  ? 439 GLN A CG     1 
ATOM   978  C CD     . GLN A 1 144 ? -37.67290 -2.38202  12.83322  1.000 32.36631  ? 439 GLN A CD     1 
ATOM   979  O OE1    . GLN A 1 144 ? -37.84219 -3.51388  13.28712  1.000 32.61889  ? 439 GLN A OE1    1 
ATOM   980  N NE2    . GLN A 1 144 ? -38.63084 -1.45038  12.84404  1.000 31.27770  ? 439 GLN A NE2    1 
ATOM   981  N N      A LYS A 1 145 ? -32.18906 -3.88071  13.42559  0.332 28.65034  ? 440 LYS A N      1 
ATOM   982  N N      B LYS A 1 145 ? -32.20270 -3.88560  13.43705  0.668 28.56590  ? 440 LYS A N      1 
ATOM   983  C CA     A LYS A 1 145 ? -31.05006 -4.14406  14.30198  0.332 32.33315  ? 440 LYS A CA     1 
ATOM   984  C CA     B LYS A 1 145 ? -31.04826 -4.14684  14.29357  0.668 32.33425  ? 440 LYS A CA     1 
ATOM   985  C C      A LYS A 1 145 ? -29.73451 -3.69595  13.68020  0.332 36.28056  ? 440 LYS A C      1 
ATOM   986  C C      B LYS A 1 145 ? -29.76511 -3.61247  13.66991  0.668 36.41144  ? 440 LYS A C      1 
ATOM   987  O O      A LYS A 1 145 ? -28.81886 -3.30240  14.40812  0.332 37.53848  ? 440 LYS A O      1 
ATOM   988  O O      B LYS A 1 145 ? -28.90345 -3.08175  14.37846  0.668 37.66250  ? 440 LYS A O      1 
ATOM   989  C CB     A LYS A 1 145 ? -30.98977 -5.62965  14.65960  0.332 31.63528  ? 440 LYS A CB     1 
ATOM   990  C CB     B LYS A 1 145 ? -30.92955 -5.65039  14.56242  0.668 31.45082  ? 440 LYS A CB     1 
ATOM   991  C CG     A LYS A 1 145 ? -32.20318 -6.10883  15.44435  0.332 35.62312  ? 440 LYS A CG     1 
ATOM   992  C CG     B LYS A 1 145 ? -31.88425 -6.15228  15.63061  0.668 36.19238  ? 440 LYS A CG     1 
ATOM   993  C CD     A LYS A 1 145 ? -31.89870 -7.34809  16.27862  0.332 40.19317  ? 440 LYS A CD     1 
ATOM   994  C CD     B LYS A 1 145 ? -32.21973 -7.62717  15.42997  0.668 40.06840  ? 440 LYS A CD     1 
ATOM   995  C CE     A LYS A 1 145 ? -31.73374 -8.59026  15.42763  0.332 43.15624  ? 440 LYS A CE     1 
ATOM   996  C CE     B LYS A 1 145 ? -30.97970 -8.49608  15.45724  0.668 44.88742  ? 440 LYS A CE     1 
ATOM   997  N NZ     A LYS A 1 145 ? -31.58744 -9.80552  16.28283  0.332 45.46329  ? 440 LYS A NZ     1 
ATOM   998  N NZ     B LYS A 1 145 ? -31.33620 -9.94298  15.28101  0.668 46.06136  ? 440 LYS A NZ     1 
ATOM   999  N N      . ASP A 1 146 ? -29.61814 -3.73865  12.35249  1.000 31.88389  ? 441 ASP A N      1 
ATOM   1000 C CA     . ASP A 1 146 ? -28.45172 -3.19273  11.67398  1.000 41.03978  ? 441 ASP A CA     1 
ATOM   1001 C C      . ASP A 1 146 ? -28.76440 -3.06738  10.19492  1.000 33.59723  ? 441 ASP A C      1 
ATOM   1002 O O      . ASP A 1 146 ? -29.10693 -4.06681  9.54971   1.000 31.38666  ? 441 ASP A O      1 
ATOM   1003 C CB     . ASP A 1 146 ? -27.21782 -4.06761  11.88181  1.000 45.33318  ? 441 ASP A CB     1 
ATOM   1004 C CG     . ASP A 1 146 ? -26.05092 -3.64404  11.00445  1.000 50.09994  ? 441 ASP A CG     1 
ATOM   1005 O OD1    . ASP A 1 146 ? -25.61708 -2.47316  11.10401  1.000 52.40720  ? 441 ASP A OD1    1 
ATOM   1006 O OD2    . ASP A 1 146 ? -25.57948 -4.48120  10.20271  1.000 65.71276  ? 441 ASP A OD2    1 
ATOM   1007 N N      . ALA A 1 147 ? -28.64447 -1.85484  9.65240   1.000 33.50692  ? 442 ALA A N      1 
ATOM   1008 C CA     . ALA A 1 147 ? -28.96309 -1.60426  8.25469   1.000 32.78977  ? 442 ALA A CA     1 
ATOM   1009 C C      . ALA A 1 147 ? -27.72221 -1.36698  7.40898   1.000 34.11878  ? 442 ALA A C      1 
ATOM   1010 O O      . ALA A 1 147 ? -27.84957 -1.02848  6.23141   1.000 33.42720  ? 442 ALA A O      1 
ATOM   1011 C CB     . ALA A 1 147 ? -29.92000 -0.41155  8.12614   1.000 31.42461  ? 442 ALA A CB     1 
ATOM   1012 N N      . LYS A 1 148 ? -26.52544 -1.54951  7.97155   1.000 33.04657  ? 443 LYS A N      1 
ATOM   1013 C CA     . LYS A 1 148 ? -25.31077 -1.17448  7.25125   1.000 38.03135  ? 443 LYS A CA     1 
ATOM   1014 C C      . LYS A 1 148 ? -25.15107 -1.95606  5.94994   1.000 36.05019  ? 443 LYS A C      1 
ATOM   1015 O O      . LYS A 1 148 ? -24.80964 -1.37579  4.91377   1.000 32.65615  ? 443 LYS A O      1 
ATOM   1016 C CB     . LYS A 1 148 ? -24.09023 -1.34885  8.15281   1.000 46.65643  ? 443 LYS A CB     1 
ATOM   1017 C CG     . LYS A 1 148 ? -23.87508 -0.15674  9.07035   1.000 54.68972  ? 443 LYS A CG     1 
ATOM   1018 C CD     . LYS A 1 148 ? -22.90863 -0.45427  10.20927  1.000 71.29413  ? 443 LYS A CD     1 
ATOM   1019 C CE     . LYS A 1 148 ? -22.45186 0.83717   10.90009  1.000 75.65031  ? 443 LYS A CE     1 
ATOM   1020 N NZ     . LYS A 1 148 ? -23.58985 1.72252   11.31041  1.000 69.99659  ? 443 LYS A NZ     1 
ATOM   1021 N N      . VAL A 1 149 ? -25.39517 -3.27083  5.97019   1.000 35.41726  ? 444 VAL A N      1 
ATOM   1022 C CA     . VAL A 1 149 ? -25.27749 -4.03785  4.72843   1.000 38.62881  ? 444 VAL A CA     1 
ATOM   1023 C C      . VAL A 1 149 ? -26.36892 -3.63004  3.74081   1.000 30.27089  ? 444 VAL A C      1 
ATOM   1024 O O      . VAL A 1 149 ? -26.11661 -3.50049  2.53992   1.000 33.32341  ? 444 VAL A O      1 
ATOM   1025 C CB     . VAL A 1 149 ? -25.30534 -5.55278  5.00469   1.000 37.64367  ? 444 VAL A CB     1 
ATOM   1026 C CG1    . VAL A 1 149 ? -25.35978 -6.32859  3.69061   1.000 40.07045  ? 444 VAL A CG1    1 
ATOM   1027 C CG2    . VAL A 1 149 ? -24.09097 -5.97288  5.80168   1.000 34.91394  ? 444 VAL A CG2    1 
ATOM   1028 N N      . LEU A 1 150 ? -27.59765 -3.42936  4.22861   1.000 30.53682  ? 445 LEU A N      1 
ATOM   1029 C CA     . LEU A 1 150 ? -28.68248 -2.95278  3.36729   1.000 26.84722  ? 445 LEU A CA     1 
ATOM   1030 C C      . LEU A 1 150 ? -28.28704 -1.68252  2.61640   1.000 29.44122  ? 445 LEU A C      1 
ATOM   1031 O O      . LEU A 1 150 ? -28.42218 -1.60188  1.38941   1.000 28.91010  ? 445 LEU A O      1 
ATOM   1032 C CB     . LEU A 1 150 ? -29.94862 -2.70631  4.19993   1.000 25.18430  ? 445 LEU A CB     1 
ATOM   1033 C CG     . LEU A 1 150 ? -31.20532 -2.16221  3.49929   1.000 26.49388  ? 445 LEU A CG     1 
ATOM   1034 C CD1    . LEU A 1 150 ? -31.69331 -3.13484  2.41178   1.000 26.26870  ? 445 LEU A CD1    1 
ATOM   1035 C CD2    . LEU A 1 150 ? -32.33969 -1.89876  4.53328   1.000 24.72287  ? 445 LEU A CD2    1 
ATOM   1036 N N      . PHE A 1 151 ? -27.80606 -0.66832  3.34807   1.000 30.25182  ? 446 PHE A N      1 
ATOM   1037 C CA     . PHE A 1 151 ? -27.50928 0.62262   2.72921   1.000 26.33414  ? 446 PHE A CA     1 
ATOM   1038 C C      . PHE A 1 151 ? -26.31090 0.52934   1.80098   1.000 30.71503  ? 446 PHE A C      1 
ATOM   1039 O O      . PHE A 1 151 ? -26.28096 1.18756   0.75598   1.000 33.69581  ? 446 PHE A O      1 
ATOM   1040 C CB     . PHE A 1 151 ? -27.26402 1.68666   3.80096   1.000 28.84513  ? 446 PHE A CB     1 
ATOM   1041 C CG     . PHE A 1 151 ? -28.50894 2.07083   4.57756   1.000 30.86816  ? 446 PHE A CG     1 
ATOM   1042 C CD1    . PHE A 1 151 ? -29.76699 1.94521   4.00556   1.000 34.92310  ? 446 PHE A CD1    1 
ATOM   1043 C CD2    . PHE A 1 151 ? -28.41449 2.55434   5.87311   1.000 35.89103  ? 446 PHE A CD2    1 
ATOM   1044 C CE1    . PHE A 1 151 ? -30.91284 2.29277   4.70835   1.000 32.76365  ? 446 PHE A CE1    1 
ATOM   1045 C CE2    . PHE A 1 151 ? -29.55978 2.89827   6.59507   1.000 39.32346  ? 446 PHE A CE2    1 
ATOM   1046 C CZ     . PHE A 1 151 ? -30.80859 2.77509   6.00718   1.000 33.03092  ? 446 PHE A CZ     1 
ATOM   1047 N N      . GLN A 1 152 ? -25.31640 -0.28617  2.16279   1.000 32.67257  ? 447 GLN A N      1 
ATOM   1048 C CA     . GLN A 1 152 ? -24.11517 -0.38112  1.34094   1.000 34.94521  ? 447 GLN A CA     1 
ATOM   1049 C C      . GLN A 1 152 ? -24.36926 -1.12054  0.03390   1.000 37.08183  ? 447 GLN A C      1 
ATOM   1050 O O      . GLN A 1 152 ? -23.67082 -0.87934  -0.95343  1.000 40.54754  ? 447 GLN A O      1 
ATOM   1051 C CB     . GLN A 1 152 ? -22.99908 -1.05635  2.13506   1.000 39.24807  ? 447 GLN A CB     1 
ATOM   1052 C CG     . GLN A 1 152 ? -22.45167 -0.16627  3.25133   1.000 48.47566  ? 447 GLN A CG     1 
ATOM   1053 C CD     . GLN A 1 152 ? -21.57890 -0.92533  4.24545   1.000 64.62498  ? 447 GLN A CD     1 
ATOM   1054 O OE1    . GLN A 1 152 ? -21.33288 -2.12291  4.08670   1.000 67.57143  ? 447 GLN A OE1    1 
ATOM   1055 N NE2    . GLN A 1 152 ? -21.11095 -0.22821  5.27922   1.000 61.44804  ? 447 GLN A NE2    1 
ATOM   1056 N N      . ASN A 1 153 ? -25.35305 -2.01252  -0.00440  1.000 33.23308  ? 448 ASN A N      1 
ATOM   1057 C CA     . ASN A 1 153 ? -25.60592 -2.81602  -1.19370  1.000 37.11010  ? 448 ASN A CA     1 
ATOM   1058 C C      . ASN A 1 153 ? -26.81816 -2.34461  -1.98158  1.000 37.82453  ? 448 ASN A C      1 
ATOM   1059 O O      . ASN A 1 153 ? -27.10809 -2.89073  -3.04951  1.000 33.16323  ? 448 ASN A O      1 
ATOM   1060 C CB     . ASN A 1 153 ? -25.75739 -4.28247  -0.79178  1.000 36.49297  ? 448 ASN A CB     1 
ATOM   1061 C CG     . ASN A 1 153 ? -24.44596 -4.86901  -0.29568  1.000 50.10513  ? 448 ASN A CG     1 
ATOM   1062 O OD1    . ASN A 1 153 ? -24.28469 -5.14545  0.89150   1.000 55.87459  ? 448 ASN A OD1    1 
ATOM   1063 N ND2    . ASN A 1 153 ? -23.48642 -5.02509  -1.20349  1.000 58.31422  ? 448 ASN A ND2    1 
ATOM   1064 N N      . TRP A 1 154 ? -27.51790 -1.32640  -1.49200  1.000 32.22636  ? 449 TRP A N      1 
ATOM   1065 C CA     . TRP A 1 154 ? -28.66819 -0.80349  -2.21577  1.000 27.11914  ? 449 TRP A CA     1 
ATOM   1066 C C      . TRP A 1 154 ? -28.24962 -0.14068  -3.52337  1.000 29.78121  ? 449 TRP A C      1 
ATOM   1067 O O      . TRP A 1 154 ? -28.94266 -0.26988  -4.53833  1.000 32.17469  ? 449 TRP A O      1 
ATOM   1068 C CB     . TRP A 1 154 ? -29.41733 0.18103   -1.31374  1.000 29.05623  ? 449 TRP A CB     1 
ATOM   1069 C CG     . TRP A 1 154 ? -30.65682 0.75296   -1.91485  1.000 25.20745  ? 449 TRP A CG     1 
ATOM   1070 C CD1    . TRP A 1 154 ? -30.76381 1.92854   -2.59479  1.000 28.20289  ? 449 TRP A CD1    1 
ATOM   1071 C CD2    . TRP A 1 154 ? -31.97207 0.18160   -1.88609  1.000 24.26043  ? 449 TRP A CD2    1 
ATOM   1072 N NE1    . TRP A 1 154 ? -32.06050 2.12303   -2.99740  1.000 27.84279  ? 449 TRP A NE1    1 
ATOM   1073 C CE2    . TRP A 1 154 ? -32.82360 1.06842   -2.57386  1.000 24.78165  ? 449 TRP A CE2    1 
ATOM   1074 C CE3    . TRP A 1 154 ? -32.50431 -1.00661  -1.37128  1.000 26.96246  ? 449 TRP A CE3    1 
ATOM   1075 C CZ2    . TRP A 1 154 ? -34.18275 0.82238   -2.74376  1.000 26.58961  ? 449 TRP A CZ2    1 
ATOM   1076 C CZ3    . TRP A 1 154 ? -33.85705 -1.25225  -1.53624  1.000 27.50698  ? 449 TRP A CZ3    1 
ATOM   1077 C CH2    . TRP A 1 154 ? -34.68257 -0.34007  -2.21593  1.000 25.69428  ? 449 TRP A CH2    1 
ATOM   1078 N N      . GLY A 1 155 ? -27.14245 0.58228   -3.51560  1.000 31.10194  ? 450 GLY A N      1 
ATOM   1079 C CA     . GLY A 1 155 ? -26.64987 1.29533   -4.68045  1.000 35.24805  ? 450 GLY A CA     1 
ATOM   1080 C C      . GLY A 1 155 ? -26.81472 2.80148   -4.52776  1.000 40.64935  ? 450 GLY A C      1 
ATOM   1081 O O      . GLY A 1 155 ? -27.75267 3.28873   -3.88599  1.000 32.90766  ? 450 GLY A O      1 
ATOM   1082 N N      . ILE A 1 156 ? -25.88581 3.55565   -5.12493  1.000 29.85530  ? 451 ILE A N      1 
ATOM   1083 C CA     . ILE A 1 156 ? -25.97882 5.00906   -5.11275  1.000 32.29845  ? 451 ILE A CA     1 
ATOM   1084 C C      . ILE A 1 156 ? -25.97115 5.52108   -6.54210  1.000 42.40126  ? 451 ILE A C      1 
ATOM   1085 O O      . ILE A 1 156 ? -25.56499 4.83045   -7.48002  1.000 44.64990  ? 451 ILE A O      1 
ATOM   1086 C CB     . ILE A 1 156 ? -24.85552 5.68176   -4.29553  1.000 38.47960  ? 451 ILE A CB     1 
ATOM   1087 C CG1    . ILE A 1 156 ? -23.48485 5.38568   -4.90178  1.000 41.85323  ? 451 ILE A CG1    1 
ATOM   1088 C CG2    . ILE A 1 156 ? -24.91750 5.23882   -2.83736  1.000 40.39149  ? 451 ILE A CG2    1 
ATOM   1089 C CD1    . ILE A 1 156 ? -22.33160 5.91264   -4.05736  1.000 49.92833  ? 451 ILE A CD1    1 
ATOM   1090 N N      . GLU A 1 157 ? -26.42697 6.75628   -6.69746  1.000 38.51245  ? 452 GLU A N      1 
ATOM   1091 C CA     . GLU A 1 157 ? -26.54396 7.39484   -7.99692  1.000 40.44464  ? 452 GLU A CA     1 
ATOM   1092 C C      . GLU A 1 157 ? -26.18377 8.86753   -7.86162  1.000 44.52917  ? 452 GLU A C      1 
ATOM   1093 O O      . GLU A 1 157 ? -26.30740 9.44041   -6.77045  1.000 40.77180  ? 452 GLU A O      1 
ATOM   1094 C CB     . GLU A 1 157 ? -27.96883 7.25318   -8.56326  1.000 37.31295  ? 452 GLU A CB     1 
ATOM   1095 C CG     . GLU A 1 157 ? -29.07500 7.80050   -7.64330  1.000 42.90169  ? 452 GLU A CG     1 
ATOM   1096 C CD     . GLU A 1 157 ? -30.48323 7.46462   -8.14017  1.000 52.04299  ? 452 GLU A CD     1 
ATOM   1097 O OE1    . GLU A 1 157 ? -30.61076 6.53100   -8.96470  1.000 46.83073  ? 452 GLU A OE1    1 
ATOM   1098 O OE2    . GLU A 1 157 ? -31.46297 8.13601   -7.72021  1.000 35.25419  ? 452 GLU A OE2    1 
ATOM   1099 N N      . PRO A 1 158 ? -25.71494 9.49892   -8.93837  1.000 48.05572  ? 453 PRO A N      1 
ATOM   1100 C CA     . PRO A 1 158 ? -25.54015 10.95395  -8.91099  1.000 43.36013  ? 453 PRO A CA     1 
ATOM   1101 C C      . PRO A 1 158 ? -26.89688 11.62663  -8.99833  1.000 41.24719  ? 453 PRO A C      1 
ATOM   1102 O O      . PRO A 1 158 ? -27.84891 11.06764  -9.54138  1.000 42.69085  ? 453 PRO A O      1 
ATOM   1103 C CB     . PRO A 1 158 ? -24.68939 11.23412  -10.15623 1.000 49.24645  ? 453 PRO A CB     1 
ATOM   1104 C CG     . PRO A 1 158 ? -25.09043 10.15015  -11.10595 1.000 48.04508  ? 453 PRO A CG     1 
ATOM   1105 C CD     . PRO A 1 158 ? -25.35313 8.92401   -10.24914 1.000 51.74098  ? 453 PRO A CD     1 
ATOM   1106 N N      . ILE A 1 159 ? -26.99080 12.83402  -8.44095  1.000 38.22337  ? 454 ILE A N      1 
ATOM   1107 C CA     . ILE A 1 159 ? -28.26508 13.53864  -8.34522  1.000 43.73915  ? 454 ILE A CA     1 
ATOM   1108 C C      . ILE A 1 159 ? -28.09877 14.94516  -8.90711  1.000 59.33572  ? 454 ILE A C      1 
ATOM   1109 O O      . ILE A 1 159 ? -26.99993 15.37635  -9.25590  1.000 54.06549  ? 454 ILE A O      1 
ATOM   1110 C CB     . ILE A 1 159 ? -28.79512 13.59506  -6.89780  1.000 48.49695  ? 454 ILE A CB     1 
ATOM   1111 C CG1    . ILE A 1 159 ? -27.97368 14.58626  -6.08008  1.000 48.76669  ? 454 ILE A CG1    1 
ATOM   1112 C CG2    . ILE A 1 159 ? -28.75469 12.20695  -6.26097  1.000 42.54897  ? 454 ILE A CG2    1 
ATOM   1113 C CD1    . ILE A 1 159 ? -28.37382 14.64331  -4.63242  1.000 41.55879  ? 454 ILE A CD1    1 
ATOM   1114 N N      . ASP A 1 160 ? -29.21175 15.66968  -8.95987  1.000 60.54428  ? 455 ASP A N      1 
ATOM   1115 C CA     . ASP A 1 160 ? -29.26255 17.02827  -9.47813  1.000 68.64664  ? 455 ASP A CA     1 
ATOM   1116 C C      . ASP A 1 160 ? -29.70257 17.99674  -8.38600  1.000 70.71514  ? 455 ASP A C      1 
ATOM   1117 O O      . ASP A 1 160 ? -29.89221 17.62931  -7.22268  1.000 70.26826  ? 455 ASP A O      1 
ATOM   1118 C CB     . ASP A 1 160 ? -30.19226 17.10686  -10.68625 1.000 78.98371  ? 455 ASP A CB     1 
ATOM   1119 C CG     . ASP A 1 160 ? -29.60904 16.41991  -11.90224 1.000 81.98352  ? 455 ASP A CG     1 
ATOM   1120 O OD1    . ASP A 1 160 ? -28.38558 16.55679  -12.12653 1.000 78.46920  ? 455 ASP A OD1    1 
ATOM   1121 O OD2    . ASP A 1 160 ? -30.36285 15.73098  -12.62104 1.000 91.98002  ? 455 ASP A OD2    1 
ATOM   1122 N N      . ASN A 1 161 ? -29.85990 19.25220  -8.78253  1.000 72.88294  ? 456 ASN A N      1 
ATOM   1123 C CA     . ASN A 1 161 ? -30.08105 20.34685  -7.84361  1.000 77.40295  ? 456 ASN A CA     1 
ATOM   1124 C C      . ASN A 1 161 ? -31.57356 20.66903  -7.76356  1.000 80.17086  ? 456 ASN A C      1 
ATOM   1125 O O      . ASN A 1 161 ? -32.05043 21.71279  -8.21648  1.000 84.72611  ? 456 ASN A O      1 
ATOM   1126 C CB     . ASN A 1 161 ? -29.25923 21.56698  -8.26479  1.000 78.78089  ? 456 ASN A CB     1 
ATOM   1127 C CG     . ASN A 1 161 ? -29.09486 22.58398  -7.15020  1.000 81.55240  ? 456 ASN A CG     1 
ATOM   1128 O OD1    . ASN A 1 161 ? -29.89963 22.64384  -6.22119  1.000 85.92183  ? 456 ASN A OD1    1 
ATOM   1129 N ND2    . ASN A 1 161 ? -28.04379 23.39428  -7.24104  1.000 70.41168  ? 456 ASN A ND2    1 
ATOM   1130 N N      . VAL A 1 162 ? -32.32119 19.73914  -7.17389  1.000 69.81873  ? 457 VAL A N      1 
ATOM   1131 C CA     . VAL A 1 162 ? -33.73524 19.96014  -6.89198  1.000 71.11365  ? 457 VAL A CA     1 
ATOM   1132 C C      . VAL A 1 162 ? -33.80332 20.65893  -5.53905  1.000 70.93234  ? 457 VAL A C      1 
ATOM   1133 O O      . VAL A 1 162 ? -33.68715 20.02636  -4.48529  1.000 63.23411  ? 457 VAL A O      1 
ATOM   1134 C CB     . VAL A 1 162 ? -34.54210 18.66135  -6.90642  1.000 68.10667  ? 457 VAL A CB     1 
ATOM   1135 C CG1    . VAL A 1 162 ? -35.98805 18.94536  -6.52111  1.000 61.52003  ? 457 VAL A CG1    1 
ATOM   1136 C CG2    . VAL A 1 162 ? -34.47925 18.00800  -8.27961  1.000 67.04970  ? 457 VAL A CG2    1 
ATOM   1137 N N      . MET A 1 163 ? -33.97828 21.97502  -5.56903  1.000 68.76653  ? 458 MET A N      1 
ATOM   1138 C CA     . MET A 1 163 ? -33.97820 22.73468  -4.33125  1.000 67.22423  ? 458 MET A CA     1 
ATOM   1139 C C      . MET A 1 163 ? -35.15482 22.32071  -3.45668  1.000 56.43642  ? 458 MET A C      1 
ATOM   1140 O O      . MET A 1 163 ? -36.24040 22.00297  -3.94942  1.000 64.92749  ? 458 MET A O      1 
ATOM   1141 C CB     . MET A 1 163 ? -34.00172 24.23377  -4.62989  1.000 71.18036  ? 458 MET A CB     1 
ATOM   1142 C CG     . MET A 1 163 ? -32.60560 24.80311  -4.89830  1.000 68.23742  ? 458 MET A CG     1 
ATOM   1143 S SD     . MET A 1 163 ? -32.57585 26.55659  -5.33163  1.000 70.15149  ? 458 MET A SD     1 
ATOM   1144 C CE     . MET A 1 163 ? -31.88215 26.48677  -6.98735  1.000 57.77473  ? 458 MET A CE     1 
ATOM   1145 N N      . GLY A 1 164 ? -34.91999 22.30969  -2.14529  1.000 51.49797  ? 459 GLY A N      1 
ATOM   1146 C CA     . GLY A 1 164 ? -35.82240 21.72129  -1.18414  1.000 53.30764  ? 459 GLY A CA     1 
ATOM   1147 C C      . GLY A 1 164 ? -35.46808 20.29847  -0.79095  1.000 51.52685  ? 459 GLY A C      1 
ATOM   1148 O O      . GLY A 1 164 ? -35.91043 19.82981  0.26637   1.000 43.10177  ? 459 GLY A O      1 
ATOM   1149 N N      . MET A 1 165 ? -34.66784 19.61094  -1.60214  1.000 45.57968  ? 460 MET A N      1 
ATOM   1150 C CA     . MET A 1 165 ? -34.33062 18.21451  -1.37932  1.000 42.34817  ? 460 MET A CA     1 
ATOM   1151 C C      . MET A 1 165 ? -32.82124 18.04762  -1.37243  1.000 42.66618  ? 460 MET A C      1 
ATOM   1152 O O      . MET A 1 165 ? -32.07567 18.89081  -1.87828  1.000 44.76710  ? 460 MET A O      1 
ATOM   1153 C CB     . MET A 1 165 ? -34.94864 17.30455  -2.44846  1.000 42.85555  ? 460 MET A CB     1 
ATOM   1154 C CG     . MET A 1 165 ? -36.42065 17.02465  -2.22024  1.000 50.01006  ? 460 MET A CG     1 
ATOM   1155 S SD     . MET A 1 165 ? -37.17860 16.21622  -3.63187  1.000 60.10632  ? 460 MET A SD     1 
ATOM   1156 C CE     . MET A 1 165 ? -35.82249 16.23211  -4.80763  1.000 62.21167  ? 460 MET A CE     1 
ATOM   1157 N N      . ILE A 1 166 ? -32.37238 16.93858  -0.78630  1.000 33.45244  ? 461 ILE A N      1 
ATOM   1158 C CA     . ILE A 1 166 ? -30.95160 16.62485  -0.72773  1.000 30.32012  ? 461 ILE A CA     1 
ATOM   1159 C C      . ILE A 1 166 ? -30.78141 15.11531  -0.83645  1.000 31.90826  ? 461 ILE A C      1 
ATOM   1160 O O      . ILE A 1 166 ? -31.71658 14.34842  -0.61798  1.000 30.40893  ? 461 ILE A O      1 
ATOM   1161 C CB     . ILE A 1 166 ? -30.30132 17.16633  0.56558   1.000 32.47200  ? 461 ILE A CB     1 
ATOM   1162 C CG1    . ILE A 1 166 ? -28.78075 17.19284  0.41506   1.000 44.19774  ? 461 ILE A CG1    1 
ATOM   1163 C CG2    . ILE A 1 166 ? -30.72676 16.32033  1.76997   1.000 31.47083  ? 461 ILE A CG2    1 
ATOM   1164 C CD1    . ILE A 1 166 ? -28.11326 18.28477  1.23665   1.000 49.68165  ? 461 ILE A CD1    1 
ATOM   1165 N N      . GLY A 1 167 ? -29.57961 14.69212  -1.20639  1.000 30.17730  ? 462 GLY A N      1 
ATOM   1166 C CA     . GLY A 1 167 ? -29.26092 13.28276  -1.22718  1.000 31.73160  ? 462 GLY A CA     1 
ATOM   1167 C C      . GLY A 1 167 ? -28.79268 12.79583  0.12514   1.000 35.56889  ? 462 GLY A C      1 
ATOM   1168 O O      . GLY A 1 167 ? -28.40316 13.57247  0.99938   1.000 33.70878  ? 462 GLY A O      1 
ATOM   1169 N N      . ILE A 1 168 ? -28.83702 11.48233  0.30085   1.000 28.19056  ? 463 ILE A N      1 
ATOM   1170 C CA     . ILE A 1 168 ? -28.39296 10.84839  1.53388   1.000 30.79418  ? 463 ILE A CA     1 
ATOM   1171 C C      . ILE A 1 168 ? -27.51634 9.66359   1.15275   1.000 32.36238  ? 463 ILE A C      1 
ATOM   1172 O O      . ILE A 1 168 ? -27.90277 8.85723   0.29883   1.000 30.01651  ? 463 ILE A O      1 
ATOM   1173 C CB     . ILE A 1 168 ? -29.59117 10.41416  2.39956   1.000 28.00050  ? 463 ILE A CB     1 
ATOM   1174 C CG1    . ILE A 1 168 ? -29.11774 9.76155   3.69832   1.000 37.88902  ? 463 ILE A CG1    1 
ATOM   1175 C CG2    . ILE A 1 168 ? -30.54572 9.49937   1.60085   1.000 34.62223  ? 463 ILE A CG2    1 
ATOM   1176 C CD1    . ILE A 1 168 ? -30.14110 9.84897   4.82836   1.000 42.40773  ? 463 ILE A CD1    1 
ATOM   1177 N N      . LEU A 1 169 ? -26.33607 9.59033   1.74126   1.000 30.64586  ? 464 LEU A N      1 
ATOM   1178 C CA     . LEU A 1 169 ? -25.37412 8.54680   1.43050   1.000 32.20529  ? 464 LEU A CA     1 
ATOM   1179 C C      . LEU A 1 169 ? -25.61876 7.31222   2.29091   1.000 36.06188  ? 464 LEU A C      1 
ATOM   1180 O O      . LEU A 1 169 ? -26.33173 7.36233   3.30251   1.000 34.71895  ? 464 LEU A O      1 
ATOM   1181 C CB     . LEU A 1 169 ? -23.94830 9.07239   1.63354   1.000 32.86596  ? 464 LEU A CB     1 
ATOM   1182 C CG     . LEU A 1 169 ? -23.59475 10.30237  0.79231   1.000 40.25543  ? 464 LEU A CG     1 
ATOM   1183 C CD1    . LEU A 1 169 ? -22.17028 10.77565  1.07161   1.000 46.05000  ? 464 LEU A CD1    1 
ATOM   1184 C CD2    . LEU A 1 169 ? -23.79513 10.01320  -0.69522  1.000 40.36264  ? 464 LEU A CD2    1 
ATOM   1185 N N      . PRO A 1 170 ? -25.03440 6.17941   1.91435   1.000 34.27237  ? 465 PRO A N      1 
ATOM   1186 C CA     . PRO A 1 170 ? -25.21976 4.95833   2.71587   1.000 33.01084  ? 465 PRO A CA     1 
ATOM   1187 C C      . PRO A 1 170 ? -24.90007 5.12872   4.18325   1.000 37.06617  ? 465 PRO A C      1 
ATOM   1188 O O      . PRO A 1 170 ? -25.49947 4.43347   5.01040   1.000 35.92484  ? 465 PRO A O      1 
ATOM   1189 C CB     . PRO A 1 170 ? -24.26456 3.95463   2.05233   1.000 34.42749  ? 465 PRO A CB     1 
ATOM   1190 C CG     . PRO A 1 170 ? -24.21672 4.39230   0.63189   1.000 33.44662  ? 465 PRO A CG     1 
ATOM   1191 C CD     . PRO A 1 170 ? -24.29308 5.92090   0.66921   1.000 30.77032  ? 465 PRO A CD     1 
ATOM   1192 N N      . ASP A 1 171 ? -23.97466 6.01555   4.54298   1.000 39.11383  ? 466 ASP A N      1 
ATOM   1193 C CA     . ASP A 1 171 ? -23.65944 6.25146   5.94497   1.000 40.51947  ? 466 ASP A CA     1 
ATOM   1194 C C      . ASP A 1 171 ? -24.57007 7.29615   6.58289   1.000 42.88362  ? 466 ASP A C      1 
ATOM   1195 O O      . ASP A 1 171 ? -24.29665 7.73770   7.70522   1.000 41.59363  ? 466 ASP A O      1 
ATOM   1196 C CB     . ASP A 1 171 ? -22.18760 6.65566   6.10058   1.000 48.34111  ? 466 ASP A CB     1 
ATOM   1197 C CG     . ASP A 1 171 ? -21.89597 8.05784   5.58393   1.000 50.96366  ? 466 ASP A CG     1 
ATOM   1198 O OD1    . ASP A 1 171 ? -22.79478 8.68776   4.98374   1.000 41.19648  ? 466 ASP A OD1    1 
ATOM   1199 O OD2    . ASP A 1 171 ? -20.75453 8.52862   5.78593   1.000 49.14888  ? 466 ASP A OD2    1 
ATOM   1200 N N      . MET A 1 172 ? -25.64070 7.68742   5.88978   1.000 36.41300  ? 467 MET A N      1 
ATOM   1201 C CA     . MET A 1 172 ? -26.67915 8.59346   6.37220   1.000 37.80455  ? 467 MET A CA     1 
ATOM   1202 C C      . MET A 1 172 ? -26.20891 10.03988  6.49663   1.000 34.34216  ? 467 MET A C      1 
ATOM   1203 O O      . MET A 1 172 ? -26.88911 10.85588  7.12335   1.000 43.53182  ? 467 MET A O      1 
ATOM   1204 C CB     . MET A 1 172 ? -27.27649 8.10373   7.70012   1.000 42.35037  ? 467 MET A CB     1 
ATOM   1205 C CG     . MET A 1 172 ? -28.11426 6.81714   7.56254   1.000 39.06003  ? 467 MET A CG     1 
ATOM   1206 S SD     . MET A 1 172 ? -29.60925 7.00610   6.55552   1.000 47.03308  ? 467 MET A SD     1 
ATOM   1207 C CE     . MET A 1 172 ? -29.34130 5.79341   5.24569   1.000 51.26851  ? 467 MET A CE     1 
ATOM   1208 N N      . THR A 1 173 ? -25.09301 10.39223  5.88769   1.000 36.72138  ? 468 THR A N      1 
ATOM   1209 C CA     . THR A 1 173 ? -24.75618 11.81195  5.83422   1.000 41.32771  ? 468 THR A CA     1 
ATOM   1210 C C      . THR A 1 173 ? -25.32146 12.45993  4.56983   1.000 37.16320  ? 468 THR A C      1 
ATOM   1211 O O      . THR A 1 173 ? -25.40081 11.82122  3.51721   1.000 36.61313  ? 468 THR A O      1 
ATOM   1212 C CB     . THR A 1 173 ? -23.24411 12.00506  5.85985   1.000 44.41920  ? 468 THR A CB     1 
ATOM   1213 O OG1    . THR A 1 173 ? -22.68086 11.42693  4.68233   1.000 45.13051  ? 468 THR A OG1    1 
ATOM   1214 C CG2    . THR A 1 173 ? -22.62731 11.33882  7.09607   1.000 41.58859  ? 468 THR A CG2    1 
ATOM   1215 N N      . PRO A 1 174 ? -25.73586 13.72331  4.63451   1.000 33.22138  ? 469 PRO A N      1 
ATOM   1216 C CA     . PRO A 1 174 ? -26.31613 14.36399  3.44805   1.000 33.98420  ? 469 PRO A CA     1 
ATOM   1217 C C      . PRO A 1 174 ? -25.26436 14.64766  2.38224   1.000 40.21691  ? 469 PRO A C      1 
ATOM   1218 O O      . PRO A 1 174 ? -24.07572 14.80243  2.67106   1.000 36.63525  ? 469 PRO A O      1 
ATOM   1219 C CB     . PRO A 1 174 ? -26.92115 15.66288  3.99958   1.000 33.30754  ? 469 PRO A CB     1 
ATOM   1220 C CG     . PRO A 1 174 ? -26.21799 15.90437  5.29263   1.000 32.04891  ? 469 PRO A CG     1 
ATOM   1221 C CD     . PRO A 1 174 ? -25.88528 14.54949  5.84682   1.000 35.71326  ? 469 PRO A CD     1 
ATOM   1222 N N      . SER A 1 175 ? -25.71858 14.69229  1.13037   1.000 33.10729  ? 470 SER A N      1 
ATOM   1223 C CA     . SER A 1 175 ? -24.84040 14.95607  -0.00354  1.000 39.48917  ? 470 SER A CA     1 
ATOM   1224 C C      . SER A 1 175 ? -25.62345 15.64330  -1.11283  1.000 39.38346  ? 470 SER A C      1 
ATOM   1225 O O      . SER A 1 175 ? -26.75188 15.24979  -1.42172  1.000 37.39014  ? 470 SER A O      1 
ATOM   1226 C CB     . SER A 1 175 ? -24.21031 13.66623  -0.54441  1.000 39.97464  ? 470 SER A CB     1 
ATOM   1227 O OG     . SER A 1 175 ? -23.57380 13.90269  -1.79033  1.000 39.45555  ? 470 SER A OG     1 
ATOM   1228 N N      . THR A 1 176 ? -25.01444 16.65615  -1.72868  1.000 36.46568  ? 471 THR A N      1 
ATOM   1229 C CA     . THR A 1 176 ? -25.65484 17.34573  -2.84132  1.000 39.88874  ? 471 THR A CA     1 
ATOM   1230 C C      . THR A 1 176 ? -25.30795 16.73930  -4.19928  1.000 45.15740  ? 471 THR A C      1 
ATOM   1231 O O      . THR A 1 176 ? -25.81458 17.21083  -5.22491  1.000 45.81341  ? 471 THR A O      1 
ATOM   1232 C CB     . THR A 1 176 ? -25.28570 18.83748  -2.82978  1.000 49.28889  ? 471 THR A CB     1 
ATOM   1233 O OG1    . THR A 1 176 ? -23.86940 18.97712  -2.98156  1.000 48.00468  ? 471 THR A OG1    1 
ATOM   1234 C CG2    . THR A 1 176 ? -25.71430 19.49272  -1.51982  1.000 44.51475  ? 471 THR A CG2    1 
ATOM   1235 N N      . GLU A 1 177 ? -24.47596 15.70228  -4.23577  1.000 39.38677  ? 472 GLU A N      1 
ATOM   1236 C CA     . GLU A 1 177 ? -24.03593 15.12175  -5.49563  1.000 49.03373  ? 472 GLU A CA     1 
ATOM   1237 C C      . GLU A 1 177 ? -24.44470 13.67266  -5.69965  1.000 45.38738  ? 472 GLU A C      1 
ATOM   1238 O O      . GLU A 1 177 ? -24.59973 13.25673  -6.84910  1.000 42.61909  ? 472 GLU A O      1 
ATOM   1239 C CB     . GLU A 1 177 ? -22.50885 15.20894  -5.61186  1.000 60.42354  ? 472 GLU A CB     1 
ATOM   1240 C CG     . GLU A 1 177 ? -21.94870 16.58305  -5.31625  1.000 69.69948  ? 472 GLU A CG     1 
ATOM   1241 C CD     . GLU A 1 177 ? -20.44087 16.62488  -5.42673  1.000 92.38933  ? 472 GLU A CD     1 
ATOM   1242 O OE1    . GLU A 1 177 ? -19.83272 15.56448  -5.69033  1.000 100.21548 ? 472 GLU A OE1    1 
ATOM   1243 O OE2    . GLU A 1 177 ? -19.86400 17.71861  -5.25210  1.000 99.06670  ? 472 GLU A OE2    1 
ATOM   1244 N N      . MET A 1 178 ? -24.60428 12.89129  -4.62856  1.000 42.96506  ? 473 MET A N      1 
ATOM   1245 C CA     . MET A 1 178 ? -24.88402 11.46578  -4.72394  1.000 38.55701  ? 473 MET A CA     1 
ATOM   1246 C C      . MET A 1 178 ? -25.95826 11.09314  -3.71360  1.000 36.16010  ? 473 MET A C      1 
ATOM   1247 O O      . MET A 1 178 ? -26.15494 11.78955  -2.71453  1.000 31.34379  ? 473 MET A O      1 
ATOM   1248 C CB     . MET A 1 178 ? -23.63017 10.62578  -4.45663  1.000 41.59644  ? 473 MET A CB     1 
ATOM   1249 C CG     . MET A 1 178 ? -22.43594 11.02026  -5.29009  1.000 54.96702  ? 473 MET A CG     1 
ATOM   1250 S SD     . MET A 1 178 ? -22.52123 10.21980  -6.89461  1.000 63.47007  ? 473 MET A SD     1 
ATOM   1251 C CE     . MET A 1 178 ? -21.95142 8.57685   -6.47626  1.000 51.64688  ? 473 MET A CE     1 
ATOM   1252 N N      . SER A 1 179 ? -26.63763 9.97592   -3.95737  1.000 34.80392  ? 474 SER A N      1 
ATOM   1253 C CA     . SER A 1 179 ? -27.66039 9.53353   -3.01903  1.000 33.27421  ? 474 SER A CA     1 
ATOM   1254 C C      . SER A 1 179 ? -27.92298 8.04871   -3.21157  1.000 32.30801  ? 474 SER A C      1 
ATOM   1255 O O      . SER A 1 179 ? -27.72328 7.50849   -4.30372  1.000 29.59371  ? 474 SER A O      1 
ATOM   1256 C CB     . SER A 1 179 ? -28.96873 10.32993  -3.19535  1.000 29.42842  ? 474 SER A CB     1 
ATOM   1257 O OG     . SER A 1 179 ? -29.90382 10.04130  -2.15802  1.000 32.62764  ? 474 SER A OG     1 
ATOM   1258 N N      . LEU A 1 180 ? -28.39716 7.39939   -2.14321  1.000 29.93022  ? 475 LEU A N      1 
ATOM   1259 C CA     . LEU A 1 180 ? -29.01145 6.08582   -2.28618  1.000 26.41494  ? 475 LEU A CA     1 
ATOM   1260 C C      . LEU A 1 180 ? -29.99401 6.11066   -3.44833  1.000 29.06685  ? 475 LEU A C      1 
ATOM   1261 O O      . LEU A 1 180 ? -30.78885 7.04340   -3.58182  1.000 29.82645  ? 475 LEU A O      1 
ATOM   1262 C CB     . LEU A 1 180 ? -29.73321 5.69639   -0.99339  1.000 24.05148  ? 475 LEU A CB     1 
ATOM   1263 C CG     . LEU A 1 180 ? -28.84650 5.33324   0.19110   1.000 27.92268  ? 475 LEU A CG     1 
ATOM   1264 C CD1    . LEU A 1 180 ? -29.68882 5.34486   1.47736   1.000 29.61565  ? 475 LEU A CD1    1 
ATOM   1265 C CD2    . LEU A 1 180 ? -28.23162 3.95580   -0.04696  1.000 29.70907  ? 475 LEU A CD2    1 
ATOM   1266 N N      . ARG A 1 181 ? -29.93281 5.08120   -4.29214  1.000 28.99062  ? 476 ARG A N      1 
ATOM   1267 C CA     . ARG A 1 181 ? -30.72742 5.05099   -5.51797  1.000 27.28998  ? 476 ARG A CA     1 
ATOM   1268 C C      . ARG A 1 181 ? -32.21726 5.24193   -5.22878  1.000 28.12111  ? 476 ARG A C      1 
ATOM   1269 O O      . ARG A 1 181 ? -32.80264 4.53200   -4.40622  1.000 29.79604  ? 476 ARG A O      1 
ATOM   1270 C CB     . ARG A 1 181 ? -30.49375 3.71862   -6.23399  1.000 30.17522  ? 476 ARG A CB     1 
ATOM   1271 C CG     . ARG A 1 181 ? -31.61229 3.32986   -7.19439  1.000 40.45042  ? 476 ARG A CG     1 
ATOM   1272 C CD     . ARG A 1 181 ? -31.39596 1.94780   -7.79285  1.000 44.08913  ? 476 ARG A CD     1 
ATOM   1273 N NE     . ARG A 1 181 ? -31.23927 0.91230   -6.77632  1.000 42.01470  ? 476 ARG A NE     1 
ATOM   1274 C CZ     . ARG A 1 181 ? -32.23379 0.21590   -6.23888  1.000 45.26269  ? 476 ARG A CZ     1 
ATOM   1275 N NH1    . ARG A 1 181 ? -33.50301 0.45553   -6.54905  1.000 37.76029  ? 476 ARG A NH1    1 
ATOM   1276 N NH2    . ARG A 1 181 ? -31.95016 -0.74494  -5.36592  1.000 38.24024  ? 476 ARG A NH2    1 
ATOM   1277 N N      . GLY A 1 182 ? -32.82628 6.21941   -5.89929  1.000 29.22267  ? 477 GLY A N      1 
ATOM   1278 C CA     . GLY A 1 182 ? -34.24535 6.50720   -5.76227  1.000 26.55636  ? 477 GLY A CA     1 
ATOM   1279 C C      . GLY A 1 182 ? -34.65376 7.28524   -4.52625  1.000 26.63779  ? 477 GLY A C      1 
ATOM   1280 O O      . GLY A 1 182 ? -35.83540 7.64545   -4.40597  1.000 26.30002  ? 477 GLY A O      1 
ATOM   1281 N N      . VAL A 1 183 ? -33.73018 7.58555   -3.61924  1.000 23.41076  ? 478 VAL A N      1 
ATOM   1282 C CA     . VAL A 1 183 ? -34.06993 8.17625   -2.32295  1.000 23.21968  ? 478 VAL A CA     1 
ATOM   1283 C C      . VAL A 1 183 ? -33.60416 9.62464   -2.29445  1.000 29.57098  ? 478 VAL A C      1 
ATOM   1284 O O      . VAL A 1 183 ? -32.44870 9.90997   -2.62556  1.000 26.37458  ? 478 VAL A O      1 
ATOM   1285 C CB     . VAL A 1 183 ? -33.41336 7.40420   -1.16971  1.000 25.53529  ? 478 VAL A CB     1 
ATOM   1286 C CG1    . VAL A 1 183 ? -33.86645 7.98272   0.17832   1.000 26.28055  ? 478 VAL A CG1    1 
ATOM   1287 C CG2    . VAL A 1 183 ? -33.74400 5.90204   -1.27737  1.000 25.20481  ? 478 VAL A CG2    1 
ATOM   1288 N N      . ARG A 1 184 ? -34.48053 10.52346  -1.83866  1.000 26.85876  ? 479 ARG A N      1 
ATOM   1289 C CA     . ARG A 1 184 ? -34.12557 11.90223  -1.53058  1.000 28.13166  ? 479 ARG A CA     1 
ATOM   1290 C C      . ARG A 1 184 ? -34.72558 12.29204  -0.18545  1.000 27.98123  ? 479 ARG A C      1 
ATOM   1291 O O      . ARG A 1 184 ? -35.77475 11.78082  0.21499   1.000 26.08708  ? 479 ARG A O      1 
ATOM   1292 C CB     . ARG A 1 184 ? -34.63751 12.86852  -2.59445  1.000 28.50588  ? 479 ARG A CB     1 
ATOM   1293 C CG     . ARG A 1 184 ? -34.19367 12.51916  -4.01058  1.000 32.20002  ? 479 ARG A CG     1 
ATOM   1294 C CD     . ARG A 1 184 ? -32.70555 12.74704  -4.18800  1.000 35.21889  ? 479 ARG A CD     1 
ATOM   1295 N NE     . ARG A 1 184 ? -32.34791 12.63902  -5.59602  1.000 38.60979  ? 479 ARG A NE     1 
ATOM   1296 C CZ     . ARG A 1 184 ? -32.09326 11.49409  -6.21383  1.000 47.42297  ? 479 ARG A CZ     1 
ATOM   1297 N NH1    . ARG A 1 184 ? -32.12571 10.33450  -5.56520  1.000 32.28861  ? 479 ARG A NH1    1 
ATOM   1298 N NH2    . ARG A 1 184 ? -31.81159 11.51077  -7.51741  1.000 39.93753  ? 479 ARG A NH2    1 
ATOM   1299 N N      . VAL A 1 185 ? -34.07263 13.22499  0.49565   1.000 27.27898  ? 480 VAL A N      1 
ATOM   1300 C CA     . VAL A 1 185 ? -34.54868 13.73634  1.78106   1.000 27.43463  ? 480 VAL A CA     1 
ATOM   1301 C C      . VAL A 1 185 ? -35.07459 15.14472  1.55594   1.000 30.66323  ? 480 VAL A C      1 
ATOM   1302 O O      . VAL A 1 185 ? -34.37652 15.98371  0.98210   1.000 29.88551  ? 480 VAL A O      1 
ATOM   1303 C CB     . VAL A 1 185 ? -33.43373 13.73583  2.84251   1.000 25.97892  ? 480 VAL A CB     1 
ATOM   1304 C CG1    . VAL A 1 185 ? -33.92046 14.41656  4.12863   1.000 31.22522  ? 480 VAL A CG1    1 
ATOM   1305 C CG2    . VAL A 1 185 ? -32.94677 12.32122  3.13514   1.000 25.31937  ? 480 VAL A CG2    1 
ATOM   1306 N N      . SER A 1 186 ? -36.29287 15.40663  2.01380   1.000 26.75244  ? 481 SER A N      1 
ATOM   1307 C CA     . SER A 1 186 ? -36.92294 16.71487  1.91227   1.000 32.73472  ? 481 SER A CA     1 
ATOM   1308 C C      . SER A 1 186 ? -36.81785 17.45692  3.24006   1.000 31.80901  ? 481 SER A C      1 
ATOM   1309 O O      . SER A 1 186 ? -36.81429 16.84194  4.30576   1.000 33.58331  ? 481 SER A O      1 
ATOM   1310 C CB     . SER A 1 186 ? -38.39936 16.56364  1.53044   1.000 37.20065  ? 481 SER A CB     1 
ATOM   1311 O OG     . SER A 1 186 ? -39.07379 17.81080  1.57470   1.000 47.53676  ? 481 SER A OG     1 
ATOM   1312 N N      . LYS A 1 187 ? -36.74233 18.78793  3.17456   1.000 38.15799  ? 482 LYS A N      1 
ATOM   1313 C CA     . LYS A 1 187 ? -36.84420 19.59027  4.39220   1.000 38.28586  ? 482 LYS A CA     1 
ATOM   1314 C C      . LYS A 1 187 ? -38.23640 19.44456  4.98628   1.000 37.16291  ? 482 LYS A C      1 
ATOM   1315 O O      . LYS A 1 187 ? -39.22700 19.33969  4.25859   1.000 43.10284  ? 482 LYS A O      1 
ATOM   1316 C CB     . LYS A 1 187 ? -36.54836 21.06122  4.09609   1.000 38.96044  ? 482 LYS A CB     1 
ATOM   1317 C CG     . LYS A 1 187 ? -35.06899 21.36619  4.05370   1.000 43.67913  ? 482 LYS A CG     1 
ATOM   1318 C CD     . LYS A 1 187 ? -34.76857 22.63924  3.26977   1.000 44.35281  ? 482 LYS A CD     1 
ATOM   1319 C CE     . LYS A 1 187 ? -33.29548 22.67707  2.86430   1.000 53.55959  ? 482 LYS A CE     1 
ATOM   1320 N NZ     . LYS A 1 187 ? -32.84083 24.03682  2.42365   1.000 50.42717  ? 482 LYS A NZ     1 
ATOM   1321 N N      . MET A 1 188 ? -38.30689 19.41193  6.31425   1.000 41.89543  ? 483 MET A N      1 
ATOM   1322 C CA     . MET A 1 188 ? -39.57553 19.17431  6.99292   1.000 50.63594  ? 483 MET A CA     1 
ATOM   1323 C C      . MET A 1 188 ? -40.29187 20.48985  7.27894   1.000 60.26240  ? 483 MET A C      1 
ATOM   1324 O O      . MET A 1 188 ? -40.89528 21.08413  6.37945   1.000 69.75512  ? 483 MET A O      1 
ATOM   1325 C CB     . MET A 1 188 ? -39.35859 18.38984  8.29021   1.000 46.66560  ? 483 MET A CB     1 
ATOM   1326 C CG     . MET A 1 188 ? -40.57834 17.58074  8.71120   1.000 57.00920  ? 483 MET A CG     1 
ATOM   1327 S SD     . MET A 1 188 ? -40.49288 17.01895  10.41935  1.000 80.01345  ? 483 MET A SD     1 
ATOM   1328 C CE     . MET A 1 188 ? -39.76755 18.45595  11.21401  1.000 54.19479  ? 483 MET A CE     1 
HETATM 1329 P PG     . MGT B 2 .   ? -49.20985 -12.60809 5.53844   0.878 78.68528  ? 501 MGT A PG     1 
HETATM 1330 O O1G    . MGT B 2 .   ? -48.07842 -12.37539 4.56228   0.878 62.28453  ? 501 MGT A O1G    1 
HETATM 1331 O O2G    . MGT B 2 .   ? -48.75711 -13.30916 6.80396   0.878 67.02629  ? 501 MGT A O2G    1 
HETATM 1332 O O3G    . MGT B 2 .   ? -50.40230 -13.28614 4.89456   0.878 74.73837  ? 501 MGT A O3G    1 
HETATM 1333 O O3B    . MGT B 2 .   ? -49.75028 -11.14663 6.07159   0.878 68.36870  ? 501 MGT A O3B    1 
HETATM 1334 P PB     . MGT B 2 .   ? -50.24637 -9.72114  5.53625   0.878 71.50616  ? 501 MGT A PB     1 
HETATM 1335 O O1B    . MGT B 2 .   ? -50.64220 -8.89691  6.70158   0.878 61.95112  ? 501 MGT A O1B    1 
HETATM 1336 O O2B    . MGT B 2 .   ? -51.20220 -9.91653  4.41802   0.878 65.75121  ? 501 MGT A O2B    1 
HETATM 1337 O O3A    . MGT B 2 .   ? -48.88660 -9.13576  4.92847   0.878 59.24234  ? 501 MGT A O3A    1 
HETATM 1338 P PA     . MGT B 2 .   ? -47.63843 -8.33032  5.52718   0.878 62.48022  ? 501 MGT A PA     1 
HETATM 1339 O O1A    . MGT B 2 .   ? -47.60517 -8.49246  7.00153   0.878 47.35074  ? 501 MGT A O1A    1 
HETATM 1340 O O2A    . MGT B 2 .   ? -46.45752 -8.73415  4.72690   0.878 50.29650  ? 501 MGT A O2A    1 
HETATM 1341 O "O5'"  . MGT B 2 .   ? -48.00590 -6.80909  5.17328   0.878 49.47112  ? 501 MGT A "O5'"  1 
HETATM 1342 C "C5'"  . MGT B 2 .   ? -48.76512 -5.97419  6.08240   0.878 43.29563  ? 501 MGT A "C5'"  1 
HETATM 1343 C "C4'"  . MGT B 2 .   ? -49.69910 -5.06749  5.31323   0.878 38.71749  ? 501 MGT A "C4'"  1 
HETATM 1344 O "O4'"  . MGT B 2 .   ? -48.99421 -4.39589  4.23790   0.878 32.35617  ? 501 MGT A "O4'"  1 
HETATM 1345 C "C3'"  . MGT B 2 .   ? -50.87870 -5.79982  4.67306   0.878 36.82435  ? 501 MGT A "C3'"  1 
HETATM 1346 O "O3'"  . MGT B 2 .   ? -52.09054 -5.06321  4.77215   0.878 42.20902  ? 501 MGT A "O3'"  1 
HETATM 1347 C "C2'"  . MGT B 2 .   ? -50.43630 -5.95369  3.21500   0.878 33.90724  ? 501 MGT A "C2'"  1 
HETATM 1348 O "O2'"  . MGT B 2 .   ? -51.54858 -6.00385  2.32996   0.878 38.82750  ? 501 MGT A "O2'"  1 
HETATM 1349 C "C1'"  . MGT B 2 .   ? -49.64613 -4.66407  3.00832   0.878 33.62636  ? 501 MGT A "C1'"  1 
HETATM 1350 N N9     . MGT B 2 .   ? -48.70241 -4.66020  1.92642   0.878 32.05441  ? 501 MGT A N9     1 
HETATM 1351 C C8     . MGT B 2 .   ? -47.36905 -5.22408  2.03080   0.878 33.36457  ? 501 MGT A C8     1 
HETATM 1352 N N7     . MGT B 2 .   ? -46.84700 -4.90128  0.75892   0.878 33.97651  ? 501 MGT A N7     1 
HETATM 1353 C CM7    . MGT B 2 .   ? -45.46723 -5.21366  0.43715   0.878 28.50515  ? 501 MGT A CM7    1 
HETATM 1354 C C5     . MGT B 2 .   ? -47.71597 -4.23691  -0.03559  0.878 29.81925  ? 501 MGT A C5     1 
HETATM 1355 C C6     . MGT B 2 .   ? -47.57731 -3.73929  -1.35771  0.878 30.53887  ? 501 MGT A C6     1 
HETATM 1356 O O6     . MGT B 2 .   ? -46.62827 -3.74016  -2.12388  0.878 27.79402  ? 501 MGT A O6     1 
HETATM 1357 N N1     . MGT B 2 .   ? -48.72703 -3.14972  -1.71453  0.878 26.63105  ? 501 MGT A N1     1 
HETATM 1358 C C2     . MGT B 2 .   ? -49.81378 -3.05314  -0.93653  0.878 32.59285  ? 501 MGT A C2     1 
HETATM 1359 N N2     . MGT B 2 .   ? -50.78559 -2.50685  -1.46930  0.878 35.46435  ? 501 MGT A N2     1 
HETATM 1360 N N3     . MGT B 2 .   ? -49.94801 -3.50702  0.29493   0.878 28.62101  ? 501 MGT A N3     1 
HETATM 1361 C C4     . MGT B 2 .   ? -48.88224 -4.09498  0.70400   0.878 31.83834  ? 501 MGT A C4     1 
HETATM 1362 H "H5'1" . MGT B 2 .   ? -49.26841 -6.53150  6.71053   0.878 51.95475  ? 501 MGT A "H5'1" 1 
HETATM 1363 H "H5'2" . MGT B 2 .   ? -48.15852 -5.44689  6.64136   0.878 51.95475  ? 501 MGT A "H5'2" 1 
HETATM 1364 H "H4'"  . MGT B 2 .   ? -50.00974 -4.34645  5.89808   0.878 46.46099  ? 501 MGT A "H4'"  1 
HETATM 1365 H "H3'"  . MGT B 2 .   ? -51.03675 -6.68450  5.06140   0.878 44.18921  ? 501 MGT A "H3'"  1 
HETATM 1366 H "HO3'" . MGT B 2 .   ? -52.17054 -4.72692  3.99561   0.878 50.65082  ? 501 MGT A "HO3'" 1 
HETATM 1367 H "H2'"  . MGT B 2 .   ? -49.92054 -6.76921  3.04955   0.878 40.68869  ? 501 MGT A "H2'"  1 
HETATM 1368 H "HO2'" . MGT B 2 .   ? -51.22840 -5.63099  1.63644   0.878 46.59299  ? 501 MGT A "HO2'" 1 
HETATM 1369 H "H1'"  . MGT B 2 .   ? -50.26911 -3.92262  2.86484   0.878 40.35164  ? 501 MGT A "H1'"  1 
HETATM 1370 H H81    . MGT B 2 .   ? -47.39227 -6.19350  2.16542   0.878 40.03749  ? 501 MGT A H81    1 
HETATM 1371 H H82    . MGT B 2 .   ? -46.84796 -4.79956  2.74262   0.878 40.03749  ? 501 MGT A H82    1 
HETATM 1372 H HM71   . MGT B 2 .   ? -45.22200 -4.83520  -0.43180  0.878 34.20618  ? 501 MGT A HM71   1 
HETATM 1373 H HM72   . MGT B 2 .   ? -45.33319 -6.18271  0.39960   0.878 34.20618  ? 501 MGT A HM72   1 
HETATM 1374 H HM73   . MGT B 2 .   ? -44.86375 -4.84556  1.11446   0.878 34.20618  ? 501 MGT A HM73   1 
HETATM 1375 H HN1    . MGT B 2 .   ? -48.80954 -2.78716  -2.51542  0.878 31.95725  ? 501 MGT A HN1    1 
HETATM 1376 H HN21   . MGT B 2 .   ? -51.50550 -2.43969  -0.96243  0.878 42.55723  ? 501 MGT A HN21   1 
HETATM 1377 H HN22   . MGT B 2 .   ? -50.65928 -2.24034  -2.30159  0.878 42.55723  ? 501 MGT A HN22   1 
HETATM 1378 O O      . HOH C 3 .   ? -46.67190 -3.00951  -5.68965  1.000 40.27113  ? 601 HOH A O      1 
HETATM 1379 O O      . HOH C 3 .   ? -49.93460 9.21200   -6.60474  1.000 42.85262  ? 602 HOH A O      1 
HETATM 1380 O O      . HOH C 3 .   ? -40.42455 2.08076   12.16398  1.000 38.47787  ? 603 HOH A O      1 
HETATM 1381 O O      . HOH C 3 .   ? -30.77936 -15.75861 5.28017   1.000 33.09533  ? 604 HOH A O      1 
HETATM 1382 O O      . HOH C 3 .   ? -32.368   26.575    2.244     1.000 53.11007  ? 605 HOH A O      1 
HETATM 1383 O O      . HOH C 3 .   ? -25.28731 1.59251   -1.65736  1.000 37.55667  ? 606 HOH A O      1 
HETATM 1384 O O      . HOH C 3 .   ? -33.47369 2.13235   12.50250  1.000 44.01436  ? 607 HOH A O      1 
HETATM 1385 O O      . HOH C 3 .   ? -54.97328 3.88104   -6.53955  1.000 44.97493  ? 608 HOH A O      1 
HETATM 1386 O O      . HOH C 3 .   ? -36.38606 -6.85630  -7.09254  1.000 30.16290  ? 609 HOH A O      1 
HETATM 1387 O O      . HOH C 3 .   ? -39.98526 -4.74169  14.27315  1.000 30.49273  ? 610 HOH A O      1 
HETATM 1388 O O      . HOH C 3 .   ? -35.556   17.281    9.119     1.000 26.82189  ? 611 HOH A O      1 
HETATM 1389 O O      . HOH C 3 .   ? -27.10218 12.35625  9.31892   1.000 41.56387  ? 612 HOH A O      1 
HETATM 1390 O O      . HOH C 3 .   ? -36.77867 16.26382  6.91861   1.000 32.80549  ? 613 HOH A O      1 
HETATM 1391 O O      . HOH C 3 .   ? -36.383   18.583    12.459    1.000 30.31915  ? 614 HOH A O      1 
HETATM 1392 O O      . HOH C 3 .   ? -55.11361 -3.53198  -4.76345  1.000 56.17331  ? 615 HOH A O      1 
HETATM 1393 O O      . HOH C 3 .   ? -45.65391 -4.01189  11.24116  1.000 31.20286  ? 616 HOH A O      1 
HETATM 1394 O O      . HOH C 3 .   ? -35.99399 9.86885   15.84626  1.000 32.13712  ? 617 HOH A O      1 
HETATM 1395 O O      . HOH C 3 .   ? -27.69449 -7.59035  6.79766   1.000 36.46626  ? 618 HOH A O      1 
HETATM 1396 O O      . HOH C 3 .   ? -44.55771 5.80696   13.73816  1.000 38.25492  ? 619 HOH A O      1 
HETATM 1397 O O      . HOH C 3 .   ? -27.63719 -6.79339  -1.56118  1.000 38.63009  ? 620 HOH A O      1 
HETATM 1398 O O      . HOH C 3 .   ? -35.57449 -11.11283 12.31574  1.000 36.75944  ? 621 HOH A O      1 
HETATM 1399 O O      . HOH C 3 .   ? -29.41269 -7.94237  -5.78396  1.000 43.73013  ? 622 HOH A O      1 
HETATM 1400 O O      . HOH C 3 .   ? -43.78623 -5.78408  -4.51534  1.000 28.59262  ? 623 HOH A O      1 
HETATM 1401 O O      . HOH C 3 .   ? -30.83305 -0.37790  15.96051  1.000 36.55244  ? 624 HOH A O      1 
HETATM 1402 O O      . HOH C 3 .   ? -45.86426 -10.84335 11.18364  1.000 44.05757  ? 625 HOH A O      1 
HETATM 1403 O O      . HOH C 3 .   ? -32.65384 4.74777   12.36008  1.000 41.21248  ? 626 HOH A O      1 
HETATM 1404 O O      . HOH C 3 .   ? -42.56087 6.51261   -11.11332 1.000 39.84648  ? 627 HOH A O      1 
HETATM 1405 O O      . HOH C 3 .   ? -27.75483 -4.66700  7.11643   1.000 34.42432  ? 628 HOH A O      1 
HETATM 1406 O O      . HOH C 3 .   ? -54.12679 4.67676   -10.78151 1.000 39.07278  ? 629 HOH A O      1 
HETATM 1407 O O      . HOH C 3 .   ? -39.21712 -6.91828  -10.20914 1.000 31.61926  ? 630 HOH A O      1 
HETATM 1408 O O      . HOH C 3 .   ? -32.81842 -4.97466  -6.43055  1.000 34.62876  ? 631 HOH A O      1 
HETATM 1409 O O      . HOH C 3 .   ? -23.71034 1.93245   -6.08203  1.000 49.79587  ? 632 HOH A O      1 
HETATM 1410 O O      . HOH C 3 .   ? -46.98045 -8.53758  1.90112   1.000 46.02057  ? 633 HOH A O      1 
HETATM 1411 O O      . HOH C 3 .   ? -33.18762 -13.62341 16.34173  1.000 53.31682  ? 634 HOH A O      1 
HETATM 1412 O O      . HOH C 3 .   ? -47.46233 5.49662   18.66846  1.000 46.56527  ? 635 HOH A O      1 
HETATM 1413 O O      . HOH C 3 .   ? -42.04076 7.61856   12.39460  1.000 24.81052  ? 636 HOH A O      1 
HETATM 1414 O O      . HOH C 3 .   ? -46.34257 10.09696  -6.05133  1.000 46.01772  ? 637 HOH A O      1 
HETATM 1415 O O      . HOH C 3 .   ? -31.03651 11.26176  14.94204  1.000 37.40107  ? 638 HOH A O      1 
HETATM 1416 O O      . HOH C 3 .   ? -41.13917 -6.91397  12.80793  1.000 40.05364  ? 639 HOH A O      1 
HETATM 1417 O O      . HOH C 3 .   ? -55.00863 -10.01584 -4.91965  1.000 45.62362  ? 640 HOH A O      1 
HETATM 1418 O O      . HOH C 3 .   ? -39.40933 7.20963   11.84728  1.000 25.80029  ? 641 HOH A O      1 
HETATM 1419 O O      . HOH C 3 .   ? -22.51599 17.73833  -0.55883  1.000 48.77339  ? 642 HOH A O      1 
HETATM 1420 O O      . HOH C 3 .   ? -47.45739 -15.98140 6.85195   1.000 59.64435  ? 643 HOH A O      1 
HETATM 1421 O O      . HOH C 3 .   ? -20.71118 13.72056  -0.97757  1.000 58.80354  ? 644 HOH A O      1 
HETATM 1422 O O      . HOH C 3 .   ? -40.58132 -18.49489 4.86731   1.000 35.48660  ? 645 HOH A O      1 
HETATM 1423 O O      . HOH C 3 .   ? -47.33141 -1.08974  12.17220  1.000 31.70769  ? 646 HOH A O      1 
HETATM 1424 O O      . HOH C 3 .   ? -31.87800 14.25398  -9.33235  1.000 58.13592  ? 647 HOH A O      1 
HETATM 1425 O O      . HOH C 3 .   ? -37.54550 -12.71114 13.67174  1.000 49.43913  ? 648 HOH A O      1 
HETATM 1426 O O      . HOH C 3 .   ? -40.79847 8.42640   -10.40495 1.000 34.76784  ? 649 HOH A O      1 
HETATM 1427 O O      . HOH C 3 .   ? -41.89461 -18.36381 -6.37496  1.000 31.19342  ? 650 HOH A O      1 
HETATM 1428 O O      . HOH C 3 .   ? -45.06139 -12.14914 3.91788   1.000 33.40684  ? 651 HOH A O      1 
HETATM 1429 O O      . HOH C 3 .   ? -26.53013 -10.39351 7.96400   1.000 48.39167  ? 652 HOH A O      1 
HETATM 1430 O O      . HOH C 3 .   ? -48.15866 -5.25946  9.16319   1.000 47.33665  ? 653 HOH A O      1 
HETATM 1431 O O      . HOH C 3 .   ? -42.056   18.370    19.065    1.000 52.05412  ? 654 HOH A O      1 
HETATM 1432 O O      . HOH C 3 .   ? -32.52602 15.67234  -6.46124  1.000 53.78427  ? 655 HOH A O      1 
HETATM 1433 O O      . HOH C 3 .   ? -41.77634 13.97376  2.03645   1.000 45.29135  ? 656 HOH A O      1 
HETATM 1434 O O      . HOH C 3 .   ? -22.72856 1.92469   -2.08961  1.000 50.18029  ? 657 HOH A O      1 
HETATM 1435 O O      . HOH C 3 .   ? -37.12066 11.90671  -10.50146 1.000 60.51374  ? 658 HOH A O      1 
HETATM 1436 O O      . HOH C 3 .   ? -39.83578 2.23897   -13.86512 1.000 19.34516  ? 659 HOH A O      1 
HETATM 1437 O O      . HOH C 3 .   ? -44.11259 -3.92083  -12.20044 1.000 21.11817  ? 660 HOH A O      1 
HETATM 1438 O O      . HOH C 3 .   ? -38.35720 6.66994   14.37806  1.000 28.59103  ? 661 HOH A O      1 
HETATM 1439 O O      . HOH C 3 .   ? -21.09682 6.49496   2.88743   1.000 45.51812  ? 662 HOH A O      1 
HETATM 1440 O O      . HOH C 3 .   ? -50.149   -17.561   -5.262    1.000 52.75371  ? 663 HOH A O      1 
HETATM 1441 O O      . HOH C 3 .   ? -43.063   9.600     18.543    1.000 27.95775  ? 664 HOH A O      1 
HETATM 1442 O O      . HOH C 3 .   ? -49.049   11.748    -3.439    1.000 51.50348  ? 665 HOH A O      1 
HETATM 1443 O O      . HOH C 3 .   ? -24.118   18.655    1.962     1.000 54.14788  ? 666 HOH A O      1 
HETATM 1444 O O      . HOH C 3 .   ? -43.09374 -18.71688 5.66004   1.000 47.98085  ? 667 HOH A O      1 
HETATM 1445 O O      . HOH C 3 .   ? -49.91928 12.64361  4.17482   1.000 61.32197  ? 668 HOH A O      1 
HETATM 1446 O O      . HOH C 3 .   ? -37.991   4.118     -13.898   1.000 42.17975  ? 669 HOH A O      1 
HETATM 1447 O O      . HOH C 3 .   ? -43.10316 -7.07379  14.35304  1.000 41.66268  ? 670 HOH A O      1 
HETATM 1448 O O      . HOH C 3 .   ? -46.32864 15.02320  1.84173   1.000 60.95734  ? 671 HOH A O      1 
# 
