data_9CUN
# 
_entry.id   9CUN 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.399 
_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   9CUN         pdb_00009cun 10.2210/pdb9cun/pdb 
WWPDB D_1000286328 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
1 'Structure model' 1 0 2024-11-20 
2 'Structure model' 1 1 2024-12-11 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
_pdbx_audit_revision_category.ordinal             1 
_pdbx_audit_revision_category.revision_ordinal    2 
_pdbx_audit_revision_category.data_content_type   'Structure model' 
_pdbx_audit_revision_category.category            citation 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_citation.journal_volume'          
2 2 'Structure model' '_citation.page_first'              
3 2 'Structure model' '_citation.page_last'               
4 2 'Structure model' '_citation.pdbx_database_id_PubMed' 
5 2 'Structure model' '_citation.title'                   
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9CUN 
_pdbx_database_status.recvd_initial_deposition_date   2024-07-26 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           N 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              siseth.martinez@iquimica.unam.mx 
_pdbx_contact_author.name_first         Siseth 
_pdbx_contact_author.name_last          'Martinez Caballero' 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0003-4842-8447 
# 
_audit_author.name               'Martinez-Caballero, S.' 
_audit_author.pdbx_ordinal       1 
_audit_author.identifier_ORCID   0000-0003-4842-8447 
# 
_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                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Acs Omega' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2470-1343 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            9 
_citation.language                  ? 
_citation.page_first                46461 
_citation.page_last                 46471 
_citation.title                     
'Identification of Potential Inhibitors of Mycobacterium tuberculosis Amidases: An Integrated In Silico and Experimental Study.' 
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1021/acsomega.4c07964 
_citation.pdbx_database_id_PubMed   39583660 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Rosas-Cruz, M.'         1 ? 
primary 'Madariaga Mazon, A.'    2 ? 
primary 'Garcia-Mejia, C.D.'     3 ? 
primary 'Hernandez-Vazquez, E.'  4 ? 
primary 'Gomez-Velasco, H.'      5 ? 
primary 'Jimenez-Faraco, E.'     6 ? 
primary 'Farias-Gaytan, R.S.'    7 ? 
primary 'Hermoso, J.A.'          8 ? 
primary 'Martinez-Caballero, S.' 9 ? 
# 
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 'N-acetylmuramoyl-L-alanine amidase Rv3717' 22696.316 1   3.5.1.28 ? ? ? 
2 non-polymer syn '5-(2-iodophenyl)-2H-tetrazole'             272.046   1   ?        ? ? ? 
3 non-polymer syn 'ZINC ION'                                  65.409    1   ?        ? ? ? 
4 water       nat water                                       18.015    160 ?        ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'Zinc-dependent peptidoglycan amidase' 
# 
_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       
;SAGMVVFIDPGHNGANDASIGRQVPTGRGGTKNCQASGTSTNSGYPEHTFTWETGLRLRAALNALGVRTALSRGNDNALG
PCVDERANMANALRPNAIVSLHADGGPASGRGFHVNYSAPPLNAIQAGPSVQFARIMRDQLQASGIPKANYIGQDGLYGR
SDLAGLNLAQYPSILVELGNMKNPADSALMESAEGRQKYANALVRGVAGFLATQGQAR
;
_entity_poly.pdbx_seq_one_letter_code_can   
;SAGMVVFIDPGHNGANDASIGRQVPTGRGGTKNCQASGTSTNSGYPEHTFTWETGLRLRAALNALGVRTALSRGNDNALG
PCVDERANMANALRPNAIVSLHADGGPASGRGFHVNYSAPPLNAIQAGPSVQFARIMRDQLQASGIPKANYIGQDGLYGR
SDLAGLNLAQYPSILVELGNMKNPADSALMESAEGRQKYANALVRGVAGFLATQGQAR
;
_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 '5-(2-iodophenyl)-2H-tetrazole' A1A0I 
3 'ZINC ION'                      ZN    
4 water                           HOH   
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   SER n 
1 2   ALA n 
1 3   GLY n 
1 4   MET n 
1 5   VAL n 
1 6   VAL n 
1 7   PHE n 
1 8   ILE n 
1 9   ASP n 
1 10  PRO n 
1 11  GLY n 
1 12  HIS n 
1 13  ASN n 
1 14  GLY n 
1 15  ALA n 
1 16  ASN n 
1 17  ASP n 
1 18  ALA n 
1 19  SER n 
1 20  ILE n 
1 21  GLY n 
1 22  ARG n 
1 23  GLN n 
1 24  VAL n 
1 25  PRO n 
1 26  THR n 
1 27  GLY n 
1 28  ARG n 
1 29  GLY n 
1 30  GLY n 
1 31  THR n 
1 32  LYS n 
1 33  ASN n 
1 34  CYS n 
1 35  GLN n 
1 36  ALA n 
1 37  SER n 
1 38  GLY n 
1 39  THR n 
1 40  SER n 
1 41  THR n 
1 42  ASN n 
1 43  SER n 
1 44  GLY n 
1 45  TYR n 
1 46  PRO n 
1 47  GLU n 
1 48  HIS n 
1 49  THR n 
1 50  PHE n 
1 51  THR n 
1 52  TRP n 
1 53  GLU n 
1 54  THR n 
1 55  GLY n 
1 56  LEU n 
1 57  ARG n 
1 58  LEU n 
1 59  ARG n 
1 60  ALA n 
1 61  ALA n 
1 62  LEU n 
1 63  ASN n 
1 64  ALA n 
1 65  LEU n 
1 66  GLY n 
1 67  VAL n 
1 68  ARG n 
1 69  THR n 
1 70  ALA n 
1 71  LEU n 
1 72  SER n 
1 73  ARG n 
1 74  GLY n 
1 75  ASN n 
1 76  ASP n 
1 77  ASN n 
1 78  ALA n 
1 79  LEU n 
1 80  GLY n 
1 81  PRO n 
1 82  CYS n 
1 83  VAL n 
1 84  ASP n 
1 85  GLU n 
1 86  ARG n 
1 87  ALA n 
1 88  ASN n 
1 89  MET n 
1 90  ALA n 
1 91  ASN n 
1 92  ALA n 
1 93  LEU n 
1 94  ARG n 
1 95  PRO n 
1 96  ASN n 
1 97  ALA n 
1 98  ILE n 
1 99  VAL n 
1 100 SER n 
1 101 LEU n 
1 102 HIS n 
1 103 ALA n 
1 104 ASP n 
1 105 GLY n 
1 106 GLY n 
1 107 PRO n 
1 108 ALA n 
1 109 SER n 
1 110 GLY n 
1 111 ARG n 
1 112 GLY n 
1 113 PHE n 
1 114 HIS n 
1 115 VAL n 
1 116 ASN n 
1 117 TYR n 
1 118 SER n 
1 119 ALA n 
1 120 PRO n 
1 121 PRO n 
1 122 LEU n 
1 123 ASN n 
1 124 ALA n 
1 125 ILE n 
1 126 GLN n 
1 127 ALA n 
1 128 GLY n 
1 129 PRO n 
1 130 SER n 
1 131 VAL n 
1 132 GLN n 
1 133 PHE n 
1 134 ALA n 
1 135 ARG n 
1 136 ILE n 
1 137 MET n 
1 138 ARG n 
1 139 ASP n 
1 140 GLN n 
1 141 LEU n 
1 142 GLN n 
1 143 ALA n 
1 144 SER n 
1 145 GLY n 
1 146 ILE n 
1 147 PRO n 
1 148 LYS n 
1 149 ALA n 
1 150 ASN n 
1 151 TYR n 
1 152 ILE n 
1 153 GLY n 
1 154 GLN n 
1 155 ASP n 
1 156 GLY n 
1 157 LEU n 
1 158 TYR n 
1 159 GLY n 
1 160 ARG n 
1 161 SER n 
1 162 ASP n 
1 163 LEU n 
1 164 ALA n 
1 165 GLY n 
1 166 LEU n 
1 167 ASN n 
1 168 LEU n 
1 169 ALA n 
1 170 GLN n 
1 171 TYR n 
1 172 PRO n 
1 173 SER n 
1 174 ILE n 
1 175 LEU n 
1 176 VAL n 
1 177 GLU n 
1 178 LEU n 
1 179 GLY n 
1 180 ASN n 
1 181 MET n 
1 182 LYS n 
1 183 ASN n 
1 184 PRO n 
1 185 ALA n 
1 186 ASP n 
1 187 SER n 
1 188 ALA n 
1 189 LEU n 
1 190 MET n 
1 191 GLU n 
1 192 SER n 
1 193 ALA n 
1 194 GLU n 
1 195 GLY n 
1 196 ARG n 
1 197 GLN n 
1 198 LYS n 
1 199 TYR n 
1 200 ALA n 
1 201 ASN n 
1 202 ALA n 
1 203 LEU n 
1 204 VAL n 
1 205 ARG n 
1 206 GLY n 
1 207 VAL n 
1 208 ALA n 
1 209 GLY n 
1 210 PHE n 
1 211 LEU n 
1 212 ALA n 
1 213 THR n 
1 214 GLN n 
1 215 GLY n 
1 216 GLN n 
1 217 ALA n 
1 218 ARG 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                   218 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 Rv3717 
_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      'Mycobacterium tuberculosis' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     1773 
_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 
A1A0I non-polymer         . '5-(2-iodophenyl)-2H-tetrazole' ? 'C7 H5 I N4'     272.046 
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 
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 
ZN    non-polymer         . 'ZINC ION'                      ? 'Zn 2'           65.409  
# 
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   SER 1   24  ?   ?   ?   A . n 
A 1 2   ALA 2   25  ?   ?   ?   A . n 
A 1 3   GLY 3   26  26  GLY GLY A . n 
A 1 4   MET 4   27  27  MET MET A . n 
A 1 5   VAL 5   28  28  VAL VAL A . n 
A 1 6   VAL 6   29  29  VAL VAL A . n 
A 1 7   PHE 7   30  30  PHE PHE A . n 
A 1 8   ILE 8   31  31  ILE ILE A . n 
A 1 9   ASP 9   32  32  ASP ASP A . n 
A 1 10  PRO 10  33  33  PRO PRO A . n 
A 1 11  GLY 11  34  34  GLY GLY A . n 
A 1 12  HIS 12  35  35  HIS HIS A . n 
A 1 13  ASN 13  36  36  ASN ASN A . n 
A 1 14  GLY 14  37  37  GLY GLY A . n 
A 1 15  ALA 15  38  38  ALA ALA A . n 
A 1 16  ASN 16  39  39  ASN ASN A . n 
A 1 17  ASP 17  40  40  ASP ASP A . n 
A 1 18  ALA 18  41  41  ALA ALA A . n 
A 1 19  SER 19  42  42  SER SER A . n 
A 1 20  ILE 20  43  43  ILE ILE A . n 
A 1 21  GLY 21  44  44  GLY GLY A . n 
A 1 22  ARG 22  45  45  ARG ARG A . n 
A 1 23  GLN 23  46  46  GLN GLN A . n 
A 1 24  VAL 24  47  47  VAL VAL A . n 
A 1 25  PRO 25  48  48  PRO PRO A . n 
A 1 26  THR 26  49  49  THR THR A . n 
A 1 27  GLY 27  50  50  GLY GLY A . n 
A 1 28  ARG 28  51  51  ARG ARG A . n 
A 1 29  GLY 29  52  52  GLY GLY A . n 
A 1 30  GLY 30  53  53  GLY GLY A . n 
A 1 31  THR 31  54  54  THR THR A . n 
A 1 32  LYS 32  55  55  LYS LYS A . n 
A 1 33  ASN 33  56  56  ASN ASN A . n 
A 1 34  CYS 34  57  57  CYS CYS A . n 
A 1 35  GLN 35  58  58  GLN GLN A . n 
A 1 36  ALA 36  59  59  ALA ALA A . n 
A 1 37  SER 37  60  60  SER SER A . n 
A 1 38  GLY 38  61  61  GLY GLY A . n 
A 1 39  THR 39  62  62  THR THR A . n 
A 1 40  SER 40  63  63  SER SER A . n 
A 1 41  THR 41  64  64  THR THR A . n 
A 1 42  ASN 42  65  65  ASN ASN A . n 
A 1 43  SER 43  66  66  SER SER A . n 
A 1 44  GLY 44  67  67  GLY GLY A . n 
A 1 45  TYR 45  68  68  TYR TYR A . n 
A 1 46  PRO 46  69  69  PRO PRO A . n 
A 1 47  GLU 47  70  70  GLU GLU A . n 
A 1 48  HIS 48  71  71  HIS HIS A . n 
A 1 49  THR 49  72  72  THR THR A . n 
A 1 50  PHE 50  73  73  PHE PHE A . n 
A 1 51  THR 51  74  74  THR THR A . n 
A 1 52  TRP 52  75  75  TRP TRP A . n 
A 1 53  GLU 53  76  76  GLU GLU A . n 
A 1 54  THR 54  77  77  THR THR A . n 
A 1 55  GLY 55  78  78  GLY GLY A . n 
A 1 56  LEU 56  79  79  LEU LEU A . n 
A 1 57  ARG 57  80  80  ARG ARG A . n 
A 1 58  LEU 58  81  81  LEU LEU A . n 
A 1 59  ARG 59  82  82  ARG ARG A . n 
A 1 60  ALA 60  83  83  ALA ALA A . n 
A 1 61  ALA 61  84  84  ALA ALA A . n 
A 1 62  LEU 62  85  85  LEU LEU A . n 
A 1 63  ASN 63  86  86  ASN ASN A . n 
A 1 64  ALA 64  87  87  ALA ALA A . n 
A 1 65  LEU 65  88  88  LEU LEU A . n 
A 1 66  GLY 66  89  89  GLY GLY A . n 
A 1 67  VAL 67  90  90  VAL VAL A . n 
A 1 68  ARG 68  91  91  ARG ARG A . n 
A 1 69  THR 69  92  92  THR THR A . n 
A 1 70  ALA 70  93  93  ALA ALA A . n 
A 1 71  LEU 71  94  94  LEU LEU A . n 
A 1 72  SER 72  95  95  SER SER A . n 
A 1 73  ARG 73  96  96  ARG ARG A . n 
A 1 74  GLY 74  97  97  GLY GLY A . n 
A 1 75  ASN 75  98  98  ASN ASN A . n 
A 1 76  ASP 76  99  99  ASP ASP A . n 
A 1 77  ASN 77  100 100 ASN ASN A . n 
A 1 78  ALA 78  101 101 ALA ALA A . n 
A 1 79  LEU 79  102 102 LEU LEU A . n 
A 1 80  GLY 80  103 103 GLY GLY A . n 
A 1 81  PRO 81  104 104 PRO PRO A . n 
A 1 82  CYS 82  105 105 CYS CYS A . n 
A 1 83  VAL 83  106 106 VAL VAL A . n 
A 1 84  ASP 84  107 107 ASP ASP A . n 
A 1 85  GLU 85  108 108 GLU GLU A . n 
A 1 86  ARG 86  109 109 ARG ARG A . n 
A 1 87  ALA 87  110 110 ALA ALA A . n 
A 1 88  ASN 88  111 111 ASN ASN A . n 
A 1 89  MET 89  112 112 MET MET A . n 
A 1 90  ALA 90  113 113 ALA ALA A . n 
A 1 91  ASN 91  114 114 ASN ASN A . n 
A 1 92  ALA 92  115 115 ALA ALA A . n 
A 1 93  LEU 93  116 116 LEU LEU A . n 
A 1 94  ARG 94  117 117 ARG ARG A . n 
A 1 95  PRO 95  118 118 PRO PRO A . n 
A 1 96  ASN 96  119 119 ASN ASN A . n 
A 1 97  ALA 97  120 120 ALA ALA A . n 
A 1 98  ILE 98  121 121 ILE ILE A . n 
A 1 99  VAL 99  122 122 VAL VAL A . n 
A 1 100 SER 100 123 123 SER SER A . n 
A 1 101 LEU 101 124 124 LEU LEU A . n 
A 1 102 HIS 102 125 125 HIS HIS A . n 
A 1 103 ALA 103 126 126 ALA ALA A . n 
A 1 104 ASP 104 127 127 ASP ASP A . n 
A 1 105 GLY 105 128 128 GLY GLY A . n 
A 1 106 GLY 106 129 129 GLY GLY A . n 
A 1 107 PRO 107 130 130 PRO PRO A . n 
A 1 108 ALA 108 131 131 ALA ALA A . n 
A 1 109 SER 109 132 132 SER SER A . n 
A 1 110 GLY 110 133 133 GLY GLY A . n 
A 1 111 ARG 111 134 134 ARG ARG A . n 
A 1 112 GLY 112 135 135 GLY GLY A . n 
A 1 113 PHE 113 136 136 PHE PHE A . n 
A 1 114 HIS 114 137 137 HIS HIS A . n 
A 1 115 VAL 115 138 138 VAL VAL A . n 
A 1 116 ASN 116 139 139 ASN ASN A . n 
A 1 117 TYR 117 140 140 TYR TYR A . n 
A 1 118 SER 118 141 141 SER SER A . n 
A 1 119 ALA 119 142 142 ALA ALA A . n 
A 1 120 PRO 120 143 143 PRO PRO A . n 
A 1 121 PRO 121 144 144 PRO PRO A . n 
A 1 122 LEU 122 145 145 LEU LEU A . n 
A 1 123 ASN 123 146 146 ASN ASN A . n 
A 1 124 ALA 124 147 147 ALA ALA A . n 
A 1 125 ILE 125 148 148 ILE ILE A . n 
A 1 126 GLN 126 149 149 GLN GLN A . n 
A 1 127 ALA 127 150 150 ALA ALA A . n 
A 1 128 GLY 128 151 151 GLY GLY A . n 
A 1 129 PRO 129 152 152 PRO PRO A . n 
A 1 130 SER 130 153 153 SER SER A . n 
A 1 131 VAL 131 154 154 VAL VAL A . n 
A 1 132 GLN 132 155 155 GLN GLN A . n 
A 1 133 PHE 133 156 156 PHE PHE A . n 
A 1 134 ALA 134 157 157 ALA ALA A . n 
A 1 135 ARG 135 158 158 ARG ARG A . n 
A 1 136 ILE 136 159 159 ILE ILE A . n 
A 1 137 MET 137 160 160 MET MET A . n 
A 1 138 ARG 138 161 161 ARG ARG A . n 
A 1 139 ASP 139 162 162 ASP ASP A . n 
A 1 140 GLN 140 163 163 GLN GLN A . n 
A 1 141 LEU 141 164 164 LEU LEU A . n 
A 1 142 GLN 142 165 165 GLN GLN A . n 
A 1 143 ALA 143 166 166 ALA ALA A . n 
A 1 144 SER 144 167 167 SER SER A . n 
A 1 145 GLY 145 168 168 GLY GLY A . n 
A 1 146 ILE 146 169 169 ILE ILE A . n 
A 1 147 PRO 147 170 170 PRO PRO A . n 
A 1 148 LYS 148 171 171 LYS LYS A . n 
A 1 149 ALA 149 172 172 ALA ALA A . n 
A 1 150 ASN 150 173 173 ASN ASN A . n 
A 1 151 TYR 151 174 174 TYR TYR A . n 
A 1 152 ILE 152 175 175 ILE ILE A . n 
A 1 153 GLY 153 176 176 GLY GLY A . n 
A 1 154 GLN 154 177 177 GLN GLN A . n 
A 1 155 ASP 155 178 178 ASP ASP A . n 
A 1 156 GLY 156 179 179 GLY GLY A . n 
A 1 157 LEU 157 180 180 LEU LEU A . n 
A 1 158 TYR 158 181 181 TYR TYR A . n 
A 1 159 GLY 159 182 182 GLY GLY A . n 
A 1 160 ARG 160 183 183 ARG ARG A . n 
A 1 161 SER 161 184 184 SER SER A . n 
A 1 162 ASP 162 185 185 ASP ASP A . n 
A 1 163 LEU 163 186 186 LEU LEU A . n 
A 1 164 ALA 164 187 187 ALA ALA A . n 
A 1 165 GLY 165 188 188 GLY GLY A . n 
A 1 166 LEU 166 189 189 LEU LEU A . n 
A 1 167 ASN 167 190 190 ASN ASN A . n 
A 1 168 LEU 168 191 191 LEU LEU A . n 
A 1 169 ALA 169 192 192 ALA ALA A . n 
A 1 170 GLN 170 193 193 GLN GLN A . n 
A 1 171 TYR 171 194 194 TYR TYR A . n 
A 1 172 PRO 172 195 195 PRO PRO A . n 
A 1 173 SER 173 196 196 SER SER A . n 
A 1 174 ILE 174 197 197 ILE ILE A . n 
A 1 175 LEU 175 198 198 LEU LEU A . n 
A 1 176 VAL 176 199 199 VAL VAL A . n 
A 1 177 GLU 177 200 200 GLU GLU A . n 
A 1 178 LEU 178 201 201 LEU LEU A . n 
A 1 179 GLY 179 202 202 GLY GLY A . n 
A 1 180 ASN 180 203 203 ASN ASN A . n 
A 1 181 MET 181 204 204 MET MET A . n 
A 1 182 LYS 182 205 205 LYS LYS A . n 
A 1 183 ASN 183 206 206 ASN ASN A . n 
A 1 184 PRO 184 207 207 PRO PRO A . n 
A 1 185 ALA 185 208 208 ALA ALA A . n 
A 1 186 ASP 186 209 209 ASP ASP A . n 
A 1 187 SER 187 210 210 SER SER A . n 
A 1 188 ALA 188 211 211 ALA ALA A . n 
A 1 189 LEU 189 212 212 LEU LEU A . n 
A 1 190 MET 190 213 213 MET MET A . n 
A 1 191 GLU 191 214 214 GLU GLU A . n 
A 1 192 SER 192 215 215 SER SER A . n 
A 1 193 ALA 193 216 216 ALA ALA A . n 
A 1 194 GLU 194 217 217 GLU GLU A . n 
A 1 195 GLY 195 218 218 GLY GLY A . n 
A 1 196 ARG 196 219 219 ARG ARG A . n 
A 1 197 GLN 197 220 220 GLN GLN A . n 
A 1 198 LYS 198 221 221 LYS LYS A . n 
A 1 199 TYR 199 222 222 TYR TYR A . n 
A 1 200 ALA 200 223 223 ALA ALA A . n 
A 1 201 ASN 201 224 224 ASN ASN A . n 
A 1 202 ALA 202 225 225 ALA ALA A . n 
A 1 203 LEU 203 226 226 LEU LEU A . n 
A 1 204 VAL 204 227 227 VAL VAL A . n 
A 1 205 ARG 205 228 228 ARG ARG A . n 
A 1 206 GLY 206 229 229 GLY GLY A . n 
A 1 207 VAL 207 230 230 VAL VAL A . n 
A 1 208 ALA 208 231 231 ALA ALA A . n 
A 1 209 GLY 209 232 232 GLY GLY A . n 
A 1 210 PHE 210 233 233 PHE PHE A . n 
A 1 211 LEU 211 234 234 LEU LEU A . n 
A 1 212 ALA 212 235 235 ALA ALA A . n 
A 1 213 THR 213 236 236 THR THR A . n 
A 1 214 GLN 214 237 237 GLN GLN A . n 
A 1 215 GLY 215 238 ?   ?   ?   A . n 
A 1 216 GLN 216 239 ?   ?   ?   A . n 
A 1 217 ALA 217 240 ?   ?   ?   A . n 
A 1 218 ARG 218 241 ?   ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        A1A0I 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   A1A0I 
_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 A1A0I 1   301 301 A1A0I UNL A . 
C 3 ZN    1   302 1   ZN    ZN  A . 
D 4 HOH   1   401 40  HOH   HOH A . 
D 4 HOH   2   402 110 HOH   HOH A . 
D 4 HOH   3   403 154 HOH   HOH A . 
D 4 HOH   4   404 117 HOH   HOH A . 
D 4 HOH   5   405 78  HOH   HOH A . 
D 4 HOH   6   406 104 HOH   HOH A . 
D 4 HOH   7   407 92  HOH   HOH A . 
D 4 HOH   8   408 45  HOH   HOH A . 
D 4 HOH   9   409 7   HOH   HOH A . 
D 4 HOH   10  410 99  HOH   HOH A . 
D 4 HOH   11  411 131 HOH   HOH A . 
D 4 HOH   12  412 55  HOH   HOH A . 
D 4 HOH   13  413 160 HOH   HOH A . 
D 4 HOH   14  414 74  HOH   HOH A . 
D 4 HOH   15  415 12  HOH   HOH A . 
D 4 HOH   16  416 85  HOH   HOH A . 
D 4 HOH   17  417 13  HOH   HOH A . 
D 4 HOH   18  418 49  HOH   HOH A . 
D 4 HOH   19  419 42  HOH   HOH A . 
D 4 HOH   20  420 158 HOH   HOH A . 
D 4 HOH   21  421 22  HOH   HOH A . 
D 4 HOH   22  422 80  HOH   HOH A . 
D 4 HOH   23  423 105 HOH   HOH A . 
D 4 HOH   24  424 97  HOH   HOH A . 
D 4 HOH   25  425 52  HOH   HOH A . 
D 4 HOH   26  426 94  HOH   HOH A . 
D 4 HOH   27  427 10  HOH   HOH A . 
D 4 HOH   28  428 109 HOH   HOH A . 
D 4 HOH   29  429 71  HOH   HOH A . 
D 4 HOH   30  430 88  HOH   HOH A . 
D 4 HOH   31  431 50  HOH   HOH A . 
D 4 HOH   32  432 39  HOH   HOH A . 
D 4 HOH   33  433 20  HOH   HOH A . 
D 4 HOH   34  434 134 HOH   HOH A . 
D 4 HOH   35  435 113 HOH   HOH A . 
D 4 HOH   36  436 37  HOH   HOH A . 
D 4 HOH   37  437 58  HOH   HOH A . 
D 4 HOH   38  438 3   HOH   HOH A . 
D 4 HOH   39  439 98  HOH   HOH A . 
D 4 HOH   40  440 4   HOH   HOH A . 
D 4 HOH   41  441 15  HOH   HOH A . 
D 4 HOH   42  442 16  HOH   HOH A . 
D 4 HOH   43  443 64  HOH   HOH A . 
D 4 HOH   44  444 77  HOH   HOH A . 
D 4 HOH   45  445 107 HOH   HOH A . 
D 4 HOH   46  446 17  HOH   HOH A . 
D 4 HOH   47  447 27  HOH   HOH A . 
D 4 HOH   48  448 159 HOH   HOH A . 
D 4 HOH   49  449 63  HOH   HOH A . 
D 4 HOH   50  450 95  HOH   HOH A . 
D 4 HOH   51  451 25  HOH   HOH A . 
D 4 HOH   52  452 11  HOH   HOH A . 
D 4 HOH   53  453 53  HOH   HOH A . 
D 4 HOH   54  454 14  HOH   HOH A . 
D 4 HOH   55  455 19  HOH   HOH A . 
D 4 HOH   56  456 69  HOH   HOH A . 
D 4 HOH   57  457 34  HOH   HOH A . 
D 4 HOH   58  458 119 HOH   HOH A . 
D 4 HOH   59  459 121 HOH   HOH A . 
D 4 HOH   60  460 108 HOH   HOH A . 
D 4 HOH   61  461 51  HOH   HOH A . 
D 4 HOH   62  462 133 HOH   HOH A . 
D 4 HOH   63  463 81  HOH   HOH A . 
D 4 HOH   64  464 41  HOH   HOH A . 
D 4 HOH   65  465 44  HOH   HOH A . 
D 4 HOH   66  466 43  HOH   HOH A . 
D 4 HOH   67  467 162 HOH   HOH A . 
D 4 HOH   68  468 91  HOH   HOH A . 
D 4 HOH   69  469 8   HOH   HOH A . 
D 4 HOH   70  470 38  HOH   HOH A . 
D 4 HOH   71  471 47  HOH   HOH A . 
D 4 HOH   72  472 33  HOH   HOH A . 
D 4 HOH   73  473 18  HOH   HOH A . 
D 4 HOH   74  474 5   HOH   HOH A . 
D 4 HOH   75  475 36  HOH   HOH A . 
D 4 HOH   76  476 72  HOH   HOH A . 
D 4 HOH   77  477 89  HOH   HOH A . 
D 4 HOH   78  478 26  HOH   HOH A . 
D 4 HOH   79  479 1   HOH   HOH A . 
D 4 HOH   80  480 96  HOH   HOH A . 
D 4 HOH   81  481 125 HOH   HOH A . 
D 4 HOH   82  482 86  HOH   HOH A . 
D 4 HOH   83  483 70  HOH   HOH A . 
D 4 HOH   84  484 87  HOH   HOH A . 
D 4 HOH   85  485 21  HOH   HOH A . 
D 4 HOH   86  486 142 HOH   HOH A . 
D 4 HOH   87  487 156 HOH   HOH A . 
D 4 HOH   88  488 32  HOH   HOH A . 
D 4 HOH   89  489 100 HOH   HOH A . 
D 4 HOH   90  490 57  HOH   HOH A . 
D 4 HOH   91  491 24  HOH   HOH A . 
D 4 HOH   92  492 83  HOH   HOH A . 
D 4 HOH   93  493 62  HOH   HOH A . 
D 4 HOH   94  494 115 HOH   HOH A . 
D 4 HOH   95  495 106 HOH   HOH A . 
D 4 HOH   96  496 148 HOH   HOH A . 
D 4 HOH   97  497 68  HOH   HOH A . 
D 4 HOH   98  498 61  HOH   HOH A . 
D 4 HOH   99  499 127 HOH   HOH A . 
D 4 HOH   100 500 35  HOH   HOH A . 
D 4 HOH   101 501 31  HOH   HOH A . 
D 4 HOH   102 502 137 HOH   HOH A . 
D 4 HOH   103 503 28  HOH   HOH A . 
D 4 HOH   104 504 23  HOH   HOH A . 
D 4 HOH   105 505 101 HOH   HOH A . 
D 4 HOH   106 506 161 HOH   HOH A . 
D 4 HOH   107 507 144 HOH   HOH A . 
D 4 HOH   108 508 29  HOH   HOH A . 
D 4 HOH   109 509 65  HOH   HOH A . 
D 4 HOH   110 510 59  HOH   HOH A . 
D 4 HOH   111 511 122 HOH   HOH A . 
D 4 HOH   112 512 56  HOH   HOH A . 
D 4 HOH   113 513 60  HOH   HOH A . 
D 4 HOH   114 514 66  HOH   HOH A . 
D 4 HOH   115 515 124 HOH   HOH A . 
D 4 HOH   116 516 123 HOH   HOH A . 
D 4 HOH   117 517 151 HOH   HOH A . 
D 4 HOH   118 518 67  HOH   HOH A . 
D 4 HOH   119 519 82  HOH   HOH A . 
D 4 HOH   120 520 6   HOH   HOH A . 
D 4 HOH   121 521 153 HOH   HOH A . 
D 4 HOH   122 522 46  HOH   HOH A . 
D 4 HOH   123 523 120 HOH   HOH A . 
D 4 HOH   124 524 75  HOH   HOH A . 
D 4 HOH   125 525 130 HOH   HOH A . 
D 4 HOH   126 526 9   HOH   HOH A . 
D 4 HOH   127 527 135 HOH   HOH A . 
D 4 HOH   128 528 30  HOH   HOH A . 
D 4 HOH   129 529 48  HOH   HOH A . 
D 4 HOH   130 530 155 HOH   HOH A . 
D 4 HOH   131 531 149 HOH   HOH A . 
D 4 HOH   132 532 76  HOH   HOH A . 
D 4 HOH   133 533 54  HOH   HOH A . 
D 4 HOH   134 534 73  HOH   HOH A . 
D 4 HOH   135 535 126 HOH   HOH A . 
D 4 HOH   136 536 141 HOH   HOH A . 
D 4 HOH   137 537 103 HOH   HOH A . 
D 4 HOH   138 538 102 HOH   HOH A . 
D 4 HOH   139 539 139 HOH   HOH A . 
D 4 HOH   140 540 114 HOH   HOH A . 
D 4 HOH   141 541 147 HOH   HOH A . 
D 4 HOH   142 542 132 HOH   HOH A . 
D 4 HOH   143 543 93  HOH   HOH A . 
D 4 HOH   144 544 79  HOH   HOH A . 
D 4 HOH   145 545 143 HOH   HOH A . 
D 4 HOH   146 546 84  HOH   HOH A . 
D 4 HOH   147 547 140 HOH   HOH A . 
D 4 HOH   148 548 116 HOH   HOH A . 
D 4 HOH   149 549 152 HOH   HOH A . 
D 4 HOH   150 550 128 HOH   HOH A . 
D 4 HOH   151 551 118 HOH   HOH A . 
D 4 HOH   152 552 111 HOH   HOH A . 
D 4 HOH   153 553 150 HOH   HOH A . 
D 4 HOH   154 554 129 HOH   HOH A . 
D 4 HOH   155 555 136 HOH   HOH A . 
D 4 HOH   156 556 90  HOH   HOH A . 
D 4 HOH   157 557 157 HOH   HOH A . 
D 4 HOH   158 558 145 HOH   HOH A . 
D 4 HOH   159 559 112 HOH   HOH A . 
D 4 HOH   160 560 138 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  ? ? ? 1.20.1_4487 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS     ? ? ? .           2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? .           3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? REFMAC  ? ? ? .           4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9CUN 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     37.353 
_cell.length_a_esd                 ? 
_cell.length_b                     103.960 
_cell.length_b_esd                 ? 
_cell.length_c                     130.143 
_cell.length_c_esd                 ? 
_cell.volume                       505373.625 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9CUN 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                24 
_symmetry.space_group_name_Hall            'I 2b 2c' 
_symmetry.space_group_name_H-M             'I 21 21 21' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9CUN 
_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             2.86 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          56.92 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              7.5 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    
;Ammonium sulphate
Sodium chloride
HEPES
;
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            291.15 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS3 6M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-10-27 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97918 
_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                        'ALBA BEAMLINE XALOC' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.97918 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   XALOC 
_diffrn_source.pdbx_synchrotron_site       ALBA 
# 
_reflns.B_iso_Wilson_estimate                          13.49 
_reflns.entry_id                                       9CUN 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.45 
_reflns.d_resolution_low                               40.04 
_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                                     44854 
_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                           99 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                5.3 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          16.6 
_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                                ? 
_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                                    1.45 
_reflns_shell.d_res_low                                     1.47 
_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                             2182 
_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                                  0.907 
_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                               15.81 
_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                                 9CUN 
_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                            1.45 
_refine.ls_d_res_low                             40.04 
_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                     44849 
_refine.ls_number_reflns_R_free                  2267 
_refine.ls_number_reflns_R_work                  42582 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    98.57 
_refine.ls_percent_reflns_R_free                 5.05 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1808 
_refine.ls_R_factor_R_free                       0.2001 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1798 
_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                          1.34 
_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                 17.4353 
_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                            0.1357 
_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                       1.45 
_refine_hist.d_res_low                        40.04 
_refine_hist.number_atoms_solvent             160 
_refine_hist.number_atoms_total               1725 
_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        1552 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         13 
_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' ? 0.0062 ? 1625 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.8870 ? 2210 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0734 ? 238  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0105 ? 305  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 6.9555 ? 241  ? 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' 1.45 1.48  . . 122 2603 97.88 . . . . 0.2032 . . . . . . . . . . . 0.2583 
'X-RAY DIFFRACTION' 1.48 1.52  . . 164 2599 98.19 . . . . 0.1889 . . . . . . . . . . . 0.2148 
'X-RAY DIFFRACTION' 1.52 1.55  . . 144 2616 97.80 . . . . 0.1835 . . . . . . . . . . . 0.2131 
'X-RAY DIFFRACTION' 1.55 1.60  . . 158 2592 98.60 . . . . 0.1794 . . . . . . . . . . . 0.1997 
'X-RAY DIFFRACTION' 1.60 1.64  . . 113 2669 98.51 . . . . 0.1769 . . . . . . . . . . . 0.1997 
'X-RAY DIFFRACTION' 1.64 1.70  . . 142 2640 98.86 . . . . 0.1875 . . . . . . . . . . . 0.2410 
'X-RAY DIFFRACTION' 1.70 1.76  . . 129 2642 98.54 . . . . 0.1888 . . . . . . . . . . . 0.2291 
'X-RAY DIFFRACTION' 1.76 1.83  . . 158 2628 99.00 . . . . 0.1761 . . . . . . . . . . . 0.2154 
'X-RAY DIFFRACTION' 1.83 1.91  . . 120 2662 98.76 . . . . 0.1756 . . . . . . . . . . . 0.1907 
'X-RAY DIFFRACTION' 1.91 2.01  . . 141 2672 99.29 . . . . 0.1657 . . . . . . . . . . . 0.1835 
'X-RAY DIFFRACTION' 2.01 2.14  . . 146 2687 99.40 . . . . 0.1699 . . . . . . . . . . . 0.1789 
'X-RAY DIFFRACTION' 2.14 2.30  . . 147 2670 99.37 . . . . 0.1618 . . . . . . . . . . . 0.1497 
'X-RAY DIFFRACTION' 2.30 2.53  . . 147 2690 99.33 . . . . 0.1790 . . . . . . . . . . . 0.1742 
'X-RAY DIFFRACTION' 2.53 2.90  . . 144 2706 98.96 . . . . 0.1989 . . . . . . . . . . . 0.2203 
'X-RAY DIFFRACTION' 2.90 3.65  . . 150 2700 98.17 . . . . 0.1928 . . . . . . . . . . . 0.2053 
'X-RAY DIFFRACTION' 3.65 40.04 . . 142 2806 96.66 . . . . 0.1701 . . . . . . . . . . . 0.2124 
# 
_struct.entry_id                     9CUN 
_struct.title                        'Crystal structure of Ami1 from M. tuberculosis in complex with a tetrazole compound' 
_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        9CUN 
_struct_keywords.text            'amidase, peptidoglycan hydrolase, HYDROLASE' 
_struct_keywords.pdbx_keywords   HYDROLASE 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 4 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    PEPAM_MYCTU 
_struct_ref.pdbx_db_accession          I6Y4D2 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;AGMVVFIDPGHNGANDASIGRQVPTGRGGTKNCQASGTSTNSGYPEHTFTWETGLRLRAALNALGVRTALSRGNDNALGP
CVDERANMANALRPNAIVSLHADGGPASGRGFHVNYSAPPLNAIQAGPSVQFARIMRDQLQASGIPKANYIGQDGLYGRS
DLAGLNLAQYPSILVELGNMKNPADSALMESAEGRQKYANALVRGVAGFLATQGQAR
;
_struct_ref.pdbx_align_begin           25 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9CUN 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 2 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 218 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             I6Y4D2 
_struct_ref_seq.db_align_beg                  25 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  241 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       25 
_struct_ref_seq.pdbx_auth_seq_align_end       241 
# 
_struct_ref_seq_dif.align_id                     1 
_struct_ref_seq_dif.pdbx_pdb_id_code             9CUN 
_struct_ref_seq_dif.mon_id                       SER 
_struct_ref_seq_dif.pdbx_pdb_strand_id           A 
_struct_ref_seq_dif.seq_num                      1 
_struct_ref_seq_dif.pdbx_pdb_ins_code            ? 
_struct_ref_seq_dif.pdbx_seq_db_name             UNP 
_struct_ref_seq_dif.pdbx_seq_db_accession_code   I6Y4D2 
_struct_ref_seq_dif.db_mon_id                    ? 
_struct_ref_seq_dif.pdbx_seq_db_seq_num          ? 
_struct_ref_seq_dif.details                      'expression tag' 
_struct_ref_seq_dif.pdbx_auth_seq_num            24 
_struct_ref_seq_dif.pdbx_ordinal                 1 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0 
_pdbx_struct_oper_list.matrix[1][2]         0.0 
_pdbx_struct_oper_list.matrix[1][3]         0.0 
_pdbx_struct_oper_list.vector[1]            0.0 
_pdbx_struct_oper_list.matrix[2][1]         0.0 
_pdbx_struct_oper_list.matrix[2][2]         1.0 
_pdbx_struct_oper_list.matrix[2][3]         0.0 
_pdbx_struct_oper_list.vector[2]            0.0 
_pdbx_struct_oper_list.matrix[3][1]         0.0 
_pdbx_struct_oper_list.matrix[3][2]         0.0 
_pdbx_struct_oper_list.matrix[3][3]         1.0 
_pdbx_struct_oper_list.vector[3]            0.0 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 ASP A 17  ? GLY A 21  ? ASP A 40  GLY A 44  5 ? 5  
HELX_P HELX_P2 AA2 PRO A 46  ? LEU A 65  ? PRO A 69  LEU A 88  1 ? 20 
HELX_P HELX_P3 AA3 CYS A 82  ? ARG A 94  ? CYS A 105 ARG A 117 1 ? 13 
HELX_P HELX_P4 AA4 ASN A 123 ? GLY A 128 ? ASN A 146 GLY A 151 1 ? 6  
HELX_P HELX_P5 AA5 GLY A 128 ? SER A 144 ? GLY A 151 SER A 167 1 ? 17 
HELX_P HELX_P6 AA6 LEU A 163 ? LEU A 168 ? LEU A 186 LEU A 191 1 ? 6  
HELX_P HELX_P7 AA7 ASN A 183 ? GLU A 191 ? ASN A 206 GLU A 214 1 ? 9  
HELX_P HELX_P8 AA8 SER A 192 ? GLN A 214 ? SER A 215 GLN A 237 1 ? 23 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1 disulf ? ? A CYS 34  SG  ? ? ? 1_555 A CYS 82 SG ? ? A CYS 57  A CYS 105 1_555 ? ? ? ? ? ? ? 2.020 ? ? 
metalc1 metalc ? ? A HIS 12  NE2 ? ? ? 1_555 C ZN  .  ZN ? ? A HIS 35  A ZN  302 1_555 ? ? ? ? ? ? ? 2.119 ? ? 
metalc2 metalc ? ? A GLU 47  OE2 ? ? ? 1_555 C ZN  .  ZN ? ? A GLU 70  A ZN  302 1_555 ? ? ? ? ? ? ? 2.080 ? ? 
metalc3 metalc ? ? A HIS 102 ND1 ? ? ? 1_555 C ZN  .  ZN ? ? A HIS 125 A ZN  302 1_555 ? ? ? ? ? ? ? 2.177 ? ? 
metalc4 metalc ? ? C ZN  .   ZN  ? ? ? 1_555 D HOH .  O  ? ? A ZN  302 A HOH 401 1_555 ? ? ? ? ? ? ? 2.287 ? ? 
metalc5 metalc ? ? C ZN  .   ZN  ? ? ? 1_555 D HOH .  O  ? ? A ZN  302 A HOH 409 1_555 ? ? ? ? ? ? ? 2.025 ? ? 
metalc6 metalc ? ? C ZN  .   ZN  ? ? ? 1_555 D HOH .  O  ? ? A ZN  302 A HOH 522 1_555 ? ? ? ? ? ? ? 2.212 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
metalc ? ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  NE2 ? A HIS 12  ? A HIS 35  ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 OE2 ? A GLU 47  ? A GLU 70  ? 1_555 89.0  ? 
2  NE2 ? A HIS 12  ? A HIS 35  ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 ND1 ? A HIS 102 ? A HIS 125 ? 1_555 96.1  ? 
3  OE2 ? A GLU 47  ? A GLU 70  ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 ND1 ? A HIS 102 ? A HIS 125 ? 1_555 97.6  ? 
4  NE2 ? A HIS 12  ? A HIS 35  ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 401 ? 1_555 84.9  ? 
5  OE2 ? A GLU 47  ? A GLU 70  ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 401 ? 1_555 93.1  ? 
6  ND1 ? A HIS 102 ? A HIS 125 ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 401 ? 1_555 169.2 ? 
7  NE2 ? A HIS 12  ? A HIS 35  ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 409 ? 1_555 161.1 ? 
8  OE2 ? A GLU 47  ? A GLU 70  ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 409 ? 1_555 88.7  ? 
9  ND1 ? A HIS 102 ? A HIS 125 ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 409 ? 1_555 102.7 ? 
10 O   ? D HOH .   ? A HOH 401 ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 409 ? 1_555 76.5  ? 
11 NE2 ? A HIS 12  ? A HIS 35  ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 522 ? 1_555 90.7  ? 
12 OE2 ? A GLU 47  ? A GLU 70  ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 522 ? 1_555 169.2 ? 
13 ND1 ? A HIS 102 ? A HIS 125 ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 522 ? 1_555 93.1  ? 
14 O   ? D HOH .   ? A HOH 401 ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 522 ? 1_555 76.1  ? 
15 O   ? D HOH .   ? A HOH 409 ? 1_555 ZN ? C ZN . ? A ZN 302 ? 1_555 O   ? D HOH .   ? A HOH 522 ? 1_555 88.1  ? 
# 
_pdbx_modification_feature.ordinal                            1 
_pdbx_modification_feature.label_comp_id                      CYS 
_pdbx_modification_feature.label_asym_id                      A 
_pdbx_modification_feature.label_seq_id                       34 
_pdbx_modification_feature.label_alt_id                       ? 
_pdbx_modification_feature.modified_residue_label_comp_id     CYS 
_pdbx_modification_feature.modified_residue_label_asym_id     A 
_pdbx_modification_feature.modified_residue_label_seq_id      82 
_pdbx_modification_feature.modified_residue_label_alt_id      ? 
_pdbx_modification_feature.auth_comp_id                       CYS 
_pdbx_modification_feature.auth_asym_id                       A 
_pdbx_modification_feature.auth_seq_id                        57 
_pdbx_modification_feature.PDB_ins_code                       ? 
_pdbx_modification_feature.symmetry                           1_555 
_pdbx_modification_feature.modified_residue_auth_comp_id      CYS 
_pdbx_modification_feature.modified_residue_auth_asym_id      A 
_pdbx_modification_feature.modified_residue_auth_seq_id       105 
_pdbx_modification_feature.modified_residue_PDB_ins_code      ? 
_pdbx_modification_feature.modified_residue_symmetry          1_555 
_pdbx_modification_feature.comp_id_linking_atom               SG 
_pdbx_modification_feature.modified_residue_id_linking_atom   SG 
_pdbx_modification_feature.modified_residue_id                . 
_pdbx_modification_feature.ref_pcm_id                         . 
_pdbx_modification_feature.ref_comp_id                        . 
_pdbx_modification_feature.type                               None 
_pdbx_modification_feature.category                           'Disulfide bridge' 
# 
_struct_mon_prot_cis.pdbx_id                1 
_struct_mon_prot_cis.label_comp_id          ALA 
_struct_mon_prot_cis.label_seq_id           119 
_struct_mon_prot_cis.label_asym_id          A 
_struct_mon_prot_cis.label_alt_id           . 
_struct_mon_prot_cis.pdbx_PDB_ins_code      ? 
_struct_mon_prot_cis.auth_comp_id           ALA 
_struct_mon_prot_cis.auth_seq_id            142 
_struct_mon_prot_cis.auth_asym_id           A 
_struct_mon_prot_cis.pdbx_label_comp_id_2   PRO 
_struct_mon_prot_cis.pdbx_label_seq_id_2    120 
_struct_mon_prot_cis.pdbx_label_asym_id_2   A 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2    ? 
_struct_mon_prot_cis.pdbx_auth_comp_id_2    PRO 
_struct_mon_prot_cis.pdbx_auth_seq_id_2     143 
_struct_mon_prot_cis.pdbx_auth_asym_id_2    A 
_struct_mon_prot_cis.pdbx_PDB_model_num     1 
_struct_mon_prot_cis.pdbx_omega_angle       -5.75 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 6 ? 
AA2 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? parallel      
AA1 2 3 ? parallel      
AA1 3 4 ? parallel      
AA1 4 5 ? anti-parallel 
AA1 5 6 ? parallel      
AA2 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 ARG A 68  ? LEU A 71  ? ARG A 91  LEU A 94  
AA1 2 VAL A 5   ? PRO A 10  ? VAL A 28  PRO A 33  
AA1 3 ALA A 97  ? ASP A 104 ? ALA A 120 ASP A 127 
AA1 4 SER A 173 ? ASN A 180 ? SER A 196 ASN A 203 
AA1 5 HIS A 114 ? SER A 118 ? HIS A 137 SER A 141 
AA1 6 LEU A 157 ? ARG A 160 ? LEU A 180 ARG A 183 
AA2 1 GLN A 23  ? PRO A 25  ? GLN A 46  PRO A 48  
AA2 2 THR A 31  ? ASN A 33  ? THR A 54  ASN A 56  
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 O ALA A 70  ? O ALA A 93  N ILE A 8   ? N ILE A 31  
AA1 2 3 N ASP A 9   ? N ASP A 32  O VAL A 99  ? O VAL A 122 
AA1 3 4 N ASP A 104 ? N ASP A 127 O GLY A 179 ? O GLY A 202 
AA1 4 5 O LEU A 175 ? O LEU A 198 N ASN A 116 ? N ASN A 139 
AA1 5 6 N TYR A 117 ? N TYR A 140 O ARG A 160 ? O ARG A 183 
AA2 1 2 N VAL A 24  ? N VAL A 47  O LYS A 32  ? O LYS A 55  
# 
_pdbx_entry_details.entry_id                   9CUN 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 HIS A 35  ? ? 76.89   -179.78 
2 1 THR A 62  ? ? -106.19 -163.60 
3 1 ASN A 100 ? ? -144.45 11.83   
# 
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 SER 24  ? A SER 1   
2 1 Y 1 A ALA 25  ? A ALA 2   
3 1 Y 1 A GLY 238 ? A GLY 215 
4 1 Y 1 A GLN 239 ? A GLN 216 
5 1 Y 1 A ALA 240 ? A ALA 217 
6 1 Y 1 A ARG 241 ? A ARG 218 
# 
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 
A1A0I C10  C  Y N 1   
A1A0I I01  I  N N 2   
A1A0I C02  C  Y N 3   
A1A0I C03  C  Y N 4   
A1A0I C04  C  Y N 5   
A1A0I N05  N  Y N 6   
A1A0I N06  N  Y N 7   
A1A0I N07  N  Y N 8   
A1A0I N08  N  Y N 9   
A1A0I C09  C  Y N 10  
A1A0I C11  C  Y N 11  
A1A0I C12  C  Y N 12  
A1A0I H101 H  N N 13  
A1A0I H061 H  N N 14  
A1A0I H091 H  N N 15  
A1A0I H111 H  N N 16  
A1A0I H121 H  N N 17  
ALA   N    N  N N 18  
ALA   CA   C  N S 19  
ALA   C    C  N N 20  
ALA   O    O  N N 21  
ALA   CB   C  N N 22  
ALA   OXT  O  N N 23  
ALA   H    H  N N 24  
ALA   H2   H  N N 25  
ALA   HA   H  N N 26  
ALA   HB1  H  N N 27  
ALA   HB2  H  N N 28  
ALA   HB3  H  N N 29  
ALA   HXT  H  N N 30  
ARG   N    N  N N 31  
ARG   CA   C  N S 32  
ARG   C    C  N N 33  
ARG   O    O  N N 34  
ARG   CB   C  N N 35  
ARG   CG   C  N N 36  
ARG   CD   C  N N 37  
ARG   NE   N  N N 38  
ARG   CZ   C  N N 39  
ARG   NH1  N  N N 40  
ARG   NH2  N  N N 41  
ARG   OXT  O  N N 42  
ARG   H    H  N N 43  
ARG   H2   H  N N 44  
ARG   HA   H  N N 45  
ARG   HB2  H  N N 46  
ARG   HB3  H  N N 47  
ARG   HG2  H  N N 48  
ARG   HG3  H  N N 49  
ARG   HD2  H  N N 50  
ARG   HD3  H  N N 51  
ARG   HE   H  N N 52  
ARG   HH11 H  N N 53  
ARG   HH12 H  N N 54  
ARG   HH21 H  N N 55  
ARG   HH22 H  N N 56  
ARG   HXT  H  N N 57  
ASN   N    N  N N 58  
ASN   CA   C  N S 59  
ASN   C    C  N N 60  
ASN   O    O  N N 61  
ASN   CB   C  N N 62  
ASN   CG   C  N N 63  
ASN   OD1  O  N N 64  
ASN   ND2  N  N N 65  
ASN   OXT  O  N N 66  
ASN   H    H  N N 67  
ASN   H2   H  N N 68  
ASN   HA   H  N N 69  
ASN   HB2  H  N N 70  
ASN   HB3  H  N N 71  
ASN   HD21 H  N N 72  
ASN   HD22 H  N N 73  
ASN   HXT  H  N N 74  
ASP   N    N  N N 75  
ASP   CA   C  N S 76  
ASP   C    C  N N 77  
ASP   O    O  N N 78  
ASP   CB   C  N N 79  
ASP   CG   C  N N 80  
ASP   OD1  O  N N 81  
ASP   OD2  O  N N 82  
ASP   OXT  O  N N 83  
ASP   H    H  N N 84  
ASP   H2   H  N N 85  
ASP   HA   H  N N 86  
ASP   HB2  H  N N 87  
ASP   HB3  H  N N 88  
ASP   HD2  H  N N 89  
ASP   HXT  H  N N 90  
CYS   N    N  N N 91  
CYS   CA   C  N R 92  
CYS   C    C  N N 93  
CYS   O    O  N N 94  
CYS   CB   C  N N 95  
CYS   SG   S  N N 96  
CYS   OXT  O  N N 97  
CYS   H    H  N N 98  
CYS   H2   H  N N 99  
CYS   HA   H  N N 100 
CYS   HB2  H  N N 101 
CYS   HB3  H  N N 102 
CYS   HG   H  N N 103 
CYS   HXT  H  N N 104 
GLN   N    N  N N 105 
GLN   CA   C  N S 106 
GLN   C    C  N N 107 
GLN   O    O  N N 108 
GLN   CB   C  N N 109 
GLN   CG   C  N N 110 
GLN   CD   C  N N 111 
GLN   OE1  O  N N 112 
GLN   NE2  N  N N 113 
GLN   OXT  O  N N 114 
GLN   H    H  N N 115 
GLN   H2   H  N N 116 
GLN   HA   H  N N 117 
GLN   HB2  H  N N 118 
GLN   HB3  H  N N 119 
GLN   HG2  H  N N 120 
GLN   HG3  H  N N 121 
GLN   HE21 H  N N 122 
GLN   HE22 H  N N 123 
GLN   HXT  H  N N 124 
GLU   N    N  N N 125 
GLU   CA   C  N S 126 
GLU   C    C  N N 127 
GLU   O    O  N N 128 
GLU   CB   C  N N 129 
GLU   CG   C  N N 130 
GLU   CD   C  N N 131 
GLU   OE1  O  N N 132 
GLU   OE2  O  N N 133 
GLU   OXT  O  N N 134 
GLU   H    H  N N 135 
GLU   H2   H  N N 136 
GLU   HA   H  N N 137 
GLU   HB2  H  N N 138 
GLU   HB3  H  N N 139 
GLU   HG2  H  N N 140 
GLU   HG3  H  N N 141 
GLU   HE2  H  N N 142 
GLU   HXT  H  N N 143 
GLY   N    N  N N 144 
GLY   CA   C  N N 145 
GLY   C    C  N N 146 
GLY   O    O  N N 147 
GLY   OXT  O  N N 148 
GLY   H    H  N N 149 
GLY   H2   H  N N 150 
GLY   HA2  H  N N 151 
GLY   HA3  H  N N 152 
GLY   HXT  H  N N 153 
HIS   N    N  N N 154 
HIS   CA   C  N S 155 
HIS   C    C  N N 156 
HIS   O    O  N N 157 
HIS   CB   C  N N 158 
HIS   CG   C  Y N 159 
HIS   ND1  N  Y N 160 
HIS   CD2  C  Y N 161 
HIS   CE1  C  Y N 162 
HIS   NE2  N  Y N 163 
HIS   OXT  O  N N 164 
HIS   H    H  N N 165 
HIS   H2   H  N N 166 
HIS   HA   H  N N 167 
HIS   HB2  H  N N 168 
HIS   HB3  H  N N 169 
HIS   HD1  H  N N 170 
HIS   HD2  H  N N 171 
HIS   HE1  H  N N 172 
HIS   HE2  H  N N 173 
HIS   HXT  H  N N 174 
HOH   O    O  N N 175 
HOH   H1   H  N N 176 
HOH   H2   H  N N 177 
ILE   N    N  N N 178 
ILE   CA   C  N S 179 
ILE   C    C  N N 180 
ILE   O    O  N N 181 
ILE   CB   C  N S 182 
ILE   CG1  C  N N 183 
ILE   CG2  C  N N 184 
ILE   CD1  C  N N 185 
ILE   OXT  O  N N 186 
ILE   H    H  N N 187 
ILE   H2   H  N N 188 
ILE   HA   H  N N 189 
ILE   HB   H  N N 190 
ILE   HG12 H  N N 191 
ILE   HG13 H  N N 192 
ILE   HG21 H  N N 193 
ILE   HG22 H  N N 194 
ILE   HG23 H  N N 195 
ILE   HD11 H  N N 196 
ILE   HD12 H  N N 197 
ILE   HD13 H  N N 198 
ILE   HXT  H  N N 199 
LEU   N    N  N N 200 
LEU   CA   C  N S 201 
LEU   C    C  N N 202 
LEU   O    O  N N 203 
LEU   CB   C  N N 204 
LEU   CG   C  N N 205 
LEU   CD1  C  N N 206 
LEU   CD2  C  N N 207 
LEU   OXT  O  N N 208 
LEU   H    H  N N 209 
LEU   H2   H  N N 210 
LEU   HA   H  N N 211 
LEU   HB2  H  N N 212 
LEU   HB3  H  N N 213 
LEU   HG   H  N N 214 
LEU   HD11 H  N N 215 
LEU   HD12 H  N N 216 
LEU   HD13 H  N N 217 
LEU   HD21 H  N N 218 
LEU   HD22 H  N N 219 
LEU   HD23 H  N N 220 
LEU   HXT  H  N N 221 
LYS   N    N  N N 222 
LYS   CA   C  N S 223 
LYS   C    C  N N 224 
LYS   O    O  N N 225 
LYS   CB   C  N N 226 
LYS   CG   C  N N 227 
LYS   CD   C  N N 228 
LYS   CE   C  N N 229 
LYS   NZ   N  N N 230 
LYS   OXT  O  N N 231 
LYS   H    H  N N 232 
LYS   H2   H  N N 233 
LYS   HA   H  N N 234 
LYS   HB2  H  N N 235 
LYS   HB3  H  N N 236 
LYS   HG2  H  N N 237 
LYS   HG3  H  N N 238 
LYS   HD2  H  N N 239 
LYS   HD3  H  N N 240 
LYS   HE2  H  N N 241 
LYS   HE3  H  N N 242 
LYS   HZ1  H  N N 243 
LYS   HZ2  H  N N 244 
LYS   HZ3  H  N N 245 
LYS   HXT  H  N N 246 
MET   N    N  N N 247 
MET   CA   C  N S 248 
MET   C    C  N N 249 
MET   O    O  N N 250 
MET   CB   C  N N 251 
MET   CG   C  N N 252 
MET   SD   S  N N 253 
MET   CE   C  N N 254 
MET   OXT  O  N N 255 
MET   H    H  N N 256 
MET   H2   H  N N 257 
MET   HA   H  N N 258 
MET   HB2  H  N N 259 
MET   HB3  H  N N 260 
MET   HG2  H  N N 261 
MET   HG3  H  N N 262 
MET   HE1  H  N N 263 
MET   HE2  H  N N 264 
MET   HE3  H  N N 265 
MET   HXT  H  N N 266 
PHE   N    N  N N 267 
PHE   CA   C  N S 268 
PHE   C    C  N N 269 
PHE   O    O  N N 270 
PHE   CB   C  N N 271 
PHE   CG   C  Y N 272 
PHE   CD1  C  Y N 273 
PHE   CD2  C  Y N 274 
PHE   CE1  C  Y N 275 
PHE   CE2  C  Y N 276 
PHE   CZ   C  Y N 277 
PHE   OXT  O  N N 278 
PHE   H    H  N N 279 
PHE   H2   H  N N 280 
PHE   HA   H  N N 281 
PHE   HB2  H  N N 282 
PHE   HB3  H  N N 283 
PHE   HD1  H  N N 284 
PHE   HD2  H  N N 285 
PHE   HE1  H  N N 286 
PHE   HE2  H  N N 287 
PHE   HZ   H  N N 288 
PHE   HXT  H  N N 289 
PRO   N    N  N N 290 
PRO   CA   C  N S 291 
PRO   C    C  N N 292 
PRO   O    O  N N 293 
PRO   CB   C  N N 294 
PRO   CG   C  N N 295 
PRO   CD   C  N N 296 
PRO   OXT  O  N N 297 
PRO   H    H  N N 298 
PRO   HA   H  N N 299 
PRO   HB2  H  N N 300 
PRO   HB3  H  N N 301 
PRO   HG2  H  N N 302 
PRO   HG3  H  N N 303 
PRO   HD2  H  N N 304 
PRO   HD3  H  N N 305 
PRO   HXT  H  N N 306 
SER   N    N  N N 307 
SER   CA   C  N S 308 
SER   C    C  N N 309 
SER   O    O  N N 310 
SER   CB   C  N N 311 
SER   OG   O  N N 312 
SER   OXT  O  N N 313 
SER   H    H  N N 314 
SER   H2   H  N N 315 
SER   HA   H  N N 316 
SER   HB2  H  N N 317 
SER   HB3  H  N N 318 
SER   HG   H  N N 319 
SER   HXT  H  N N 320 
THR   N    N  N N 321 
THR   CA   C  N S 322 
THR   C    C  N N 323 
THR   O    O  N N 324 
THR   CB   C  N R 325 
THR   OG1  O  N N 326 
THR   CG2  C  N N 327 
THR   OXT  O  N N 328 
THR   H    H  N N 329 
THR   H2   H  N N 330 
THR   HA   H  N N 331 
THR   HB   H  N N 332 
THR   HG1  H  N N 333 
THR   HG21 H  N N 334 
THR   HG22 H  N N 335 
THR   HG23 H  N N 336 
THR   HXT  H  N N 337 
TRP   N    N  N N 338 
TRP   CA   C  N S 339 
TRP   C    C  N N 340 
TRP   O    O  N N 341 
TRP   CB   C  N N 342 
TRP   CG   C  Y N 343 
TRP   CD1  C  Y N 344 
TRP   CD2  C  Y N 345 
TRP   NE1  N  Y N 346 
TRP   CE2  C  Y N 347 
TRP   CE3  C  Y N 348 
TRP   CZ2  C  Y N 349 
TRP   CZ3  C  Y N 350 
TRP   CH2  C  Y N 351 
TRP   OXT  O  N N 352 
TRP   H    H  N N 353 
TRP   H2   H  N N 354 
TRP   HA   H  N N 355 
TRP   HB2  H  N N 356 
TRP   HB3  H  N N 357 
TRP   HD1  H  N N 358 
TRP   HE1  H  N N 359 
TRP   HE3  H  N N 360 
TRP   HZ2  H  N N 361 
TRP   HZ3  H  N N 362 
TRP   HH2  H  N N 363 
TRP   HXT  H  N N 364 
TYR   N    N  N N 365 
TYR   CA   C  N S 366 
TYR   C    C  N N 367 
TYR   O    O  N N 368 
TYR   CB   C  N N 369 
TYR   CG   C  Y N 370 
TYR   CD1  C  Y N 371 
TYR   CD2  C  Y N 372 
TYR   CE1  C  Y N 373 
TYR   CE2  C  Y N 374 
TYR   CZ   C  Y N 375 
TYR   OH   O  N N 376 
TYR   OXT  O  N N 377 
TYR   H    H  N N 378 
TYR   H2   H  N N 379 
TYR   HA   H  N N 380 
TYR   HB2  H  N N 381 
TYR   HB3  H  N N 382 
TYR   HD1  H  N N 383 
TYR   HD2  H  N N 384 
TYR   HE1  H  N N 385 
TYR   HE2  H  N N 386 
TYR   HH   H  N N 387 
TYR   HXT  H  N N 388 
VAL   N    N  N N 389 
VAL   CA   C  N S 390 
VAL   C    C  N N 391 
VAL   O    O  N N 392 
VAL   CB   C  N N 393 
VAL   CG1  C  N N 394 
VAL   CG2  C  N N 395 
VAL   OXT  O  N N 396 
VAL   H    H  N N 397 
VAL   H2   H  N N 398 
VAL   HA   H  N N 399 
VAL   HB   H  N N 400 
VAL   HG11 H  N N 401 
VAL   HG12 H  N N 402 
VAL   HG13 H  N N 403 
VAL   HG21 H  N N 404 
VAL   HG22 H  N N 405 
VAL   HG23 H  N N 406 
VAL   HXT  H  N N 407 
ZN    ZN   ZN N N 408 
# 
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 
A1A0I C02 I01  sing N N 1   
A1A0I C03 C02  doub Y N 2   
A1A0I N05 C04  doub Y N 3   
A1A0I N06 N05  sing Y N 4   
A1A0I N07 N06  sing Y N 5   
A1A0I N08 N07  doub Y N 6   
A1A0I C04 C03  sing N N 7   
A1A0I C09 C03  sing Y N 8   
A1A0I C10 C09  doub Y N 9   
A1A0I C11 C10  sing Y N 10  
A1A0I C12 C11  doub Y N 11  
A1A0I C02 C12  sing Y N 12  
A1A0I C04 N08  sing Y N 13  
A1A0I C10 H101 sing N N 14  
A1A0I N06 H061 sing N N 15  
A1A0I C09 H091 sing N N 16  
A1A0I C11 H111 sing N N 17  
A1A0I C12 H121 sing N N 18  
ALA   N   CA   sing N N 19  
ALA   N   H    sing N N 20  
ALA   N   H2   sing N N 21  
ALA   CA  C    sing N N 22  
ALA   CA  CB   sing N N 23  
ALA   CA  HA   sing N N 24  
ALA   C   O    doub N N 25  
ALA   C   OXT  sing N N 26  
ALA   CB  HB1  sing N N 27  
ALA   CB  HB2  sing N N 28  
ALA   CB  HB3  sing N N 29  
ALA   OXT HXT  sing N N 30  
ARG   N   CA   sing N N 31  
ARG   N   H    sing N N 32  
ARG   N   H2   sing N N 33  
ARG   CA  C    sing N N 34  
ARG   CA  CB   sing N N 35  
ARG   CA  HA   sing N N 36  
ARG   C   O    doub N N 37  
ARG   C   OXT  sing N N 38  
ARG   CB  CG   sing N N 39  
ARG   CB  HB2  sing N N 40  
ARG   CB  HB3  sing N N 41  
ARG   CG  CD   sing N N 42  
ARG   CG  HG2  sing N N 43  
ARG   CG  HG3  sing N N 44  
ARG   CD  NE   sing N N 45  
ARG   CD  HD2  sing N N 46  
ARG   CD  HD3  sing N N 47  
ARG   NE  CZ   sing N N 48  
ARG   NE  HE   sing N N 49  
ARG   CZ  NH1  sing N N 50  
ARG   CZ  NH2  doub N N 51  
ARG   NH1 HH11 sing N N 52  
ARG   NH1 HH12 sing N N 53  
ARG   NH2 HH21 sing N N 54  
ARG   NH2 HH22 sing N N 55  
ARG   OXT HXT  sing N N 56  
ASN   N   CA   sing N N 57  
ASN   N   H    sing N N 58  
ASN   N   H2   sing N N 59  
ASN   CA  C    sing N N 60  
ASN   CA  CB   sing N N 61  
ASN   CA  HA   sing N N 62  
ASN   C   O    doub N N 63  
ASN   C   OXT  sing N N 64  
ASN   CB  CG   sing N N 65  
ASN   CB  HB2  sing N N 66  
ASN   CB  HB3  sing N N 67  
ASN   CG  OD1  doub N N 68  
ASN   CG  ND2  sing N N 69  
ASN   ND2 HD21 sing N N 70  
ASN   ND2 HD22 sing N N 71  
ASN   OXT HXT  sing N N 72  
ASP   N   CA   sing N N 73  
ASP   N   H    sing N N 74  
ASP   N   H2   sing N N 75  
ASP   CA  C    sing N N 76  
ASP   CA  CB   sing N N 77  
ASP   CA  HA   sing N N 78  
ASP   C   O    doub N N 79  
ASP   C   OXT  sing N N 80  
ASP   CB  CG   sing N N 81  
ASP   CB  HB2  sing N N 82  
ASP   CB  HB3  sing N N 83  
ASP   CG  OD1  doub N N 84  
ASP   CG  OD2  sing N N 85  
ASP   OD2 HD2  sing N N 86  
ASP   OXT HXT  sing N N 87  
CYS   N   CA   sing N N 88  
CYS   N   H    sing N N 89  
CYS   N   H2   sing N N 90  
CYS   CA  C    sing N N 91  
CYS   CA  CB   sing N N 92  
CYS   CA  HA   sing N N 93  
CYS   C   O    doub N N 94  
CYS   C   OXT  sing N N 95  
CYS   CB  SG   sing N N 96  
CYS   CB  HB2  sing N N 97  
CYS   CB  HB3  sing N N 98  
CYS   SG  HG   sing N N 99  
CYS   OXT HXT  sing N N 100 
GLN   N   CA   sing N N 101 
GLN   N   H    sing N N 102 
GLN   N   H2   sing N N 103 
GLN   CA  C    sing N N 104 
GLN   CA  CB   sing N N 105 
GLN   CA  HA   sing N N 106 
GLN   C   O    doub N N 107 
GLN   C   OXT  sing N N 108 
GLN   CB  CG   sing N N 109 
GLN   CB  HB2  sing N N 110 
GLN   CB  HB3  sing N N 111 
GLN   CG  CD   sing N N 112 
GLN   CG  HG2  sing N N 113 
GLN   CG  HG3  sing N N 114 
GLN   CD  OE1  doub N N 115 
GLN   CD  NE2  sing N N 116 
GLN   NE2 HE21 sing N N 117 
GLN   NE2 HE22 sing N N 118 
GLN   OXT HXT  sing N N 119 
GLU   N   CA   sing N N 120 
GLU   N   H    sing N N 121 
GLU   N   H2   sing N N 122 
GLU   CA  C    sing N N 123 
GLU   CA  CB   sing N N 124 
GLU   CA  HA   sing N N 125 
GLU   C   O    doub N N 126 
GLU   C   OXT  sing N N 127 
GLU   CB  CG   sing N N 128 
GLU   CB  HB2  sing N N 129 
GLU   CB  HB3  sing N N 130 
GLU   CG  CD   sing N N 131 
GLU   CG  HG2  sing N N 132 
GLU   CG  HG3  sing N N 133 
GLU   CD  OE1  doub N N 134 
GLU   CD  OE2  sing N N 135 
GLU   OE2 HE2  sing N N 136 
GLU   OXT HXT  sing N N 137 
GLY   N   CA   sing N N 138 
GLY   N   H    sing N N 139 
GLY   N   H2   sing N N 140 
GLY   CA  C    sing N N 141 
GLY   CA  HA2  sing N N 142 
GLY   CA  HA3  sing N N 143 
GLY   C   O    doub N N 144 
GLY   C   OXT  sing N N 145 
GLY   OXT HXT  sing N N 146 
HIS   N   CA   sing N N 147 
HIS   N   H    sing N N 148 
HIS   N   H2   sing N N 149 
HIS   CA  C    sing N N 150 
HIS   CA  CB   sing N N 151 
HIS   CA  HA   sing N N 152 
HIS   C   O    doub N N 153 
HIS   C   OXT  sing N N 154 
HIS   CB  CG   sing N N 155 
HIS   CB  HB2  sing N N 156 
HIS   CB  HB3  sing N N 157 
HIS   CG  ND1  sing Y N 158 
HIS   CG  CD2  doub Y N 159 
HIS   ND1 CE1  doub Y N 160 
HIS   ND1 HD1  sing N N 161 
HIS   CD2 NE2  sing Y N 162 
HIS   CD2 HD2  sing N N 163 
HIS   CE1 NE2  sing Y N 164 
HIS   CE1 HE1  sing N N 165 
HIS   NE2 HE2  sing N N 166 
HIS   OXT HXT  sing N N 167 
HOH   O   H1   sing N N 168 
HOH   O   H2   sing N N 169 
ILE   N   CA   sing N N 170 
ILE   N   H    sing N N 171 
ILE   N   H2   sing N N 172 
ILE   CA  C    sing N N 173 
ILE   CA  CB   sing N N 174 
ILE   CA  HA   sing N N 175 
ILE   C   O    doub N N 176 
ILE   C   OXT  sing N N 177 
ILE   CB  CG1  sing N N 178 
ILE   CB  CG2  sing N N 179 
ILE   CB  HB   sing N N 180 
ILE   CG1 CD1  sing N N 181 
ILE   CG1 HG12 sing N N 182 
ILE   CG1 HG13 sing N N 183 
ILE   CG2 HG21 sing N N 184 
ILE   CG2 HG22 sing N N 185 
ILE   CG2 HG23 sing N N 186 
ILE   CD1 HD11 sing N N 187 
ILE   CD1 HD12 sing N N 188 
ILE   CD1 HD13 sing N N 189 
ILE   OXT HXT  sing N N 190 
LEU   N   CA   sing N N 191 
LEU   N   H    sing N N 192 
LEU   N   H2   sing N N 193 
LEU   CA  C    sing N N 194 
LEU   CA  CB   sing N N 195 
LEU   CA  HA   sing N N 196 
LEU   C   O    doub N N 197 
LEU   C   OXT  sing N N 198 
LEU   CB  CG   sing N N 199 
LEU   CB  HB2  sing N N 200 
LEU   CB  HB3  sing N N 201 
LEU   CG  CD1  sing N N 202 
LEU   CG  CD2  sing N N 203 
LEU   CG  HG   sing N N 204 
LEU   CD1 HD11 sing N N 205 
LEU   CD1 HD12 sing N N 206 
LEU   CD1 HD13 sing N N 207 
LEU   CD2 HD21 sing N N 208 
LEU   CD2 HD22 sing N N 209 
LEU   CD2 HD23 sing N N 210 
LEU   OXT HXT  sing N N 211 
LYS   N   CA   sing N N 212 
LYS   N   H    sing N N 213 
LYS   N   H2   sing N N 214 
LYS   CA  C    sing N N 215 
LYS   CA  CB   sing N N 216 
LYS   CA  HA   sing N N 217 
LYS   C   O    doub N N 218 
LYS   C   OXT  sing N N 219 
LYS   CB  CG   sing N N 220 
LYS   CB  HB2  sing N N 221 
LYS   CB  HB3  sing N N 222 
LYS   CG  CD   sing N N 223 
LYS   CG  HG2  sing N N 224 
LYS   CG  HG3  sing N N 225 
LYS   CD  CE   sing N N 226 
LYS   CD  HD2  sing N N 227 
LYS   CD  HD3  sing N N 228 
LYS   CE  NZ   sing N N 229 
LYS   CE  HE2  sing N N 230 
LYS   CE  HE3  sing N N 231 
LYS   NZ  HZ1  sing N N 232 
LYS   NZ  HZ2  sing N N 233 
LYS   NZ  HZ3  sing N N 234 
LYS   OXT HXT  sing N N 235 
MET   N   CA   sing N N 236 
MET   N   H    sing N N 237 
MET   N   H2   sing N N 238 
MET   CA  C    sing N N 239 
MET   CA  CB   sing N N 240 
MET   CA  HA   sing N N 241 
MET   C   O    doub N N 242 
MET   C   OXT  sing N N 243 
MET   CB  CG   sing N N 244 
MET   CB  HB2  sing N N 245 
MET   CB  HB3  sing N N 246 
MET   CG  SD   sing N N 247 
MET   CG  HG2  sing N N 248 
MET   CG  HG3  sing N N 249 
MET   SD  CE   sing N N 250 
MET   CE  HE1  sing N N 251 
MET   CE  HE2  sing N N 252 
MET   CE  HE3  sing N N 253 
MET   OXT HXT  sing N N 254 
PHE   N   CA   sing N N 255 
PHE   N   H    sing N N 256 
PHE   N   H2   sing N N 257 
PHE   CA  C    sing N N 258 
PHE   CA  CB   sing N N 259 
PHE   CA  HA   sing N N 260 
PHE   C   O    doub N N 261 
PHE   C   OXT  sing N N 262 
PHE   CB  CG   sing N N 263 
PHE   CB  HB2  sing N N 264 
PHE   CB  HB3  sing N N 265 
PHE   CG  CD1  doub Y N 266 
PHE   CG  CD2  sing Y N 267 
PHE   CD1 CE1  sing Y N 268 
PHE   CD1 HD1  sing N N 269 
PHE   CD2 CE2  doub Y N 270 
PHE   CD2 HD2  sing N N 271 
PHE   CE1 CZ   doub Y N 272 
PHE   CE1 HE1  sing N N 273 
PHE   CE2 CZ   sing Y N 274 
PHE   CE2 HE2  sing N N 275 
PHE   CZ  HZ   sing N N 276 
PHE   OXT HXT  sing N N 277 
PRO   N   CA   sing N N 278 
PRO   N   CD   sing N N 279 
PRO   N   H    sing N N 280 
PRO   CA  C    sing N N 281 
PRO   CA  CB   sing N N 282 
PRO   CA  HA   sing N N 283 
PRO   C   O    doub N N 284 
PRO   C   OXT  sing N N 285 
PRO   CB  CG   sing N N 286 
PRO   CB  HB2  sing N N 287 
PRO   CB  HB3  sing N N 288 
PRO   CG  CD   sing N N 289 
PRO   CG  HG2  sing N N 290 
PRO   CG  HG3  sing N N 291 
PRO   CD  HD2  sing N N 292 
PRO   CD  HD3  sing N N 293 
PRO   OXT HXT  sing N N 294 
SER   N   CA   sing N N 295 
SER   N   H    sing N N 296 
SER   N   H2   sing N N 297 
SER   CA  C    sing N N 298 
SER   CA  CB   sing N N 299 
SER   CA  HA   sing N N 300 
SER   C   O    doub N N 301 
SER   C   OXT  sing N N 302 
SER   CB  OG   sing N N 303 
SER   CB  HB2  sing N N 304 
SER   CB  HB3  sing N N 305 
SER   OG  HG   sing N N 306 
SER   OXT HXT  sing N N 307 
THR   N   CA   sing N N 308 
THR   N   H    sing N N 309 
THR   N   H2   sing N N 310 
THR   CA  C    sing N N 311 
THR   CA  CB   sing N N 312 
THR   CA  HA   sing N N 313 
THR   C   O    doub N N 314 
THR   C   OXT  sing N N 315 
THR   CB  OG1  sing N N 316 
THR   CB  CG2  sing N N 317 
THR   CB  HB   sing N N 318 
THR   OG1 HG1  sing N N 319 
THR   CG2 HG21 sing N N 320 
THR   CG2 HG22 sing N N 321 
THR   CG2 HG23 sing N N 322 
THR   OXT HXT  sing N N 323 
TRP   N   CA   sing N N 324 
TRP   N   H    sing N N 325 
TRP   N   H2   sing N N 326 
TRP   CA  C    sing N N 327 
TRP   CA  CB   sing N N 328 
TRP   CA  HA   sing N N 329 
TRP   C   O    doub N N 330 
TRP   C   OXT  sing N N 331 
TRP   CB  CG   sing N N 332 
TRP   CB  HB2  sing N N 333 
TRP   CB  HB3  sing N N 334 
TRP   CG  CD1  doub Y N 335 
TRP   CG  CD2  sing Y N 336 
TRP   CD1 NE1  sing Y N 337 
TRP   CD1 HD1  sing N N 338 
TRP   CD2 CE2  doub Y N 339 
TRP   CD2 CE3  sing Y N 340 
TRP   NE1 CE2  sing Y N 341 
TRP   NE1 HE1  sing N N 342 
TRP   CE2 CZ2  sing Y N 343 
TRP   CE3 CZ3  doub Y N 344 
TRP   CE3 HE3  sing N N 345 
TRP   CZ2 CH2  doub Y N 346 
TRP   CZ2 HZ2  sing N N 347 
TRP   CZ3 CH2  sing Y N 348 
TRP   CZ3 HZ3  sing N N 349 
TRP   CH2 HH2  sing N N 350 
TRP   OXT HXT  sing N N 351 
TYR   N   CA   sing N N 352 
TYR   N   H    sing N N 353 
TYR   N   H2   sing N N 354 
TYR   CA  C    sing N N 355 
TYR   CA  CB   sing N N 356 
TYR   CA  HA   sing N N 357 
TYR   C   O    doub N N 358 
TYR   C   OXT  sing N N 359 
TYR   CB  CG   sing N N 360 
TYR   CB  HB2  sing N N 361 
TYR   CB  HB3  sing N N 362 
TYR   CG  CD1  doub Y N 363 
TYR   CG  CD2  sing Y N 364 
TYR   CD1 CE1  sing Y N 365 
TYR   CD1 HD1  sing N N 366 
TYR   CD2 CE2  doub Y N 367 
TYR   CD2 HD2  sing N N 368 
TYR   CE1 CZ   doub Y N 369 
TYR   CE1 HE1  sing N N 370 
TYR   CE2 CZ   sing Y N 371 
TYR   CE2 HE2  sing N N 372 
TYR   CZ  OH   sing N N 373 
TYR   OH  HH   sing N N 374 
TYR   OXT HXT  sing N N 375 
VAL   N   CA   sing N N 376 
VAL   N   H    sing N N 377 
VAL   N   H2   sing N N 378 
VAL   CA  C    sing N N 379 
VAL   CA  CB   sing N N 380 
VAL   CA  HA   sing N N 381 
VAL   C   O    doub N N 382 
VAL   C   OXT  sing N N 383 
VAL   CB  CG1  sing N N 384 
VAL   CB  CG2  sing N N 385 
VAL   CB  HB   sing N N 386 
VAL   CG1 HG11 sing N N 387 
VAL   CG1 HG12 sing N N 388 
VAL   CG1 HG13 sing N N 389 
VAL   CG2 HG21 sing N N 390 
VAL   CG2 HG22 sing N N 391 
VAL   CG2 HG23 sing N N 392 
VAL   OXT HXT  sing N N 393 
# 
_pdbx_audit_support.funding_organization   'Programa de Apoyo a Proyectos de Investigacion e Innovacion Tecnologica (PAPIIT)' 
_pdbx_audit_support.country                Mexico 
_pdbx_audit_support.grant_number           IA205122 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   4LQ6 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9CUN 
_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]   0.026772 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.009619 
_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]   0.007684 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.pdbx_scat_Z 
_atom_type.pdbx_N_electrons 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
C  6  6  2.3103  20.8439 1.0201  10.2075 1.5888 0.5687  0.8651 51.6512 0.2156   
H  1  1  0.4930  10.5109 0.3229  26.1257 0.1402 3.1424  0.0408 57.7997 0.0030   
I  53 53 20.1470 4.3470  18.9947 0.3814  7.5137 27.7660 2.2735 66.8776 3.7480   
N  7  7  12.2220 0.0057  3.1346  9.8933  2.0141 28.9975 1.1672 0.5826  -11.5379 
O  8  8  3.0487  13.2771 2.2870  5.7011  1.5464 0.3239  0.8671 32.9089 0.2508   
S  16 16 6.9054  1.4679  5.2035  22.2151 1.4379 0.2536  1.5863 56.1720 1.0495   
ZN 30 30 14.0812 3.2655  7.0352  0.2333  5.1677 10.3163 2.4112 58.7097 0.9929   
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
_atom_site.calc_flag 
ATOM   1    N  N    . GLY   A 1 3   ? -25.95393 -6.24743  -33.13066 1.000 38.49097 ? 26  GLY   A N    1 ? 
ATOM   2    C  CA   . GLY   A 1 3   ? -24.65133 -5.63040  -32.97515 1.000 35.68988 ? 26  GLY   A CA   1 ? 
ATOM   3    C  C    . GLY   A 1 3   ? -23.65671 -6.50187  -32.22717 1.000 28.43452 ? 26  GLY   A C    1 ? 
ATOM   4    O  O    . GLY   A 1 3   ? -23.94828 -7.65449  -31.90074 1.000 32.48500 ? 26  GLY   A O    1 ? 
ATOM   5    N  N    . MET   A 1 4   ? -22.48339 -5.93671  -31.95220 1.000 30.03054 ? 27  MET   A N    1 ? 
ATOM   6    C  CA   . MET   A 1 4   ? -21.40407 -6.66995  -31.30610 1.000 20.22827 ? 27  MET   A CA   1 ? 
ATOM   7    C  C    . MET   A 1 4   ? -21.64155 -6.78818  -29.80347 1.000 21.19591 ? 27  MET   A C    1 ? 
ATOM   8    O  O    . MET   A 1 4   ? -22.19734 -5.89037  -29.16363 1.000 22.79348 ? 27  MET   A O    1 ? 
ATOM   9    C  CB   . MET   A 1 4   ? -20.07042 -5.95963  -31.55257 1.000 23.76685 ? 27  MET   A CB   1 ? 
ATOM   10   C  CG   . MET   A 1 4   ? -19.62016 -5.89167  -33.02226 1.000 24.71644 ? 27  MET   A CG   1 ? 
ATOM   11   S  SD   . MET   A 1 4   ? -19.34028 -7.53252  -33.70589 1.000 29.57667 ? 27  MET   A SD   1 ? 
ATOM   12   C  CE   . MET   A 1 4   ? -19.01825 -7.20722  -35.43723 1.000 36.19788 ? 27  MET   A CE   1 ? 
ATOM   13   N  N    . VAL   A 1 5   ? -21.20364 -7.91748  -29.24425 1.000 19.23769 ? 28  VAL   A N    1 ? 
ATOM   14   C  CA   . VAL   A 1 5   ? -21.32021 -8.22290  -27.82124 1.000 18.21168 ? 28  VAL   A CA   1 ? 
ATOM   15   C  C    . VAL   A 1 5   ? -19.97979 -8.76741  -27.34420 1.000 15.96086 ? 28  VAL   A C    1 ? 
ATOM   16   O  O    . VAL   A 1 5   ? -19.40728 -9.66361  -27.97847 1.000 14.68960 ? 28  VAL   A O    1 ? 
ATOM   17   C  CB   . VAL   A 1 5   ? -22.42627 -9.26105  -27.56274 1.000 21.84972 ? 28  VAL   A CB   1 ? 
ATOM   18   C  CG1  . VAL   A 1 5   ? -22.47939 -9.62485  -26.08761 1.000 22.05657 ? 28  VAL   A CG1  1 ? 
ATOM   19   C  CG2  . VAL   A 1 5   ? -23.78254 -8.73258  -28.04143 1.000 22.06501 ? 28  VAL   A CG2  1 ? 
ATOM   20   N  N    . VAL   A 1 6   ? -19.49035 -8.24676  -26.22177 1.000 14.23489 ? 29  VAL   A N    1 ? 
ATOM   21   C  CA   . VAL   A 1 6   ? -18.18853 -8.63404  -25.68981 1.000 10.63346 ? 29  VAL   A CA   1 ? 
ATOM   22   C  C    . VAL   A 1 6   ? -18.32899 -9.02530  -24.22701 1.000 11.11873 ? 29  VAL   A C    1 ? 
ATOM   23   O  O    . VAL   A 1 6   ? -18.90276 -8.28070  -23.42600 1.000 11.81493 ? 29  VAL   A O    1 ? 
ATOM   24   C  CB   . VAL   A 1 6   ? -17.15704 -7.50935  -25.86152 1.000 9.60612  ? 29  VAL   A CB   1 ? 
ATOM   25   C  CG1  . VAL   A 1 6   ? -15.85177 -7.87016  -25.14601 1.000 10.71439 ? 29  VAL   A CG1  1 ? 
ATOM   26   C  CG2  . VAL   A 1 6   ? -16.90954 -7.27427  -27.35612 1.000 13.87698 ? 29  VAL   A CG2  1 ? 
ATOM   27   N  N    . PHE   A 1 7   ? -17.78468 -10.18673 -23.87427 1.000 9.07716  ? 30  PHE   A N    1 ? 
ATOM   28   C  CA   . PHE   A 1 7   ? -17.72626 -10.64093 -22.48758 1.000 8.89757  ? 30  PHE   A CA   1 ? 
ATOM   29   C  C    . PHE   A 1 7   ? -16.37376 -10.24411 -21.89769 1.000 8.47706  ? 30  PHE   A C    1 ? 
ATOM   30   O  O    . PHE   A 1 7   ? -15.32226 -10.60985 -22.43533 1.000 10.08311 ? 30  PHE   A O    1 ? 
ATOM   31   C  CB   . PHE   A 1 7   ? -17.91325 -12.16052 -22.46571 1.000 9.27049  ? 30  PHE   A CB   1 ? 
ATOM   32   C  CG   . PHE   A 1 7   ? -18.03331 -12.76060 -21.10065 1.000 9.74995  ? 30  PHE   A CG   1 ? 
ATOM   33   C  CD1  . PHE   A 1 7   ? -16.89941 -13.18430 -20.39653 1.000 10.16082 ? 30  PHE   A CD1  1 ? 
ATOM   34   C  CD2  . PHE   A 1 7   ? -19.28495 -12.97104 -20.53481 1.000 10.27090 ? 30  PHE   A CD2  1 ? 
ATOM   35   C  CE1  . PHE   A 1 7   ? -17.01522 -13.78025 -19.14101 1.000 10.73675 ? 30  PHE   A CE1  1 ? 
ATOM   36   C  CE2  . PHE   A 1 7   ? -19.40975 -13.55539 -19.29101 1.000 10.63540 ? 30  PHE   A CE2  1 ? 
ATOM   37   C  CZ   . PHE   A 1 7   ? -18.27263 -13.96478 -18.59090 1.000 11.30918 ? 30  PHE   A CZ   1 ? 
ATOM   38   N  N    . ILE   A 1 8   ? -16.39972 -9.49425  -20.80644 1.000 9.85004  ? 31  ILE   A N    1 ? 
ATOM   39   C  CA   . ILE   A 1 8   ? -15.19038 -9.04055  -20.12237 1.000 9.27499  ? 31  ILE   A CA   1 ? 
ATOM   40   C  C    . ILE   A 1 8   ? -15.07032 -9.80271  -18.81405 1.000 8.19148  ? 31  ILE   A C    1 ? 
ATOM   41   O  O    . ILE   A 1 8   ? -15.98781 -9.77809  -17.98637 1.000 8.88895  ? 31  ILE   A O    1 ? 
ATOM   42   C  CB   . ILE   A 1 8   ? -15.24471 -7.53361  -19.82145 1.000 9.39135  ? 31  ILE   A CB   1 ? 
ATOM   43   C  CG1  . ILE   A 1 8   ? -15.44611 -6.69422  -21.09217 1.000 11.83152 ? 31  ILE   A CG1  1 ? 
ATOM   44   C  CG2  . ILE   A 1 8   ? -13.98196 -7.10980  -19.04470 1.000 10.67519 ? 31  ILE   A CG2  1 ? 
ATOM   45   C  CD1  . ILE   A 1 8   ? -15.78708 -5.21700  -20.81597 1.000 12.58705 ? 31  ILE   A CD1  1 ? 
ATOM   46   N  N    . ASP   A 1 9   ? -13.93148 -10.46266 -18.60932 1.000 8.65912  ? 32  ASP   A N    1 ? 
ATOM   47   C  CA   . ASP   A 1 9   ? -13.67750 -11.18862 -17.36916 1.000 7.73448  ? 32  ASP   A CA   1 ? 
ATOM   48   C  C    . ASP   A 1 9   ? -12.58082 -10.48552 -16.58064 1.000 9.81634  ? 32  ASP   A C    1 ? 
ATOM   49   O  O    . ASP   A 1 9   ? -11.39307 -10.70203 -16.85624 1.000 9.08005  ? 32  ASP   A O    1 ? 
ATOM   50   C  CB   . ASP   A 1 9   ? -13.25729 -12.62665 -17.69202 1.000 9.34586  ? 32  ASP   A CB   1 ? 
ATOM   51   C  CG   . ASP   A 1 9   ? -12.73622 -13.35554 -16.48560 1.000 10.78967 ? 32  ASP   A CG   1 ? 
ATOM   52   O  OD1  . ASP   A 1 9   ? -13.28037 -13.14901 -15.38289 1.000 9.97888  ? 32  ASP   A OD1  1 ? 
ATOM   53   O  OD2  . ASP   A 1 9   ? -11.76942 -14.12501 -16.64784 1.000 12.46895 ? 32  ASP   A OD2  1 ? 
ATOM   54   N  N    . PRO   A 1 10  ? -12.90651 -9.63574  -15.60825 1.000 9.25377  ? 33  PRO   A N    1 ? 
ATOM   55   C  CA   . PRO   A 1 10  ? -11.86625 -9.13366  -14.69684 1.000 9.65923  ? 33  PRO   A CA   1 ? 
ATOM   56   C  C    . PRO   A 1 10  ? -11.40025 -10.28787 -13.82242 1.000 9.46434  ? 33  PRO   A C    1 ? 
ATOM   57   O  O    . PRO   A 1 10  ? -12.17504 -10.80174 -13.01052 1.000 9.37647  ? 33  PRO   A O    1 ? 
ATOM   58   C  CB   . PRO   A 1 10  ? -12.58727 -8.04516  -13.88278 1.000 9.81573  ? 33  PRO   A CB   1 ? 
ATOM   59   C  CG   . PRO   A 1 10  ? -13.92479 -7.84830  -14.56567 1.000 14.03937 ? 33  PRO   A CG   1 ? 
ATOM   60   C  CD   . PRO   A 1 10  ? -14.24318 -9.12844  -15.25356 1.000 10.73451 ? 33  PRO   A CD   1 ? 
ATOM   61   N  N    . GLY   A 1 11  ? -10.15593 -10.72166 -14.01324 1.000 9.42677  ? 34  GLY   A N    1 ? 
ATOM   62   C  CA   . GLY   A 1 11  ? -9.69153  -11.93729 -13.36716 1.000 9.55789  ? 34  GLY   A CA   1 ? 
ATOM   63   C  C    . GLY   A 1 11  ? -9.77183  -11.86828 -11.85473 1.000 8.62967  ? 34  GLY   A C    1 ? 
ATOM   64   O  O    . GLY   A 1 11  ? -9.61282  -10.81301 -11.23749 1.000 9.75489  ? 34  GLY   A O    1 ? 
ATOM   65   N  N    . HIS   A 1 12  ? -10.00025 -13.04183 -11.26208 1.000 8.80653  ? 35  HIS   A N    1 ? 
ATOM   66   C  CA   . HIS   A 1 12  ? -10.00713 -13.27585 -9.82449  1.000 9.95434  ? 35  HIS   A CA   1 ? 
ATOM   67   C  C    . HIS   A 1 12  ? -11.28149 -12.78065 -9.16744  1.000 10.55471 ? 35  HIS   A C    1 ? 
ATOM   68   O  O    . HIS   A 1 12  ? -12.18399 -12.29137 -9.84750  1.000 10.31984 ? 35  HIS   A O    1 ? 
ATOM   69   C  CB   . HIS   A 1 12  ? -8.73358  -12.73527 -9.16674  1.000 10.85752 ? 35  HIS   A CB   1 ? 
ATOM   70   C  CG   . HIS   A 1 12  ? -7.50759  -13.34142 -9.74924  1.000 10.50017 ? 35  HIS   A CG   1 ? 
ATOM   71   N  ND1  . HIS   A 1 12  ? -7.07733  -14.61563 -9.44274  1.000 11.14183 ? 35  HIS   A ND1  1 ? 
ATOM   72   C  CD2  . HIS   A 1 12  ? -6.68934  -12.88611 -10.71829 1.000 10.95056 ? 35  HIS   A CD2  1 ? 
ATOM   73   C  CE1  . HIS   A 1 12  ? -6.01002  -14.89918 -10.16443 1.000 11.16258 ? 35  HIS   A CE1  1 ? 
ATOM   74   N  NE2  . HIS   A 1 12  ? -5.76059  -13.86625 -10.94541 1.000 10.88491 ? 35  HIS   A NE2  1 ? 
ATOM   75   N  N    . ASN   A 1 13  ? -11.37754 -12.94676 -7.85454  1.000 10.66552 ? 36  ASN   A N    1 ? 
ATOM   76   C  CA   . ASN   A 1 13  ? -12.58880 -12.64347 -7.10795  1.000 9.76738  ? 36  ASN   A CA   1 ? 
ATOM   77   C  C    . ASN   A 1 13  ? -12.41490 -11.34766 -6.33673  1.000 11.55380 ? 36  ASN   A C    1 ? 
ATOM   78   O  O    . ASN   A 1 13  ? -11.30232 -10.97970 -5.95511  1.000 13.11339 ? 36  ASN   A O    1 ? 
ATOM   79   C  CB   . ASN   A 1 13  ? -12.83891 -13.73617 -6.05984  1.000 10.84493 ? 36  ASN   A CB   1 ? 
ATOM   80   C  CG   . ASN   A 1 13  ? -13.32152 -15.04765 -6.65115  1.000 13.16683 ? 36  ASN   A CG   1 ? 
ATOM   81   O  OD1  . ASN   A 1 13  ? -13.98722 -15.08288 -7.68546  1.000 14.07730 ? 36  ASN   A OD1  1 ? 
ATOM   82   N  ND2  . ASN   A 1 13  ? -13.01458 -16.14010 -5.96325  1.000 13.33610 ? 36  ASN   A ND2  1 ? 
ATOM   83   N  N    . GLY   A 1 14  ? -13.54725 -10.69242 -6.04424  1.000 12.81804 ? 37  GLY   A N    1 ? 
ATOM   84   C  CA   . GLY   A 1 14  ? -13.52191 -9.58427  -5.10326  1.000 14.12211 ? 37  GLY   A CA   1 ? 
ATOM   85   C  C    . GLY   A 1 14  ? -13.10052 -9.99124  -3.70492  1.000 14.19017 ? 37  GLY   A C    1 ? 
ATOM   86   O  O    . GLY   A 1 14  ? -12.51811 -9.18673  -2.97415  1.000 17.73539 ? 37  GLY   A O    1 ? 
ATOM   87   N  N    . ALA   A 1 15  ? -13.40144 -11.23170 -3.31012  1.000 12.05180 ? 38  ALA   A N    1 ? 
ATOM   88   C  CA   . ALA   A 1 15  ? -13.00814 -11.79092 -2.02465  1.000 12.82038 ? 38  ALA   A CA   1 ? 
ATOM   89   C  C    . ALA   A 1 15  ? -12.96126 -13.30247 -2.19329  1.000 13.11318 ? 38  ALA   A C    1 ? 
ATOM   90   O  O    . ALA   A 1 15  ? -13.67977 -13.85950 -3.01861  1.000 12.92365 ? 38  ALA   A O    1 ? 
ATOM   91   C  CB   . ALA   A 1 15  ? -14.00939 -11.40927 -0.92404  1.000 14.44694 ? 38  ALA   A CB   1 ? 
ATOM   92   N  N    . ASN   A 1 16  ? -12.10449 -13.96580 -1.42259  1.000 14.49556 ? 39  ASN   A N    1 ? 
ATOM   93   C  CA   . ASN   A 1 16  ? -11.91681 -15.40524 -1.54033  1.000 13.41969 ? 39  ASN   A CA   1 ? 
ATOM   94   C  C    . ASN   A 1 16  ? -12.36593 -16.10402 -0.26342  1.000 16.33250 ? 39  ASN   A C    1 ? 
ATOM   95   O  O    . ASN   A 1 16  ? -12.34838 -15.51607 0.82019   1.000 19.39178 ? 39  ASN   A O    1 ? 
ATOM   96   C  CB   . ASN   A 1 16  ? -10.43776 -15.71950 -1.77430  1.000 13.21856 ? 39  ASN   A CB   1 ? 
ATOM   97   C  CG   . ASN   A 1 16  ? -9.95447  -15.29637 -3.14406  1.000 16.42710 ? 39  ASN   A CG   1 ? 
ATOM   98   O  OD1  . ASN   A 1 16  ? -10.60014 -15.56901 -4.14820  1.000 13.93320 ? 39  ASN   A OD1  1 ? 
ATOM   99   N  ND2  . ASN   A 1 16  ? -8.78190  -14.66412 -3.19416  1.000 26.12477 ? 39  ASN   A ND2  1 ? 
ATOM   100  N  N    . ASP   A 1 17  ? -12.74949 -17.37397 -0.38760  1.000 13.38991 ? 40  ASP   A N    1 ? 
ATOM   101  C  CA   . ASP   A 1 17  ? -12.94860 -18.25151 0.76965   1.000 13.64509 ? 40  ASP   A CA   1 ? 
ATOM   102  C  C    . ASP   A 1 17  ? -12.32863 -19.61105 0.44255   1.000 14.01640 ? 40  ASP   A C    1 ? 
ATOM   103  O  O    . ASP   A 1 17  ? -11.69426 -19.77822 -0.60251  1.000 13.26609 ? 40  ASP   A O    1 ? 
ATOM   104  C  CB   . ASP   A 1 17  ? -14.41625 -18.28977 1.22248   1.000 15.70082 ? 40  ASP   A CB   1 ? 
ATOM   105  C  CG   . ASP   A 1 17  ? -15.32660 -18.91351 0.19683   1.000 14.95618 ? 40  ASP   A CG   1 ? 
ATOM   106  O  OD1  . ASP   A 1 17  ? -14.82489 -19.65853 -0.68389  1.000 14.61831 ? 40  ASP   A OD1  1 ? 
ATOM   107  O  OD2  . ASP   A 1 17  ? -16.54310 -18.62727 0.25819   1.000 19.12083 ? 40  ASP   A OD2  1 ? 
ATOM   108  N  N    . ALA   A 1 18  ? -12.50222 -20.59734 1.33436   1.000 13.24666 ? 41  ALA   A N    1 ? 
ATOM   109  C  CA   . ALA   A 1 18  ? -11.86364 -21.89370 1.10668   1.000 14.69143 ? 41  ALA   A CA   1 ? 
ATOM   110  C  C    . ALA   A 1 18  ? -12.37658 -22.60110 -0.14581  1.000 13.04031 ? 41  ALA   A C    1 ? 
ATOM   111  O  O    . ALA   A 1 18  ? -11.69183 -23.49369 -0.66085  1.000 15.45774 ? 41  ALA   A O    1 ? 
ATOM   112  C  CB   . ALA   A 1 18  ? -12.01777 -22.81123 2.32218   1.000 15.12431 ? 41  ALA   A CB   1 ? 
ATOM   113  N  N    . SER   A 1 19  ? -13.54439 -22.21193 -0.66411  1.000 12.87643 ? 42  SER   A N    1 ? 
ATOM   114  C  CA   . SER   A 1 19  ? -14.09565 -22.87379 -1.84053  1.000 13.39834 ? 42  SER   A CA   1 ? 
ATOM   115  C  C    . SER   A 1 19  ? -13.24939 -22.68486 -3.09057  1.000 14.13644 ? 42  SER   A C    1 ? 
ATOM   116  O  O    . SER   A 1 19  ? -13.45311 -23.42312 -4.06246  1.000 14.25931 ? 42  SER   A O    1 ? 
ATOM   117  C  CB   . SER   A 1 19  ? -15.52920 -22.38530 -2.11334  1.000 13.82173 ? 42  SER   A CB   1 ? 
ATOM   118  O  OG   . SER   A 1 19  ? -15.53508 -21.06829 -2.65299  1.000 13.92439 ? 42  SER   A OG   1 ? 
ATOM   119  N  N    . ILE   A 1 20  ? -12.30447 -21.73891 -3.10257  1.000 12.34661 ? 43  ILE   A N    1 ? 
ATOM   120  C  CA   . ILE   A 1 20  ? -11.50364 -21.56672 -4.31063  1.000 12.67381 ? 43  ILE   A CA   1 ? 
ATOM   121  C  C    . ILE   A 1 20  ? -10.57913 -22.74941 -4.57155  1.000 11.67057 ? 43  ILE   A C    1 ? 
ATOM   122  O  O    . ILE   A 1 20  ? -10.04605 -22.87587 -5.67937  1.000 13.08521 ? 43  ILE   A O    1 ? 
ATOM   123  C  CB   . ILE   A 1 20  ? -10.75372 -20.22182 -4.36707  1.000 11.97348 ? 43  ILE   A CB   1 ? 
ATOM   124  C  CG1  . ILE   A 1 20  ? -9.61670  -20.15396 -3.33393  1.000 13.10339 ? 43  ILE   A CG1  1 ? 
ATOM   125  C  CG2  . ILE   A 1 20  ? -11.72872 -19.06411 -4.23150  1.000 13.80975 ? 43  ILE   A CG2  1 ? 
ATOM   126  C  CD1  . ILE   A 1 20  ? -8.64217  -19.00145 -3.60316  1.000 13.63208 ? 43  ILE   A CD1  1 ? 
ATOM   127  N  N    . GLY   A 1 21  ? -10.37844 -23.62364 -3.58070  1.000 11.82133 ? 44  GLY   A N    1 ? 
ATOM   128  C  CA   . GLY   A 1 21  ? -9.58700  -24.82115 -3.78425  1.000 12.97143 ? 44  GLY   A CA   1 ? 
ATOM   129  C  C    . GLY   A 1 21  ? -10.32078 -25.98801 -4.41302  1.000 12.89940 ? 44  GLY   A C    1 ? 
ATOM   130  O  O    . GLY   A 1 21  ? -9.66925  -26.98982 -4.73128  1.000 14.89648 ? 44  GLY   A O    1 ? 
ATOM   131  N  N    . ARG   A 1 22  ? -11.63570 -25.88501 -4.61389  1.000 12.44719 ? 45  ARG   A N    1 ? 
ATOM   132  C  CA   . ARG   A 1 22  ? -12.39241 -26.99053 -5.19751  1.000 11.94645 ? 45  ARG   A CA   1 ? 
ATOM   133  C  C    . ARG   A 1 22  ? -11.93751 -27.23708 -6.63045  1.000 12.81583 ? 45  ARG   A C    1 ? 
ATOM   134  O  O    . ARG   A 1 22  ? -11.74473 -26.29922 -7.41015  1.000 12.33098 ? 45  ARG   A O    1 ? 
ATOM   135  C  CB   . ARG   A 1 22  ? -13.89388 -26.67581 -5.16344  1.000 15.04728 ? 45  ARG   A CB   1 ? 
ATOM   136  C  CG   . ARG   A 1 22  ? -14.78006 -27.81944 -5.69758  1.000 13.10047 ? 45  ARG   A CG   1 ? 
ATOM   137  C  CD   . ARG   A 1 22  ? -16.28067 -27.53805 -5.56751  1.000 15.75959 ? 45  ARG   A CD   1 ? 
ATOM   138  N  NE   . ARG   A 1 22  ? -16.60408 -26.27560 -6.21769  1.000 14.83318 ? 45  ARG   A NE   1 ? 
ATOM   139  C  CZ   . ARG   A 1 22  ? -16.86826 -26.14298 -7.51162  1.000 14.68358 ? 45  ARG   A CZ   1 ? 
ATOM   140  N  NH1  . ARG   A 1 22  ? -17.00127 -27.19333 -8.30100  1.000 14.22300 ? 45  ARG   A NH1  1 ? 
ATOM   141  N  NH2  . ARG   A 1 22  ? -16.98961 -24.92330 -8.02691  1.000 14.73024 ? 45  ARG   A NH2  1 ? 
ATOM   142  N  N    . GLN   A 1 23  ? -11.78566 -28.50968 -6.98813  1.000 14.13695 ? 46  GLN   A N    1 ? 
ATOM   143  C  CA   . GLN   A 1 23  ? -11.33061 -28.86224 -8.33030  1.000 12.31764 ? 46  GLN   A CA   1 ? 
ATOM   144  C  C    . GLN   A 1 23  ? -12.43057 -28.64712 -9.36477  1.000 13.42103 ? 46  GLN   A C    1 ? 
ATOM   145  O  O    . GLN   A 1 23  ? -13.59262 -29.02163 -9.15528  1.000 13.52082 ? 46  GLN   A O    1 ? 
ATOM   146  C  CB   . GLN   A 1 23  ? -10.88566 -30.32498 -8.36951  1.000 15.54938 ? 46  GLN   A CB   1 ? 
ATOM   147  C  CG   . GLN   A 1 23  ? -9.63937  -30.58072 -7.56254  1.000 16.04474 ? 46  GLN   A CG   1 ? 
ATOM   148  C  CD   . GLN   A 1 23  ? -8.53947  -29.59806 -7.91394  1.000 13.84027 ? 46  GLN   A CD   1 ? 
ATOM   149  O  OE1  . GLN   A 1 23  ? -7.90248  -29.70240 -8.96388  1.000 18.51966 ? 46  GLN   A OE1  1 ? 
ATOM   150  N  NE2  . GLN   A 1 23  ? -8.33232  -28.61501 -7.04713  1.000 16.48338 ? 46  GLN   A NE2  1 ? 
ATOM   151  N  N    . VAL   A 1 24  ? -12.05161 -28.04717 -10.49342 1.000 12.05034 ? 47  VAL   A N    1 ? 
ATOM   152  C  CA   . VAL   A 1 24  ? -12.94871 -27.80170 -11.62550 1.000 12.53915 ? 47  VAL   A CA   1 ? 
ATOM   153  C  C    . VAL   A 1 24  ? -12.28801 -28.30932 -12.90515 1.000 12.93084 ? 47  VAL   A C    1 ? 
ATOM   154  O  O    . VAL   A 1 24  ? -11.05639 -28.39980 -12.97277 1.000 12.94733 ? 47  VAL   A O    1 ? 
ATOM   155  C  CB   . VAL   A 1 24  ? -13.35078 -26.31802 -11.73587 1.000 11.69685 ? 47  VAL   A CB   1 ? 
ATOM   156  C  CG1  . VAL   A 1 24  ? -13.98115 -25.82743 -10.42422 1.000 13.16031 ? 47  VAL   A CG1  1 ? 
ATOM   157  C  CG2  . VAL   A 1 24  ? -12.16095 -25.44049 -12.16267 1.000 13.73050 ? 47  VAL   A CG2  1 ? 
ATOM   158  N  N    . PRO   A 1 25  ? -13.04911 -28.67449 -13.93393 1.000 13.03982 ? 48  PRO   A N    1 ? 
ATOM   159  C  CA   . PRO   A 1 25  ? -12.41896 -29.22478 -15.14529 1.000 11.90666 ? 48  PRO   A CA   1 ? 
ATOM   160  C  C    . PRO   A 1 25  ? -11.58541 -28.19856 -15.89944 1.000 12.09874 ? 48  PRO   A C    1 ? 
ATOM   161  O  O    . PRO   A 1 25  ? -11.90755 -27.01002 -15.95070 1.000 14.29936 ? 48  PRO   A O    1 ? 
ATOM   162  C  CB   . PRO   A 1 25  ? -13.60624 -29.70010 -15.99238 1.000 14.17204 ? 48  PRO   A CB   1 ? 
ATOM   163  C  CG   . PRO   A 1 25  ? -14.82918 -29.09353 -15.37488 1.000 16.86461 ? 48  PRO   A CG   1 ? 
ATOM   164  C  CD   . PRO   A 1 25  ? -14.51768 -28.77600 -13.95077 1.000 14.67948 ? 48  PRO   A CD   1 ? 
ATOM   165  N  N    . THR   A 1 26  ? -10.49026 -28.68588 -16.50037 1.000 13.22600 ? 49  THR   A N    1 ? 
ATOM   166  C  CA   . THR   A 1 26  ? -9.64056  -27.84738 -17.34343 1.000 12.27603 ? 49  THR   A CA   1 ? 
ATOM   167  C  C    . THR   A 1 26  ? -10.11442 -27.77854 -18.78669 1.000 12.19284 ? 49  THR   A C    1 ? 
ATOM   168  O  O    . THR   A 1 26  ? -9.68957  -26.87554 -19.52159 1.000 12.12879 ? 49  THR   A O    1 ? 
ATOM   169  C  CB   . THR   A 1 26  ? -8.21120  -28.39452 -17.39768 1.000 14.64925 ? 49  THR   A CB   1 ? 
ATOM   170  O  OG1  . THR   A 1 26  ? -8.23446  -29.66285 -18.05818 1.000 15.22536 ? 49  THR   A OG1  1 ? 
ATOM   171  C  CG2  . THR   A 1 26  ? -7.61532  -28.55924 -16.01412 1.000 15.53220 ? 49  THR   A CG2  1 ? 
ATOM   172  N  N    . GLY   A 1 27  ? -10.95690 -28.71120 -19.22530 1.000 11.19366 ? 50  GLY   A N    1 ? 
ATOM   173  C  CA   . GLY   A 1 27  ? -11.28910 -28.82239 -20.63094 1.000 11.46781 ? 50  GLY   A CA   1 ? 
ATOM   174  C  C    . GLY   A 1 27  ? -10.39462 -29.75846 -21.41376 1.000 11.61482 ? 50  GLY   A C    1 ? 
ATOM   175  O  O    . GLY   A 1 27  ? -10.72268 -30.08288 -22.56241 1.000 13.16721 ? 50  GLY   A O    1 ? 
ATOM   176  N  N    . ARG   A 1 28  ? -9.28145  -30.20551 -20.83236 1.000 12.00139 ? 51  ARG   A N    1 ? 
ATOM   177  C  CA   . ARG   A 1 28  ? -8.40049  -31.17582 -21.47507 1.000 12.66979 ? 51  ARG   A CA   1 ? 
ATOM   178  C  C    . ARG   A 1 28  ? -8.31677  -32.48579 -20.71054 1.000 16.01374 ? 51  ARG   A C    1 ? 
ATOM   179  O  O    . ARG   A 1 28  ? -7.47372  -33.33493 -21.04106 1.000 14.92126 ? 51  ARG   A O    1 ? 
ATOM   180  C  CB   . ARG   A 1 28  ? -7.01137  -30.58121 -21.70904 1.000 13.39409 ? 51  ARG   A CB   1 ? 
ATOM   181  C  CG   . ARG   A 1 28  ? -7.06182  -29.41001 -22.68112 1.000 12.97977 ? 51  ARG   A CG   1 ? 
ATOM   182  C  CD   . ARG   A 1 28  ? -5.67439  -28.94892 -23.09373 1.000 11.56226 ? 51  ARG   A CD   1 ? 
ATOM   183  N  NE   . ARG   A 1 28  ? -5.73385  -27.60521 -23.66230 1.000 10.70108 ? 51  ARG   A NE   1 ? 
ATOM   184  C  CZ   . ARG   A 1 28  ? -5.61668  -27.30189 -24.94924 1.000 11.69138 ? 51  ARG   A CZ   1 ? 
ATOM   185  N  NH1  . ARG   A 1 28  ? -5.38689  -28.23053 -25.86943 1.000 12.01843 ? 51  ARG   A NH1  1 ? 
ATOM   186  N  NH2  . ARG   A 1 28  ? -5.77411  -26.03514 -25.33204 1.000 11.68848 ? 51  ARG   A NH2  1 ? 
ATOM   187  N  N    . GLY   A 1 29  ? -9.16734  -32.68052 -19.70444 1.000 14.83929 ? 52  GLY   A N    1 ? 
ATOM   188  C  CA   . GLY   A 1 29  ? -9.21727  -33.96554 -19.03400 1.000 15.59723 ? 52  GLY   A CA   1 ? 
ATOM   189  C  C    . GLY   A 1 29  ? -9.05092  -33.90440 -17.53258 1.000 19.95591 ? 52  GLY   A C    1 ? 
ATOM   190  O  O    . GLY   A 1 29  ? -9.80728  -34.54488 -16.79558 1.000 23.84266 ? 52  GLY   A O    1 ? 
ATOM   191  N  N    . GLY   A 1 30  ? -8.06996  -33.14652 -17.06599 1.000 18.32406 ? 53  GLY   A N    1 ? 
ATOM   192  C  CA   . GLY   A 1 30  ? -7.78496  -33.03341 -15.64916 1.000 20.04301 ? 53  GLY   A CA   1 ? 
ATOM   193  C  C    . GLY   A 1 30  ? -8.58885  -31.93220 -14.98831 1.000 14.65203 ? 53  GLY   A C    1 ? 
ATOM   194  O  O    . GLY   A 1 30  ? -9.56327  -31.42163 -15.54113 1.000 17.55762 ? 53  GLY   A O    1 ? 
ATOM   195  N  N    . THR   A 1 31  ? -8.15265  -31.54927 -13.78578 1.000 17.81591 ? 54  THR   A N    1 ? 
ATOM   196  C  CA   . THR   A 1 31  ? -8.79553  -30.48173 -13.02934 1.000 15.20014 ? 54  THR   A CA   1 ? 
ATOM   197  C  C    . THR   A 1 31  ? -7.74209  -29.51214 -12.51742 1.000 16.58840 ? 54  THR   A C    1 ? 
ATOM   198  O  O    . THR   A 1 31  ? -6.55019  -29.82011 -12.46808 1.000 17.57812 ? 54  THR   A O    1 ? 
ATOM   199  C  CB   . THR   A 1 31  ? -9.55745  -31.02535 -11.81173 1.000 16.76081 ? 54  THR   A CB   1 ? 
ATOM   200  O  OG1  . THR   A 1 31  ? -8.61986  -31.59864 -10.88919 1.000 20.16875 ? 54  THR   A OG1  1 ? 
ATOM   201  C  CG2  . THR   A 1 31  ? -10.58581 -32.07134 -12.23048 1.000 19.27784 ? 54  THR   A CG2  1 ? 
ATOM   202  N  N    . LYS   A 1 32  ? -8.20256  -28.32481 -12.12634 1.000 13.86375 ? 55  LYS   A N    1 ? 
ATOM   203  C  CA   . LYS   A 1 32  ? -7.37486  -27.35856 -11.41650 1.000 14.90324 ? 55  LYS   A CA   1 ? 
ATOM   204  C  C    . LYS   A 1 32  ? -8.26566  -26.63971 -10.41177 1.000 14.28483 ? 55  LYS   A C    1 ? 
ATOM   205  O  O    . LYS   A 1 32  ? -9.48472  -26.83786 -10.37870 1.000 14.36719 ? 55  LYS   A O    1 ? 
ATOM   206  C  CB   . LYS   A 1 32  ? -6.69580  -26.37276 -12.36987 1.000 18.62377 ? 55  LYS   A CB   1 ? 
ATOM   207  C  CG   . LYS   A 1 32  ? -7.65929  -25.52125 -13.18124 1.000 20.12658 ? 55  LYS   A CG   1 ? 
ATOM   208  C  CD   . LYS   A 1 32  ? -6.92367  -24.74958 -14.29581 1.000 23.45200 ? 55  LYS   A CD   1 ? 
ATOM   209  C  CE   . LYS   A 1 32  ? -5.61113  -24.11784 -13.81446 1.000 25.59018 ? 55  LYS   A CE   1 ? 
ATOM   210  N  NZ   . LYS   A 1 32  ? -5.15601  -22.95527 -14.65231 1.000 27.20312 ? 55  LYS   A NZ   1 ? 
ATOM   211  N  N    . ASN   A 1 33  ? -7.65292  -25.80794 -9.57504  1.000 13.65656 ? 56  ASN   A N    1 ? 
ATOM   212  C  CA   . ASN   A 1 33  ? -8.42907  -25.09457 -8.56720  1.000 12.43958 ? 56  ASN   A CA   1 ? 
ATOM   213  C  C    . ASN   A 1 33  ? -9.44394  -24.16254 -9.22097  1.000 12.58176 ? 56  ASN   A C    1 ? 
ATOM   214  O  O    . ASN   A 1 33  ? -9.17328  -23.52612 -10.24490 1.000 13.31523 ? 56  ASN   A O    1 ? 
ATOM   215  C  CB   . ASN   A 1 33  ? -7.51463  -24.25913 -7.66211  1.000 12.31727 ? 56  ASN   A CB   1 ? 
ATOM   216  C  CG   . ASN   A 1 33  ? -6.71152  -25.10026 -6.66561  1.000 16.45168 ? 56  ASN   A CG   1 ? 
ATOM   217  O  OD1  . ASN   A 1 33  ? -6.67501  -26.32982 -6.73655  1.000 17.60019 ? 56  ASN   A OD1  1 ? 
ATOM   218  N  ND2  . ASN   A 1 33  ? -6.05961  -24.42015 -5.72689  1.000 16.77607 ? 56  ASN   A ND2  1 ? 
ATOM   219  N  N    . CYS   A 1 34  ? -10.60914 -24.06579 -8.58107  1.000 11.56464 ? 57  CYS   A N    1 ? 
ATOM   220  C  CA   . CYS   A 1 34  ? -11.68079 -23.17479 -9.00161  1.000 11.57148 ? 57  CYS   A CA   1 ? 
ATOM   221  C  C    . CYS   A 1 34  ? -11.16691 -21.77137 -9.31992  1.000 11.34906 ? 57  CYS   A C    1 ? 
ATOM   222  O  O    . CYS   A 1 34  ? -11.55902 -21.16490 -10.32465 1.000 11.99252 ? 57  CYS   A O    1 ? 
ATOM   223  C  CB   . CYS   A 1 34  ? -12.70514 -23.13232 -7.85739  1.000 12.80325 ? 57  CYS   A CB   1 ? 
ATOM   224  S  SG   . CYS   A 1 34  ? -13.65267 -21.59974 -7.66044  1.000 12.94631 ? 57  CYS   A SG   1 ? 
ATOM   225  N  N    . GLN   A 1 35  ? -10.32309 -21.22297 -8.44844  1.000 13.24319 ? 58  GLN   A N    1 ? 
ATOM   226  C  CA   . GLN   A 1 35  ? -9.79986  -19.87292 -8.62011  1.000 14.47978 ? 58  GLN   A CA   1 ? 
ATOM   227  C  C    . GLN   A 1 35  ? -8.43306  -19.81916 -7.96591  1.000 17.55150 ? 58  GLN   A C    1 ? 
ATOM   228  O  O    . GLN   A 1 35  ? -8.18554  -20.50136 -6.97549  1.000 16.94761 ? 58  GLN   A O    1 ? 
ATOM   229  C  CB   . GLN   A 1 35  ? -10.67430 -18.81592 -7.92391  1.000 16.52001 ? 58  GLN   A CB   1 ? 
ATOM   230  C  CG   . GLN   A 1 35  ? -11.72160 -18.16739 -8.81152  1.000 19.84913 ? 58  GLN   A CG   1 ? 
ATOM   231  C  CD   . GLN   A 1 35  ? -11.12548 -17.41890 -9.98771  1.000 16.15585 ? 58  GLN   A CD   1 ? 
ATOM   232  O  OE1  . GLN   A 1 35  ? -9.91413  -17.17691 -10.05196 1.000 23.17885 ? 58  GLN   A OE1  1 ? 
ATOM   233  N  NE2  . GLN   A 1 35  ? -11.97167 -17.06952 -10.94082 1.000 17.49391 ? 58  GLN   A NE2  1 ? 
ATOM   234  N  N    . ALA   A 1 36  ? -7.54579  -19.01318 -8.53644  1.000 22.63369 ? 59  ALA   A N    1 ? 
ATOM   235  C  CA   . ALA   A 1 36  ? -6.35174  -18.58251 -7.82414  1.000 24.68484 ? 59  ALA   A CA   1 ? 
ATOM   236  C  C    . ALA   A 1 36  ? -6.66592  -17.27915 -7.10312  1.000 22.65479 ? 59  ALA   A C    1 ? 
ATOM   237  O  O    . ALA   A 1 36  ? -7.52369  -16.51534 -7.53683  1.000 18.77298 ? 59  ALA   A O    1 ? 
ATOM   238  C  CB   . ALA   A 1 36  ? -5.20422  -18.37394 -8.80728  1.000 24.09389 ? 59  ALA   A CB   1 ? 
ATOM   239  N  N    . SER   A 1 37  ? -5.98792  -17.03526 -5.97369  1.000 19.63850 ? 60  SER   A N    1 ? 
ATOM   240  C  CA   . SER   A 1 37  ? -6.23453  -15.80484 -5.23245  1.000 25.03550 ? 60  SER   A CA   1 ? 
ATOM   241  C  C    . SER   A 1 37  ? -5.81691  -14.58313 -6.03215  1.000 18.27235 ? 60  SER   A C    1 ? 
ATOM   242  O  O    . SER   A 1 37  ? -6.44737  -13.52375 -5.93183  1.000 23.29264 ? 60  SER   A O    1 ? 
ATOM   243  C  CB   . SER   A 1 37  ? -5.48588  -15.82652 -3.89597  1.000 26.95216 ? 60  SER   A CB   1 ? 
ATOM   244  O  OG   . SER   A 1 37  ? -4.08443  -15.85670 -4.10596  1.000 27.42107 ? 60  SER   A OG   1 ? 
ATOM   245  N  N    . GLY   A 1 38  ? -4.76696  -14.70387 -6.83591  1.000 14.17108 ? 61  GLY   A N    1 ? 
ATOM   246  C  CA   . GLY   A 1 38  ? -4.21692  -13.55251 -7.52038  1.000 14.30904 ? 61  GLY   A CA   1 ? 
ATOM   247  C  C    . GLY   A 1 38  ? -3.05656  -12.94475 -6.75058  1.000 15.72044 ? 61  GLY   A C    1 ? 
ATOM   248  O  O    . GLY   A 1 38  ? -2.79374  -13.27269 -5.59368  1.000 16.93470 ? 61  GLY   A O    1 ? 
ATOM   249  N  N    . THR   A 1 39  ? -2.35032  -12.03258 -7.41459  1.000 12.14652 ? 62  THR   A N    1 ? 
ATOM   250  C  CA   . THR   A 1 39  ? -1.13884  -11.44277 -6.85388  1.000 12.63894 ? 62  THR   A CA   1 ? 
ATOM   251  C  C    . THR   A 1 39  ? -1.40688  -10.00120 -6.40398  1.000 12.28190 ? 62  THR   A C    1 ? 
ATOM   252  O  O    . THR   A 1 39  ? -2.56144  -9.59602  -6.23041  1.000 12.96778 ? 62  THR   A O    1 ? 
ATOM   253  C  CB   . THR   A 1 39  ? 0.02172   -11.59444 -7.84806  1.000 14.30634 ? 62  THR   A CB   1 ? 
ATOM   254  O  OG1  . THR   A 1 39  ? 1.24823   -11.16653 -7.22905  1.000 14.76718 ? 62  THR   A OG1  1 ? 
ATOM   255  C  CG2  . THR   A 1 39  ? -0.22835  -10.78084 -9.11718  1.000 15.08686 ? 62  THR   A CG2  1 ? 
ATOM   256  N  N    . SER   A 1 40  ? -0.33800  -9.23874  -6.19136  1.000 14.00339 ? 63  SER   A N    1 ? 
ATOM   257  C  CA   . SER   A 1 40  ? -0.47607  -7.87725  -5.69598  1.000 14.54087 ? 63  SER   A CA   1 ? 
ATOM   258  C  C    . SER   A 1 40  ? 0.82016   -7.14013  -5.97741  1.000 13.46515 ? 63  SER   A C    1 ? 
ATOM   259  O  O    . SER   A 1 40  ? 1.86417   -7.75646  -6.19936  1.000 13.92450 ? 63  SER   A O    1 ? 
ATOM   260  C  CB   . SER   A 1 40  ? -0.77664  -7.84705  -4.18777  1.000 14.69441 ? 63  SER   A CB   1 ? 
ATOM   261  O  OG   . SER   A 1 40  ? 0.24003   -8.53156  -3.46333  1.000 18.82075 ? 63  SER   A OG   1 ? 
ATOM   262  N  N    . THR   A 1 41  ? 0.74384   -5.81385  -5.96828  1.000 12.90101 ? 64  THR   A N    1 ? 
ATOM   263  C  CA   . THR   A 1 41  ? 1.97195   -5.03255  -6.04232  1.000 14.06847 ? 64  THR   A CA   1 ? 
ATOM   264  C  C    . THR   A 1 41  ? 2.66129   -5.02467  -4.67961  1.000 16.53639 ? 64  THR   A C    1 ? 
ATOM   265  O  O    . THR   A 1 41  ? 2.08914   -5.42094  -3.66449  1.000 16.53981 ? 64  THR   A O    1 ? 
ATOM   266  C  CB   . THR   A 1 41  ? 1.68359   -3.59238  -6.45958  1.000 14.35876 ? 64  THR   A CB   1 ? 
ATOM   267  O  OG1  . THR   A 1 41  ? 1.02286   -2.91331  -5.38943  1.000 14.73046 ? 64  THR   A OG1  1 ? 
ATOM   268  C  CG2  . THR   A 1 41  ? 0.83064   -3.52588  -7.73141  1.000 15.43897 ? 64  THR   A CG2  1 ? 
ATOM   269  N  N    . ASN   A 1 42  ? 3.91580   -4.55972  -4.66713  1.000 18.54057 ? 65  ASN   A N    1 ? 
ATOM   270  C  CA   . ASN   A 1 42  ? 4.64305   -4.46568  -3.40458  1.000 20.68219 ? 65  ASN   A CA   1 ? 
ATOM   271  C  C    . ASN   A 1 42  ? 3.91958   -3.57919  -2.39655  1.000 21.17707 ? 65  ASN   A C    1 ? 
ATOM   272  O  O    . ASN   A 1 42  ? 4.02917   -3.80626  -1.18610  1.000 26.51596 ? 65  ASN   A O    1 ? 
ATOM   273  C  CB   . ASN   A 1 42  ? 6.07000   -3.96353  -3.63484  1.000 20.32627 ? 65  ASN   A CB   1 ? 
ATOM   274  C  CG   . ASN   A 1 42  ? 6.92793   -4.96060  -4.38822  1.000 21.66816 ? 65  ASN   A CG   1 ? 
ATOM   275  O  OD1  . ASN   A 1 42  ? 6.63533   -6.15711  -4.41821  1.000 25.78705 ? 65  ASN   A OD1  1 ? 
ATOM   276  N  ND2  . ASN   A 1 42  ? 8.00930   -4.47329  -4.99269  1.000 30.08548 ? 65  ASN   A ND2  1 ? 
ATOM   277  N  N    . SER   A 1 43  ? 3.18075   -2.57042  -2.86231  1.000 18.37837 ? 66  SER   A N    1 ? 
ATOM   278  C  CA   . SER   A 1 43  ? 2.44154   -1.71028  -1.94884  1.000 20.38959 ? 66  SER   A CA   1 ? 
ATOM   279  C  C    . SER   A 1 43  ? 1.13761   -2.33789  -1.47051  1.000 21.97020 ? 66  SER   A C    1 ? 
ATOM   280  O  O    . SER   A 1 43  ? 0.47341   -1.76561  -0.60136  1.000 23.11445 ? 66  SER   A O    1 ? 
ATOM   281  C  CB   . SER   A 1 43  ? 2.16435   -0.34851  -2.59089  1.000 24.06937 ? 66  SER   A CB   1 ? 
ATOM   282  O  OG   . SER   A 1 43  ? 1.17864   -0.45418  -3.60302  1.000 26.70186 ? 66  SER   A OG   1 ? 
ATOM   283  N  N    . GLY   A 1 44  ? 0.75192   -3.49449  -2.00336  1.000 18.79434 ? 67  GLY   A N    1 ? 
ATOM   284  C  CA   . GLY   A 1 44  ? -0.45212  -4.16715  -1.55856  1.000 18.22235 ? 67  GLY   A CA   1 ? 
ATOM   285  C  C    . GLY   A 1 44  ? -1.66093  -4.02475  -2.45974  1.000 18.91411 ? 67  GLY   A C    1 ? 
ATOM   286  O  O    . GLY   A 1 44  ? -2.72011  -4.57193  -2.13023  1.000 19.84483 ? 67  GLY   A O    1 ? 
ATOM   287  N  N    . TYR   A 1 45  ? -1.54063  -3.31894  -3.57438  1.000 14.86304 ? 68  TYR   A N    1 ? 
ATOM   288  C  CA   . TYR   A 1 45  ? -2.65845  -3.16136  -4.49716  1.000 13.90377 ? 68  TYR   A CA   1 ? 
ATOM   289  C  C    . TYR   A 1 45  ? -2.94587  -4.51074  -5.14226  1.000 14.90009 ? 68  TYR   A C    1 ? 
ATOM   290  O  O    . TYR   A 1 45  ? -2.07239  -5.05048  -5.83606  1.000 12.86342 ? 68  TYR   A O    1 ? 
ATOM   291  C  CB   . TYR   A 1 45  ? -2.27535  -2.14040  -5.55733  1.000 13.02777 ? 68  TYR   A CB   1 ? 
ATOM   292  C  CG   . TYR   A 1 45  ? -3.37238  -1.80754  -6.55323  1.000 13.07409 ? 68  TYR   A CG   1 ? 
ATOM   293  C  CD1  . TYR   A 1 45  ? -4.62726  -1.40419  -6.13159  1.000 14.40341 ? 68  TYR   A CD1  1 ? 
ATOM   294  C  CD2  . TYR   A 1 45  ? -3.12952  -1.87245  -7.92371  1.000 14.28000 ? 68  TYR   A CD2  1 ? 
ATOM   295  C  CE1  . TYR   A 1 45  ? -5.62680  -1.08216  -7.05271  1.000 14.16025 ? 68  TYR   A CE1  1 ? 
ATOM   296  C  CE2  . TYR   A 1 45  ? -4.11721  -1.55899  -8.83636  1.000 13.56286 ? 68  TYR   A CE2  1 ? 
ATOM   297  C  CZ   . TYR   A 1 45  ? -5.35329  -1.16872  -8.40223  1.000 12.24168 ? 68  TYR   A CZ   1 ? 
ATOM   298  O  OH   . TYR   A 1 45  ? -6.33579  -0.85233  -9.32049  1.000 14.54479 ? 68  TYR   A OH   1 ? 
ATOM   299  N  N    . PRO   A 1 46  ? -4.12628  -5.09384  -4.93482  1.000 12.15610 ? 69  PRO   A N    1 ? 
ATOM   300  C  CA   . PRO   A 1 46  ? -4.36886  -6.46760  -5.38741  1.000 13.17701 ? 69  PRO   A CA   1 ? 
ATOM   301  C  C    . PRO   A 1 46  ? -4.71962  -6.56564  -6.86488  1.000 11.41976 ? 69  PRO   A C    1 ? 
ATOM   302  O  O    . PRO   A 1 46  ? -5.42446  -5.72080  -7.43297  1.000 11.26036 ? 69  PRO   A O    1 ? 
ATOM   303  C  CB   . PRO   A 1 46  ? -5.57632  -6.92220  -4.54794  1.000 14.78251 ? 69  PRO   A CB   1 ? 
ATOM   304  C  CG   . PRO   A 1 46  ? -5.95682  -5.76425  -3.67057  1.000 18.26782 ? 69  PRO   A CG   1 ? 
ATOM   305  C  CD   . PRO   A 1 46  ? -5.25505  -4.54465  -4.17301  1.000 14.75584 ? 69  PRO   A CD   1 ? 
ATOM   306  N  N    . GLU   A 1 47  ? -4.27853  -7.68120  -7.45363  1.000 11.13538 ? 70  GLU   A N    1 ? 
ATOM   307  C  CA   . GLU   A 1 47  ? -4.63256  -8.01550  -8.83257  1.000 9.96524  ? 70  GLU   A CA   1 ? 
ATOM   308  C  C    . GLU   A 1 47  ? -6.13545  -7.91995  -9.06786  1.000 10.64693 ? 70  GLU   A C    1 ? 
ATOM   309  O  O    . GLU   A 1 47  ? -6.57782  -7.35961  -10.07496 1.000 10.08173 ? 70  GLU   A O    1 ? 
ATOM   310  C  CB   . GLU   A 1 47  ? -4.11482  -9.41260  -9.18353  1.000 10.04911 ? 70  GLU   A CB   1 ? 
ATOM   311  C  CG   . GLU   A 1 47  ? -4.38584  -9.78061  -10.63416 1.000 11.87423 ? 70  GLU   A CG   1 ? 
ATOM   312  C  CD   . GLU   A 1 47  ? -3.95878  -11.18919 -10.95583 1.000 11.84528 ? 70  GLU   A CD   1 ? 
ATOM   313  O  OE1  . GLU   A 1 47  ? -3.34760  -11.85851 -10.08741 1.000 11.63924 ? 70  GLU   A OE1  1 ? 
ATOM   314  O  OE2  . GLU   A 1 47  ? -4.21858  -11.63928 -12.09795 1.000 11.00387 ? 70  GLU   A OE2  1 ? 
ATOM   315  N  N    . HIS   A 1 48  ? -6.94564  -8.49406  -8.17043  1.000 9.92792  ? 71  HIS   A N    1 ? 
ATOM   316  C  CA   . HIS   A 1 48  ? -8.38137  -8.50723  -8.41576  1.000 9.51173  ? 71  HIS   A CA   1 ? 
ATOM   317  C  C    . HIS   A 1 48  ? -8.95399  -7.10077  -8.52164  1.000 10.31540 ? 71  HIS   A C    1 ? 
ATOM   318  O  O    . HIS   A 1 48  ? -9.92031  -6.87977  -9.26264  1.000 10.95108 ? 71  HIS   A O    1 ? 
ATOM   319  C  CB   . HIS   A 1 48  ? -9.10279  -9.34554  -7.35500  1.000 10.57663 ? 71  HIS   A CB   1 ? 
ATOM   320  C  CG   . HIS   A 1 48  ? -9.16910  -8.70834  -5.99835  1.000 11.81813 ? 71  HIS   A CG   1 ? 
ATOM   321  N  ND1  . HIS   A 1 48  ? -10.13292 -7.78197  -5.65688  1.000 11.80822 ? 71  HIS   A ND1  1 ? 
ATOM   322  C  CD2  . HIS   A 1 48  ? -8.40452  -8.88290  -4.89179  1.000 11.71089 ? 71  HIS   A CD2  1 ? 
ATOM   323  C  CE1  . HIS   A 1 48  ? -9.95715  -7.40967  -4.39860  1.000 13.32579 ? 71  HIS   A CE1  1 ? 
ATOM   324  N  NE2  . HIS   A 1 48  ? -8.91189  -8.05658  -3.91317  1.000 13.74268 ? 71  HIS   A NE2  1 ? 
ATOM   325  N  N    . THR   A 1 49  ? -8.37630  -6.13174  -7.80986  1.000 10.67403 ? 72  THR   A N    1 ? 
ATOM   326  C  CA   . THR   A 1 49  ? -8.89126  -4.76959  -7.93457  1.000 10.93227 ? 72  THR   A CA   1 ? 
ATOM   327  C  C    . THR   A 1 49  ? -8.36193  -4.10245  -9.19536  1.000 10.08866 ? 72  THR   A C    1 ? 
ATOM   328  O  O    . THR   A 1 49  ? -9.09245  -3.36244  -9.86599  1.000 11.17296 ? 72  THR   A O    1 ? 
ATOM   329  C  CB   . THR   A 1 49  ? -8.52983  -3.95758  -6.69084  1.000 11.09387 ? 72  THR   A CB   1 ? 
ATOM   330  O  OG1  . THR   A 1 49  ? -9.09601  -4.60051  -5.54031  1.000 12.33492 ? 72  THR   A OG1  1 ? 
ATOM   331  C  CG2  . THR   A 1 49  ? -9.06466  -2.52444  -6.80194  1.000 12.06354 ? 72  THR   A CG2  1 ? 
ATOM   332  N  N    . PHE   A 1 50  ? -7.09827  -4.35936  -9.54190  1.000 10.53223 ? 73  PHE   A N    1 ? 
ATOM   333  C  CA   . PHE   A 1 50  ? -6.56339  -3.84830  -10.79783 1.000 10.74664 ? 73  PHE   A CA   1 ? 
ATOM   334  C  C    . PHE   A 1 50  ? -7.40114  -4.32399  -11.98088 1.000 10.57159 ? 73  PHE   A C    1 ? 
ATOM   335  O  O    . PHE   A 1 50  ? -7.73170  -3.54319  -12.88135 1.000 9.94701  ? 73  PHE   A O    1 ? 
ATOM   336  C  CB   . PHE   A 1 50  ? -5.11392  -4.30574  -10.97609 1.000 12.12051 ? 73  PHE   A CB   1 ? 
ATOM   337  C  CG   . PHE   A 1 50  ? -4.59762  -4.11280  -12.37416 1.000 10.29977 ? 73  PHE   A CG   1 ? 
ATOM   338  C  CD1  . PHE   A 1 50  ? -4.44293  -2.83171  -12.90089 1.000 11.61073 ? 73  PHE   A CD1  1 ? 
ATOM   339  C  CD2  . PHE   A 1 50  ? -4.30786  -5.20069  -13.17228 1.000 10.58689 ? 73  PHE   A CD2  1 ? 
ATOM   340  C  CE1  . PHE   A 1 50  ? -3.97161  -2.65151  -14.19574 1.000 11.07863 ? 73  PHE   A CE1  1 ? 
ATOM   341  C  CE2  . PHE   A 1 50  ? -3.84695  -5.02860  -14.47437 1.000 12.09363 ? 73  PHE   A CE2  1 ? 
ATOM   342  C  CZ   . PHE   A 1 50  ? -3.68322  -3.74820  -14.97947 1.000 10.81065 ? 73  PHE   A CZ   1 ? 
ATOM   343  N  N    . THR   A 1 51  ? -7.72931  -5.61422  -12.02124 1.000 10.61994 ? 74  THR   A N    1 ? 
ATOM   344  C  CA   . THR   A 1 51  ? -8.46488  -6.11879  -13.17786 1.000 9.49291  ? 74  THR   A CA   1 ? 
ATOM   345  C  C    . THR   A 1 51  ? -9.89481  -5.59453  -13.18393 1.000 9.91687  ? 74  THR   A C    1 ? 
ATOM   346  O  O    . THR   A 1 51  ? -10.44805 -5.30137  -14.25154 1.000 9.70539  ? 74  THR   A O    1 ? 
ATOM   347  C  CB   . THR   A 1 51  ? -8.45787  -7.65372  -13.18790 1.000 8.48755  ? 74  THR   A CB   1 ? 
ATOM   348  O  OG1  . THR   A 1 51  ? -9.17875  -8.12948  -12.04238 1.000 9.73716  ? 74  THR   A OG1  1 ? 
ATOM   349  C  CG2  . THR   A 1 51  ? -7.02949  -8.20205  -13.19274 1.000 9.67233  ? 74  THR   A CG2  1 ? 
ATOM   350  N  N    . TRP   A 1 52  ? -10.51005 -5.46821  -12.00111 1.000 9.39859  ? 75  TRP   A N    1 ? 
ATOM   351  C  CA   . TRP   A 1 52  ? -11.84572 -4.88370  -11.90335 1.000 9.50894  ? 75  TRP   A CA   1 ? 
ATOM   352  C  C    . TRP   A 1 52  ? -11.85746 -3.44216  -12.39702 1.000 10.89461 ? 75  TRP   A C    1 ? 
ATOM   353  O  O    . TRP   A 1 52  ? -12.67194 -3.07274  -13.25481 1.000 10.99377 ? 75  TRP   A O    1 ? 
ATOM   354  C  CB   . TRP   A 1 52  ? -12.32615 -4.96279  -10.45308 1.000 10.20928 ? 75  TRP   A CB   1 ? 
ATOM   355  C  CG   . TRP   A 1 52  ? -13.65665 -4.31382  -10.22942 1.000 10.46319 ? 75  TRP   A CG   1 ? 
ATOM   356  C  CD1  . TRP   A 1 52  ? -13.89412 -3.15167  -9.56680  1.000 13.09603 ? 75  TRP   A CD1  1 ? 
ATOM   357  C  CD2  . TRP   A 1 52  ? -14.92879 -4.80606  -10.66435 1.000 10.45991 ? 75  TRP   A CD2  1 ? 
ATOM   358  N  NE1  . TRP   A 1 52  ? -15.24693 -2.88730  -9.55823  1.000 14.00829 ? 75  TRP   A NE1  1 ? 
ATOM   359  C  CE2  . TRP   A 1 52  ? -15.90415 -3.88665  -10.22422 1.000 12.48467 ? 75  TRP   A CE2  1 ? 
ATOM   360  C  CE3  . TRP   A 1 52  ? -15.33922 -5.93640  -11.38443 1.000 10.22897 ? 75  TRP   A CE3  1 ? 
ATOM   361  C  CZ2  . TRP   A 1 52  ? -17.26805 -4.05522  -10.48171 1.000 13.25622 ? 75  TRP   A CZ2  1 ? 
ATOM   362  C  CZ3  . TRP   A 1 52  ? -16.69105 -6.10217  -11.64338 1.000 12.74240 ? 75  TRP   A CZ3  1 ? 
ATOM   363  C  CH2  . TRP   A 1 52  ? -17.64273 -5.16302  -11.19089 1.000 12.89946 ? 75  TRP   A CH2  1 ? 
ATOM   364  N  N    . GLU   A 1 53  ? -10.94747 -2.61102  -11.87555 1.000 10.86640 ? 76  GLU   A N    1 ? 
ATOM   365  C  CA   . GLU   A 1 53  ? -10.96742 -1.19358  -12.22516 1.000 12.26166 ? 76  GLU   A CA   1 ? 
ATOM   366  C  C    . GLU   A 1 53  ? -10.61935 -0.98577  -13.69502 1.000 11.36974 ? 76  GLU   A C    1 ? 
ATOM   367  O  O    . GLU   A 1 53  ? -11.27005 -0.19689  -14.38936 1.000 12.30842 ? 76  GLU   A O    1 ? 
ATOM   368  C  CB   . GLU   A 1 53  ? -10.06515 -0.40134  -11.27411 1.000 12.35474 ? 76  GLU   A CB   1 ? 
ATOM   369  C  CG   . GLU   A 1 53  ? -10.60014 -0.45589  -9.83099  1.000 13.69011 ? 76  GLU   A CG   1 ? 
ATOM   370  C  CD   . GLU   A 1 53  ? -9.79356  0.30324   -8.78526  1.000 19.85553 ? 76  GLU   A CD   1 ? 
ATOM   371  O  OE1  . GLU   A 1 53  ? -8.56062  0.48187   -8.92094  1.000 22.46381 ? 76  GLU   A OE1  1 ? 
ATOM   372  O  OE2  . GLU   A 1 53  ? -10.42206 0.72129   -7.78410  1.000 24.13550 ? 76  GLU   A OE2  1 ? 
ATOM   373  N  N    . THR   A 1 54  ? -9.64656  -1.73426  -14.20574 1.000 10.90926 ? 77  THR   A N    1 ? 
ATOM   374  C  CA   . THR   A 1 54  ? -9.33890  -1.66016  -15.62820 1.000 9.71975  ? 77  THR   A CA   1 ? 
ATOM   375  C  C    . THR   A 1 54  ? -10.50396 -2.18288  -16.45679 1.000 11.04425 ? 77  THR   A C    1 ? 
ATOM   376  O  O    . THR   A 1 54  ? -10.84115 -1.60211  -17.49652 1.000 11.03300 ? 77  THR   A O    1 ? 
ATOM   377  C  CB   . THR   A 1 54  ? -8.04086  -2.41695  -15.91459 1.000 10.13619 ? 77  THR   A CB   1 ? 
ATOM   378  O  OG1  . THR   A 1 54  ? -7.00618  -1.89613  -15.07612 1.000 11.82711 ? 77  THR   A OG1  1 ? 
ATOM   379  C  CG2  . THR   A 1 54  ? -7.60409  -2.25312  -17.37135 1.000 11.57354 ? 77  THR   A CG2  1 ? 
ATOM   380  N  N    . GLY   A 1 55  ? -11.14066 -3.26531  -15.99902 1.000 10.99605 ? 78  GLY   A N    1 ? 
ATOM   381  C  CA   . GLY   A 1 55  ? -12.27045 -3.82551  -16.72650 1.000 11.36603 ? 78  GLY   A CA   1 ? 
ATOM   382  C  C    . GLY   A 1 55  ? -13.42943 -2.85913  -16.85077 1.000 11.20387 ? 78  GLY   A C    1 ? 
ATOM   383  O  O    . GLY   A 1 55  ? -14.10625 -2.81800  -17.88394 1.000 11.68233 ? 78  GLY   A O    1 ? 
ATOM   384  N  N    . LEU   A 1 56  ? -13.67609 -2.06998  -15.79943 1.000 10.98531 ? 79  LEU   A N    1 ? 
ATOM   385  C  CA   . LEU   A 1 56  ? -14.73774 -1.06565  -15.87094 1.000 11.46853 ? 79  LEU   A CA   1 ? 
ATOM   386  C  C    . LEU   A 1 56  ? -14.40771 0.00795   -16.89949 1.000 12.74989 ? 79  LEU   A C    1 ? 
ATOM   387  O  O    . LEU   A 1 56  ? -15.30148 0.50043   -17.60051 1.000 12.00588 ? 79  LEU   A O    1 ? 
ATOM   388  C  CB   . LEU   A 1 56  ? -14.96884 -0.43962  -14.49385 1.000 12.15569 ? 79  LEU   A CB   1 ? 
ATOM   389  C  CG   . LEU   A 1 56  ? -15.60388 -1.36301  -13.44822 1.000 12.74816 ? 79  LEU   A CG   1 ? 
ATOM   390  C  CD1  . LEU   A 1 56  ? -15.88093 -0.60351  -12.13663 1.000 15.50137 ? 79  LEU   A CD1  1 ? 
ATOM   391  C  CD2  . LEU   A 1 56  ? -16.86413 -1.99136  -13.97387 1.000 16.69036 ? 79  LEU   A CD2  1 ? 
ATOM   392  N  N    . ARG   A 1 57  ? -13.13378 0.39159   -17.00388 1.000 12.07126 ? 80  ARG   A N    1 ? 
ATOM   393  C  CA   . ARG   A 1 57  ? -12.74982 1.35695   -18.03440 1.000 12.85538 ? 80  ARG   A CA   1 ? 
ATOM   394  C  C    . ARG   A 1 57  ? -12.88689 0.75781   -19.43113 1.000 13.16157 ? 80  ARG   A C    1 ? 
ATOM   395  O  O    . ARG   A 1 57  ? -13.30973 1.44399   -20.37258 1.000 13.29760 ? 80  ARG   A O    1 ? 
ATOM   396  C  CB   . ARG   A 1 57  ? -11.32389 1.87249   -17.80314 1.000 13.43572 ? 80  ARG   A CB   1 ? 
ATOM   397  C  CG   . ARG   A 1 57  ? -11.07617 2.61917   -16.48657 1.000 16.52257 ? 80  ARG   A CG   1 ? 
ATOM   398  C  CD   . ARG   A 1 57  ? -12.19611 3.57682   -16.15759 1.000 19.83850 ? 80  ARG   A CD   1 ? 
ATOM   399  N  NE   . ARG   A 1 57  ? -12.47523 4.47090   -17.27488 1.000 21.56937 ? 80  ARG   A NE   1 ? 
ATOM   400  C  CZ   . ARG   A 1 57  ? -13.64356 5.06149   -17.48125 1.000 24.92430 ? 80  ARG   A CZ   1 ? 
ATOM   401  N  NH1  . ARG   A 1 57  ? -14.66560 4.87556   -16.65921 1.000 21.30023 ? 80  ARG   A NH1  1 ? 
ATOM   402  N  NH2  . ARG   A 1 57  ? -13.79807 5.83542   -18.55438 1.000 21.23913 ? 80  ARG   A NH2  1 ? 
ATOM   403  N  N    . LEU   A 1 58  ? -12.52084 -0.51514  -19.59738 1.000 10.70594 ? 81  LEU   A N    1 ? 
ATOM   404  C  CA   . LEU   A 1 58  ? -12.74640 -1.18334  -20.87039 1.000 10.96419 ? 81  LEU   A CA   1 ? 
ATOM   405  C  C    . LEU   A 1 58  ? -14.22909 -1.22511  -21.21219 1.000 10.53644 ? 81  LEU   A C    1 ? 
ATOM   406  O  O    . LEU   A 1 58  ? -14.61139 -0.96153  -22.35829 1.000 11.44932 ? 81  LEU   A O    1 ? 
ATOM   407  C  CB   . LEU   A 1 58  ? -12.15514 -2.59552  -20.84043 1.000 10.96457 ? 81  LEU   A CB   1 ? 
ATOM   408  C  CG   . LEU   A 1 58  ? -12.44141 -3.43510  -22.08862 1.000 10.28916 ? 81  LEU   A CG   1 ? 
ATOM   409  C  CD1  . LEU   A 1 58  ? -11.96240 -2.73425  -23.35549 1.000 12.27479 ? 81  LEU   A CD1  1 ? 
ATOM   410  C  CD2  . LEU   A 1 58  ? -11.78601 -4.82084  -21.95463 1.000 12.16861 ? 81  LEU   A CD2  1 ? 
ATOM   411  N  N    . ARG   A 1 59  ? -15.07829 -1.56176  -20.23441 1.000 11.17208 ? 82  ARG   A N    1 ? 
ATOM   412  C  CA   . ARG   A 1 59  ? -16.51977 -1.55079  -20.46204 1.000 11.69376 ? 82  ARG   A CA   1 ? 
ATOM   413  C  C    . ARG   A 1 59  ? -16.98637 -0.18018  -20.93287 1.000 11.93451 ? 82  ARG   A C    1 ? 
ATOM   414  O  O    . ARG   A 1 59  ? -17.72948 -0.07184  -21.91488 1.000 13.05809 ? 82  ARG   A O    1 ? 
ATOM   415  C  CB   . ARG   A 1 59  ? -17.25449 -1.95883  -19.18802 1.000 12.54010 ? 82  ARG   A CB   1 ? 
ATOM   416  C  CG   . ARG   A 1 59  ? -18.76166 -1.81121  -19.35781 1.000 15.25387 ? 82  ARG   A CG   1 ? 
ATOM   417  C  CD   . ARG   A 1 59  ? -19.53538 -2.60006  -18.33245 1.000 25.45937 ? 82  ARG   A CD   1 ? 
ATOM   418  N  NE   . ARG   A 1 59  ? -19.73736 -1.84661  -17.10551 1.000 34.76568 ? 82  ARG   A NE   1 ? 
ATOM   419  C  CZ   . ARG   A 1 59  ? -20.61284 -2.17294  -16.16502 1.000 39.41193 ? 82  ARG   A CZ   1 ? 
ATOM   420  N  NH1  . ARG   A 1 59  ? -21.38364 -3.24502  -16.27892 1.000 33.23159 ? 82  ARG   A NH1  1 ? 
ATOM   421  N  NH2  . ARG   A 1 59  ? -20.72445 -1.40049  -15.08773 1.000 33.25085 ? 82  ARG   A NH2  1 ? 
ATOM   422  N  N    . ALA   A 1 60  ? -16.55081 0.88603   -20.25417 1.000 12.08363 ? 83  ALA   A N    1 ? 
ATOM   423  C  CA   . ALA   A 1 60  ? -16.98072 2.22411   -20.65966 1.000 13.08467 ? 83  ALA   A CA   1 ? 
ATOM   424  C  C    . ALA   A 1 60  ? -16.55754 2.53007   -22.08649 1.000 13.05739 ? 83  ALA   A C    1 ? 
ATOM   425  O  O    . ALA   A 1 60  ? -17.32033 3.14213   -22.84956 1.000 15.82515 ? 83  ALA   A O    1 ? 
ATOM   426  C  CB   . ALA   A 1 60  ? -16.42416 3.27496   -19.70062 1.000 14.04939 ? 83  ALA   A CB   1 ? 
ATOM   427  N  N    . ALA   A 1 61  ? -15.35061 2.11262   -22.46719 1.000 11.27731 ? 84  ALA   A N    1 ? 
ATOM   428  C  CA   . ALA   A 1 61  ? -14.86014 2.37299   -23.81651 1.000 13.43186 ? 84  ALA   A CA   1 ? 
ATOM   429  C  C    . ALA   A 1 61  ? -15.66954 1.61555   -24.86100 1.000 14.68186 ? 84  ALA   A C    1 ? 
ATOM   430  O  O    . ALA   A 1 61  ? -16.05185 2.18271   -25.89347 1.000 14.98241 ? 84  ALA   A O    1 ? 
ATOM   431  C  CB   . ALA   A 1 61  ? -13.37792 2.01224   -23.91261 1.000 14.41421 ? 84  ALA   A CB   1 ? 
ATOM   432  N  N    . LEU   A 1 62  ? -15.92351 0.32384   -24.62591 1.000 13.50886 ? 85  LEU   A N    1 ? 
ATOM   433  C  CA   . LEU   A 1 62  ? -16.73349 -0.44927  -25.55596 1.000 12.83630 ? 85  LEU   A CA   1 ? 
ATOM   434  C  C    . LEU   A 1 62  ? -18.14069 0.11341   -25.65863 1.000 16.35449 ? 85  LEU   A C    1 ? 
ATOM   435  O  O    . LEU   A 1 62  ? -18.69789 0.20567   -26.75922 1.000 16.01167 ? 85  LEU   A O    1 ? 
ATOM   436  C  CB   . LEU   A 1 62  ? -16.77907 -1.91496  -25.12648 1.000 12.08969 ? 85  LEU   A CB   1 ? 
ATOM   437  C  CG   . LEU   A 1 62  ? -15.45573 -2.62992  -25.41297 1.000 11.78426 ? 85  LEU   A CG   1 ? 
ATOM   438  C  CD1  . LEU   A 1 62  ? -15.41381 -3.96654  -24.66933 1.000 12.77133 ? 85  LEU   A CD1  1 ? 
ATOM   439  C  CD2  . LEU   A 1 62  ? -15.27752 -2.84158  -26.91325 1.000 15.22201 ? 85  LEU   A CD2  1 ? 
ATOM   440  N  N    . ASN   A 1 63  ? -18.74175 0.47724   -24.52564 1.000 15.27089 ? 86  ASN   A N    1 ? 
ATOM   441  C  CA   . ASN   A 1 63  ? -20.08724 1.04473   -24.57110 1.000 17.72040 ? 86  ASN   A CA   1 ? 
ATOM   442  C  C    . ASN   A 1 63  ? -20.11049 2.33140   -25.38124 1.000 21.46595 ? 86  ASN   A C    1 ? 
ATOM   443  O  O    . ASN   A 1 63  ? -21.07950 2.60005   -26.10411 1.000 21.43947 ? 86  ASN   A O    1 ? 
ATOM   444  C  CB   . ASN   A 1 63  ? -20.59023 1.31432   -23.15884 1.000 15.83855 ? 86  ASN   A CB   1 ? 
ATOM   445  C  CG   . ASN   A 1 63  ? -20.85611 0.05113   -22.38508 1.000 18.88263 ? 86  ASN   A CG   1 ? 
ATOM   446  O  OD1  . ASN   A 1 63  ? -20.89543 -1.05329  -22.94492 1.000 25.59020 ? 86  ASN   A OD1  1 ? 
ATOM   447  N  ND2  . ASN   A 1 63  ? -21.04100 0.19797   -21.08010 1.000 19.93661 ? 86  ASN   A ND2  1 ? 
ATOM   448  N  N    . ALA   A 1 64  ? -19.05415 3.14245   -25.27236 1.000 16.78266 ? 87  ALA   A N    1 ? 
ATOM   449  C  CA   . ALA   A 1 64  ? -18.98406 4.36722   -26.06437 1.000 18.86735 ? 87  ALA   A CA   1 ? 
ATOM   450  C  C    . ALA   A 1 64  ? -19.05481 4.06654   -27.55551 1.000 23.58983 ? 87  ALA   A C    1 ? 
ATOM   451  O  O    . ALA   A 1 64  ? -19.56041 4.88602   -28.33070 1.000 23.90170 ? 87  ALA   A O    1 ? 
ATOM   452  C  CB   . ALA   A 1 64  ? -17.72051 5.15619   -25.72142 1.000 20.07109 ? 87  ALA   A CB   1 ? 
ATOM   453  N  N    . LEU   A 1 65  ? -18.56298 2.89941   -27.97265 1.000 20.45670 ? 88  LEU   A N    1 ? 
ATOM   454  C  CA   . LEU   A 1 65  ? -18.63081 2.45150   -29.35896 1.000 21.52405 ? 88  LEU   A CA   1 ? 
ATOM   455  C  C    . LEU   A 1 65  ? -19.95528 1.79418   -29.71661 1.000 22.10844 ? 88  LEU   A C    1 ? 
ATOM   456  O  O    . LEU   A 1 65  ? -20.11976 1.36576   -30.86351 1.000 30.86122 ? 88  LEU   A O    1 ? 
ATOM   457  C  CB   . LEU   A 1 65  ? -17.51842 1.43233   -29.62561 1.000 22.38503 ? 88  LEU   A CB   1 ? 
ATOM   458  C  CG   . LEU   A 1 65  ? -16.08798 1.93991   -29.73595 1.000 20.30491 ? 88  LEU   A CG   1 ? 
ATOM   459  C  CD1  . LEU   A 1 65  ? -15.17753 0.81362   -30.21057 1.000 20.61141 ? 88  LEU   A CD1  1 ? 
ATOM   460  C  CD2  . LEU   A 1 65  ? -15.99084 3.14654   -30.67469 1.000 23.85308 ? 88  LEU   A CD2  1 ? 
ATOM   461  N  N    . GLY   A 1 66  ? -20.88603 1.67007   -28.78115 1.000 20.69464 ? 89  GLY   A N    1 ? 
ATOM   462  C  CA   . GLY   A 1 66  ? -22.11571 0.96045   -29.05199 1.000 21.48769 ? 89  GLY   A CA   1 ? 
ATOM   463  C  C    . GLY   A 1 66  ? -22.01539 -0.53839  -28.91362 1.000 25.11901 ? 89  GLY   A C    1 ? 
ATOM   464  O  O    . GLY   A 1 66  ? -22.94981 -1.25139  -29.29755 1.000 26.20269 ? 89  GLY   A O    1 ? 
ATOM   465  N  N    . VAL   A 1 67  ? -20.91373 -1.04045  -28.37164 1.000 20.32469 ? 90  VAL   A N    1 ? 
ATOM   466  C  CA   . VAL   A 1 67  ? -20.72298 -2.46912  -28.17909 1.000 20.48178 ? 90  VAL   A CA   1 ? 
ATOM   467  C  C    . VAL   A 1 67  ? -21.33370 -2.85259  -26.83824 1.000 16.63444 ? 90  VAL   A C    1 ? 
ATOM   468  O  O    . VAL   A 1 67  ? -20.97990 -2.27956  -25.80157 1.000 23.95038 ? 90  VAL   A O    1 ? 
ATOM   469  C  CB   . VAL   A 1 67  ? -19.23253 -2.83056  -28.23516 1.000 19.33743 ? 90  VAL   A CB   1 ? 
ATOM   470  C  CG1  . VAL   A 1 67  ? -19.03922 -4.30661  -27.97263 1.000 19.59709 ? 90  VAL   A CG1  1 ? 
ATOM   471  C  CG2  . VAL   A 1 67  ? -18.65388 -2.44521  -29.57957 1.000 20.83841 ? 90  VAL   A CG2  1 ? 
ATOM   472  N  N    . ARG   A 1 68  ? -22.25763 -3.80385  -26.86747 1.000 16.86955 ? 91  ARG   A N    1 ? 
ATOM   473  C  CA   . ARG   A 1 68  ? -22.85362 -4.33635  -25.65135 1.000 16.88657 ? 91  ARG   A CA   1 ? 
ATOM   474  C  C    . ARG   A 1 68  ? -21.81271 -5.17969  -24.91650 1.000 20.56754 ? 91  ARG   A C    1 ? 
ATOM   475  O  O    . ARG   A 1 68  ? -20.98487 -5.85052  -25.54247 1.000 21.48660 ? 91  ARG   A O    1 ? 
ATOM   476  C  CB   . ARG   A 1 68  ? -24.09398 -5.16423  -26.01901 1.000 21.71830 ? 91  ARG   A CB   1 ? 
ATOM   477  C  CG   . ARG   A 1 68  ? -24.84736 -5.82728  -24.85906 1.000 28.06201 ? 91  ARG   A CG   1 ? 
ATOM   478  C  CD   . ARG   A 1 68  ? -26.35871 -6.05619  -25.15700 1.000 30.16058 ? 91  ARG   A CD   1 ? 
ATOM   479  N  NE   . ARG   A 1 68  ? -26.60692 -6.82925  -26.37214 1.000 29.45788 ? 91  ARG   A NE   1 ? 
ATOM   480  C  CZ   . ARG   A 1 68  ? -26.90879 -8.12195  -26.40234 1.000 36.84343 ? 91  ARG   A CZ   1 ? 
ATOM   481  N  NH1  . ARG   A 1 68  ? -27.03926 -8.83282  -25.28884 1.000 25.62885 ? 91  ARG   A NH1  1 ? 
ATOM   482  N  NH2  . ARG   A 1 68  ? -27.07304 -8.72159  -27.57988 1.000 35.18926 ? 91  ARG   A NH2  1 ? 
ATOM   483  N  N    . THR   A 1 69  ? -21.81558 -5.10968  -23.58621 1.000 16.11140 ? 92  THR   A N    1 ? 
ATOM   484  C  CA   . THR   A 1 69  ? -20.83662 -5.85001  -22.79463 1.000 14.50450 ? 92  THR   A CA   1 ? 
ATOM   485  C  C    . THR   A 1 69  ? -21.54973 -6.65768  -21.72501 1.000 14.60949 ? 92  THR   A C    1 ? 
ATOM   486  O  O    . THR   A 1 69  ? -22.70205 -6.38443  -21.36334 1.000 15.45456 ? 92  THR   A O    1 ? 
ATOM   487  C  CB   . THR   A 1 69  ? -19.79114 -4.94669  -22.11650 1.000 19.23495 ? 92  THR   A CB   1 ? 
ATOM   488  O  OG1  . THR   A 1 69  ? -20.45348 -3.98331  -21.29069 1.000 20.09158 ? 92  THR   A OG1  1 ? 
ATOM   489  C  CG2  . THR   A 1 69  ? -18.93077 -4.22661  -23.14088 1.000 18.75325 ? 92  THR   A CG2  1 ? 
ATOM   490  N  N    . ALA   A 1 70  ? -20.84643 -7.67380  -21.23847 1.000 12.75475 ? 93  ALA   A N    1 ? 
ATOM   491  C  CA   . ALA   A 1 70  ? -21.21476 -8.41837  -20.04674 1.000 11.95281 ? 93  ALA   A CA   1 ? 
ATOM   492  C  C    . ALA   A 1 70  ? -19.95130 -8.61334  -19.22589 1.000 11.99768 ? 93  ALA   A C    1 ? 
ATOM   493  O  O    . ALA   A 1 70  ? -18.84989 -8.69518  -19.77706 1.000 14.06035 ? 93  ALA   A O    1 ? 
ATOM   494  C  CB   . ALA   A 1 70  ? -21.77963 -9.80064  -20.38983 1.000 13.14611 ? 93  ALA   A CB   1 ? 
ATOM   495  N  N    . LEU   A 1 71  ? -20.10499 -8.67242  -17.90811 1.000 11.80817 ? 94  LEU   A N    1 ? 
ATOM   496  C  CA   . LEU   A 1 71  ? -18.99929 -8.89838  -16.98878 1.000 10.74446 ? 94  LEU   A CA   1 ? 
ATOM   497  C  C    . LEU   A 1 71  ? -19.13403 -10.26931 -16.34493 1.000 12.95619 ? 94  LEU   A C    1 ? 
ATOM   498  O  O    . LEU   A 1 71  ? -20.24195 -10.75310 -16.09270 1.000 13.38882 ? 94  LEU   A O    1 ? 
ATOM   499  C  CB   . LEU   A 1 71  ? -18.98302 -7.84289  -15.88285 1.000 11.40761 ? 94  LEU   A CB   1 ? 
ATOM   500  C  CG   . LEU   A 1 71  ? -18.78895 -6.39220  -16.28921 1.000 12.36903 ? 94  LEU   A CG   1 ? 
ATOM   501  C  CD1  . LEU   A 1 71  ? -18.89481 -5.47257  -15.07336 1.000 18.45854 ? 94  LEU   A CD1  1 ? 
ATOM   502  C  CD2  . LEU   A 1 71  ? -17.44898 -6.20124  -16.97271 1.000 20.49104 ? 94  LEU   A CD2  1 ? 
ATOM   503  N  N    . SER   A 1 72  ? -17.98369 -10.89391 -16.06344 1.000 9.50856  ? 95  SER   A N    1 ? 
ATOM   504  C  CA   . SER   A 1 72  ? -17.98838 -12.20225 -15.42126 1.000 10.49304 ? 95  SER   A CA   1 ? 
ATOM   505  C  C    . SER   A 1 72  ? -18.38440 -12.11562 -13.95571 1.000 10.43678 ? 95  SER   A C    1 ? 
ATOM   506  O  O    . SER   A 1 72  ? -18.78062 -13.13636 -13.37327 1.000 12.72988 ? 95  SER   A O    1 ? 
ATOM   507  C  CB   . SER   A 1 72  ? -16.60132 -12.84069 -15.53728 1.000 9.95561  ? 95  SER   A CB   1 ? 
ATOM   508  O  OG   . SER   A 1 72  ? -15.66589 -12.05645 -14.83231 1.000 9.82282  ? 95  SER   A OG   1 ? 
ATOM   509  N  N    . ARG   A 1 73  ? -18.26087 -10.93544 -13.35012 1.000 10.05717 ? 96  ARG   A N    1 ? 
ATOM   510  C  CA   . ARG   A 1 73  ? -18.60489 -10.71956 -11.95254 1.000 11.00460 ? 96  ARG   A CA   1 ? 
ATOM   511  C  C    . ARG   A 1 73  ? -19.11188 -9.29224  -11.82999 1.000 11.91978 ? 96  ARG   A C    1 ? 
ATOM   512  O  O    . ARG   A 1 73  ? -18.79821 -8.43711  -12.65371 1.000 12.77806 ? 96  ARG   A O    1 ? 
ATOM   513  C  CB   . ARG   A 1 73  ? -17.39646 -10.96616 -11.03067 1.000 12.04571 ? 96  ARG   A CB   1 ? 
ATOM   514  C  CG   . ARG   A 1 73  ? -16.16931 -10.08976 -11.34103 1.000 10.22796 ? 96  ARG   A CG   1 ? 
ATOM   515  C  CD   . ARG   A 1 73  ? -15.06603 -10.43651 -10.34933 1.000 10.07126 ? 96  ARG   A CD   1 ? 
ATOM   516  N  NE   . ARG   A 1 73  ? -13.73510 -9.93872  -10.69015 1.000 11.18411 ? 96  ARG   A NE   1 ? 
ATOM   517  C  CZ   . ARG   A 1 73  ? -13.03821 -9.07015  -9.96747  1.000 10.40530 ? 96  ARG   A CZ   1 ? 
ATOM   518  N  NH1  . ARG   A 1 73  ? -13.59526 -8.36501  -8.98735  1.000 9.59598  ? 96  ARG   A NH1  1 ? 
ATOM   519  N  NH2  . ARG   A 1 73  ? -11.74197 -8.92238  -10.21391 1.000 9.57955  ? 96  ARG   A NH2  1 ? 
ATOM   520  N  N    . GLY   A 1 74  ? -19.89728 -9.03067  -10.78974 1.000 13.12824 ? 97  GLY   A N    1 ? 
ATOM   521  C  CA   . GLY   A 1 74  ? -20.56763 -7.74978  -10.65851 1.000 14.70753 ? 97  GLY   A CA   1 ? 
ATOM   522  C  C    . GLY   A 1 74  ? -20.04454 -6.85529  -9.56335  1.000 15.64173 ? 97  GLY   A C    1 ? 
ATOM   523  O  O    . GLY   A 1 74  ? -20.64261 -5.79851  -9.30940  1.000 15.82331 ? 97  GLY   A O    1 ? 
ATOM   524  N  N    . ASN   A 1 75  ? -18.94806 -7.22255  -8.90831  1.000 13.33242 ? 98  ASN   A N    1 ? 
ATOM   525  C  CA   . ASN   A 1 75  ? -18.42918 -6.44907  -7.79267  1.000 12.43018 ? 98  ASN   A CA   1 ? 
ATOM   526  C  C    . ASN   A 1 75  ? -16.97814 -6.84372  -7.59076  1.000 11.75785 ? 98  ASN   A C    1 ? 
ATOM   527  O  O    . ASN   A 1 75  ? -16.48896 -7.81211  -8.17487  1.000 12.49825 ? 98  ASN   A O    1 ? 
ATOM   528  C  CB   . ASN   A 1 75  ? -19.23312 -6.74607  -6.52222  1.000 13.82840 ? 98  ASN   A CB   1 ? 
ATOM   529  C  CG   . ASN   A 1 75  ? -19.05867 -8.17985  -6.06950  1.000 14.11334 ? 98  ASN   A CG   1 ? 
ATOM   530  O  OD1  . ASN   A 1 75  ? -17.98239 -8.57582  -5.61962  1.000 12.93363 ? 98  ASN   A OD1  1 ? 
ATOM   531  N  ND2  . ASN   A 1 75  ? -20.10924 -8.98108  -6.21519  1.000 21.38103 ? 98  ASN   A ND2  1 ? 
ATOM   532  N  N    . ASP   A 1 76  ? -16.30983 -6.08879  -6.73634  1.000 11.63157 ? 99  ASP   A N    1 ? 
ATOM   533  C  CA   . ASP   A 1 76  ? -14.94205 -6.36336  -6.33232  1.000 13.15337 ? 99  ASP   A CA   1 ? 
ATOM   534  C  C    . ASP   A 1 76  ? -14.83979 -6.50572  -4.82233  1.000 11.87115 ? 99  ASP   A C    1 ? 
ATOM   535  O  O    . ASP   A 1 76  ? -13.85452 -6.09402  -4.21009  1.000 13.88676 ? 99  ASP   A O    1 ? 
ATOM   536  C  CB   . ASP   A 1 76  ? -13.98778 -5.29119  -6.85025  1.000 11.03341 ? 99  ASP   A CB   1 ? 
ATOM   537  C  CG   . ASP   A 1 76  ? -12.55320 -5.67677  -6.67168  1.000 11.86384 ? 99  ASP   A CG   1 ? 
ATOM   538  O  OD1  . ASP   A 1 76  ? -12.20715 -6.84190  -6.98314  1.000 12.91475 ? 99  ASP   A OD1  1 ? 
ATOM   539  O  OD2  . ASP   A 1 76  ? -11.76582 -4.81789  -6.22125  1.000 14.18658 ? 99  ASP   A OD2  1 ? 
ATOM   540  N  N    . ASN   A 1 77  ? -15.86112 -7.09880  -4.19699  1.000 12.13213 ? 100 ASN   A N    1 ? 
ATOM   541  C  CA   . ASN   A 1 77  ? -15.79900 -7.25121  -2.74920  1.000 14.07564 ? 100 ASN   A CA   1 ? 
ATOM   542  C  C    . ASN   A 1 77  ? -16.42470 -8.54371  -2.24139  1.000 14.60537 ? 100 ASN   A C    1 ? 
ATOM   543  O  O    . ASN   A 1 77  ? -16.61442 -8.68027  -1.02199  1.000 17.39276 ? 100 ASN   A O    1 ? 
ATOM   544  C  CB   . ASN   A 1 77  ? -16.41880 -6.04452  -2.02058  1.000 17.70236 ? 100 ASN   A CB   1 ? 
ATOM   545  C  CG   . ASN   A 1 77  ? -17.84854 -5.80867  -2.40214  1.000 16.05690 ? 100 ASN   A CG   1 ? 
ATOM   546  O  OD1  . ASN   A 1 77  ? -18.54377 -6.71736  -2.85079  1.000 18.63513 ? 100 ASN   A OD1  1 ? 
ATOM   547  N  ND2  . ASN   A 1 77  ? -18.30992 -4.57605  -2.22261  1.000 19.98261 ? 100 ASN   A ND2  1 ? 
ATOM   548  N  N    . ALA   A 1 78  ? -16.73819 -9.49620  -3.11462  1.000 13.13325 ? 101 ALA   A N    1 ? 
ATOM   549  C  CA   . ALA   A 1 78  ? -17.37269 -10.73534 -2.70023  1.000 12.95813 ? 101 ALA   A CA   1 ? 
ATOM   550  C  C    . ALA   A 1 78  ? -16.87786 -11.87505 -3.57547  1.000 14.66367 ? 101 ALA   A C    1 ? 
ATOM   551  O  O    . ALA   A 1 78  ? -16.24648 -11.66686 -4.61043  1.000 14.38001 ? 101 ALA   A O    1 ? 
ATOM   552  C  CB   . ALA   A 1 78  ? -18.90346 -10.64124 -2.79405  1.000 14.87895 ? 101 ALA   A CB   1 ? 
ATOM   553  N  N    . LEU   A 1 79  ? -17.19668 -13.08988 -3.16161  1.000 13.79802 ? 102 LEU   A N    1 ? 
ATOM   554  C  CA   . LEU   A 1 79  ? -16.82546 -14.26188 -3.94376  1.000 12.92973 ? 102 LEU   A CA   1 ? 
ATOM   555  C  C    . LEU   A 1 79  ? -17.44025 -14.17351 -5.33867  1.000 14.37096 ? 102 LEU   A C    1 ? 
ATOM   556  O  O    . LEU   A 1 79  ? -18.58603 -13.74999 -5.49964  1.000 17.03614 ? 102 LEU   A O    1 ? 
ATOM   557  C  CB   . LEU   A 1 79  ? -17.34074 -15.50636 -3.21602  1.000 14.48721 ? 102 LEU   A CB   1 ? 
ATOM   558  C  CG   . LEU   A 1 79  ? -16.86149 -16.85370 -3.74504  1.000 16.30498 ? 102 LEU   A CG   1 ? 
ATOM   559  C  CD1  . LEU   A 1 79  ? -15.38545 -17.02548 -3.40248  1.000 14.35653 ? 102 LEU   A CD1  1 ? 
ATOM   560  C  CD2  . LEU   A 1 79  ? -17.71321 -17.95960 -3.13408  1.000 15.90518 ? 102 LEU   A CD2  1 ? 
ATOM   561  N  N    . GLY   A 1 80  ? -16.65486 -14.53483 -6.36058  1.000 14.31722 ? 103 GLY   A N    1 ? 
ATOM   562  C  CA   . GLY   A 1 80  ? -17.12124 -14.58203 -7.73107  1.000 14.37634 ? 103 GLY   A CA   1 ? 
ATOM   563  C  C    . GLY   A 1 80  ? -17.12642 -16.00555 -8.26446  1.000 14.65162 ? 103 GLY   A C    1 ? 
ATOM   564  O  O    . GLY   A 1 80  ? -16.84833 -16.96675 -7.53439  1.000 13.11194 ? 103 GLY   A O    1 ? 
ATOM   565  N  N    . PRO   A 1 81  ? -17.44726 -16.17752 -9.54000  1.000 14.50379 ? 104 PRO   A N    1 ? 
ATOM   566  C  CA   . PRO   A 1 81  ? -17.53812 -17.53479 -10.09400 1.000 13.40145 ? 104 PRO   A CA   1 ? 
ATOM   567  C  C    . PRO   A 1 81  ? -16.15616 -18.13150 -10.33303 1.000 14.35087 ? 104 PRO   A C    1 ? 
ATOM   568  O  O    . PRO   A 1 81  ? -15.16191 -17.42624 -10.53423 1.000 13.39293 ? 104 PRO   A O    1 ? 
ATOM   569  C  CB   . PRO   A 1 81  ? -18.28311 -17.33482 -11.42229 1.000 15.56554 ? 104 PRO   A CB   1 ? 
ATOM   570  C  CG   . PRO   A 1 81  ? -18.81559 -15.91264 -11.39213 1.000 19.19010 ? 104 PRO   A CG   1 ? 
ATOM   571  C  CD   . PRO   A 1 81  ? -17.88684 -15.15207 -10.50148 1.000 15.42268 ? 104 PRO   A CD   1 ? 
ATOM   572  N  N    . CYS   A 1 82  ? -16.10132 -19.46422 -10.28882 1.000 12.35298 ? 105 CYS   A N    1 ? 
ATOM   573  C  CA   . CYS   A 1 82  ? -14.89125 -20.18858 -10.64067 1.000 11.05804 ? 105 CYS   A CA   1 ? 
ATOM   574  C  C    . CYS   A 1 82  ? -14.57880 -20.04775 -12.13533 1.000 11.97979 ? 105 CYS   A C    1 ? 
ATOM   575  O  O    . CYS   A 1 82  ? -15.41461 -19.62664 -12.94034 1.000 12.62015 ? 105 CYS   A O    1 ? 
ATOM   576  C  CB   . CYS   A 1 82  ? -15.04805 -21.67426 -10.31921 1.000 12.39247 ? 105 CYS   A CB   1 ? 
ATOM   577  S  SG   . CYS   A 1 82  ? -15.40242 -22.01110 -8.58197  1.000 12.72369 ? 105 CYS   A SG   1 ? 
ATOM   578  N  N    A VAL   A 1 83  ? -13.36901 -20.47882 -12.51183 0.601 11.42048 ? 106 VAL   A N    1 ? 
ATOM   579  N  N    B VAL   A 1 83  ? -13.35390 -20.41219 -12.50427 0.399 11.45707 ? 106 VAL   A N    1 ? 
ATOM   580  C  CA   A VAL   A 1 83  ? -12.89264 -20.28215 -13.88725 0.601 12.29166 ? 106 VAL   A CA   1 ? 
ATOM   581  C  CA   B VAL   A 1 83  ? -12.94658 -20.25295 -13.89767 0.399 12.29271 ? 106 VAL   A CA   1 ? 
ATOM   582  C  C    A VAL   A 1 83  ? -13.69619 -21.09115 -14.90571 0.601 11.84364 ? 106 VAL   A C    1 ? 
ATOM   583  C  C    B VAL   A 1 83  ? -13.90586 -20.99431 -14.82552 0.399 11.78612 ? 106 VAL   A C    1 ? 
ATOM   584  O  O    A VAL   A 1 83  ? -13.86316 -20.66132 -16.05776 0.601 13.48182 ? 106 VAL   A O    1 ? 
ATOM   585  O  O    B VAL   A 1 83  ? -14.40533 -20.42851 -15.81103 0.399 9.94439  ? 106 VAL   A O    1 ? 
ATOM   586  C  CB   A VAL   A 1 83  ? -11.37202 -20.51497 -14.01529 0.601 12.32631 ? 106 VAL   A CB   1 ? 
ATOM   587  C  CB   B VAL   A 1 83  ? -11.48039 -20.67681 -14.09750 0.399 12.15782 ? 106 VAL   A CB   1 ? 
ATOM   588  C  CG1  A VAL   A 1 83  ? -10.59520 -19.43341 -13.24811 0.601 14.42101 ? 106 VAL   A CG1  1 ? 
ATOM   589  C  CG1  B VAL   A 1 83  ? -11.15721 -20.74318 -15.57802 0.399 12.26749 ? 106 VAL   A CG1  1 ? 
ATOM   590  C  CG2  A VAL   A 1 83  ? -10.97234 -21.93792 -13.56882 0.601 11.37491 ? 106 VAL   A CG2  1 ? 
ATOM   591  C  CG2  B VAL   A 1 83  ? -10.53484 -19.69664 -13.39185 0.399 15.03258 ? 106 VAL   A CG2  1 ? 
ATOM   592  N  N    . ASP   A 1 84  ? -14.19208 -22.26811 -14.52230 1.000 11.47618 ? 107 ASP   A N    1 ? 
ATOM   593  C  CA   . ASP   A 1 84  ? -15.04289 -23.04462 -15.43069 1.000 12.17067 ? 107 ASP   A CA   1 ? 
ATOM   594  C  C    . ASP   A 1 84  ? -16.40225 -22.37691 -15.62106 1.000 11.62514 ? 107 ASP   A C    1 ? 
ATOM   595  O  O    . ASP   A 1 84  ? -16.90076 -22.28395 -16.74962 1.000 13.44828 ? 107 ASP   A O    1 ? 
ATOM   596  C  CB   . ASP   A 1 84  ? -15.17207 -24.51059 -14.98460 1.000 11.40247 ? 107 ASP   A CB   1 ? 
ATOM   597  C  CG   . ASP   A 1 84  ? -15.85469 -24.66655 -13.63541 1.000 14.33588 ? 107 ASP   A CG   1 ? 
ATOM   598  O  OD1  . ASP   A 1 84  ? -15.68962 -23.79132 -12.75999 1.000 11.54641 ? 107 ASP   A OD1  1 ? 
ATOM   599  O  OD2  . ASP   A 1 84  ? -16.54006 -25.69213 -13.43747 1.000 17.44300 ? 107 ASP   A OD2  1 ? 
ATOM   600  N  N    . GLU   A 1 85  ? -17.01686 -21.89728 -14.53510 1.000 10.37114 ? 108 GLU   A N    1 ? 
ATOM   601  C  CA   . GLU   A 1 85  ? -18.27965 -21.17289 -14.65578 1.000 10.79717 ? 108 GLU   A CA   1 ? 
ATOM   602  C  C    . GLU   A 1 85  ? -18.14205 -19.92575 -15.51172 1.000 10.44206 ? 108 GLU   A C    1 ? 
ATOM   603  O  O    . GLU   A 1 85  ? -19.02528 -19.62779 -16.32462 1.000 11.86323 ? 108 GLU   A O    1 ? 
ATOM   604  C  CB   . GLU   A 1 85  ? -18.88580 -20.84548 -13.28862 1.000 13.12719 ? 108 GLU   A CB   1 ? 
ATOM   605  C  CG   . GLU   A 1 85  ? -20.24157 -20.14624 -13.44865 1.000 13.90239 ? 108 GLU   A CG   1 ? 
ATOM   606  C  CD   . GLU   A 1 85  ? -20.95681 -19.80986 -12.14876 1.000 17.67146 ? 108 GLU   A CD   1 ? 
ATOM   607  O  OE1  . GLU   A 1 85  ? -20.41677 -20.04231 -11.05630 1.000 15.93549 ? 108 GLU   A OE1  1 ? 
ATOM   608  O  OE2  . GLU   A 1 85  ? -22.05775 -19.23839 -12.22982 1.000 21.59562 ? 108 GLU   A OE2  1 ? 
ATOM   609  N  N    . ARG   A 1 86  ? -17.06909 -19.16593 -15.32525 1.000 12.59297 ? 109 ARG   A N    1 ? 
ATOM   610  C  CA   . ARG   A 1 86  ? -16.90423 -17.96858 -16.14525 1.000 10.97752 ? 109 ARG   A CA   1 ? 
ATOM   611  C  C    . ARG   A 1 86  ? -16.86867 -18.31830 -17.63031 1.000 12.32375 ? 109 ARG   A C    1 ? 
ATOM   612  O  O    . ARG   A 1 86  ? -17.49495 -17.63034 -18.45276 1.000 12.31455 ? 109 ARG   A O    1 ? 
ATOM   613  C  CB   . ARG   A 1 86  ? -15.64829 -17.21417 -15.71586 1.000 10.85715 ? 109 ARG   A CB   1 ? 
ATOM   614  C  CG   . ARG   A 1 86  ? -15.75067 -16.66035 -14.30486 1.000 11.88535 ? 109 ARG   A CG   1 ? 
ATOM   615  C  CD   . ARG   A 1 86  ? -14.48272 -15.91572 -13.92629 1.000 11.68555 ? 109 ARG   A CD   1 ? 
ATOM   616  N  NE   . ARG   A 1 86  ? -14.52456 -15.58333 -12.50542 1.000 12.14754 ? 109 ARG   A NE   1 ? 
ATOM   617  C  CZ   . ARG   A 1 86  ? -13.94444 -14.53285 -11.93229 1.000 10.28947 ? 109 ARG   A CZ   1 ? 
ATOM   618  N  NH1  . ARG   A 1 86  ? -13.28551 -13.62456 -12.63954 1.000 11.10014 ? 109 ARG   A NH1  1 ? 
ATOM   619  N  NH2  . ARG   A 1 86  ? -14.04636 -14.38218 -10.60933 1.000 11.46414 ? 109 ARG   A NH2  1 ? 
ATOM   620  N  N    . ALA   A 1 87  ? -16.17669 -19.40338 -17.99517 1.000 9.43418  ? 110 ALA   A N    1 ? 
ATOM   621  C  CA   . ALA   A 1 87  ? -16.17104 -19.82974 -19.39469 1.000 9.58129  ? 110 ALA   A CA   1 ? 
ATOM   622  C  C    . ALA   A 1 87  ? -17.53969 -20.31342 -19.85784 1.000 9.83627  ? 110 ALA   A C    1 ? 
ATOM   623  O  O    . ALA   A 1 87  ? -17.96691 -19.97434 -20.96242 1.000 9.18765  ? 110 ALA   A O    1 ? 
ATOM   624  C  CB   . ALA   A 1 87  ? -15.12080 -20.91540 -19.62576 1.000 10.60327 ? 110 ALA   A CB   1 ? 
ATOM   625  N  N    . ASN   A 1 88  ? -18.24412 -21.10658 -19.04671 1.000 9.95414  ? 111 ASN   A N    1 ? 
ATOM   626  C  CA   . ASN   A 1 88  ? -19.57241 -21.55527 -19.46453 1.000 10.36119 ? 111 ASN   A CA   1 ? 
ATOM   627  C  C    . ASN   A 1 88  ? -20.52771 -20.37148 -19.60827 1.000 10.32641 ? 111 ASN   A C    1 ? 
ATOM   628  O  O    . ASN   A 1 88  ? -21.33663 -20.33477 -20.54205 1.000 11.69661 ? 111 ASN   A O    1 ? 
ATOM   629  C  CB   . ASN   A 1 88  ? -20.13161 -22.60907 -18.49419 1.000 12.72123 ? 111 ASN   A CB   1 ? 
ATOM   630  C  CG   . ASN   A 1 88  ? -19.46509 -23.98984 -18.62819 1.000 12.51755 ? 111 ASN   A CG   1 ? 
ATOM   631  O  OD1  . ASN   A 1 88  ? -19.22054 -24.48841 -19.72716 1.000 14.60891 ? 111 ASN   A OD1  1 ? 
ATOM   632  N  ND2  . ASN   A 1 88  ? -19.19499 -24.61678 -17.49727 1.000 11.29446 ? 111 ASN   A ND2  1 ? 
ATOM   633  N  N    A MET   A 1 89  ? -20.44844 -19.39414 -18.69190 0.541 10.29059 ? 112 MET   A N    1 ? 
ATOM   634  N  N    B MET   A 1 89  ? -20.43791 -19.38396 -18.70737 0.459 10.29364 ? 112 MET   A N    1 ? 
ATOM   635  C  CA   A MET   A 1 89  ? -21.25199 -18.17496 -18.81253 0.541 11.33664 ? 112 MET   A CA   1 ? 
ATOM   636  C  CA   B MET   A 1 89  ? -21.27077 -18.18438 -18.82472 0.459 11.34424 ? 112 MET   A CA   1 ? 
ATOM   637  C  C    A MET   A 1 89  ? -20.98221 -17.47422 -20.13292 0.541 10.50572 ? 112 MET   A C    1 ? 
ATOM   638  C  C    B MET   A 1 89  ? -20.98393 -17.43480 -20.11783 0.459 10.49398 ? 112 MET   A C    1 ? 
ATOM   639  O  O    A MET   A 1 89  ? -21.91243 -17.08932 -20.85618 0.541 11.75568 ? 112 MET   A O    1 ? 
ATOM   640  O  O    B MET   A 1 89  ? -21.90650 -16.99029 -20.81467 0.459 11.74758 ? 112 MET   A O    1 ? 
ATOM   641  C  CB   A MET   A 1 89  ? -20.90923 -17.19835 -17.68741 0.541 14.96689 ? 112 MET   A CB   1 ? 
ATOM   642  C  CB   B MET   A 1 89  ? -21.04232 -17.25344 -17.63269 0.459 14.84027 ? 112 MET   A CB   1 ? 
ATOM   643  C  CG   A MET   A 1 89  ? -21.34683 -17.57078 -16.30015 0.541 18.24869 ? 112 MET   A CG   1 ? 
ATOM   644  C  CG   B MET   A 1 89  ? -21.54283 -17.76738 -16.30655 0.459 18.25437 ? 112 MET   A CG   1 ? 
ATOM   645  S  SD   A MET   A 1 89  ? -20.50005 -16.50283 -15.10187 0.541 19.68425 ? 112 MET   A SD   1 ? 
ATOM   646  S  SD   B MET   A 1 89  ? -21.14644 -16.65460 -14.93387 0.459 29.66560 ? 112 MET   A SD   1 ? 
ATOM   647  C  CE   A MET   A 1 89  ? -21.01493 -14.88573 -15.65908 0.541 13.98942 ? 112 MET   A CE   1 ? 
ATOM   648  C  CE   B MET   A 1 89  ? -19.63071 -15.87545 -15.49710 0.459 14.87609 ? 112 MET   A CE   1 ? 
ATOM   649  N  N    . ALA   A 1 90  ? -19.70291 -17.26607 -20.45033 1.000 9.83774  ? 113 ALA   A N    1 ? 
ATOM   650  C  CA   . ALA   A 1 90  ? -19.35272 -16.60275 -21.69530 1.000 10.18055 ? 113 ALA   A CA   1 ? 
ATOM   651  C  C    . ALA   A 1 90  ? -19.92034 -17.35470 -22.88536 1.000 9.68928  ? 113 ALA   A C    1 ? 
ATOM   652  O  O    . ALA   A 1 90  ? -20.49926 -16.74729 -23.79741 1.000 10.41400 ? 113 ALA   A O    1 ? 
ATOM   653  C  CB   . ALA   A 1 90  ? -17.83049 -16.47209 -21.81012 1.000 10.42552 ? 113 ALA   A CB   1 ? 
ATOM   654  N  N    . ASN   A 1 91  ? -19.76030 -18.68024 -22.91148 1.000 9.41593  ? 114 ASN   A N    1 ? 
ATOM   655  C  CA   . ASN   A 1 91  ? -20.29416 -19.44178 -24.03558 1.000 9.46668  ? 114 ASN   A CA   1 ? 
ATOM   656  C  C    . ASN   A 1 91  ? -21.80267 -19.29143 -24.15051 1.000 10.23944 ? 114 ASN   A C    1 ? 
ATOM   657  O  O    . ASN   A 1 91  ? -22.33506 -19.27750 -25.26284 1.000 11.30333 ? 114 ASN   A O    1 ? 
ATOM   658  C  CB   . ASN   A 1 91  ? -19.94161 -20.92163 -23.91153 1.000 8.81100  ? 114 ASN   A CB   1 ? 
ATOM   659  C  CG   . ASN   A 1 91  ? -18.48036 -21.20774 -24.16372 1.000 9.14501  ? 114 ASN   A CG   1 ? 
ATOM   660  O  OD1  . ASN   A 1 91  ? -17.76333 -20.44758 -24.81759 1.000 9.66839  ? 114 ASN   A OD1  1 ? 
ATOM   661  N  ND2  . ASN   A 1 91  ? -18.03175 -22.33720 -23.63598 1.000 9.59638  ? 114 ASN   A ND2  1 ? 
ATOM   662  N  N    . ALA   A 1 92  ? -22.51120 -19.21168 -23.01468 1.000 9.45223  ? 115 ALA   A N    1 ? 
ATOM   663  C  CA   . ALA   A 1 92  ? -23.96572 -19.08255 -23.08085 1.000 10.78633 ? 115 ALA   A CA   1 ? 
ATOM   664  C  C    . ALA   A 1 92  ? -24.38061 -17.77653 -23.74441 1.000 12.85890 ? 115 ALA   A C    1 ? 
ATOM   665  O  O    . ALA   A 1 92  ? -25.43070 -17.72294 -24.40097 1.000 13.80354 ? 115 ALA   A O    1 ? 
ATOM   666  C  CB   . ALA   A 1 92  ? -24.56168 -19.17233 -21.67817 1.000 11.69691 ? 115 ALA   A CB   1 ? 
ATOM   667  N  N    . LEU   A 1 93  ? -23.56962 -16.72332 -23.60984 1.000 12.05465 ? 116 LEU   A N    1 ? 
ATOM   668  C  CA   . LEU   A 1 93  ? -23.85335 -15.42790 -24.22950 1.000 11.79930 ? 116 LEU   A CA   1 ? 
ATOM   669  C  C    . LEU   A 1 93  ? -23.58512 -15.41300 -25.72979 1.000 14.33932 ? 116 LEU   A C    1 ? 
ATOM   670  O  O    . LEU   A 1 93  ? -24.10915 -14.53457 -26.43616 1.000 14.50102 ? 116 LEU   A O    1 ? 
ATOM   671  C  CB   . LEU   A 1 93  ? -22.99899 -14.34490 -23.55013 1.000 11.88706 ? 116 LEU   A CB   1 ? 
ATOM   672  C  CG   . LEU   A 1 93  ? -23.00487 -12.91383 -24.08992 1.000 12.80402 ? 116 LEU   A CG   1 ? 
ATOM   673  C  CD1  . LEU   A 1 93  ? -24.40761 -12.34342 -23.97374 1.000 14.75814 ? 116 LEU   A CD1  1 ? 
ATOM   674  C  CD2  . LEU   A 1 93  ? -22.03214 -12.03889 -23.31659 1.000 14.06427 ? 116 LEU   A CD2  1 ? 
ATOM   675  N  N    . ARG   A 1 94  ? -22.78554 -16.34730 -26.24044 1.000 11.72781 ? 117 ARG   A N    1 ? 
ATOM   676  C  CA   . ARG   A 1 94  ? -22.43992 -16.41026 -27.65532 1.000 12.46904 ? 117 ARG   A CA   1 ? 
ATOM   677  C  C    . ARG   A 1 94  ? -21.85104 -15.07482 -28.12399 1.000 14.57628 ? 117 ARG   A C    1 ? 
ATOM   678  O  O    . ARG   A 1 94  ? -22.28581 -14.51342 -29.13536 1.000 14.11772 ? 117 ARG   A O    1 ? 
ATOM   679  C  CB   . ARG   A 1 94  ? -23.65495 -16.80157 -28.48799 1.000 15.90007 ? 117 ARG   A CB   1 ? 
ATOM   680  C  CG   . ARG   A 1 94  ? -24.42291 -17.99677 -27.88749 1.000 16.88047 ? 117 ARG   A CG   1 ? 
ATOM   681  C  CD   . ARG   A 1 94  ? -25.73843 -18.30932 -28.61376 1.000 19.47872 ? 117 ARG   A CD   1 ? 
ATOM   682  N  NE   . ARG   A 1 94  ? -25.50874 -18.97854 -29.89013 1.000 22.10580 ? 117 ARG   A NE   1 ? 
ATOM   683  C  CZ   . ARG   A 1 94  ? -25.36419 -20.29104 -30.03140 1.000 24.07898 ? 117 ARG   A CZ   1 ? 
ATOM   684  N  NH1  . ARG   A 1 94  ? -25.41253 -21.10933 -28.99129 1.000 17.36483 ? 117 ARG   A NH1  1 ? 
ATOM   685  N  NH2  . ARG   A 1 94  ? -25.14975 -20.79543 -31.24494 1.000 24.89287 ? 117 ARG   A NH2  1 ? 
ATOM   686  N  N    . PRO   A 1 95  ? -20.87619 -14.53295 -27.40856 1.000 11.61847 ? 118 PRO   A N    1 ? 
ATOM   687  C  CA   . PRO   A 1 95  ? -20.38116 -13.19713 -27.72906 1.000 12.30588 ? 118 PRO   A CA   1 ? 
ATOM   688  C  C    . PRO   A 1 95  ? -19.49494 -13.21751 -28.96610 1.000 12.24610 ? 118 PRO   A C    1 ? 
ATOM   689  O  O    . PRO   A 1 95  ? -19.00446 -14.25705 -29.40551 1.000 13.52266 ? 118 PRO   A O    1 ? 
ATOM   690  C  CB   . PRO   A 1 95  ? -19.55557 -12.83291 -26.49154 1.000 14.76815 ? 118 PRO   A CB   1 ? 
ATOM   691  C  CG   . PRO   A 1 95  ? -19.02687 -14.16341 -26.01787 1.000 16.61479 ? 118 PRO   A CG   1 ? 
ATOM   692  C  CD   . PRO   A 1 95  ? -20.11233 -15.17188 -26.31821 1.000 12.68038 ? 118 PRO   A CD   1 ? 
ATOM   693  N  N    . ASN   A 1 96  ? -19.27446 -12.02791 -29.51674 1.000 12.22104 ? 119 ASN   A N    1 ? 
ATOM   694  C  CA   . ASN   A 1 96  ? -18.33871 -11.88267 -30.61961 1.000 12.61011 ? 119 ASN   A CA   1 ? 
ATOM   695  C  C    . ASN   A 1 96  ? -16.89230 -11.94805 -30.15321 1.000 12.92538 ? 119 ASN   A C    1 ? 
ATOM   696  O  O    . ASN   A 1 96  ? -16.02346 -12.29693 -30.95137 1.000 13.22726 ? 119 ASN   A O    1 ? 
ATOM   697  C  CB   . ASN   A 1 96  ? -18.60562 -10.56060 -31.35074 1.000 12.19097 ? 119 ASN   A CB   1 ? 
ATOM   698  C  CG   . ASN   A 1 96  ? -20.02748 -10.47218 -31.86351 1.000 15.34466 ? 119 ASN   A CG   1 ? 
ATOM   699  O  OD1  . ASN   A 1 96  ? -20.92622 -10.03307 -31.15160 1.000 16.36831 ? 119 ASN   A OD1  1 ? 
ATOM   700  N  ND2  . ASN   A 1 96  ? -20.23860 -10.93536 -33.08405 1.000 21.01158 ? 119 ASN   A ND2  1 ? 
ATOM   701  N  N    . ALA   A 1 97  ? -16.62529 -11.65155 -28.88089 1.000 11.58745 ? 120 ALA   A N    1 ? 
ATOM   702  C  CA   . ALA   A 1 97  ? -15.27817 -11.75191 -28.34176 1.000 10.75534 ? 120 ALA   A CA   1 ? 
ATOM   703  C  C    . ALA   A 1 97  ? -15.36699 -11.86671 -26.83128 1.000 8.94666  ? 120 ALA   A C    1 ? 
ATOM   704  O  O    . ALA   A 1 97  ? -16.30004 -11.35122 -26.20148 1.000 10.15036 ? 120 ALA   A O    1 ? 
ATOM   705  C  CB   . ALA   A 1 97  ? -14.40732 -10.54710 -28.71806 1.000 11.62614 ? 120 ALA   A CB   1 ? 
ATOM   706  N  N    . ILE   A 1 98  ? -14.37877 -12.56287 -26.26576 1.000 9.04784  ? 121 ILE   A N    1 ? 
ATOM   707  C  CA   . ILE   A 1 98  ? -14.21501 -12.73983 -24.82742 1.000 8.22165  ? 121 ILE   A CA   1 ? 
ATOM   708  C  C    . ILE   A 1 98  ? -12.81023 -12.26448 -24.48761 1.000 8.22233  ? 121 ILE   A C    1 ? 
ATOM   709  O  O    . ILE   A 1 98  ? -11.84467 -12.67474 -25.14298 1.000 8.85920  ? 121 ILE   A O    1 ? 
ATOM   710  C  CB   . ILE   A 1 98  ? -14.35452 -14.22610 -24.43149 1.000 8.34741  ? 121 ILE   A CB   1 ? 
ATOM   711  C  CG1  . ILE   A 1 98  ? -15.72972 -14.77281 -24.82988 1.000 10.54146 ? 121 ILE   A CG1  1 ? 
ATOM   712  C  CG2  . ILE   A 1 98  ? -14.09314 -14.39651 -22.93910 1.000 11.37050 ? 121 ILE   A CG2  1 ? 
ATOM   713  C  CD1  . ILE   A 1 98  ? -15.79933 -16.31034 -24.88309 1.000 11.65019 ? 121 ILE   A CD1  1 ? 
ATOM   714  N  N    A VAL   A 1 99  ? -12.68740 -11.39921 -23.48239 0.638 8.18454  ? 122 VAL   A N    1 ? 
ATOM   715  N  N    B VAL   A 1 99  ? -12.68837 -11.40372 -23.48116 0.362 8.22800  ? 122 VAL   A N    1 ? 
ATOM   716  C  CA   A VAL   A 1 99  ? -11.36803 -10.93402 -23.05215 0.638 9.09443  ? 122 VAL   A CA   1 ? 
ATOM   717  C  CA   B VAL   A 1 99  ? -11.37713 -10.93392 -23.04021 0.362 9.09396  ? 122 VAL   A CA   1 ? 
ATOM   718  C  C    A VAL   A 1 99  ? -11.26588 -11.01233 -21.53504 0.638 8.33992  ? 122 VAL   A C    1 ? 
ATOM   719  C  C    B VAL   A 1 99  ? -11.29623 -11.05413 -21.52858 0.362 8.37352  ? 122 VAL   A C    1 ? 
ATOM   720  O  O    A VAL   A 1 99  ? -12.06910 -10.40233 -20.81952 0.638 9.22209  ? 122 VAL   A O    1 ? 
ATOM   721  O  O    B VAL   A 1 99  ? -12.14814 -10.51619 -20.81154 0.362 9.20607  ? 122 VAL   A O    1 ? 
ATOM   722  C  CB   A VAL   A 1 99  ? -11.03995 -9.52342  -23.57373 0.638 10.34399 ? 122 VAL   A CB   1 ? 
ATOM   723  C  CB   B VAL   A 1 99  ? -11.08417 -9.49580  -23.49667 0.362 10.31219 ? 122 VAL   A CB   1 ? 
ATOM   724  C  CG1  A VAL   A 1 99  ? -12.14562 -8.54314  -23.25134 0.638 10.15080 ? 122 VAL   A CG1  1 ? 
ATOM   725  C  CG1  B VAL   A 1 99  ? -9.60335  -9.17601  -23.31291 0.362 11.36393 ? 122 VAL   A CG1  1 ? 
ATOM   726  C  CG2  A VAL   A 1 99  ? -9.70547  -9.04405  -22.99602 0.638 12.04084 ? 122 VAL   A CG2  1 ? 
ATOM   727  C  CG2  B VAL   A 1 99  ? -11.46735 -9.32416  -24.94347 0.362 11.10300 ? 122 VAL   A CG2  1 ? 
ATOM   728  N  N    . SER   A 1 100 ? -10.27981 -11.76145 -21.04692 1.000 8.59491  ? 123 SER   A N    1 ? 
ATOM   729  C  CA   . SER   A 1 100 ? -9.99802  -11.86780 -19.62274 1.000 7.92086  ? 123 SER   A CA   1 ? 
ATOM   730  C  C    . SER   A 1 100 ? -8.77982  -11.00714 -19.30635 1.000 8.87754  ? 123 SER   A C    1 ? 
ATOM   731  O  O    . SER   A 1 100 ? -7.84110  -10.92579 -20.11290 1.000 9.29011  ? 123 SER   A O    1 ? 
ATOM   732  C  CB   . SER   A 1 100 ? -9.75208  -13.33108 -19.25404 1.000 9.51253  ? 123 SER   A CB   1 ? 
ATOM   733  O  OG   . SER   A 1 100 ? -9.39200  -13.45973 -17.89046 1.000 10.29274 ? 123 SER   A OG   1 ? 
ATOM   734  N  N    . LEU   A 1 101 ? -8.83845  -10.30995 -18.16878 1.000 7.96603  ? 124 LEU   A N    1 ? 
ATOM   735  C  CA   . LEU   A 1 101 ? -7.79528  -9.37821  -17.75022 1.000 8.37382  ? 124 LEU   A CA   1 ? 
ATOM   736  C  C    . LEU   A 1 101 ? -7.14342  -9.88857  -16.47746 1.000 9.12949  ? 124 LEU   A C    1 ? 
ATOM   737  O  O    . LEU   A 1 101 ? -7.83705  -10.17669 -15.49296 1.000 9.35951  ? 124 LEU   A O    1 ? 
ATOM   738  C  CB   . LEU   A 1 101 ? -8.39106  -7.99412  -17.47753 1.000 10.37686 ? 124 LEU   A CB   1 ? 
ATOM   739  C  CG   . LEU   A 1 101 ? -9.19615  -7.39408  -18.62354 1.000 11.92007 ? 124 LEU   A CG   1 ? 
ATOM   740  C  CD1  . LEU   A 1 101 ? -9.65341  -5.99633  -18.18572 1.000 15.14268 ? 124 LEU   A CD1  1 ? 
ATOM   741  C  CD2  . LEU   A 1 101 ? -8.33695  -7.34424  -19.87675 1.000 14.43869 ? 124 LEU   A CD2  1 ? 
ATOM   742  N  N    . HIS   A 1 102 ? -5.81061  -9.93861  -16.49086 1.000 10.03203 ? 125 HIS   A N    1 ? 
ATOM   743  C  CA   . HIS   A 1 102 ? -5.00657  -10.42038 -15.37748 1.000 9.58028  ? 125 HIS   A CA   1 ? 
ATOM   744  C  C    . HIS   A 1 102 ? -3.76367  -9.56090  -15.25945 1.000 9.94853  ? 125 HIS   A C    1 ? 
ATOM   745  O  O    . HIS   A 1 102 ? -3.44052  -8.75829  -16.13810 1.000 10.66997 ? 125 HIS   A O    1 ? 
ATOM   746  C  CB   . HIS   A 1 102 ? -4.59513  -11.88367 -15.57351 1.000 9.87138  ? 125 HIS   A CB   1 ? 
ATOM   747  C  CG   . HIS   A 1 102 ? -5.69111  -12.85083 -15.26719 1.000 8.95559  ? 125 HIS   A CG   1 ? 
ATOM   748  N  ND1  . HIS   A 1 102 ? -5.70306  -13.62113 -14.13159 1.000 10.08320 ? 125 HIS   A ND1  1 ? 
ATOM   749  C  CD2  . HIS   A 1 102 ? -6.81823  -13.17153 -15.94775 1.000 11.09942 ? 125 HIS   A CD2  1 ? 
ATOM   750  C  CE1  . HIS   A 1 102 ? -6.79560  -14.36064 -14.10467 1.000 12.00590 ? 125 HIS   A CE1  1 ? 
ATOM   751  N  NE2  . HIS   A 1 102 ? -7.48367  -14.11218 -15.19954 1.000 10.66400 ? 125 HIS   A NE2  1 ? 
ATOM   752  N  N    . ALA   A 1 103 ? -3.04626  -9.75832  -14.15397 1.000 10.27324 ? 126 ALA   A N    1 ? 
ATOM   753  C  CA   . ALA   A 1 103 ? -1.69253  -9.24568  -14.01859 1.000 11.81742 ? 126 ALA   A CA   1 ? 
ATOM   754  C  C    . ALA   A 1 103 ? -0.84813  -10.30757 -13.33711 1.000 11.86031 ? 126 ALA   A C    1 ? 
ATOM   755  O  O    . ALA   A 1 103 ? -1.35393  -11.14696 -12.59027 1.000 12.49804 ? 126 ALA   A O    1 ? 
ATOM   756  C  CB   . ALA   A 1 103 ? -1.64538  -7.93808  -13.22876 1.000 10.95038 ? 126 ALA   A CB   1 ? 
ATOM   757  N  N    . ASP   A 1 104 ? 0.44463   -10.26607 -13.59834 1.000 11.82683 ? 127 ASP   A N    1 ? 
ATOM   758  C  CA   . ASP   A 1 104 ? 1.31661   -11.37404 -13.26213 1.000 12.48029 ? 127 ASP   A CA   1 ? 
ATOM   759  C  C    . ASP   A 1 104 ? 2.13174   -11.05862 -12.01907 1.000 13.71453 ? 127 ASP   A C    1 ? 
ATOM   760  O  O    . ASP   A 1 104 ? 2.33892   -9.90135  -11.66275 1.000 14.00624 ? 127 ASP   A O    1 ? 
ATOM   761  C  CB   . ASP   A 1 104 ? 2.24111   -11.65288 -14.44935 1.000 13.66662 ? 127 ASP   A CB   1 ? 
ATOM   762  C  CG   . ASP   A 1 104 ? 2.89924   -13.00428 -14.37421 1.000 16.79877 ? 127 ASP   A CG   1 ? 
ATOM   763  O  OD1  . ASP   A 1 104 ? 2.36903   -13.92659 -13.70689 1.000 17.00313 ? 127 ASP   A OD1  1 ? 
ATOM   764  O  OD2  . ASP   A 1 104 ? 3.97143   -13.14966 -14.99176 1.000 18.76702 ? 127 ASP   A OD2  1 ? 
ATOM   765  N  N    . GLY   A 1 105 ? 2.57245   -12.11734 -11.34802 1.000 18.37302 ? 128 GLY   A N    1 ? 
ATOM   766  C  CA   . GLY   A 1 105 ? 3.53699   -11.97068 -10.27570 1.000 26.04938 ? 128 GLY   A CA   1 ? 
ATOM   767  C  C    . GLY   A 1 105 ? 4.84306   -12.65430 -10.61872 1.000 26.31494 ? 128 GLY   A C    1 ? 
ATOM   768  O  O    . GLY   A 1 105 ? 5.00714   -13.84556 -10.33118 1.000 29.84102 ? 128 GLY   A O    1 ? 
ATOM   769  N  N    . GLY   A 1 106 ? 5.77342   -11.92036 -11.23613 1.000 26.51642 ? 129 GLY   A N    1 ? 
ATOM   770  C  CA   . GLY   A 1 106 ? 7.04148   -12.46676 -11.66519 1.000 29.28632 ? 129 GLY   A CA   1 ? 
ATOM   771  C  C    . GLY   A 1 106 ? 8.23182   -11.76259 -11.03689 1.000 30.40926 ? 129 GLY   A C    1 ? 
ATOM   772  O  O    . GLY   A 1 106 ? 8.08366   -10.95754 -10.11222 1.000 26.32065 ? 129 GLY   A O    1 ? 
ATOM   773  N  N    . PRO   A 1 107 ? 9.43952   -12.04080 -11.52642 1.000 32.54641 ? 130 PRO   A N    1 ? 
ATOM   774  C  CA   . PRO   A 1 107 ? 10.62478  -11.39581 -10.94697 1.000 25.08863 ? 130 PRO   A CA   1 ? 
ATOM   775  C  C    . PRO   A 1 107 ? 10.62542  -9.90381  -11.23716 1.000 23.08317 ? 130 PRO   A C    1 ? 
ATOM   776  O  O    . PRO   A 1 107 ? 10.14760  -9.44999  -12.27723 1.000 24.80045 ? 130 PRO   A O    1 ? 
ATOM   777  C  CB   . PRO   A 1 107 ? 11.79939  -12.09301 -11.65110 1.000 30.52457 ? 130 PRO   A CB   1 ? 
ATOM   778  C  CG   . PRO   A 1 107 ? 11.19560  -13.28681 -12.35592 1.000 32.87376 ? 130 PRO   A CG   1 ? 
ATOM   779  C  CD   . PRO   A 1 107 ? 9.79027   -12.89062 -12.67516 1.000 34.26141 ? 130 PRO   A CD   1 ? 
ATOM   780  N  N    . ALA   A 1 108 ? 11.22520  -9.14112  -10.31595 1.000 24.10686 ? 131 ALA   A N    1 ? 
ATOM   781  C  CA   . ALA   A 1 108 ? 11.04300  -7.69094  -10.30359 1.000 21.38120 ? 131 ALA   A CA   1 ? 
ATOM   782  C  C    . ALA   A 1 108 ? 11.53444  -7.01213  -11.57891 1.000 21.72758 ? 131 ALA   A C    1 ? 
ATOM   783  O  O    . ALA   A 1 108 ? 10.95936  -5.99922  -11.99645 1.000 24.23104 ? 131 ALA   A O    1 ? 
ATOM   784  C  CB   . ALA   A 1 108 ? 11.72400  -7.08339  -9.07460  1.000 28.33712 ? 131 ALA   A CB   1 ? 
ATOM   785  N  N    A SER   A 1 109 ? 12.58550  -7.54218  -12.21425 0.700 24.09356 ? 132 SER   A N    1 ? 
ATOM   786  N  N    B SER   A 1 109 ? 12.59977  -7.52944  -12.19303 0.300 24.06860 ? 132 SER   A N    1 ? 
ATOM   787  C  CA   A SER   A 1 109 ? 13.13146  -6.91304  -13.41392 0.700 25.88407 ? 132 SER   A CA   1 ? 
ATOM   788  C  CA   B SER   A 1 109 ? 13.10752  -6.90412  -13.40821 0.300 25.75017 ? 132 SER   A CA   1 ? 
ATOM   789  C  C    A SER   A 1 109 ? 12.33398  -7.23534  -14.67084 0.700 22.75008 ? 132 SER   A C    1 ? 
ATOM   790  C  C    B SER   A 1 109 ? 12.17086  -7.12439  -14.58678 0.300 22.60732 ? 132 SER   A C    1 ? 
ATOM   791  O  O    A SER   A 1 109 ? 12.48376  -6.53658  -15.67964 0.700 24.93659 ? 132 SER   A O    1 ? 
ATOM   792  O  O    B SER   A 1 109 ? 12.04920  -6.24829  -15.45081 0.300 23.00389 ? 132 SER   A O    1 ? 
ATOM   793  C  CB   A SER   A 1 109 ? 14.60853  -7.29009  -13.61112 0.700 23.99531 ? 132 SER   A CB   1 ? 
ATOM   794  C  CB   B SER   A 1 109 ? 14.51178  -7.41710  -13.73103 0.300 23.87988 ? 132 SER   A CB   1 ? 
ATOM   795  O  OG   A SER   A 1 109 ? 14.76420  -8.63647  -14.02675 0.700 26.14255 ? 132 SER   A OG   1 ? 
ATOM   796  O  OG   B SER   A 1 109 ? 15.45684  -6.36300  -13.66236 0.300 24.63970 ? 132 SER   A OG   1 ? 
ATOM   797  N  N    . GLY   A 1 110 ? 11.50359  -8.27369  -14.63659 1.000 19.88377 ? 133 GLY   A N    1 ? 
ATOM   798  C  CA   . GLY   A 1 110 ? 10.65003  -8.57946  -15.77556 1.000 16.95845 ? 133 GLY   A CA   1 ? 
ATOM   799  C  C    . GLY   A 1 110 ? 9.44826   -7.65314  -15.81309 1.000 16.25327 ? 133 GLY   A C    1 ? 
ATOM   800  O  O    . GLY   A 1 110 ? 8.84183   -7.33969  -14.78738 1.000 16.42125 ? 133 GLY   A O    1 ? 
ATOM   801  N  N    . ARG   A 1 111 ? 9.12264   -7.18230  -17.01196 1.000 13.80087 ? 134 ARG   A N    1 ? 
ATOM   802  C  CA   . ARG   A 1 111 ? 7.98233   -6.29400  -17.14664 1.000 14.57328 ? 134 ARG   A CA   1 ? 
ATOM   803  C  C    . ARG   A 1 111 ? 7.36248   -6.46761  -18.52339 1.000 13.82022 ? 134 ARG   A C    1 ? 
ATOM   804  O  O    . ARG   A 1 111 ? 7.95719   -7.05781  -19.42859 1.000 13.78393 ? 134 ARG   A O    1 ? 
ATOM   805  C  CB   . ARG   A 1 111 ? 8.35616   -4.82874  -16.88965 1.000 18.83377 ? 134 ARG   A CB   1 ? 
ATOM   806  C  CG   . ARG   A 1 111 ? 9.01473   -4.13960  -18.06583 1.000 17.34391 ? 134 ARG   A CG   1 ? 
ATOM   807  C  CD   . ARG   A 1 111 ? 9.02413   -2.62180  -17.88082 1.000 18.34470 ? 134 ARG   A CD   1 ? 
ATOM   808  N  NE   . ARG   A 1 111 ? 7.66586   -2.07637  -17.81505 1.000 20.51118 ? 134 ARG   A NE   1 ? 
ATOM   809  C  CZ   . ARG   A 1 111 ? 7.33205   -0.83029  -18.13190 1.000 22.48368 ? 134 ARG   A CZ   1 ? 
ATOM   810  N  NH1  . ARG   A 1 111 ? 8.23879   0.05225   -18.53127 1.000 24.58737 ? 134 ARG   A NH1  1 ? 
ATOM   811  N  NH2  . ARG   A 1 111 ? 6.05171   -0.46129  -18.06447 1.000 19.04574 ? 134 ARG   A NH2  1 ? 
ATOM   812  N  N    . GLY   A 1 112 ? 6.15116   -5.94117  -18.66377 1.000 14.53000 ? 135 GLY   A N    1 ? 
ATOM   813  C  CA   . GLY   A 1 112 ? 5.44737   -5.94282  -19.92969 1.000 14.84257 ? 135 GLY   A CA   1 ? 
ATOM   814  C  C    . GLY   A 1 112 ? 4.31597   -6.95895  -19.93078 1.000 12.38275 ? 135 GLY   A C    1 ? 
ATOM   815  O  O    . GLY   A 1 112 ? 4.09459   -7.68752  -18.95923 1.000 12.28313 ? 135 GLY   A O    1 ? 
ATOM   816  N  N    . PHE   A 1 113 ? 3.63763   -7.02292  -21.07759 1.000 13.83879 ? 136 PHE   A N    1 ? 
ATOM   817  C  CA   . PHE   A 1 113 ? 2.39353   -7.77253  -21.22862 1.000 11.58769 ? 136 PHE   A CA   1 ? 
ATOM   818  C  C    . PHE   A 1 113 ? 2.61737   -9.06974  -22.00121 1.000 11.71811 ? 136 PHE   A C    1 ? 
ATOM   819  O  O    . PHE   A 1 113 ? 3.54205   -9.20653  -22.81384 1.000 10.83967 ? 136 PHE   A O    1 ? 
ATOM   820  C  CB   . PHE   A 1 113 ? 1.34043   -6.93333  -21.97698 1.000 12.19591 ? 136 PHE   A CB   1 ? 
ATOM   821  C  CG   . PHE   A 1 113 ? 1.61329   -6.80341  -23.44679 1.000 12.24954 ? 136 PHE   A CG   1 ? 
ATOM   822  C  CD1  . PHE   A 1 113 ? 1.19426   -7.78118  -24.33109 1.000 12.76249 ? 136 PHE   A CD1  1 ? 
ATOM   823  C  CD2  . PHE   A 1 113 ? 2.31480   -5.71312  -23.94693 1.000 13.51657 ? 136 PHE   A CD2  1 ? 
ATOM   824  C  CE1  . PHE   A 1 113 ? 1.45555   -7.68322  -25.69226 1.000 12.45318 ? 136 PHE   A CE1  1 ? 
ATOM   825  C  CE2  . PHE   A 1 113 ? 2.59449   -5.61011  -25.31343 1.000 13.35650 ? 136 PHE   A CE2  1 ? 
ATOM   826  C  CZ   . PHE   A 1 113 ? 2.16737   -6.59750  -26.17834 1.000 14.03063 ? 136 PHE   A CZ   1 ? 
ATOM   827  N  N    . HIS   A 1 114 ? 1.71157   -10.02122 -21.79654 1.000 11.11201 ? 137 HIS   A N    1 ? 
ATOM   828  C  CA   . HIS   A 1 114 ? 1.63124   -11.14013 -22.72133 1.000 11.36512 ? 137 HIS   A CA   1 ? 
ATOM   829  C  C    . HIS   A 1 114 ? 0.17577   -11.54341 -22.91377 1.000 10.24921 ? 137 HIS   A C    1 ? 
ATOM   830  O  O    . HIS   A 1 114 ? -0.61809  -11.51462 -21.96418 1.000 10.51079 ? 137 HIS   A O    1 ? 
ATOM   831  C  CB   . HIS   A 1 114 ? 2.55347   -12.33943 -22.36194 1.000 10.23107 ? 137 HIS   A CB   1 ? 
ATOM   832  C  CG   . HIS   A 1 114 ? 2.27390   -13.00475 -21.04516 1.000 9.65788  ? 137 HIS   A CG   1 ? 
ATOM   833  N  ND1  . HIS   A 1 114 ? 2.55026   -12.41939 -19.82623 1.000 10.61349 ? 137 HIS   A ND1  1 ? 
ATOM   834  C  CD2  . HIS   A 1 114 ? 1.80764   -14.24676 -20.76829 1.000 11.14964 ? 137 HIS   A CD2  1 ? 
ATOM   835  C  CE1  . HIS   A 1 114 ? 2.25377   -13.27016 -18.85595 1.000 10.82348 ? 137 HIS   A CE1  1 ? 
ATOM   836  N  NE2  . HIS   A 1 114 ? 1.79111   -14.38193 -19.40142 1.000 12.85100 ? 137 HIS   A NE2  1 ? 
ATOM   837  N  N    . VAL   A 1 115 ? -0.15985  -11.88339 -24.15717 1.000 9.53324  ? 138 VAL   A N    1 ? 
ATOM   838  C  CA   . VAL   A 1 115 ? -1.51110  -12.27919 -24.55004 1.000 8.74478  ? 138 VAL   A CA   1 ? 
ATOM   839  C  C    . VAL   A 1 115 ? -1.55127  -13.78911 -24.69243 1.000 10.03844 ? 138 VAL   A C    1 ? 
ATOM   840  O  O    . VAL   A 1 115 ? -0.86250  -14.35794 -25.55188 1.000 10.47264 ? 138 VAL   A O    1 ? 
ATOM   841  C  CB   . VAL   A 1 115 ? -1.92340  -11.60642 -25.86318 1.000 8.93050  ? 138 VAL   A CB   1 ? 
ATOM   842  C  CG1  . VAL   A 1 115 ? -3.35896  -12.01954 -26.21374 1.000 10.66309 ? 138 VAL   A CG1  1 ? 
ATOM   843  C  CG2  . VAL   A 1 115 ? -1.81372  -10.09488 -25.75325 1.000 11.73706 ? 138 VAL   A CG2  1 ? 
ATOM   844  N  N    . ASN   A 1 116 ? -2.39008  -14.43478 -23.88587 1.000 9.32299  ? 139 ASN   A N    1 ? 
ATOM   845  C  CA   . ASN   A 1 116 ? -2.50767  -15.88246 -23.84036 1.000 9.57233  ? 139 ASN   A CA   1 ? 
ATOM   846  C  C    . ASN   A 1 116 ? -3.67689  -16.35868 -24.68089 1.000 9.82227  ? 139 ASN   A C    1 ? 
ATOM   847  O  O    . ASN   A 1 116 ? -4.75128  -15.74685 -24.68158 1.000 9.27625  ? 139 ASN   A O    1 ? 
ATOM   848  C  CB   . ASN   A 1 116 ? -2.69524  -16.34028 -22.39627 1.000 9.61851  ? 139 ASN   A CB   1 ? 
ATOM   849  C  CG   . ASN   A 1 116 ? -1.55493  -15.90111 -21.51431 1.000 11.49891 ? 139 ASN   A CG   1 ? 
ATOM   850  O  OD1  . ASN   A 1 116 ? -0.54729  -16.59383 -21.41204 1.000 10.68007 ? 139 ASN   A OD1  1 ? 
ATOM   851  N  ND2  . ASN   A 1 116 ? -1.68280  -14.72936 -20.90200 1.000 12.42657 ? 139 ASN   A ND2  1 ? 
ATOM   852  N  N    . TYR   A 1 117 ? -3.47093  -17.46452 -25.37875 1.000 9.69104  ? 140 TYR   A N    1 ? 
ATOM   853  C  CA   . TYR   A 1 117 ? -4.51428  -18.05273 -26.19600 1.000 8.87520  ? 140 TYR   A CA   1 ? 
ATOM   854  C  C    . TYR   A 1 117 ? -4.38209  -19.56747 -26.13325 1.000 8.86830  ? 140 TYR   A C    1 ? 
ATOM   855  O  O    . TYR   A 1 117 ? -3.29762  -20.09515 -25.86766 1.000 10.48440 ? 140 TYR   A O    1 ? 
ATOM   856  C  CB   . TYR   A 1 117 ? -4.48477  -17.54282 -27.65297 1.000 10.34193 ? 140 TYR   A CB   1 ? 
ATOM   857  C  CG   . TYR   A 1 117 ? -3.21824  -17.86291 -28.41895 1.000 10.26284 ? 140 TYR   A CG   1 ? 
ATOM   858  C  CD1  . TYR   A 1 117 ? -2.09915  -17.04431 -28.32796 1.000 10.25144 ? 140 TYR   A CD1  1 ? 
ATOM   859  C  CD2  . TYR   A 1 117 ? -3.16067  -18.97305 -29.24567 1.000 11.98004 ? 140 TYR   A CD2  1 ? 
ATOM   860  C  CE1  . TYR   A 1 117 ? -0.94315  -17.33965 -29.03353 1.000 12.97836 ? 140 TYR   A CE1  1 ? 
ATOM   861  C  CE2  . TYR   A 1 117 ? -2.01186  -19.27993 -29.95281 1.000 12.64882 ? 140 TYR   A CE2  1 ? 
ATOM   862  C  CZ   . TYR   A 1 117 ? -0.92445  -18.45618 -29.84971 1.000 13.54873 ? 140 TYR   A CZ   1 ? 
ATOM   863  O  OH   . TYR   A 1 117 ? 0.23465   -18.76615 -30.55349 1.000 18.10858 ? 140 TYR   A OH   1 ? 
ATOM   864  N  N    . SER   A 1 118 ? -5.49139  -20.25791 -26.35866 1.000 9.01630  ? 141 SER   A N    1 ? 
ATOM   865  C  CA   . SER   A 1 118 ? -5.52690  -21.71669 -26.28904 1.000 8.23619  ? 141 SER   A CA   1 ? 
ATOM   866  C  C    . SER   A 1 118 ? -4.74925  -22.34404 -27.43832 1.000 11.55159 ? 141 SER   A C    1 ? 
ATOM   867  O  O    . SER   A 1 118 ? -5.05005  -22.09504 -28.61115 1.000 11.41190 ? 141 SER   A O    1 ? 
ATOM   868  C  CB   . SER   A 1 118 ? -6.97021  -22.19224 -26.37419 1.000 11.00963 ? 141 SER   A CB   1 ? 
ATOM   869  O  OG   . SER   A 1 118 ? -7.02756  -23.62138 -26.33527 1.000 11.49661 ? 141 SER   A OG   1 ? 
ATOM   870  N  N    . ALA   A 1 119 ? -3.78012  -23.20322 -27.10080 1.000 11.53990 ? 142 ALA   A N    1 ? 
ATOM   871  C  CA   . ALA   A 1 119 ? -3.03926  -23.95437 -28.10293 1.000 11.95392 ? 142 ALA   A CA   1 ? 
ATOM   872  C  C    . ALA   A 1 119 ? -2.49563  -25.18939 -27.41462 1.000 11.12901 ? 142 ALA   A C    1 ? 
ATOM   873  O  O    . ALA   A 1 119 ? -2.00760  -25.08179 -26.28200 1.000 12.11193 ? 142 ALA   A O    1 ? 
ATOM   874  C  CB   . ALA   A 1 119 ? -1.87401  -23.12927 -28.65091 1.000 12.51585 ? 142 ALA   A CB   1 ? 
ATOM   875  N  N    . PRO   A 1 120 ? -2.54903  -26.35736 -28.04480 1.000 11.72976 ? 143 PRO   A N    1 ? 
ATOM   876  C  CA   . PRO   A 1 120 ? -3.19597  -26.63951 -29.33367 1.000 12.09841 ? 143 PRO   A CA   1 ? 
ATOM   877  C  C    . PRO   A 1 120 ? -4.68545  -26.35904 -29.25247 1.000 11.45620 ? 143 PRO   A C    1 ? 
ATOM   878  O  O    . PRO   A 1 120 ? -5.29634  -26.51029 -28.19425 1.000 11.89012 ? 143 PRO   A O    1 ? 
ATOM   879  C  CB   . PRO   A 1 120 ? -2.94840  -28.14473 -29.53986 1.000 13.53881 ? 143 PRO   A CB   1 ? 
ATOM   880  C  CG   . PRO   A 1 120 ? -1.84106  -28.52130 -28.57494 1.000 14.64357 ? 143 PRO   A CG   1 ? 
ATOM   881  C  CD   . PRO   A 1 120 ? -1.91069  -27.54893 -27.44610 1.000 11.44916 ? 143 PRO   A CD   1 ? 
ATOM   882  N  N    . PRO   A 1 121 ? -5.29261  -25.96620 -30.36691 1.000 11.23355 ? 144 PRO   A N    1 ? 
ATOM   883  C  CA   . PRO   A 1 121 ? -6.71366  -25.60248 -30.34698 1.000 12.78802 ? 144 PRO   A CA   1 ? 
ATOM   884  C  C    . PRO   A 1 121 ? -7.60855  -26.81745 -30.17644 1.000 13.97032 ? 144 PRO   A C    1 ? 
ATOM   885  O  O    . PRO   A 1 121 ? -7.32122  -27.91862 -30.66294 1.000 15.10829 ? 144 PRO   A O    1 ? 
ATOM   886  C  CB   . PRO   A 1 121 ? -6.92563  -24.96193 -31.72460 1.000 12.76835 ? 144 PRO   A CB   1 ? 
ATOM   887  C  CG   . PRO   A 1 121 ? -5.91366  -25.61991 -32.59257 1.000 13.18272 ? 144 PRO   A CG   1 ? 
ATOM   888  C  CD   . PRO   A 1 121 ? -4.69610  -25.76558 -31.69616 1.000 12.24391 ? 144 PRO   A CD   1 ? 
ATOM   889  N  N    . LEU   A 1 122 ? -8.73303  -26.59314 -29.50217 1.000 12.75849 ? 145 LEU   A N    1 ? 
ATOM   890  C  CA   . LEU   A 1 122 ? -9.72510  -27.63157 -29.26875 1.000 12.26906 ? 145 LEU   A CA   1 ? 
ATOM   891  C  C    . LEU   A 1 122 ? -10.94789 -27.48349 -30.15764 1.000 14.43281 ? 145 LEU   A C    1 ? 
ATOM   892  O  O    . LEU   A 1 122 ? -11.83450 -28.34829 -30.11826 1.000 15.59310 ? 145 LEU   A O    1 ? 
ATOM   893  C  CB   . LEU   A 1 122 ? -10.17009 -27.62416 -27.80239 1.000 12.37586 ? 145 LEU   A CB   1 ? 
ATOM   894  C  CG   . LEU   A 1 122 ? -9.03962  -27.97944 -26.83483 1.000 12.09267 ? 145 LEU   A CG   1 ? 
ATOM   895  C  CD1  . LEU   A 1 122 ? -9.53417  -27.83655 -25.41014 1.000 13.60770 ? 145 LEU   A CD1  1 ? 
ATOM   896  C  CD2  . LEU   A 1 122 ? -8.53653  -29.41000 -27.09139 1.000 15.61016 ? 145 LEU   A CD2  1 ? 
ATOM   897  N  N    . ASN   A 1 123 ? -11.02514 -26.40608 -30.93649 1.000 12.29082 ? 146 ASN   A N    1 ? 
ATOM   898  C  CA   . ASN   A 1 123 ? -12.09359 -26.24432 -31.91172 1.000 13.65779 ? 146 ASN   A CA   1 ? 
ATOM   899  C  C    . ASN   A 1 123 ? -11.62575 -25.23012 -32.94210 1.000 11.94703 ? 146 ASN   A C    1 ? 
ATOM   900  O  O    . ASN   A 1 123 ? -10.56673 -24.61241 -32.79616 1.000 11.82616 ? 146 ASN   A O    1 ? 
ATOM   901  C  CB   . ASN   A 1 123 ? -13.41851 -25.86545 -31.23948 1.000 12.78736 ? 146 ASN   A CB   1 ? 
ATOM   902  C  CG   . ASN   A 1 123 ? -13.33967 -24.54941 -30.46161 1.000 10.93678 ? 146 ASN   A CG   1 ? 
ATOM   903  O  OD1  . ASN   A 1 123 ? -12.92219 -23.52077 -30.99966 1.000 12.76714 ? 146 ASN   A OD1  1 ? 
ATOM   904  N  ND2  . ASN   A 1 123 ? -13.74972 -24.58219 -29.19503 1.000 12.58906 ? 146 ASN   A ND2  1 ? 
ATOM   905  N  N    . ALA   A 1 124 ? -12.43603 -25.05584 -33.98921 1.000 12.83041 ? 147 ALA   A N    1 ? 
ATOM   906  C  CA   . ALA   A 1 124 ? -12.01924 -24.20216 -35.10118 1.000 12.72810 ? 147 ALA   A CA   1 ? 
ATOM   907  C  C    . ALA   A 1 124 ? -11.89971 -22.73465 -34.69912 1.000 11.01578 ? 147 ALA   A C    1 ? 
ATOM   908  O  O    . ALA   A 1 124 ? -11.06873 -22.00230 -35.25196 1.000 11.95097 ? 147 ALA   A O    1 ? 
ATOM   909  C  CB   . ALA   A 1 124 ? -13.00320 -24.34739 -36.26459 1.000 14.10279 ? 147 ALA   A CB   1 ? 
ATOM   910  N  N    . ILE   A 1 125 ? -12.72630 -22.27613 -33.75827 1.000 12.04616 ? 148 ILE   A N    1 ? 
ATOM   911  C  CA   . ILE   A 1 125 ? -12.60772 -20.89691 -33.29621 1.000 11.24916 ? 148 ILE   A CA   1 ? 
ATOM   912  C  C    . ILE   A 1 125 ? -11.26479 -20.68384 -32.61144 1.000 10.49983 ? 148 ILE   A C    1 ? 
ATOM   913  O  O    . ILE   A 1 125 ? -10.57896 -19.68450 -32.84796 1.000 11.58923 ? 148 ILE   A O    1 ? 
ATOM   914  C  CB   . ILE   A 1 125 ? -13.78862 -20.56024 -32.37229 1.000 11.92280 ? 148 ILE   A CB   1 ? 
ATOM   915  C  CG1  . ILE   A 1 125 ? -15.12115 -20.66968 -33.12952 1.000 17.91564 ? 148 ILE   A CG1  1 ? 
ATOM   916  C  CG2  . ILE   A 1 125 ? -13.60194 -19.16908 -31.76656 1.000 12.42508 ? 148 ILE   A CG2  1 ? 
ATOM   917  C  CD1  . ILE   A 1 125 ? -15.19709 -19.81302 -34.38269 1.000 18.87582 ? 148 ILE   A CD1  1 ? 
ATOM   918  N  N    . GLN   A 1 126 ? -10.87471 -21.62248 -31.74832 1.000 11.53318 ? 149 GLN   A N    1 ? 
ATOM   919  C  CA   . GLN   A 1 126 ? -9.57346  -21.52793 -31.09990 1.000 10.25675 ? 149 GLN   A CA   1 ? 
ATOM   920  C  C    . GLN   A 1 126 ? -8.43247  -21.59901 -32.10509 1.000 10.61572 ? 149 GLN   A C    1 ? 
ATOM   921  O  O    . GLN   A 1 126 ? -7.38566  -20.97407 -31.89416 1.000 11.62211 ? 149 GLN   A O    1 ? 
ATOM   922  C  CB   . GLN   A 1 126 ? -9.43658  -22.65020 -30.06890 1.000 10.21460 ? 149 GLN   A CB   1 ? 
ATOM   923  C  CG   . GLN   A 1 126 ? -10.40000 -22.53910 -28.92069 1.000 11.24671 ? 149 GLN   A CG   1 ? 
ATOM   924  C  CD   . GLN   A 1 126 ? -10.17662 -23.60490 -27.87615 1.000 9.75351  ? 149 GLN   A CD   1 ? 
ATOM   925  O  OE1  . GLN   A 1 126 ? -9.14913  -24.28916 -27.86572 1.000 10.42382 ? 149 GLN   A OE1  1 ? 
ATOM   926  N  NE2  . GLN   A 1 126 ? -11.12521 -23.73272 -26.96255 1.000 9.77691  ? 149 GLN   A NE2  1 ? 
ATOM   927  N  N    . ALA   A 1 127 ? -8.61297  -22.34616 -33.19974 1.000 11.23656 ? 150 ALA   A N    1 ? 
ATOM   928  C  CA   . ALA   A 1 127 ? -7.51953  -22.53715 -34.14866 1.000 12.38759 ? 150 ALA   A CA   1 ? 
ATOM   929  C  C    . ALA   A 1 127 ? -7.29303  -21.32439 -35.04045 1.000 13.46992 ? 150 ALA   A C    1 ? 
ATOM   930  O  O    . ALA   A 1 127 ? -6.16919  -21.11816 -35.52068 1.000 16.23095 ? 150 ALA   A O    1 ? 
ATOM   931  C  CB   . ALA   A 1 127 ? -7.79195  -23.76546 -35.02093 1.000 13.55911 ? 150 ALA   A CB   1 ? 
ATOM   932  N  N    . GLY   A 1 128 ? -8.32594  -20.50917 -35.26033 1.000 13.49175 ? 151 GLY   A N    1 ? 
ATOM   933  C  CA   . GLY   A 1 128 ? -8.24563  -19.44151 -36.22820 1.000 14.94881 ? 151 GLY   A CA   1 ? 
ATOM   934  C  C    . GLY   A 1 128 ? -8.52172  -18.08561 -35.61469 1.000 12.32569 ? 151 GLY   A C    1 ? 
ATOM   935  O  O    . GLY   A 1 128 ? -7.60372  -17.34576 -35.23505 1.000 13.25272 ? 151 GLY   A O    1 ? 
ATOM   936  N  N    . PRO   A 1 129 ? -9.80466  -17.74335 -35.49318 1.000 11.51213 ? 152 PRO   A N    1 ? 
ATOM   937  C  CA   . PRO   A 1 129 ? -10.16880 -16.41826 -34.95999 1.000 12.01144 ? 152 PRO   A CA   1 ? 
ATOM   938  C  C    . PRO   A 1 129 ? -9.46536  -16.03935 -33.65980 1.000 10.04418 ? 152 PRO   A C    1 ? 
ATOM   939  O  O    . PRO   A 1 129 ? -9.01597  -14.89960 -33.51810 1.000 11.22182 ? 152 PRO   A O    1 ? 
ATOM   940  C  CB   . PRO   A 1 129 ? -11.69479 -16.51873 -34.79113 1.000 13.03165 ? 152 PRO   A CB   1 ? 
ATOM   941  C  CG   . PRO   A 1 129 ? -12.11811 -17.51234 -35.82081 1.000 16.99976 ? 152 PRO   A CG   1 ? 
ATOM   942  C  CD   . PRO   A 1 129 ? -10.97906 -18.49944 -35.96497 1.000 13.30226 ? 152 PRO   A CD   1 ? 
ATOM   943  N  N    . SER   A 1 130 ? -9.36198  -16.95197 -32.68643 1.000 10.94400 ? 153 SER   A N    1 ? 
ATOM   944  C  CA   . SER   A 1 130 ? -8.75084  -16.53476 -31.42405 1.000 10.34376 ? 153 SER   A CA   1 ? 
ATOM   945  C  C    . SER   A 1 130 ? -7.26901  -16.23059 -31.56086 1.000 9.75272  ? 153 SER   A C    1 ? 
ATOM   946  O  O    . SER   A 1 130 ? -6.75630  -15.35811 -30.84899 1.000 10.82872 ? 153 SER   A O    1 ? 
ATOM   947  C  CB   . SER   A 1 130 ? -8.97377  -17.58641 -30.35539 1.000 10.03247 ? 153 SER   A CB   1 ? 
ATOM   948  O  OG   . SER   A 1 130 ? -10.34343 -17.61707 -30.01711 1.000 10.99597 ? 153 SER   A OG   1 ? 
ATOM   949  N  N    . VAL   A 1 131 ? -6.56528  -16.94616 -32.44127 1.000 10.43038 ? 154 VAL   A N    1 ? 
ATOM   950  C  CA   . VAL   A 1 131 ? -5.16918  -16.62014 -32.69554 1.000 12.44519 ? 154 VAL   A CA   1 ? 
ATOM   951  C  C    . VAL   A 1 131 ? -5.05706  -15.24876 -33.34420 1.000 11.12381 ? 154 VAL   A C    1 ? 
ATOM   952  O  O    . VAL   A 1 131 ? -4.18560  -14.45210 -32.99451 1.000 12.41338 ? 154 VAL   A O    1 ? 
ATOM   953  C  CB   . VAL   A 1 131 ? -4.50094  -17.71609 -33.54293 1.000 12.27763 ? 154 VAL   A CB   1 ? 
ATOM   954  C  CG1  . VAL   A 1 131 ? -3.01687  -17.37809 -33.75462 1.000 15.78927 ? 154 VAL   A CG1  1 ? 
ATOM   955  C  CG2  . VAL   A 1 131 ? -4.65663  -19.07975 -32.87426 1.000 12.84931 ? 154 VAL   A CG2  1 ? 
ATOM   956  N  N    . GLN   A 1 132 ? -5.96032  -14.94291 -34.28019 1.000 12.41736 ? 155 GLN   A N    1 ? 
ATOM   957  C  CA   . GLN   A 1 132 ? -5.95013  -13.62565 -34.91076 1.000 12.71909 ? 155 GLN   A CA   1 ? 
ATOM   958  C  C    . GLN   A 1 132 ? -6.25260  -12.52470 -33.90480 1.000 11.51539 ? 155 GLN   A C    1 ? 
ATOM   959  O  O    . GLN   A 1 132 ? -5.62333  -11.46081 -33.92496 1.000 13.56525 ? 155 GLN   A O    1 ? 
ATOM   960  C  CB   . GLN   A 1 132 ? -6.94443  -13.61328 -36.07468 1.000 14.68418 ? 155 GLN   A CB   1 ? 
ATOM   961  C  CG   . GLN   A 1 132 ? -6.43464  -14.43045 -37.26071 1.000 26.15449 ? 155 GLN   A CG   1 ? 
ATOM   962  C  CD   . GLN   A 1 132 ? -4.98309  -14.08536 -37.61464 1.000 40.77633 ? 155 GLN   A CD   1 ? 
ATOM   963  O  OE1  . GLN   A 1 132 ? -4.66510  -12.93994 -37.94352 1.000 42.71075 ? 155 GLN   A OE1  1 ? 
ATOM   964  N  NE2  . GLN   A 1 132 ? -4.09858  -15.08077 -37.54060 1.000 37.98041 ? 155 GLN   A NE2  1 ? 
ATOM   965  N  N    . PHE   A 1 133 ? -7.21563  -12.77075 -33.01402 1.000 11.11753 ? 156 PHE   A N    1 ? 
ATOM   966  C  CA   . PHE   A 1 133 ? -7.54031  -11.83317 -31.94142 1.000 11.04781 ? 156 PHE   A CA   1 ? 
ATOM   967  C  C    . PHE   A 1 133 ? -6.31949  -11.58860 -31.05306 1.000 10.24316 ? 156 PHE   A C    1 ? 
ATOM   968  O  O    . PHE   A 1 133 ? -5.98427  -10.44175 -30.73209 1.000 10.68000 ? 156 PHE   A O    1 ? 
ATOM   969  C  CB   . PHE   A 1 133 ? -8.69361  -12.46443 -31.15444 1.000 9.47631  ? 156 PHE   A CB   1 ? 
ATOM   970  C  CG   . PHE   A 1 133 ? -9.31560  -11.59265 -30.08011 1.000 9.40765  ? 156 PHE   A CG   1 ? 
ATOM   971  C  CD1  . PHE   A 1 133 ? -9.09159  -10.22373 -29.99162 1.000 11.20291 ? 156 PHE   A CD1  1 ? 
ATOM   972  C  CD2  . PHE   A 1 133 ? -10.14766 -12.19144 -29.13225 1.000 10.37264 ? 156 PHE   A CD2  1 ? 
ATOM   973  C  CE1  . PHE   A 1 133 ? -9.70390  -9.46089  -28.97393 1.000 11.72565 ? 156 PHE   A CE1  1 ? 
ATOM   974  C  CE2  . PHE   A 1 133 ? -10.74672 -11.44448 -28.12033 1.000 11.42731 ? 156 PHE   A CE2  1 ? 
ATOM   975  C  CZ   . PHE   A 1 133 ? -10.52009 -10.07160 -28.05205 1.000 11.53774 ? 156 PHE   A CZ   1 ? 
ATOM   976  N  N    . ALA   A 1 134 ? -5.62019  -12.66218 -30.67350 1.000 10.71494 ? 157 ALA   A N    1 ? 
ATOM   977  C  CA   . ALA   A 1 134 ? -4.43532  -12.50589 -29.83092 1.000 10.98137 ? 157 ALA   A CA   1 ? 
ATOM   978  C  C    . ALA   A 1 134 ? -3.37119  -11.65449 -30.51471 1.000 10.43086 ? 157 ALA   A C    1 ? 
ATOM   979  O  O    . ALA   A 1 134 ? -2.77745  -10.77618 -29.88411 1.000 10.96829 ? 157 ALA   A O    1 ? 
ATOM   980  C  CB   . ALA   A 1 134 ? -3.87704  -13.87866 -29.46576 1.000 11.19028 ? 157 ALA   A CB   1 ? 
ATOM   981  N  N    . ARG   A 1 135 ? -3.13772  -11.88761 -31.80863 1.000 10.85970 ? 158 ARG   A N    1 ? 
ATOM   982  C  CA   . ARG   A 1 135 ? -2.12160  -11.12599 -32.52701 1.000 12.55182 ? 158 ARG   A CA   1 ? 
ATOM   983  C  C    . ARG   A 1 135 ? -2.50030  -9.65630  -32.63427 1.000 12.97525 ? 158 ARG   A C    1 ? 
ATOM   984  O  O    . ARG   A 1 135 ? -1.65818  -8.77160  -32.42040 1.000 13.54787 ? 158 ARG   A O    1 ? 
ATOM   985  C  CB   . ARG   A 1 135 ? -1.91404  -11.75253 -33.90139 1.000 13.51600 ? 158 ARG   A CB   1 ? 
ATOM   986  C  CG   . ARG   A 1 135 ? -1.35986  -13.16326 -33.80867 1.000 17.58727 ? 158 ARG   A CG   1 ? 
ATOM   987  C  CD   . ARG   A 1 135 ? -1.02547  -13.73844 -35.18096 1.000 23.24526 ? 158 ARG   A CD   1 ? 
ATOM   988  N  NE   . ARG   A 1 135 ? -0.31990  -15.00954 -35.07267 1.000 39.24396 ? 158 ARG   A NE   1 ? 
ATOM   989  C  CZ   . ARG   A 1 135 ? -0.35672  -15.96885 -35.98841 1.000 45.69473 ? 158 ARG   A CZ   1 ? 
ATOM   990  N  NH1  . ARG   A 1 135 ? -1.04594  -15.82959 -37.10948 1.000 47.41209 ? 158 ARG   A NH1  1 ? 
ATOM   991  N  NH2  . ARG   A 1 135 ? 0.30208   -17.10318 -35.76694 1.000 50.90273 ? 158 ARG   A NH2  1 ? 
ATOM   992  N  N    . ILE   A 1 136 ? -3.76277  -9.37295  -32.96964 1.000 12.09141 ? 159 ILE   A N    1 ? 
ATOM   993  C  CA   . ILE   A 1 136 ? -4.22427  -7.98987  -33.01559 1.000 12.76208 ? 159 ILE   A CA   1 ? 
ATOM   994  C  C    . ILE   A 1 136 ? -4.03046  -7.30684  -31.66118 1.000 12.00744 ? 159 ILE   A C    1 ? 
ATOM   995  O  O    . ILE   A 1 136 ? -3.55037  -6.16790  -31.58136 1.000 12.95415 ? 159 ILE   A O    1 ? 
ATOM   996  C  CB   . ILE   A 1 136 ? -5.68502  -7.93349  -33.50294 1.000 13.39812 ? 159 ILE   A CB   1 ? 
ATOM   997  C  CG1  . ILE   A 1 136 ? -5.74316  -8.29464  -34.98857 1.000 14.12617 ? 159 ILE   A CG1  1 ? 
ATOM   998  C  CG2  . ILE   A 1 136 ? -6.31310  -6.57477  -33.19544 1.000 14.14394 ? 159 ILE   A CG2  1 ? 
ATOM   999  C  CD1  . ILE   A 1 136 ? -7.15395  -8.62907  -35.49728 1.000 13.59382 ? 159 ILE   A CD1  1 ? 
ATOM   1000 N  N    . MET   A 1 137 ? -4.42248  -7.99025  -30.57318 1.000 10.79833 ? 160 MET   A N    1 ? 
ATOM   1001 C  CA   . MET   A 1 137 ? -4.30471  -7.40840  -29.24475 1.000 11.85934 ? 160 MET   A CA   1 ? 
ATOM   1002 C  C    . MET   A 1 137 ? -2.85277  -7.12556  -28.89284 1.000 11.37871 ? 160 MET   A C    1 ? 
ATOM   1003 O  O    . MET   A 1 137 ? -2.54615  -6.09504  -28.28637 1.000 12.64838 ? 160 MET   A O    1 ? 
ATOM   1004 C  CB   . MET   A 1 137 ? -4.84909  -8.38668  -28.22140 1.000 10.96455 ? 160 MET   A CB   1 ? 
ATOM   1005 C  CG   . MET   A 1 137 ? -5.02188  -7.77169  -26.83102 1.000 10.94065 ? 160 MET   A CG   1 ? 
ATOM   1006 S  SD   . MET   A 1 137 ? -5.87410  -6.19626  -26.68023 1.000 12.39535 ? 160 MET   A SD   1 ? 
ATOM   1007 C  CE   . MET   A 1 137 ? -7.57002  -6.83218  -26.56994 1.000 13.24916 ? 160 MET   A CE   1 ? 
ATOM   1008 N  N    . ARG   A 1 138 ? -1.95405  -8.05718  -29.22330 1.000 11.33345 ? 161 ARG   A N    1 ? 
ATOM   1009 C  CA   . ARG   A 1 138 ? -0.52864  -7.85107  -28.95923 1.000 13.16422 ? 161 ARG   A CA   1 ? 
ATOM   1010 C  C    . ARG   A 1 138 ? -0.02561  -6.59345  -29.66377 1.000 13.91463 ? 161 ARG   A C    1 ? 
ATOM   1011 O  O    . ARG   A 1 138 ? 0.65738   -5.75685  -29.05938 1.000 13.02502 ? 161 ARG   A O    1 ? 
ATOM   1012 C  CB   . ARG   A 1 138 ? 0.23508   -9.08636  -29.42614 1.000 13.07293 ? 161 ARG   A CB   1 ? 
ATOM   1013 C  CG   . ARG   A 1 138 ? 1.73768   -9.07599  -29.17728 1.000 13.74245 ? 161 ARG   A CG   1 ? 
ATOM   1014 C  CD   . ARG   A 1 138 ? 2.50753   -8.38788  -30.31308 1.000 16.55657 ? 161 ARG   A CD   1 ? 
ATOM   1015 N  NE   . ARG   A 1 138 ? 2.13401   -8.91596  -31.62306 1.000 17.76178 ? 161 ARG   A NE   1 ? 
ATOM   1016 C  CZ   . ARG   A 1 138 ? 2.61959   -10.02791 -32.16123 1.000 17.26303 ? 161 ARG   A CZ   1 ? 
ATOM   1017 N  NH1  . ARG   A 1 138 ? 3.52083   -10.76836 -31.53632 1.000 17.95161 ? 161 ARG   A NH1  1 ? 
ATOM   1018 N  NH2  . ARG   A 1 138 ? 2.18076   -10.41701 -33.35687 1.000 21.56460 ? 161 ARG   A NH2  1 ? 
ATOM   1019 N  N    . ASP   A 1 139 ? -0.41057  -6.41746  -30.93091 1.000 14.18150 ? 162 ASP   A N    1 ? 
ATOM   1020 C  CA   . ASP   A 1 139 ? -0.00613  -5.21619  -31.65760 1.000 15.11046 ? 162 ASP   A CA   1 ? 
ATOM   1021 C  C    . ASP   A 1 139 ? -0.56776  -3.95517  -31.01097 1.000 18.68298 ? 162 ASP   A C    1 ? 
ATOM   1022 O  O    . ASP   A 1 139 ? 0.09981   -2.91688  -30.97618 1.000 19.92442 ? 162 ASP   A O    1 ? 
ATOM   1023 C  CB   . ASP   A 1 139 ? -0.44199  -5.30703  -33.12191 1.000 17.99818 ? 162 ASP   A CB   1 ? 
ATOM   1024 C  CG   . ASP   A 1 139 ? 0.32810   -6.35534  -33.91395 1.000 18.94625 ? 162 ASP   A CG   1 ? 
ATOM   1025 O  OD1  . ASP   A 1 139 ? 1.35512   -6.86780  -33.42169 1.000 19.53353 ? 162 ASP   A OD1  1 ? 
ATOM   1026 O  OD2  . ASP   A 1 139 ? -0.09020  -6.66414  -35.05404 1.000 22.53586 ? 162 ASP   A OD2  1 ? 
ATOM   1027 N  N    . GLN   A 1 140 ? -1.78764  -4.02376  -30.47612 1.000 15.07003 ? 163 GLN   A N    1 ? 
ATOM   1028 C  CA   . GLN   A 1 140 ? -2.40917  -2.84403  -29.88208 1.000 17.97109 ? 163 GLN   A CA   1 ? 
ATOM   1029 C  C    . GLN   A 1 140 ? -1.76872  -2.46322  -28.55733 1.000 19.66902 ? 163 GLN   A C    1 ? 
ATOM   1030 O  O    . GLN   A 1 140 ? -1.60441  -1.27526  -28.26246 1.000 21.90494 ? 163 GLN   A O    1 ? 
ATOM   1031 C  CB   . GLN   A 1 140 ? -3.90305  -3.08505  -29.68136 1.000 19.20068 ? 163 GLN   A CB   1 ? 
ATOM   1032 C  CG   . GLN   A 1 140 ? -4.68512  -2.97380  -30.94358 1.000 20.82786 ? 163 GLN   A CG   1 ? 
ATOM   1033 C  CD   . GLN   A 1 140 ? -4.35035  -1.68889  -31.64407 1.000 16.83420 ? 163 GLN   A CD   1 ? 
ATOM   1034 O  OE1  . GLN   A 1 140 ? -4.33720  -0.63259  -31.01674 1.000 21.95399 ? 163 GLN   A OE1  1 ? 
ATOM   1035 N  NE2  . GLN   A 1 140 ? -4.00906  -1.77660  -32.92090 1.000 20.85609 ? 163 GLN   A NE2  1 ? 
ATOM   1036 N  N    . LEU   A 1 141 ? -1.46326  -3.44122  -27.71055 1.000 16.13024 ? 164 LEU   A N    1 ? 
ATOM   1037 C  CA   . LEU   A 1 141 ? -0.77761  -3.10632  -26.47177 1.000 16.07104 ? 164 LEU   A CA   1 ? 
ATOM   1038 C  C    . LEU   A 1 141 ? 0.58251   -2.48635  -26.76249 1.000 18.55472 ? 164 LEU   A C    1 ? 
ATOM   1039 O  O    . LEU   A 1 141 ? 0.96807   -1.49396  -26.13149 1.000 19.86614 ? 164 LEU   A O    1 ? 
ATOM   1040 C  CB   . LEU   A 1 141 ? -0.66745  -4.34485  -25.57842 1.000 15.85508 ? 164 LEU   A CB   1 ? 
ATOM   1041 C  CG   . LEU   A 1 141 ? -2.01613  -4.76803  -24.98398 1.000 13.74812 ? 164 LEU   A CG   1 ? 
ATOM   1042 C  CD1  . LEU   A 1 141 ? -2.00902  -6.24895  -24.63963 1.000 15.20091 ? 164 LEU   A CD1  1 ? 
ATOM   1043 C  CD2  . LEU   A 1 141 ? -2.30276  -3.91461  -23.75474 1.000 18.78258 ? 164 LEU   A CD2  1 ? 
ATOM   1044 N  N    . GLN   A 1 142 ? 1.30658   -3.04654  -27.73449 1.000 16.56945 ? 165 GLN   A N    1 ? 
ATOM   1045 C  CA   . GLN   A 1 142 ? 2.58208   -2.47414  -28.14964 1.000 21.14760 ? 165 GLN   A CA   1 ? 
ATOM   1046 C  C    . GLN   A 1 142 ? 2.39643   -1.04265  -28.62603 1.000 22.10228 ? 165 GLN   A C    1 ? 
ATOM   1047 O  O    . GLN   A 1 142 ? 3.21356   -0.16675  -28.31567 1.000 23.96798 ? 165 GLN   A O    1 ? 
ATOM   1048 C  CB   . GLN   A 1 142 ? 3.18621   -3.34568  -29.25277 1.000 21.47487 ? 165 GLN   A CB   1 ? 
ATOM   1049 C  CG   . GLN   A 1 142 ? 4.69367   -3.19989  -29.44985 1.000 36.69395 ? 165 GLN   A CG   1 ? 
ATOM   1050 C  CD   . GLN   A 1 142 ? 5.18243   -3.92861  -30.69297 1.000 41.90342 ? 165 GLN   A CD   1 ? 
ATOM   1051 O  OE1  . GLN   A 1 142 ? 4.76051   -5.05128  -30.97534 1.000 49.22784 ? 165 GLN   A OE1  1 ? 
ATOM   1052 N  NE2  . GLN   A 1 142 ? 6.07236   -3.28928  -31.44379 1.000 51.78557 ? 165 GLN   A NE2  1 ? 
ATOM   1053 N  N    . ALA   A 1 143 ? 1.30967   -0.78034  -29.35756 1.000 22.45875 ? 166 ALA   A N    1 ? 
ATOM   1054 C  CA   . ALA   A 1 143 ? 1.05501   0.56347   -29.86970 1.000 25.76100 ? 166 ALA   A CA   1 ? 
ATOM   1055 C  C    . ALA   A 1 143 ? 0.74502   1.56379   -28.75850 1.000 30.25068 ? 166 ALA   A C    1 ? 
ATOM   1056 O  O    . ALA   A 1 143 ? 1.04638   2.75378   -28.90350 1.000 35.31171 ? 166 ALA   A O    1 ? 
ATOM   1057 C  CB   . ALA   A 1 143 ? -0.06722  0.53058   -30.90428 1.000 27.17632 ? 166 ALA   A CB   1 ? 
ATOM   1058 N  N    . SER   A 1 144 ? 0.13559   1.11962   -27.65720 1.000 24.25786 ? 167 SER   A N    1 ? 
ATOM   1059 C  CA   . SER   A 1 144 ? -0.05665  1.97747   -26.48776 1.000 25.78318 ? 167 SER   A CA   1 ? 
ATOM   1060 C  C    . SER   A 1 144 ? 1.19367   2.18037   -25.70592 1.000 21.01289 ? 167 SER   A C    1 ? 
ATOM   1061 O  O    . SER   A 1 144 ? 1.14287   2.78823   -24.62611 1.000 26.56816 ? 167 SER   A O    1 ? 
ATOM   1062 C  CB   . SER   A 1 144 ? -1.12688  1.39358   -25.56146 1.000 27.81693 ? 167 SER   A CB   1 ? 
ATOM   1063 O  OG   . SER   A 1 144 ? -2.41907  1.63968   -26.07355 1.000 26.30755 ? 167 SER   A OG   1 ? 
ATOM   1064 N  N    . GLY   A 1 145 ? 2.32706   1.68031   -26.18633 1.000 21.45965 ? 168 GLY   A N    1 ? 
ATOM   1065 C  CA   . GLY   A 1 145 ? 3.55839   1.83452   -25.44827 1.000 21.21419 ? 168 GLY   A CA   1 ? 
ATOM   1066 C  C    . GLY   A 1 145 ? 3.69770   0.93517   -24.24722 1.000 24.44735 ? 168 GLY   A C    1 ? 
ATOM   1067 O  O    . GLY   A 1 145 ? 4.50314   1.22218   -23.36203 1.000 26.04826 ? 168 GLY   A O    1 ? 
ATOM   1068 N  N    . ILE   A 1 146 ? 2.93701   -0.15013  -24.17855 1.000 22.30133 ? 169 ILE   A N    1 ? 
ATOM   1069 C  CA   . ILE   A 1 146 ? 3.12914   -1.17109  -23.15438 1.000 22.23329 ? 169 ILE   A CA   1 ? 
ATOM   1070 C  C    . ILE   A 1 146 ? 4.17824   -2.13993  -23.69207 1.000 16.36400 ? 169 ILE   A C    1 ? 
ATOM   1071 O  O    . ILE   A 1 146 ? 3.95519   -2.74240  -24.75290 1.000 19.78787 ? 169 ILE   A O    1 ? 
ATOM   1072 C  CB   . ILE   A 1 146 ? 1.82426   -1.92151  -22.86463 1.000 19.05707 ? 169 ILE   A CB   1 ? 
ATOM   1073 C  CG1  . ILE   A 1 146 ? 0.68707   -0.96681  -22.48863 1.000 21.67250 ? 169 ILE   A CG1  1 ? 
ATOM   1074 C  CG2  . ILE   A 1 146 ? 2.03925   -2.85343  -21.68903 1.000 19.77161 ? 169 ILE   A CG2  1 ? 
ATOM   1075 C  CD1  . ILE   A 1 146 ? 1.03845   0.01530   -21.40446 1.000 29.58227 ? 169 ILE   A CD1  1 ? 
ATOM   1076 N  N    . PRO   A 1 147 ? 5.30647   -2.32709  -23.01343 1.000 18.59885 ? 170 PRO   A N    1 ? 
ATOM   1077 C  CA   . PRO   A 1 147 ? 6.33016   -3.22670  -23.55607 1.000 17.84277 ? 170 PRO   A CA   1 ? 
ATOM   1078 C  C    . PRO   A 1 147 ? 5.84801   -4.66767  -23.57063 1.000 18.16025 ? 170 PRO   A C    1 ? 
ATOM   1079 O  O    . PRO   A 1 147 ? 5.13121   -5.10921  -22.67067 1.000 17.83078 ? 170 PRO   A O    1 ? 
ATOM   1080 C  CB   . PRO   A 1 147 ? 7.51910   -3.04475  -22.59932 1.000 20.24293 ? 170 PRO   A CB   1 ? 
ATOM   1081 C  CG   . PRO   A 1 147 ? 6.94399   -2.46681  -21.36010 1.000 25.40456 ? 170 PRO   A CG   1 ? 
ATOM   1082 C  CD   . PRO   A 1 147 ? 5.70496   -1.71394  -21.73487 1.000 21.71632 ? 170 PRO   A CD   1 ? 
ATOM   1083 N  N    . LYS   A 1 148 ? 6.22865   -5.39414  -24.61642 1.000 15.48670 ? 171 LYS   A N    1 ? 
ATOM   1084 C  CA   . LYS   A 1 148 ? 6.01982   -6.83392  -24.62780 1.000 14.73264 ? 171 LYS   A CA   1 ? 
ATOM   1085 C  C    . LYS   A 1 148 ? 6.82489   -7.45448  -23.49441 1.000 17.21137 ? 171 LYS   A C    1 ? 
ATOM   1086 O  O    . LYS   A 1 148 ? 7.95468   -7.03849  -23.22098 1.000 19.77986 ? 171 LYS   A O    1 ? 
ATOM   1087 C  CB   . LYS   A 1 148 ? 6.49417   -7.40453  -25.96141 1.000 18.95108 ? 171 LYS   A CB   1 ? 
ATOM   1088 C  CG   . LYS   A 1 148 ? 5.67969   -6.90241  -27.14798 1.000 17.83690 ? 171 LYS   A CG   1 ? 
ATOM   1089 C  CD   . LYS   A 1 148 ? 6.13688   -7.53180  -28.44085 1.000 26.37341 ? 171 LYS   A CD   1 ? 
ATOM   1090 C  CE   . LYS   A 1 148 ? 7.37893   -6.86499  -28.98905 1.000 36.50659 ? 171 LYS   A CE   1 ? 
ATOM   1091 N  NZ   . LYS   A 1 148 ? 7.35676   -6.89214  -30.48045 1.000 40.74541 ? 171 LYS   A NZ   1 ? 
ATOM   1092 N  N    . ALA   A 1 149 ? 6.25228   -8.44910  -22.82412 1.000 14.46305 ? 172 ALA   A N    1 ? 
ATOM   1093 C  CA   . ALA   A 1 149 ? 6.95616   -9.04911  -21.69697 1.000 11.70482 ? 172 ALA   A CA   1 ? 
ATOM   1094 C  C    . ALA   A 1 149 ? 8.33287   -9.53744  -22.12771 1.000 14.97468 ? 172 ALA   A C    1 ? 
ATOM   1095 O  O    . ALA   A 1 149 ? 8.49973   -10.13220 -23.19534 1.000 15.62729 ? 172 ALA   A O    1 ? 
ATOM   1096 C  CB   . ALA   A 1 149 ? 6.14654   -10.20858 -21.12093 1.000 11.93711 ? 172 ALA   A CB   1 ? 
ATOM   1097 N  N    . ASN   A 1 150 ? 9.32307   -9.28701  -21.27547 1.000 14.00088 ? 173 ASN   A N    1 ? 
ATOM   1098 C  CA   . ASN   A 1 150 ? 10.69994  -9.69404  -21.53123 1.000 15.41677 ? 173 ASN   A CA   1 ? 
ATOM   1099 C  C    . ASN   A 1 150 ? 11.11839  -10.88156 -20.67538 1.000 15.38569 ? 173 ASN   A C    1 ? 
ATOM   1100 O  O    . ASN   A 1 150 ? 12.31068  -11.17632 -20.57387 1.000 15.80576 ? 173 ASN   A O    1 ? 
ATOM   1101 C  CB   . ASN   A 1 150 ? 11.64253  -8.51016  -21.32508 1.000 14.86755 ? 173 ASN   A CB   1 ? 
ATOM   1102 C  CG   . ASN   A 1 150 ? 11.64094  -8.01438  -19.88387 1.000 17.82334 ? 173 ASN   A CG   1 ? 
ATOM   1103 O  OD1  . ASN   A 1 150 ? 10.81114  -8.43759  -19.06338 1.000 15.29490 ? 173 ASN   A OD1  1 ? 
ATOM   1104 N  ND2  . ASN   A 1 150 ? 12.57757  -7.12784  -19.55991 1.000 16.55986 ? 173 ASN   A ND2  1 ? 
ATOM   1105 N  N    . TYR   A 1 151 ? 10.15521  -11.57974 -20.07309 1.000 13.73938 ? 174 TYR   A N    1 ? 
ATOM   1106 C  CA   . TYR   A 1 151 ? 10.43261  -12.68450 -19.16601 1.000 15.15432 ? 174 TYR   A CA   1 ? 
ATOM   1107 C  C    . TYR   A 1 151 ? 9.49580   -13.86769 -19.36695 1.000 13.61463 ? 174 TYR   A C    1 ? 
ATOM   1108 O  O    . TYR   A 1 151 ? 9.66835   -14.88672 -18.69275 1.000 13.90973 ? 174 TYR   A O    1 ? 
ATOM   1109 C  CB   . TYR   A 1 151 ? 10.35468  -12.20120 -17.69576 1.000 14.01112 ? 174 TYR   A CB   1 ? 
ATOM   1110 C  CG   . TYR   A 1 151 ? 8.94632   -11.87159 -17.25445 1.000 13.48742 ? 174 TYR   A CG   1 ? 
ATOM   1111 C  CD1  . TYR   A 1 151 ? 8.35225   -10.65422 -17.58109 1.000 11.98657 ? 174 TYR   A CD1  1 ? 
ATOM   1112 C  CD2  . TYR   A 1 151 ? 8.19726   -12.80190 -16.54196 1.000 14.60159 ? 174 TYR   A CD2  1 ? 
ATOM   1113 C  CE1  . TYR   A 1 151 ? 7.04329   -10.37093 -17.19872 1.000 13.97390 ? 174 TYR   A CE1  1 ? 
ATOM   1114 C  CE2  . TYR   A 1 151 ? 6.90099   -12.53384 -16.15968 1.000 16.49419 ? 174 TYR   A CE2  1 ? 
ATOM   1115 C  CZ   . TYR   A 1 151 ? 6.32546   -11.32208 -16.49146 1.000 14.19234 ? 174 TYR   A CZ   1 ? 
ATOM   1116 O  OH   . TYR   A 1 151 ? 5.02643   -11.04385 -16.10764 1.000 14.20381 ? 174 TYR   A OH   1 ? 
ATOM   1117 N  N    . ILE   A 1 152 ? 8.50735   -13.77017 -20.26188 1.000 12.32316 ? 175 ILE   A N    1 ? 
ATOM   1118 C  CA   . ILE   A 1 152 ? 7.53525   -14.84505 -20.44162 1.000 14.58365 ? 175 ILE   A CA   1 ? 
ATOM   1119 C  C    . ILE   A 1 152 ? 6.87068   -14.66056 -21.79536 1.000 12.90907 ? 175 ILE   A C    1 ? 
ATOM   1120 O  O    . ILE   A 1 152 ? 6.83165   -13.55424 -22.33285 1.000 15.50773 ? 175 ILE   A O    1 ? 
ATOM   1121 C  CB   . ILE   A 1 152 ? 6.51469   -14.88359 -19.27228 1.000 13.51503 ? 175 ILE   A CB   1 ? 
ATOM   1122 C  CG1  . ILE   A 1 152 ? 5.66142   -16.15371 -19.32174 1.000 14.66188 ? 175 ILE   A CG1  1 ? 
ATOM   1123 C  CG2  . ILE   A 1 152 ? 5.64673   -13.61604 -19.24289 1.000 13.42519 ? 175 ILE   A CG2  1 ? 
ATOM   1124 C  CD1  . ILE   A 1 152 ? 4.93413   -16.45647 -18.01889 1.000 17.20646 ? 175 ILE   A CD1  1 ? 
ATOM   1125 N  N    . GLY   A 1 153 ? 6.38780   -15.77006 -22.36965 1.000 13.16448 ? 176 GLY   A N    1 ? 
ATOM   1126 C  CA   . GLY   A 1 153 ? 5.82946   -15.75381 -23.70908 1.000 16.04867 ? 176 GLY   A CA   1 ? 
ATOM   1127 C  C    . GLY   A 1 153 ? 6.88392   -15.48739 -24.77649 1.000 14.76766 ? 176 GLY   A C    1 ? 
ATOM   1128 O  O    . GLY   A 1 153 ? 8.09250   -15.45976 -24.50778 1.000 17.17120 ? 176 GLY   A O    1 ? 
ATOM   1129 N  N    . GLN   A 1 154 ? 6.40408   -15.27730 -26.00572 1.000 17.04310 ? 177 GLN   A N    1 ? 
ATOM   1130 C  CA   . GLN   A 1 154 ? 7.25108   -14.97032 -27.16210 1.000 18.18447 ? 177 GLN   A CA   1 ? 
ATOM   1131 C  C    . GLN   A 1 154 ? 6.69986   -13.73627 -27.86206 1.000 17.26813 ? 177 GLN   A C    1 ? 
ATOM   1132 O  O    . GLN   A 1 154 ? 5.60572   -13.78296 -28.44026 1.000 14.71116 ? 177 GLN   A O    1 ? 
ATOM   1133 C  CB   . GLN   A 1 154 ? 7.32674   -16.15056 -28.14445 1.000 18.53667 ? 177 GLN   A CB   1 ? 
ATOM   1134 C  CG   . GLN   A 1 154 ? 7.90369   -17.44489 -27.54726 1.000 27.01488 ? 177 GLN   A CG   1 ? 
ATOM   1135 C  CD   . GLN   A 1 154 ? 7.64452   -18.68801 -28.39827 1.000 35.21596 ? 177 GLN   A CD   1 ? 
ATOM   1136 O  OE1  . GLN   A 1 154 ? 8.10866   -18.78948 -29.53627 1.000 33.13995 ? 177 GLN   A OE1  1 ? 
ATOM   1137 N  NE2  . GLN   A 1 154 ? 6.90329   -19.63937 -27.84367 1.000 32.35396 ? 177 GLN   A NE2  1 ? 
ATOM   1138 N  N    . ASP   A 1 155 ? 7.44449   -12.63245 -27.81613 1.000 17.35143 ? 178 ASP   A N    1 ? 
ATOM   1139 C  CA   . ASP   A 1 155 ? 7.03764   -11.38935 -28.46998 1.000 15.07880 ? 178 ASP   A CA   1 ? 
ATOM   1140 C  C    . ASP   A 1 155 ? 5.61051   -10.99383 -28.09580 1.000 15.28950 ? 178 ASP   A C    1 ? 
ATOM   1141 O  O    . ASP   A 1 155 ? 4.81857   -10.53663 -28.92856 1.000 14.81018 ? 178 ASP   A O    1 ? 
ATOM   1142 C  CB   . ASP   A 1 155 ? 7.21995   -11.45202 -29.98422 1.000 20.88045 ? 178 ASP   A CB   1 ? 
ATOM   1143 C  CG   . ASP   A 1 155 ? 8.67576   -11.40331 -30.38656 1.000 34.76660 ? 178 ASP   A CG   1 ? 
ATOM   1144 O  OD1  . ASP   A 1 155 ? 9.37780   -10.46473 -29.94471 1.000 34.75661 ? 178 ASP   A OD1  1 ? 
ATOM   1145 O  OD2  . ASP   A 1 155 ? 9.11063   -12.29642 -31.14327 1.000 36.52497 ? 178 ASP   A OD2  1 ? 
ATOM   1146 N  N    . GLY   A 1 156 ? 5.28082   -11.17357 -26.82337 1.000 13.77028 ? 179 GLY   A N    1 ? 
ATOM   1147 C  CA   . GLY   A 1 156 ? 4.00119   -10.73041 -26.32467 1.000 13.14060 ? 179 GLY   A CA   1 ? 
ATOM   1148 C  C    . GLY   A 1 156 ? 2.86893   -11.71795 -26.49063 1.000 12.98358 ? 179 GLY   A C    1 ? 
ATOM   1149 O  O    . GLY   A 1 156 ? 1.73081   -11.37338 -26.15803 1.000 12.06232 ? 179 GLY   A O    1 ? 
ATOM   1150 N  N    . LEU   A 1 157 ? 3.14456   -12.92717 -26.98039 1.000 13.64045 ? 180 LEU   A N    1 ? 
ATOM   1151 C  CA   . LEU   A 1 157 ? 2.14552   -13.97102 -27.17948 1.000 12.25758 ? 180 LEU   A CA   1 ? 
ATOM   1152 C  C    . LEU   A 1 157 ? 2.51603   -15.22213 -26.39387 1.000 13.11281 ? 180 LEU   A C    1 ? 
ATOM   1153 O  O    . LEU   A 1 157 ? 3.69619   -15.53502 -26.21303 1.000 13.65427 ? 180 LEU   A O    1 ? 
ATOM   1154 C  CB   . LEU   A 1 157 ? 2.05011   -14.35310 -28.66527 1.000 12.53212 ? 180 LEU   A CB   1 ? 
ATOM   1155 C  CG   . LEU   A 1 157 ? 1.50414   -13.26744 -29.59133 1.000 14.09650 ? 180 LEU   A CG   1 ? 
ATOM   1156 C  CD1  . LEU   A 1 157 ? 1.62432   -13.70733 -31.04884 1.000 19.28000 ? 180 LEU   A CD1  1 ? 
ATOM   1157 C  CD2  . LEU   A 1 157 ? 0.05064   -12.97586 -29.23921 1.000 16.12322 ? 180 LEU   A CD2  1 ? 
ATOM   1158 N  N    . TYR   A 1 158 ? 1.50190   -15.96847 -25.95679 1.000 10.66125 ? 181 TYR   A N    1 ? 
ATOM   1159 C  CA   . TYR   A 1 158 ? 1.73750   -17.22783 -25.24554 1.000 10.90404 ? 181 TYR   A CA   1 ? 
ATOM   1160 C  C    . TYR   A 1 158 ? 0.58931   -18.18049 -25.58186 1.000 10.99930 ? 181 TYR   A C    1 ? 
ATOM   1161 O  O    . TYR   A 1 158 ? -0.48470  -18.09769 -24.98455 1.000 10.52238 ? 181 TYR   A O    1 ? 
ATOM   1162 C  CB   . TYR   A 1 158 ? 1.87594   -16.97855 -23.74807 1.000 11.85055 ? 181 TYR   A CB   1 ? 
ATOM   1163 C  CG   . TYR   A 1 158 ? 2.37153   -18.14047 -22.89549 1.000 10.05365 ? 181 TYR   A CG   1 ? 
ATOM   1164 C  CD1  . TYR   A 1 158 ? 2.44401   -19.44642 -23.39549 1.000 12.60606 ? 181 TYR   A CD1  1 ? 
ATOM   1165 C  CD2  . TYR   A 1 158 ? 2.74881   -17.93446 -21.57894 1.000 12.68608 ? 181 TYR   A CD2  1 ? 
ATOM   1166 C  CE1  . TYR   A 1 158 ? 2.87139   -20.51115 -22.59508 1.000 11.76135 ? 181 TYR   A CE1  1 ? 
ATOM   1167 C  CE2  . TYR   A 1 158 ? 3.18701   -18.99478 -20.77254 1.000 14.48839 ? 181 TYR   A CE2  1 ? 
ATOM   1168 C  CZ   . TYR   A 1 158 ? 3.24146   -20.27234 -21.29686 1.000 11.80112 ? 181 TYR   A CZ   1 ? 
ATOM   1169 O  OH   . TYR   A 1 158 ? 3.66562   -21.31515 -20.50457 1.000 13.45226 ? 181 TYR   A OH   1 ? 
ATOM   1170 N  N    . GLY   A 1 159 ? 0.81676   -19.07236 -26.54485 1.000 10.59407 ? 182 GLY   A N    1 ? 
ATOM   1171 C  CA   . GLY   A 1 159 ? -0.14413  -20.12997 -26.82432 1.000 11.02657 ? 182 GLY   A CA   1 ? 
ATOM   1172 C  C    . GLY   A 1 159 ? 0.07552   -21.24180 -25.81515 1.000 10.44826 ? 182 GLY   A C    1 ? 
ATOM   1173 O  O    . GLY   A 1 159 ? 1.21507   -21.66240 -25.58097 1.000 10.69135 ? 182 GLY   A O    1 ? 
ATOM   1174 N  N    . ARG   A 1 160 ? -0.99789  -21.70201 -25.18769 1.000 10.22722 ? 183 ARG   A N    1 ? 
ATOM   1175 C  CA   . ARG   A 1 160 ? -0.81220  -22.60826 -24.06175 1.000 10.79913 ? 183 ARG   A CA   1 ? 
ATOM   1176 C  C    . ARG   A 1 160 ? -2.04993  -23.46770 -23.85002 1.000 10.15220 ? 183 ARG   A C    1 ? 
ATOM   1177 O  O    . ARG   A 1 160 ? -3.16401  -23.11993 -24.27250 1.000 9.80147  ? 183 ARG   A O    1 ? 
ATOM   1178 C  CB   . ARG   A 1 160 ? -0.49350  -21.82988 -22.78234 1.000 11.34659 ? 183 ARG   A CB   1 ? 
ATOM   1179 C  CG   . ARG   A 1 160 ? -1.61919  -20.88385 -22.35807 1.000 9.09515  ? 183 ARG   A CG   1 ? 
ATOM   1180 C  CD   . ARG   A 1 160 ? -1.09648  -19.84243 -21.41268 1.000 10.17762 ? 183 ARG   A CD   1 ? 
ATOM   1181 N  NE   . ARG   A 1 160 ? -0.62334  -20.45207 -20.17151 1.000 10.99604 ? 183 ARG   A NE   1 ? 
ATOM   1182 C  CZ   . ARG   A 1 160 ? -0.11899  -19.75061 -19.16933 1.000 13.57556 ? 183 ARG   A CZ   1 ? 
ATOM   1183 N  NH1  . ARG   A 1 160 ? 0.02641   -18.43354 -19.25094 1.000 12.91775 ? 183 ARG   A NH1  1 ? 
ATOM   1184 N  NH2  . ARG   A 1 160 ? 0.22203   -20.38115 -18.04634 1.000 14.58562 ? 183 ARG   A NH2  1 ? 
ATOM   1185 N  N    . SER   A 1 161 ? -1.85348  -24.58047 -23.13071 1.000 9.80075  ? 184 SER   A N    1 ? 
ATOM   1186 C  CA   . SER   A 1 161 ? -2.87530  -25.59864 -22.93514 1.000 10.74763 ? 184 SER   A CA   1 ? 
ATOM   1187 C  C    . SER   A 1 161 ? -3.44324  -25.64681 -21.51962 1.000 9.15219  ? 184 SER   A C    1 ? 
ATOM   1188 O  O    . SER   A 1 161 ? -4.36825  -26.43597 -21.27478 1.000 9.93536  ? 184 SER   A O    1 ? 
ATOM   1189 C  CB   . SER   A 1 161 ? -2.28285  -26.98177 -23.27449 1.000 10.85662 ? 184 SER   A CB   1 ? 
ATOM   1190 O  OG   . SER   A 1 161 ? -1.12214  -27.21186 -22.46402 1.000 10.63601 ? 184 SER   A OG   1 ? 
ATOM   1191 N  N    . ASP   A 1 162 ? -2.89674  -24.86248 -20.58269 1.000 8.98885  ? 185 ASP   A N    1 ? 
ATOM   1192 C  CA   . ASP   A 1 162 ? -3.15752  -25.06542 -19.15954 1.000 9.22829  ? 185 ASP   A CA   1 ? 
ATOM   1193 C  C    . ASP   A 1 162 ? -4.20195  -24.13039 -18.54450 1.000 11.64317 ? 185 ASP   A C    1 ? 
ATOM   1194 O  O    . ASP   A 1 162 ? -4.46057  -24.24960 -17.34574 1.000 13.94868 ? 185 ASP   A O    1 ? 
ATOM   1195 C  CB   . ASP   A 1 162 ? -1.85447  -25.01782 -18.34617 1.000 11.11019 ? 185 ASP   A CB   1 ? 
ATOM   1196 C  CG   . ASP   A 1 162 ? -1.08094  -23.75085 -18.55369 1.000 14.75543 ? 185 ASP   A CG   1 ? 
ATOM   1197 O  OD1  . ASP   A 1 162 ? -1.05868  -23.22360 -19.67973 1.000 14.14614 ? 185 ASP   A OD1  1 ? 
ATOM   1198 O  OD2  . ASP   A 1 162 ? -0.48069  -23.26516 -17.57932 1.000 21.43730 ? 185 ASP   A OD2  1 ? 
ATOM   1199 N  N    . LEU   A 1 163 ? -4.80729  -23.21029 -19.30694 1.000 10.21570 ? 186 LEU   A N    1 ? 
ATOM   1200 C  CA   . LEU   A 1 163 ? -5.79143  -22.28815 -18.74135 1.000 9.63051  ? 186 LEU   A CA   1 ? 
ATOM   1201 C  C    . LEU   A 1 163 ? -7.19756  -22.76212 -19.09236 1.000 10.42168 ? 186 LEU   A C    1 ? 
ATOM   1202 O  O    . LEU   A 1 163 ? -7.56471  -22.81935 -20.27221 1.000 10.23956 ? 186 LEU   A O    1 ? 
ATOM   1203 C  CB   . LEU   A 1 163 ? -5.54930  -20.85744 -19.21881 1.000 10.79150 ? 186 LEU   A CB   1 ? 
ATOM   1204 C  CG   . LEU   A 1 163 ? -4.15099  -20.31443 -18.87961 1.000 11.23278 ? 186 LEU   A CG   1 ? 
ATOM   1205 C  CD1  . LEU   A 1 163 ? -3.99536  -18.85205 -19.25268 1.000 12.19549 ? 186 LEU   A CD1  1 ? 
ATOM   1206 C  CD2  . LEU   A 1 163 ? -3.86227  -20.51039 -17.39917 1.000 16.44902 ? 186 LEU   A CD2  1 ? 
ATOM   1207 N  N    . ALA   A 1 164 ? -7.98045  -23.08184 -18.05824 1.000 10.33006 ? 187 ALA   A N    1 ? 
ATOM   1208 C  CA   . ALA   A 1 164 ? -9.29228  -23.69358 -18.25883 1.000 10.29578 ? 187 ALA   A CA   1 ? 
ATOM   1209 C  C    . ALA   A 1 164 ? -10.22329 -22.78810 -19.04223 1.000 11.05512 ? 187 ALA   A C    1 ? 
ATOM   1210 O  O    . ALA   A 1 164 ? -10.95902 -23.25856 -19.91467 1.000 11.18072 ? 187 ALA   A O    1 ? 
ATOM   1211 C  CB   . ALA   A 1 164 ? -9.92207  -24.03763 -16.90959 1.000 10.22694 ? 187 ALA   A CB   1 ? 
ATOM   1212 N  N    . GLY   A 1 165 ? -10.21250 -21.48663 -18.73926 1.000 10.91405 ? 188 GLY   A N    1 ? 
ATOM   1213 C  CA   . GLY   A 1 165 ? -11.11432 -20.57017 -19.42660 1.000 10.83097 ? 188 GLY   A CA   1 ? 
ATOM   1214 C  C    . GLY   A 1 165 ? -10.84410 -20.47635 -20.91340 1.000 11.33185 ? 188 GLY   A C    1 ? 
ATOM   1215 O  O    . GLY   A 1 165 ? -11.77025 -20.35323 -21.71736 1.000 13.78511 ? 188 GLY   A O    1 ? 
ATOM   1216 N  N    . LEU   A 1 166 ? -9.56760  -20.54305 -21.30659 1.000 9.31344  ? 189 LEU   A N    1 ? 
ATOM   1217 C  CA   . LEU   A 1 166 ? -9.23986  -20.56896 -22.72728 1.000 9.53365  ? 189 LEU   A CA   1 ? 
ATOM   1218 C  C    . LEU   A 1 166 ? -9.63440  -21.91238 -23.33348 1.000 9.88258  ? 189 LEU   A C    1 ? 
ATOM   1219 O  O    . LEU   A 1 166 ? -10.18821 -21.97464 -24.44069 1.000 11.57388 ? 189 LEU   A O    1 ? 
ATOM   1220 C  CB   . LEU   A 1 166 ? -7.73083  -20.36988 -22.90252 1.000 11.07726 ? 189 LEU   A CB   1 ? 
ATOM   1221 C  CG   . LEU   A 1 166 ? -7.22646  -18.95777 -22.59779 1.000 9.64681  ? 189 LEU   A CG   1 ? 
ATOM   1222 C  CD1  . LEU   A 1 166 ? -5.70993  -18.86207 -22.72752 1.000 12.73982 ? 189 LEU   A CD1  1 ? 
ATOM   1223 C  CD2  . LEU   A 1 166 ? -7.91359  -17.89292 -23.45790 1.000 14.84990 ? 189 LEU   A CD2  1 ? 
ATOM   1224 N  N    . ASN   A 1 167 ? -9.35024  -23.00816 -22.62565 1.000 9.23935  ? 190 ASN   A N    1 ? 
ATOM   1225 C  CA   . ASN   A 1 167 ? -9.65225  -24.32927 -23.18366 1.000 9.57173  ? 190 ASN   A CA   1 ? 
ATOM   1226 C  C    . ASN   A 1 167 ? -11.13706 -24.50509 -23.43646 1.000 9.11256  ? 190 ASN   A C    1 ? 
ATOM   1227 O  O    . ASN   A 1 167 ? -11.53383 -25.14097 -24.42037 1.000 10.41667 ? 190 ASN   A O    1 ? 
ATOM   1228 C  CB   . ASN   A 1 167 ? -9.19672  -25.41899 -22.21864 1.000 10.37051 ? 190 ASN   A CB   1 ? 
ATOM   1229 C  CG   . ASN   A 1 167 ? -7.69221  -25.43588 -22.00725 1.000 8.88308  ? 190 ASN   A CG   1 ? 
ATOM   1230 O  OD1  . ASN   A 1 167 ? -6.92541  -24.93774 -22.82996 1.000 10.54472 ? 190 ASN   A OD1  1 ? 
ATOM   1231 N  ND2  . ASN   A 1 167 ? -7.26965  -26.00814 -20.88234 1.000 10.51617 ? 190 ASN   A ND2  1 ? 
ATOM   1232 N  N    . LEU   A 1 168 ? -11.96921 -23.97250 -22.54036 1.000 9.22819  ? 191 LEU   A N    1 ? 
ATOM   1233 C  CA   . LEU   A 1 168 ? -13.40457 -24.19432 -22.59706 1.000 9.42079  ? 191 LEU   A CA   1 ? 
ATOM   1234 C  C    . LEU   A 1 168 ? -14.12731 -23.25766 -23.56257 1.000 8.99843  ? 191 LEU   A C    1 ? 
ATOM   1235 O  O    . LEU   A 1 168 ? -15.31852 -23.45998 -23.81033 1.000 11.32344 ? 191 LEU   A O    1 ? 
ATOM   1236 C  CB   . LEU   A 1 168 ? -13.98650 -24.04692 -21.18429 1.000 9.12320  ? 191 LEU   A CB   1 ? 
ATOM   1237 C  CG   . LEU   A 1 168 ? -13.56577 -25.11823 -20.17186 1.000 10.09223 ? 191 LEU   A CG   1 ? 
ATOM   1238 C  CD1  . LEU   A 1 168 ? -13.97785 -24.69668 -18.76422 1.000 13.67057 ? 191 LEU   A CD1  1 ? 
ATOM   1239 C  CD2  . LEU   A 1 168 ? -14.18043 -26.46877 -20.52737 1.000 12.64254 ? 191 LEU   A CD2  1 ? 
ATOM   1240 N  N    . ALA   A 1 169 ? -13.46584 -22.25212 -24.12682 1.000 9.12001  ? 192 ALA   A N    1 ? 
ATOM   1241 C  CA   . ALA   A 1 169 ? -14.17097 -21.26195 -24.94306 1.000 7.66563  ? 192 ALA   A CA   1 ? 
ATOM   1242 C  C    . ALA   A 1 169 ? -14.60968 -21.81866 -26.29131 1.000 9.32234  ? 192 ALA   A C    1 ? 
ATOM   1243 O  O    . ALA   A 1 169 ? -13.85224 -22.50781 -26.98371 1.000 11.20107 ? 192 ALA   A O    1 ? 
ATOM   1244 C  CB   . ALA   A 1 169 ? -13.26780 -20.05603 -25.18925 1.000 11.35248 ? 192 ALA   A CB   1 ? 
ATOM   1245 N  N    . GLN   A 1 170 ? -15.85064 -21.49197 -26.67718 1.000 9.29828  ? 193 GLN   A N    1 ? 
ATOM   1246 C  CA   . GLN   A 1 170 ? -16.38384 -21.81634 -27.99190 1.000 11.00595 ? 193 GLN   A CA   1 ? 
ATOM   1247 C  C    . GLN   A 1 170 ? -16.46070 -20.59534 -28.89606 1.000 10.07203 ? 193 GLN   A C    1 ? 
ATOM   1248 O  O    . GLN   A 1 170 ? -16.90060 -20.71895 -30.05037 1.000 12.37659 ? 193 GLN   A O    1 ? 
ATOM   1249 C  CB   . GLN   A 1 170 ? -17.79747 -22.38620 -27.87104 1.000 11.14998 ? 193 GLN   A CB   1 ? 
ATOM   1250 C  CG   . GLN   A 1 170 ? -17.99561 -23.69051 -27.13029 1.000 16.47359 ? 193 GLN   A CG   1 ? 
ATOM   1251 C  CD   . GLN   A 1 170 ? -19.49782 -23.98230 -27.01928 1.000 19.71349 ? 193 GLN   A CD   1 ? 
ATOM   1252 O  OE1  . GLN   A 1 170 ? -20.20796 -23.35992 -26.23444 1.000 24.31291 ? 193 GLN   A OE1  1 ? 
ATOM   1253 N  NE2  . GLN   A 1 170 ? -19.99050 -24.87356 -27.86421 1.000 23.65867 ? 193 GLN   A NE2  1 ? 
ATOM   1254 N  N    . TYR   A 1 171 ? -16.10454 -19.42332 -28.38761 1.000 8.18859  ? 194 TYR   A N    1 ? 
ATOM   1255 C  CA   . TYR   A 1 171 ? -16.15845 -18.14751 -29.08600 1.000 8.95672  ? 194 TYR   A CA   1 ? 
ATOM   1256 C  C    . TYR   A 1 171 ? -14.79157 -17.49875 -28.93965 1.000 10.69762 ? 194 TYR   A C    1 ? 
ATOM   1257 O  O    . TYR   A 1 171 ? -13.99644 -17.92056 -28.09140 1.000 9.59165  ? 194 TYR   A O    1 ? 
ATOM   1258 C  CB   . TYR   A 1 171 ? -17.28494 -17.26341 -28.50037 1.000 11.13626 ? 194 TYR   A CB   1 ? 
ATOM   1259 C  CG   . TYR   A 1 171 ? -18.60971 -17.96471 -28.74323 1.000 11.22315 ? 194 TYR   A CG   1 ? 
ATOM   1260 C  CD1  . TYR   A 1 171 ? -19.29689 -17.79860 -29.94780 1.000 12.52563 ? 194 TYR   A CD1  1 ? 
ATOM   1261 C  CD2  . TYR   A 1 171 ? -19.11544 -18.87216 -27.82535 1.000 10.95883 ? 194 TYR   A CD2  1 ? 
ATOM   1262 C  CE1  . TYR   A 1 171 ? -20.48614 -18.50306 -30.19794 1.000 14.22887 ? 194 TYR   A CE1  1 ? 
ATOM   1263 C  CE2  . TYR   A 1 171 ? -20.29173 -19.57474 -28.07438 1.000 11.83903 ? 194 TYR   A CE2  1 ? 
ATOM   1264 C  CZ   . TYR   A 1 171 ? -20.95650 -19.38547 -29.25698 1.000 15.10265 ? 194 TYR   A CZ   1 ? 
ATOM   1265 O  OH   . TYR   A 1 171 ? -22.11017 -20.10252 -29.49054 1.000 17.13389 ? 194 TYR   A OH   1 ? 
ATOM   1266 N  N    . PRO   A 1 172 ? -14.45895 -16.51052 -29.77327 1.000 9.11466  ? 195 PRO   A N    1 ? 
ATOM   1267 C  CA   . PRO   A 1 172 ? -13.09209 -15.95516 -29.74572 1.000 9.43740  ? 195 PRO   A CA   1 ? 
ATOM   1268 C  C    . PRO   A 1 172 ? -12.72810 -15.45886 -28.35291 1.000 8.82426  ? 195 PRO   A C    1 ? 
ATOM   1269 O  O    . PRO   A 1 172 ? -13.48380 -14.71959 -27.72856 1.000 9.85334  ? 195 PRO   A O    1 ? 
ATOM   1270 C  CB   . PRO   A 1 172 ? -13.16545 -14.79695 -30.75285 1.000 9.17956  ? 195 PRO   A CB   1 ? 
ATOM   1271 C  CG   . PRO   A 1 172 ? -14.28809 -15.19600 -31.70489 1.000 10.75540 ? 195 PRO   A CG   1 ? 
ATOM   1272 C  CD   . PRO   A 1 172 ? -15.30185 -15.85962 -30.79986 1.000 9.62488  ? 195 PRO   A CD   1 ? 
ATOM   1273 N  N    . SER   A 1 173 ? -11.56899 -15.89729 -27.84782 1.000 9.57190  ? 196 SER   A N    1 ? 
ATOM   1274 C  CA   . SER   A 1 173 ? -11.24473 -15.66023 -26.44622 1.000 9.03039  ? 196 SER   A CA   1 ? 
ATOM   1275 C  C    . SER   A 1 173 ? -9.73977  -15.54986 -26.26140 1.000 8.28990  ? 196 SER   A C    1 ? 
ATOM   1276 O  O    . SER   A 1 173 ? -8.97738  -16.35760 -26.80360 1.000 9.46487  ? 196 SER   A O    1 ? 
ATOM   1277 C  CB   . SER   A 1 173 ? -11.77548 -16.82092 -25.59171 1.000 9.48938  ? 196 SER   A CB   1 ? 
ATOM   1278 O  OG   . SER   A 1 173 ? -11.58722 -16.57345 -24.20572 1.000 10.25047 ? 196 SER   A OG   1 ? 
ATOM   1279 N  N    . ILE   A 1 174 ? -9.31932  -14.55755 -25.47275 1.000 7.84753  ? 197 ILE   A N    1 ? 
ATOM   1280 C  CA   . ILE   A 1 174 ? -7.91921  -14.37965 -25.09449 1.000 8.27728  ? 197 ILE   A CA   1 ? 
ATOM   1281 C  C    . ILE   A 1 174 ? -7.85658  -13.94171 -23.63935 1.000 9.02288  ? 197 ILE   A C    1 ? 
ATOM   1282 O  O    . ILE   A 1 174 ? -8.81947  -13.41293 -23.07906 1.000 9.05830  ? 197 ILE   A O    1 ? 
ATOM   1283 C  CB   . ILE   A 1 174 ? -7.18667  -13.33058 -25.96862 1.000 8.46362  ? 197 ILE   A CB   1 ? 
ATOM   1284 C  CG1  . ILE   A 1 174 ? -7.84262  -11.94506 -25.83125 1.000 8.76182  ? 197 ILE   A CG1  1 ? 
ATOM   1285 C  CG2  . ILE   A 1 174 ? -7.14458  -13.77437 -27.42383 1.000 10.93817 ? 197 ILE   A CG2  1 ? 
ATOM   1286 C  CD1  . ILE   A 1 174 ? -7.13901  -10.82939 -26.65818 1.000 11.16326 ? 197 ILE   A CD1  1 ? 
ATOM   1287 N  N    . LEU   A 1 175 ? -6.70085  -14.16772 -23.01969 1.000 8.94450  ? 198 LEU   A N    1 ? 
ATOM   1288 C  CA   . LEU   A 1 175 ? -6.45279  -13.74001 -21.64681 1.000 8.78002  ? 198 LEU   A CA   1 ? 
ATOM   1289 C  C    . LEU   A 1 175 ? -5.20540  -12.86911 -21.63611 1.000 8.39757  ? 198 LEU   A C    1 ? 
ATOM   1290 O  O    . LEU   A 1 175 ? -4.11669  -13.32183 -22.02645 1.000 9.59793  ? 198 LEU   A O    1 ? 
ATOM   1291 C  CB   . LEU   A 1 175 ? -6.31647  -14.95498 -20.71640 1.000 8.46641  ? 198 LEU   A CB   1 ? 
ATOM   1292 C  CG   . LEU   A 1 175 ? -6.15061  -14.62767 -19.23462 1.000 8.01003  ? 198 LEU   A CG   1 ? 
ATOM   1293 C  CD1  . LEU   A 1 175 ? -6.72762  -15.78181 -18.36690 1.000 11.75915 ? 198 LEU   A CD1  1 ? 
ATOM   1294 C  CD2  . LEU   A 1 175 ? -4.68949  -14.30899 -18.87491 1.000 10.41181 ? 198 LEU   A CD2  1 ? 
ATOM   1295 N  N    . VAL   A 1 176 ? -5.36324  -11.61206 -21.24925 1.000 8.72877  ? 199 VAL   A N    1 ? 
ATOM   1296 C  CA   . VAL   A 1 176 ? -4.27816  -10.63645 -21.31842 1.000 9.34889  ? 199 VAL   A CA   1 ? 
ATOM   1297 C  C    . VAL   A 1 176 ? -3.66371  -10.46072 -19.93726 1.000 9.45816  ? 199 VAL   A C    1 ? 
ATOM   1298 O  O    . VAL   A 1 176 ? -4.32649  -9.99148  -19.00547 1.000 9.75033  ? 199 VAL   A O    1 ? 
ATOM   1299 C  CB   . VAL   A 1 176 ? -4.77126  -9.28419  -21.85086 1.000 8.59785  ? 199 VAL   A CB   1 ? 
ATOM   1300 C  CG1  . VAL   A 1 176 ? -3.59718  -8.30385  -21.96319 1.000 12.59573 ? 199 VAL   A CG1  1 ? 
ATOM   1301 C  CG2  . VAL   A 1 176 ? -5.47369  -9.45205  -23.21197 1.000 11.53902 ? 199 VAL   A CG2  1 ? 
ATOM   1302 N  N    . GLU   A 1 177 ? -2.39748  -10.83680 -19.80173 1.000 9.72550  ? 200 GLU   A N    1 ? 
ATOM   1303 C  CA   . GLU   A 1 177 ? -1.59431  -10.48321 -18.63681 1.000 9.88964  ? 200 GLU   A CA   1 ? 
ATOM   1304 C  C    . GLU   A 1 177 ? -0.97255  -9.12303  -18.92248 1.000 10.13056 ? 200 GLU   A C    1 ? 
ATOM   1305 O  O    . GLU   A 1 177 ? -0.09029  -9.00460  -19.77510 1.000 11.66416 ? 200 GLU   A O    1 ? 
ATOM   1306 C  CB   . GLU   A 1 177 ? -0.53185  -11.54900 -18.39437 1.000 10.61609 ? 200 GLU   A CB   1 ? 
ATOM   1307 C  CG   . GLU   A 1 177 ? -1.10060  -12.88772 -17.90519 1.000 10.40126 ? 200 GLU   A CG   1 ? 
ATOM   1308 C  CD   . GLU   A 1 177 ? -1.42389  -12.88293 -16.41614 1.000 15.48192 ? 200 GLU   A CD   1 ? 
ATOM   1309 O  OE1  . GLU   A 1 177 ? -1.22332  -11.84418 -15.74653 1.000 14.07018 ? 200 GLU   A OE1  1 ? 
ATOM   1310 O  OE2  . GLU   A 1 177 ? -1.86553  -13.93625 -15.90530 1.000 16.12444 ? 200 GLU   A OE2  1 ? 
ATOM   1311 N  N    . LEU   A 1 178 ? -1.47507  -8.08600  -18.26301 1.000 10.71526 ? 201 LEU   A N    1 ? 
ATOM   1312 C  CA   . LEU   A 1 178 ? -1.16212  -6.71871  -18.67133 1.000 10.50648 ? 201 LEU   A CA   1 ? 
ATOM   1313 C  C    . LEU   A 1 178 ? 0.22680   -6.26705  -18.23096 1.000 11.04363 ? 201 LEU   A C    1 ? 
ATOM   1314 O  O    . LEU   A 1 178 ? 0.77408   -5.33357  -18.83039 1.000 12.63222 ? 201 LEU   A O    1 ? 
ATOM   1315 C  CB   . LEU   A 1 178 ? -2.24607  -5.76191  -18.15569 1.000 11.31815 ? 201 LEU   A CB   1 ? 
ATOM   1316 C  CG   . LEU   A 1 178 ? -3.59046  -5.90361  -18.90347 1.000 12.62168 ? 201 LEU   A CG   1 ? 
ATOM   1317 C  CD1  . LEU   A 1 178 ? -4.74540  -5.36214  -18.07472 1.000 14.00754 ? 201 LEU   A CD1  1 ? 
ATOM   1318 C  CD2  . LEU   A 1 178 ? -3.51440  -5.20172  -20.27052 1.000 13.50344 ? 201 LEU   A CD2  1 ? 
ATOM   1319 N  N    . GLY   A 1 179 ? 0.79089   -6.90362  -17.21518 1.000 11.12536 ? 202 GLY   A N    1 ? 
ATOM   1320 C  CA   . GLY   A 1 179 ? 2.12085   -6.55918  -16.74412 1.000 12.15809 ? 202 GLY   A CA   1 ? 
ATOM   1321 C  C    . GLY   A 1 179 ? 2.44236   -7.37749  -15.51707 1.000 12.03929 ? 202 GLY   A C    1 ? 
ATOM   1322 O  O    . GLY   A 1 179 ? 1.66982   -8.25410  -15.10179 1.000 11.78493 ? 202 GLY   A O    1 ? 
ATOM   1323 N  N    . ASN   A 1 180 ? 3.60790   -7.07845  -14.93603 1.000 12.41940 ? 203 ASN   A N    1 ? 
ATOM   1324 C  CA   . ASN   A 1 180 ? 4.11157   -7.75968  -13.75009 1.000 11.16054 ? 203 ASN   A CA   1 ? 
ATOM   1325 C  C    . ASN   A 1 180 ? 3.90120   -6.83623  -12.55477 1.000 11.87278 ? 203 ASN   A C    1 ? 
ATOM   1326 O  O    . ASN   A 1 180 ? 4.50983   -5.76430  -12.48156 1.000 13.48127 ? 203 ASN   A O    1 ? 
ATOM   1327 C  CB   . ASN   A 1 180 ? 5.59157   -8.07012  -13.95094 1.000 13.71940 ? 203 ASN   A CB   1 ? 
ATOM   1328 C  CG   . ASN   A 1 180 ? 6.23161   -8.65334  -12.71963 1.000 17.22912 ? 203 ASN   A CG   1 ? 
ATOM   1329 O  OD1  . ASN   A 1 180 ? 5.55225   -9.00861  -11.76107 1.000 13.67831 ? 203 ASN   A OD1  1 ? 
ATOM   1330 N  ND2  . ASN   A 1 180 ? 7.55565   -8.74797  -12.73662 1.000 16.80773 ? 203 ASN   A ND2  1 ? 
ATOM   1331 N  N    . MET   A 1 181 ? 3.03035   -7.24298  -11.62450 1.000 12.00302 ? 204 MET   A N    1 ? 
ATOM   1332 C  CA   . MET   A 1 181 ? 2.70698   -6.38146  -10.49174 1.000 12.61971 ? 204 MET   A CA   1 ? 
ATOM   1333 C  C    . MET   A 1 181 ? 3.90328   -6.15188  -9.59277  1.000 13.29270 ? 204 MET   A C    1 ? 
ATOM   1334 O  O    . MET   A 1 181 ? 3.89962   -5.18160  -8.83351  1.000 14.32613 ? 204 MET   A O    1 ? 
ATOM   1335 C  CB   . MET   A 1 181 ? 1.58931   -7.01220  -9.65370  1.000 13.61121 ? 204 MET   A CB   1 ? 
ATOM   1336 C  CG   . MET   A 1 181 ? 0.29903   -7.26660  -10.43435 1.000 10.98288 ? 204 MET   A CG   1 ? 
ATOM   1337 S  SD   . MET   A 1 181 ? -1.18219  -7.31348  -9.38811  1.000 13.66448 ? 204 MET   A SD   1 ? 
ATOM   1338 C  CE   . MET   A 1 181 ? -1.70456  -5.61853  -9.40890  1.000 14.50170 ? 204 MET   A CE   1 ? 
ATOM   1339 N  N    . LYS   A 1 182 ? 4.91642   -7.01300  -9.66778  1.000 14.08606 ? 205 LYS   A N    1 ? 
ATOM   1340 C  CA   . LYS   A 1 182 ? 6.12976   -6.89743  -8.85811  1.000 15.18045 ? 205 LYS   A CA   1 ? 
ATOM   1341 C  C    . LYS   A 1 182 ? 7.17565   -5.99004  -9.48779  1.000 19.15642 ? 205 LYS   A C    1 ? 
ATOM   1342 O  O    . LYS   A 1 182 ? 8.22305   -5.74952  -8.87383  1.000 19.00453 ? 205 LYS   A O    1 ? 
ATOM   1343 C  CB   . LYS   A 1 182 ? 6.73788   -8.28662  -8.64173  1.000 16.11402 ? 205 LYS   A CB   1 ? 
ATOM   1344 C  CG   . LYS   A 1 182 ? 5.76270   -9.30298  -8.06413  1.000 18.20750 ? 205 LYS   A CG   1 ? 
ATOM   1345 C  CD   . LYS   A 1 182 ? 5.19548   -8.83331  -6.73830  1.000 17.35307 ? 205 LYS   A CD   1 ? 
ATOM   1346 C  CE   . LYS   A 1 182 ? 4.31721   -9.91903  -6.11917  1.000 17.69553 ? 205 LYS   A CE   1 ? 
ATOM   1347 N  NZ   . LYS   A 1 182 ? 3.60079   -9.47457  -4.90042  1.000 20.43844 ? 205 LYS   A NZ   1 ? 
ATOM   1348 N  N    . ASN   A 1 183 ? 6.92367   -5.47620  -10.68399 1.000 13.91090 ? 206 ASN   A N    1 ? 
ATOM   1349 C  CA   . ASN   A 1 183 ? 7.87433   -4.60206  -11.37039 1.000 16.62052 ? 206 ASN   A CA   1 ? 
ATOM   1350 C  C    . ASN   A 1 183 ? 7.56828   -3.14149  -11.05012 1.000 18.34558 ? 206 ASN   A C    1 ? 
ATOM   1351 O  O    . ASN   A 1 183 ? 6.40291   -2.74468  -11.03730 1.000 16.39078 ? 206 ASN   A O    1 ? 
ATOM   1352 C  CB   . ASN   A 1 183 ? 7.77209   -4.82064  -12.87730 1.000 14.33462 ? 206 ASN   A CB   1 ? 
ATOM   1353 C  CG   . ASN   A 1 183 ? 8.57881   -3.82316  -13.66950 1.000 15.63076 ? 206 ASN   A CG   1 ? 
ATOM   1354 O  OD1  . ASN   A 1 183 ? 8.03905   -2.84095  -14.19001 1.000 15.47748 ? 206 ASN   A OD1  1 ? 
ATOM   1355 N  ND2  . ASN   A 1 183 ? 9.89647   -4.06155  -13.75897 1.000 16.11322 ? 206 ASN   A ND2  1 ? 
ATOM   1356 N  N    . PRO   A 1 184 ? 8.57437   -2.30193  -10.76997 1.000 16.85804 ? 207 PRO   A N    1 ? 
ATOM   1357 C  CA   . PRO   A 1 184 ? 8.26009   -0.90692  -10.41568 1.000 17.54988 ? 207 PRO   A CA   1 ? 
ATOM   1358 C  C    . PRO   A 1 184 ? 7.50297   -0.15369  -11.48940 1.000 15.45603 ? 207 PRO   A C    1 ? 
ATOM   1359 O  O    . PRO   A 1 184 ? 6.55294   0.56735   -11.16420 1.000 17.99332 ? 207 PRO   A O    1 ? 
ATOM   1360 C  CB   . PRO   A 1 184 ? 9.64149   -0.29340  -10.13879 1.000 18.32364 ? 207 PRO   A CB   1 ? 
ATOM   1361 C  CG   . PRO   A 1 184 ? 10.45151  -1.45569  -9.67501  1.000 20.90761 ? 207 PRO   A CG   1 ? 
ATOM   1362 C  CD   . PRO   A 1 184 ? 9.98068   -2.63850  -10.48309 1.000 18.03925 ? 207 PRO   A CD   1 ? 
ATOM   1363 N  N    . ALA   A 1 185 ? 7.89593   -0.29415  -12.75518 1.000 15.59507 ? 208 ALA   A N    1 ? 
ATOM   1364 C  CA   . ALA   A 1 185 ? 7.25298   0.46204   -13.82467 1.000 16.83827 ? 208 ALA   A CA   1 ? 
ATOM   1365 C  C    . ALA   A 1 185 ? 5.82967   -0.02749  -14.07171 1.000 15.88507 ? 208 ALA   A C    1 ? 
ATOM   1366 O  O    . ALA   A 1 185 ? 4.90270   0.77908   -14.20461 1.000 16.88126 ? 208 ALA   A O    1 ? 
ATOM   1367 C  CB   . ALA   A 1 185 ? 8.08628   0.38520   -15.10797 1.000 18.29642 ? 208 ALA   A CB   1 ? 
ATOM   1368 N  N    . ASP   A 1 186 ? 5.64328   -1.34903  -14.16638 1.000 15.07924 ? 209 ASP   A N    1 ? 
ATOM   1369 C  CA   . ASP   A 1 186 ? 4.29618   -1.87022  -14.39595 1.000 13.55385 ? 209 ASP   A CA   1 ? 
ATOM   1370 C  C    . ASP   A 1 186 ? 3.37194   -1.51900  -13.23718 1.000 13.13246 ? 209 ASP   A C    1 ? 
ATOM   1371 O  O    . ASP   A 1 186 ? 2.23493   -1.08240  -13.45085 1.000 14.12749 ? 209 ASP   A O    1 ? 
ATOM   1372 C  CB   . ASP   A 1 186 ? 4.34411   -3.38464  -14.60766 1.000 13.73838 ? 209 ASP   A CB   1 ? 
ATOM   1373 C  CG   . ASP   A 1 186 ? 4.81708   -3.78924  -15.99878 1.000 13.81513 ? 209 ASP   A CG   1 ? 
ATOM   1374 O  OD1  . ASP   A 1 186 ? 4.99236   -2.92885  -16.88971 1.000 16.48981 ? 209 ASP   A OD1  1 ? 
ATOM   1375 O  OD2  . ASP   A 1 186 ? 4.99408   -5.00002  -16.20783 1.000 14.20863 ? 209 ASP   A OD2  1 ? 
ATOM   1376 N  N    . SER   A 1 187 ? 3.84342   -1.67422  -11.99658 1.000 14.77440 ? 210 SER   A N    1 ? 
ATOM   1377 C  CA   . SER   A 1 187 ? 2.98414   -1.38659  -10.85097 1.000 14.65396 ? 210 SER   A CA   1 ? 
ATOM   1378 C  C    . SER   A 1 187 ? 2.60629   0.09021   -10.78332 1.000 14.45073 ? 210 SER   A C    1 ? 
ATOM   1379 O  O    . SER   A 1 187 ? 1.48892   0.42209   -10.37769 1.000 15.60195 ? 210 SER   A O    1 ? 
ATOM   1380 C  CB   . SER   A 1 187 ? 3.62885   -1.86102  -9.54264  1.000 18.63732 ? 210 SER   A CB   1 ? 
ATOM   1381 O  OG   . SER   A 1 187 ? 4.83683   -1.17058  -9.27908  1.000 18.88959 ? 210 SER   A OG   1 ? 
ATOM   1382 N  N    . ALA   A 1 188 ? 3.51293   0.99067   -11.17851 1.000 15.37291 ? 211 ALA   A N    1 ? 
ATOM   1383 C  CA   . ALA   A 1 188 ? 3.16250   2.40895   -11.21774 1.000 17.92368 ? 211 ALA   A CA   1 ? 
ATOM   1384 C  C    . ALA   A 1 188 ? 2.01467   2.67071   -12.18249 1.000 16.55481 ? 211 ALA   A C    1 ? 
ATOM   1385 O  O    . ALA   A 1 188 ? 1.13025   3.49192   -11.90347 1.000 17.73086 ? 211 ALA   A O    1 ? 
ATOM   1386 C  CB   . ALA   A 1 188 ? 4.38276   3.25149   -11.58983 1.000 20.11514 ? 211 ALA   A CB   1 ? 
ATOM   1387 N  N    . LEU   A 1 189 ? 2.01379   1.99222   -13.33089 1.000 16.31529 ? 212 LEU   A N    1 ? 
ATOM   1388 C  CA   . LEU   A 1 189 ? 0.87141   2.09042   -14.23609 1.000 15.16241 ? 212 LEU   A CA   1 ? 
ATOM   1389 C  C    . LEU   A 1 189 ? -0.38412  1.53248   -13.59568 1.000 14.63408 ? 212 LEU   A C    1 ? 
ATOM   1390 O  O    . LEU   A 1 189 ? -1.45508  2.16061   -13.61478 1.000 14.93260 ? 212 LEU   A O    1 ? 
ATOM   1391 C  CB   . LEU   A 1 189 ? 1.16192   1.33681   -15.53370 1.000 15.71977 ? 212 LEU   A CB   1 ? 
ATOM   1392 C  CG   . LEU   A 1 189 ? 2.29697   1.82941   -16.43214 1.000 16.96220 ? 212 LEU   A CG   1 ? 
ATOM   1393 C  CD1  . LEU   A 1 189 ? 2.49321   0.85065   -17.58349 1.000 16.94324 ? 212 LEU   A CD1  1 ? 
ATOM   1394 C  CD2  . LEU   A 1 189 ? 1.98929   3.21426   -16.94472 1.000 19.39180 ? 212 LEU   A CD2  1 ? 
ATOM   1395 N  N    . MET   A 1 190 ? -0.27288  0.33088   -13.03860 1.000 14.01402 ? 213 MET   A N    1 ? 
ATOM   1396 C  CA   . MET   A 1 190 ? -1.45963  -0.33644  -12.51849 1.000 13.39450 ? 213 MET   A CA   1 ? 
ATOM   1397 C  C    . MET   A 1 190 ? -2.12452  0.44390   -11.38075 1.000 14.57195 ? 213 MET   A C    1 ? 
ATOM   1398 O  O    . MET   A 1 190 ? -3.35641  0.44312   -11.24307 1.000 13.82958 ? 213 MET   A O    1 ? 
ATOM   1399 C  CB   . MET   A 1 190 ? -1.15783  -1.75553  -12.06371 1.000 13.18513 ? 213 MET   A CB   1 ? 
ATOM   1400 C  CG   . MET   A 1 190 ? -0.71162  -2.69792  -13.16503 1.000 13.46583 ? 213 MET   A CG   1 ? 
ATOM   1401 S  SD   . MET   A 1 190 ? 0.24080   -4.06629  -12.52009 1.000 14.27113 ? 213 MET   A SD   1 ? 
ATOM   1402 C  CE   . MET   A 1 190 ? 0.54600   -4.96451  -14.04248 1.000 14.98357 ? 213 MET   A CE   1 ? 
ATOM   1403 N  N    . GLU   A 1 191 ? -1.31984  1.10028   -10.54401 1.000 15.07601 ? 214 GLU   A N    1 ? 
ATOM   1404 C  CA   . GLU   A 1 191 ? -1.78317  1.81335   -9.36251  1.000 15.27177 ? 214 GLU   A CA   1 ? 
ATOM   1405 C  C    . GLU   A 1 191 ? -2.30164  3.20263   -9.68027  1.000 18.19996 ? 214 GLU   A C    1 ? 
ATOM   1406 O  O    . GLU   A 1 191 ? -2.74300  3.89859   -8.76431  1.000 21.15549 ? 214 GLU   A O    1 ? 
ATOM   1407 C  CB   . GLU   A 1 191 ? -0.65724  1.91272   -8.32327  1.000 17.23275 ? 214 GLU   A CB   1 ? 
ATOM   1408 C  CG   . GLU   A 1 191 ? -0.30515  0.58854   -7.65069  1.000 17.06067 ? 214 GLU   A CG   1 ? 
ATOM   1409 C  CD   . GLU   A 1 191 ? 0.98958   0.66680   -6.84689  1.000 18.83914 ? 214 GLU   A CD   1 ? 
ATOM   1410 O  OE1  . GLU   A 1 191 ? 1.54212   1.78749   -6.68874  1.000 23.94576 ? 214 GLU   A OE1  1 ? 
ATOM   1411 O  OE2  . GLU   A 1 191 ? 1.46015   -0.38435  -6.37960  1.000 21.24048 ? 214 GLU   A OE2  1 ? 
ATOM   1412 N  N    . SER   A 1 192 ? -2.25761  3.63739   -10.93222 1.000 16.89875 ? 215 SER   A N    1 ? 
ATOM   1413 C  CA   . SER   A 1 192 ? -2.72485  4.96913   -11.29065 1.000 16.61394 ? 215 SER   A CA   1 ? 
ATOM   1414 C  C    . SER   A 1 192 ? -3.96007  4.87294   -12.16984 1.000 16.43287 ? 215 SER   A C    1 ? 
ATOM   1415 O  O    . SER   A 1 192 ? -4.05555  3.99336   -13.03670 1.000 16.29326 ? 215 SER   A O    1 ? 
ATOM   1416 C  CB   . SER   A 1 192 ? -1.63160  5.74760   -12.01519 1.000 20.47303 ? 215 SER   A CB   1 ? 
ATOM   1417 O  OG   . SER   A 1 192 ? -1.27743  5.10840   -13.22342 1.000 23.22279 ? 215 SER   A OG   1 ? 
ATOM   1418 N  N    . ALA   A 1 193 ? -4.91717  5.77007   -11.92688 1.000 16.57578 ? 216 ALA   A N    1 ? 
ATOM   1419 C  CA   . ALA   A 1 193 ? -6.10686  5.80733   -12.76650 1.000 15.14366 ? 216 ALA   A CA   1 ? 
ATOM   1420 C  C    . ALA   A 1 193 ? -5.73559  6.06357   -14.21926 1.000 17.20015 ? 216 ALA   A C    1 ? 
ATOM   1421 O  O    . ALA   A 1 193 ? -6.32764  5.47641   -15.13174 1.000 16.11784 ? 216 ALA   A O    1 ? 
ATOM   1422 C  CB   . ALA   A 1 193 ? -7.09740  6.84996   -12.24113 1.000 18.58060 ? 216 ALA   A CB   1 ? 
ATOM   1423 N  N    . GLU   A 1 194 ? -4.72474  6.90656   -14.45463 1.000 16.74546 ? 217 GLU   A N    1 ? 
ATOM   1424 C  CA   . GLU   A 1 194 ? -4.29857  7.18712   -15.81962 1.000 16.45739 ? 217 GLU   A CA   1 ? 
ATOM   1425 C  C    . GLU   A 1 194 ? -3.68152  5.95470   -16.47282 1.000 15.55428 ? 217 GLU   A C    1 ? 
ATOM   1426 O  O    . GLU   A 1 194 ? -3.91473  5.69501   -17.65832 1.000 17.90016 ? 217 GLU   A O    1 ? 
ATOM   1427 C  CB   . GLU   A 1 194 ? -3.33553  8.38006   -15.84993 1.000 20.05822 ? 217 GLU   A CB   1 ? 
ATOM   1428 C  CG   . GLU   A 1 194 ? -3.63230  9.47926   -14.80998 1.000 33.59687 ? 217 GLU   A CG   1 ? 
ATOM   1429 C  CD   . GLU   A 1 194 ? -3.25664  9.09425   -13.37323 1.000 32.13220 ? 217 GLU   A CD   1 ? 
ATOM   1430 O  OE1  . GLU   A 1 194 ? -2.08301  8.73886   -13.14604 1.000 46.16390 ? 217 GLU   A OE1  1 ? 
ATOM   1431 O  OE2  . GLU   A 1 194 ? -4.11794  9.15180   -12.47112 1.000 34.20924 ? 217 GLU   A OE2  1 ? 
ATOM   1432 N  N    . GLY   A 1 195 ? -2.88821  5.18613   -15.72083 1.000 16.67488 ? 218 GLY   A N    1 ? 
ATOM   1433 C  CA   . GLY   A 1 195 ? -2.33811  3.95501   -16.27097 1.000 15.95886 ? 218 GLY   A CA   1 ? 
ATOM   1434 C  C    . GLY   A 1 195 ? -3.41177  2.92824   -16.58715 1.000 14.02827 ? 218 GLY   A C    1 ? 
ATOM   1435 O  O    . GLY   A 1 195 ? -3.36917  2.26778   -17.62964 1.000 13.67191 ? 218 GLY   A O    1 ? 
ATOM   1436 N  N    . ARG   A 1 196 ? -4.38765  2.77239   -15.69176 1.000 13.90536 ? 219 ARG   A N    1 ? 
ATOM   1437 C  CA   . ARG   A 1 196 ? -5.47370  1.83782   -15.97523 1.000 13.74807 ? 219 ARG   A CA   1 ? 
ATOM   1438 C  C    . ARG   A 1 196 ? -6.25841  2.27676   -17.20442 1.000 14.54025 ? 219 ARG   A C    1 ? 
ATOM   1439 O  O    . ARG   A 1 196 ? -6.67299  1.44277   -18.01572 1.000 13.14195 ? 219 ARG   A O    1 ? 
ATOM   1440 C  CB   . ARG   A 1 196 ? -6.38308  1.70229   -14.75541 1.000 12.65336 ? 219 ARG   A CB   1 ? 
ATOM   1441 C  CG   . ARG   A 1 196 ? -5.67667  1.02670   -13.57563 1.000 13.17070 ? 219 ARG   A CG   1 ? 
ATOM   1442 C  CD   . ARG   A 1 196 ? -6.63631  0.75831   -12.42458 1.000 13.00322 ? 219 ARG   A CD   1 ? 
ATOM   1443 N  NE   . ARG   A 1 196 ? -7.15814  1.97346   -11.80762 1.000 14.55141 ? 219 ARG   A NE   1 ? 
ATOM   1444 C  CZ   . ARG   A 1 196 ? -6.59800  2.61367   -10.78990 1.000 14.30680 ? 219 ARG   A CZ   1 ? 
ATOM   1445 N  NH1  . ARG   A 1 196 ? -5.43653  2.23319   -10.28044 1.000 16.25113 ? 219 ARG   A NH1  1 ? 
ATOM   1446 N  NH2  . ARG   A 1 196 ? -7.22132  3.66836   -10.26772 1.000 18.20076 ? 219 ARG   A NH2  1 ? 
ATOM   1447 N  N    . GLN   A 1 197 ? -6.45262  3.58606   -17.37738 1.000 14.07950 ? 220 GLN   A N    1 ? 
ATOM   1448 C  CA   . GLN   A 1 197 ? -7.12393  4.06195   -18.57790 1.000 14.44173 ? 220 GLN   A CA   1 ? 
ATOM   1449 C  C    . GLN   A 1 197 ? -6.31015  3.74772   -19.82819 1.000 13.98961 ? 220 GLN   A C    1 ? 
ATOM   1450 O  O    . GLN   A 1 197 ? -6.87748  3.37636   -20.86275 1.000 13.88774 ? 220 GLN   A O    1 ? 
ATOM   1451 C  CB   . GLN   A 1 197 ? -7.39835  5.56237   -18.47393 1.000 15.69795 ? 220 GLN   A CB   1 ? 
ATOM   1452 C  CG   . GLN   A 1 197 ? -8.20081  6.09529   -19.64293 1.000 15.80934 ? 220 GLN   A CG   1 ? 
ATOM   1453 C  CD   . GLN   A 1 197 ? -9.60530  5.51677   -19.68342 1.000 15.17514 ? 220 GLN   A CD   1 ? 
ATOM   1454 O  OE1  . GLN   A 1 197 ? -10.36078 5.62308   -18.71715 1.000 18.39662 ? 220 GLN   A OE1  1 ? 
ATOM   1455 N  NE2  . GLN   A 1 197 ? -9.96664  4.90579   -20.80590 1.000 15.01099 ? 220 GLN   A NE2  1 ? 
ATOM   1456 N  N    . LYS   A 1 198 ? -4.98322  3.90007   -19.75782 1.000 14.39369 ? 221 LYS   A N    1 ? 
ATOM   1457 C  CA   . LYS   A 1 198 ? -4.14761  3.57854   -20.90990 1.000 14.62388 ? 221 LYS   A CA   1 ? 
ATOM   1458 C  C    . LYS   A 1 198 ? -4.22901  2.09702   -21.25899 1.000 12.69420 ? 221 LYS   A C    1 ? 
ATOM   1459 O  O    . LYS   A 1 198 ? -4.28277  1.73649   -22.43623 1.000 14.93887 ? 221 LYS   A O    1 ? 
ATOM   1460 C  CB   . LYS   A 1 198 ? -2.70608  4.02461   -20.67219 1.000 19.69425 ? 221 LYS   A CB   1 ? 
ATOM   1461 C  CG   . LYS   A 1 198 ? -1.71843  3.49929   -21.70814 1.000 32.84832 ? 221 LYS   A CG   1 ? 
ATOM   1462 C  CD   . LYS   A 1 198 ? -0.45485  4.34515   -21.76894 1.000 39.10205 ? 221 LYS   A CD   1 ? 
ATOM   1463 C  CE   . LYS   A 1 198 ? 0.30077   4.27284   -20.45957 1.000 37.84728 ? 221 LYS   A CE   1 ? 
ATOM   1464 N  NZ   . LYS   A 1 198 ? 0.95907   2.95855   -20.29089 1.000 34.25935 ? 221 LYS   A NZ   1 ? 
ATOM   1465 N  N    . TYR   A 1 199 ? -4.25278  1.21966   -20.25259 1.000 13.47760 ? 222 TYR   A N    1 ? 
ATOM   1466 C  CA   . TYR   A 1 199 ? -4.47733  -0.19671  -20.54260 1.000 13.68146 ? 222 TYR   A CA   1 ? 
ATOM   1467 C  C    . TYR   A 1 199 ? -5.82359  -0.40988  -21.22216 1.000 12.17004 ? 222 TYR   A C    1 ? 
ATOM   1468 O  O    . TYR   A 1 199 ? -5.92057  -1.14709  -22.20868 1.000 12.16657 ? 222 TYR   A O    1 ? 
ATOM   1469 C  CB   . TYR   A 1 199 ? -4.42294  -1.02956  -19.25876 1.000 12.22197 ? 222 TYR   A CB   1 ? 
ATOM   1470 C  CG   . TYR   A 1 199 ? -3.05498  -1.27287  -18.62872 1.000 13.00590 ? 222 TYR   A CG   1 ? 
ATOM   1471 C  CD1  . TYR   A 1 199 ? -1.99097  -1.79085  -19.35831 1.000 12.60156 ? 222 TYR   A CD1  1 ? 
ATOM   1472 C  CD2  . TYR   A 1 199 ? -2.86070  -1.01479  -17.28138 1.000 12.55315 ? 222 TYR   A CD2  1 ? 
ATOM   1473 C  CE1  . TYR   A 1 199 ? -0.75552  -2.03889  -18.74271 1.000 11.81042 ? 222 TYR   A CE1  1 ? 
ATOM   1474 C  CE2  . TYR   A 1 199 ? -1.65549  -1.25122  -16.66676 1.000 12.81537 ? 222 TYR   A CE2  1 ? 
ATOM   1475 C  CZ   . TYR   A 1 199 ? -0.61654  -1.76422  -17.39201 1.000 13.07805 ? 222 TYR   A CZ   1 ? 
ATOM   1476 O  OH   . TYR   A 1 199 ? 0.57689   -1.98090  -16.74176 1.000 14.59571 ? 222 TYR   A OH   1 ? 
ATOM   1477 N  N    . ALA   A 1 200 ? -6.87791  0.24415   -20.71145 1.000 10.53344 ? 223 ALA   A N    1 ? 
ATOM   1478 C  CA   . ALA   A 1 200 ? -8.20490  0.08758   -21.30024 1.000 12.15975 ? 223 ALA   A CA   1 ? 
ATOM   1479 C  C    . ALA   A 1 200 ? -8.25802  0.62675   -22.71966 1.000 12.44327 ? 223 ALA   A C    1 ? 
ATOM   1480 O  O    . ALA   A 1 200 ? -8.96927  0.06837   -23.56056 1.000 14.04169 ? 223 ALA   A O    1 ? 
ATOM   1481 C  CB   . ALA   A 1 200 ? -9.25418  0.77920   -20.43449 1.000 11.76824 ? 223 ALA   A CB   1 ? 
ATOM   1482 N  N    . ASN   A 1 201 ? -7.50481  1.69144   -23.01485 1.000 12.09967 ? 224 ASN   A N    1 ? 
ATOM   1483 C  CA   . ASN   A 1 201 ? -7.48059  2.19987   -24.38229 1.000 13.03626 ? 224 ASN   A CA   1 ? 
ATOM   1484 C  C    . ASN   A 1 201 ? -6.86846  1.18070   -25.33216 1.000 14.01453 ? 224 ASN   A C    1 ? 
ATOM   1485 O  O    . ASN   A 1 201 ? -7.40119  0.93207   -26.41861 1.000 15.64119 ? 224 ASN   A O    1 ? 
ATOM   1486 C  CB   . ASN   A 1 201 ? -6.71323  3.52382   -24.45029 1.000 14.18674 ? 224 ASN   A CB   1 ? 
ATOM   1487 C  CG   . ASN   A 1 201 ? -7.39316  4.64850   -23.69037 1.000 16.40370 ? 224 ASN   A CG   1 ? 
ATOM   1488 O  OD1  . ASN   A 1 201 ? -8.56997  4.57018   -23.34409 1.000 17.48005 ? 224 ASN   A OD1  1 ? 
ATOM   1489 N  ND2  . ASN   A 1 201 ? -6.63979  5.71296   -23.43615 1.000 18.73815 ? 224 ASN   A ND2  1 ? 
ATOM   1490 N  N    . ALA   A 1 202 ? -5.74768  0.56794   -24.93726 1.000 13.26129 ? 225 ALA   A N    1 ? 
ATOM   1491 C  CA   . ALA   A 1 202 ? -5.16651  -0.47734  -25.76935 1.000 12.91891 ? 225 ALA   A CA   1 ? 
ATOM   1492 C  C    . ALA   A 1 202 ? -6.14357  -1.63100  -25.93911 1.000 13.47724 ? 225 ALA   A C    1 ? 
ATOM   1493 O  O    . ALA   A 1 202 ? -6.33542  -2.14939  -27.04553 1.000 15.93373 ? 225 ALA   A O    1 ? 
ATOM   1494 C  CB   . ALA   A 1 202 ? -3.86088  -0.97521  -25.14726 1.000 15.53269 ? 225 ALA   A CB   1 ? 
ATOM   1495 N  N    . LEU   A 1 203 ? -6.78669  -2.03608  -24.84657 1.000 12.57628 ? 226 LEU   A N    1 ? 
ATOM   1496 C  CA   . LEU   A 1 203 ? -7.67746  -3.18543  -24.90223 1.000 14.04175 ? 226 LEU   A CA   1 ? 
ATOM   1497 C  C    . LEU   A 1 203 ? -8.84835  -2.93345  -25.84393 1.000 13.15466 ? 226 LEU   A C    1 ? 
ATOM   1498 O  O    . LEU   A 1 203 ? -9.20736  -3.80490  -26.64094 1.000 13.49730 ? 226 LEU   A O    1 ? 
ATOM   1499 C  CB   . LEU   A 1 203 ? -8.14893  -3.54439  -23.48990 1.000 11.75824 ? 226 LEU   A CB   1 ? 
ATOM   1500 C  CG   . LEU   A 1 203 ? -7.06073  -4.17651  -22.60721 1.000 10.66555 ? 226 LEU   A CG   1 ? 
ATOM   1501 C  CD1  . LEU   A 1 203 ? -7.45778  -4.07861  -21.15890 1.000 13.15019 ? 226 LEU   A CD1  1 ? 
ATOM   1502 C  CD2  . LEU   A 1 203 ? -6.84732  -5.64095  -22.98653 1.000 12.57699 ? 226 LEU   A CD2  1 ? 
ATOM   1503 N  N    . VAL   A 1 204 ? -9.46265  -1.74747  -25.77222 1.000 12.11594 ? 227 VAL   A N    1 ? 
ATOM   1504 C  CA   . VAL   A 1 204 ? -10.61471 -1.48820  -26.63602 1.000 13.36071 ? 227 VAL   A CA   1 ? 
ATOM   1505 C  C    . VAL   A 1 204 ? -10.20581 -1.46520  -28.10644 1.000 12.52276 ? 227 VAL   A C    1 ? 
ATOM   1506 O  O    . VAL   A 1 204 ? -10.96467 -1.90601  -28.97792 1.000 12.75179 ? 227 VAL   A O    1 ? 
ATOM   1507 C  CB   . VAL   A 1 204 ? -11.37919 -0.21672  -26.22037 1.000 11.35331 ? 227 VAL   A CB   1 ? 
ATOM   1508 C  CG1  . VAL   A 1 204 ? -10.63196 1.03764   -26.66957 1.000 14.56796 ? 227 VAL   A CG1  1 ? 
ATOM   1509 C  CG2  . VAL   A 1 204 ? -12.78556 -0.22869  -26.84307 1.000 12.59010 ? 227 VAL   A CG2  1 ? 
ATOM   1510 N  N    . ARG   A 1 205 ? -9.01621  -0.94068  -28.40708 1.000 14.78372 ? 228 ARG   A N    1 ? 
ATOM   1511 C  CA   . ARG   A 1 205 ? -8.54536  -0.91987  -29.78853 1.000 13.23382 ? 228 ARG   A CA   1 ? 
ATOM   1512 C  C    . ARG   A 1 205 ? -8.28329  -2.32860  -30.30000 1.000 14.41287 ? 228 ARG   A C    1 ? 
ATOM   1513 O  O    . ARG   A 1 205 ? -8.55938  -2.62905  -31.46670 1.000 14.95118 ? 228 ARG   A O    1 ? 
ATOM   1514 C  CB   . ARG   A 1 205 ? -7.30158  -0.03638  -29.90348 1.000 14.81886 ? 228 ARG   A CB   1 ? 
ATOM   1515 C  CG   . ARG   A 1 205 ? -7.62893  1.44679   -29.68031 1.000 14.98959 ? 228 ARG   A CG   1 ? 
ATOM   1516 C  CD   . ARG   A 1 205 ? -6.41451  2.27484   -29.23644 1.000 21.52471 ? 228 ARG   A CD   1 ? 
ATOM   1517 N  NE   . ARG   A 1 205 ? -6.86019  3.49343   -28.56564 1.000 22.70118 ? 228 ARG   A NE   1 ? 
ATOM   1518 C  CZ   . ARG   A 1 205 ? -6.05599  4.42863   -28.07764 1.000 23.64373 ? 228 ARG   A CZ   1 ? 
ATOM   1519 N  NH1  . ARG   A 1 205 ? -4.73904  4.30832   -28.13636 1.000 29.68310 ? 228 ARG   A NH1  1 ? 
ATOM   1520 N  NH2  . ARG   A 1 205 ? -6.58883  5.50630   -27.50871 1.000 23.56823 ? 228 ARG   A NH2  1 ? 
ATOM   1521 N  N    . GLY   A 1 206 ? -7.76770  -3.21162  -29.43981 1.000 14.95380 ? 229 GLY   A N    1 ? 
ATOM   1522 C  CA   . GLY   A 1 206 ? -7.59884  -4.59896  -29.84332 1.000 15.07797 ? 229 GLY   A CA   1 ? 
ATOM   1523 C  C    . GLY   A 1 206 ? -8.92906  -5.29372  -30.06245 1.000 12.18682 ? 229 GLY   A C    1 ? 
ATOM   1524 O  O    . GLY   A 1 206 ? -9.11772  -6.00876  -31.05190 1.000 14.19402 ? 229 GLY   A O    1 ? 
ATOM   1525 N  N    . VAL   A 1 207 ? -9.87682  -5.08928  -29.14606 1.000 11.87295 ? 230 VAL   A N    1 ? 
ATOM   1526 C  CA   . VAL   A 1 207 ? -11.19619 -5.69245  -29.31545 1.000 13.96588 ? 230 VAL   A CA   1 ? 
ATOM   1527 C  C    . VAL   A 1 207 ? -11.86221 -5.16800  -30.58395 1.000 14.81421 ? 230 VAL   A C    1 ? 
ATOM   1528 O  O    . VAL   A 1 207 ? -12.36300 -5.93929  -31.40906 1.000 13.86232 ? 230 VAL   A O    1 ? 
ATOM   1529 C  CB   . VAL   A 1 207 ? -12.07413 -5.45977  -28.07435 1.000 12.45044 ? 230 VAL   A CB   1 ? 
ATOM   1530 C  CG1  . VAL   A 1 207 ? -13.47828 -5.97278  -28.35274 1.000 14.35257 ? 230 VAL   A CG1  1 ? 
ATOM   1531 C  CG2  . VAL   A 1 207 ? -11.48464 -6.15204  -26.83126 1.000 13.82636 ? 230 VAL   A CG2  1 ? 
ATOM   1532 N  N    . ALA   A 1 208 ? -11.86884 -3.84140  -30.76254 1.000 14.13679 ? 231 ALA   A N    1 ? 
ATOM   1533 C  CA   . ALA   A 1 208 ? -12.52479 -3.26849  -31.93636 1.000 15.33047 ? 231 ALA   A CA   1 ? 
ATOM   1534 C  C    . ALA   A 1 208 ? -11.83219 -3.69594  -33.22278 1.000 13.28049 ? 231 ALA   A C    1 ? 
ATOM   1535 O  O    . ALA   A 1 208 ? -12.49893 -3.99318  -34.22371 1.000 15.59405 ? 231 ALA   A O    1 ? 
ATOM   1536 C  CB   . ALA   A 1 208 ? -12.56005 -1.74533  -31.82447 1.000 16.42856 ? 231 ALA   A CB   1 ? 
ATOM   1537 N  N    . GLY   A 1 209 ? -10.49814 -3.73842  -33.21410 1.000 14.82399 ? 232 GLY   A N    1 ? 
ATOM   1538 C  CA   . GLY   A 1 209 ? -9.77306  -4.19339  -34.38834 1.000 16.55530 ? 232 GLY   A CA   1 ? 
ATOM   1539 C  C    . GLY   A 1 209 ? -10.15693 -5.60517  -34.77899 1.000 16.53249 ? 232 GLY   A C    1 ? 
ATOM   1540 O  O    . GLY   A 1 209 ? -10.39573 -5.89803  -35.95316 1.000 16.06573 ? 232 GLY   A O    1 ? 
ATOM   1541 N  N    . PHE   A 1 210 ? -10.25293 -6.49933  -33.79210 1.000 13.53890 ? 233 PHE   A N    1 ? 
ATOM   1542 C  CA   . PHE   A 1 210 ? -10.64786 -7.86572  -34.10148 1.000 14.83784 ? 233 PHE   A CA   1 ? 
ATOM   1543 C  C    . PHE   A 1 210 ? -12.09231 -7.92259  -34.59149 1.000 15.10492 ? 233 PHE   A C    1 ? 
ATOM   1544 O  O    . PHE   A 1 210 ? -12.39049 -8.57438  -35.59939 1.000 16.18367 ? 233 PHE   A O    1 ? 
ATOM   1545 C  CB   . PHE   A 1 210 ? -10.42612 -8.77613  -32.88599 1.000 13.34276 ? 233 PHE   A CB   1 ? 
ATOM   1546 C  CG   . PHE   A 1 210 ? -11.01472 -10.14110 -33.05934 1.000 11.31228 ? 233 PHE   A CG   1 ? 
ATOM   1547 C  CD1  . PHE   A 1 210 ? -10.47024 -11.02856 -33.98083 1.000 11.76100 ? 233 PHE   A CD1  1 ? 
ATOM   1548 C  CD2  . PHE   A 1 210 ? -12.15890 -10.50972 -32.37465 1.000 10.83679 ? 233 PHE   A CD2  1 ? 
ATOM   1549 C  CE1  . PHE   A 1 210 ? -11.03874 -12.27419 -34.18648 1.000 11.65897 ? 233 PHE   A CE1  1 ? 
ATOM   1550 C  CE2  . PHE   A 1 210 ? -12.72401 -11.75634 -32.56410 1.000 13.25889 ? 233 PHE   A CE2  1 ? 
ATOM   1551 C  CZ   . PHE   A 1 210 ? -12.15872 -12.64188 -33.46488 1.000 10.73547 ? 233 PHE   A CZ   1 ? 
ATOM   1552 N  N    . LEU   A 1 211 ? -13.01026 -7.25391  -33.88639 1.000 13.11490 ? 234 LEU   A N    1 ? 
ATOM   1553 C  CA   . LEU   A 1 211 ? -14.41441 -7.27990  -34.28877 1.000 14.33410 ? 234 LEU   A CA   1 ? 
ATOM   1554 C  C    . LEU   A 1 211 ? -14.60412 -6.75642  -35.70773 1.000 15.55241 ? 234 LEU   A C    1 ? 
ATOM   1555 O  O    . LEU   A 1 211 ? -15.48737 -7.23205  -36.43540 1.000 18.61776 ? 234 LEU   A O    1 ? 
ATOM   1556 C  CB   . LEU   A 1 211 ? -15.25063 -6.44403  -33.32439 1.000 14.59422 ? 234 LEU   A CB   1 ? 
ATOM   1557 C  CG   . LEU   A 1 211 ? -15.37844 -6.94700  -31.87824 1.000 16.96779 ? 234 LEU   A CG   1 ? 
ATOM   1558 C  CD1  . LEU   A 1 211 ? -16.22994 -5.99679  -31.08643 1.000 17.47829 ? 234 LEU   A CD1  1 ? 
ATOM   1559 C  CD2  . LEU   A 1 211 ? -15.97484 -8.33724  -31.86643 1.000 18.87119 ? 234 LEU   A CD2  1 ? 
ATOM   1560 N  N    . ALA   A 1 212 ? -13.78945 -5.78313  -36.11230 1.000 15.14162 ? 235 ALA   A N    1 ? 
ATOM   1561 C  CA   . ALA   A 1 212 ? -13.93665 -5.18061  -37.43076 1.000 15.85840 ? 235 ALA   A CA   1 ? 
ATOM   1562 C  C    . ALA   A 1 212 ? -13.46493 -6.09062  -38.55454 1.000 23.59824 ? 235 ALA   A C    1 ? 
ATOM   1563 O  O    . ALA   A 1 212 ? -13.75370 -5.80685  -39.72235 1.000 27.30939 ? 235 ALA   A O    1 ? 
ATOM   1564 C  CB   . ALA   A 1 212 ? -13.16203 -3.86839  -37.47301 1.000 15.43090 ? 235 ALA   A CB   1 ? 
ATOM   1565 N  N    . THR   A 1 213 ? -12.72224 -7.15206  -38.24162 1.000 22.53040 ? 236 THR   A N    1 ? 
ATOM   1566 C  CA   . THR   A 1 213 ? -12.29498 -8.12745  -39.23774 1.000 29.13106 ? 236 THR   A CA   1 ? 
ATOM   1567 C  C    . THR   A 1 213 ? -13.28185 -9.27014  -39.40536 1.000 31.55992 ? 236 THR   A C    1 ? 
ATOM   1568 O  O    . THR   A 1 213 ? -13.13812 -10.05965 -40.34578 1.000 30.94288 ? 236 THR   A O    1 ? 
ATOM   1569 C  CB   . THR   A 1 213 ? -10.92627 -8.71967  -38.86945 1.000 25.02909 ? 236 THR   A CB   1 ? 
ATOM   1570 O  OG1  . THR   A 1 213 ? -11.10101 -9.72707  -37.85765 1.000 27.93468 ? 236 THR   A OG1  1 ? 
ATOM   1571 C  CG2  . THR   A 1 213 ? -9.96697  -7.64914  -38.38030 1.000 27.01905 ? 236 THR   A CG2  1 ? 
ATOM   1572 N  N    . GLN   A 1 214 ? -14.26786 -9.37791  -38.52359 1.000 26.45842 ? 237 GLN   A N    1 ? 
ATOM   1573 C  CA   . GLN   A 1 214 ? -15.17483 -10.51494 -38.50381 1.000 38.31123 ? 237 GLN   A CA   1 ? 
ATOM   1574 C  C    . GLN   A 1 214 ? -16.50046 -10.15317 -39.16337 1.000 43.35945 ? 237 GLN   A C    1 ? 
ATOM   1575 O  O    . GLN   A 1 214 ? -16.99450 -10.88293 -40.02030 1.000 53.77217 ? 237 GLN   A O    1 ? 
ATOM   1576 C  CB   . GLN   A 1 214 ? -15.40927 -10.96445 -37.05950 1.000 36.01824 ? 237 GLN   A CB   1 ? 
ATOM   1577 C  CG   . GLN   A 1 214 ? -14.16902 -11.53642 -36.37132 1.000 33.41291 ? 237 GLN   A CG   1 ? 
ATOM   1578 C  CD   . GLN   A 1 214 ? -14.21442 -13.04961 -36.25057 1.000 39.30798 ? 237 GLN   A CD   1 ? 
ATOM   1579 O  OE1  . GLN   A 1 214 ? -15.07492 -13.60702 -35.56050 1.000 39.55587 ? 237 GLN   A OE1  1 ? 
ATOM   1580 N  NE2  . GLN   A 1 214 ? -13.28848 -13.72345 -36.91908 1.000 28.90352 ? 237 GLN   A NE2  1 ? 
HETATM 1581 C  C10  . A1A0I B 2 .   ? -10.01830 -16.29151 -21.27029 0.737 18.53402 ? 301 A1A0I A C10  1 ? 
HETATM 1582 I  I01  . A1A0I B 2 .   ? -12.68089 -17.51510 -17.38634 0.463 15.22895 ? 301 A1A0I A I01  1 ? 
HETATM 1583 C  C02  . A1A0I B 2 .   ? -11.43276 -17.02103 -19.00489 0.693 18.18805 ? 301 A1A0I A C02  1 ? 
HETATM 1584 C  C03  . A1A0I B 2 .   ? -10.08178 -17.35593 -19.09430 0.930 15.82620 ? 301 A1A0I A C03  1 ? 
HETATM 1585 C  C04  . A1A0I B 2 .   ? -9.38078  -18.06755 -18.01056 0.516 12.74242 ? 301 A1A0I A C04  1 ? 
HETATM 1586 N  N05  . A1A0I B 2 .   ? -9.35275  -17.67796 -16.71592 1.000 13.29412 ? 301 A1A0I A N05  1 ? 
HETATM 1587 N  N06  . A1A0I B 2 .   ? -8.57738  -18.54976 -16.07451 0.656 17.78313 ? 301 A1A0I A N06  1 ? 
HETATM 1588 N  N07  . A1A0I B 2 .   ? -8.18115  -19.42850 -16.96402 0.669 17.53456 ? 301 A1A0I A N07  1 ? 
HETATM 1589 N  N08  . A1A0I B 2 .   ? -8.63761  -19.15519 -18.17942 0.612 14.83360 ? 301 A1A0I A N08  1 ? 
HETATM 1590 C  C09  . A1A0I B 2 .   ? -9.39175  -16.97930 -20.24353 0.787 18.59808 ? 301 A1A0I A C09  1 ? 
HETATM 1591 C  C11  . A1A0I B 2 .   ? -11.34214 -15.98113 -21.17477 0.461 17.90506 ? 301 A1A0I A C11  1 ? 
HETATM 1592 C  C12  . A1A0I B 2 .   ? -12.05103 -16.33908 -20.04989 0.553 16.50858 ? 301 A1A0I A C12  1 ? 
HETATM 1593 H  H101 . A1A0I B 2 .   ? -9.52741  -16.03876 -22.03475 0.815 22.24082 ? 301 A1A0I A H101 1 ? 
HETATM 1594 H  H091 . A1A0I B 2 .   ? -8.47982  -17.19705 -20.32385 0.826 22.31770 ? 301 A1A0I A H091 1 ? 
HETATM 1595 H  H111 . A1A0I B 2 .   ? -11.77280 -15.52268 -21.87599 0.737 21.48608 ? 301 A1A0I A H111 1 ? 
HETATM 1596 H  H121 . A1A0I B 2 .   ? -12.96524 -16.12263 -19.98114 0.815 19.81029 ? 301 A1A0I A H121 1 ? 
HETATM 1597 ZN ZN   . ZN    C 3 .   ? -4.29925  -13.68450 -12.46885 1.000 13.67586 ? 302 ZN    A ZN   1 ? 
HETATM 1598 O  O    . HOH   D 4 .   ? -2.80184  -14.16975 -10.81038 1.000 21.38738 ? 401 HOH   A O    1 ? 
HETATM 1599 O  O    . HOH   D 4 .   ? -4.30260  -10.96702 -36.43234 1.000 25.28915 ? 402 HOH   A O    1 ? 
HETATM 1600 O  O    . HOH   D 4 .   ? 9.40472   -6.14395  -6.67367  1.000 29.51608 ? 403 HOH   A O    1 ? 
HETATM 1601 O  O    . HOH   D 4 .   ? -2.42863  -6.13678  -35.98293 1.000 32.71162 ? 404 HOH   A O    1 ? 
HETATM 1602 O  O    . HOH   D 4 .   ? -16.59278 -12.92360 -33.58734 1.000 25.29988 ? 405 HOH   A O    1 ? 
HETATM 1603 O  O    . HOH   D 4 .   ? 9.10463   -11.12258 -7.73697  1.000 31.07490 ? 406 HOH   A O    1 ? 
HETATM 1604 O  O    . HOH   D 4 .   ? 5.56503   -19.00483 -25.70673 1.000 24.97664 ? 407 HOH   A O    1 ? 
HETATM 1605 O  O    . HOH   D 4 .   ? -10.82127 -8.83261  -1.01649  1.000 16.40487 ? 408 HOH   A O    1 ? 
HETATM 1606 O  O    . HOH   D 4 .   ? -2.50346  -13.54003 -13.39428 1.000 12.70740 ? 409 HOH   A O    1 ? 
HETATM 1607 O  O    . HOH   D 4 .   ? -3.30211  1.08212   -28.48156 1.000 25.01200 ? 410 HOH   A O    1 ? 
HETATM 1608 O  O    . HOH   D 4 .   ? -7.09250  -22.05972 -10.89530 1.000 31.40305 ? 411 HOH   A O    1 ? 
HETATM 1609 O  O    . HOH   D 4 .   ? 0.13087   -15.35336 -14.95150 1.000 25.35457 ? 412 HOH   A O    1 ? 
HETATM 1610 O  O    . HOH   D 4 .   ? -9.69541  0.86065   -5.25425  1.000 32.02473 ? 413 HOH   A O    1 ? 
HETATM 1611 O  O    . HOH   D 4 .   ? -6.02455  -21.62718 -5.96852  1.000 19.13599 ? 414 HOH   A O    1 ? 
HETATM 1612 O  O    . HOH   D 4 .   ? -11.63697 -19.41517 -28.58624 1.000 10.41683 ? 415 HOH   A O    1 ? 
HETATM 1613 O  O    . HOH   D 4 .   ? -10.643   4.178     -24.934   1.000 22.74888 ? 416 HOH   A O    1 ? 
HETATM 1614 O  O    . HOH   D 4 .   ? 2.42931   -3.16058  -18.21883 1.000 15.52298 ? 417 HOH   A O    1 ? 
HETATM 1615 O  O    . HOH   D 4 .   ? -9.24691  -4.38528  -37.80391 1.000 22.48663 ? 418 HOH   A O    1 ? 
HETATM 1616 O  O    . HOH   D 4 .   ? -15.84466 -20.55766 -5.23991  1.000 18.49825 ? 419 HOH   A O    1 ? 
HETATM 1617 O  O    . HOH   D 4 .   ? -4.22852  -10.41478 -4.33100  1.000 25.70296 ? 420 HOH   A O    1 ? 
HETATM 1618 O  O    . HOH   D 4 .   ? -7.34402  -21.68969 -15.50101 1.000 19.14311 ? 421 HOH   A O    1 ? 
HETATM 1619 O  O    . HOH   D 4 .   ? -8.82666  -3.29116  -3.23236  1.000 22.57276 ? 422 HOH   A O    1 ? 
HETATM 1620 O  O    . HOH   D 4 .   ? -3.70509  -4.30014  -33.76105 1.000 23.28402 ? 423 HOH   A O    1 ? 
HETATM 1621 O  O    . HOH   D 4 .   ? -27.26304 -19.68026 -24.42732 1.000 24.49774 ? 424 HOH   A O    1 ? 
HETATM 1622 O  O    . HOH   D 4 .   ? -20.84512 -18.70188 -8.77153  1.000 19.44617 ? 425 HOH   A O    1 ? 
HETATM 1623 O  O    . HOH   D 4 .   ? -0.84880  1.67870   -18.77607 1.000 21.39176 ? 426 HOH   A O    1 ? 
HETATM 1624 O  O    . HOH   D 4 .   ? -10.14411 -20.17521 -26.43102 1.000 11.40553 ? 427 HOH   A O    1 ? 
HETATM 1625 O  O    . HOH   D 4 .   ? -14.376   -5.679    -42.338   1.000 25.76265 ? 428 HOH   A O    1 ? 
HETATM 1626 O  O    . HOH   D 4 .   ? -10.19657 -22.30386 -37.78107 1.000 22.62419 ? 429 HOH   A O    1 ? 
HETATM 1627 O  O    . HOH   D 4 .   ? -11.95373 -5.61157  -2.36272  1.000 24.18424 ? 430 HOH   A O    1 ? 
HETATM 1628 O  O    . HOH   D 4 .   ? -16.23698 -10.68576 -7.12706  1.000 17.83906 ? 431 HOH   A O    1 ? 
HETATM 1629 O  O    . HOH   D 4 .   ? -4.68982  -22.23474 -31.28512 1.000 17.22436 ? 432 HOH   A O    1 ? 
HETATM 1630 O  O    . HOH   D 4 .   ? -9.96238  -15.50519 -15.18575 1.000 12.25992 ? 433 HOH   A O    1 ? 
HETATM 1631 O  O    . HOH   D 4 .   ? -2.64764  -16.40530 -16.68878 1.000 25.86593 ? 434 HOH   A O    1 ? 
HETATM 1632 O  O    . HOH   D 4 .   ? -7.41393  2.04877   -7.03132  1.000 27.20861 ? 435 HOH   A O    1 ? 
HETATM 1633 O  O    . HOH   D 4 .   ? -12.43850 1.89037   -13.10391 1.000 16.73786 ? 436 HOH   A O    1 ? 
HETATM 1634 O  O    . HOH   D 4 .   ? -12.65210 -2.51541  -5.08649  1.000 19.29478 ? 437 HOH   A O    1 ? 
HETATM 1635 O  O    . HOH   D 4 .   ? -7.86139  -18.81745 -27.10178 1.000 9.87848  ? 438 HOH   A O    1 ? 
HETATM 1636 O  O    . HOH   D 4 .   ? -12.67808 -0.48774  -6.86782  1.000 27.10806 ? 439 HOH   A O    1 ? 
HETATM 1637 O  O    . HOH   D 4 .   ? 3.34652   -10.23498 -18.36180 1.000 13.88161 ? 440 HOH   A O    1 ? 
HETATM 1638 O  O    . HOH   D 4 .   ? -17.27969 -27.09644 -11.22629 1.000 13.50456 ? 441 HOH   A O    1 ? 
HETATM 1639 O  O    . HOH   D 4 .   ? -18.33624 -21.35382 -9.88689  1.000 14.18896 ? 442 HOH   A O    1 ? 
HETATM 1640 O  O    . HOH   D 4 .   ? 5.23686   -15.49200 -14.41309 1.000 25.68324 ? 443 HOH   A O    1 ? 
HETATM 1641 O  O    . HOH   D 4 .   ? 1.33773   5.23351   -9.81811  1.000 22.44066 ? 444 HOH   A O    1 ? 
HETATM 1642 O  O    . HOH   D 4 .   ? -21.16421 -13.36978 -12.06236 1.000 25.57360 ? 445 HOH   A O    1 ? 
HETATM 1643 O  O    . HOH   D 4 .   ? -13.03458 -29.39362 -23.84465 1.000 13.36655 ? 446 HOH   A O    1 ? 
HETATM 1644 O  O    . HOH   D 4 .   ? 5.33672   -3.69368  -7.04603  1.000 18.85852 ? 447 HOH   A O    1 ? 
HETATM 1645 O  O    . HOH   D 4 .   ? -19.27371 4.84395   -21.96357 1.000 25.35348 ? 448 HOH   A O    1 ? 
HETATM 1646 O  O    . HOH   D 4 .   ? -14.81973 -30.86521 -7.54435  1.000 20.38474 ? 449 HOH   A O    1 ? 
HETATM 1647 O  O    . HOH   D 4 .   ? 10.398    -15.952   -25.908   1.000 23.21454 ? 450 HOH   A O    1 ? 
HETATM 1648 O  O    . HOH   D 4 .   ? -9.60522  -14.94541 -6.62704  1.000 14.75765 ? 451 HOH   A O    1 ? 
HETATM 1649 O  O    . HOH   D 4 .   ? -22.47636 -22.50142 -21.78029 1.000 12.12684 ? 452 HOH   A O    1 ? 
HETATM 1650 O  O    . HOH   D 4 .   ? -23.99429 -15.36381 -20.09134 1.000 17.07244 ? 453 HOH   A O    1 ? 
HETATM 1651 O  O    . HOH   D 4 .   ? -16.234   -26.032   -24.086   1.000 14.10632 ? 454 HOH   A O    1 ? 
HETATM 1652 O  O    . HOH   D 4 .   ? -17.922   -27.732   -14.647   1.000 13.95679 ? 455 HOH   A O    1 ? 
HETATM 1653 O  O    . HOH   D 4 .   ? -23.64625 -19.36091 -9.98947  1.000 23.28561 ? 456 HOH   A O    1 ? 
HETATM 1654 O  O    . HOH   D 4 .   ? -18.36463 -20.43165 -0.75208  1.000 22.62889 ? 457 HOH   A O    1 ? 
HETATM 1655 O  O    . HOH   D 4 .   ? -5.35443  -17.53106 -37.31931 1.000 31.76287 ? 458 HOH   A O    1 ? 
HETATM 1656 O  O    . HOH   D 4 .   ? -15.45955 -7.25643  1.05474   1.000 26.77456 ? 459 HOH   A O    1 ? 
HETATM 1657 O  O    . HOH   D 4 .   ? -22.53422 -11.86483 -17.18341 1.000 25.77756 ? 460 HOH   A O    1 ? 
HETATM 1658 O  O    . HOH   D 4 .   ? 6.75485   -11.88120 -24.54452 1.000 16.30216 ? 461 HOH   A O    1 ? 
HETATM 1659 O  O    . HOH   D 4 .   ? -6.86810  -18.15466 -13.92535 1.000 30.88794 ? 462 HOH   A O    1 ? 
HETATM 1660 O  O    . HOH   D 4 .   ? 5.32096   3.35900   -15.13845 1.000 22.40412 ? 463 HOH   A O    1 ? 
HETATM 1661 O  O    . HOH   D 4 .   ? 3.96026   -1.27670  -5.56934  1.000 21.45154 ? 464 HOH   A O    1 ? 
HETATM 1662 O  O    . HOH   D 4 .   ? -17.94783 0.84171   -16.82479 1.000 18.09031 ? 465 HOH   A O    1 ? 
HETATM 1663 O  O    . HOH   D 4 .   ? -21.43717 -22.60277 -10.69643 1.000 16.24889 ? 466 HOH   A O    1 ? 
HETATM 1664 O  O    . HOH   D 4 .   ? -5.21150  -29.01057 -8.86649  1.000 30.91103 ? 467 HOH   A O    1 ? 
HETATM 1665 O  O    . HOH   D 4 .   ? 5.33017   -14.90747 -30.97862 1.000 25.22394 ? 468 HOH   A O    1 ? 
HETATM 1666 O  O    . HOH   D 4 .   ? -6.81298  -19.99487 -29.34295 1.000 10.36090 ? 469 HOH   A O    1 ? 
HETATM 1667 O  O    . HOH   D 4 .   ? -12.82380 4.15349   -20.84783 1.000 17.02050 ? 470 HOH   A O    1 ? 
HETATM 1668 O  O    . HOH   D 4 .   ? -24.41587 -20.92469 -26.14005 1.000 18.49226 ? 471 HOH   A O    1 ? 
HETATM 1669 O  O    . HOH   D 4 .   ? -17.57706 -23.86515 -10.69685 1.000 13.89669 ? 472 HOH   A O    1 ? 
HETATM 1670 O  O    . HOH   D 4 .   ? -13.58986 -26.91989 -25.08129 1.000 12.30830 ? 473 HOH   A O    1 ? 
HETATM 1671 O  O    . HOH   D 4 .   ? -20.15075 -23.98056 -22.31826 1.000 9.60354  ? 474 HOH   A O    1 ? 
HETATM 1672 O  O    . HOH   D 4 .   ? -4.001    -30.667   -25.916   1.000 15.71339 ? 475 HOH   A O    1 ? 
HETATM 1673 O  O    . HOH   D 4 .   ? -19.07197 -18.42631 -6.64080  1.000 22.80136 ? 476 HOH   A O    1 ? 
HETATM 1674 O  O    . HOH   D 4 .   ? 14.35687  -12.84059 -19.61238 1.000 20.47620 ? 477 HOH   A O    1 ? 
HETATM 1675 O  O    . HOH   D 4 .   ? 1.27266   -16.46929 -17.58589 1.000 14.54817 ? 478 HOH   A O    1 ? 
HETATM 1676 O  O    . HOH   D 4 .   ? -5.04477  -22.83938 -22.19726 1.000 9.95843  ? 479 HOH   A O    1 ? 
HETATM 1677 O  O    . HOH   D 4 .   ? -22.650   -8.044    -16.882   1.000 24.91266 ? 480 HOH   A O    1 ? 
HETATM 1678 O  O    . HOH   D 4 .   ? -20.48880 -3.28496  -8.04684  1.000 31.09376 ? 481 HOH   A O    1 ? 
HETATM 1679 O  O    . HOH   D 4 .   ? -16.75368 -23.29915 -31.17221 1.000 23.46298 ? 482 HOH   A O    1 ? 
HETATM 1680 O  O    . HOH   D 4 .   ? -8.65294  -7.12603  -1.26391  1.000 21.75453 ? 483 HOH   A O    1 ? 
HETATM 1681 O  O    . HOH   D 4 .   ? 9.63835   -5.72279  -21.37391 1.000 22.01541 ? 484 HOH   A O    1 ? 
HETATM 1682 O  O    . HOH   D 4 .   ? -10.14202 -15.62258 -12.53476 1.000 16.53101 ? 485 HOH   A O    1 ? 
HETATM 1683 O  O    . HOH   D 4 .   ? -4.00614  -19.85988 -36.83730 1.000 32.82336 ? 486 HOH   A O    1 ? 
HETATM 1684 O  O    . HOH   D 4 .   ? -12.183   -35.804   -17.676   1.000 29.06971 ? 487 HOH   A O    1 ? 
HETATM 1685 O  O    . HOH   D 4 .   ? -15.99387 -19.31060 -22.88053 1.000 16.35688 ? 488 HOH   A O    1 ? 
HETATM 1686 O  O    . HOH   D 4 .   ? -18.88395 -14.91912 -32.16729 1.000 26.82221 ? 489 HOH   A O    1 ? 
HETATM 1687 O  O    . HOH   D 4 .   ? -15.88114 -23.42173 -5.57425  1.000 17.85716 ? 490 HOH   A O    1 ? 
HETATM 1688 O  O    . HOH   D 4 .   ? -14.52874 -18.50910 -6.85124  1.000 13.43998 ? 491 HOH   A O    1 ? 
HETATM 1689 O  O    . HOH   D 4 .   ? -18.08999 -13.36968 -0.43227  1.000 22.12096 ? 492 HOH   A O    1 ? 
HETATM 1690 O  O    . HOH   D 4 .   ? -5.21686  -27.99280 -18.99187 1.000 17.77577 ? 493 HOH   A O    1 ? 
HETATM 1691 O  O    . HOH   D 4 .   ? -4.78259  2.55662   -7.21499  1.000 29.69295 ? 494 HOH   A O    1 ? 
HETATM 1692 O  O    . HOH   D 4 .   ? -9.13972  4.83585   -14.89832 1.000 24.90307 ? 495 HOH   A O    1 ? 
HETATM 1693 O  O    . HOH   D 4 .   ? 9.87177   -12.46467 -26.24933 1.000 23.72152 ? 496 HOH   A O    1 ? 
HETATM 1694 O  O    . HOH   D 4 .   ? -20.55380 -11.32622 -9.15036  1.000 24.07299 ? 497 HOH   A O    1 ? 
HETATM 1695 O  O    . HOH   D 4 .   ? -21.80185 -4.93449  -18.60410 1.000 20.63795 ? 498 HOH   A O    1 ? 
HETATM 1696 O  O    . HOH   D 4 .   ? -23.26338 -11.65262 -30.53621 1.000 32.11802 ? 499 HOH   A O    1 ? 
HETATM 1697 O  O    . HOH   D 4 .   ? -14.360   -27.053   -27.776   1.000 17.88033 ? 500 HOH   A O    1 ? 
HETATM 1698 O  O    . HOH   D 4 .   ? -17.27845 -3.58209  -5.60430  1.000 19.62535 ? 501 HOH   A O    1 ? 
HETATM 1699 O  O    . HOH   D 4 .   ? -15.69542 -16.40005 -34.96724 1.000 34.15322 ? 502 HOH   A O    1 ? 
HETATM 1700 O  O    . HOH   D 4 .   ? -13.42011 -18.03109 -22.45634 1.000 16.32765 ? 503 HOH   A O    1 ? 
HETATM 1701 O  O    . HOH   D 4 .   ? -5.82075  -10.40542 -6.25883  1.000 14.84497 ? 504 HOH   A O    1 ? 
HETATM 1702 O  O    . HOH   D 4 .   ? -23.79715 -3.28251  -22.42146 1.000 26.49100 ? 505 HOH   A O    1 ? 
HETATM 1703 O  O    . HOH   D 4 .   ? 11.16966  -0.10819  -18.61331 1.000 33.22985 ? 506 HOH   A O    1 ? 
HETATM 1704 O  O    . HOH   D 4 .   ? -4.03876  -23.09236 -35.04442 1.000 32.16286 ? 507 HOH   A O    1 ? 
HETATM 1705 O  O    . HOH   D 4 .   ? -11.34305 -31.46625 -18.13067 1.000 16.97929 ? 508 HOH   A O    1 ? 
HETATM 1706 O  O    . HOH   D 4 .   ? -8.83609  -12.16326 -4.85234  1.000 23.52516 ? 509 HOH   A O    1 ? 
HETATM 1707 O  O    . HOH   D 4 .   ? 9.563     -17.058   -22.504   1.000 18.56944 ? 510 HOH   A O    1 ? 
HETATM 1708 O  O    . HOH   D 4 .   ? -1.90314  -23.13929 -14.97948 1.000 27.05888 ? 511 HOH   A O    1 ? 
HETATM 1709 O  O    . HOH   D 4 .   ? 9.71540   -13.16371 -23.52252 1.000 15.33103 ? 512 HOH   A O    1 ? 
HETATM 1710 O  O    . HOH   D 4 .   ? -17.545   -30.036   -7.577    1.000 17.21495 ? 513 HOH   A O    1 ? 
HETATM 1711 O  O    . HOH   D 4 .   ? -14.60540 3.44433   -14.01203 1.000 25.33421 ? 514 HOH   A O    1 ? 
HETATM 1712 O  O    . HOH   D 4 .   ? -23.917   -18.940   -14.599   1.000 25.23937 ? 515 HOH   A O    1 ? 
HETATM 1713 O  O    . HOH   D 4 .   ? 2.58971   -2.90540  -32.70654 1.000 28.40421 ? 516 HOH   A O    1 ? 
HETATM 1714 O  O    . HOH   D 4 .   ? 3.44481   -18.60954 -27.99591 1.000 28.81715 ? 517 HOH   A O    1 ? 
HETATM 1715 O  O    . HOH   D 4 .   ? -1.22256  -15.03013 -3.47889  1.000 22.85258 ? 518 HOH   A O    1 ? 
HETATM 1716 O  O    . HOH   D 4 .   ? -4.61214  -25.58171 -9.53475  1.000 27.92666 ? 519 HOH   A O    1 ? 
HETATM 1717 O  O    . HOH   D 4 .   ? -5.58495  -31.19210 -18.07240 1.000 13.74589 ? 520 HOH   A O    1 ? 
HETATM 1718 O  O    . HOH   D 4 .   ? -17.21073 -1.27462  -7.82201  1.000 34.07232 ? 521 HOH   A O    1 ? 
HETATM 1719 O  O    . HOH   D 4 .   ? -4.09261  -15.88502 -12.56869 1.000 20.73124 ? 522 HOH   A O    1 ? 
HETATM 1720 O  O    . HOH   D 4 .   ? 2.30032   -16.77312 -12.51179 1.000 34.64276 ? 523 HOH   A O    1 ? 
HETATM 1721 O  O    . HOH   D 4 .   ? -2.67509  -16.12745 -8.65940  1.000 24.18932 ? 524 HOH   A O    1 ? 
HETATM 1722 O  O    . HOH   D 4 .   ? 7.71396   -2.71657  -7.61514  1.000 26.75136 ? 525 HOH   A O    1 ? 
HETATM 1723 O  O    . HOH   D 4 .   ? -7.21985  -17.85031 -11.69125 1.000 14.96222 ? 526 HOH   A O    1 ? 
HETATM 1724 O  O    . HOH   D 4 .   ? -3.10297  -20.97550 -13.09852 1.000 39.26622 ? 527 HOH   A O    1 ? 
HETATM 1725 O  O    . HOH   D 4 .   ? -14.68545 -16.51636 -19.64807 1.000 18.13919 ? 528 HOH   A O    1 ? 
HETATM 1726 O  O    . HOH   D 4 .   ? -6.46414  -9.18432  -2.01722  1.000 20.50898 ? 529 HOH   A O    1 ? 
HETATM 1727 O  O    . HOH   D 4 .   ? -26.65456 -14.54882 -28.56303 1.000 31.28068 ? 530 HOH   A O    1 ? 
HETATM 1728 O  O    . HOH   D 4 .   ? -17.79613 -24.92183 -3.42395  1.000 25.32184 ? 531 HOH   A O    1 ? 
HETATM 1729 O  O    . HOH   D 4 .   ? -15.65082 -24.06326 -33.46689 1.000 21.46806 ? 532 HOH   A O    1 ? 
HETATM 1730 O  O    . HOH   D 4 .   ? -25.97965 -14.99050 -21.87410 1.000 19.24181 ? 533 HOH   A O    1 ? 
HETATM 1731 O  O    . HOH   D 4 .   ? -0.79927  -18.26290 -15.53011 1.000 24.37307 ? 534 HOH   A O    1 ? 
HETATM 1732 O  O    . HOH   D 4 .   ? -7.96209  -11.16454 -2.48625  1.000 24.76094 ? 535 HOH   A O    1 ? 
HETATM 1733 O  O    . HOH   D 4 .   ? -7.41439  -22.05601 -38.74380 1.000 30.08874 ? 536 HOH   A O    1 ? 
HETATM 1734 O  O    . HOH   D 4 .   ? -19.03940 -21.91824 -2.96083  1.000 26.19572 ? 537 HOH   A O    1 ? 
HETATM 1735 O  O    . HOH   D 4 .   ? -13.18542 -33.24893 -17.11975 1.000 23.09661 ? 538 HOH   A O    1 ? 
HETATM 1736 O  O    . HOH   D 4 .   ? -13.61146 -20.32235 -37.30482 1.000 31.77663 ? 539 HOH   A O    1 ? 
HETATM 1737 O  O    . HOH   D 4 .   ? -15.18540 -2.64029  -4.10613  1.000 26.01362 ? 540 HOH   A O    1 ? 
HETATM 1738 O  O    . HOH   D 4 .   ? -2.50673  -8.94609  -36.74770 1.000 27.57430 ? 541 HOH   A O    1 ? 
HETATM 1739 O  O    . HOH   D 4 .   ? -6.42937  -20.15095 -12.44256 1.000 34.19531 ? 542 HOH   A O    1 ? 
HETATM 1740 O  O    . HOH   D 4 .   ? 6.25126   3.31952   -18.34976 1.000 33.44978 ? 543 HOH   A O    1 ? 
HETATM 1741 O  O    . HOH   D 4 .   ? -4.51425  -17.21390 -14.90237 1.000 29.02437 ? 544 HOH   A O    1 ? 
HETATM 1742 O  O    . HOH   D 4 .   ? -1.43120  -20.46094 -34.94374 1.000 36.38460 ? 545 HOH   A O    1 ? 
HETATM 1743 O  O    . HOH   D 4 .   ? -23.18528 -14.59890 -17.99982 1.000 22.03744 ? 546 HOH   A O    1 ? 
HETATM 1744 O  O    . HOH   D 4 .   ? -12.01495 -20.82428 -38.91305 1.000 35.94892 ? 547 HOH   A O    1 ? 
HETATM 1745 O  O    . HOH   D 4 .   ? -12.95642 -6.60076  0.11444   1.000 27.91870 ? 548 HOH   A O    1 ? 
HETATM 1746 O  O    . HOH   D 4 .   ? -18.59597 -20.81684 -5.34628  1.000 23.75988 ? 549 HOH   A O    1 ? 
HETATM 1747 O  O    . HOH   D 4 .   ? 3.69392   5.55168   -14.50693 1.000 30.08643 ? 550 HOH   A O    1 ? 
HETATM 1748 O  O    . HOH   D 4 .   ? -2.90835  1.85990   -5.14176  1.000 35.15094 ? 551 HOH   A O    1 ? 
HETATM 1749 O  O    . HOH   D 4 .   ? -16.55358 -22.96789 -35.74416 1.000 29.12011 ? 552 HOH   A O    1 ? 
HETATM 1750 O  O    . HOH   D 4 .   ? -16.01841 -26.21694 -1.80021  1.000 31.66665 ? 553 HOH   A O    1 ? 
HETATM 1751 O  O    . HOH   D 4 .   ? -7.25600  -1.14140  -3.31817  1.000 32.87399 ? 554 HOH   A O    1 ? 
HETATM 1752 O  O    . HOH   D 4 .   ? -17.47926 -17.13013 -33.14120 1.000 24.67954 ? 555 HOH   A O    1 ? 
HETATM 1753 O  O    . HOH   D 4 .   ? -2.53506  -22.40537 -32.81773 1.000 24.32732 ? 556 HOH   A O    1 ? 
HETATM 1754 O  O    . HOH   D 4 .   ? -17.84105 2.34723   -14.05190 1.000 34.92960 ? 557 HOH   A O    1 ? 
HETATM 1755 O  O    . HOH   D 4 .   ? -4.17267  -25.40849 -35.87838 1.000 36.99878 ? 558 HOH   A O    1 ? 
HETATM 1756 O  O    . HOH   D 4 .   ? -8.07140  -4.51842  -0.84938  1.000 29.52439 ? 559 HOH   A O    1 ? 
HETATM 1757 O  O    . HOH   D 4 .   ? -15.34126 -18.11602 -37.37748 1.000 28.84507 ? 560 HOH   A O    1 ? 
# 
