data_9F7A
# 
_entry.id   9F7A 
# 
_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   9F7A         pdb_00009f7a 10.2210/pdb9f7a/pdb 
WWPDB D_1292138349 ?            ?                   
# 
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 2024-12-18 
# 
_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' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' citation        
2 2 'Structure model' citation_author 
# 
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.country'                 
2  2 'Structure model' '_citation.journal_abbrev'          
3  2 'Structure model' '_citation.journal_id_CSD'          
4  2 'Structure model' '_citation.journal_id_ISSN'         
5  2 'Structure model' '_citation.journal_volume'          
6  2 'Structure model' '_citation.page_first'              
7  2 'Structure model' '_citation.page_last'               
8  2 'Structure model' '_citation.pdbx_database_id_DOI'    
9  2 'Structure model' '_citation.pdbx_database_id_PubMed' 
10 2 'Structure model' '_citation.title'                   
11 2 'Structure model' '_citation.year'                    
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9F7A 
_pdbx_database_status.recvd_initial_deposition_date   2024-05-03 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
loop_
_pdbx_database_related.content_type 
_pdbx_database_related.db_id 
_pdbx_database_related.db_name 
_pdbx_database_related.details 
unspecified 9EXB PDB . 
unspecified 9F83 PDB . 
unspecified 9EZB PDB . 
unspecified 9F5L PDB . 
unspecified 9EVY PDB . 
unspecified 9FBG PDB . 
unspecified 9F5J PDB . 
unspecified 9F7C PDB . 
unspecified 9EWH PDB . 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              andreas.schlundt@uni-greifswald.de 
_pdbx_contact_author.name_first         Andreas 
_pdbx_contact_author.name_last          Schlundt 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0003-2254-7560 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Dhamotharan, K.' 1 0000-0003-0226-7350 
'Schlundt, A.'    2 0000-0003-2254-7560 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   UK 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Nat Commun' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2041-1723 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            15 
_citation.language                  ? 
_citation.page_first                10656 
_citation.page_last                 10656 
_citation.title                     
'A core network in the SARS-CoV-2 nucleocapsid NTD mediates structural integrity and selective RNA-binding.' 
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1038/s41467-024-55024-0 
_citation.pdbx_database_id_PubMed   39653699 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Dhamotharan, K.' 1 ? 
primary 'Korn, S.M.'      2 ? 
primary 'Wacker, A.'      3 ? 
primary 'Becker, M.A.'    4 ? 
primary 'Gunther, S.'     5 ? 
primary 'Schwalbe, H.'    6 ? 
primary 'Schlundt, A.'    7 ? 
# 
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 Nucleoprotein 14954.669 1  ? P80R ? ? 
2 non-polymer syn 'ZINC ION'    65.409    1  ? ?    ? ? 
3 water       nat water         18.015    50 ? ?    ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'N,Nucleocapsid protein,NC,Protein N' 
# 
_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       
;GSRPQGLPNNTASWFTALTQHGKEDLKFPRGQGVPINTNSSRDDQIGYYRRATRRIRGGDGKMKDLSPRWYFYYLGTGPE
AGLPYGANKDGIIWVATEGALNTPKDHIGTRNPANNAAIVLQLPQGTTLPKGFYAE
;
_entity_poly.pdbx_seq_one_letter_code_can   
;GSRPQGLPNNTASWFTALTQHGKEDLKFPRGQGVPINTNSSRDDQIGYYRRATRRIRGGDGKMKDLSPRWYFYYLGTGPE
AGLPYGANKDGIIWVATEGALNTPKDHIGTRNPANNAAIVLQLPQGTTLPKGFYAE
;
_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 'ZINC ION' ZN  
3 water      HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   GLY n 
1 2   SER n 
1 3   ARG n 
1 4   PRO n 
1 5   GLN n 
1 6   GLY n 
1 7   LEU n 
1 8   PRO n 
1 9   ASN n 
1 10  ASN n 
1 11  THR n 
1 12  ALA n 
1 13  SER n 
1 14  TRP n 
1 15  PHE n 
1 16  THR n 
1 17  ALA n 
1 18  LEU n 
1 19  THR n 
1 20  GLN n 
1 21  HIS n 
1 22  GLY n 
1 23  LYS n 
1 24  GLU n 
1 25  ASP n 
1 26  LEU n 
1 27  LYS n 
1 28  PHE n 
1 29  PRO n 
1 30  ARG n 
1 31  GLY n 
1 32  GLN n 
1 33  GLY n 
1 34  VAL n 
1 35  PRO n 
1 36  ILE n 
1 37  ASN n 
1 38  THR n 
1 39  ASN n 
1 40  SER n 
1 41  SER n 
1 42  ARG n 
1 43  ASP n 
1 44  ASP n 
1 45  GLN n 
1 46  ILE n 
1 47  GLY n 
1 48  TYR n 
1 49  TYR n 
1 50  ARG n 
1 51  ARG n 
1 52  ALA n 
1 53  THR n 
1 54  ARG n 
1 55  ARG n 
1 56  ILE n 
1 57  ARG n 
1 58  GLY n 
1 59  GLY n 
1 60  ASP n 
1 61  GLY n 
1 62  LYS n 
1 63  MET n 
1 64  LYS n 
1 65  ASP n 
1 66  LEU n 
1 67  SER n 
1 68  PRO n 
1 69  ARG n 
1 70  TRP n 
1 71  TYR n 
1 72  PHE n 
1 73  TYR n 
1 74  TYR n 
1 75  LEU n 
1 76  GLY n 
1 77  THR n 
1 78  GLY n 
1 79  PRO n 
1 80  GLU n 
1 81  ALA n 
1 82  GLY n 
1 83  LEU n 
1 84  PRO n 
1 85  TYR n 
1 86  GLY n 
1 87  ALA n 
1 88  ASN n 
1 89  LYS n 
1 90  ASP n 
1 91  GLY n 
1 92  ILE n 
1 93  ILE n 
1 94  TRP n 
1 95  VAL n 
1 96  ALA n 
1 97  THR n 
1 98  GLU n 
1 99  GLY n 
1 100 ALA n 
1 101 LEU n 
1 102 ASN n 
1 103 THR n 
1 104 PRO n 
1 105 LYS n 
1 106 ASP n 
1 107 HIS n 
1 108 ILE n 
1 109 GLY n 
1 110 THR n 
1 111 ARG n 
1 112 ASN n 
1 113 PRO n 
1 114 ALA n 
1 115 ASN n 
1 116 ASN n 
1 117 ALA n 
1 118 ALA n 
1 119 ILE n 
1 120 VAL n 
1 121 LEU n 
1 122 GLN n 
1 123 LEU n 
1 124 PRO n 
1 125 GLN n 
1 126 GLY n 
1 127 THR n 
1 128 THR n 
1 129 LEU n 
1 130 PRO n 
1 131 LYS n 
1 132 GLY n 
1 133 PHE n 
1 134 TYR n 
1 135 ALA n 
1 136 GLU 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                   136 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 ? 
_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      'Severe acute respiratory syndrome coronavirus 2' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     2697049 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli BL21(DE3)' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     469008 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE      ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4'     133.103 
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   GLY 1   39  ?   ?   ?   A . n 
A 1 2   SER 2   40  ?   ?   ?   A . n 
A 1 3   ARG 3   41  ?   ?   ?   A . n 
A 1 4   PRO 4   42  ?   ?   ?   A . n 
A 1 5   GLN 5   43  ?   ?   ?   A . n 
A 1 6   GLY 6   44  ?   ?   ?   A . n 
A 1 7   LEU 7   45  ?   ?   ?   A . n 
A 1 8   PRO 8   46  ?   ?   ?   A . n 
A 1 9   ASN 9   47  ?   ?   ?   A . n 
A 1 10  ASN 10  48  48  ASN ASN A . n 
A 1 11  THR 11  49  49  THR THR A . n 
A 1 12  ALA 12  50  50  ALA ALA A . n 
A 1 13  SER 13  51  51  SER SER A . n 
A 1 14  TRP 14  52  52  TRP TRP A . n 
A 1 15  PHE 15  53  53  PHE PHE A . n 
A 1 16  THR 16  54  54  THR THR A . n 
A 1 17  ALA 17  55  55  ALA ALA A . n 
A 1 18  LEU 18  56  56  LEU LEU A . n 
A 1 19  THR 19  57  57  THR THR A . n 
A 1 20  GLN 20  58  58  GLN GLN A . n 
A 1 21  HIS 21  59  59  HIS HIS A . n 
A 1 22  GLY 22  60  60  GLY GLY A . n 
A 1 23  LYS 23  61  61  LYS LYS A . n 
A 1 24  GLU 24  62  62  GLU GLU A . n 
A 1 25  ASP 25  63  63  ASP ASP A . n 
A 1 26  LEU 26  64  64  LEU LEU A . n 
A 1 27  LYS 27  65  65  LYS LYS A . n 
A 1 28  PHE 28  66  66  PHE PHE A . n 
A 1 29  PRO 29  67  67  PRO PRO A . n 
A 1 30  ARG 30  68  68  ARG ARG A . n 
A 1 31  GLY 31  69  69  GLY GLY A . n 
A 1 32  GLN 32  70  70  GLN GLN A . n 
A 1 33  GLY 33  71  71  GLY GLY A . n 
A 1 34  VAL 34  72  72  VAL VAL A . n 
A 1 35  PRO 35  73  73  PRO PRO A . n 
A 1 36  ILE 36  74  74  ILE ILE A . n 
A 1 37  ASN 37  75  75  ASN ASN A . n 
A 1 38  THR 38  76  76  THR THR A . n 
A 1 39  ASN 39  77  77  ASN ASN A . n 
A 1 40  SER 40  78  78  SER SER A . n 
A 1 41  SER 41  79  79  SER SER A . n 
A 1 42  ARG 42  80  80  ARG ARG A . n 
A 1 43  ASP 43  81  81  ASP ASP A . n 
A 1 44  ASP 44  82  82  ASP ASP A . n 
A 1 45  GLN 45  83  83  GLN GLN A . n 
A 1 46  ILE 46  84  84  ILE ILE A . n 
A 1 47  GLY 47  85  85  GLY GLY A . n 
A 1 48  TYR 48  86  86  TYR TYR A . n 
A 1 49  TYR 49  87  87  TYR TYR A . n 
A 1 50  ARG 50  88  88  ARG ARG A . n 
A 1 51  ARG 51  89  89  ARG ARG A . n 
A 1 52  ALA 52  90  90  ALA ALA A . n 
A 1 53  THR 53  91  91  THR THR A . n 
A 1 54  ARG 54  92  92  ARG ARG A . n 
A 1 55  ARG 55  93  93  ARG ARG A . n 
A 1 56  ILE 56  94  ?   ?   ?   A . n 
A 1 57  ARG 57  95  ?   ?   ?   A . n 
A 1 58  GLY 58  96  ?   ?   ?   A . n 
A 1 59  GLY 59  97  ?   ?   ?   A . n 
A 1 60  ASP 60  98  ?   ?   ?   A . n 
A 1 61  GLY 61  99  ?   ?   ?   A . n 
A 1 62  LYS 62  100 ?   ?   ?   A . n 
A 1 63  MET 63  101 ?   ?   ?   A . n 
A 1 64  LYS 64  102 ?   ?   ?   A . n 
A 1 65  ASP 65  103 ?   ?   ?   A . n 
A 1 66  LEU 66  104 104 LEU LEU A . n 
A 1 67  SER 67  105 105 SER SER A . n 
A 1 68  PRO 68  106 106 PRO PRO A . n 
A 1 69  ARG 69  107 107 ARG ARG A . n 
A 1 70  TRP 70  108 108 TRP TRP A . n 
A 1 71  TYR 71  109 109 TYR TYR A . n 
A 1 72  PHE 72  110 110 PHE PHE A . n 
A 1 73  TYR 73  111 111 TYR TYR A . n 
A 1 74  TYR 74  112 112 TYR TYR A . n 
A 1 75  LEU 75  113 113 LEU LEU A . n 
A 1 76  GLY 76  114 114 GLY GLY A . n 
A 1 77  THR 77  115 115 THR THR A . n 
A 1 78  GLY 78  116 116 GLY GLY A . n 
A 1 79  PRO 79  117 117 PRO PRO A . n 
A 1 80  GLU 80  118 118 GLU GLU A . n 
A 1 81  ALA 81  119 119 ALA ALA A . n 
A 1 82  GLY 82  120 120 GLY GLY A . n 
A 1 83  LEU 83  121 121 LEU LEU A . n 
A 1 84  PRO 84  122 122 PRO PRO A . n 
A 1 85  TYR 85  123 123 TYR TYR A . n 
A 1 86  GLY 86  124 124 GLY GLY A . n 
A 1 87  ALA 87  125 125 ALA ALA A . n 
A 1 88  ASN 88  126 126 ASN ASN A . n 
A 1 89  LYS 89  127 127 LYS LYS A . n 
A 1 90  ASP 90  128 128 ASP ASP A . n 
A 1 91  GLY 91  129 129 GLY GLY A . n 
A 1 92  ILE 92  130 130 ILE ILE A . n 
A 1 93  ILE 93  131 131 ILE ILE A . n 
A 1 94  TRP 94  132 132 TRP TRP A . n 
A 1 95  VAL 95  133 133 VAL VAL A . n 
A 1 96  ALA 96  134 134 ALA ALA A . n 
A 1 97  THR 97  135 135 THR THR A . n 
A 1 98  GLU 98  136 136 GLU GLU A . n 
A 1 99  GLY 99  137 137 GLY GLY A . n 
A 1 100 ALA 100 138 138 ALA ALA A . n 
A 1 101 LEU 101 139 139 LEU LEU A . n 
A 1 102 ASN 102 140 140 ASN ASN A . n 
A 1 103 THR 103 141 141 THR THR A . n 
A 1 104 PRO 104 142 142 PRO PRO A . n 
A 1 105 LYS 105 143 143 LYS LYS A . n 
A 1 106 ASP 106 144 144 ASP ASP A . n 
A 1 107 HIS 107 145 145 HIS HIS A . n 
A 1 108 ILE 108 146 146 ILE ILE A . n 
A 1 109 GLY 109 147 147 GLY GLY A . n 
A 1 110 THR 110 148 148 THR THR A . n 
A 1 111 ARG 111 149 149 ARG ARG A . n 
A 1 112 ASN 112 150 150 ASN ASN A . n 
A 1 113 PRO 113 151 151 PRO PRO A . n 
A 1 114 ALA 114 152 152 ALA ALA A . n 
A 1 115 ASN 115 153 153 ASN ASN A . n 
A 1 116 ASN 116 154 154 ASN ASN A . n 
A 1 117 ALA 117 155 155 ALA ALA A . n 
A 1 118 ALA 118 156 156 ALA ALA A . n 
A 1 119 ILE 119 157 157 ILE ILE A . n 
A 1 120 VAL 120 158 158 VAL VAL A . n 
A 1 121 LEU 121 159 159 LEU LEU A . n 
A 1 122 GLN 122 160 160 GLN GLN A . n 
A 1 123 LEU 123 161 161 LEU LEU A . n 
A 1 124 PRO 124 162 162 PRO PRO A . n 
A 1 125 GLN 125 163 163 GLN GLN A . n 
A 1 126 GLY 126 164 164 GLY GLY A . n 
A 1 127 THR 127 165 165 THR THR A . n 
A 1 128 THR 128 166 166 THR THR A . n 
A 1 129 LEU 129 167 167 LEU LEU A . n 
A 1 130 PRO 130 168 168 PRO PRO A . n 
A 1 131 LYS 131 169 169 LYS LYS A . n 
A 1 132 GLY 132 170 170 GLY GLY A . n 
A 1 133 PHE 133 171 171 PHE PHE A . n 
A 1 134 TYR 134 172 172 TYR TYR A . n 
A 1 135 ALA 135 173 173 ALA ALA A . n 
A 1 136 GLU 136 174 174 GLU GLU A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        ZN 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   ZN 
_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 ZN  1  201 2  ZN  ZN  A . 
C 3 HOH 1  301 6  HOH HOH A . 
C 3 HOH 2  302 15 HOH HOH A . 
C 3 HOH 3  303 1  HOH HOH A . 
C 3 HOH 4  304 30 HOH HOH A . 
C 3 HOH 5  305 31 HOH HOH A . 
C 3 HOH 6  306 44 HOH HOH A . 
C 3 HOH 7  307 13 HOH HOH A . 
C 3 HOH 8  308 9  HOH HOH A . 
C 3 HOH 9  309 23 HOH HOH A . 
C 3 HOH 10 310 25 HOH HOH A . 
C 3 HOH 11 311 27 HOH HOH A . 
C 3 HOH 12 312 8  HOH HOH A . 
C 3 HOH 13 313 12 HOH HOH A . 
C 3 HOH 14 314 2  HOH HOH A . 
C 3 HOH 15 315 19 HOH HOH A . 
C 3 HOH 16 316 40 HOH HOH A . 
C 3 HOH 17 317 36 HOH HOH A . 
C 3 HOH 18 318 5  HOH HOH A . 
C 3 HOH 19 319 49 HOH HOH A . 
C 3 HOH 20 320 28 HOH HOH A . 
C 3 HOH 21 321 37 HOH HOH A . 
C 3 HOH 22 322 50 HOH HOH A . 
C 3 HOH 23 323 24 HOH HOH A . 
C 3 HOH 24 324 29 HOH HOH A . 
C 3 HOH 25 325 47 HOH HOH A . 
C 3 HOH 26 326 42 HOH HOH A . 
C 3 HOH 27 327 34 HOH HOH A . 
C 3 HOH 28 328 26 HOH HOH A . 
C 3 HOH 29 329 38 HOH HOH A . 
C 3 HOH 30 330 43 HOH HOH A . 
C 3 HOH 31 331 3  HOH HOH A . 
C 3 HOH 32 332 51 HOH HOH A . 
C 3 HOH 33 333 46 HOH HOH A . 
C 3 HOH 34 334 48 HOH HOH A . 
C 3 HOH 35 335 7  HOH HOH A . 
C 3 HOH 36 336 35 HOH HOH A . 
C 3 HOH 37 337 18 HOH HOH A . 
C 3 HOH 38 338 39 HOH HOH A . 
C 3 HOH 39 339 11 HOH HOH A . 
C 3 HOH 40 340 21 HOH HOH A . 
C 3 HOH 41 341 32 HOH HOH A . 
C 3 HOH 42 342 4  HOH HOH A . 
C 3 HOH 43 343 17 HOH HOH A . 
C 3 HOH 44 344 16 HOH HOH A . 
C 3 HOH 45 345 33 HOH HOH A . 
C 3 HOH 46 346 14 HOH HOH A . 
C 3 HOH 47 347 10 HOH HOH A . 
C 3 HOH 48 348 41 HOH HOH A . 
C 3 HOH 49 349 22 HOH HOH A . 
C 3 HOH 50 350 20 HOH HOH A . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? REFMAC    ? ? ? '5.8.0430 (refmacat 0.4.88)' 1  
? refinement       ? ? ? ? ? ? ? ? ? ? ? REFMAC    ? ? ? '5.8.0430 (refmacat 0.4.88)' 2  
? 'model building' ? ? ? ? ? ? ? ? ? ? ? Coot      ? ? ? 0.9.8.8                      3  
? 'model building' ? ? ? ? ? ? ? ? ? ? ? BUCCANEER ? ? ? 3.5.2                        4  
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? Aimless   ? ? ? 0.7.13                       5  
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? pointless ? ? ? 1.12.15                      6  
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? STARANISO ? ? ? 2.3.74                       7  
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? autoPROC  ? ? ? 1.1.7                        8  
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS       ? ? ? 'BUILT 20230630'             9  
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER    ? ? ? 2.8.3                        10 
# 
_cell.angle_alpha                  90 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9F7A 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     66.753 
_cell.length_a_esd                 ? 
_cell.length_b                     66.753 
_cell.length_b_esd                 ? 
_cell.length_c                     121.214 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        12 
_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                         9F7A 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                179 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 65 2 2' 
_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                   9F7A 
_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             2.61 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          52.96 
_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              9 
_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    
;22% PEG 3350
200mM Zinc Acetate dihydrate
;
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            285 
# 
_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 EIGER X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2024-04-30 
_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   0.97626 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.97626 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   'P13 (MX1)' 
_diffrn_source.pdbx_synchrotron_site       'PETRA III, EMBL c/o DESY' 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9F7A 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.9 
_reflns.d_resolution_low                               121.21 
_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                                     13269 
_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                           99.9 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                36.4 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          20.2 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               1 
_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                                   1 
_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                                    1.90 
_reflns_shell.d_res_low                                     1.94 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           0.3 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             815 
_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                              0.97 
_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                                  0.380 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          99.9 
_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]                            1.782 
_refine.aniso_B[1][2]                            0.891 
_refine.aniso_B[1][3]                            0.000 
_refine.aniso_B[2][2]                            1.782 
_refine.aniso_B[2][3]                            -0.000 
_refine.aniso_B[3][3]                            -5.782 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               77.817 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.946 
_refine.correlation_coeff_Fo_to_Fc_free          0.919 
_refine.details                                  'Hydrogens have been added in their riding positions' 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9F7A 
_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                            1.900 
_refine.ls_d_res_low                             57.810 
_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                     13209 
_refine.ls_number_reflns_R_free                  692 
_refine.ls_number_reflns_R_work                  12517 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.909 
_refine.ls_percent_reflns_R_free                 5.239 
_refine.ls_R_factor_all                          0.281 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.3477 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2770 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'MASK BULK SOLVENT' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.180 
_refine.pdbx_overall_ESU_R_Free                  0.187 
_refine.pdbx_solvent_vdw_probe_radii             1.100 
_refine.pdbx_solvent_ion_probe_radii             0.700 
_refine.pdbx_solvent_shrinkage_radii             0.700 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             10.779 
_refine.overall_SU_ML                            0.277 
_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                       1.900 
_refine_hist.d_res_low                        57.810 
_refine_hist.number_atoms_solvent             50 
_refine_hist.number_atoms_total               972 
_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        921 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         1 
_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' ? 0.010  0.012  949  ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.003  0.016  870  ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.782  1.813  1292 ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 0.721  1.767  1994 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 8.529  5.000  115  ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 14.176 5.000  8    ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 13.539 10.000 139  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 14.192 10.000 46   ? r_dihedral_angle_6_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.078  0.200  133  ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.009  0.020  1164 ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.002  0.020  242  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.186  0.200  158  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.156  0.200  729  ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.167  0.200  444  ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.077  0.200  496  ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.150  0.200  41   ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.321  0.200  12   ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.126  0.200  20   ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.171  0.200  3    ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 7.327  7.468  466  ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 7.325  7.469  466  ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 10.168 13.399 579  ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 10.162 13.406 580  ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 7.361  7.976  483  ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 7.276  7.956  481  ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 10.108 14.390 713  ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 10.101 14.396 714  ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 13.172 68.292 1020 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 13.273 68.310 1015 ? r_lrange_other                 ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.900 1.949  941 . 55 885 99.8937  . 0.522 . . 0.521 . . . . . 0.509 . 20 . 0.775 0.769 0.548 
'X-RAY DIFFRACTION' 1.949 2.003  919 . 56 861 99.7824  . 0.492 . . 0.493 . . . . . 0.473 . 20 . 0.773 0.733 0.482 
'X-RAY DIFFRACTION' 2.003 2.061  898 . 61 835 99.7773  . 0.455 . . 0.453 . . . . . 0.420 . 20 . 0.800 0.792 0.478 
'X-RAY DIFFRACTION' 2.061 2.124  888 . 45 843 100.0000 . 0.407 . . 0.400 . . . . . 0.362 . 20 . 0.840 0.787 0.573 
'X-RAY DIFFRACTION' 2.124 2.194  842 . 42 799 99.8812  . 0.411 . . 0.410 . . . . . 0.379 . 20 . 0.858 0.865 0.425 
'X-RAY DIFFRACTION' 2.194 2.270  829 . 47 781 99.8794  . 0.372 . . 0.376 . . . . . 0.337 . 20 . 0.878 0.910 0.316 
'X-RAY DIFFRACTION' 2.270 2.356  799 . 43 756 100.0000 . 0.387 . . 0.383 . . . . . 0.351 . 20 . 0.883 0.804 0.462 
'X-RAY DIFFRACTION' 2.356 2.452  766 . 36 728 99.7389  . 0.342 . . 0.341 . . . . . 0.299 . 20 . 0.915 0.888 0.356 
'X-RAY DIFFRACTION' 2.452 2.561  752 . 34 718 100.0000 . 0.338 . . 0.329 . . . . . 0.287 . 20 . 0.931 0.860 0.510 
'X-RAY DIFFRACTION' 2.561 2.686  712 . 30 682 100.0000 . 0.340 . . 0.337 . . . . . 0.299 . 20 . 0.923 0.903 0.395 
'X-RAY DIFFRACTION' 2.686 2.831  682 . 27 655 100.0000 . 0.353 . . 0.352 . . . . . 0.315 . 20 . 0.913 0.886 0.384 
'X-RAY DIFFRACTION' 2.831 3.002  650 . 33 616 99.8462  . 0.319 . . 0.317 . . . . . 0.277 . 20 . 0.926 0.933 0.348 
'X-RAY DIFFRACTION' 3.002 3.208  613 . 34 579 100.0000 . 0.318 . . 0.310 . . . . . 0.291 . 20 . 0.933 0.846 0.468 
'X-RAY DIFFRACTION' 3.208 3.465  574 . 23 551 100.0000 . 0.297 . . 0.294 . . . . . 0.285 . 20 . 0.945 0.904 0.377 
'X-RAY DIFFRACTION' 3.465 3.794  529 . 29 500 100.0000 . 0.274 . . 0.272 . . . . . 0.272 . 20 . 0.955 0.934 0.298 
'X-RAY DIFFRACTION' 3.794 4.239  490 . 15 475 100.0000 . 0.235 . . 0.235 . . . . . 0.241 . 20 . 0.965 0.972 0.238 
'X-RAY DIFFRACTION' 4.239 4.891  442 . 24 418 100.0000 . 0.212 . . 0.205 . . . . . 0.213 . 20 . 0.971 0.943 0.339 
'X-RAY DIFFRACTION' 4.891 5.979  385 . 26 359 100.0000 . 0.211 . . 0.201 . . . . . 0.218 . 20 . 0.975 0.944 0.347 
'X-RAY DIFFRACTION' 5.979 8.411  311 . 21 290 100.0000 . 0.222 . . 0.218 . . . . . 0.235 . 20 . 0.963 0.969 0.273 
'X-RAY DIFFRACTION' 8.411 57.810 199 . 11 186 98.9950  . 0.288 . . 0.286 . . . . . 0.330 . 20 . 0.932 0.926 0.312 
# 
_struct.entry_id                     9F7A 
_struct.title                        'SARS-CoV-2 Nucleocapsid N-terminal domain (NTD) mutant P80R' 
_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        9F7A 
_struct_keywords.text            'SARS-CoV-2, Nucelocapsid, N-terminal domain, Gamma variant, VIRAL PROTEIN' 
_struct_keywords.pdbx_keywords   'VIRAL PROTEIN' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    NCAP_SARS2 
_struct_ref.pdbx_db_accession          P0DTC9 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;RPQGLPNNTASWFTALTQHGKEDLKFPRGQGVPINTNSSPDDQIGYYRRATRRIRGGDGKMKDLSPRWYFYYLGTGPEAG
LPYGANKDGIIWVATEGALNTPKDHIGTRNPANNAAIVLQLPQGTTLPKGFYAE
;
_struct_ref.pdbx_align_begin           41 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9F7A 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 3 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 136 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P0DTC9 
_struct_ref_seq.db_align_beg                  41 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  174 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       41 
_struct_ref_seq.pdbx_auth_seq_align_end       174 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 9F7A GLY A 1  ? UNP P0DTC9 ?   ?  'expression tag' 39 1 
1 9F7A SER A 2  ? UNP P0DTC9 ?   ?  'expression tag' 40 2 
1 9F7A ARG A 42 ? UNP P0DTC9 PRO 80 variant          80 3 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 80   ? 
1 MORE         -25  ? 
1 'SSA (A^2)'  7270 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
_struct_conf.conf_type_id            HELX_P 
_struct_conf.id                      HELX_P1 
_struct_conf.pdbx_PDB_helix_id       AA1 
_struct_conf.beg_label_comp_id       SER 
_struct_conf.beg_label_asym_id       A 
_struct_conf.beg_label_seq_id        41 
_struct_conf.pdbx_beg_PDB_ins_code   ? 
_struct_conf.end_label_comp_id       ASP 
_struct_conf.end_label_asym_id       A 
_struct_conf.end_label_seq_id        44 
_struct_conf.pdbx_end_PDB_ins_code   ? 
_struct_conf.beg_auth_comp_id        SER 
_struct_conf.beg_auth_asym_id        A 
_struct_conf.beg_auth_seq_id         79 
_struct_conf.end_auth_comp_id        ASP 
_struct_conf.end_auth_asym_id        A 
_struct_conf.end_auth_seq_id         82 
_struct_conf.pdbx_PDB_helix_class    5 
_struct_conf.details                 ? 
_struct_conf.pdbx_PDB_helix_length   4 
# 
_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 
metalc1 metalc ? ? A ASP 43  OD1 ? ? ? 1_555 B ZN . ZN ? ? A ASP 81  A ZN 201 9_555 ? ? ? ? ? ? ? 2.575 ? ? 
metalc2 metalc ? ? A ASP 43  OD2 ? ? ? 1_555 B ZN . ZN ? ? A ASP 81  A ZN 201 9_555 ? ? ? ? ? ? ? 2.328 ? ? 
metalc3 metalc ? ? A ASP 44  OD2 ? ? ? 1_555 B ZN . ZN ? ? A ASP 82  A ZN 201 1_555 ? ? ? ? ? ? ? 1.832 ? ? 
metalc4 metalc ? ? A HIS 107 NE2 ? ? ? 1_555 B ZN . ZN ? ? A HIS 145 A ZN 201 1_555 ? ? ? ? ? ? ? 1.990 ? ? 
# 
_struct_conn_type.id          metalc 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1 OD1 ? A ASP 43 ? A ASP 81 ? 1_555 ZN ? B ZN . ? A ZN 201 ? 9_555 OD2 ? A ASP 43  ? A ASP 81  ? 1_555 53.1 ? 
2 OD1 ? A ASP 43 ? A ASP 81 ? 1_555 ZN ? B ZN . ? A ZN 201 ? 9_555 OD2 ? A ASP 44  ? A ASP 82  ? 1_555 52.5 ? 
3 OD2 ? A ASP 43 ? A ASP 81 ? 1_555 ZN ? B ZN . ? A ZN 201 ? 9_555 OD2 ? A ASP 44  ? A ASP 82  ? 1_555 5.1  ? 
4 OD1 ? A ASP 43 ? A ASP 81 ? 1_555 ZN ? B ZN . ? A ZN 201 ? 9_555 NE2 ? A HIS 107 ? A HIS 145 ? 1_555 65.3 ? 
5 OD2 ? A ASP 43 ? A ASP 81 ? 1_555 ZN ? B ZN . ? A ZN 201 ? 9_555 NE2 ? A HIS 107 ? A HIS 145 ? 1_555 14.0 ? 
6 OD2 ? A ASP 44 ? A ASP 82 ? 1_555 ZN ? B ZN . ? A ZN 201 ? 9_555 NE2 ? A HIS 107 ? A HIS 145 ? 1_555 17.6 ? 
# 
_struct_sheet.id               AA1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   5 
_struct_sheet.details          ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
# 
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 ILE A 92  ? ALA A 96  ? ILE A 130 ALA A 134 
AA1 2 ILE A 46  ? ARG A 51  ? ILE A 84  ARG A 89  
AA1 3 ARG A 69  ? TYR A 74  ? ARG A 107 TYR A 112 
AA1 4 LEU A 18  ? GLN A 20  ? LEU A 56  GLN A 58  
AA1 5 PHE A 133 ? TYR A 134 ? PHE A 171 TYR A 172 
# 
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 VAL A 95 ? O VAL A 133 N GLY A 47  ? N GLY A 85  
AA1 2 3 N TYR A 48 ? N TYR A 86  O TYR A 73  ? O TYR A 111 
AA1 3 4 O TRP A 70 ? O TRP A 108 N LEU A 18  ? N LEU A 56  
AA1 4 5 N THR A 19 ? N THR A 57  O TYR A 134 ? O TYR A 172 
# 
_pdbx_entry_details.entry_id                   9F7A 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   N 
# 
_pdbx_validate_symm_contact.id                1 
_pdbx_validate_symm_contact.PDB_model_num     1 
_pdbx_validate_symm_contact.auth_atom_id_1    NE2 
_pdbx_validate_symm_contact.auth_asym_id_1    A 
_pdbx_validate_symm_contact.auth_comp_id_1    HIS 
_pdbx_validate_symm_contact.auth_seq_id_1     59 
_pdbx_validate_symm_contact.PDB_ins_code_1    ? 
_pdbx_validate_symm_contact.label_alt_id_1    ? 
_pdbx_validate_symm_contact.site_symmetry_1   1_555 
_pdbx_validate_symm_contact.auth_atom_id_2    NE2 
_pdbx_validate_symm_contact.auth_asym_id_2    A 
_pdbx_validate_symm_contact.auth_comp_id_2    HIS 
_pdbx_validate_symm_contact.auth_seq_id_2     59 
_pdbx_validate_symm_contact.PDB_ins_code_2    ? 
_pdbx_validate_symm_contact.label_alt_id_2    ? 
_pdbx_validate_symm_contact.site_symmetry_2   12_544 
_pdbx_validate_symm_contact.dist              2.10 
# 
loop_
_pdbx_validate_rmsd_angle.id 
_pdbx_validate_rmsd_angle.PDB_model_num 
_pdbx_validate_rmsd_angle.auth_atom_id_1 
_pdbx_validate_rmsd_angle.auth_asym_id_1 
_pdbx_validate_rmsd_angle.auth_comp_id_1 
_pdbx_validate_rmsd_angle.auth_seq_id_1 
_pdbx_validate_rmsd_angle.PDB_ins_code_1 
_pdbx_validate_rmsd_angle.label_alt_id_1 
_pdbx_validate_rmsd_angle.auth_atom_id_2 
_pdbx_validate_rmsd_angle.auth_asym_id_2 
_pdbx_validate_rmsd_angle.auth_comp_id_2 
_pdbx_validate_rmsd_angle.auth_seq_id_2 
_pdbx_validate_rmsd_angle.PDB_ins_code_2 
_pdbx_validate_rmsd_angle.label_alt_id_2 
_pdbx_validate_rmsd_angle.auth_atom_id_3 
_pdbx_validate_rmsd_angle.auth_asym_id_3 
_pdbx_validate_rmsd_angle.auth_comp_id_3 
_pdbx_validate_rmsd_angle.auth_seq_id_3 
_pdbx_validate_rmsd_angle.PDB_ins_code_3 
_pdbx_validate_rmsd_angle.label_alt_id_3 
_pdbx_validate_rmsd_angle.angle_value 
_pdbx_validate_rmsd_angle.angle_target_value 
_pdbx_validate_rmsd_angle.angle_deviation 
_pdbx_validate_rmsd_angle.angle_standard_deviation 
_pdbx_validate_rmsd_angle.linker_flag 
1 1 CA A HIS 59 ? ? CB A HIS 59 ? ? CG  A HIS 59 ? ? 123.87 113.60 10.27 1.70 N 
2 1 NE A ARG 80 ? ? CZ A ARG 80 ? ? NH1 A ARG 80 ? ? 116.34 120.30 -3.96 0.50 N 
3 1 NE A ARG 80 ? ? CZ A ARG 80 ? ? NH2 A ARG 80 ? ? 123.64 120.30 3.34  0.50 N 
# 
_pdbx_validate_torsion.id              1 
_pdbx_validate_torsion.PDB_model_num   1 
_pdbx_validate_torsion.auth_comp_id    PRO 
_pdbx_validate_torsion.auth_asym_id    A 
_pdbx_validate_torsion.auth_seq_id     67 
_pdbx_validate_torsion.PDB_ins_code    ? 
_pdbx_validate_torsion.label_alt_id    ? 
_pdbx_validate_torsion.phi             -49.43 
_pdbx_validate_torsion.psi             152.91 
# 
_pdbx_validate_planes.id              1 
_pdbx_validate_planes.PDB_model_num   1 
_pdbx_validate_planes.auth_comp_id    ARG 
_pdbx_validate_planes.auth_asym_id    A 
_pdbx_validate_planes.auth_seq_id     80 
_pdbx_validate_planes.PDB_ins_code    ? 
_pdbx_validate_planes.label_alt_id    ? 
_pdbx_validate_planes.rmsd            0.208 
_pdbx_validate_planes.type            'SIDE CHAIN' 
# 
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 GLY 39  ? A GLY 1  
2  1 Y 1 A SER 40  ? A SER 2  
3  1 Y 1 A ARG 41  ? A ARG 3  
4  1 Y 1 A PRO 42  ? A PRO 4  
5  1 Y 1 A GLN 43  ? A GLN 5  
6  1 Y 1 A GLY 44  ? A GLY 6  
7  1 Y 1 A LEU 45  ? A LEU 7  
8  1 Y 1 A PRO 46  ? A PRO 8  
9  1 Y 1 A ASN 47  ? A ASN 9  
10 1 Y 1 A ILE 94  ? A ILE 56 
11 1 Y 1 A ARG 95  ? A ARG 57 
12 1 Y 1 A GLY 96  ? A GLY 58 
13 1 Y 1 A GLY 97  ? A GLY 59 
14 1 Y 1 A ASP 98  ? A ASP 60 
15 1 Y 1 A GLY 99  ? A GLY 61 
16 1 Y 1 A LYS 100 ? A LYS 62 
17 1 Y 1 A MET 101 ? A MET 63 
18 1 Y 1 A LYS 102 ? A LYS 64 
19 1 Y 1 A ASP 103 ? A ASP 65 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N  N N 1   
ALA CA   C  N S 2   
ALA C    C  N N 3   
ALA O    O  N N 4   
ALA CB   C  N N 5   
ALA OXT  O  N N 6   
ALA H    H  N N 7   
ALA H2   H  N N 8   
ALA HA   H  N N 9   
ALA HB1  H  N N 10  
ALA HB2  H  N N 11  
ALA HB3  H  N N 12  
ALA HXT  H  N N 13  
ARG N    N  N N 14  
ARG CA   C  N S 15  
ARG C    C  N N 16  
ARG O    O  N N 17  
ARG CB   C  N N 18  
ARG CG   C  N N 19  
ARG CD   C  N N 20  
ARG NE   N  N N 21  
ARG CZ   C  N N 22  
ARG NH1  N  N N 23  
ARG NH2  N  N N 24  
ARG OXT  O  N N 25  
ARG H    H  N N 26  
ARG H2   H  N N 27  
ARG HA   H  N N 28  
ARG HB2  H  N N 29  
ARG HB3  H  N N 30  
ARG HG2  H  N N 31  
ARG HG3  H  N N 32  
ARG HD2  H  N N 33  
ARG HD3  H  N N 34  
ARG HE   H  N N 35  
ARG HH11 H  N N 36  
ARG HH12 H  N N 37  
ARG HH21 H  N N 38  
ARG HH22 H  N N 39  
ARG HXT  H  N N 40  
ASN N    N  N N 41  
ASN CA   C  N S 42  
ASN C    C  N N 43  
ASN O    O  N N 44  
ASN CB   C  N N 45  
ASN CG   C  N N 46  
ASN OD1  O  N N 47  
ASN ND2  N  N N 48  
ASN OXT  O  N N 49  
ASN H    H  N N 50  
ASN H2   H  N N 51  
ASN HA   H  N N 52  
ASN HB2  H  N N 53  
ASN HB3  H  N N 54  
ASN HD21 H  N N 55  
ASN HD22 H  N N 56  
ASN HXT  H  N N 57  
ASP N    N  N N 58  
ASP CA   C  N S 59  
ASP C    C  N N 60  
ASP O    O  N N 61  
ASP CB   C  N N 62  
ASP CG   C  N N 63  
ASP OD1  O  N N 64  
ASP OD2  O  N N 65  
ASP OXT  O  N N 66  
ASP H    H  N N 67  
ASP H2   H  N N 68  
ASP HA   H  N N 69  
ASP HB2  H  N N 70  
ASP HB3  H  N N 71  
ASP HD2  H  N N 72  
ASP HXT  H  N N 73  
GLN N    N  N N 74  
GLN CA   C  N S 75  
GLN C    C  N N 76  
GLN O    O  N N 77  
GLN CB   C  N N 78  
GLN CG   C  N N 79  
GLN CD   C  N N 80  
GLN OE1  O  N N 81  
GLN NE2  N  N N 82  
GLN OXT  O  N N 83  
GLN H    H  N N 84  
GLN H2   H  N N 85  
GLN HA   H  N N 86  
GLN HB2  H  N N 87  
GLN HB3  H  N N 88  
GLN HG2  H  N N 89  
GLN HG3  H  N N 90  
GLN HE21 H  N N 91  
GLN HE22 H  N N 92  
GLN HXT  H  N N 93  
GLU N    N  N N 94  
GLU CA   C  N S 95  
GLU C    C  N N 96  
GLU O    O  N N 97  
GLU CB   C  N N 98  
GLU CG   C  N N 99  
GLU CD   C  N N 100 
GLU OE1  O  N N 101 
GLU OE2  O  N N 102 
GLU OXT  O  N N 103 
GLU H    H  N N 104 
GLU H2   H  N N 105 
GLU HA   H  N N 106 
GLU HB2  H  N N 107 
GLU HB3  H  N N 108 
GLU HG2  H  N N 109 
GLU HG3  H  N N 110 
GLU HE2  H  N N 111 
GLU HXT  H  N N 112 
GLY N    N  N N 113 
GLY CA   C  N N 114 
GLY C    C  N N 115 
GLY O    O  N N 116 
GLY OXT  O  N N 117 
GLY H    H  N N 118 
GLY H2   H  N N 119 
GLY HA2  H  N N 120 
GLY HA3  H  N N 121 
GLY HXT  H  N N 122 
HIS N    N  N N 123 
HIS CA   C  N S 124 
HIS C    C  N N 125 
HIS O    O  N N 126 
HIS CB   C  N N 127 
HIS CG   C  Y N 128 
HIS ND1  N  Y N 129 
HIS CD2  C  Y N 130 
HIS CE1  C  Y N 131 
HIS NE2  N  Y N 132 
HIS OXT  O  N N 133 
HIS H    H  N N 134 
HIS H2   H  N N 135 
HIS HA   H  N N 136 
HIS HB2  H  N N 137 
HIS HB3  H  N N 138 
HIS HD1  H  N N 139 
HIS HD2  H  N N 140 
HIS HE1  H  N N 141 
HIS HE2  H  N N 142 
HIS HXT  H  N N 143 
HOH O    O  N N 144 
HOH H1   H  N N 145 
HOH H2   H  N N 146 
ILE N    N  N N 147 
ILE CA   C  N S 148 
ILE C    C  N N 149 
ILE O    O  N N 150 
ILE CB   C  N S 151 
ILE CG1  C  N N 152 
ILE CG2  C  N N 153 
ILE CD1  C  N N 154 
ILE OXT  O  N N 155 
ILE H    H  N N 156 
ILE H2   H  N N 157 
ILE HA   H  N N 158 
ILE HB   H  N N 159 
ILE HG12 H  N N 160 
ILE HG13 H  N N 161 
ILE HG21 H  N N 162 
ILE HG22 H  N N 163 
ILE HG23 H  N N 164 
ILE HD11 H  N N 165 
ILE HD12 H  N N 166 
ILE HD13 H  N N 167 
ILE HXT  H  N N 168 
LEU N    N  N N 169 
LEU CA   C  N S 170 
LEU C    C  N N 171 
LEU O    O  N N 172 
LEU CB   C  N N 173 
LEU CG   C  N N 174 
LEU CD1  C  N N 175 
LEU CD2  C  N N 176 
LEU OXT  O  N N 177 
LEU H    H  N N 178 
LEU H2   H  N N 179 
LEU HA   H  N N 180 
LEU HB2  H  N N 181 
LEU HB3  H  N N 182 
LEU HG   H  N N 183 
LEU HD11 H  N N 184 
LEU HD12 H  N N 185 
LEU HD13 H  N N 186 
LEU HD21 H  N N 187 
LEU HD22 H  N N 188 
LEU HD23 H  N N 189 
LEU HXT  H  N N 190 
LYS N    N  N N 191 
LYS CA   C  N S 192 
LYS C    C  N N 193 
LYS O    O  N N 194 
LYS CB   C  N N 195 
LYS CG   C  N N 196 
LYS CD   C  N N 197 
LYS CE   C  N N 198 
LYS NZ   N  N N 199 
LYS OXT  O  N N 200 
LYS H    H  N N 201 
LYS H2   H  N N 202 
LYS HA   H  N N 203 
LYS HB2  H  N N 204 
LYS HB3  H  N N 205 
LYS HG2  H  N N 206 
LYS HG3  H  N N 207 
LYS HD2  H  N N 208 
LYS HD3  H  N N 209 
LYS HE2  H  N N 210 
LYS HE3  H  N N 211 
LYS HZ1  H  N N 212 
LYS HZ2  H  N N 213 
LYS HZ3  H  N N 214 
LYS HXT  H  N N 215 
MET N    N  N N 216 
MET CA   C  N S 217 
MET C    C  N N 218 
MET O    O  N N 219 
MET CB   C  N N 220 
MET CG   C  N N 221 
MET SD   S  N N 222 
MET CE   C  N N 223 
MET OXT  O  N N 224 
MET H    H  N N 225 
MET H2   H  N N 226 
MET HA   H  N N 227 
MET HB2  H  N N 228 
MET HB3  H  N N 229 
MET HG2  H  N N 230 
MET HG3  H  N N 231 
MET HE1  H  N N 232 
MET HE2  H  N N 233 
MET HE3  H  N N 234 
MET HXT  H  N N 235 
PHE N    N  N N 236 
PHE CA   C  N S 237 
PHE C    C  N N 238 
PHE O    O  N N 239 
PHE CB   C  N N 240 
PHE CG   C  Y N 241 
PHE CD1  C  Y N 242 
PHE CD2  C  Y N 243 
PHE CE1  C  Y N 244 
PHE CE2  C  Y N 245 
PHE CZ   C  Y N 246 
PHE OXT  O  N N 247 
PHE H    H  N N 248 
PHE H2   H  N N 249 
PHE HA   H  N N 250 
PHE HB2  H  N N 251 
PHE HB3  H  N N 252 
PHE HD1  H  N N 253 
PHE HD2  H  N N 254 
PHE HE1  H  N N 255 
PHE HE2  H  N N 256 
PHE HZ   H  N N 257 
PHE HXT  H  N N 258 
PRO N    N  N N 259 
PRO CA   C  N S 260 
PRO C    C  N N 261 
PRO O    O  N N 262 
PRO CB   C  N N 263 
PRO CG   C  N N 264 
PRO CD   C  N N 265 
PRO OXT  O  N N 266 
PRO H    H  N N 267 
PRO HA   H  N N 268 
PRO HB2  H  N N 269 
PRO HB3  H  N N 270 
PRO HG2  H  N N 271 
PRO HG3  H  N N 272 
PRO HD2  H  N N 273 
PRO HD3  H  N N 274 
PRO HXT  H  N N 275 
SER N    N  N N 276 
SER CA   C  N S 277 
SER C    C  N N 278 
SER O    O  N N 279 
SER CB   C  N N 280 
SER OG   O  N N 281 
SER OXT  O  N N 282 
SER H    H  N N 283 
SER H2   H  N N 284 
SER HA   H  N N 285 
SER HB2  H  N N 286 
SER HB3  H  N N 287 
SER HG   H  N N 288 
SER HXT  H  N N 289 
THR N    N  N N 290 
THR CA   C  N S 291 
THR C    C  N N 292 
THR O    O  N N 293 
THR CB   C  N R 294 
THR OG1  O  N N 295 
THR CG2  C  N N 296 
THR OXT  O  N N 297 
THR H    H  N N 298 
THR H2   H  N N 299 
THR HA   H  N N 300 
THR HB   H  N N 301 
THR HG1  H  N N 302 
THR HG21 H  N N 303 
THR HG22 H  N N 304 
THR HG23 H  N N 305 
THR HXT  H  N N 306 
TRP N    N  N N 307 
TRP CA   C  N S 308 
TRP C    C  N N 309 
TRP O    O  N N 310 
TRP CB   C  N N 311 
TRP CG   C  Y N 312 
TRP CD1  C  Y N 313 
TRP CD2  C  Y N 314 
TRP NE1  N  Y N 315 
TRP CE2  C  Y N 316 
TRP CE3  C  Y N 317 
TRP CZ2  C  Y N 318 
TRP CZ3  C  Y N 319 
TRP CH2  C  Y N 320 
TRP OXT  O  N N 321 
TRP H    H  N N 322 
TRP H2   H  N N 323 
TRP HA   H  N N 324 
TRP HB2  H  N N 325 
TRP HB3  H  N N 326 
TRP HD1  H  N N 327 
TRP HE1  H  N N 328 
TRP HE3  H  N N 329 
TRP HZ2  H  N N 330 
TRP HZ3  H  N N 331 
TRP HH2  H  N N 332 
TRP HXT  H  N N 333 
TYR N    N  N N 334 
TYR CA   C  N S 335 
TYR C    C  N N 336 
TYR O    O  N N 337 
TYR CB   C  N N 338 
TYR CG   C  Y N 339 
TYR CD1  C  Y N 340 
TYR CD2  C  Y N 341 
TYR CE1  C  Y N 342 
TYR CE2  C  Y N 343 
TYR CZ   C  Y N 344 
TYR OH   O  N N 345 
TYR OXT  O  N N 346 
TYR H    H  N N 347 
TYR H2   H  N N 348 
TYR HA   H  N N 349 
TYR HB2  H  N N 350 
TYR HB3  H  N N 351 
TYR HD1  H  N N 352 
TYR HD2  H  N N 353 
TYR HE1  H  N N 354 
TYR HE2  H  N N 355 
TYR HH   H  N N 356 
TYR HXT  H  N N 357 
VAL N    N  N N 358 
VAL CA   C  N S 359 
VAL C    C  N N 360 
VAL O    O  N N 361 
VAL CB   C  N N 362 
VAL CG1  C  N N 363 
VAL CG2  C  N N 364 
VAL OXT  O  N N 365 
VAL H    H  N N 366 
VAL H2   H  N N 367 
VAL HA   H  N N 368 
VAL HB   H  N N 369 
VAL HG11 H  N N 370 
VAL HG12 H  N N 371 
VAL HG13 H  N N 372 
VAL HG21 H  N N 373 
VAL HG22 H  N N 374 
VAL HG23 H  N N 375 
VAL HXT  H  N N 376 
ZN  ZN   ZN N N 377 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
GLN N   CA   sing N N 70  
GLN N   H    sing N N 71  
GLN N   H2   sing N N 72  
GLN CA  C    sing N N 73  
GLN CA  CB   sing N N 74  
GLN CA  HA   sing N N 75  
GLN C   O    doub N N 76  
GLN C   OXT  sing N N 77  
GLN CB  CG   sing N N 78  
GLN CB  HB2  sing N N 79  
GLN CB  HB3  sing N N 80  
GLN CG  CD   sing N N 81  
GLN CG  HG2  sing N N 82  
GLN CG  HG3  sing N N 83  
GLN CD  OE1  doub N N 84  
GLN CD  NE2  sing N N 85  
GLN NE2 HE21 sing N N 86  
GLN NE2 HE22 sing N N 87  
GLN OXT HXT  sing N N 88  
GLU N   CA   sing N N 89  
GLU N   H    sing N N 90  
GLU N   H2   sing N N 91  
GLU CA  C    sing N N 92  
GLU CA  CB   sing N N 93  
GLU CA  HA   sing N N 94  
GLU C   O    doub N N 95  
GLU C   OXT  sing N N 96  
GLU CB  CG   sing N N 97  
GLU CB  HB2  sing N N 98  
GLU CB  HB3  sing N N 99  
GLU CG  CD   sing N N 100 
GLU CG  HG2  sing N N 101 
GLU CG  HG3  sing N N 102 
GLU CD  OE1  doub N N 103 
GLU CD  OE2  sing N N 104 
GLU OE2 HE2  sing N N 105 
GLU OXT HXT  sing N N 106 
GLY N   CA   sing N N 107 
GLY N   H    sing N N 108 
GLY N   H2   sing N N 109 
GLY CA  C    sing N N 110 
GLY CA  HA2  sing N N 111 
GLY CA  HA3  sing N N 112 
GLY C   O    doub N N 113 
GLY C   OXT  sing N N 114 
GLY OXT HXT  sing N N 115 
HIS N   CA   sing N N 116 
HIS N   H    sing N N 117 
HIS N   H2   sing N N 118 
HIS CA  C    sing N N 119 
HIS CA  CB   sing N N 120 
HIS CA  HA   sing N N 121 
HIS C   O    doub N N 122 
HIS C   OXT  sing N N 123 
HIS CB  CG   sing N N 124 
HIS CB  HB2  sing N N 125 
HIS CB  HB3  sing N N 126 
HIS CG  ND1  sing Y N 127 
HIS CG  CD2  doub Y N 128 
HIS ND1 CE1  doub Y N 129 
HIS ND1 HD1  sing N N 130 
HIS CD2 NE2  sing Y N 131 
HIS CD2 HD2  sing N N 132 
HIS CE1 NE2  sing Y N 133 
HIS CE1 HE1  sing N N 134 
HIS NE2 HE2  sing N N 135 
HIS OXT HXT  sing N N 136 
HOH O   H1   sing N N 137 
HOH O   H2   sing N N 138 
ILE N   CA   sing N N 139 
ILE N   H    sing N N 140 
ILE N   H2   sing N N 141 
ILE CA  C    sing N N 142 
ILE CA  CB   sing N N 143 
ILE CA  HA   sing N N 144 
ILE C   O    doub N N 145 
ILE C   OXT  sing N N 146 
ILE CB  CG1  sing N N 147 
ILE CB  CG2  sing N N 148 
ILE CB  HB   sing N N 149 
ILE CG1 CD1  sing N N 150 
ILE CG1 HG12 sing N N 151 
ILE CG1 HG13 sing N N 152 
ILE CG2 HG21 sing N N 153 
ILE CG2 HG22 sing N N 154 
ILE CG2 HG23 sing N N 155 
ILE CD1 HD11 sing N N 156 
ILE CD1 HD12 sing N N 157 
ILE CD1 HD13 sing N N 158 
ILE OXT HXT  sing N N 159 
LEU N   CA   sing N N 160 
LEU N   H    sing N N 161 
LEU N   H2   sing N N 162 
LEU CA  C    sing N N 163 
LEU CA  CB   sing N N 164 
LEU CA  HA   sing N N 165 
LEU C   O    doub N N 166 
LEU C   OXT  sing N N 167 
LEU CB  CG   sing N N 168 
LEU CB  HB2  sing N N 169 
LEU CB  HB3  sing N N 170 
LEU CG  CD1  sing N N 171 
LEU CG  CD2  sing N N 172 
LEU CG  HG   sing N N 173 
LEU CD1 HD11 sing N N 174 
LEU CD1 HD12 sing N N 175 
LEU CD1 HD13 sing N N 176 
LEU CD2 HD21 sing N N 177 
LEU CD2 HD22 sing N N 178 
LEU CD2 HD23 sing N N 179 
LEU OXT HXT  sing N N 180 
LYS N   CA   sing N N 181 
LYS N   H    sing N N 182 
LYS N   H2   sing N N 183 
LYS CA  C    sing N N 184 
LYS CA  CB   sing N N 185 
LYS CA  HA   sing N N 186 
LYS C   O    doub N N 187 
LYS C   OXT  sing N N 188 
LYS CB  CG   sing N N 189 
LYS CB  HB2  sing N N 190 
LYS CB  HB3  sing N N 191 
LYS CG  CD   sing N N 192 
LYS CG  HG2  sing N N 193 
LYS CG  HG3  sing N N 194 
LYS CD  CE   sing N N 195 
LYS CD  HD2  sing N N 196 
LYS CD  HD3  sing N N 197 
LYS CE  NZ   sing N N 198 
LYS CE  HE2  sing N N 199 
LYS CE  HE3  sing N N 200 
LYS NZ  HZ1  sing N N 201 
LYS NZ  HZ2  sing N N 202 
LYS NZ  HZ3  sing N N 203 
LYS OXT HXT  sing N N 204 
MET N   CA   sing N N 205 
MET N   H    sing N N 206 
MET N   H2   sing N N 207 
MET CA  C    sing N N 208 
MET CA  CB   sing N N 209 
MET CA  HA   sing N N 210 
MET C   O    doub N N 211 
MET C   OXT  sing N N 212 
MET CB  CG   sing N N 213 
MET CB  HB2  sing N N 214 
MET CB  HB3  sing N N 215 
MET CG  SD   sing N N 216 
MET CG  HG2  sing N N 217 
MET CG  HG3  sing N N 218 
MET SD  CE   sing N N 219 
MET CE  HE1  sing N N 220 
MET CE  HE2  sing N N 221 
MET CE  HE3  sing N N 222 
MET OXT HXT  sing N N 223 
PHE N   CA   sing N N 224 
PHE N   H    sing N N 225 
PHE N   H2   sing N N 226 
PHE CA  C    sing N N 227 
PHE CA  CB   sing N N 228 
PHE CA  HA   sing N N 229 
PHE C   O    doub N N 230 
PHE C   OXT  sing N N 231 
PHE CB  CG   sing N N 232 
PHE CB  HB2  sing N N 233 
PHE CB  HB3  sing N N 234 
PHE CG  CD1  doub Y N 235 
PHE CG  CD2  sing Y N 236 
PHE CD1 CE1  sing Y N 237 
PHE CD1 HD1  sing N N 238 
PHE CD2 CE2  doub Y N 239 
PHE CD2 HD2  sing N N 240 
PHE CE1 CZ   doub Y N 241 
PHE CE1 HE1  sing N N 242 
PHE CE2 CZ   sing Y N 243 
PHE CE2 HE2  sing N N 244 
PHE CZ  HZ   sing N N 245 
PHE OXT HXT  sing N N 246 
PRO N   CA   sing N N 247 
PRO N   CD   sing N N 248 
PRO N   H    sing N N 249 
PRO CA  C    sing N N 250 
PRO CA  CB   sing N N 251 
PRO CA  HA   sing N N 252 
PRO C   O    doub N N 253 
PRO C   OXT  sing N N 254 
PRO CB  CG   sing N N 255 
PRO CB  HB2  sing N N 256 
PRO CB  HB3  sing N N 257 
PRO CG  CD   sing N N 258 
PRO CG  HG2  sing N N 259 
PRO CG  HG3  sing N N 260 
PRO CD  HD2  sing N N 261 
PRO CD  HD3  sing N N 262 
PRO OXT HXT  sing N N 263 
SER N   CA   sing N N 264 
SER N   H    sing N N 265 
SER N   H2   sing N N 266 
SER CA  C    sing N N 267 
SER CA  CB   sing N N 268 
SER CA  HA   sing N N 269 
SER C   O    doub N N 270 
SER C   OXT  sing N N 271 
SER CB  OG   sing N N 272 
SER CB  HB2  sing N N 273 
SER CB  HB3  sing N N 274 
SER OG  HG   sing N N 275 
SER OXT HXT  sing N N 276 
THR N   CA   sing N N 277 
THR N   H    sing N N 278 
THR N   H2   sing N N 279 
THR CA  C    sing N N 280 
THR CA  CB   sing N N 281 
THR CA  HA   sing N N 282 
THR C   O    doub N N 283 
THR C   OXT  sing N N 284 
THR CB  OG1  sing N N 285 
THR CB  CG2  sing N N 286 
THR CB  HB   sing N N 287 
THR OG1 HG1  sing N N 288 
THR CG2 HG21 sing N N 289 
THR CG2 HG22 sing N N 290 
THR CG2 HG23 sing N N 291 
THR OXT HXT  sing N N 292 
TRP N   CA   sing N N 293 
TRP N   H    sing N N 294 
TRP N   H2   sing N N 295 
TRP CA  C    sing N N 296 
TRP CA  CB   sing N N 297 
TRP CA  HA   sing N N 298 
TRP C   O    doub N N 299 
TRP C   OXT  sing N N 300 
TRP CB  CG   sing N N 301 
TRP CB  HB2  sing N N 302 
TRP CB  HB3  sing N N 303 
TRP CG  CD1  doub Y N 304 
TRP CG  CD2  sing Y N 305 
TRP CD1 NE1  sing Y N 306 
TRP CD1 HD1  sing N N 307 
TRP CD2 CE2  doub Y N 308 
TRP CD2 CE3  sing Y N 309 
TRP NE1 CE2  sing Y N 310 
TRP NE1 HE1  sing N N 311 
TRP CE2 CZ2  sing Y N 312 
TRP CE3 CZ3  doub Y N 313 
TRP CE3 HE3  sing N N 314 
TRP CZ2 CH2  doub Y N 315 
TRP CZ2 HZ2  sing N N 316 
TRP CZ3 CH2  sing Y N 317 
TRP CZ3 HZ3  sing N N 318 
TRP CH2 HH2  sing N N 319 
TRP OXT HXT  sing N N 320 
TYR N   CA   sing N N 321 
TYR N   H    sing N N 322 
TYR N   H2   sing N N 323 
TYR CA  C    sing N N 324 
TYR CA  CB   sing N N 325 
TYR CA  HA   sing N N 326 
TYR C   O    doub N N 327 
TYR C   OXT  sing N N 328 
TYR CB  CG   sing N N 329 
TYR CB  HB2  sing N N 330 
TYR CB  HB3  sing N N 331 
TYR CG  CD1  doub Y N 332 
TYR CG  CD2  sing Y N 333 
TYR CD1 CE1  sing Y N 334 
TYR CD1 HD1  sing N N 335 
TYR CD2 CE2  doub Y N 336 
TYR CD2 HD2  sing N N 337 
TYR CE1 CZ   doub Y N 338 
TYR CE1 HE1  sing N N 339 
TYR CE2 CZ   sing Y N 340 
TYR CE2 HE2  sing N N 341 
TYR CZ  OH   sing N N 342 
TYR OH  HH   sing N N 343 
TYR OXT HXT  sing N N 344 
VAL N   CA   sing N N 345 
VAL N   H    sing N N 346 
VAL N   H2   sing N N 347 
VAL CA  C    sing N N 348 
VAL CA  CB   sing N N 349 
VAL CA  HA   sing N N 350 
VAL C   O    doub N N 351 
VAL C   OXT  sing N N 352 
VAL CB  CG1  sing N N 353 
VAL CB  CG2  sing N N 354 
VAL CB  HB   sing N N 355 
VAL CG1 HG11 sing N N 356 
VAL CG1 HG12 sing N N 357 
VAL CG1 HG13 sing N N 358 
VAL CG2 HG21 sing N N 359 
VAL CG2 HG22 sing N N 360 
VAL CG2 HG23 sing N N 361 
VAL OXT HXT  sing N N 362 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'German Research Foundation (DFG)' Germany 'SCHL2062/2-1 and 2-2'                                              1 
'German Research Foundation (DFG)' Germany 161793742                                                           2 
'Other government'                 ?       Goethe-Corona-Funds                                                 3 
'Other government'                 ?       'Johanna Quandt Young Academy at Goethe (stipend number 2019/AS01)' 4 
# 
_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   7cdz 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9F7A 
_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]   0.014981 
_atom_sites.fract_transf_matrix[1][2]   0.008649 
_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]   0.017298 
_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]   0.008250 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C  
H  
N  
O  
S  
ZN 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
_atom_site.pdbx_tls_group_id 
ATOM   1    N  N    . ASN A 1 10  ? 6.488   -11.295 -3.466  1 101.184 ? 48  ASN A N    1 ? 
ATOM   2    C  CA   . ASN A 1 10  ? 7.891   -10.929 -3.831  1 111.424 ? 48  ASN A CA   1 ? 
ATOM   3    C  C    . ASN A 1 10  ? 8.93    -11.625 -2.956  1 110.541 ? 48  ASN A C    1 ? 
ATOM   4    O  O    . ASN A 1 10  ? 10.022  -11.902 -3.446  1 111.218 ? 48  ASN A O    1 ? 
ATOM   5    C  CB   . ASN A 1 10  ? 8.154   -9.424  -3.767  1 120.058 ? 48  ASN A CB   1 ? 
ATOM   6    C  CG   . ASN A 1 10  ? 7.939   -8.729  -5.091  1 119.008 ? 48  ASN A CG   1 ? 
ATOM   7    O  OD1  . ASN A 1 10  ? 7.259   -9.257  -5.978  1 116.414 ? 48  ASN A OD1  1 ? 
ATOM   8    N  ND2  . ASN A 1 10  ? 8.501   -7.537  -5.237  1 112.705 ? 48  ASN A ND2  1 ? 
ATOM   9    H  H    . ASN A 1 10  ? 5.934   -11.067 -4.14   1 104.234 ? 48  ASN A H    1 ? 
ATOM   10   H  HA   . ASN A 1 10  ? 8.047   -11.228 -4.754  1 110.823 ? 48  ASN A HA   1 ? 
ATOM   11   H  HB2  . ASN A 1 10  ? 7.561   -9.024  -3.101  1 117.698 ? 48  ASN A HB2  1 ? 
ATOM   12   H  HB3  . ASN A 1 10  ? 9.075   -9.267  -3.478  1 117.728 ? 48  ASN A HB3  1 ? 
ATOM   13   H  HD21 . ASN A 1 10  ? 8.456   -7.122  -6.02   1 114.636 ? 48  ASN A HD21 1 ? 
ATOM   14   H  HD22 . ASN A 1 10  ? 8.922   -7.149  -4.558  1 114.673 ? 48  ASN A HD22 1 ? 
ATOM   15   N  N    . THR A 1 11  ? 8.614   -11.849 -1.67   1 93.639  ? 49  THR A N    1 ? 
ATOM   16   C  CA   . THR A 1 11  ? 9.5     -12.55  -0.751  1 80.739  ? 49  THR A CA   1 ? 
ATOM   17   C  C    . THR A 1 11  ? 9.557   -14.041 -1.089  1 75.817  ? 49  THR A C    1 ? 
ATOM   18   O  O    . THR A 1 11  ? 8.526   -14.645 -1.387  1 77.99   ? 49  THR A O    1 ? 
ATOM   19   C  CB   . THR A 1 11  ? 9.023   -12.345 0.686   1 77.93   ? 49  THR A CB   1 ? 
ATOM   20   O  OG1  . THR A 1 11  ? 7.662   -12.77  0.768   1 67.538  ? 49  THR A OG1  1 ? 
ATOM   21   C  CG2  . THR A 1 11  ? 9.157   -10.899 1.125   1 75.513  ? 49  THR A CG2  1 ? 
ATOM   22   H  H    . THR A 1 11  ? 7.822   -11.533 -1.343  1 94.05   ? 49  THR A H    1 ? 
ATOM   23   H  HA   . THR A 1 11  ? 10.399  -12.165 -0.836  1 81.619  ? 49  THR A HA   1 ? 
ATOM   24   H  HB   . THR A 1 11  ? 9.575   -12.905 1.278   1 75.72   ? 49  THR A HB   1 ? 
ATOM   25   H  HG21 . THR A 1 11  ? 8.898   -10.818 2.058   1 76.266  ? 49  THR A HG21 1 ? 
ATOM   26   H  HG22 . THR A 1 11  ? 8.579   -10.338 0.581   1 76.413  ? 49  THR A HG22 1 ? 
ATOM   27   H  HG23 . THR A 1 11  ? 10.079  -10.611 1.019   1 76.266  ? 49  THR A HG23 1 ? 
ATOM   28   N  N    . ALA A 1 12  ? 10.764  -14.629 -0.972  1 59.873  ? 50  ALA A N    1 ? 
ATOM   29   C  CA   . ALA A 1 12  ? 11.001  -16.016 -1.324  1 66.881  ? 50  ALA A CA   1 ? 
ATOM   30   C  C    . ALA A 1 12  ? 10.816  -16.926 -0.099  1 62.301  ? 50  ALA A C    1 ? 
ATOM   31   O  O    . ALA A 1 12  ? 11.213  -16.558 1.01    1 59.592  ? 50  ALA A O    1 ? 
ATOM   32   C  CB   . ALA A 1 12  ? 12.39   -16.122 -1.892  1 70.901  ? 50  ALA A CB   1 ? 
ATOM   33   H  H    . ALA A 1 12  ? 11.463  -14.142 -0.641  1 65.208  ? 50  ALA A H    1 ? 
ATOM   34   H  HA   . ALA A 1 12  ? 10.348  -16.286 -2.026  1 65.405  ? 50  ALA A HA   1 ? 
ATOM   35   H  HB1  . ALA A 1 12  ? 12.479  -15.523 -2.652  1 69.66   ? 50  ALA A HB1  1 ? 
ATOM   36   H  HB2  . ALA A 1 12  ? 13.04   -15.878 -1.214  1 69.599  ? 50  ALA A HB2  1 ? 
ATOM   37   H  HB3  . ALA A 1 12  ? 12.556  -17.035 -2.181  1 69.66   ? 50  ALA A HB3  1 ? 
ATOM   38   N  N    . SER A 1 13  ? 10.226  -18.116 -0.317  1 60.591  ? 51  SER A N    1 ? 
ATOM   39   C  CA   . SER A 1 13  ? 10.183  -19.199 0.672   1 54.519  ? 51  SER A CA   1 ? 
ATOM   40   C  C    . SER A 1 13  ? 11.584  -19.724 0.982   1 69.537  ? 51  SER A C    1 ? 
ATOM   41   O  O    . SER A 1 13  ? 12.42   -19.891 0.078   1 56.079  ? 51  SER A O    1 ? 
ATOM   42   C  CB   . SER A 1 13  ? 9.326   -20.335 0.191   1 51.069  ? 51  SER A CB   1 ? 
ATOM   43   O  OG   . SER A 1 13  ? 9.448   -21.537 0.972   1 54.305  ? 51  SER A OG   1 ? 
ATOM   44   H  H    . SER A 1 13  ? 9.818   -18.257 -1.123  1 59.537  ? 51  SER A H    1 ? 
ATOM   45   H  HA   . SER A 1 13  ? 9.786   -18.837 1.504   1 57.444  ? 51  SER A HA   1 ? 
ATOM   46   H  HB2  . SER A 1 13  ? 8.395   -20.047 0.199   1 52.701  ? 51  SER A HB2  1 ? 
ATOM   47   H  HB3  . SER A 1 13  ? 9.563   -20.538 -0.733  1 52.753  ? 51  SER A HB3  1 ? 
ATOM   48   N  N    . TRP A 1 14  ? 11.788  -20.107 2.253   1 53.614  ? 52  TRP A N    1 ? 
ATOM   49   C  CA   . TRP A 1 14  ? 13.008  -20.798 2.648   1 58.137  ? 52  TRP A CA   1 ? 
ATOM   50   C  C    . TRP A 1 14  ? 13.179  -22.171 1.992   1 46.987  ? 52  TRP A C    1 ? 
ATOM   51   O  O    . TRP A 1 14  ? 14.276  -22.696 2.057   1 58.922  ? 52  TRP A O    1 ? 
ATOM   52   C  CB   . TRP A 1 14  ? 13.074  -20.931 4.177   1 58.804  ? 52  TRP A CB   1 ? 
ATOM   53   C  CG   . TRP A 1 14  ? 13.589  -19.69  4.848   1 50.929  ? 52  TRP A CG   1 ? 
ATOM   54   C  CD1  . TRP A 1 14  ? 12.853  -18.689 5.403   1 55.425  ? 52  TRP A CD1  1 ? 
ATOM   55   C  CD2  . TRP A 1 14  ? 14.967  -19.285 4.954   1 53.331  ? 52  TRP A CD2  1 ? 
ATOM   56   N  NE1  . TRP A 1 14  ? 13.676  -17.723 5.898   1 55.456  ? 52  TRP A NE1  1 ? 
ATOM   57   C  CE2  . TRP A 1 14  ? 14.974  -18.052 5.624   1 50.084  ? 52  TRP A CE2  1 ? 
ATOM   58   C  CE3  . TRP A 1 14  ? 16.184  -19.835 4.538   1 59.455  ? 52  TRP A CE3  1 ? 
ATOM   59   C  CZ2  . TRP A 1 14  ? 16.15   -17.363 5.907   1 56.525  ? 52  TRP A CZ2  1 ? 
ATOM   60   C  CZ3  . TRP A 1 14  ? 17.348  -19.142 4.796   1 59.075  ? 52  TRP A CZ3  1 ? 
ATOM   61   C  CH2  . TRP A 1 14  ? 17.326  -17.934 5.488   1 58.415  ? 52  TRP A CH2  1 ? 
ATOM   62   H  H    . TRP A 1 14  ? 11.156  -19.926 2.889   1 58.068  ? 52  TRP A H    1 ? 
ATOM   63   H  HA   . TRP A 1 14  ? 13.772  -20.239 2.364   1 55.225  ? 52  TRP A HA   1 ? 
ATOM   64   H  HB2  . TRP A 1 14  ? 12.177  -21.132 4.519   1 56.682  ? 52  TRP A HB2  1 ? 
ATOM   65   H  HB3  . TRP A 1 14  ? 13.661  -21.682 4.411   1 56.668  ? 52  TRP A HB3  1 ? 
ATOM   66   H  HD1  . TRP A 1 14  ? 11.913  -18.689 5.497   1 54.386  ? 52  TRP A HD1  1 ? 
ATOM   67   H  HE1  . TRP A 1 14  ? 13.415  -17.002 6.311   1 54.225  ? 52  TRP A HE1  1 ? 
ATOM   68   H  HE3  . TRP A 1 14  ? 16.205  -20.659 4.081   1 57.83   ? 52  TRP A HE3  1 ? 
ATOM   69   H  HZ2  . TRP A 1 14  ? 16.136  -16.534 6.354   1 55.444  ? 52  TRP A HZ2  1 ? 
ATOM   70   H  HZ3  . TRP A 1 14  ? 18.176  -19.513 4.538   1 58.896  ? 52  TRP A HZ3  1 ? 
ATOM   71   H  HH2  . TRP A 1 14  ? 18.136  -17.487 5.656   1 58.083  ? 52  TRP A HH2  1 ? 
ATOM   72   N  N    . PHE A 1 15  ? 12.113  -22.785 1.454   1 49.763  ? 53  PHE A N    1 ? 
ATOM   73   C  CA   . PHE A 1 15  ? 12.138  -24.183 1.058   1 60.469  ? 53  PHE A CA   1 ? 
ATOM   74   C  C    . PHE A 1 15  ? 11.761  -24.268 -0.413  1 57.938  ? 53  PHE A C    1 ? 
ATOM   75   O  O    . PHE A 1 15  ? 11.092  -23.374 -0.926  1 55.661  ? 53  PHE A O    1 ? 
ATOM   76   C  CB   . PHE A 1 15  ? 11.194  -25.081 1.878   1 61.26   ? 53  PHE A CB   1 ? 
ATOM   77   C  CG   . PHE A 1 15  ? 11.418  -24.888 3.363   1 49.648  ? 53  PHE A CG   1 ? 
ATOM   78   C  CD1  . PHE A 1 15  ? 10.767  -23.876 4.045   1 55.19   ? 53  PHE A CD1  1 ? 
ATOM   79   C  CD2  . PHE A 1 15  ? 12.329  -25.663 4.058   1 46.41   ? 53  PHE A CD2  1 ? 
ATOM   80   C  CE1  . PHE A 1 15  ? 11.042  -23.642 5.373   1 46.568  ? 53  PHE A CE1  1 ? 
ATOM   81   C  CE2  . PHE A 1 15  ? 12.648  -25.386 5.375   1 44.905  ? 53  PHE A CE2  1 ? 
ATOM   82   C  CZ   . PHE A 1 15  ? 11.969  -24.418 6.053   1 48.282  ? 53  PHE A CZ   1 ? 
ATOM   83   H  H    . PHE A 1 15  ? 11.326  -22.335 1.358   1 51.441  ? 53  PHE A H    1 ? 
ATOM   84   H  HA   . PHE A 1 15  ? 13.049  -24.521 1.168   1 57.844  ? 53  PHE A HA   1 ? 
ATOM   85   H  HB2  . PHE A 1 15  ? 10.264  -24.856 1.658   1 58.205  ? 53  PHE A HB2  1 ? 
ATOM   86   H  HB3  . PHE A 1 15  ? 11.36   -26.02  1.641   1 58.207  ? 53  PHE A HB3  1 ? 
ATOM   87   H  HD1  . PHE A 1 15  ? 10.146  -23.33  3.59    1 51.691  ? 53  PHE A HD1  1 ? 
ATOM   88   H  HD2  . PHE A 1 15  ? 12.823  -26.319 3.592   1 46.912  ? 53  PHE A HD2  1 ? 
ATOM   89   H  HE1  . PHE A 1 15  ? 10.579  -22.959 5.831   1 48.865  ? 53  PHE A HE1  1 ? 
ATOM   90   H  HE2  . PHE A 1 15  ? 13.254  -25.944 5.833   1 46.309  ? 53  PHE A HE2  1 ? 
ATOM   91   H  HZ   . PHE A 1 15  ? 12.137  -24.266 6.961   1 47.258  ? 53  PHE A HZ   1 ? 
ATOM   92   N  N    . THR A 1 16  ? 12.124  -25.405 -1.028  1 62.663  ? 54  THR A N    1 ? 
ATOM   93   C  CA   . THR A 1 16  ? 11.613  -25.792 -2.339  1 57.051  ? 54  THR A CA   1 ? 
ATOM   94   C  C    . THR A 1 16  ? 10.12   -26.11  -2.242  1 68.424  ? 54  THR A C    1 ? 
ATOM   95   O  O    . THR A 1 16  ? 9.588   -26.383 -1.169  1 65.759  ? 54  THR A O    1 ? 
ATOM   96   C  CB   . THR A 1 16  ? 12.418  -26.97  -2.892  1 68.223  ? 54  THR A CB   1 ? 
ATOM   97   O  OG1  . THR A 1 16  ? 12.343  -28.077 -1.991  1 57.36   ? 54  THR A OG1  1 ? 
ATOM   98   C  CG2  . THR A 1 16  ? 13.887  -26.615 -3.099  1 62.402  ? 54  THR A CG2  1 ? 
ATOM   99   H  H    . THR A 1 16  ? 12.698  -25.973 -0.6    1 60.289  ? 54  THR A H    1 ? 
ATOM   100  H  HA   . THR A 1 16  ? 11.729  -25.03  -2.947  1 62.025  ? 54  THR A HA   1 ? 
ATOM   101  H  HB   . THR A 1 16  ? 12.037  -27.237 -3.762  1 62.804  ? 54  THR A HB   1 ? 
ATOM   102  H  HG21 . THR A 1 16  ? 14.344  -27.363 -3.518  1 64.055  ? 54  THR A HG21 1 ? 
ATOM   103  H  HG22 . THR A 1 16  ? 14.304  -26.422 -2.243  1 64.026  ? 54  THR A HG22 1 ? 
ATOM   104  H  HG23 . THR A 1 16  ? 13.954  -25.833 -3.673  1 64.055  ? 54  THR A HG23 1 ? 
ATOM   105  N  N    . ALA A 1 17  ? 9.455   -26.108 -3.394  1 65.051  ? 55  ALA A N    1 ? 
ATOM   106  C  CA   . ALA A 1 17  ? 8.011   -26.204 -3.46   1 67.832  ? 55  ALA A CA   1 ? 
ATOM   107  C  C    . ALA A 1 17  ? 7.574   -27.655 -3.391  1 69.363  ? 55  ALA A C    1 ? 
ATOM   108  O  O    . ALA A 1 17  ? 8.374   -28.554 -3.633  1 66.257  ? 55  ALA A O    1 ? 
ATOM   109  C  CB   . ALA A 1 17  ? 7.503   -25.578 -4.728  1 80.457  ? 55  ALA A CB   1 ? 
ATOM   110  H  H    . ALA A 1 17  ? 9.926   -26.052 -4.176  1 66.481  ? 55  ALA A H    1 ? 
ATOM   111  H  HA   . ALA A 1 17  ? 7.623   -25.715 -2.682  1 69.686  ? 55  ALA A HA   1 ? 
ATOM   112  H  HB1  . ALA A 1 17  ? 7.837   -24.681 -4.799  1 76.383  ? 55  ALA A HB1  1 ? 
ATOM   113  H  HB2  . ALA A 1 17  ? 7.806   -26.095 -5.494  1 76.42   ? 55  ALA A HB2  1 ? 
ATOM   114  H  HB3  . ALA A 1 17  ? 6.533   -25.562 -4.713  1 76.495  ? 55  ALA A HB3  1 ? 
ATOM   115  N  N    . LEU A 1 18  ? 6.297   -27.833 -3.017  1 68.722  ? 56  LEU A N    1 ? 
ATOM   116  C  CA   . LEU A 1 18  ? 5.548   -29.06  -3.214  1 62.633  ? 56  LEU A CA   1 ? 
ATOM   117  C  C    . LEU A 1 18  ? 4.801   -28.921 -4.535  1 70.833  ? 56  LEU A C    1 ? 
ATOM   118  O  O    . LEU A 1 18  ? 4.135   -27.905 -4.769  1 74.65   ? 56  LEU A O    1 ? 
ATOM   119  C  CB   . LEU A 1 18  ? 4.563   -29.321 -2.068  1 66.785  ? 56  LEU A CB   1 ? 
ATOM   120  C  CG   . LEU A 1 18  ? 5.167   -29.617 -0.694  1 67.08   ? 56  LEU A CG   1 ? 
ATOM   121  C  CD1  . LEU A 1 18  ? 4.112   -29.763 0.372   1 75.262  ? 56  LEU A CD1  1 ? 
ATOM   122  C  CD2  . LEU A 1 18  ? 6.01    -30.873 -0.738  1 74.739  ? 56  LEU A CD2  1 ? 
ATOM   123  H  H    . LEU A 1 18  ? 5.865   -27.139 -2.607  1 67.447  ? 56  LEU A H    1 ? 
ATOM   124  H  HA   . LEU A 1 18  ? 6.182   -29.814 -3.278  1 66.122  ? 56  LEU A HA   1 ? 
ATOM   125  H  HB2  . LEU A 1 18  ? 3.978   -28.533 -1.984  1 65.888  ? 56  LEU A HB2  1 ? 
ATOM   126  H  HB3  . LEU A 1 18  ? 3.991   -30.081 -2.323  1 65.909  ? 56  LEU A HB3  1 ? 
ATOM   127  H  HG   . LEU A 1 18  ? 5.755   -28.858 -0.444  1 69.887  ? 56  LEU A HG   1 ? 
ATOM   128  H  HD11 . LEU A 1 18  ? 3.532   -28.984 0.365   1 72.626  ? 56  LEU A HD11 1 ? 
ATOM   129  H  HD12 . LEU A 1 18  ? 4.536   -29.844 1.243   1 72.701  ? 56  LEU A HD12 1 ? 
ATOM   130  H  HD13 . LEU A 1 18  ? 3.582   -30.56  0.196   1 72.701  ? 56  LEU A HD13 1 ? 
ATOM   131  H  HD21 . LEU A 1 18  ? 6.835   -30.695 -1.219  1 72.292  ? 56  LEU A HD21 1 ? 
ATOM   132  H  HD22 . LEU A 1 18  ? 5.519   -31.579 -1.189  1 72.364  ? 56  LEU A HD22 1 ? 
ATOM   133  H  HD23 . LEU A 1 18  ? 6.223   -31.155 0.169   1 72.39   ? 56  LEU A HD23 1 ? 
ATOM   134  N  N    . THR A 1 19  ? 4.918   -29.95  -5.381  1 67.379  ? 57  THR A N    1 ? 
ATOM   135  C  CA   . THR A 1 19  ? 4.334   -29.908 -6.706  1 73.211  ? 57  THR A CA   1 ? 
ATOM   136  C  C    . THR A 1 19  ? 2.974   -30.58  -6.634  1 71.2    ? 57  THR A C    1 ? 
ATOM   137  O  O    . THR A 1 19  ? 2.885   -31.699 -6.122  1 72.738  ? 57  THR A O    1 ? 
ATOM   138  C  CB   . THR A 1 19  ? 5.249   -30.588 -7.724  1 71.014  ? 57  THR A CB   1 ? 
ATOM   139  O  OG1  . THR A 1 19  ? 6.365   -29.709 -7.791  1 76.029  ? 57  THR A OG1  1 ? 
ATOM   140  C  CG2  . THR A 1 19  ? 4.655   -30.635 -9.119  1 72.549  ? 57  THR A CG2  1 ? 
ATOM   141  H  H    . THR A 1 19  ? 5.364   -30.706 -5.125  1 69.402  ? 57  THR A H    1 ? 
ATOM   142  H  HA   . THR A 1 19  ? 4.222   -28.972 -6.978  1 71.333  ? 57  THR A HA   1 ? 
ATOM   143  H  HB   . THR A 1 19  ? 5.531   -31.483 -7.418  1 72.649  ? 57  THR A HB   1 ? 
ATOM   144  H  HG21 . THR A 1 19  ? 5.347   -30.885 -9.756  1 72.173  ? 57  THR A HG21 1 ? 
ATOM   145  H  HG22 . THR A 1 19  ? 4.306   -29.758 -9.35   1 72.436  ? 57  THR A HG22 1 ? 
ATOM   146  H  HG23 . THR A 1 19  ? 3.936   -31.288 -9.153  1 72.17   ? 57  THR A HG23 1 ? 
ATOM   147  N  N    . GLN A 1 20  ? 1.963   -29.878 -7.18   1 72.671  ? 58  GLN A N    1 ? 
ATOM   148  C  CA   . GLN A 1 20  ? 0.609   -30.393 -7.281  1 74.557  ? 58  GLN A CA   1 ? 
ATOM   149  C  C    . GLN A 1 20  ? 0.444   -31.106 -8.625  1 70.383  ? 58  GLN A C    1 ? 
ATOM   150  O  O    . GLN A 1 20  ? -0.06   -30.516 -9.57   1 68.048  ? 58  GLN A O    1 ? 
ATOM   151  C  CB   . GLN A 1 20  ? -0.399  -29.265 -7.07   1 70.605  ? 58  GLN A CB   1 ? 
ATOM   152  C  CG   . GLN A 1 20  ? -1.789  -29.81  -6.76   1 84.037  ? 58  GLN A CG   1 ? 
ATOM   153  C  CD   . GLN A 1 20  ? -2.9    -28.787 -6.779  1 80.242  ? 58  GLN A CD   1 ? 
ATOM   154  O  OE1  . GLN A 1 20  ? -2.781  -27.678 -6.247  1 95.722  ? 58  GLN A OE1  1 ? 
ATOM   155  N  NE2  . GLN A 1 20  ? -4.012  -29.161 -7.392  1 95.567  ? 58  GLN A NE2  1 ? 
ATOM   156  H  H    . GLN A 1 20  ? 2.126   -29.041 -7.509  1 72.718  ? 58  GLN A H    1 ? 
ATOM   157  H  HA   . GLN A 1 20  ? 0.463   -31.052 -6.555  1 72.755  ? 58  GLN A HA   1 ? 
ATOM   158  H  HB2  . GLN A 1 20  ? -0.099  -28.71  -6.319  1 74.381  ? 58  GLN A HB2  1 ? 
ATOM   159  H  HB3  . GLN A 1 20  ? -0.438  -28.696 -7.863  1 74.382  ? 58  GLN A HB3  1 ? 
ATOM   160  H  HG2  . GLN A 1 20  ? -2.004  -30.511 -7.41   1 80.049  ? 58  GLN A HG2  1 ? 
ATOM   161  H  HG3  . GLN A 1 20  ? -1.778  -30.231 -5.887  1 80.058  ? 58  GLN A HG3  1 ? 
ATOM   162  H  HE21 . GLN A 1 20  ? -4.57   -28.54  -7.697  1 90.56   ? 58  GLN A HE21 1 ? 
ATOM   163  H  HE22 . GLN A 1 20  ? -4.214  -30.021 -7.498  1 90.417  ? 58  GLN A HE22 1 ? 
ATOM   164  N  N    . HIS A 1 21  ? 0.829   -32.392 -8.68   1 76.641  ? 59  HIS A N    1 ? 
ATOM   165  C  CA   . HIS A 1 21  ? 0.76    -33.192 -9.899  1 87.103  ? 59  HIS A CA   1 ? 
ATOM   166  C  C    . HIS A 1 21  ? -0.712  -33.613 -10.158 1 101.714 ? 59  HIS A C    1 ? 
ATOM   167  O  O    . HIS A 1 21  ? -0.982  -34.103 -11.252 1 107.235 ? 59  HIS A O    1 ? 
ATOM   168  C  CB   . HIS A 1 21  ? 1.84    -34.314 -9.899  1 81.168  ? 59  HIS A CB   1 ? 
ATOM   169  C  CG   . HIS A 1 21  ? 3.35    -34.061 -10.152 1 68.514  ? 59  HIS A CG   1 ? 
ATOM   170  N  ND1  . HIS A 1 21  ? 3.827   -33.408 -11.261 1 68.393  ? 59  HIS A ND1  1 ? 
ATOM   171  C  CD2  . HIS A 1 21  ? 4.516   -34.473 -9.513  1 81.154  ? 59  HIS A CD2  1 ? 
ATOM   172  C  CE1  . HIS A 1 21  ? 5.177   -33.406 -11.268 1 78.057  ? 59  HIS A CE1  1 ? 
ATOM   173  N  NE2  . HIS A 1 21  ? 5.677   -34.058 -10.232 1 57.136  ? 59  HIS A NE2  1 ? 
ATOM   174  H  H    . HIS A 1 21  ? 1.153   -32.789 -7.923  1 77.288  ? 59  HIS A H    1 ? 
ATOM   175  H  HA   . HIS A 1 21  ? 1.023   -32.594 -10.64  1 86.057  ? 59  HIS A HA   1 ? 
ATOM   176  H  HB2  . HIS A 1 21  ? 1.764   -34.787 -9.042  1 79.349  ? 59  HIS A HB2  1 ? 
ATOM   177  H  HB3  . HIS A 1 21  ? 1.549   -34.986 -10.554 1 79.38   ? 59  HIS A HB3  1 ? 
ATOM   178  H  HD2  . HIS A 1 21  ? 4.529   -34.964 -8.717  1 72.572  ? 59  HIS A HD2  1 ? 
ATOM   179  H  HE1  . HIS A 1 21  ? 5.65    -32.984 -11.923 1 70.472  ? 59  HIS A HE1  1 ? 
ATOM   180  N  N    . GLY A 1 22  ? -1.68   -33.365 -9.225  1 105.355 ? 60  GLY A N    1 ? 
ATOM   181  C  CA   . GLY A 1 22  ? -3.071  -33.836 -9.296  1 99.044  ? 60  GLY A CA   1 ? 
ATOM   182  C  C    . GLY A 1 22  ? -4.137  -32.724 -9.219  1 106.519 ? 60  GLY A C    1 ? 
ATOM   183  O  O    . GLY A 1 22  ? -3.869  -31.581 -9.601  1 91.456  ? 60  GLY A O    1 ? 
ATOM   184  H  H    . GLY A 1 22  ? -1.461  -32.874 -8.489  1 102.518 ? 60  GLY A H    1 ? 
ATOM   185  H  HA2  . GLY A 1 22  ? -3.2    -34.335 -10.135 1 102.185 ? 60  GLY A HA2  1 ? 
ATOM   186  H  HA3  . GLY A 1 22  ? -3.217  -34.469 -8.556  1 102.231 ? 60  GLY A HA3  1 ? 
ATOM   187  N  N    . LYS A 1 23  ? -5.365  -33.074 -8.76   1 116.626 ? 61  LYS A N    1 ? 
ATOM   188  C  CA   . LYS A 1 23  ? -6.557  -32.219 -8.853  1 121.258 ? 61  LYS A CA   1 ? 
ATOM   189  C  C    . LYS A 1 23  ? -6.831  -31.438 -7.565  1 108.558 ? 61  LYS A C    1 ? 
ATOM   190  O  O    . LYS A 1 23  ? -7.164  -30.255 -7.62   1 100.152 ? 61  LYS A O    1 ? 
ATOM   191  C  CB   . LYS A 1 23  ? -7.907  -32.922 -9.078  1 121.929 ? 61  LYS A CB   1 ? 
ATOM   192  C  CG   . LYS A 1 23  ? -8.058  -33.793 -10.306 1 125.853 ? 61  LYS A CG   1 ? 
ATOM   193  C  CD   . LYS A 1 23  ? -7.994  -35.288 -10.021 1 137.561 ? 61  LYS A CD   1 ? 
ATOM   194  C  CE   . LYS A 1 23  ? -8.385  -36.096 -11.216 1 143.52  ? 61  LYS A CE   1 ? 
ATOM   195  N  NZ   . LYS A 1 23  ? -7.465  -35.914 -12.343 1 147.441 ? 61  LYS A NZ   1 ? 
ATOM   196  H  H    . LYS A 1 23  ? -5.464  -33.899 -8.378  1 114.859 ? 61  LYS A H    1 ? 
ATOM   197  H  HA   . LYS A 1 23  ? -6.428  -31.572 -9.593  1 117.834 ? 61  LYS A HA   1 ? 
ATOM   198  H  HB2  . LYS A 1 23  ? -8.101  -33.476 -8.291  1 122.646 ? 61  LYS A HB2  1 ? 
ATOM   199  H  HB3  . LYS A 1 23  ? -8.605  -32.233 -9.122  1 122.588 ? 61  LYS A HB3  1 ? 
ATOM   200  H  HG2  . LYS A 1 23  ? -8.918  -33.586 -10.732 1 127.536 ? 61  LYS A HG2  1 ? 
ATOM   201  H  HG3  . LYS A 1 23  ? -7.346  -33.56  -10.941 1 127.625 ? 61  LYS A HG3  1 ? 
ATOM   202  H  HD2  . LYS A 1 23  ? -7.081  -35.528 -9.752  1 136.196 ? 61  LYS A HD2  1 ? 
ATOM   203  H  HD3  . LYS A 1 23  ? -8.599  -35.504 -9.278  1 136.076 ? 61  LYS A HD3  1 ? 
ATOM   204  H  HE2  . LYS A 1 23  ? -8.403  -37.04  -10.974 1 143.035 ? 61  LYS A HE2  1 ? 
ATOM   205  H  HE3  . LYS A 1 23  ? -9.281  -35.84  -11.499 1 143.019 ? 61  LYS A HE3  1 ? 
ATOM   206  H  HZ1  . LYS A 1 23  ? -6.605  -35.933 -12.054 1 146.061 ? 61  LYS A HZ1  1 ? 
ATOM   207  H  HZ2  . LYS A 1 23  ? -7.624  -35.124 -12.757 1 146.004 ? 61  LYS A HZ2  1 ? 
ATOM   208  H  HZ3  . LYS A 1 23  ? -7.586  -36.585 -12.939 1 146.15  ? 61  LYS A HZ3  1 ? 
ATOM   209  N  N    . GLU A 1 24  ? -6.794  -32.135 -6.424  1 105.548 ? 62  GLU A N    1 ? 
ATOM   210  C  CA   . GLU A 1 24  ? -7.173  -31.565 -5.133  1 104.188 ? 62  GLU A CA   1 ? 
ATOM   211  C  C    . GLU A 1 24  ? -6.141  -30.552 -4.621  1 95.778  ? 62  GLU A C    1 ? 
ATOM   212  O  O    . GLU A 1 24  ? -4.941  -30.718 -4.832  1 109.737 ? 62  GLU A O    1 ? 
ATOM   213  C  CB   . GLU A 1 24  ? -7.392  -32.661 -4.089  1 108.258 ? 62  GLU A CB   1 ? 
ATOM   214  C  CG   . GLU A 1 24  ? -6.27   -33.692 -3.994  1 117.246 ? 62  GLU A CG   1 ? 
ATOM   215  C  CD   . GLU A 1 24  ? -6.398  -34.584 -2.78   1 131.594 ? 62  GLU A CD   1 ? 
ATOM   216  O  OE1  . GLU A 1 24  ? -7.426  -35.283 -2.665  1 127.027 ? 62  GLU A OE1  1 ? 
ATOM   217  O  OE2  . GLU A 1 24  ? -5.466  -34.58  -1.956  1 140.797 ? 62  GLU A OE2  1 ? 
ATOM   218  H  H    . GLU A 1 24  ? -6.547  -33.011 -6.466  1 106.351 ? 62  GLU A H    1 ? 
ATOM   219  H  HA   . GLU A 1 24  ? -8.038  -31.099 -5.254  1 103.556 ? 62  GLU A HA   1 ? 
ATOM   220  H  HB2  . GLU A 1 24  ? -7.507  -32.241 -3.21   1 109.319 ? 62  GLU A HB2  1 ? 
ATOM   221  H  HB3  . GLU A 1 24  ? -8.225  -33.132 -4.302  1 109.299 ? 62  GLU A HB3  1 ? 
ATOM   222  H  HG2  . GLU A 1 24  ? -6.283  -34.264 -4.788  1 118.094 ? 62  GLU A HG2  1 ? 
ATOM   223  H  HG3  . GLU A 1 24  ? -5.403  -33.235 -3.963  1 118.085 ? 62  GLU A HG3  1 ? 
ATOM   224  N  N    . ASP A 1 25  ? -6.63   -29.53  -3.9    1 97.938  ? 63  ASP A N    1 ? 
ATOM   225  C  CA   . ASP A 1 25  ? -5.796  -28.551 -3.212  1 94.349  ? 63  ASP A CA   1 ? 
ATOM   226  C  C    . ASP A 1 25  ? -5.041  -29.208 -2.055  1 97.245  ? 63  ASP A C    1 ? 
ATOM   227  O  O    . ASP A 1 25  ? -5.483  -30.232 -1.533  1 97.628  ? 63  ASP A O    1 ? 
ATOM   228  C  CB   . ASP A 1 25  ? -6.611  -27.383 -2.674  1 94.732  ? 63  ASP A CB   1 ? 
ATOM   229  C  CG   . ASP A 1 25  ? -7.43   -26.603 -3.693  1 107.502 ? 63  ASP A CG   1 ? 
ATOM   230  O  OD1  . ASP A 1 25  ? -7.568  -27.076 -4.842  1 126.399 ? 63  ASP A OD1  1 ? 
ATOM   231  O  OD2  . ASP A 1 25  ? -7.919  -25.518 -3.335  1 111.234 ? 63  ASP A OD2  1 ? 
ATOM   232  H  H    . ASP A 1 25  ? -7.537  -29.451 -3.817  1 96.748  ? 63  ASP A H    1 ? 
ATOM   233  H  HA   . ASP A 1 25  ? -5.144  -28.197 -3.858  1 95.659  ? 63  ASP A HA   1 ? 
ATOM   234  H  HB2  . ASP A 1 25  ? -7.225  -27.722 -1.99   1 97.434  ? 63  ASP A HB2  1 ? 
ATOM   235  H  HB3  . ASP A 1 25  ? -5.998  -26.754 -2.238  1 97.436  ? 63  ASP A HB3  1 ? 
ATOM   236  N  N    . LEU A 1 26  ? -3.9    -28.6   -1.674  1 90.786  ? 64  LEU A N    1 ? 
ATOM   237  C  CA   . LEU A 1 26  ? -3.031  -29.084 -0.608  1 83.125  ? 64  LEU A CA   1 ? 
ATOM   238  C  C    . LEU A 1 26  ? -3.769  -29.005 0.723   1 78.852  ? 64  LEU A C    1 ? 
ATOM   239  O  O    . LEU A 1 26  ? -4.492  -28.047 0.982   1 81.207  ? 64  LEU A O    1 ? 
ATOM   240  C  CB   . LEU A 1 26  ? -1.737  -28.267 -0.509  1 85.856  ? 64  LEU A CB   1 ? 
ATOM   241  C  CG   . LEU A 1 26  ? -0.71   -28.707 0.546   1 74.672  ? 64  LEU A CG   1 ? 
ATOM   242  C  CD1  . LEU A 1 26  ? -0.194  -30.109 0.275   1 76.2    ? 64  LEU A CD1  1 ? 
ATOM   243  C  CD2  . LEU A 1 26  ? 0.446   -27.716 0.62    1 80.763  ? 64  LEU A CD2  1 ? 
ATOM   244  H  H    . LEU A 1 26  ? -3.645  -27.846 -2.118  1 90.478  ? 64  LEU A H    1 ? 
ATOM   245  H  HA   . LEU A 1 26  ? -2.81   -30.027 -0.806  1 84.099  ? 64  LEU A HA   1 ? 
ATOM   246  H  HB2  . LEU A 1 26  ? -1.298  -28.273 -1.389  1 82.616  ? 64  LEU A HB2  1 ? 
ATOM   247  H  HB3  . LEU A 1 26  ? -1.983  -27.331 -0.325  1 82.574  ? 64  LEU A HB3  1 ? 
ATOM   248  H  HG   . LEU A 1 26  ? -1.148  -28.709 1.434   1 78.042  ? 64  LEU A HG   1 ? 
ATOM   249  H  HD11 . LEU A 1 26  ? -0.918  -30.747 0.345   1 75.975  ? 64  LEU A HD11 1 ? 
ATOM   250  H  HD12 . LEU A 1 26  ? 0.493   -30.332 0.923   1 75.783  ? 64  LEU A HD12 1 ? 
ATOM   251  H  HD13 . LEU A 1 26  ? 0.185   -30.147 -0.615  1 75.836  ? 64  LEU A HD13 1 ? 
ATOM   252  H  HD21 . LEU A 1 26  ? 0.11    -26.846 0.894   1 78.882  ? 64  LEU A HD21 1 ? 
ATOM   253  H  HD22 . LEU A 1 26  ? 0.864   -27.64  -0.254  1 78.893  ? 64  LEU A HD22 1 ? 
ATOM   254  H  HD23 . LEU A 1 26  ? 1.101   -28.025 1.264   1 78.82   ? 64  LEU A HD23 1 ? 
ATOM   255  N  N    . LYS A 1 27  ? -3.514  -29.987 1.581   1 79.613  ? 65  LYS A N    1 ? 
ATOM   256  C  CA   . LYS A 1 27  ? -4.039  -29.981 2.93    1 80.525  ? 65  LYS A CA   1 ? 
ATOM   257  C  C    . LYS A 1 27  ? -3.3    -31.058 3.71    1 78.142  ? 65  LYS A C    1 ? 
ATOM   258  O  O    . LYS A 1 27  ? -2.933  -32.075 3.123   1 73.271  ? 65  LYS A O    1 ? 
ATOM   259  C  CB   . LYS A 1 27  ? -5.544  -30.279 2.969   1 95.249  ? 65  LYS A CB   1 ? 
ATOM   260  C  CG   . LYS A 1 27  ? -6.258  -29.715 4.193   1 108.484 ? 65  LYS A CG   1 ? 
ATOM   261  C  CD   . LYS A 1 27  ? -7.337  -30.628 4.768   1 119.678 ? 65  LYS A CD   1 ? 
ATOM   262  C  CE   . LYS A 1 27  ? -7.888  -30.123 6.07    1 120.722 ? 65  LYS A CE   1 ? 
ATOM   263  N  NZ   . LYS A 1 27  ? -8.448  -31.21  6.879   1 122.025 ? 65  LYS A NZ   1 ? 
ATOM   264  H  H    . LYS A 1 27  ? -3.003  -30.696 1.314   1 79.656  ? 65  LYS A H    1 ? 
ATOM   265  H  HA   . LYS A 1 27  ? -3.856  -29.095 3.337   1 82.347  ? 65  LYS A HA   1 ? 
ATOM   266  H  HB2  . LYS A 1 27  ? -5.969  -29.907 2.169   1 94.374  ? 65  LYS A HB2  1 ? 
ATOM   267  H  HB3  . LYS A 1 27  ? -5.677  -31.251 2.947   1 94.604  ? 65  LYS A HB3  1 ? 
ATOM   268  H  HG2  . LYS A 1 27  ? -5.592  -29.534 4.889   1 107.034 ? 65  LYS A HG2  1 ? 
ATOM   269  H  HG3  . LYS A 1 27  ? -6.668  -28.858 3.945   1 107.551 ? 65  LYS A HG3  1 ? 
ATOM   270  H  HD2  . LYS A 1 27  ? -8.069  -30.707 4.118   1 117.259 ? 65  LYS A HD2  1 ? 
ATOM   271  H  HD3  . LYS A 1 27  ? -6.958  -31.524 4.907   1 117.167 ? 65  LYS A HD3  1 ? 
ATOM   272  H  HE2  . LYS A 1 27  ? -7.189  -29.68  6.583   1 120.623 ? 65  LYS A HE2  1 ? 
ATOM   273  H  HE3  . LYS A 1 27  ? -8.589  -29.471 5.89    1 120.757 ? 65  LYS A HE3  1 ? 
ATOM   274  H  HZ1  . LYS A 1 27  ? -7.791  -31.785 7.121   1 121.591 ? 65  LYS A HZ1  1 ? 
ATOM   275  H  HZ2  . LYS A 1 27  ? -9.075  -31.657 6.402   1 121.613 ? 65  LYS A HZ2  1 ? 
ATOM   276  H  HZ3  . LYS A 1 27  ? -8.831  -30.868 7.626   1 121.615 ? 65  LYS A HZ3  1 ? 
ATOM   277  N  N    . PHE A 1 28  ? -3.072  -30.798 5.008   1 61.703  ? 66  PHE A N    1 ? 
ATOM   278  C  CA   . PHE A 1 28  ? -2.384  -31.702 5.913   1 65.9    ? 66  PHE A CA   1 ? 
ATOM   279  C  C    . PHE A 1 28  ? -3.262  -31.93  7.139   1 79.951  ? 66  PHE A C    1 ? 
ATOM   280  O  O    . PHE A 1 28  ? -3.97   -31.012 7.557   1 78.089  ? 66  PHE A O    1 ? 
ATOM   281  C  CB   . PHE A 1 28  ? -1.075  -31.077 6.412   1 73.938  ? 66  PHE A CB   1 ? 
ATOM   282  C  CG   . PHE A 1 28  ? 0.069   -31.13  5.408   1 71.172  ? 66  PHE A CG   1 ? 
ATOM   283  C  CD1  . PHE A 1 28  ? 0.889   -32.246 5.356   1 66.024  ? 66  PHE A CD1  1 ? 
ATOM   284  C  CD2  . PHE A 1 28  ? 0.291   -30.089 4.504   1 66.758  ? 66  PHE A CD2  1 ? 
ATOM   285  C  CE1  . PHE A 1 28  ? 1.915   -32.332 4.429   1 73.443  ? 66  PHE A CE1  1 ? 
ATOM   286  C  CE2  . PHE A 1 28  ? 1.348   -30.164 3.601   1 70.684  ? 66  PHE A CE2  1 ? 
ATOM   287  C  CZ   . PHE A 1 28  ? 2.164   -31.284 3.57    1 58.674  ? 66  PHE A CZ   1 ? 
ATOM   288  H  H    . PHE A 1 28  ? -3.358  -29.999 5.349   1 66.805  ? 66  PHE A H    1 ? 
ATOM   289  H  HA   . PHE A 1 28  ? -2.19   -32.559 5.459   1 69.015  ? 66  PHE A HA   1 ? 
ATOM   290  H  HB2  . PHE A 1 28  ? -1.249  -30.137 6.644   1 71.419  ? 66  PHE A HB2  1 ? 
ATOM   291  H  HB3  . PHE A 1 28  ? -0.794  -31.54  7.233   1 71.463  ? 66  PHE A HB3  1 ? 
ATOM   292  H  HD1  . PHE A 1 28  ? 0.73    -32.966 5.946   1 68.827  ? 66  PHE A HD1  1 ? 
ATOM   293  H  HD2  . PHE A 1 28  ? -0.249  -29.315 4.536   1 68.616  ? 66  PHE A HD2  1 ? 
ATOM   294  H  HE1  . PHE A 1 28  ? 2.473   -33.094 4.417   1 68.008  ? 66  PHE A HE1  1 ? 
ATOM   295  H  HE2  . PHE A 1 28  ? 1.506   -29.453 3.005   1 66.944  ? 66  PHE A HE2  1 ? 
ATOM   296  H  HZ   . PHE A 1 28  ? 2.867   -31.343 2.943   1 64.655  ? 66  PHE A HZ   1 ? 
ATOM   297  N  N    . PRO A 1 29  ? -3.191  -33.118 7.783   1 85.112  ? 67  PRO A N    1 ? 
ATOM   298  C  CA   . PRO A 1 29  ? -3.645  -33.27  9.163   1 90.128  ? 67  PRO A CA   1 ? 
ATOM   299  C  C    . PRO A 1 29  ? -3.091  -32.205 10.112  1 92.501  ? 67  PRO A C    1 ? 
ATOM   300  O  O    . PRO A 1 29  ? -2.023  -31.665 9.837   1 93.621  ? 67  PRO A O    1 ? 
ATOM   301  C  CB   . PRO A 1 29  ? -3.157  -34.67  9.522   1 85.894  ? 67  PRO A CB   1 ? 
ATOM   302  C  CG   . PRO A 1 29  ? -3.135  -35.401 8.193   1 81.411  ? 67  PRO A CG   1 ? 
ATOM   303  C  CD   . PRO A 1 29  ? -2.731  -34.384 7.186   1 80.626  ? 67  PRO A CD   1 ? 
ATOM   304  H  HA   . PRO A 1 29  ? -4.625  -33.249 9.184   1 88.734  ? 67  PRO A HA   1 ? 
ATOM   305  H  HB2  . PRO A 1 29  ? -2.269  -34.641 9.923   1 85.806  ? 67  PRO A HB2  1 ? 
ATOM   306  H  HB3  . PRO A 1 29  ? -3.773  -35.102 10.146  1 85.787  ? 67  PRO A HB3  1 ? 
ATOM   307  H  HG2  . PRO A 1 29  ? -2.493  -36.138 8.212   1 82.212  ? 67  PRO A HG2  1 ? 
ATOM   308  H  HG3  . PRO A 1 29  ? -4.02   -35.761 7.979   1 82.212  ? 67  PRO A HG3  1 ? 
ATOM   309  H  HD2  . PRO A 1 29  ? -1.762  -34.374 7.059   1 81.807  ? 67  PRO A HD2  1 ? 
ATOM   310  H  HD3  . PRO A 1 29  ? -3.168  -34.541 6.327   1 81.733  ? 67  PRO A HD3  1 ? 
ATOM   311  N  N    . ARG A 1 30  ? -3.827  -31.899 11.203  1 80.009  ? 68  ARG A N    1 ? 
ATOM   312  C  CA   . ARG A 1 30  ? -3.32   -31.063 12.288  1 82.422  ? 68  ARG A CA   1 ? 
ATOM   313  C  C    . ARG A 1 30  ? -2.036  -31.69  12.831  1 75.898  ? 68  ARG A C    1 ? 
ATOM   314  O  O    . ARG A 1 30  ? -1.922  -32.919 12.844  1 67.021  ? 68  ARG A O    1 ? 
ATOM   315  C  CB   . ARG A 1 30  ? -4.24   -30.948 13.514  1 91.008  ? 68  ARG A CB   1 ? 
ATOM   316  C  CG   . ARG A 1 30  ? -5.694  -30.535 13.344  1 95.81   ? 68  ARG A CG   1 ? 
ATOM   317  C  CD   . ARG A 1 30  ? -6.403  -30.56  14.712  1 104.675 ? 68  ARG A CD   1 ? 
ATOM   318  N  NE   . ARG A 1 30  ? -6.005  -29.425 15.563  1 92.609  ? 68  ARG A NE   1 ? 
ATOM   319  C  CZ   . ARG A 1 30  ? -5.207  -29.405 16.648  1 96.449  ? 68  ARG A CZ   1 ? 
ATOM   320  N  NH1  . ARG A 1 30  ? -4.806  -30.521 17.246  1 95.73   ? 68  ARG A NH1  1 ? 
ATOM   321  N  NH2  . ARG A 1 30  ? -4.822  -28.242 17.155  1 91.853  ? 68  ARG A NH2  1 ? 
ATOM   322  H  H    . ARG A 1 30  ? -4.674  -32.235 11.273  1 83.623  ? 68  ARG A H    1 ? 
ATOM   323  H  HA   . ARG A 1 30  ? -3.124  -30.163 11.928  1 81.921  ? 68  ARG A HA   1 ? 
ATOM   324  H  HB2  . ARG A 1 30  ? -4.236  -31.82  13.965  1 89.987  ? 68  ARG A HB2  1 ? 
ATOM   325  H  HB3  . ARG A 1 30  ? -3.822  -30.311 14.132  1 89.93   ? 68  ARG A HB3  1 ? 
ATOM   326  H  HG2  . ARG A 1 30  ? -5.739  -29.627 12.971  1 96.58   ? 68  ARG A HG2  1 ? 
ATOM   327  H  HG3  . ARG A 1 30  ? -6.148  -31.152 12.732  1 96.506  ? 68  ARG A HG3  1 ? 
ATOM   328  H  HD2  . ARG A 1 30  ? -7.371  -30.525 14.567  1 99.68   ? 68  ARG A HD2  1 ? 
ATOM   329  H  HD3  . ARG A 1 30  ? -6.202  -31.4   15.168  1 99.595  ? 68  ARG A HD3  1 ? 
ATOM   330  H  HE   . ARG A 1 30  ? -6.347  -28.658 15.331  1 96.161  ? 68  ARG A HE   1 ? 
ATOM   331  H  HH11 . ARG A 1 30  ? -5.365  -31.2   17.34   1 96.018  ? 68  ARG A HH11 1 ? 
ATOM   332  H  HH12 . ARG A 1 30  ? -3.979  -30.578 17.557  1 95.933  ? 68  ARG A HH12 1 ? 
ATOM   333  H  HH21 . ARG A 1 30  ? -5.143  -27.48  16.839  1 93.273  ? 68  ARG A HH21 1 ? 
ATOM   334  H  HH22 . ARG A 1 30  ? -4.234  -28.223 17.817  1 93.288  ? 68  ARG A HH22 1 ? 
ATOM   335  N  N    . GLY A 1 31  ? -1.084  -30.842 13.264  1 71.205  ? 69  GLY A N    1 ? 
ATOM   336  C  CA   . GLY A 1 31  ? 0.218   -31.305 13.737  1 67.681  ? 69  GLY A CA   1 ? 
ATOM   337  C  C    . GLY A 1 31  ? 1.223   -31.624 12.61   1 72.997  ? 69  GLY A C    1 ? 
ATOM   338  O  O    . GLY A 1 31  ? 2.381   -31.931 12.898  1 55.474  ? 69  GLY A O    1 ? 
ATOM   339  H  H    . GLY A 1 31  ? -1.254  -29.943 13.271  1 71.623  ? 69  GLY A H    1 ? 
ATOM   340  H  HA2  . GLY A 1 31  ? 0.601   -30.617 14.325  1 69.684  ? 69  GLY A HA2  1 ? 
ATOM   341  H  HA3  . GLY A 1 31  ? 0.087   -32.114 14.286  1 69.682  ? 69  GLY A HA3  1 ? 
ATOM   342  N  N    . GLN A 1 32  ? 0.828   -31.52  11.326  1 82.632  ? 70  GLN A N    1 ? 
ATOM   343  C  CA   . GLN A 1 32  ? 1.677   -31.997 10.238  1 81.589  ? 70  GLN A CA   1 ? 
ATOM   344  C  C    . GLN A 1 32  ? 1.912   -30.94  9.162   1 72.409  ? 70  GLN A C    1 ? 
ATOM   345  O  O    . GLN A 1 32  ? 1.106   -30.021 8.953   1 64.359  ? 70  GLN A O    1 ? 
ATOM   346  C  CB   . GLN A 1 32  ? 1.094   -33.201 9.506   1 82.762  ? 70  GLN A CB   1 ? 
ATOM   347  C  CG   . GLN A 1 32  ? 1.02    -34.457 10.358  1 75.55   ? 70  GLN A CG   1 ? 
ATOM   348  C  CD   . GLN A 1 32  ? 0.386   -35.605 9.606   1 83.326  ? 70  GLN A CD   1 ? 
ATOM   349  O  OE1  . GLN A 1 32  ? 0.322   -35.637 8.37    1 80.58   ? 70  GLN A OE1  1 ? 
ATOM   350  N  NE2  . GLN A 1 32  ? -0.116  -36.561 10.369  1 92.55   ? 70  GLN A NE2  1 ? 
ATOM   351  H  H    . GLN A 1 32  ? 0.038   -31.118 11.112  1 79.903  ? 70  GLN A H    1 ? 
ATOM   352  H  HA   . GLN A 1 32  ? 2.553   -32.276 10.601  1 79.74   ? 70  GLN A HA   1 ? 
ATOM   353  H  HB2  . GLN A 1 32  ? 0.196   -32.976 9.191   1 80.816  ? 70  GLN A HB2  1 ? 
ATOM   354  H  HB3  . GLN A 1 32  ? 1.646   -33.393 8.719   1 80.681  ? 70  GLN A HB3  1 ? 
ATOM   355  H  HG2  . GLN A 1 32  ? 1.924   -34.716 10.638  1 78.897  ? 70  GLN A HG2  1 ? 
ATOM   356  H  HG3  . GLN A 1 32  ? 0.496   -34.27  11.166  1 78.97   ? 70  GLN A HG3  1 ? 
ATOM   357  H  HE21 . GLN A 1 32  ? -0.042  -37.401 10.1    1 89.515  ? 70  GLN A HE21 1 ? 
ATOM   358  H  HE22 . GLN A 1 32  ? -0.516  -36.369 11.141  1 89.394  ? 70  GLN A HE22 1 ? 
ATOM   359  N  N    . GLY A 1 33  ? 3.024   -31.148 8.434   1 69.717  ? 71  GLY A N    1 ? 
ATOM   360  C  CA   . GLY A 1 33  ? 3.291   -30.439 7.2     1 62.268  ? 71  GLY A CA   1 ? 
ATOM   361  C  C    . GLY A 1 33  ? 4.259   -29.262 7.327   1 63.43   ? 71  GLY A C    1 ? 
ATOM   362  O  O    . GLY A 1 33  ? 4.491   -28.587 6.329   1 69.579  ? 71  GLY A O    1 ? 
ATOM   363  H  H    . GLY A 1 33  ? 3.64    -31.761 8.718   1 68.733  ? 71  GLY A H    1 ? 
ATOM   364  H  HA2  . GLY A 1 33  ? 3.665   -31.082 6.553   1 64.249  ? 71  GLY A HA2  1 ? 
ATOM   365  H  HA3  . GLY A 1 33  ? 2.441   -30.112 6.821   1 64.295  ? 71  GLY A HA3  1 ? 
ATOM   366  N  N    . VAL A 1 34  ? 4.838   -29.011 8.51    1 63.962  ? 72  VAL A N    1 ? 
ATOM   367  C  CA   . VAL A 1 34  ? 5.807   -27.937 8.662   1 64.305  ? 72  VAL A CA   1 ? 
ATOM   368  C  C    . VAL A 1 34  ? 7.156   -28.459 8.174   1 59.555  ? 72  VAL A C    1 ? 
ATOM   369  O  O    . VAL A 1 34  ? 7.638   -29.418 8.761   1 55.297  ? 72  VAL A O    1 ? 
ATOM   370  C  CB   . VAL A 1 34  ? 5.914   -27.438 10.106  1 60.374  ? 72  VAL A CB   1 ? 
ATOM   371  C  CG1  . VAL A 1 34  ? 7.055   -26.444 10.262  1 65.1    ? 72  VAL A CG1  1 ? 
ATOM   372  C  CG2  . VAL A 1 34  ? 4.597   -26.81  10.549  1 64.567  ? 72  VAL A CG2  1 ? 
ATOM   373  H  H    . VAL A 1 34  ? 4.629   -29.515 9.242   1 63.932  ? 72  VAL A H    1 ? 
ATOM   374  H  HA   . VAL A 1 34  ? 5.528   -27.187 8.115   1 62.581  ? 72  VAL A HA   1 ? 
ATOM   375  H  HB   . VAL A 1 34  ? 6.098   -28.22  10.679  1 62.717  ? 72  VAL A HB   1 ? 
ATOM   376  H  HG11 . VAL A 1 34  ? 7.037   -25.811 9.524   1 63.664  ? 72  VAL A HG11 1 ? 
ATOM   377  H  HG12 . VAL A 1 34  ? 7.908   -26.913 10.267  1 63.651  ? 72  VAL A HG12 1 ? 
ATOM   378  H  HG13 . VAL A 1 34  ? 6.954   -25.963 11.101  1 63.665  ? 72  VAL A HG13 1 ? 
ATOM   379  H  HG21 . VAL A 1 34  ? 4.675   -26.509 11.467  1 63.273  ? 72  VAL A HG21 1 ? 
ATOM   380  H  HG22 . VAL A 1 34  ? 3.884   -27.468 10.488  1 63.296  ? 72  VAL A HG22 1 ? 
ATOM   381  H  HG23 . VAL A 1 34  ? 4.388   -26.053 9.977   1 63.273  ? 72  VAL A HG23 1 ? 
ATOM   382  N  N    . PRO A 1 35  ? 7.829   -27.839 7.167   1 54.672  ? 73  PRO A N    1 ? 
ATOM   383  C  CA   . PRO A 1 35  ? 9.128   -28.347 6.698   1 54.23   ? 73  PRO A CA   1 ? 
ATOM   384  C  C    . PRO A 1 35  ? 10.166  -28.433 7.797   1 48.356  ? 73  PRO A C    1 ? 
ATOM   385  O  O    . PRO A 1 35  ? 10.189  -27.55  8.667   1 53.438  ? 73  PRO A O    1 ? 
ATOM   386  C  CB   . PRO A 1 35  ? 9.562   -27.321 5.654   1 52.97   ? 73  PRO A CB   1 ? 
ATOM   387  C  CG   . PRO A 1 35  ? 8.267   -26.741 5.151   1 59.39   ? 73  PRO A CG   1 ? 
ATOM   388  C  CD   . PRO A 1 35  ? 7.35    -26.71  6.357   1 57.411  ? 73  PRO A CD   1 ? 
ATOM   389  H  HA   . PRO A 1 35  ? 9.004   -29.224 6.278   1 52.945  ? 73  PRO A HA   1 ? 
ATOM   390  H  HB2  . PRO A 1 35  ? 10.124  -26.627 6.05    1 54.557  ? 73  PRO A HB2  1 ? 
ATOM   391  H  HB3  . PRO A 1 35  ? 10.054  -27.752 4.928   1 54.671  ? 73  PRO A HB3  1 ? 
ATOM   392  H  HG2  . PRO A 1 35  ? 8.405   -25.836 4.803   1 57.421  ? 73  PRO A HG2  1 ? 
ATOM   393  H  HG3  . PRO A 1 35  ? 7.886   -27.297 4.442   1 57.423  ? 73  PRO A HG3  1 ? 
ATOM   394  H  HD2  . PRO A 1 35  ? 7.432   -25.87  6.849   1 57.215  ? 73  PRO A HD2  1 ? 
ATOM   395  H  HD3  . PRO A 1 35  ? 6.424   -26.838 6.088   1 57.323  ? 73  PRO A HD3  1 ? 
ATOM   396  N  N    . ILE A 1 36  ? 11.031  -29.449 7.737   1 52.67   ? 74  ILE A N    1 ? 
ATOM   397  C  CA   . ILE A 1 36  ? 12.158  -29.573 8.653   1 51.083  ? 74  ILE A CA   1 ? 
ATOM   398  C  C    . ILE A 1 36  ? 13.173  -28.461 8.371   1 59.372  ? 74  ILE A C    1 ? 
ATOM   399  O  O    . ILE A 1 36  ? 13.533  -28.224 7.217   1 65.549  ? 74  ILE A O    1 ? 
ATOM   400  C  CB   . ILE A 1 36  ? 12.826  -30.958 8.539   1 66.127  ? 74  ILE A CB   1 ? 
ATOM   401  C  CG1  . ILE A 1 36  ? 11.903  -32.099 9.034   1 65.676  ? 74  ILE A CG1  1 ? 
ATOM   402  C  CG2  . ILE A 1 36  ? 14.172  -30.98  9.274   1 63.399  ? 74  ILE A CG2  1 ? 
ATOM   403  C  CD1  . ILE A 1 36  ? 12.261  -33.466 8.468   1 64.694  ? 74  ILE A CD1  1 ? 
ATOM   404  H  H    . ILE A 1 36  ? 10.918  -30.095 7.1     1 51.459  ? 74  ILE A H    1 ? 
ATOM   405  H  HA   . ILE A 1 36  ? 11.817  -29.477 9.563   1 55.399  ? 74  ILE A HA   1 ? 
ATOM   406  H  HB   . ILE A 1 36  ? 13.006  -31.119 7.591   1 62.366  ? 74  ILE A HB   1 ? 
ATOM   407  H  HG12 . ILE A 1 36  ? 11.95   -32.14  10.011  1 65.534  ? 74  ILE A HG12 1 ? 
ATOM   408  H  HG13 . ILE A 1 36  ? 10.979  -31.89  8.788   1 65.468  ? 74  ILE A HG13 1 ? 
ATOM   409  H  HG21 . ILE A 1 36  ? 14.458  -31.9   9.402   1 64.185  ? 74  ILE A HG21 1 ? 
ATOM   410  H  HG22 . ILE A 1 36  ? 14.077  -30.552 10.143  1 64.163  ? 74  ILE A HG22 1 ? 
ATOM   411  H  HG23 . ILE A 1 36  ? 14.845  -30.511 8.752   1 64.154  ? 74  ILE A HG23 1 ? 
ATOM   412  H  HD11 . ILE A 1 36  ? 12.253  -33.425 7.492   1 64.98   ? 74  ILE A HD11 1 ? 
ATOM   413  H  HD12 . ILE A 1 36  ? 11.606  -34.124 8.769   1 64.98   ? 74  ILE A HD12 1 ? 
ATOM   414  H  HD13 . ILE A 1 36  ? 13.149  -33.733 8.773   1 64.975  ? 74  ILE A HD13 1 ? 
ATOM   415  N  N    . ASN A 1 37  ? 13.608  -27.813 9.457   1 61.19   ? 75  ASN A N    1 ? 
ATOM   416  C  CA   . ASN A 1 37  ? 14.527  -26.709 9.436   1 56.832  ? 75  ASN A CA   1 ? 
ATOM   417  C  C    . ASN A 1 37  ? 15.208  -26.598 10.791  1 58.04   ? 75  ASN A C    1 ? 
ATOM   418  O  O    . ASN A 1 37  ? 14.718  -25.911 11.684  1 53.263  ? 75  ASN A O    1 ? 
ATOM   419  C  CB   . ASN A 1 37  ? 13.857  -25.406 9.015   1 60.887  ? 75  ASN A CB   1 ? 
ATOM   420  C  CG   . ASN A 1 37  ? 14.809  -24.23  9.057   1 62.888  ? 75  ASN A CG   1 ? 
ATOM   421  O  OD1  . ASN A 1 37  ? 16.03   -24.416 9.124   1 58.076  ? 75  ASN A OD1  1 ? 
ATOM   422  N  ND2  . ASN A 1 37  ? 14.286  -23.017 9.05    1 66.91   ? 75  ASN A ND2  1 ? 
ATOM   423  H  H    . ASN A 1 37  ? 13.292  -28.08  10.273  1 59.609  ? 75  ASN A H    1 ? 
ATOM   424  H  HA   . ASN A 1 37  ? 15.213  -26.906 8.758   1 58.679  ? 75  ASN A HA   1 ? 
ATOM   425  H  HB2  . ASN A 1 37  ? 13.514  -25.51  8.112   1 59.997  ? 75  ASN A HB2  1 ? 
ATOM   426  H  HB3  . ASN A 1 37  ? 13.105  -25.226 9.61    1 60.159  ? 75  ASN A HB3  1 ? 
ATOM   427  H  HD21 . ASN A 1 37  ? 14.818  -22.307 9.002   1 65.568  ? 75  ASN A HD21 1 ? 
ATOM   428  H  HD22 . ASN A 1 37  ? 13.407  -22.907 9.094   1 65.564  ? 75  ASN A HD22 1 ? 
ATOM   429  N  N    . THR A 1 38  ? 16.448  -27.097 10.864  1 60.223  ? 76  THR A N    1 ? 
ATOM   430  C  CA   . THR A 1 38  ? 17.21   -27.133 12.108  1 62.528  ? 76  THR A CA   1 ? 
ATOM   431  C  C    . THR A 1 38  ? 17.779  -25.768 12.507  1 60.729  ? 76  THR A C    1 ? 
ATOM   432  O  O    . THR A 1 38  ? 18.286  -25.658 13.616  1 67.709  ? 76  THR A O    1 ? 
ATOM   433  C  CB   . THR A 1 38  ? 18.33   -28.17  12.023  1 78.415  ? 76  THR A CB   1 ? 
ATOM   434  O  OG1  . THR A 1 38  ? 19.017  -27.897 10.802  1 86.743  ? 76  THR A OG1  1 ? 
ATOM   435  C  CG2  . THR A 1 38  ? 17.808  -29.595 12.061  1 82.239  ? 76  THR A CG2  1 ? 
ATOM   436  H  H    . THR A 1 38  ? 16.842  -27.429 10.109  1 60.273  ? 76  THR A H    1 ? 
ATOM   437  H  HA   . THR A 1 38  ? 16.597  -27.421 12.821  1 64.302  ? 76  THR A HA   1 ? 
ATOM   438  H  HB   . THR A 1 38  ? 18.956  -28.056 12.778  1 77.302  ? 76  THR A HB   1 ? 
ATOM   439  H  HG21 . THR A 1 38  ? 18.554  -30.216 12.02   1 81.089  ? 76  THR A HG21 1 ? 
ATOM   440  H  HG22 . THR A 1 38  ? 17.219  -29.746 11.302  1 81.089  ? 76  THR A HG22 1 ? 
ATOM   441  H  HG23 . THR A 1 38  ? 17.314  -29.738 12.886  1 81.089  ? 76  THR A HG23 1 ? 
ATOM   442  N  N    . ASN A 1 39  ? 17.668  -24.731 11.66   1 65.604  ? 77  ASN A N    1 ? 
ATOM   443  C  CA   . ASN A 1 39  ? 17.926  -23.351 12.068  1 67.732  ? 77  ASN A CA   1 ? 
ATOM   444  C  C    . ASN A 1 39  ? 16.639  -22.657 12.531  1 66.016  ? 77  ASN A C    1 ? 
ATOM   445  O  O    . ASN A 1 39  ? 16.537  -21.432 12.432  1 67.744  ? 77  ASN A O    1 ? 
ATOM   446  C  CB   . ASN A 1 39  ? 18.606  -22.565 10.942  1 70.545  ? 77  ASN A CB   1 ? 
ATOM   447  C  CG   . ASN A 1 39  ? 19.943  -23.146 10.532  1 72.993  ? 77  ASN A CG   1 ? 
ATOM   448  O  OD1  . ASN A 1 39  ? 20.546  -23.96  11.244  1 72.707  ? 77  ASN A OD1  1 ? 
ATOM   449  N  ND2  . ASN A 1 39  ? 20.437  -22.73  9.38    1 83.047  ? 77  ASN A ND2  1 ? 
ATOM   450  H  H    . ASN A 1 39  ? 17.472  -24.885 10.782  1 64.836  ? 77  ASN A H    1 ? 
ATOM   451  H  HA   . ASN A 1 39  ? 18.549  -23.355 12.828  1 67.497  ? 77  ASN A HA   1 ? 
ATOM   452  H  HB2  . ASN A 1 39  ? 18.014  -22.551 10.164  1 70.499  ? 77  ASN A HB2  1 ? 
ATOM   453  H  HB3  . ASN A 1 39  ? 18.745  -21.642 11.23   1 70.447  ? 77  ASN A HB3  1 ? 
ATOM   454  H  HD21 . ASN A 1 39  ? 21.225  -23.03  9.103   1 79.722  ? 77  ASN A HD21 1 ? 
ATOM   455  H  HD22 . ASN A 1 39  ? 19.988  -22.15  8.879   1 79.655  ? 77  ASN A HD22 1 ? 
ATOM   456  N  N    . SER A 1 40  ? 15.66   -23.436 13.032  1 62.714  ? 78  SER A N    1 ? 
ATOM   457  C  CA   . SER A 1 40  ? 14.438  -22.918 13.626  1 65.087  ? 78  SER A CA   1 ? 
ATOM   458  C  C    . SER A 1 40  ? 14.108  -23.757 14.87   1 58.738  ? 78  SER A C    1 ? 
ATOM   459  O  O    . SER A 1 40  ? 14.474  -24.939 14.918  1 60.198  ? 78  SER A O    1 ? 
ATOM   460  C  CB   . SER A 1 40  ? 13.315  -22.907 12.611  1 57.986  ? 78  SER A CB   1 ? 
ATOM   461  O  OG   . SER A 1 40  ? 12.891  -24.219 12.274  1 56.449  ? 78  SER A OG   1 ? 
ATOM   462  H  H    . SER A 1 40  ? 15.746  -24.342 12.996  1 64.002  ? 78  SER A H    1 ? 
ATOM   463  H  HA   . SER A 1 40  ? 14.598  -21.986 13.921  1 62.119  ? 78  SER A HA   1 ? 
ATOM   464  H  HB2  . SER A 1 40  ? 12.559  -22.408 12.975  1 59.142  ? 78  SER A HB2  1 ? 
ATOM   465  H  HB3  . SER A 1 40  ? 13.617  -22.449 11.804  1 59.142  ? 78  SER A HB3  1 ? 
ATOM   466  N  N    . SER A 1 41  ? 13.495  -23.123 15.89   1 61.079  ? 79  SER A N    1 ? 
ATOM   467  C  CA   . SER A 1 41  ? 13.193  -23.776 17.171  1 59.811  ? 79  SER A CA   1 ? 
ATOM   468  C  C    . SER A 1 41  ? 11.783  -24.363 17.183  1 57.751  ? 79  SER A C    1 ? 
ATOM   469  O  O    . SER A 1 41  ? 10.958  -24.084 16.306  1 53.823  ? 79  SER A O    1 ? 
ATOM   470  C  CB   . SER A 1 41  ? 13.368  -22.827 18.324  1 61.721  ? 79  SER A CB   1 ? 
ATOM   471  O  OG   . SER A 1 41  ? 12.342  -21.844 18.304  1 54.241  ? 79  SER A OG   1 ? 
ATOM   472  H  H    . SER A 1 41  ? 13.249  -22.25  15.783  1 60.28   ? 79  SER A H    1 ? 
ATOM   473  H  HA   . SER A 1 41  ? 13.831  -24.522 17.3    1 60.018  ? 79  SER A HA   1 ? 
ATOM   474  H  HB2  . SER A 1 41  ? 13.33   -23.324 19.163  1 59.427  ? 79  SER A HB2  1 ? 
ATOM   475  H  HB3  . SER A 1 41  ? 14.239  -22.393 18.259  1 59.427  ? 79  SER A HB3  1 ? 
ATOM   476  N  N    . ARG A 1 42  ? 11.497  -25.172 18.224  1 62.835  ? 80  ARG A N    1 ? 
ATOM   477  C  CA   . ARG A 1 42  ? 10.149  -25.656 18.511  1 58.461  ? 80  ARG A CA   1 ? 
ATOM   478  C  C    . ARG A 1 42  ? 9.087   -24.552 18.511  1 44.441  ? 80  ARG A C    1 ? 
ATOM   479  O  O    . ARG A 1 42  ? 7.967   -24.791 18.08   1 59.987  ? 80  ARG A O    1 ? 
ATOM   480  C  CB   . ARG A 1 42  ? 10.033  -26.223 19.922  1 54.375  ? 80  ARG A CB   1 ? 
ATOM   481  C  CG   . ARG A 1 42  ? 10.607  -27.621 20.049  1 69.628  ? 80  ARG A CG   1 ? 
ATOM   482  C  CD   . ARG A 1 42  ? 10.672  -27.971 21.531  1 83.647  ? 80  ARG A CD   1 ? 
ATOM   483  N  NE   . ARG A 1 42  ? 11.783  -27.238 22.152  1 84.929  ? 80  ARG A NE   1 ? 
ATOM   484  C  CZ   . ARG A 1 42  ? 12.266  -27.45  23.36   1 73.457  ? 80  ARG A CZ   1 ? 
ATOM   485  N  NH1  . ARG A 1 42  ? 13.564  -27.54  23.457  1 63.093  ? 80  ARG A NH1  1 ? 
ATOM   486  N  NH2  . ARG A 1 42  ? 11.522  -27.803 24.395  1 83.366  ? 80  ARG A NH2  1 ? 
ATOM   487  H  H    . ARG A 1 42  ? 12.178  -25.436 18.774  1 60.542  ? 80  ARG A H    1 ? 
ATOM   488  H  HA   . ARG A 1 42  ? 9.905   -26.347 17.844  1 55.654  ? 80  ARG A HA   1 ? 
ATOM   489  H  HB2  . ARG A 1 42  ? 10.495  -25.619 20.538  1 58.844  ? 80  ARG A HB2  1 ? 
ATOM   490  H  HB3  . ARG A 1 42  ? 9.088   -26.254 20.188  1 58.482  ? 80  ARG A HB3  1 ? 
ATOM   491  H  HG2  . ARG A 1 42  ? 10.031  -28.265 19.582  1 68.615  ? 80  ARG A HG2  1 ? 
ATOM   492  H  HG3  . ARG A 1 42  ? 11.509  -27.65  19.662  1 68.655  ? 80  ARG A HG3  1 ? 
ATOM   493  H  HD2  . ARG A 1 42  ? 9.832   -27.734 21.976  1 80.421  ? 80  ARG A HD2  1 ? 
ATOM   494  H  HD3  . ARG A 1 42  ? 10.818  -28.934 21.637  1 80.535  ? 80  ARG A HD3  1 ? 
ATOM   495  H  HE   . ARG A 1 42  ? 12.175  -26.606 21.696  1 81.034  ? 80  ARG A HE   1 ? 
ATOM   496  H  HH11 . ARG A 1 42  ? 14.038  -27.87  22.784  1 66.282  ? 80  ARG A HH11 1 ? 
ATOM   497  H  HH12 . ARG A 1 42  ? 13.968  -27.271 24.198  1 66.283  ? 80  ARG A HH12 1 ? 
ATOM   498  H  HH21 . ARG A 1 42  ? 10.643  -27.851 24.318  1 80.137  ? 80  ARG A HH21 1 ? 
ATOM   499  H  HH22 . ARG A 1 42  ? 11.905  -27.987 25.173  1 79.917  ? 80  ARG A HH22 1 ? 
ATOM   500  N  N    . ASP A 1 43  ? 9.439   -23.369 19.01   1 50.134  ? 81  ASP A N    1 ? 
ATOM   501  C  CA   . ASP A 1 43  ? 8.521   -22.235 19.007  1 57.152  ? 81  ASP A CA   1 ? 
ATOM   502  C  C    . ASP A 1 43  ? 8.144   -21.757 17.608  1 62.126  ? 81  ASP A C    1 ? 
ATOM   503  O  O    . ASP A 1 43  ? 7.087   -21.124 17.445  1 54.807  ? 81  ASP A O    1 ? 
ATOM   504  C  CB   . ASP A 1 43  ? 9.108   -21.085 19.802  1 57.635  ? 81  ASP A CB   1 ? 
ATOM   505  C  CG   . ASP A 1 43  ? 9.369   -21.387 21.266  1 64.342  ? 81  ASP A CG   1 ? 
ATOM   506  O  OD1  . ASP A 1 43  ? 8.583   -22.15  21.877  1 55.418  ? 81  ASP A OD1  1 ? 
ATOM   507  O  OD2  . ASP A 1 43  ? 10.351  -20.841 21.801  1 70.367  ? 81  ASP A OD2  1 ? 
ATOM   508  H  H    . ASP A 1 43  ? 10.269  -23.262 19.376  1 50.446  ? 81  ASP A H    1 ? 
ATOM   509  H  HA   . ASP A 1 43  ? 7.693   -22.513 19.46   1 56.61   ? 81  ASP A HA   1 ? 
ATOM   510  H  HB2  . ASP A 1 43  ? 9.964   -20.845 19.387  1 59.078  ? 81  ASP A HB2  1 ? 
ATOM   511  H  HB3  . ASP A 1 43  ? 8.525   -20.302 19.74   1 59.099  ? 81  ASP A HB3  1 ? 
ATOM   512  N  N    . ASP A 1 44  ? 8.987   -22.086 16.609  1 56.963  ? 82  ASP A N    1 ? 
ATOM   513  C  CA   . ASP A 1 44  ? 8.945   -21.458 15.311  1 52.579  ? 82  ASP A CA   1 ? 
ATOM   514  C  C    . ASP A 1 44  ? 8.161   -22.301 14.317  1 57.397  ? 82  ASP A C    1 ? 
ATOM   515  O  O    . ASP A 1 44  ? 7.981   -21.833 13.214  1 54.215  ? 82  ASP A O    1 ? 
ATOM   516  C  CB   . ASP A 1 44  ? 10.374  -21.183 14.857  1 53.653  ? 82  ASP A CB   1 ? 
ATOM   517  C  CG   . ASP A 1 44  ? 11.169  -20.215 15.709  1 62.08   ? 82  ASP A CG   1 ? 
ATOM   518  O  OD1  . ASP A 1 44  ? 10.551  -19.437 16.455  1 65.273  ? 82  ASP A OD1  1 ? 
ATOM   519  O  OD2  . ASP A 1 44  ? 12.398  -20.271 15.619  1 47.258  ? 82  ASP A OD2  1 ? 
ATOM   520  H  H    . ASP A 1 44  ? 9.628   -22.717 16.744  1 56.913  ? 82  ASP A H    1 ? 
ATOM   521  H  HA   . ASP A 1 44  ? 8.508   -20.589 15.392  1 54.676  ? 82  ASP A HA   1 ? 
ATOM   522  H  HB2  . ASP A 1 44  ? 10.872  -22.022 14.8    1 55.194  ? 82  ASP A HB2  1 ? 
ATOM   523  H  HB3  . ASP A 1 44  ? 10.339  -20.807 13.953  1 55.236  ? 82  ASP A HB3  1 ? 
ATOM   524  N  N    . GLN A 1 45  ? 7.631   -23.486 14.701  1 58.016  ? 83  GLN A N    1 ? 
ATOM   525  C  CA   . GLN A 1 45  ? 7.116   -24.471 13.752  1 51.726  ? 83  GLN A CA   1 ? 
ATOM   526  C  C    . GLN A 1 45  ? 5.648   -24.26  13.363  1 62.392  ? 83  GLN A C    1 ? 
ATOM   527  O  O    . GLN A 1 45  ? 4.775   -25.093 13.606  1 59.003  ? 83  GLN A O    1 ? 
ATOM   528  C  CB   . GLN A 1 45  ? 7.304   -25.879 14.317  1 51.65   ? 83  GLN A CB   1 ? 
ATOM   529  C  CG   . GLN A 1 45  ? 8.729   -26.264 14.702  1 59.155  ? 83  GLN A CG   1 ? 
ATOM   530  C  CD   . GLN A 1 45  ? 9.713   -26.041 13.557  1 57.751  ? 83  GLN A CD   1 ? 
ATOM   531  O  OE1  . GLN A 1 45  ? 9.503   -26.492 12.423  1 48.535  ? 83  GLN A OE1  1 ? 
ATOM   532  N  NE2  . GLN A 1 45  ? 10.7    -25.204 13.803  1 48.357  ? 83  GLN A NE2  1 ? 
ATOM   533  H  H    . GLN A 1 45  ? 7.563   -23.681 15.59   1 56.384  ? 83  GLN A H    1 ? 
ATOM   534  H  HA   . GLN A 1 45  ? 7.648   -24.404 12.92   1 54.767  ? 83  GLN A HA   1 ? 
ATOM   535  H  HB2  . GLN A 1 45  ? 6.743   -25.958 15.114  1 53.475  ? 83  GLN A HB2  1 ? 
ATOM   536  H  HB3  . GLN A 1 45  ? 6.978   -26.523 13.654  1 53.5    ? 83  GLN A HB3  1 ? 
ATOM   537  H  HG2  . GLN A 1 45  ? 9.003   -25.745 15.487  1 56.928  ? 83  GLN A HG2  1 ? 
ATOM   538  H  HG3  . GLN A 1 45  ? 8.749   -27.213 14.952  1 57.023  ? 83  GLN A HG3  1 ? 
ATOM   539  H  HE21 . GLN A 1 45  ? 11.435  -25.246 13.307  1 51.086  ? 83  GLN A HE21 1 ? 
ATOM   540  H  HE22 . GLN A 1 45  ? 10.641  -24.595 14.446  1 51.195  ? 83  GLN A HE22 1 ? 
ATOM   541  N  N    . ILE A 1 46  ? 5.378   -23.195 12.616  1 59.051  ? 84  ILE A N    1 ? 
ATOM   542  C  CA   . ILE A 1 46  ? 4.015   -22.879 12.269  1 53.127  ? 84  ILE A CA   1 ? 
ATOM   543  C  C    . ILE A 1 46  ? 4.022   -21.926 11.091  1 49.083  ? 84  ILE A C    1 ? 
ATOM   544  O  O    . ILE A 1 46  ? 4.783   -20.97  11.096  1 62.066  ? 84  ILE A O    1 ? 
ATOM   545  C  CB   . ILE A 1 46  ? 3.288   -22.264 13.499  1 58.157  ? 84  ILE A CB   1 ? 
ATOM   546  C  CG1  . ILE A 1 46  ? 1.868   -21.794 13.184  1 63.615  ? 84  ILE A CG1  1 ? 
ATOM   547  C  CG2  . ILE A 1 46  ? 4.091   -21.117 14.112  1 58.993  ? 84  ILE A CG2  1 ? 
ATOM   548  C  CD1  . ILE A 1 46  ? 1.043   -21.515 14.434  1 75.116  ? 84  ILE A CD1  1 ? 
ATOM   549  H  H    . ILE A 1 46  ? 6.055   -22.654 12.326  1 58.294  ? 84  ILE A H    1 ? 
ATOM   550  H  HA   . ILE A 1 46  ? 3.553   -23.695 12.008  1 54.39   ? 84  ILE A HA   1 ? 
ATOM   551  H  HB   . ILE A 1 46  ? 3.215   -22.965 14.177  1 58.41   ? 84  ILE A HB   1 ? 
ATOM   552  H  HG12 . ILE A 1 46  ? 1.913   -20.975 12.651  1 64.669  ? 84  ILE A HG12 1 ? 
ATOM   553  H  HG13 . ILE A 1 46  ? 1.418   -22.478 12.649  1 64.716  ? 84  ILE A HG13 1 ? 
ATOM   554  H  HG21 . ILE A 1 46  ? 3.689   -20.856 14.953  1 58.909  ? 84  ILE A HG21 1 ? 
ATOM   555  H  HG22 . ILE A 1 46  ? 4.09    -20.355 13.512  1 58.757  ? 84  ILE A HG22 1 ? 
ATOM   556  H  HG23 . ILE A 1 46  ? 5.005   -21.398 14.277  1 58.782  ? 84  ILE A HG23 1 ? 
ATOM   557  H  HD11 . ILE A 1 46  ? 1.132   -22.26  15.059  1 71.419  ? 84  ILE A HD11 1 ? 
ATOM   558  H  HD12 . ILE A 1 46  ? 0.104   -21.411 14.192  1 71.492  ? 84  ILE A HD12 1 ? 
ATOM   559  H  HD13 . ILE A 1 46  ? 1.355   -20.696 14.862  1 71.361  ? 84  ILE A HD13 1 ? 
ATOM   560  N  N    . GLY A 1 47  ? 3.105   -22.146 10.147  1 50.519  ? 85  GLY A N    1 ? 
ATOM   561  C  CA   . GLY A 1 47  ? 2.873   -21.164 9.099   1 55.968  ? 85  GLY A CA   1 ? 
ATOM   562  C  C    . GLY A 1 47  ? 1.939   -21.715 8.029   1 64.105  ? 85  GLY A C    1 ? 
ATOM   563  O  O    . GLY A 1 47  ? 1.078   -22.537 8.342   1 63.409  ? 85  GLY A O    1 ? 
ATOM   564  H  H    . GLY A 1 47  ? 2.618   -22.92  10.148  1 51.456  ? 85  GLY A H    1 ? 
ATOM   565  H  HA2  . GLY A 1 47  ? 2.48    -20.352 9.496   1 56.303  ? 85  GLY A HA2  1 ? 
ATOM   566  H  HA3  . GLY A 1 47  ? 3.733   -20.922 8.697   1 56.324  ? 85  GLY A HA3  1 ? 
ATOM   567  N  N    . TYR A 1 48  ? 2.137   -21.251 6.78    1 60.409  ? 86  TYR A N    1 ? 
ATOM   568  C  CA   . TYR A 1 48  ? 1.232   -21.55  5.686   1 58.293  ? 86  TYR A CA   1 ? 
ATOM   569  C  C    . TYR A 1 48  ? 1.994   -21.967 4.427   1 56.446  ? 86  TYR A C    1 ? 
ATOM   570  O  O    . TYR A 1 48  ? 3.121   -21.542 4.199   1 56.619  ? 86  TYR A O    1 ? 
ATOM   571  C  CB   . TYR A 1 48  ? 0.339   -20.339 5.42    1 50.791  ? 86  TYR A CB   1 ? 
ATOM   572  C  CG   . TYR A 1 48  ? 1.02    -19.055 4.984   1 61.738  ? 86  TYR A CG   1 ? 
ATOM   573  C  CD1  . TYR A 1 48  ? 1.492   -18.131 5.907   1 63.339  ? 86  TYR A CD1  1 ? 
ATOM   574  C  CD2  . TYR A 1 48  ? 1.182   -18.759 3.629   1 67.807  ? 86  TYR A CD2  1 ? 
ATOM   575  C  CE1  . TYR A 1 48  ? 2.131   -16.967 5.496   1 67.134  ? 86  TYR A CE1  1 ? 
ATOM   576  C  CE2  . TYR A 1 48  ? 1.816   -17.599 3.207   1 57.24   ? 86  TYR A CE2  1 ? 
ATOM   577  C  CZ   . TYR A 1 48  ? 2.296   -16.704 4.142   1 63.136  ? 86  TYR A CZ   1 ? 
ATOM   578  O  OH   . TYR A 1 48  ? 2.944   -15.577 3.728   1 59.712  ? 86  TYR A OH   1 ? 
ATOM   579  H  H    . TYR A 1 48  ? 2.867   -20.729 6.607   1 60.703  ? 86  TYR A H    1 ? 
ATOM   580  H  HA   . TYR A 1 48  ? 0.656   -22.303 5.958   1 57.135  ? 86  TYR A HA   1 ? 
ATOM   581  H  HB2  . TYR A 1 48  ? -0.311  -20.589 4.727   1 54.927  ? 86  TYR A HB2  1 ? 
ATOM   582  H  HB3  . TYR A 1 48  ? -0.172  -20.157 6.23    1 54.915  ? 86  TYR A HB3  1 ? 
ATOM   583  H  HD1  . TYR A 1 48  ? 1.398   -18.306 6.829   1 63.72   ? 86  TYR A HD1  1 ? 
ATOM   584  H  HD2  . TYR A 1 48  ? 0.871   -19.373 2.983   1 63.675  ? 86  TYR A HD2  1 ? 
ATOM   585  H  HE1  . TYR A 1 48  ? 2.461   -16.36  6.136   1 65.167  ? 86  TYR A HE1  1 ? 
ATOM   586  H  HE2  . TYR A 1 48  ? 1.932   -17.43  2.287   1 60.942  ? 86  TYR A HE2  1 ? 
ATOM   587  N  N    . TYR A 1 49  ? 1.357   -22.826 3.626   1 64.185  ? 87  TYR A N    1 ? 
ATOM   588  C  CA   . TYR A 1 49  ? 1.722   -23.003 2.236   1 66.219  ? 87  TYR A CA   1 ? 
ATOM   589  C  C    . TYR A 1 49  ? 0.837   -22.105 1.39    1 67.02   ? 87  TYR A C    1 ? 
ATOM   590  O  O    . TYR A 1 49  ? -0.378  -22.118 1.59    1 65.22   ? 87  TYR A O    1 ? 
ATOM   591  C  CB   . TYR A 1 49  ? 1.495   -24.441 1.812   1 65.464  ? 87  TYR A CB   1 ? 
ATOM   592  C  CG   . TYR A 1 49  ? 2.489   -25.446 2.358   1 67.663  ? 87  TYR A CG   1 ? 
ATOM   593  C  CD1  . TYR A 1 49  ? 2.299   -26.031 3.599   1 55.669  ? 87  TYR A CD1  1 ? 
ATOM   594  C  CD2  . TYR A 1 49  ? 3.565   -25.876 1.58    1 58.532  ? 87  TYR A CD2  1 ? 
ATOM   595  C  CE1  . TYR A 1 49  ? 3.174   -26.991 4.07    1 61.203  ? 87  TYR A CE1  1 ? 
ATOM   596  C  CE2  . TYR A 1 49  ? 4.436   -26.845 2.033   1 54.733  ? 87  TYR A CE2  1 ? 
ATOM   597  C  CZ   . TYR A 1 49  ? 4.239   -27.411 3.28    1 57.897  ? 87  TYR A CZ   1 ? 
ATOM   598  O  OH   . TYR A 1 49  ? 5.103   -28.383 3.701   1 56.907  ? 87  TYR A OH   1 ? 
ATOM   599  H  H    . TYR A 1 49  ? 0.66    -23.315 3.957   1 62.659  ? 87  TYR A H    1 ? 
ATOM   600  H  HA   . TYR A 1 49  ? 2.666   -22.776 2.105   1 65.579  ? 87  TYR A HA   1 ? 
ATOM   601  H  HB2  . TYR A 1 49  ? 0.594   -24.71  2.091   1 66.164  ? 87  TYR A HB2  1 ? 
ATOM   602  H  HB3  . TYR A 1 49  ? 1.519   -24.483 0.83    1 66.137  ? 87  TYR A HB3  1 ? 
ATOM   603  H  HD1  . TYR A 1 49  ? 1.566   -25.767 4.133   1 59.541  ? 87  TYR A HD1  1 ? 
ATOM   604  H  HD2  . TYR A 1 49  ? 3.691   -25.507 0.72    1 59.568  ? 87  TYR A HD2  1 ? 
ATOM   605  H  HE1  . TYR A 1 49  ? 3.025   -27.38  4.907   1 59.177  ? 87  TYR A HE1  1 ? 
ATOM   606  H  HE2  . TYR A 1 49  ? 5.158   -27.123 1.496   1 56.506  ? 87  TYR A HE2  1 ? 
ATOM   607  N  N    . ARG A 1 50  ? 1.454   -21.371 0.445   1 62.117  ? 88  ARG A N    1 ? 
ATOM   608  C  CA   . ARG A 1 50  ? 0.743   -20.571 -0.542  1 60.427  ? 88  ARG A CA   1 ? 
ATOM   609  C  C    . ARG A 1 50  ? 0.956   -21.164 -1.938  1 70.692  ? 88  ARG A C    1 ? 
ATOM   610  O  O    . ARG A 1 50  ? 2.093   -21.319 -2.384  1 67.074  ? 88  ARG A O    1 ? 
ATOM   611  C  CB   . ARG A 1 50  ? 1.282   -19.144 -0.476  1 64.826  ? 88  ARG A CB   1 ? 
ATOM   612  C  CG   . ARG A 1 50  ? 0.661   -18.134 -1.441  1 68.677  ? 88  ARG A CG   1 ? 
ATOM   613  C  CD   . ARG A 1 50  ? 1.171   -16.756 -1.063  1 72.079  ? 88  ARG A CD   1 ? 
ATOM   614  N  NE   . ARG A 1 50  ? 0.884   -15.695 -2.034  1 84.984  ? 88  ARG A NE   1 ? 
ATOM   615  C  CZ   . ARG A 1 50  ? 1.431   -15.556 -3.244  1 86.524  ? 88  ARG A CZ   1 ? 
ATOM   616  N  NH1  . ARG A 1 50  ? 2.291   -16.447 -3.723  1 90.964  ? 88  ARG A NH1  1 ? 
ATOM   617  N  NH2  . ARG A 1 50  ? 1.108   -14.511 -3.987  1 93.418  ? 88  ARG A NH2  1 ? 
ATOM   618  H  H    . ARG A 1 50  ? 2.368   -21.369 0.414   1 62.899  ? 88  ARG A H    1 ? 
ATOM   619  H  HA   . ARG A 1 50  ? -0.211  -20.56  -0.324  1 63.554  ? 88  ARG A HA   1 ? 
ATOM   620  H  HB2  . ARG A 1 50  ? 1.153   -18.816 0.439   1 64.686  ? 88  ARG A HB2  1 ? 
ATOM   621  H  HB3  . ARG A 1 50  ? 2.248   -19.176 -0.64   1 64.705  ? 88  ARG A HB3  1 ? 
ATOM   622  H  HG2  . ARG A 1 50  ? 0.915   -18.338 -2.364  1 68.714  ? 88  ARG A HG2  1 ? 
ATOM   623  H  HG3  . ARG A 1 50  ? -0.316  -18.156 -1.369  1 68.589  ? 88  ARG A HG3  1 ? 
ATOM   624  H  HD2  . ARG A 1 50  ? 0.777   -16.51  -0.201  1 74.128  ? 88  ARG A HD2  1 ? 
ATOM   625  H  HD3  . ARG A 1 50  ? 2.138   -16.813 -0.934  1 74.138  ? 88  ARG A HD3  1 ? 
ATOM   626  H  HE   . ARG A 1 50  ? 0.295   -15.101 -1.789  1 82.262  ? 88  ARG A HE   1 ? 
ATOM   627  H  HH11 . ARG A 1 50  ? 2.757   -16.977 -3.191  1 89.14   ? 88  ARG A HH11 1 ? 
ATOM   628  H  HH12 . ARG A 1 50  ? 2.407   -16.513 -4.6    1 89.513  ? 88  ARG A HH12 1 ? 
ATOM   629  H  HH21 . ARG A 1 50  ? 0.46    -13.963 -3.739  1 91.105  ? 88  ARG A HH21 1 ? 
ATOM   630  H  HH22 . ARG A 1 50  ? 1.538   -14.354 -4.745  1 91.193  ? 88  ARG A HH22 1 ? 
ATOM   631  N  N    . ARG A 1 51  ? -0.145  -21.479 -2.625  1 74.536  ? 89  ARG A N    1 ? 
ATOM   632  C  CA   . ARG A 1 51  ? -0.101  -21.844 -4.031  1 74.109  ? 89  ARG A CA   1 ? 
ATOM   633  C  C    . ARG A 1 51  ? 0.349   -20.63  -4.84   1 74.787  ? 89  ARG A C    1 ? 
ATOM   634  O  O    . ARG A 1 51  ? -0.213  -19.553 -4.669  1 80.495  ? 89  ARG A O    1 ? 
ATOM   635  C  CB   . ARG A 1 51  ? -1.502  -22.282 -4.45   1 72.209  ? 89  ARG A CB   1 ? 
ATOM   636  C  CG   . ARG A 1 51  ? -1.511  -23.01  -5.785  1 75.965  ? 89  ARG A CG   1 ? 
ATOM   637  C  CD   . ARG A 1 51  ? -2.895  -23.505 -6.161  1 70.415  ? 89  ARG A CD   1 ? 
ATOM   638  N  NE   . ARG A 1 51  ? -3.826  -22.375 -6.157  1 80.679  ? 89  ARG A NE   1 ? 
ATOM   639  C  CZ   . ARG A 1 51  ? -5.066  -22.358 -5.674  1 74.342  ? 89  ARG A CZ   1 ? 
ATOM   640  N  NH1  . ARG A 1 51  ? -5.733  -23.481 -5.45   1 77.075  ? 89  ARG A NH1  1 ? 
ATOM   641  N  NH2  . ARG A 1 51  ? -5.665  -21.188 -5.522  1 81.815  ? 89  ARG A NH2  1 ? 
ATOM   642  H  H    . ARG A 1 51  ? -0.956  -21.458 -2.203  1 73.309  ? 89  ARG A H    1 ? 
ATOM   643  H  HA   . ARG A 1 51  ? 0.538   -22.591 -4.149  1 73.912  ? 89  ARG A HA   1 ? 
ATOM   644  H  HB2  . ARG A 1 51  ? -1.874  -22.875 -3.766  1 73.564  ? 89  ARG A HB2  1 ? 
ATOM   645  H  HB3  . ARG A 1 51  ? -2.077  -21.489 -4.507  1 73.572  ? 89  ARG A HB3  1 ? 
ATOM   646  H  HG2  . ARG A 1 51  ? -1.189  -22.405 -6.489  1 73.807  ? 89  ARG A HG2  1 ? 
ATOM   647  H  HG3  . ARG A 1 51  ? -0.899  -23.775 -5.74   1 73.804  ? 89  ARG A HG3  1 ? 
ATOM   648  H  HD2  . ARG A 1 51  ? -2.871  -23.904 -7.055  1 74.068  ? 89  ARG A HD2  1 ? 
ATOM   649  H  HD3  . ARG A 1 51  ? -3.194  -24.183 -5.53   1 74.071  ? 89  ARG A HD3  1 ? 
ATOM   650  H  HE   . ARG A 1 51  ? -3.538  -21.638 -6.527  1 76.712  ? 89  ARG A HE   1 ? 
ATOM   651  H  HH11 . ARG A 1 51  ? -5.613  -24.186 -5.971  1 76.187  ? 89  ARG A HH11 1 ? 
ATOM   652  H  HH12 . ARG A 1 51  ? -6.308  -23.516 -4.778  1 76.23   ? 89  ARG A HH12 1 ? 
ATOM   653  H  HH21 . ARG A 1 51  ? -5.192  -20.439 -5.471  1 79.421  ? 89  ARG A HH21 1 ? 
ATOM   654  H  HH22 . ARG A 1 51  ? -6.549  -21.156 -5.466  1 79.425  ? 89  ARG A HH22 1 ? 
ATOM   655  N  N    . ALA A 1 52  ? 1.393   -20.789 -5.665  1 84.548  ? 90  ALA A N    1 ? 
ATOM   656  C  CA   . ALA A 1 52  ? 1.926   -19.684 -6.455  1 78.927  ? 90  ALA A CA   1 ? 
ATOM   657  C  C    . ALA A 1 52  ? 1.087   -19.524 -7.72   1 89.403  ? 90  ALA A C    1 ? 
ATOM   658  O  O    . ALA A 1 52  ? 0.428   -20.484 -8.149  1 82.048  ? 90  ALA A O    1 ? 
ATOM   659  C  CB   . ALA A 1 52  ? 3.384   -19.935 -6.785  1 91.956  ? 90  ALA A CB   1 ? 
ATOM   660  H  H    . ALA A 1 52  ? 1.782   -21.612 -5.747  1 80.811  ? 90  ALA A H    1 ? 
ATOM   661  H  HA   . ALA A 1 52  ? 1.86    -18.845 -5.921  1 84.147  ? 90  ALA A HA   1 ? 
ATOM   662  H  HB1  . ALA A 1 52  ? 3.893   -20.036 -5.963  1 87.89   ? 90  ALA A HB1  1 ? 
ATOM   663  H  HB2  . ALA A 1 52  ? 3.464   -20.747 -7.314  1 87.889  ? 90  ALA A HB2  1 ? 
ATOM   664  H  HB3  . ALA A 1 52  ? 3.738   -19.186 -7.292  1 87.89   ? 90  ALA A HB3  1 ? 
ATOM   665  N  N    . THR A 1 53  ? 1.118   -18.307 -8.296  1 89.982  ? 91  THR A N    1 ? 
ATOM   666  C  CA   . THR A 1 53  ? 0.557   -18.047 -9.621  1 116.507 ? 91  THR A CA   1 ? 
ATOM   667  C  C    . THR A 1 53  ? 1.67    -18.239 -10.657 1 116.523 ? 91  THR A C    1 ? 
ATOM   668  O  O    . THR A 1 53  ? 2.802   -17.822 -10.411 1 114.197 ? 91  THR A O    1 ? 
ATOM   669  C  CB   . THR A 1 53  ? -0.099  -16.663 -9.657  1 118.454 ? 91  THR A CB   1 ? 
ATOM   670  O  OG1  . THR A 1 53  ? 0.83    -15.719 -9.134  1 117.927 ? 91  THR A OG1  1 ? 
ATOM   671  C  CG2  . THR A 1 53  ? -1.363  -16.604 -8.813  1 119.594 ? 91  THR A CG2  1 ? 
ATOM   672  H  H    . THR A 1 53  ? 1.507   -17.611 -7.847  1 95.06   ? 91  THR A H    1 ? 
ATOM   673  H  HA   . THR A 1 53  ? -0.144  -18.71  -9.799  1 110.862 ? 91  THR A HA   1 ? 
ATOM   674  H  HB   . THR A 1 53  ? -0.32   -16.424 -10.589 1 118.206 ? 91  THR A HB   1 ? 
ATOM   675  H  HG21 . THR A 1 53  ? -1.757  -15.718 -8.879  1 119.147 ? 91  THR A HG21 1 ? 
ATOM   676  H  HG22 . THR A 1 53  ? -1.142  -16.79  -7.884  1 119.014 ? 91  THR A HG22 1 ? 
ATOM   677  H  HG23 . THR A 1 53  ? -1.999  -17.264 -9.133  1 118.928 ? 91  THR A HG23 1 ? 
ATOM   678  N  N    . ARG A 1 54  ? 1.322   -18.854 -11.806 1 114.749 ? 92  ARG A N    1 ? 
ATOM   679  C  CA   . ARG A 1 54  ? 2.238   -19.619 -12.657 1 126.939 ? 92  ARG A CA   1 ? 
ATOM   680  C  C    . ARG A 1 54  ? 3.455   -18.81  -13.127 1 143.894 ? 92  ARG A C    1 ? 
ATOM   681  O  O    . ARG A 1 54  ? 3.358   -17.593 -13.305 1 153.486 ? 92  ARG A O    1 ? 
ATOM   682  C  CB   . ARG A 1 54  ? 1.56    -20.084 -13.951 1 127.09  ? 92  ARG A CB   1 ? 
ATOM   683  C  CG   . ARG A 1 54  ? 0.346   -20.999 -13.874 1 135.626 ? 92  ARG A CG   1 ? 
ATOM   684  C  CD   . ARG A 1 54  ? -0.57   -20.804 -15.087 1 141.685 ? 92  ARG A CD   1 ? 
ATOM   685  N  NE   . ARG A 1 54  ? 0.115   -20.657 -16.384 1 154.134 ? 92  ARG A NE   1 ? 
ATOM   686  C  CZ   . ARG A 1 54  ? 0.024   -21.419 -17.482 1 160.496 ? 92  ARG A CZ   1 ? 
ATOM   687  N  NH1  . ARG A 1 54  ? -0.774  -22.475 -17.528 1 172.694 ? 92  ARG A NH1  1 ? 
ATOM   688  N  NH2  . ARG A 1 54  ? 0.73    -21.11  -18.563 1 148.312 ? 92  ARG A NH2  1 ? 
ATOM   689  H  H    . ARG A 1 54  ? 0.455   -18.771 -12.08  1 118.026 ? 92  ARG A H    1 ? 
ATOM   690  H  HA   . ARG A 1 54  ? 2.552   -20.409 -12.148 1 127.405 ? 92  ARG A HA   1 ? 
ATOM   691  H  HB2  . ARG A 1 54  ? 1.297   -19.273 -14.434 1 129.41  ? 92  ARG A HB2  1 ? 
ATOM   692  H  HB3  . ARG A 1 54  ? 2.235   -20.539 -14.5   1 129.176 ? 92  ARG A HB3  1 ? 
ATOM   693  H  HG2  . ARG A 1 54  ? 0.643   -21.935 -13.842 1 134.934 ? 92  ARG A HG2  1 ? 
ATOM   694  H  HG3  . ARG A 1 54  ? -0.16   -20.809 -13.054 1 134.808 ? 92  ARG A HG3  1 ? 
ATOM   695  H  HD2  . ARG A 1 54  ? -1.19   -21.558 -15.126 1 143.403 ? 92  ARG A HD2  1 ? 
ATOM   696  H  HD3  . ARG A 1 54  ? -1.106  -20     -14.927 1 143.164 ? 92  ARG A HD3  1 ? 
ATOM   697  H  HE   . ARG A 1 54  ? 0.623   -19.958 -16.472 1 152.176 ? 92  ARG A HE   1 ? 
ATOM   698  H  HH11 . ARG A 1 54  ? -0.839  -23.027 -16.836 1 168.35  ? 92  ARG A HH11 1 ? 
ATOM   699  H  HH12 . ARG A 1 54  ? -1.237  -22.635 -18.27  1 168.441 ? 92  ARG A HH12 1 ? 
ATOM   700  H  HH21 . ARG A 1 54  ? 1.311   -20.444 -18.552 1 152.045 ? 92  ARG A HH21 1 ? 
ATOM   701  H  HH22 . ARG A 1 54  ? 0.622   -21.579 -19.306 1 152.244 ? 92  ARG A HH22 1 ? 
ATOM   702  N  N    . ARG A 1 55  ? 4.545   -19.546 -13.443 1 131.4   ? 93  ARG A N    1 ? 
ATOM   703  C  CA   . ARG A 1 55  ? 5.927   -19.068 -13.518 1 125.056 ? 93  ARG A CA   1 ? 
ATOM   704  C  C    . ARG A 1 55  ? 6.034   -17.655 -14.133 1 129.961 ? 93  ARG A C    1 ? 
ATOM   705  O  O    . ARG A 1 55  ? 5.956   -17.548 -15.374 1 132.839 ? 93  ARG A O    1 ? 
ATOM   706  C  CB   . ARG A 1 55  ? 6.819   -20.08  -14.263 1 123.501 ? 93  ARG A CB   1 ? 
ATOM   707  C  CG   . ARG A 1 55  ? 7.53    -21.112 -13.399 1 119.068 ? 93  ARG A CG   1 ? 
ATOM   708  C  CD   . ARG A 1 55  ? 6.599   -22.011 -12.585 1 124.87  ? 93  ARG A CD   1 ? 
ATOM   709  N  NE   . ARG A 1 55  ? 7.303   -22.718 -11.504 1 127.014 ? 93  ARG A NE   1 ? 
ATOM   710  C  CZ   . ARG A 1 55  ? 7.2     -22.511 -10.176 1 116.545 ? 93  ARG A CZ   1 ? 
ATOM   711  N  NH1  . ARG A 1 55  ? 6.512   -21.489 -9.679  1 113.677 ? 93  ARG A NH1  1 ? 
ATOM   712  N  NH2  . ARG A 1 55  ? 7.804   -23.333 -9.33   1 106.495 ? 93  ARG A NH2  1 ? 
ATOM   713  H  H    . ARG A 1 55  ? 4.399   -20.429 -13.628 1 132.414 ? 93  ARG A H    1 ? 
ATOM   714  H  HA   . ARG A 1 55  ? 6.271   -19.012 -12.59  1 126.822 ? 93  ARG A HA   1 ? 
ATOM   715  H  HB2  . ARG A 1 55  ? 6.268   -20.556 -14.921 1 122.947 ? 93  ARG A HB2  1 ? 
ATOM   716  H  HB3  . ARG A 1 55  ? 7.501   -19.586 -14.765 1 122.924 ? 93  ARG A HB3  1 ? 
ATOM   717  H  HG2  . ARG A 1 55  ? 8.087   -21.678 -13.976 1 121.371 ? 93  ARG A HG2  1 ? 
ATOM   718  H  HG3  . ARG A 1 55  ? 8.133   -20.645 -12.781 1 121.371 ? 93  ARG A HG3  1 ? 
ATOM   719  H  HD2  . ARG A 1 55  ? 5.874   -21.486 -12.203 1 123.986 ? 93  ARG A HD2  1 ? 
ATOM   720  H  HD3  . ARG A 1 55  ? 6.2     -22.67  -13.188 1 124.025 ? 93  ARG A HD3  1 ? 
ATOM   721  H  HE   . ARG A 1 55  ? 7.856   -23.341 -11.759 1 123.709 ? 93  ARG A HE   1 ? 
ATOM   722  H  HH11 . ARG A 1 55  ? 6.544   -20.695 -10.072 1 114.666 ? 93  ARG A HH11 1 ? 
ATOM   723  H  HH12 . ARG A 1 55  ? 6.028   -21.604 -8.944  1 114.503 ? 93  ARG A HH12 1 ? 
ATOM   724  H  HH21 . ARG A 1 55  ? 8.303   -23.999 -9.627  1 109.874 ? 93  ARG A HH21 1 ? 
ATOM   725  H  HH22 . ARG A 1 55  ? 7.709   -23.217 -8.458  1 109.648 ? 93  ARG A HH22 1 ? 
ATOM   726  N  N    . LEU A 1 66  ? 0.3     -25.827 -16.313 1 124.363 ? 104 LEU A N    1 ? 
ATOM   727  C  CA   . LEU A 1 66  ? 1.068   -26.917 -15.654 1 120.796 ? 104 LEU A CA   1 ? 
ATOM   728  C  C    . LEU A 1 66  ? 0.704   -26.978 -14.171 1 107.843 ? 104 LEU A C    1 ? 
ATOM   729  O  O    . LEU A 1 66  ? 0.071   -26.065 -13.649 1 109.712 ? 104 LEU A O    1 ? 
ATOM   730  C  CB   . LEU A 1 66  ? 2.576   -26.729 -15.861 1 121.122 ? 104 LEU A CB   1 ? 
ATOM   731  C  CG   . LEU A 1 66  ? 3.136   -27.13  -17.231 1 128.126 ? 104 LEU A CG   1 ? 
ATOM   732  C  CD1  . LEU A 1 66  ? 4.542   -26.579 -17.425 1 128.008 ? 104 LEU A CD1  1 ? 
ATOM   733  C  CD2  . LEU A 1 66  ? 3.135   -28.642 -17.428 1 122.324 ? 104 LEU A CD2  1 ? 
ATOM   734  H  H    . LEU A 1 66  ? 0.509   -25.787 -17.189 1 123.228 ? 104 LEU A H    1 ? 
ATOM   735  H  HA   . LEU A 1 66  ? 0.79    -27.771 -16.069 1 118.918 ? 104 LEU A HA   1 ? 
ATOM   736  H  HB2  . LEU A 1 66  ? 2.788   -25.78  -15.706 1 122.587 ? 104 LEU A HB2  1 ? 
ATOM   737  H  HB3  . LEU A 1 66  ? 3.054   -27.248 -15.174 1 122.231 ? 104 LEU A HB3  1 ? 
ATOM   738  H  HG   . LEU A 1 66  ? 2.556   -26.732 -17.93  1 125.681 ? 104 LEU A HG   1 ? 
ATOM   739  H  HD11 . LEU A 1 66  ? 4.528   -25.612 -17.336 1 128.01  ? 104 LEU A HD11 1 ? 
ATOM   740  H  HD12 . LEU A 1 66  ? 4.865   -26.818 -18.31  1 128.035 ? 104 LEU A HD12 1 ? 
ATOM   741  H  HD13 . LEU A 1 66  ? 5.134   -26.957 -16.753 1 128.035 ? 104 LEU A HD13 1 ? 
ATOM   742  H  HD21 . LEU A 1 66  ? 2.221   -28.971 -17.434 1 123.966 ? 104 LEU A HD21 1 ? 
ATOM   743  H  HD22 . LEU A 1 66  ? 3.627   -29.065 -16.705 1 123.995 ? 104 LEU A HD22 1 ? 
ATOM   744  H  HD23 . LEU A 1 66  ? 3.559   -28.858 -18.276 1 123.996 ? 104 LEU A HD23 1 ? 
ATOM   745  N  N    . SER A 1 67  ? 1.124   -28.085 -13.539 1 99.158  ? 105 SER A N    1 ? 
ATOM   746  C  CA   . SER A 1 67  ? 0.957   -28.408 -12.128 1 91.249  ? 105 SER A CA   1 ? 
ATOM   747  C  C    . SER A 1 67  ? 1.222   -27.199 -11.22  1 92.821  ? 105 SER A C    1 ? 
ATOM   748  O  O    . SER A 1 67  ? 2.298   -26.608 -11.291 1 87.024  ? 105 SER A O    1 ? 
ATOM   749  C  CB   . SER A 1 67  ? 1.897   -29.543 -11.786 1 85.946  ? 105 SER A CB   1 ? 
ATOM   750  O  OG   . SER A 1 67  ? 1.569   -30.738 -12.486 1 86.512  ? 105 SER A OG   1 ? 
ATOM   751  H  H    . SER A 1 67  ? 1.555   -28.707 -14.052 1 99.681  ? 105 SER A H    1 ? 
ATOM   752  H  HA   . SER A 1 67  ? 0.034   -28.724 -11.994 1 91.862  ? 105 SER A HA   1 ? 
ATOM   753  H  HB2  . SER A 1 67  ? 2.802   -29.281 -12.019 1 87.69   ? 105 SER A HB2  1 ? 
ATOM   754  H  HB3  . SER A 1 67  ? 1.877   -29.707 -10.829 1 87.218  ? 105 SER A HB3  1 ? 
ATOM   755  N  N    . PRO A 1 68  ? 0.274   -26.753 -10.355 1 85.448  ? 106 PRO A N    1 ? 
ATOM   756  C  CA   . PRO A 1 68  ? 0.598   -25.725 -9.365  1 83.764  ? 106 PRO A CA   1 ? 
ATOM   757  C  C    . PRO A 1 68  ? 1.706   -26.139 -8.394  1 66.794  ? 106 PRO A C    1 ? 
ATOM   758  O  O    . PRO A 1 68  ? 1.94    -27.332 -8.181  1 67.905  ? 106 PRO A O    1 ? 
ATOM   759  C  CB   . PRO A 1 68  ? -0.746  -25.444 -8.691  1 88.586  ? 106 PRO A CB   1 ? 
ATOM   760  C  CG   . PRO A 1 68  ? -1.783  -25.917 -9.701  1 88.078  ? 106 PRO A CG   1 ? 
ATOM   761  C  CD   . PRO A 1 68  ? -1.161  -27.097 -10.371 1 80.235  ? 106 PRO A CD   1 ? 
ATOM   762  H  HA   . PRO A 1 68  ? 0.877   -24.913 -9.838  1 81.428  ? 106 PRO A HA   1 ? 
ATOM   763  H  HB2  . PRO A 1 68  ? -0.827  -25.937 -7.852  1 87.237  ? 106 PRO A HB2  1 ? 
ATOM   764  H  HB3  . PRO A 1 68  ? -0.849  -24.49  -8.509  1 87.341  ? 106 PRO A HB3  1 ? 
ATOM   765  H  HG2  . PRO A 1 68  ? -2.613  -26.174 -9.253  1 86.315  ? 106 PRO A HG2  1 ? 
ATOM   766  H  HG3  . PRO A 1 68  ? -1.98   -25.215 -10.353 1 86.315  ? 106 PRO A HG3  1 ? 
ATOM   767  H  HD2  . PRO A 1 68  ? -1.33   -27.921 -9.878  1 83.112  ? 106 PRO A HD2  1 ? 
ATOM   768  H  HD3  . PRO A 1 68  ? -1.49   -27.191 -11.286 1 83.241  ? 106 PRO A HD3  1 ? 
ATOM   769  N  N    . ARG A 1 69  ? 2.415   -25.144 -7.842  1 62.102  ? 107 ARG A N    1 ? 
ATOM   770  C  CA   . ARG A 1 69  ? 3.417   -25.378 -6.808  1 80.726  ? 107 ARG A CA   1 ? 
ATOM   771  C  C    . ARG A 1 69  ? 3.023   -24.651 -5.511  1 64.441  ? 107 ARG A C    1 ? 
ATOM   772  O  O    . ARG A 1 69  ? 2.701   -23.474 -5.523  1 60.948  ? 107 ARG A O    1 ? 
ATOM   773  C  CB   . ARG A 1 69  ? 4.816   -24.913 -7.25   1 84.939  ? 107 ARG A CB   1 ? 
ATOM   774  C  CG   . ARG A 1 69  ? 5.63    -25.845 -8.142  1 100.322 ? 107 ARG A CG   1 ? 
ATOM   775  C  CD   . ARG A 1 69  ? 5.418   -25.609 -9.629  1 117.714 ? 107 ARG A CD   1 ? 
ATOM   776  N  NE   . ARG A 1 69  ? 6.419   -26.285 -10.467 1 127.429 ? 107 ARG A NE   1 ? 
ATOM   777  C  CZ   . ARG A 1 69  ? 6.232   -27.284 -11.343 1 136.998 ? 107 ARG A CZ   1 ? 
ATOM   778  N  NH1  . ARG A 1 69  ? 5.068   -27.905 -11.453 1 131.988 ? 107 ARG A NH1  1 ? 
ATOM   779  N  NH2  . ARG A 1 69  ? 7.238   -27.691 -12.107 1 150.047 ? 107 ARG A NH2  1 ? 
ATOM   780  H  H    . ARG A 1 69  ? 2.269   -24.284 -8.117  1 67.258  ? 107 ARG A H    1 ? 
ATOM   781  H  HA   . ARG A 1 69  ? 3.468   -26.342 -6.626  1 74.279  ? 107 ARG A HA   1 ? 
ATOM   782  H  HB2  . ARG A 1 69  ? 4.708   -24.058 -7.717  1 87.498  ? 107 ARG A HB2  1 ? 
ATOM   783  H  HB3  . ARG A 1 69  ? 5.344   -24.732 -6.447  1 87.042  ? 107 ARG A HB3  1 ? 
ATOM   784  H  HG2  . ARG A 1 69  ? 6.583   -25.731 -7.936  1 100.156 ? 107 ARG A HG2  1 ? 
ATOM   785  H  HG3  . ARG A 1 69  ? 5.393   -26.776 -7.934  1 100.001 ? 107 ARG A HG3  1 ? 
ATOM   786  H  HD2  . ARG A 1 69  ? 4.522   -25.909 -9.873  1 115.875 ? 107 ARG A HD2  1 ? 
ATOM   787  H  HD3  . ARG A 1 69  ? 5.456   -24.651 -9.806  1 115.458 ? 107 ARG A HD3  1 ? 
ATOM   788  H  HE   . ARG A 1 69  ? 7.237   -26.001 -10.376 1 127.389 ? 107 ARG A HE   1 ? 
ATOM   789  H  HH11 . ARG A 1 69  ? 4.517   -27.979 -10.769 1 132.477 ? 107 ARG A HH11 1 ? 
ATOM   790  H  HH12 . ARG A 1 69  ? 4.846   -28.26  -12.233 1 133.003 ? 107 ARG A HH12 1 ? 
ATOM   791  H  HH21 . ARG A 1 69  ? 7.996   -27.236 -12.132 1 145.531 ? 107 ARG A HH21 1 ? 
ATOM   792  H  HH22 . ARG A 1 69  ? 7.154   -28.42  -12.602 1 145.602 ? 107 ARG A HH22 1 ? 
ATOM   793  N  N    . TRP A 1 70  ? 3.148   -25.334 -4.375  1 66.902  ? 108 TRP A N    1 ? 
ATOM   794  C  CA   . TRP A 1 70  ? 2.855   -24.732 -3.082  1 72.838  ? 108 TRP A CA   1 ? 
ATOM   795  C  C    . TRP A 1 70  ? 4.158   -24.49  -2.333  1 55.024  ? 108 TRP A C    1 ? 
ATOM   796  O  O    . TRP A 1 70  ? 4.936   -25.43  -2.164  1 59.28   ? 108 TRP A O    1 ? 
ATOM   797  C  CB   . TRP A 1 70  ? 1.941   -25.651 -2.265  1 71.505  ? 108 TRP A CB   1 ? 
ATOM   798  C  CG   . TRP A 1 70  ? 0.616   -25.925 -2.907  1 72.9    ? 108 TRP A CG   1 ? 
ATOM   799  C  CD1  . TRP A 1 70  ? 0.373   -26.728 -3.976  1 81.924  ? 108 TRP A CD1  1 ? 
ATOM   800  C  CD2  . TRP A 1 70  ? -0.664  -25.404 -2.492  1 88.642  ? 108 TRP A CD2  1 ? 
ATOM   801  N  NE1  . TRP A 1 70  ? -0.964  -26.753 -4.259  1 80.691  ? 108 TRP A NE1  1 ? 
ATOM   802  C  CE2  . TRP A 1 70  ? -1.627  -25.946 -3.373  1 84.166  ? 108 TRP A CE2  1 ? 
ATOM   803  C  CE3  . TRP A 1 70  ? -1.091  -24.539 -1.474  1 81.083  ? 108 TRP A CE3  1 ? 
ATOM   804  C  CZ2  . TRP A 1 70  ? -2.983  -25.64  -3.266  1 89.138  ? 108 TRP A CZ2  1 ? 
ATOM   805  C  CZ3  . TRP A 1 70  ? -2.438  -24.241 -1.367  1 76.641  ? 108 TRP A CZ3  1 ? 
ATOM   806  C  CH2  . TRP A 1 70  ? -3.369  -24.786 -2.253  1 85.749  ? 108 TRP A CH2  1 ? 
ATOM   807  H  H    . TRP A 1 70  ? 3.429   -26.203 -4.395  1 67.727  ? 108 TRP A H    1 ? 
ATOM   808  H  HA   . TRP A 1 70  ? 2.384   -23.868 -3.213  1 67.614  ? 108 TRP A HA   1 ? 
ATOM   809  H  HB2  . TRP A 1 70  ? 2.405   -26.502 -2.117  1 72.113  ? 108 TRP A HB2  1 ? 
ATOM   810  H  HB3  . TRP A 1 70  ? 1.787   -25.234 -1.39   1 72.085  ? 108 TRP A HB3  1 ? 
ATOM   811  H  HD1  . TRP A 1 70  ? 1.029   -27.206 -4.457  1 79.583  ? 108 TRP A HD1  1 ? 
ATOM   812  H  HE1  . TRP A 1 70  ? -1.331  -27.195 -4.914  1 81.758  ? 108 TRP A HE1  1 ? 
ATOM   813  H  HE3  . TRP A 1 70  ? -0.468  -24.163 -0.877  1 81.678  ? 108 TRP A HE3  1 ? 
ATOM   814  H  HZ2  . TRP A 1 70  ? -3.614  -26.013 -3.858  1 87.004  ? 108 TRP A HZ2  1 ? 
ATOM   815  H  HZ3  . TRP A 1 70  ? -2.731  -23.658 -0.688  1 79.834  ? 108 TRP A HZ3  1 ? 
ATOM   816  H  HH2  . TRP A 1 70  ? -4.28   -24.569 -2.156  1 84.266  ? 108 TRP A HH2  1 ? 
ATOM   817  N  N    . TYR A 1 71  ? 4.318   -23.26  -1.801  1 56.465  ? 109 TYR A N    1 ? 
ATOM   818  C  CA   . TYR A 1 71  ? 5.482   -22.883 -1.017  1 61.109  ? 109 TYR A CA   1 ? 
ATOM   819  C  C    . TYR A 1 71  ? 5.113   -22.491 0.413   1 59.135  ? 109 TYR A C    1 ? 
ATOM   820  O  O    . TYR A 1 71  ? 4.239   -21.659 0.634   1 62.445  ? 109 TYR A O    1 ? 
ATOM   821  C  CB   . TYR A 1 71  ? 6.183   -21.662 -1.616  1 64.16   ? 109 TYR A CB   1 ? 
ATOM   822  C  CG   . TYR A 1 71  ? 6.816   -21.872 -2.986  1 70.161  ? 109 TYR A CG   1 ? 
ATOM   823  C  CD1  . TYR A 1 71  ? 6.044   -21.854 -4.149  1 70.409  ? 109 TYR A CD1  1 ? 
ATOM   824  C  CD2  . TYR A 1 71  ? 8.194   -22.053 -3.122  1 71.574  ? 109 TYR A CD2  1 ? 
ATOM   825  C  CE1  . TYR A 1 71  ? 6.623   -22.034 -5.4    1 77.117  ? 109 TYR A CE1  1 ? 
ATOM   826  C  CE2  . TYR A 1 71  ? 8.787   -22.21  -4.371  1 69.241  ? 109 TYR A CE2  1 ? 
ATOM   827  C  CZ   . TYR A 1 71  ? 7.999   -22.198 -5.514  1 72.462  ? 109 TYR A CZ   1 ? 
ATOM   828  O  OH   . TYR A 1 71  ? 8.581   -22.378 -6.739  1 81.365  ? 109 TYR A OH   1 ? 
ATOM   829  H  H    . TYR A 1 71  ? 3.669   -22.629 -1.932  1 57.317  ? 109 TYR A H    1 ? 
ATOM   830  H  HA   . TYR A 1 71  ? 6.12    -23.636 -1      1 60.251  ? 109 TYR A HA   1 ? 
ATOM   831  H  HB2  . TYR A 1 71  ? 5.527   -20.932 -1.682  1 64.72   ? 109 TYR A HB2  1 ? 
ATOM   832  H  HB3  . TYR A 1 71  ? 6.884   -21.37  -0.993  1 64.705  ? 109 TYR A HB3  1 ? 
ATOM   833  H  HD1  . TYR A 1 71  ? 5.11    -21.734 -4.084  1 71.834  ? 109 TYR A HD1  1 ? 
ATOM   834  H  HD2  . TYR A 1 71  ? 8.738   -22.052 -2.352  1 70.521  ? 109 TYR A HD2  1 ? 
ATOM   835  H  HE1  . TYR A 1 71  ? 6.086   -22.021 -6.174  1 74.363  ? 109 TYR A HE1  1 ? 
ATOM   836  H  HE2  . TYR A 1 71  ? 9.717   -22.338 -4.441  1 70.6    ? 109 TYR A HE2  1 ? 
ATOM   837  N  N    . PHE A 1 72  ? 5.924   -22.97  1.359   1 55.553  ? 110 PHE A N    1 ? 
ATOM   838  C  CA   . PHE A 1 72  ? 5.748   -22.701 2.769   1 55.553  ? 110 PHE A CA   1 ? 
ATOM   839  C  C    . PHE A 1 72  ? 6.375   -21.367 3.188   1 57.66   ? 110 PHE A C    1 ? 
ATOM   840  O  O    . PHE A 1 72  ? 7.546   -21.086 2.886   1 57.485  ? 110 PHE A O    1 ? 
ATOM   841  C  CB   . PHE A 1 72  ? 6.376   -23.865 3.544   1 54.265  ? 110 PHE A CB   1 ? 
ATOM   842  C  CG   . PHE A 1 72  ? 6.311   -23.652 5.047   1 60.873  ? 110 PHE A CG   1 ? 
ATOM   843  C  CD1  . PHE A 1 72  ? 5.169   -23.986 5.767   1 65.389  ? 110 PHE A CD1  1 ? 
ATOM   844  C  CD2  . PHE A 1 72  ? 7.359   -23.04  5.73    1 55.392  ? 110 PHE A CD2  1 ? 
ATOM   845  C  CE1  . PHE A 1 72  ? 5.123   -23.789 7.143   1 53.432  ? 110 PHE A CE1  1 ? 
ATOM   846  C  CE2  . PHE A 1 72  ? 7.315   -22.856 7.105   1 57.802  ? 110 PHE A CE2  1 ? 
ATOM   847  C  CZ   . PHE A 1 72  ? 6.179   -23.22  7.808   1 60.699  ? 110 PHE A CZ   1 ? 
ATOM   848  H  H    . PHE A 1 72  ? 6.637   -23.484 1.107   1 56.43   ? 110 PHE A H    1 ? 
ATOM   849  H  HA   . PHE A 1 72  ? 4.788   -22.692 2.965   1 55.798  ? 110 PHE A HA   1 ? 
ATOM   850  H  HB2  . PHE A 1 72  ? 5.901   -24.695 3.313   1 55.997  ? 110 PHE A HB2  1 ? 
ATOM   851  H  HB3  . PHE A 1 72  ? 7.317   -23.958 3.274   1 56.006  ? 110 PHE A HB3  1 ? 
ATOM   852  H  HD1  . PHE A 1 72  ? 4.439   -24.391 5.325   1 61.239  ? 110 PHE A HD1  1 ? 
ATOM   853  H  HD2  . PHE A 1 72  ? 8.142   -22.807 5.256   1 57.215  ? 110 PHE A HD2  1 ? 
ATOM   854  H  HE1  . PHE A 1 72  ? 4.356   -24.03  7.62    1 57.734  ? 110 PHE A HE1  1 ? 
ATOM   855  H  HE2  . PHE A 1 72  ? 8.043   -22.456 7.553   1 57.898  ? 110 PHE A HE2  1 ? 
ATOM   856  H  HZ   . PHE A 1 72  ? 6.131   -23.076 8.74    1 58.269  ? 110 PHE A HZ   1 ? 
ATOM   857  N  N    . TYR A 1 73  ? 5.624   -20.613 4.017   1 55.286  ? 111 TYR A N    1 ? 
ATOM   858  C  CA   . TYR A 1 73  ? 6.142   -19.478 4.774   1 53.803  ? 111 TYR A CA   1 ? 
ATOM   859  C  C    . TYR A 1 73  ? 5.79    -19.602 6.256   1 59.663  ? 111 TYR A C    1 ? 
ATOM   860  O  O    . TYR A 1 73  ? 4.647   -19.914 6.583   1 58.432  ? 111 TYR A O    1 ? 
ATOM   861  C  CB   . TYR A 1 73  ? 5.485   -18.215 4.218   1 54.156  ? 111 TYR A CB   1 ? 
ATOM   862  C  CG   . TYR A 1 73  ? 5.87    -17.922 2.776   1 59.498  ? 111 TYR A CG   1 ? 
ATOM   863  C  CD1  . TYR A 1 73  ? 6.975   -17.133 2.482   1 64.002  ? 111 TYR A CD1  1 ? 
ATOM   864  C  CD2  . TYR A 1 73  ? 5.134   -18.431 1.712   1 73.836  ? 111 TYR A CD2  1 ? 
ATOM   865  C  CE1  . TYR A 1 73  ? 7.341   -16.866 1.169   1 70.739  ? 111 TYR A CE1  1 ? 
ATOM   866  C  CE2  . TYR A 1 73  ? 5.488   -18.163 0.392   1 71.197  ? 111 TYR A CE2  1 ? 
ATOM   867  C  CZ   . TYR A 1 73  ? 6.59    -17.375 0.124   1 71.064  ? 111 TYR A CZ   1 ? 
ATOM   868  O  OH   . TYR A 1 73  ? 6.915   -17.087 -1.168  1 75.573  ? 111 TYR A OH   1 ? 
ATOM   869  H  H    . TYR A 1 73  ? 4.737   -20.812 4.109   1 55.502  ? 111 TYR A H    1 ? 
ATOM   870  H  HA   . TYR A 1 73  ? 7.124   -19.413 4.666   1 55.196  ? 111 TYR A HA   1 ? 
ATOM   871  H  HB2  . TYR A 1 73  ? 4.514   -18.326 4.272   1 55.289  ? 111 TYR A HB2  1 ? 
ATOM   872  H  HB3  . TYR A 1 73  ? 5.742   -17.45  4.78    1 55.278  ? 111 TYR A HB3  1 ? 
ATOM   873  H  HD1  . TYR A 1 73  ? 7.495   -16.78  3.187   1 64.512  ? 111 TYR A HD1  1 ? 
ATOM   874  H  HD2  . TYR A 1 73  ? 4.377   -18.967 1.887   1 69.527  ? 111 TYR A HD2  1 ? 
ATOM   875  H  HE1  . TYR A 1 73  ? 8.087   -16.319 0.989   1 69.146  ? 111 TYR A HE1  1 ? 
ATOM   876  H  HE2  . TYR A 1 73  ? 4.97    -18.506 -0.316  1 71.625  ? 111 TYR A HE2  1 ? 
ATOM   877  N  N    . TYR A 1 74  ? 6.731   -19.234 7.13    1 59.38   ? 112 TYR A N    1 ? 
ATOM   878  C  CA   . TYR A 1 74  ? 6.475   -19.16  8.56    1 55.686  ? 112 TYR A CA   1 ? 
ATOM   879  C  C    . TYR A 1 74  ? 5.376   -18.127 8.829   1 63.905  ? 112 TYR A C    1 ? 
ATOM   880  O  O    . TYR A 1 74  ? 5.18    -17.208 8.035   1 59.982  ? 112 TYR A O    1 ? 
ATOM   881  C  CB   . TYR A 1 74  ? 7.755   -18.838 9.322   1 50.134  ? 112 TYR A CB   1 ? 
ATOM   882  C  CG   . TYR A 1 74  ? 8.746   -19.987 9.273   1 59.99   ? 112 TYR A CG   1 ? 
ATOM   883  C  CD1  . TYR A 1 74  ? 8.637   -21.053 10.173  1 57.146  ? 112 TYR A CD1  1 ? 
ATOM   884  C  CD2  . TYR A 1 74  ? 9.757   -20.046 8.303   1 55.573  ? 112 TYR A CD2  1 ? 
ATOM   885  C  CE1  . TYR A 1 74  ? 9.489   -22.146 10.122  1 54.201  ? 112 TYR A CE1  1 ? 
ATOM   886  C  CE2  . TYR A 1 74  ? 10.647  -21.116 8.271   1 55.817  ? 112 TYR A CE2  1 ? 
ATOM   887  C  CZ   . TYR A 1 74  ? 10.51   -22.162 9.174   1 64.794  ? 112 TYR A CZ   1 ? 
ATOM   888  O  OH   . TYR A 1 74  ? 11.337  -23.227 9.086   1 47.97   ? 112 TYR A OH   1 ? 
ATOM   889  H  H    . TYR A 1 74  ? 7.56    -19.003 6.822   1 58.429  ? 112 TYR A H    1 ? 
ATOM   890  H  HA   . TYR A 1 74  ? 6.15    -20.051 8.859   1 56.745  ? 112 TYR A HA   1 ? 
ATOM   891  H  HB2  . TYR A 1 74  ? 8.168   -18.037 8.928   1 53.531  ? 112 TYR A HB2  1 ? 
ATOM   892  H  HB3  . TYR A 1 74  ? 7.529   -18.646 10.259  1 53.59   ? 112 TYR A HB3  1 ? 
ATOM   893  H  HD1  . TYR A 1 74  ? 7.94    -21.043 10.806  1 57.017  ? 112 TYR A HD1  1 ? 
ATOM   894  H  HD2  . TYR A 1 74  ? 9.86    -19.335 7.692   1 56.602  ? 112 TYR A HD2  1 ? 
ATOM   895  H  HE1  . TYR A 1 74  ? 9.397   -22.853 10.737  1 57.093  ? 112 TYR A HE1  1 ? 
ATOM   896  H  HE2  . TYR A 1 74  ? 11.321  -21.148 7.614   1 57.621  ? 112 TYR A HE2  1 ? 
ATOM   897  N  N    . LEU A 1 75  ? 4.619   -18.342 9.925   1 60.603  ? 113 LEU A N    1 ? 
ATOM   898  C  CA   . LEU A 1 75  ? 3.503   -17.488 10.305  1 50.005  ? 113 LEU A CA   1 ? 
ATOM   899  C  C    . LEU A 1 75  ? 4.007   -16.057 10.422  1 53.456  ? 113 LEU A C    1 ? 
ATOM   900  O  O    . LEU A 1 75  ? 5.077   -15.82  10.998  1 54.425  ? 113 LEU A O    1 ? 
ATOM   901  C  CB   . LEU A 1 75  ? 2.89    -17.974 11.63   1 64.305  ? 113 LEU A CB   1 ? 
ATOM   902  C  CG   . LEU A 1 75  ? 1.825   -17.096 12.316  1 66.99   ? 113 LEU A CG   1 ? 
ATOM   903  C  CD1  . LEU A 1 75  ? 0.504   -17.113 11.564  1 64.067  ? 113 LEU A CD1  1 ? 
ATOM   904  C  CD2  . LEU A 1 75  ? 1.596   -17.563 13.746  1 65.833  ? 113 LEU A CD2  1 ? 
ATOM   905  H  H    . LEU A 1 75  ? 4.819   -19.055 10.461  1 58.776  ? 113 LEU A H    1 ? 
ATOM   906  H  HA   . LEU A 1 75  ? 2.819   -17.542 9.591   1 55.129  ? 113 LEU A HA   1 ? 
ATOM   907  H  HB2  . LEU A 1 75  ? 2.495   -18.862 11.47   1 61.282  ? 113 LEU A HB2  1 ? 
ATOM   908  H  HB3  . LEU A 1 75  ? 3.629   -18.112 12.267  1 61.31   ? 113 LEU A HB3  1 ? 
ATOM   909  H  HG   . LEU A 1 75  ? 2.15    -16.161 12.353  1 65.66   ? 113 LEU A HG   1 ? 
ATOM   910  H  HD11 . LEU A 1 75  ? 0.66    -16.897 10.633  1 64.944  ? 113 LEU A HD11 1 ? 
ATOM   911  H  HD12 . LEU A 1 75  ? -0.101  -16.458 11.951  1 64.924  ? 113 LEU A HD12 1 ? 
ATOM   912  H  HD13 . LEU A 1 75  ? 0.106   -17.997 11.627  1 64.924  ? 113 LEU A HD13 1 ? 
ATOM   913  H  HD21 . LEU A 1 75  ? 2.441   -17.601 14.218  1 66.168  ? 113 LEU A HD21 1 ? 
ATOM   914  H  HD22 . LEU A 1 75  ? 1.193   -18.447 13.737  1 66.172  ? 113 LEU A HD22 1 ? 
ATOM   915  H  HD23 . LEU A 1 75  ? 1.001   -16.942 14.198  1 66.172  ? 113 LEU A HD23 1 ? 
ATOM   916  N  N    . GLY A 1 76  ? 3.228   -15.12  9.866   1 67.373  ? 114 GLY A N    1 ? 
ATOM   917  C  CA   . GLY A 1 76  ? 3.538   -13.705 9.948   1 67.742  ? 114 GLY A CA   1 ? 
ATOM   918  C  C    . GLY A 1 76  ? 4.719   -13.301 9.07    1 72.425  ? 114 GLY A C    1 ? 
ATOM   919  O  O    . GLY A 1 76  ? 5.3     -12.241 9.296   1 65.626  ? 114 GLY A O    1 ? 
ATOM   920  H  H    . GLY A 1 76  ? 2.467   -15.369 9.424   1 63.644  ? 114 GLY A H    1 ? 
ATOM   921  H  HA2  . GLY A 1 76  ? 2.754   -13.2   9.685   1 68.684  ? 114 GLY A HA2  1 ? 
ATOM   922  H  HA3  . GLY A 1 76  ? 3.735   -13.481 10.88   1 68.596  ? 114 GLY A HA3  1 ? 
ATOM   923  N  N    . THR A 1 77  ? 5.086   -14.144 8.092   1 68.149  ? 115 THR A N    1 ? 
ATOM   924  C  CA   . THR A 1 77  ? 6.083   -13.782 7.099   1 64.301  ? 115 THR A CA   1 ? 
ATOM   925  C  C    . THR A 1 77  ? 5.445   -13.929 5.72    1 57.459  ? 115 THR A C    1 ? 
ATOM   926  O  O    . THR A 1 77  ? 4.445   -14.634 5.542   1 66.435  ? 115 THR A O    1 ? 
ATOM   927  C  CB   . THR A 1 77  ? 7.351   -14.628 7.238   1 64.813  ? 115 THR A CB   1 ? 
ATOM   928  O  OG1  . THR A 1 77  ? 7.029   -15.905 6.7     1 56.641  ? 115 THR A OG1  1 ? 
ATOM   929  C  CG2  . THR A 1 77  ? 7.853   -14.686 8.668   1 58.763  ? 115 THR A CG2  1 ? 
ATOM   930  H  H    . THR A 1 77  ? 4.692   -14.964 8.016   1 68.057  ? 115 THR A H    1 ? 
ATOM   931  H  HA   . THR A 1 77  ? 6.332   -12.842 7.222   1 63.827  ? 115 THR A HA   1 ? 
ATOM   932  H  HB   . THR A 1 77  ? 8.061   -14.222 6.686   1 61.907  ? 115 THR A HB   1 ? 
ATOM   933  H  HG21 . THR A 1 77  ? 8.728   -15.109 8.687   1 60.502  ? 115 THR A HG21 1 ? 
ATOM   934  H  HG22 . THR A 1 77  ? 7.236   -15.203 9.213   1 60.53   ? 115 THR A HG22 1 ? 
ATOM   935  H  HG23 . THR A 1 77  ? 7.923   -13.784 9.024   1 60.502  ? 115 THR A HG23 1 ? 
ATOM   936  N  N    . GLY A 1 78  ? 6.044   -13.233 4.749   1 65.763  ? 116 GLY A N    1 ? 
ATOM   937  C  CA   . GLY A 1 78  ? 5.824   -13.514 3.343   1 54.225  ? 116 GLY A CA   1 ? 
ATOM   938  C  C    . GLY A 1 78  ? 4.644   -12.769 2.737   1 63.435  ? 116 GLY A C    1 ? 
ATOM   939  O  O    . GLY A 1 78  ? 4.211   -11.748 3.276   1 69.373  ? 116 GLY A O    1 ? 
ATOM   940  H  H    . GLY A 1 78  ? 6.613   -12.552 4.97    1 61      ? 116 GLY A H    1 ? 
ATOM   941  H  HA2  . GLY A 1 78  ? 6.635   -13.274 2.859   1 58.991  ? 116 GLY A HA2  1 ? 
ATOM   942  H  HA3  . GLY A 1 78  ? 5.695   -14.484 3.24    1 59.075  ? 116 GLY A HA3  1 ? 
ATOM   943  N  N    . PRO A 1 79  ? 4.084   -13.285 1.615   1 73.869  ? 117 PRO A N    1 ? 
ATOM   944  C  CA   . PRO A 1 79  ? 2.971   -12.642 0.922   1 78.127  ? 117 PRO A CA   1 ? 
ATOM   945  C  C    . PRO A 1 79  ? 1.71    -12.416 1.761   1 79.014  ? 117 PRO A C    1 ? 
ATOM   946  O  O    . PRO A 1 79  ? 1.008   -11.431 1.531   1 83.743  ? 117 PRO A O    1 ? 
ATOM   947  C  CB   . PRO A 1 79  ? 2.659   -13.616 -0.215  1 76.67   ? 117 PRO A CB   1 ? 
ATOM   948  C  CG   . PRO A 1 79  ? 3.946   -14.386 -0.411  1 81.276  ? 117 PRO A CG   1 ? 
ATOM   949  C  CD   . PRO A 1 79  ? 4.5     -14.536 0.953   1 79.844  ? 117 PRO A CD   1 ? 
ATOM   950  H  HA   . PRO A 1 79  ? 3.272   -11.787 0.549   1 77.175  ? 117 PRO A HA   1 ? 
ATOM   951  H  HB2  . PRO A 1 79  ? 1.927   -14.217 0.024   1 78.033  ? 117 PRO A HB2  1 ? 
ATOM   952  H  HB3  . PRO A 1 79  ? 2.417   -13.132 -1.029  1 78.025  ? 117 PRO A HB3  1 ? 
ATOM   953  H  HG2  . PRO A 1 79  ? 3.777   -15.258 -0.812  1 79.844  ? 117 PRO A HG2  1 ? 
ATOM   954  H  HG3  . PRO A 1 79  ? 4.566   -13.891 -0.982  1 79.879  ? 117 PRO A HG3  1 ? 
ATOM   955  H  HD2  . PRO A 1 79  ? 4.124   -15.313 1.405   1 78.567  ? 117 PRO A HD2  1 ? 
ATOM   956  H  HD3  . PRO A 1 79  ? 5.472   -14.617 0.922   1 78.423  ? 117 PRO A HD3  1 ? 
ATOM   957  N  N    . GLU A 1 80  ? 1.423   -13.355 2.682   1 75.54   ? 118 GLU A N    1 ? 
ATOM   958  C  CA   . GLU A 1 80  ? 0.29    -13.302 3.6     1 72.378  ? 118 GLU A CA   1 ? 
ATOM   959  C  C    . GLU A 1 80  ? 0.759   -13.251 5.067   1 75.974  ? 118 GLU A C    1 ? 
ATOM   960  O  O    . GLU A 1 80  ? 0.186   -13.899 5.952   1 73.159  ? 118 GLU A O    1 ? 
ATOM   961  C  CB   . GLU A 1 80  ? -0.606  -14.493 3.26    1 79.424  ? 118 GLU A CB   1 ? 
ATOM   962  C  CG   . GLU A 1 80  ? -1.207  -14.453 1.852   1 88.089  ? 118 GLU A CG   1 ? 
ATOM   963  C  CD   . GLU A 1 80  ? -2.088  -13.276 1.428   1 90.03   ? 118 GLU A CD   1 ? 
ATOM   964  O  OE1  . GLU A 1 80  ? -2.598  -12.495 2.272   1 92.217  ? 118 GLU A OE1  1 ? 
ATOM   965  O  OE2  . GLU A 1 80  ? -2.248  -13.121 0.196   1 92.574  ? 118 GLU A OE2  1 ? 
ATOM   966  H  H    . GLU A 1 80  ? 1.959   -14.094 2.728   1 75.616  ? 118 GLU A H    1 ? 
ATOM   967  H  HA   . GLU A 1 80  ? -0.219  -12.475 3.427   1 75.216  ? 118 GLU A HA   1 ? 
ATOM   968  H  HB2  . GLU A 1 80  ? -0.088  -15.317 3.36    1 79.548  ? 118 GLU A HB2  1 ? 
ATOM   969  H  HB3  . GLU A 1 80  ? -1.339  -14.524 3.904   1 79.698  ? 118 GLU A HB3  1 ? 
ATOM   970  H  HG2  . GLU A 1 80  ? -0.473  -14.521 1.205   1 86.364  ? 118 GLU A HG2  1 ? 
ATOM   971  H  HG3  . GLU A 1 80  ? -1.741  -15.264 1.737   1 86.236  ? 118 GLU A HG3  1 ? 
ATOM   972  N  N    . ALA A 1 81  ? 1.788   -12.431 5.325   1 65.821  ? 119 ALA A N    1 ? 
ATOM   973  C  CA   . ALA A 1 81  ? 2.275   -12.123 6.66    1 64.694  ? 119 ALA A CA   1 ? 
ATOM   974  C  C    . ALA A 1 81  ? 1.162   -11.587 7.56    1 80.783  ? 119 ALA A C    1 ? 
ATOM   975  O  O    . ALA A 1 81  ? 1.085   -11.953 8.726   1 71.912  ? 119 ALA A O    1 ? 
ATOM   976  C  CB   . ALA A 1 81  ? 3.393   -11.119 6.577   1 58.201  ? 119 ALA A CB   1 ? 
ATOM   977  H  H    . ALA A 1 81  ? 2.204   -12.023 4.621   1 67.863  ? 119 ALA A H    1 ? 
ATOM   978  H  HA   . ALA A 1 81  ? 2.623   -12.965 7.064   1 66.327  ? 119 ALA A HA   1 ? 
ATOM   979  H  HB1  . ALA A 1 81  ? 4.087   -11.446 5.982   1 60.085  ? 119 ALA A HB1  1 ? 
ATOM   980  H  HB2  . ALA A 1 81  ? 3.05    -10.277 6.234   1 60.075  ? 119 ALA A HB2  1 ? 
ATOM   981  H  HB3  . ALA A 1 81  ? 3.77    -10.975 7.461   1 60.1    ? 119 ALA A HB3  1 ? 
ATOM   982  N  N    . GLY A 1 82  ? 0.273   -10.756 7.001   1 83.85   ? 120 GLY A N    1 ? 
ATOM   983  C  CA   . GLY A 1 82  ? -0.785  -10.136 7.774   1 77.394  ? 120 GLY A CA   1 ? 
ATOM   984  C  C    . GLY A 1 82  ? -1.926  -11.082 8.144   1 77.951  ? 120 GLY A C    1 ? 
ATOM   985  O  O    . GLY A 1 82  ? -2.836  -10.635 8.834   1 74.086  ? 120 GLY A O    1 ? 
ATOM   986  H  H    . GLY A 1 82  ? 0.335   -10.552 6.113   1 81.336  ? 120 GLY A H    1 ? 
ATOM   987  H  HA2  . GLY A 1 82  ? -0.397  -9.759  8.6     1 78.988  ? 120 GLY A HA2  1 ? 
ATOM   988  H  HA3  . GLY A 1 82  ? -1.152  -9.384  7.252   1 79.012  ? 120 GLY A HA3  1 ? 
ATOM   989  N  N    . LEU A 1 83  ? -1.923  -12.349 7.687   1 72.694  ? 121 LEU A N    1 ? 
ATOM   990  C  CA   . LEU A 1 83  ? -3.001  -13.257 8.06    1 78.571  ? 121 LEU A CA   1 ? 
ATOM   991  C  C    . LEU A 1 83  ? -2.746  -13.84  9.449   1 88.867  ? 121 LEU A C    1 ? 
ATOM   992  O  O    . LEU A 1 83  ? -1.607  -14.13  9.817   1 78.611  ? 121 LEU A O    1 ? 
ATOM   993  C  CB   . LEU A 1 83  ? -3.238  -14.356 7.027   1 80.236  ? 121 LEU A CB   1 ? 
ATOM   994  C  CG   . LEU A 1 83  ? -3.695  -13.858 5.647   1 88.293  ? 121 LEU A CG   1 ? 
ATOM   995  C  CD1  . LEU A 1 83  ? -3.994  -15.041 4.734   1 92.741  ? 121 LEU A CD1  1 ? 
ATOM   996  C  CD2  . LEU A 1 83  ? -4.911  -12.915 5.698   1 83.598  ? 121 LEU A CD2  1 ? 
ATOM   997  H  H    . LEU A 1 83  ? -1.277  -12.65  7.118   1 75.342  ? 121 LEU A H    1 ? 
ATOM   998  H  HA   . LEU A 1 83  ? -3.819  -12.722 8.111   1 79.85   ? 121 LEU A HA   1 ? 
ATOM   999  H  HB2  . LEU A 1 83  ? -2.399  -14.861 6.914   1 81.606  ? 121 LEU A HB2  1 ? 
ATOM   1000 H  HB3  . LEU A 1 83  ? -3.921  -14.972 7.379   1 81.631  ? 121 LEU A HB3  1 ? 
ATOM   1001 H  HG   . LEU A 1 83  ? -2.943  -13.352 5.245   1 86.669  ? 121 LEU A HG   1 ? 
ATOM   1002 H  HD11 . LEU A 1 83  ? -3.225  -15.635 4.708   1 91.316  ? 121 LEU A HD11 1 ? 
ATOM   1003 H  HD12 . LEU A 1 83  ? -4.182  -14.718 3.836   1 91.386  ? 121 LEU A HD12 1 ? 
ATOM   1004 H  HD13 . LEU A 1 83  ? -4.765  -15.526 5.071   1 91.386  ? 121 LEU A HD13 1 ? 
ATOM   1005 H  HD21 . LEU A 1 83  ? -4.646  -12.054 6.063   1 84.875  ? 121 LEU A HD21 1 ? 
ATOM   1006 H  HD22 . LEU A 1 83  ? -5.602  -13.305 6.26    1 84.931  ? 121 LEU A HD22 1 ? 
ATOM   1007 H  HD23 . LEU A 1 83  ? -5.26   -12.788 4.799   1 84.958  ? 121 LEU A HD23 1 ? 
ATOM   1008 N  N    . PRO A 1 84  ? -3.803  -13.987 10.28   1 94.961  ? 122 PRO A N    1 ? 
ATOM   1009 C  CA   . PRO A 1 84  ? -3.725  -14.876 11.424  1 86.905  ? 122 PRO A CA   1 ? 
ATOM   1010 C  C    . PRO A 1 84  ? -3.841  -16.334 10.996  1 76.971  ? 122 PRO A C    1 ? 
ATOM   1011 O  O    . PRO A 1 84  ? -4.478  -16.638 9.983   1 66.666  ? 122 PRO A O    1 ? 
ATOM   1012 C  CB   . PRO A 1 84  ? -4.889  -14.439 12.309  1 99.472  ? 122 PRO A CB   1 ? 
ATOM   1013 C  CG   . PRO A 1 84  ? -5.875  -13.788 11.353  1 102.102 ? 122 PRO A CG   1 ? 
ATOM   1014 C  CD   . PRO A 1 84  ? -5.115  -13.325 10.147  1 95.135  ? 122 PRO A CD   1 ? 
ATOM   1015 H  HA   . PRO A 1 84  ? -2.883  -14.733 11.904  1 88.444  ? 122 PRO A HA   1 ? 
ATOM   1016 H  HB2  . PRO A 1 84  ? -5.297  -15.205 12.759  1 96.941  ? 122 PRO A HB2  1 ? 
ATOM   1017 H  HB3  . PRO A 1 84  ? -4.59   -13.803 12.988  1 97.039  ? 122 PRO A HB3  1 ? 
ATOM   1018 H  HG2  . PRO A 1 84  ? -6.567  -14.427 11.089  1 99.864  ? 122 PRO A HG2  1 ? 
ATOM   1019 H  HG3  . PRO A 1 84  ? -6.311  -13.025 11.784  1 99.862  ? 122 PRO A HG3  1 ? 
ATOM   1020 H  HD2  . PRO A 1 84  ? -5.564  -13.607 9.325   1 96.399  ? 122 PRO A HD2  1 ? 
ATOM   1021 H  HD3  . PRO A 1 84  ? -5.014  -12.354 10.142  1 96.468  ? 122 PRO A HD3  1 ? 
ATOM   1022 N  N    . TYR A 1 85  ? -3.291  -17.223 11.831  1 66.57   ? 123 TYR A N    1 ? 
ATOM   1023 C  CA   . TYR A 1 85  ? -3.42   -18.658 11.653  1 69.347  ? 123 TYR A CA   1 ? 
ATOM   1024 C  C    . TYR A 1 85  ? -4.869  -19.062 11.388  1 75.571  ? 123 TYR A C    1 ? 
ATOM   1025 O  O    . TYR A 1 85  ? -5.795  -18.456 11.912  1 86.943  ? 123 TYR A O    1 ? 
ATOM   1026 C  CB   . TYR A 1 85  ? -2.899  -19.399 12.882  1 62.281  ? 123 TYR A CB   1 ? 
ATOM   1027 C  CG   . TYR A 1 85  ? -2.645  -20.856 12.557  1 71.405  ? 123 TYR A CG   1 ? 
ATOM   1028 C  CD1  . TYR A 1 85  ? -1.482  -21.25  11.896  1 74.75   ? 123 TYR A CD1  1 ? 
ATOM   1029 C  CD2  . TYR A 1 85  ? -3.595  -21.831 12.833  1 69.042  ? 123 TYR A CD2  1 ? 
ATOM   1030 C  CE1  . TYR A 1 85  ? -1.253  -22.579 11.574  1 58.884  ? 123 TYR A CE1  1 ? 
ATOM   1031 C  CE2  . TYR A 1 85  ? -3.371  -23.163 12.526  1 69.489  ? 123 TYR A CE2  1 ? 
ATOM   1032 C  CZ   . TYR A 1 85  ? -2.194  -23.535 11.895  1 63.193  ? 123 TYR A CZ   1 ? 
ATOM   1033 O  OH   . TYR A 1 85  ? -2.011  -24.852 11.612  1 73.055  ? 123 TYR A OH   1 ? 
ATOM   1034 H  H    . TYR A 1 85  ? -2.816  -16.916 12.55   1 69.715  ? 123 TYR A H    1 ? 
ATOM   1035 H  HA   . TYR A 1 85  ? -2.865  -18.918 10.87   1 68.682  ? 123 TYR A HA   1 ? 
ATOM   1036 H  HB2  . TYR A 1 85  ? -2.059  -18.984 13.179  1 65.877  ? 123 TYR A HB2  1 ? 
ATOM   1037 H  HB3  . TYR A 1 85  ? -3.561  -19.334 13.606  1 65.892  ? 123 TYR A HB3  1 ? 
ATOM   1038 H  HD1  . TYR A 1 85  ? -0.828  -20.603 11.68   1 69.822  ? 123 TYR A HD1  1 ? 
ATOM   1039 H  HD2  . TYR A 1 85  ? -4.392  -21.588 13.277  1 69.578  ? 123 TYR A HD2  1 ? 
ATOM   1040 H  HE1  . TYR A 1 85  ? -0.458  -22.825 11.15   1 63.431  ? 123 TYR A HE1  1 ? 
ATOM   1041 H  HE2  . TYR A 1 85  ? -4.015  -23.815 12.745  1 67.896  ? 123 TYR A HE2  1 ? 
ATOM   1042 N  N    . GLY A 1 86  ? -5.049  -20.075 10.534  1 79.736  ? 124 GLY A N    1 ? 
ATOM   1043 C  CA   . GLY A 1 86  ? -6.352  -20.615 10.166  1 79.768  ? 124 GLY A CA   1 ? 
ATOM   1044 C  C    . GLY A 1 86  ? -7.246  -19.719 9.295   1 75.177  ? 124 GLY A C    1 ? 
ATOM   1045 O  O    . GLY A 1 86  ? -8.304  -20.192 8.89    1 81.019  ? 124 GLY A O    1 ? 
ATOM   1046 H  H    . GLY A 1 86  ? -4.311  -20.495 10.206  1 78.198  ? 124 GLY A H    1 ? 
ATOM   1047 H  HA2  . GLY A 1 86  ? -6.204  -21.465 9.688   1 78.592  ? 124 GLY A HA2  1 ? 
ATOM   1048 H  HA3  . GLY A 1 86  ? -6.838  -20.831 10.995  1 78.691  ? 124 GLY A HA3  1 ? 
ATOM   1049 N  N    . ALA A 1 87  ? -6.86   -18.467 8.99    1 69.204  ? 125 ALA A N    1 ? 
ATOM   1050 C  CA   . ALA A 1 87  ? -7.68   -17.555 8.199   1 81.441  ? 125 ALA A CA   1 ? 
ATOM   1051 C  C    . ALA A 1 87  ? -7.966  -18.128 6.805   1 94.669  ? 125 ALA A C    1 ? 
ATOM   1052 O  O    . ALA A 1 87  ? -7.09   -18.745 6.204   1 104.111 ? 125 ALA A O    1 ? 
ATOM   1053 C  CB   . ALA A 1 87  ? -6.99   -16.208 8.099   1 77.457  ? 125 ALA A CB   1 ? 
ATOM   1054 H  H    . ALA A 1 87  ? -6.037  -18.174 9.252   1 73.326  ? 125 ALA A H    1 ? 
ATOM   1055 H  HA   . ALA A 1 87  ? -8.548  -17.438 8.674   1 80.494  ? 125 ALA A HA   1 ? 
ATOM   1056 H  HB1  . ALA A 1 87  ? -6.872  -15.835 8.989   1 78.576  ? 125 ALA A HB1  1 ? 
ATOM   1057 H  HB2  . ALA A 1 87  ? -6.121  -16.315 7.678   1 78.606  ? 125 ALA A HB2  1 ? 
ATOM   1058 H  HB3  . ALA A 1 87  ? -7.532  -15.602 7.566   1 78.606  ? 125 ALA A HB3  1 ? 
ATOM   1059 N  N    . ASN A 1 88  ? -9.193  -17.906 6.301   1 96.489  ? 126 ASN A N    1 ? 
ATOM   1060 C  CA   . ASN A 1 88  ? -9.672  -18.48  5.047   1 97.23   ? 126 ASN A CA   1 ? 
ATOM   1061 C  C    . ASN A 1 88  ? -9.28   -17.611 3.855   1 97.564  ? 126 ASN A C    1 ? 
ATOM   1062 O  O    . ASN A 1 88  ? -9.745  -16.476 3.744   1 87.339  ? 126 ASN A O    1 ? 
ATOM   1063 C  CB   . ASN A 1 88  ? -11.189 -18.636 5.015   1 99.087  ? 126 ASN A CB   1 ? 
ATOM   1064 C  CG   . ASN A 1 88  ? -11.623 -19.988 5.515   1 106.427 ? 126 ASN A CG   1 ? 
ATOM   1065 O  OD1  . ASN A 1 88  ? -11.354 -20.993 4.847   1 101.906 ? 126 ASN A OD1  1 ? 
ATOM   1066 N  ND2  . ASN A 1 88  ? -12.293 -20.036 6.659   1 113.131 ? 126 ASN A ND2  1 ? 
ATOM   1067 H  H    . ASN A 1 88  ? -9.758  -17.356 6.763   1 96.02   ? 126 ASN A H    1 ? 
ATOM   1068 H  HA   . ASN A 1 88  ? -9.276  -19.375 4.942   1 97.532  ? 126 ASN A HA   1 ? 
ATOM   1069 H  HB2  . ASN A 1 88  ? -11.598 -17.938 5.561   1 100.409 ? 126 ASN A HB2  1 ? 
ATOM   1070 H  HB3  . ASN A 1 88  ? -11.511 -18.525 4.097   1 100.307 ? 126 ASN A HB3  1 ? 
ATOM   1071 H  HD21 . ASN A 1 88  ? -12.702 -20.789 6.892   1 110.909 ? 126 ASN A HD21 1 ? 
ATOM   1072 H  HD22 . ASN A 1 88  ? -12.338 -19.33  7.196   1 110.822 ? 126 ASN A HD22 1 ? 
ATOM   1073 N  N    . LYS A 1 89  ? -8.447  -18.176 2.963   1 95.239  ? 127 LYS A N    1 ? 
ATOM   1074 C  CA   . LYS A 1 89  ? -8.083  -17.552 1.701   1 86.272  ? 127 LYS A CA   1 ? 
ATOM   1075 C  C    . LYS A 1 89  ? -7.802  -18.658 0.695   1 83.958  ? 127 LYS A C    1 ? 
ATOM   1076 O  O    . LYS A 1 89  ? -7.185  -19.662 1.046   1 79.5    ? 127 LYS A O    1 ? 
ATOM   1077 C  CB   . LYS A 1 89  ? -6.858  -16.647 1.859   1 85.812  ? 127 LYS A CB   1 ? 
ATOM   1078 C  CG   . LYS A 1 89  ? -6.699  -15.556 0.812   1 82.993  ? 127 LYS A CG   1 ? 
ATOM   1079 C  CD   . LYS A 1 89  ? -5.861  -14.399 1.341   1 90.458  ? 127 LYS A CD   1 ? 
ATOM   1080 C  CE   . LYS A 1 89  ? -5.924  -13.169 0.502   1 98.635  ? 127 LYS A CE   1 ? 
ATOM   1081 N  NZ   . LYS A 1 89  ? -5.124  -13.298 -0.71   1 97.633  ? 127 LYS A NZ   1 ? 
ATOM   1082 H  H    . LYS A 1 89  ? -8.071  -18.985 3.164   1 93.647  ? 127 LYS A H    1 ? 
ATOM   1083 H  HA   . LYS A 1 89  ? -8.85   -17.012 1.384   1 87.505  ? 127 LYS A HA   1 ? 
ATOM   1084 H  HB2  . LYS A 1 89  ? -6.906  -16.229 2.745   1 85.36   ? 127 LYS A HB2  1 ? 
ATOM   1085 H  HB3  . LYS A 1 89  ? -6.051  -17.203 1.843   1 85.156  ? 127 LYS A HB3  1 ? 
ATOM   1086 H  HG2  . LYS A 1 89  ? -6.265  -15.937 0.018   1 85.292  ? 127 LYS A HG2  1 ? 
ATOM   1087 H  HG3  . LYS A 1 89  ? -7.587  -15.226 0.554   1 85.355  ? 127 LYS A HG3  1 ? 
ATOM   1088 H  HD2  . LYS A 1 89  ? -6.163  -14.172 2.247   1 90.474  ? 127 LYS A HD2  1 ? 
ATOM   1089 H  HD3  . LYS A 1 89  ? -4.927  -14.692 1.407   1 90.551  ? 127 LYS A HD3  1 ? 
ATOM   1090 H  HE2  . LYS A 1 89  ? -6.848  -12.987 0.255   1 96.391  ? 127 LYS A HE2  1 ? 
ATOM   1091 H  HE3  . LYS A 1 89  ? -5.596  -12.411 1.018   1 96.446  ? 127 LYS A HE3  1 ? 
ATOM   1092 H  HZ1  . LYS A 1 89  ? -5.452  -13.964 -1.228  1 97.843  ? 127 LYS A HZ1  1 ? 
ATOM   1093 H  HZ2  . LYS A 1 89  ? -4.263  -13.482 -0.5    1 97.833  ? 127 LYS A HZ2  1 ? 
ATOM   1094 H  HZ3  . LYS A 1 89  ? -5.154  -12.521 -1.175  1 97.901  ? 127 LYS A HZ3  1 ? 
ATOM   1095 N  N    . ASP A 1 90  ? -8.307  -18.476 -0.531  1 91.189  ? 128 ASP A N    1 ? 
ATOM   1096 C  CA   . ASP A 1 90  ? -8.082  -19.425 -1.608  1 90.528  ? 128 ASP A CA   1 ? 
ATOM   1097 C  C    . ASP A 1 90  ? -6.584  -19.451 -1.909  1 73.659  ? 128 ASP A C    1 ? 
ATOM   1098 O  O    . ASP A 1 90  ? -5.97   -18.385 -2.041  1 70.933  ? 128 ASP A O    1 ? 
ATOM   1099 C  CB   . ASP A 1 90  ? -8.882  -19.043 -2.844  1 91.718  ? 128 ASP A CB   1 ? 
ATOM   1100 C  CG   . ASP A 1 90  ? -8.93   -20.066 -3.967  1 98.333  ? 128 ASP A CG   1 ? 
ATOM   1101 O  OD1  . ASP A 1 90  ? -8.792  -21.286 -3.684  1 91.817  ? 128 ASP A OD1  1 ? 
ATOM   1102 O  OD2  . ASP A 1 90  ? -9.099  -19.624 -5.123  1 109.583 ? 128 ASP A OD2  1 ? 
ATOM   1103 H  H    . ASP A 1 90  ? -8.815  -17.736 -0.704  1 89.272  ? 128 ASP A H    1 ? 
ATOM   1104 H  HA   . ASP A 1 90  ? -8.376  -20.311 -1.297  1 87.327  ? 128 ASP A HA   1 ? 
ATOM   1105 H  HB2  . ASP A 1 90  ? -9.805  -18.862 -2.567  1 92.898  ? 128 ASP A HB2  1 ? 
ATOM   1106 H  HB3  . ASP A 1 90  ? -8.513  -18.211 -3.207  1 92.901  ? 128 ASP A HB3  1 ? 
ATOM   1107 N  N    . GLY A 1 91  ? -6.017  -20.662 -1.928  1 73.078  ? 129 GLY A N    1 ? 
ATOM   1108 C  CA   . GLY A 1 91  ? -4.603  -20.881 -2.208  1 78.611  ? 129 GLY A CA   1 ? 
ATOM   1109 C  C    . GLY A 1 91  ? -3.696  -20.638 -1.002  1 84.586  ? 129 GLY A C    1 ? 
ATOM   1110 O  O    . GLY A 1 91  ? -2.505  -20.446 -1.202  1 70.898  ? 129 GLY A O    1 ? 
ATOM   1111 H  H    . GLY A 1 91  ? -6.534  -21.398 -1.763  1 74.646  ? 129 GLY A H    1 ? 
ATOM   1112 H  HA2  . GLY A 1 91  ? -4.484  -21.809 -2.518  1 78.516  ? 129 GLY A HA2  1 ? 
ATOM   1113 H  HA3  . GLY A 1 91  ? -4.328  -20.285 -2.944  1 78.463  ? 129 GLY A HA3  1 ? 
ATOM   1114 N  N    . ILE A 1 92  ? -4.263  -20.629 0.22    1 78.31   ? 130 ILE A N    1 ? 
ATOM   1115 C  CA   . ILE A 1 92  ? -3.532  -20.53  1.478   1 70.339  ? 130 ILE A CA   1 ? 
ATOM   1116 C  C    . ILE A 1 92  ? -4.059  -21.646 2.373   1 66.234  ? 130 ILE A C    1 ? 
ATOM   1117 O  O    . ILE A 1 92  ? -5.269  -21.806 2.486   1 83.475  ? 130 ILE A O    1 ? 
ATOM   1118 C  CB   . ILE A 1 92  ? -3.727  -19.141 2.12    1 68.275  ? 130 ILE A CB   1 ? 
ATOM   1119 C  CG1  . ILE A 1 92  ? -3.168  -18.007 1.25    1 73.454  ? 130 ILE A CG1  1 ? 
ATOM   1120 C  CG2  . ILE A 1 92  ? -3.162  -19.07  3.54    1 71.173  ? 130 ILE A CG2  1 ? 
ATOM   1121 C  CD1  . ILE A 1 92  ? -1.647  -17.978 1.128   1 68.908  ? 130 ILE A CD1  1 ? 
ATOM   1122 H  H    . ILE A 1 92  ? -5.172  -20.695 0.276   1 77.69   ? 130 ILE A H    1 ? 
ATOM   1123 H  HA   . ILE A 1 92  ? -2.585  -20.672 1.314   1 70.664  ? 130 ILE A HA   1 ? 
ATOM   1124 H  HB   . ILE A 1 92  ? -4.69   -18.998 2.19    1 70.238  ? 130 ILE A HB   1 ? 
ATOM   1125 H  HG12 . ILE A 1 92  ? -3.552  -18.076 0.353   1 71.291  ? 130 ILE A HG12 1 ? 
ATOM   1126 H  HG13 . ILE A 1 92  ? -3.463  -17.154 1.629   1 71.215  ? 130 ILE A HG13 1 ? 
ATOM   1127 H  HG21 . ILE A 1 92  ? -3.104  -18.14  3.82    1 70.318  ? 130 ILE A HG21 1 ? 
ATOM   1128 H  HG22 . ILE A 1 92  ? -2.274  -19.466 3.557   1 70.304  ? 130 ILE A HG22 1 ? 
ATOM   1129 H  HG23 . ILE A 1 92  ? -3.743  -19.551 4.153   1 70.293  ? 130 ILE A HG23 1 ? 
ATOM   1130 H  HD11 . ILE A 1 92  ? -1.237  -17.815 1.999   1 70.222  ? 130 ILE A HD11 1 ? 
ATOM   1131 H  HD12 . ILE A 1 92  ? -1.398  -17.259 0.519   1 70.298  ? 130 ILE A HD12 1 ? 
ATOM   1132 H  HD13 . ILE A 1 92  ? -1.321  -18.825 0.773   1 70.186  ? 130 ILE A HD13 1 ? 
ATOM   1133 N  N    . ILE A 1 93  ? -3.159  -22.445 2.952   1 69.423  ? 131 ILE A N    1 ? 
ATOM   1134 C  CA   . ILE A 1 93  ? -3.529  -23.506 3.879   1 72.057  ? 131 ILE A CA   1 ? 
ATOM   1135 C  C    . ILE A 1 93  ? -2.525  -23.476 5.01    1 73.896  ? 131 ILE A C    1 ? 
ATOM   1136 O  O    . ILE A 1 93  ? -1.418  -22.981 4.832   1 74.624  ? 131 ILE A O    1 ? 
ATOM   1137 C  CB   . ILE A 1 93  ? -3.627  -24.895 3.217   1 70.311  ? 131 ILE A CB   1 ? 
ATOM   1138 C  CG1  . ILE A 1 93  ? -2.265  -25.426 2.708   1 78.662  ? 131 ILE A CG1  1 ? 
ATOM   1139 C  CG2  . ILE A 1 93  ? -4.694  -24.859 2.117   1 69.084  ? 131 ILE A CG2  1 ? 
ATOM   1140 C  CD1  . ILE A 1 93  ? -1.543  -26.385 3.649   1 69.331  ? 131 ILE A CD1  1 ? 
ATOM   1141 H  H    . ILE A 1 93  ? -2.273  -22.333 2.755   1 69.285  ? 131 ILE A H    1 ? 
ATOM   1142 H  HA   . ILE A 1 93  ? -4.402  -23.297 4.257   1 71.51   ? 131 ILE A HA   1 ? 
ATOM   1143 H  HB   . ILE A 1 93  ? -3.941  -25.518 3.903   1 71.865  ? 131 ILE A HB   1 ? 
ATOM   1144 H  HG12 . ILE A 1 93  ? -2.409  -25.885 1.856   1 74.455  ? 131 ILE A HG12 1 ? 
ATOM   1145 H  HG13 . ILE A 1 93  ? -1.679  -24.663 2.532   1 74.399  ? 131 ILE A HG13 1 ? 
ATOM   1146 H  HG21 . ILE A 1 93  ? -4.877  -25.757 1.812   1 69.523  ? 131 ILE A HG21 1 ? 
ATOM   1147 H  HG22 . ILE A 1 93  ? -4.376  -24.325 1.37    1 69.456  ? 131 ILE A HG22 1 ? 
ATOM   1148 H  HG23 . ILE A 1 93  ? -5.511  -24.469 2.469   1 69.51   ? 131 ILE A HG23 1 ? 
ATOM   1149 H  HD11 . ILE A 1 93  ? -1.33   -25.947 4.493   1 71.947  ? 131 ILE A HD11 1 ? 
ATOM   1150 H  HD12 . ILE A 1 93  ? -0.715  -26.682 3.224   1 71.96   ? 131 ILE A HD12 1 ? 
ATOM   1151 H  HD13 . ILE A 1 93  ? -2.111  -27.159 3.822   1 71.954  ? 131 ILE A HD13 1 ? 
ATOM   1152 N  N    . TRP A 1 94  ? -2.939  -24.009 6.159   1 71.924  ? 132 TRP A N    1 ? 
ATOM   1153 C  CA   . TRP A 1 94  ? -2.235  -23.752 7.396   1 57.613  ? 132 TRP A CA   1 ? 
ATOM   1154 C  C    . TRP A 1 94  ? -1.717  -25.039 7.998   1 54.648  ? 132 TRP A C    1 ? 
ATOM   1155 O  O    . TRP A 1 94  ? -2.346  -26.077 7.86    1 71.947  ? 132 TRP A O    1 ? 
ATOM   1156 C  CB   . TRP A 1 94  ? -3.156  -23.006 8.358   1 59.904  ? 132 TRP A CB   1 ? 
ATOM   1157 C  CG   . TRP A 1 94  ? -3.476  -21.613 7.899   1 55.223  ? 132 TRP A CG   1 ? 
ATOM   1158 C  CD1  . TRP A 1 94  ? -4.617  -21.218 7.271   1 55.942  ? 132 TRP A CD1  1 ? 
ATOM   1159 C  CD2  . TRP A 1 94  ? -2.672  -20.42  8.062   1 55.291  ? 132 TRP A CD2  1 ? 
ATOM   1160 N  NE1  . TRP A 1 94  ? -4.583  -19.869 7.028   1 56.208  ? 132 TRP A NE1  1 ? 
ATOM   1161 C  CE2  . TRP A 1 94  ? -3.416  -19.349 7.515   1 53.784  ? 132 TRP A CE2  1 ? 
ATOM   1162 C  CE3  . TRP A 1 94  ? -1.405  -20.149 8.602   1 67.295  ? 132 TRP A CE3  1 ? 
ATOM   1163 C  CZ2  . TRP A 1 94  ? -2.931  -18.044 7.483   1 67.754  ? 132 TRP A CZ2  1 ? 
ATOM   1164 C  CZ3  . TRP A 1 94  ? -0.923  -18.853 8.575   1 58.072  ? 132 TRP A CZ3  1 ? 
ATOM   1165 C  CH2  . TRP A 1 94  ? -1.687  -17.815 8.043   1 67.192  ? 132 TRP A CH2  1 ? 
ATOM   1166 H  H    . TRP A 1 94  ? -3.683  -24.54  6.175   1 68.876  ? 132 TRP A H    1 ? 
ATOM   1167 H  HA   . TRP A 1 94  ? -1.46   -23.159 7.21    1 60.076  ? 132 TRP A HA   1 ? 
ATOM   1168 H  HB2  . TRP A 1 94  ? -3.99   -23.513 8.451   1 58.272  ? 132 TRP A HB2  1 ? 
ATOM   1169 H  HB3  . TRP A 1 94  ? -2.719  -22.957 9.232   1 58.273  ? 132 TRP A HB3  1 ? 
ATOM   1170 H  HD1  . TRP A 1 94  ? -5.34   -21.782 7.046   1 55.891  ? 132 TRP A HD1  1 ? 
ATOM   1171 H  HE1  . TRP A 1 94  ? -5.218  -19.411 6.641   1 55.66   ? 132 TRP A HE1  1 ? 
ATOM   1172 H  HE3  . TRP A 1 94  ? -0.892  -20.841 8.979   1 62.132  ? 132 TRP A HE3  1 ? 
ATOM   1173 H  HZ2  . TRP A 1 94  ? -3.44   -17.343 7.112   1 64.007  ? 132 TRP A HZ2  1 ? 
ATOM   1174 H  HZ3  . TRP A 1 94  ? -0.081  -18.662 8.954   1 62.129  ? 132 TRP A HZ3  1 ? 
ATOM   1175 H  HH2  . TRP A 1 94  ? -1.336  -16.942 8.035   1 64.957  ? 132 TRP A HH2  1 ? 
ATOM   1176 N  N    . VAL A 1 95  ? -0.536  -24.936 8.635   1 55.787  ? 133 VAL A N    1 ? 
ATOM   1177 C  CA   . VAL A 1 95  ? 0.152   -26.054 9.247   1 58.89   ? 133 VAL A CA   1 ? 
ATOM   1178 C  C    . VAL A 1 95  ? 0.821   -25.571 10.53   1 48.249  ? 133 VAL A C    1 ? 
ATOM   1179 O  O    . VAL A 1 95  ? 1.266   -24.431 10.624  1 56.388  ? 133 VAL A O    1 ? 
ATOM   1180 C  CB   . VAL A 1 95  ? 1.196   -26.719 8.319   1 62.876  ? 133 VAL A CB   1 ? 
ATOM   1181 C  CG1  . VAL A 1 95  ? 0.522   -27.502 7.191   1 71.614  ? 133 VAL A CG1  1 ? 
ATOM   1182 C  CG2  . VAL A 1 95  ? 2.198   -25.706 7.766   1 57.212  ? 133 VAL A CG2  1 ? 
ATOM   1183 H  H    . VAL A 1 95  ? -0.137  -24.115 8.686   1 56.192  ? 133 VAL A H    1 ? 
ATOM   1184 H  HA   . VAL A 1 95  ? -0.506  -26.719 9.482   1 56.916  ? 133 VAL A HA   1 ? 
ATOM   1185 H  HB   . VAL A 1 95  ? 1.7     -27.366 8.867   1 62.454  ? 133 VAL A HB   1 ? 
ATOM   1186 H  HG11 . VAL A 1 95  ? 0.076   -26.884 6.588   1 68.848  ? 133 VAL A HG11 1 ? 
ATOM   1187 H  HG12 . VAL A 1 95  ? -0.131  -28.116 7.566   1 68.884  ? 133 VAL A HG12 1 ? 
ATOM   1188 H  HG13 . VAL A 1 95  ? 1.194   -28.004 6.699   1 68.904  ? 133 VAL A HG13 1 ? 
ATOM   1189 H  HG21 . VAL A 1 95  ? 2.831   -26.163 7.187   1 58.805  ? 133 VAL A HG21 1 ? 
ATOM   1190 H  HG22 . VAL A 1 95  ? 2.678   -25.288 8.497   1 58.76   ? 133 VAL A HG22 1 ? 
ATOM   1191 H  HG23 . VAL A 1 95  ? 1.73    -25.025 7.254   1 58.789  ? 133 VAL A HG23 1 ? 
ATOM   1192 N  N    . ALA A 1 96  ? 0.934   -26.474 11.501  1 63.723  ? 134 ALA A N    1 ? 
ATOM   1193 C  CA   . ALA A 1 96  ? 1.683   -26.189 12.71   1 59.767  ? 134 ALA A CA   1 ? 
ATOM   1194 C  C    . ALA A 1 96  ? 2.094   -27.495 13.353  1 62.271  ? 134 ALA A C    1 ? 
ATOM   1195 O  O    . ALA A 1 96  ? 1.436   -28.507 13.136  1 73.129  ? 134 ALA A O    1 ? 
ATOM   1196 C  CB   . ALA A 1 96  ? 0.847   -25.356 13.666  1 70.207  ? 134 ALA A CB   1 ? 
ATOM   1197 H  H    . ALA A 1 96  ? 0.525   -27.288 11.415  1 58.774  ? 134 ALA A H    1 ? 
ATOM   1198 H  HA   . ALA A 1 96  ? 2.503   -25.69  12.464  1 62.603  ? 134 ALA A HA   1 ? 
ATOM   1199 H  HB1  . ALA A 1 96  ? 0.56    -24.539 13.229  1 66.782  ? 134 ALA A HB1  1 ? 
ATOM   1200 H  HB2  . ALA A 1 96  ? 0.063   -25.863 13.94   1 66.906  ? 134 ALA A HB2  1 ? 
ATOM   1201 H  HB3  . ALA A 1 96  ? 1.374   -25.132 14.452  1 66.908  ? 134 ALA A HB3  1 ? 
ATOM   1202 N  N    . THR A 1 97  ? 3.21    -27.452 14.09   1 63.785  ? 135 THR A N    1 ? 
ATOM   1203 C  CA   . THR A 1 97  ? 3.659   -28.552 14.921  1 68.032  ? 135 THR A CA   1 ? 
ATOM   1204 C  C    . THR A 1 97  ? 3.239   -28.236 16.354  1 69.514  ? 135 THR A C    1 ? 
ATOM   1205 O  O    . THR A 1 97  ? 3.171   -27.06  16.727  1 64.786  ? 135 THR A O    1 ? 
ATOM   1206 C  CB   . THR A 1 97  ? 5.171   -28.673 14.745  1 69.539  ? 135 THR A CB   1 ? 
ATOM   1207 O  OG1  . THR A 1 97  ? 5.323   -28.988 13.361  1 76.174  ? 135 THR A OG1  1 ? 
ATOM   1208 C  CG2  . THR A 1 97  ? 5.834   -29.757 15.569  1 68.919  ? 135 THR A CG2  1 ? 
ATOM   1209 H  H    . THR A 1 97  ? 3.714   -26.689 14.08   1 64.386  ? 135 THR A H    1 ? 
ATOM   1210 H  HA   . THR A 1 97  ? 3.235   -29.387 14.629  1 67.76   ? 135 THR A HA   1 ? 
ATOM   1211 H  HB   . THR A 1 97  ? 5.591   -27.809 14.952  1 69.968  ? 135 THR A HB   1 ? 
ATOM   1212 H  HG21 . THR A 1 97  ? 6.768   -29.834 15.31   1 69.105  ? 135 THR A HG21 1 ? 
ATOM   1213 H  HG22 . THR A 1 97  ? 5.385   -30.605 15.412  1 69.105  ? 135 THR A HG22 1 ? 
ATOM   1214 H  HG23 . THR A 1 97  ? 5.78    -29.533 16.512  1 69.115  ? 135 THR A HG23 1 ? 
ATOM   1215 N  N    . GLU A 1 98  ? 2.99    -29.285 17.156  1 75.32   ? 136 GLU A N    1 ? 
ATOM   1216 C  CA   . GLU A 1 98  ? 2.668   -29.092 18.563  1 76.595  ? 136 GLU A CA   1 ? 
ATOM   1217 C  C    . GLU A 1 98  ? 3.857   -28.415 19.237  1 66.198  ? 136 GLU A C    1 ? 
ATOM   1218 O  O    . GLU A 1 98  ? 5.002   -28.75  18.953  1 71.061  ? 136 GLU A O    1 ? 
ATOM   1219 C  CB   . GLU A 1 98  ? 2.296   -30.376 19.305  1 90.327  ? 136 GLU A CB   1 ? 
ATOM   1220 C  CG   . GLU A 1 98  ? 1.767   -30.082 20.709  1 103.511 ? 136 GLU A CG   1 ? 
ATOM   1221 C  CD   . GLU A 1 98  ? 1.128   -31.213 21.492  1 112.725 ? 136 GLU A CD   1 ? 
ATOM   1222 O  OE1  . GLU A 1 98  ? 1.14    -32.378 21.039  1 125.428 ? 136 GLU A OE1  1 ? 
ATOM   1223 O  OE2  . GLU A 1 98  ? 0.593   -30.894 22.576  1 109.131 ? 136 GLU A OE2  1 ? 
ATOM   1224 H  H    . GLU A 1 98  ? 3.022   -30.134 16.821  1 74.169  ? 136 GLU A H    1 ? 
ATOM   1225 H  HA   . GLU A 1 98  ? 1.887   -28.484 18.607  1 76.448  ? 136 GLU A HA   1 ? 
ATOM   1226 H  HB2  . GLU A 1 98  ? 1.614   -30.857 18.79   1 89.705  ? 136 GLU A HB2  1 ? 
ATOM   1227 H  HB3  . GLU A 1 98  ? 3.088   -30.951 19.366  1 89.656  ? 136 GLU A HB3  1 ? 
ATOM   1228 H  HG2  . GLU A 1 98  ? 2.504   -29.732 21.253  1 102.092 ? 136 GLU A HG2  1 ? 
ATOM   1229 H  HG3  . GLU A 1 98  ? 1.106   -29.364 20.64   1 102.101 ? 136 GLU A HG3  1 ? 
ATOM   1230 N  N    . GLY A 1 99  ? 3.574   -27.425 20.087  1 59.951  ? 137 GLY A N    1 ? 
ATOM   1231 C  CA   . GLY A 1 99  ? 4.59    -26.637 20.759  1 54.884  ? 137 GLY A CA   1 ? 
ATOM   1232 C  C    . GLY A 1 99  ? 4.752   -25.252 20.128  1 56.692  ? 137 GLY A C    1 ? 
ATOM   1233 O  O    . GLY A 1 99  ? 5.228   -24.361 20.812  1 63.844  ? 137 GLY A O    1 ? 
ATOM   1234 H  H    . GLY A 1 99  ? 2.698   -27.235 20.269  1 60.384  ? 137 GLY A H    1 ? 
ATOM   1235 H  HA2  . GLY A 1 99  ? 4.332   -26.531 21.705  1 56.485  ? 137 GLY A HA2  1 ? 
ATOM   1236 H  HA3  . GLY A 1 99  ? 5.454   -27.11  20.739  1 56.581  ? 137 GLY A HA3  1 ? 
ATOM   1237 N  N    . ALA A 1 100 ? 4.291   -25.035 18.878  1 55.293  ? 138 ALA A N    1 ? 
ATOM   1238 C  CA   . ALA A 1 100 ? 4.623   -23.799 18.186  1 54.357  ? 138 ALA A CA   1 ? 
ATOM   1239 C  C    . ALA A 1 100 ? 3.909   -22.635 18.866  1 64.493  ? 138 ALA A C    1 ? 
ATOM   1240 O  O    . ALA A 1 100 ? 2.794   -22.814 19.347  1 57.995  ? 138 ALA A O    1 ? 
ATOM   1241 C  CB   . ALA A 1 100 ? 4.262   -23.917 16.73   1 57.554  ? 138 ALA A CB   1 ? 
ATOM   1242 H  H    . ALA A 1 100 ? 3.763   -25.65  18.457  1 55.509  ? 138 ALA A H    1 ? 
ATOM   1243 H  HA   . ALA A 1 100 ? 5.604   -23.654 18.263  1 56.931  ? 138 ALA A HA   1 ? 
ATOM   1244 H  HB1  . ALA A 1 100 ? 4.757   -24.651 16.329  1 56.583  ? 138 ALA A HB1  1 ? 
ATOM   1245 H  HB2  . ALA A 1 100 ? 3.309   -24.086 16.642  1 56.583  ? 138 ALA A HB2  1 ? 
ATOM   1246 H  HB3  . ALA A 1 100 ? 4.486   -23.09  16.27   1 56.583  ? 138 ALA A HB3  1 ? 
ATOM   1247 N  N    . LEU A 1 101 ? 4.579   -21.474 18.95   1 57.702  ? 139 LEU A N    1 ? 
ATOM   1248 C  CA   . LEU A 1 101 ? 3.936   -20.254 19.388  1 58.634  ? 139 LEU A CA   1 ? 
ATOM   1249 C  C    . LEU A 1 101 ? 3.16    -19.613 18.244  1 67.869  ? 139 LEU A C    1 ? 
ATOM   1250 O  O    . LEU A 1 101 ? 3.655   -19.488 17.122  1 61.086  ? 139 LEU A O    1 ? 
ATOM   1251 C  CB   . LEU A 1 101 ? 4.965   -19.287 19.929  1 64.692  ? 139 LEU A CB   1 ? 
ATOM   1252 C  CG   . LEU A 1 101 ? 5.823   -19.778 21.092  1 69.067  ? 139 LEU A CG   1 ? 
ATOM   1253 C  CD1  . LEU A 1 101 ? 6.537   -18.548 21.588  1 67.323  ? 139 LEU A CD1  1 ? 
ATOM   1254 C  CD2  . LEU A 1 101 ? 5.046   -20.48  22.2    1 82.037  ? 139 LEU A CD2  1 ? 
ATOM   1255 H  H    . LEU A 1 101 ? 5.464   -21.445 18.721  1 59.457  ? 139 LEU A H    1 ? 
ATOM   1256 H  HA   . LEU A 1 101 ? 3.3     -20.479 20.111  1 61.305  ? 139 LEU A HA   1 ? 
ATOM   1257 H  HB2  . LEU A 1 101 ? 5.564   -19.035 19.189  1 64.256  ? 139 LEU A HB2  1 ? 
ATOM   1258 H  HB3  . LEU A 1 101 ? 4.49    -18.471 20.21   1 64.251  ? 139 LEU A HB3  1 ? 
ATOM   1259 H  HG   . LEU A 1 101 ? 6.493   -20.412 20.738  1 69.981  ? 139 LEU A HG   1 ? 
ATOM   1260 H  HD11 . LEU A 1 101 ? 6.986   -18.106 20.847  1 67.789  ? 139 LEU A HD11 1 ? 
ATOM   1261 H  HD12 . LEU A 1 101 ? 7.194   -18.807 22.248  1 67.825  ? 139 LEU A HD12 1 ? 
ATOM   1262 H  HD13 . LEU A 1 101 ? 5.898   -17.937 21.992  1 67.801  ? 139 LEU A HD13 1 ? 
ATOM   1263 H  HD21 . LEU A 1 101 ? 4.633   -21.288 21.853  1 77.729  ? 139 LEU A HD21 1 ? 
ATOM   1264 H  HD22 . LEU A 1 101 ? 4.358   -19.886 22.543  1 77.914  ? 139 LEU A HD22 1 ? 
ATOM   1265 H  HD23 . LEU A 1 101 ? 5.651   -20.72  22.913  1 77.895  ? 139 LEU A HD23 1 ? 
ATOM   1266 N  N    . ASN A 1 102 ? 1.975   -19.105 18.576  1 59.043  ? 140 ASN A N    1 ? 
ATOM   1267 C  CA   . ASN A 1 102 ? 1.072   -18.477 17.628  1 59.722  ? 140 ASN A CA   1 ? 
ATOM   1268 C  C    . ASN A 1 102 ? 1.432   -17     17.539  1 66.234  ? 140 ASN A C    1 ? 
ATOM   1269 O  O    . ASN A 1 102 ? 0.627   -16.152 17.912  1 66.131  ? 140 ASN A O    1 ? 
ATOM   1270 C  CB   . ASN A 1 102 ? -0.369  -18.726 18.066  1 72.677  ? 140 ASN A CB   1 ? 
ATOM   1271 C  CG   . ASN A 1 102 ? -1.39   -18.2   17.086  1 78.258  ? 140 ASN A CG   1 ? 
ATOM   1272 O  OD1  . ASN A 1 102 ? -1.073  -18.025 15.907  1 77.038  ? 140 ASN A OD1  1 ? 
ATOM   1273 N  ND2  . ASN A 1 102 ? -2.613  -17.953 17.54   1 76.331  ? 140 ASN A ND2  1 ? 
ATOM   1274 H  H    . ASN A 1 102 ? 1.713   -19.135 19.451  1 61.246  ? 140 ASN A H    1 ? 
ATOM   1275 H  HA   . ASN A 1 102 ? 1.195   -18.895 16.745  1 63.052  ? 140 ASN A HA   1 ? 
ATOM   1276 H  HB2  . ASN A 1 102 ? -0.505  -19.688 18.177  1 70.7    ? 140 ASN A HB2  1 ? 
ATOM   1277 H  HB3  . ASN A 1 102 ? -0.516  -18.303 18.936  1 70.713  ? 140 ASN A HB3  1 ? 
ATOM   1278 H  HD21 . ASN A 1 102 ? -3.223  -17.604 16.998  1 76.901  ? 140 ASN A HD21 1 ? 
ATOM   1279 H  HD22 . ASN A 1 102 ? -2.826  -18.136 18.382  1 76.838  ? 140 ASN A HD22 1 ? 
ATOM   1280 N  N    . THR A 1 103 ? 2.656   -16.711 17.066  1 63.366  ? 141 THR A N    1 ? 
ATOM   1281 C  CA   . THR A 1 103 ? 3.18    -15.362 16.927  1 65.297  ? 141 THR A CA   1 ? 
ATOM   1282 C  C    . THR A 1 103 ? 3.956   -15.247 15.611  1 69.744  ? 141 THR A C    1 ? 
ATOM   1283 O  O    . THR A 1 103 ? 4.437   -16.256 15.115  1 71.636  ? 141 THR A O    1 ? 
ATOM   1284 C  CB   . THR A 1 103 ? 4.104   -14.991 18.083  1 71.431  ? 141 THR A CB   1 ? 
ATOM   1285 O  OG1  . THR A 1 103 ? 5.167   -15.95  18.089  1 64.854  ? 141 THR A OG1  1 ? 
ATOM   1286 C  CG2  . THR A 1 103 ? 3.345   -14.864 19.395  1 75.907  ? 141 THR A CG2  1 ? 
ATOM   1287 H  H    . THR A 1 103 ? 3.183   -17.4   16.778  1 64.495  ? 141 THR A H    1 ? 
ATOM   1288 H  HA   . THR A 1 103 ? 2.43    -14.74  16.914  1 66.925  ? 141 THR A HA   1 ? 
ATOM   1289 H  HB   . THR A 1 103 ? 4.491   -14.104 17.893  1 69.752  ? 141 THR A HB   1 ? 
ATOM   1290 H  HG21 . THR A 1 103 ? 3.951   -14.565 20.093  1 74.547  ? 141 THR A HG21 1 ? 
ATOM   1291 H  HG22 . THR A 1 103 ? 2.971   -15.726 19.64   1 74.517  ? 141 THR A HG22 1 ? 
ATOM   1292 H  HG23 . THR A 1 103 ? 2.626   -14.217 19.292  1 74.547  ? 141 THR A HG23 1 ? 
ATOM   1293 N  N    . PRO A 1 104 ? 4.13    -14.038 15.023  1 70.5    ? 142 PRO A N    1 ? 
ATOM   1294 C  CA   . PRO A 1 104 ? 4.885   -13.878 13.782  1 71.37   ? 142 PRO A CA   1 ? 
ATOM   1295 C  C    . PRO A 1 104 ? 6.363   -14.225 13.936  1 60.12   ? 142 PRO A C    1 ? 
ATOM   1296 O  O    . PRO A 1 104 ? 6.946   -13.937 14.966  1 55.693  ? 142 PRO A O    1 ? 
ATOM   1297 C  CB   . PRO A 1 104 ? 4.687   -12.395 13.445  1 82.634  ? 142 PRO A CB   1 ? 
ATOM   1298 C  CG   . PRO A 1 104 ? 3.382   -12.054 14.144  1 79.026  ? 142 PRO A CG   1 ? 
ATOM   1299 C  CD   . PRO A 1 104 ? 3.536   -12.759 15.453  1 80.06   ? 142 PRO A CD   1 ? 
ATOM   1300 H  HA   . PRO A 1 104 ? 4.482   -14.431 13.088  1 70.714  ? 142 PRO A HA   1 ? 
ATOM   1301 H  HB2  . PRO A 1 104 ? 5.42    -11.851 13.794  1 79.027  ? 142 PRO A HB2  1 ? 
ATOM   1302 H  HB3  . PRO A 1 104 ? 4.619   -12.254 12.483  1 79.058  ? 142 PRO A HB3  1 ? 
ATOM   1303 H  HG2  . PRO A 1 104 ? 3.286   -11.089 14.273  1 80.057  ? 142 PRO A HG2  1 ? 
ATOM   1304 H  HG3  . PRO A 1 104 ? 2.61    -12.395 13.649  1 80.057  ? 142 PRO A HG3  1 ? 
ATOM   1305 H  HD2  . PRO A 1 104 ? 4.137   -12.277 16.055  1 77.479  ? 142 PRO A HD2  1 ? 
ATOM   1306 H  HD3  . PRO A 1 104 ? 2.673   -12.883 15.883  1 77.365  ? 142 PRO A HD3  1 ? 
ATOM   1307 N  N    . LYS A 1 105 ? 6.966   -14.846 12.921  1 65.345  ? 143 LYS A N    1 ? 
ATOM   1308 C  CA   . LYS A 1 105 ? 8.352   -15.294 13.001  1 61.33   ? 143 LYS A CA   1 ? 
ATOM   1309 C  C    . LYS A 1 105 ? 9.241   -14.267 12.315  1 70.168  ? 143 LYS A C    1 ? 
ATOM   1310 O  O    . LYS A 1 105 ? 9.907   -14.577 11.336  1 73.363  ? 143 LYS A O    1 ? 
ATOM   1311 C  CB   . LYS A 1 105 ? 8.46    -16.724 12.46   1 65.29   ? 143 LYS A CB   1 ? 
ATOM   1312 C  CG   . LYS A 1 105 ? 7.468   -17.732 13.036  1 66.131  ? 143 LYS A CG   1 ? 
ATOM   1313 C  CD   . LYS A 1 105 ? 7.484   -17.832 14.559  1 62.848  ? 143 LYS A CD   1 ? 
ATOM   1314 C  CE   . LYS A 1 105 ? 6.374   -18.686 15.077  1 66.389  ? 143 LYS A CE   1 ? 
ATOM   1315 N  NZ   . LYS A 1 105 ? 6.199   -18.393 16.499  1 67.109  ? 143 LYS A NZ   1 ? 
ATOM   1316 H  H    . LYS A 1 105 ? 6.505   -14.992 12.145  1 63.261  ? 143 LYS A H    1 ? 
ATOM   1317 H  HA   . LYS A 1 105 ? 8.629   -15.327 13.949  1 64.312  ? 143 LYS A HA   1 ? 
ATOM   1318 H  HB2  . LYS A 1 105 ? 8.336   -16.698 11.487  1 64.602  ? 143 LYS A HB2  1 ? 
ATOM   1319 H  HB3  . LYS A 1 105 ? 9.368   -17.053 12.632  1 64.566  ? 143 LYS A HB3  1 ? 
ATOM   1320 H  HG2  . LYS A 1 105 ? 6.564   -17.486 12.74   1 65.176  ? 143 LYS A HG2  1 ? 
ATOM   1321 H  HG3  . LYS A 1 105 ? 7.671   -18.616 12.659  1 65.128  ? 143 LYS A HG3  1 ? 
ATOM   1322 H  HD2  . LYS A 1 105 ? 8.343   -18.212 14.847  1 64.392  ? 143 LYS A HD2  1 ? 
ATOM   1323 H  HD3  . LYS A 1 105 ? 7.401   -16.938 14.95   1 64.405  ? 143 LYS A HD3  1 ? 
ATOM   1324 H  HE2  . LYS A 1 105 ? 5.547   -18.503 14.6    1 65.749  ? 143 LYS A HE2  1 ? 
ATOM   1325 H  HE3  . LYS A 1 105 ? 6.578   -19.629 14.96   1 65.651  ? 143 LYS A HE3  1 ? 
ATOM   1326 H  HZ1  . LYS A 1 105 ? 5.89    -17.549 16.613  1 66.855  ? 143 LYS A HZ1  1 ? 
ATOM   1327 H  HZ2  . LYS A 1 105 ? 6.984   -18.491 16.944  1 66.854  ? 143 LYS A HZ2  1 ? 
ATOM   1328 H  HZ3  . LYS A 1 105 ? 5.597   -18.973 16.84   1 66.862  ? 143 LYS A HZ3  1 ? 
ATOM   1329 N  N    . ASP A 1 106 ? 9.286   -13.064 12.901  1 78.942  ? 144 ASP A N    1 ? 
ATOM   1330 C  CA   . ASP A 1 106 ? 10.04   -11.941 12.368  1 80.824  ? 144 ASP A CA   1 ? 
ATOM   1331 C  C    . ASP A 1 106 ? 11.522  -12.281 12.309  1 66.903  ? 144 ASP A C    1 ? 
ATOM   1332 O  O    . ASP A 1 106 ? 12.16   -11.906 11.339  1 70.321  ? 144 ASP A O    1 ? 
ATOM   1333 C  CB   . ASP A 1 106 ? 9.802   -10.667 13.17   1 96.006  ? 144 ASP A CB   1 ? 
ATOM   1334 C  CG   . ASP A 1 106 ? 8.377   -10.11  13.185  1 106.521 ? 144 ASP A CG   1 ? 
ATOM   1335 O  OD1  . ASP A 1 106 ? 7.562   -10.494 12.318  1 101.722 ? 144 ASP A OD1  1 ? 
ATOM   1336 O  OD2  . ASP A 1 106 ? 8.072   -9.297  14.09   1 118.926 ? 144 ASP A OD2  1 ? 
ATOM   1337 H  H    . ASP A 1 106 ? 8.838   -12.944 13.688  1 77.18   ? 144 ASP A H    1 ? 
ATOM   1338 H  HA   . ASP A 1 106 ? 9.728   -11.775 11.45   1 80.253  ? 144 ASP A HA   1 ? 
ATOM   1339 H  HB2  . ASP A 1 106 ? 10.065  -10.837 14.098  1 94.478  ? 144 ASP A HB2  1 ? 
ATOM   1340 H  HB3  . ASP A 1 106 ? 10.391  -9.966  12.819  1 94.343  ? 144 ASP A HB3  1 ? 
ATOM   1341 N  N    . HIS A 1 107 ? 12.054  -13.019 13.301  1 62.358  ? 145 HIS A N    1 ? 
ATOM   1342 C  CA   . HIS A 1 107 ? 13.479  -13.358 13.341  1 54.376  ? 145 HIS A CA   1 ? 
ATOM   1343 C  C    . HIS A 1 107 ? 13.896  -14.403 12.302  1 53.671  ? 145 HIS A C    1 ? 
ATOM   1344 O  O    . HIS A 1 107 ? 15.098  -14.581 12.097  1 58.467  ? 145 HIS A O    1 ? 
ATOM   1345 C  CB   . HIS A 1 107 ? 13.933  -13.861 14.722  1 62.198  ? 145 HIS A CB   1 ? 
ATOM   1346 C  CG   . HIS A 1 107 ? 13.406  -15.206 15.135  1 54.819  ? 145 HIS A CG   1 ? 
ATOM   1347 N  ND1  . HIS A 1 107 ? 12.076  -15.407 15.412  1 60.605  ? 145 HIS A ND1  1 ? 
ATOM   1348 C  CD2  . HIS A 1 107 ? 13.995  -16.432 15.232  1 61.777  ? 145 HIS A CD2  1 ? 
ATOM   1349 C  CE1  . HIS A 1 107 ? 11.879  -16.688 15.719  1 72.42   ? 145 HIS A CE1  1 ? 
ATOM   1350 N  NE2  . HIS A 1 107 ? 13.036  -17.329 15.643  1 64.557  ? 145 HIS A NE2  1 ? 
ATOM   1351 H  H    . HIS A 1 107 ? 11.523  -13.284 13.995  1 61.672  ? 145 HIS A H    1 ? 
ATOM   1352 H  HA   . HIS A 1 107 ? 13.984  -12.528 13.154  1 57.216  ? 145 HIS A HA   1 ? 
ATOM   1353 H  HB2  . HIS A 1 107 ? 14.915  -13.893 14.731  1 58.601  ? 145 HIS A HB2  1 ? 
ATOM   1354 H  HB3  . HIS A 1 107 ? 13.664  -13.199 15.396  1 58.601  ? 145 HIS A HB3  1 ? 
ATOM   1355 H  HD2  . HIS A 1 107 ? 14.904  -16.624 15.111  1 60.794  ? 145 HIS A HD2  1 ? 
ATOM   1356 H  HE1  . HIS A 1 107 ? 11.056  -17.057 15.967  1 67.503  ? 145 HIS A HE1  1 ? 
ATOM   1357 N  N    . ILE A 1 108 ? 12.94   -15.17  11.763  1 56.316  ? 146 ILE A N    1 ? 
ATOM   1358 C  CA   . ILE A 1 108 ? 13.201  -16.168 10.725  1 63.298  ? 146 ILE A CA   1 ? 
ATOM   1359 C  C    . ILE A 1 108 ? 13.11   -15.454 9.377   1 60.754  ? 146 ILE A C    1 ? 
ATOM   1360 O  O    . ILE A 1 108 ? 13.972  -15.64  8.539   1 70.237  ? 146 ILE A O    1 ? 
ATOM   1361 C  CB   . ILE A 1 108 ? 12.239  -17.384 10.783  1 63.023  ? 146 ILE A CB   1 ? 
ATOM   1362 C  CG1  . ILE A 1 108 ? 12.157  -18.066 12.164  1 66.568  ? 146 ILE A CG1  1 ? 
ATOM   1363 C  CG2  . ILE A 1 108 ? 12.58   -18.429 9.71    1 65.29   ? 146 ILE A CG2  1 ? 
ATOM   1364 C  CD1  . ILE A 1 108 ? 13.421  -18.8   12.577  1 74.07   ? 146 ILE A CD1  1 ? 
ATOM   1365 H  H    . ILE A 1 108 ? 12.085  -15.105 12.078  1 57.307  ? 146 ILE A H    1 ? 
ATOM   1366 H  HA   . ILE A 1 108 ? 14.111  -16.504 10.833  1 61.391  ? 146 ILE A HA   1 ? 
ATOM   1367 H  HB   . ILE A 1 108 ? 11.344  -17.047 10.58   1 64.144  ? 146 ILE A HB   1 ? 
ATOM   1368 H  HG12 . ILE A 1 108 ? 11.953  -17.388 12.84   1 67.31   ? 146 ILE A HG12 1 ? 
ATOM   1369 H  HG13 . ILE A 1 108 ? 11.415  -18.704 12.152  1 67.372  ? 146 ILE A HG13 1 ? 
ATOM   1370 H  HG21 . ILE A 1 108 ? 12.124  -19.263 9.911   1 64.59   ? 146 ILE A HG21 1 ? 
ATOM   1371 H  HG22 . ILE A 1 108 ? 13.541  -18.583 9.699   1 64.656  ? 146 ILE A HG22 1 ? 
ATOM   1372 H  HG23 . ILE A 1 108 ? 12.295  -18.112 8.837   1 64.604  ? 146 ILE A HG23 1 ? 
ATOM   1373 H  HD11 . ILE A 1 108 ? 13.539  -19.6   12.031  1 71.668  ? 146 ILE A HD11 1 ? 
ATOM   1374 H  HD12 . ILE A 1 108 ? 13.349  -19.062 13.512  1 71.531  ? 146 ILE A HD12 1 ? 
ATOM   1375 H  HD13 . ILE A 1 108 ? 14.196  -18.217 12.467  1 71.622  ? 146 ILE A HD13 1 ? 
ATOM   1376 N  N    . GLY A 1 109 ? 12.024  -14.697 9.186   1 66.911  ? 147 GLY A N    1 ? 
ATOM   1377 C  CA   . GLY A 1 109 ? 11.766  -13.926 7.986   1 66.98   ? 147 GLY A CA   1 ? 
ATOM   1378 C  C    . GLY A 1 109 ? 11.572  -14.811 6.764   1 70.403  ? 147 GLY A C    1 ? 
ATOM   1379 O  O    . GLY A 1 109 ? 11.193  -15.988 6.874   1 61.468  ? 147 GLY A O    1 ? 
ATOM   1380 H  H    . GLY A 1 109 ? 11.392  -14.668 9.846   1 65.262  ? 147 GLY A H    1 ? 
ATOM   1381 H  HA2  . GLY A 1 109 ? 10.958  -13.378 8.125   1 67.714  ? 147 GLY A HA2  1 ? 
ATOM   1382 H  HA3  . GLY A 1 109 ? 12.524  -13.313 7.835   1 67.714  ? 147 GLY A HA3  1 ? 
ATOM   1383 N  N    . THR A 1 110 ? 11.876  -14.21  5.602   1 69.708  ? 148 THR A N    1 ? 
ATOM   1384 C  CA   . THR A 1 110 ? 11.889  -14.897 4.318   1 55.867  ? 148 THR A CA   1 ? 
ATOM   1385 C  C    . THR A 1 110 ? 13.321  -14.985 3.801   1 55.578  ? 148 THR A C    1 ? 
ATOM   1386 O  O    . THR A 1 110 ? 14.229  -14.361 4.346   1 64.391  ? 148 THR A O    1 ? 
ATOM   1387 C  CB   . THR A 1 110 ? 10.942  -14.175 3.365   1 65.417  ? 148 THR A CB   1 ? 
ATOM   1388 O  OG1  . THR A 1 110 ? 11.273  -12.79  3.347   1 68.324  ? 148 THR A OG1  1 ? 
ATOM   1389 C  CG2  . THR A 1 110 ? 9.505   -14.346 3.82    1 74.662  ? 148 THR A CG2  1 ? 
ATOM   1390 H  H    . THR A 1 110 ? 12.074  -13.318 5.607   1 66.45   ? 148 THR A H    1 ? 
ATOM   1391 H  HA   . THR A 1 110 ? 11.554  -15.81  4.44    1 60.182  ? 148 THR A HA   1 ? 
ATOM   1392 H  HB   . THR A 1 110 ? 11.04   -14.537 2.454   1 65.654  ? 148 THR A HB   1 ? 
ATOM   1393 H  HG21 . THR A 1 110 ? 8.906   -13.94  3.174   1 71.707  ? 148 THR A HG21 1 ? 
ATOM   1394 H  HG22 . THR A 1 110 ? 9.382   -13.919 4.684   1 71.75   ? 148 THR A HG22 1 ? 
ATOM   1395 H  HG23 . THR A 1 110 ? 9.299   -15.293 3.897   1 71.689  ? 148 THR A HG23 1 ? 
ATOM   1396 N  N    . ARG A 1 111 ? 13.537  -15.832 2.784   1 57.445  ? 149 ARG A N    1 ? 
ATOM   1397 C  CA   . ARG A 1 111 ? 14.888  -16.108 2.308   1 59.975  ? 149 ARG A CA   1 ? 
ATOM   1398 C  C    . ARG A 1 111 ? 15.358  -15.013 1.335   1 59.21   ? 149 ARG A C    1 ? 
ATOM   1399 O  O    . ARG A 1 111 ? 14.59   -14.599 0.473   1 57.034  ? 149 ARG A O    1 ? 
ATOM   1400 C  CB   . ARG A 1 111 ? 14.851  -17.442 1.568   1 59.647  ? 149 ARG A CB   1 ? 
ATOM   1401 C  CG   . ARG A 1 111 ? 16.181  -17.88  0.983   1 58.408  ? 149 ARG A CG   1 ? 
ATOM   1402 C  CD   . ARG A 1 111 ? 16.112  -19.319 0.559   1 59.394  ? 149 ARG A CD   1 ? 
ATOM   1403 N  NE   . ARG A 1 111 ? 15.143  -19.464 -0.524  1 55.74   ? 149 ARG A NE   1 ? 
ATOM   1404 C  CZ   . ARG A 1 111 ? 15.354  -19.186 -1.815  1 65.733  ? 149 ARG A CZ   1 ? 
ATOM   1405 N  NH1  . ARG A 1 111 ? 16.524  -18.739 -2.257  1 60.161  ? 149 ARG A NH1  1 ? 
ATOM   1406 N  NH2  . ARG A 1 111 ? 14.393  -19.416 -2.676  1 61.385  ? 149 ARG A NH2  1 ? 
ATOM   1407 H  H    . ARG A 1 111 ? 12.826  -16.236 2.374   1 57.563  ? 149 ARG A H    1 ? 
ATOM   1408 H  HA   . ARG A 1 111 ? 15.505  -16.174 3.081   1 59.326  ? 149 ARG A HA   1 ? 
ATOM   1409 H  HB2  . ARG A 1 111 ? 14.544  -18.126 2.197   1 59.387  ? 149 ARG A HB2  1 ? 
ATOM   1410 H  HB3  . ARG A 1 111 ? 14.191  -17.382 0.845   1 59.395  ? 149 ARG A HB3  1 ? 
ATOM   1411 H  HG2  . ARG A 1 111 ? 16.402  -17.327 0.203   1 58.967  ? 149 ARG A HG2  1 ? 
ATOM   1412 H  HG3  . ARG A 1 111 ? 16.884  -17.771 1.657   1 58.963  ? 149 ARG A HG3  1 ? 
ATOM   1413 H  HD2  . ARG A 1 111 ? 16.988  -19.628 0.264   1 58.363  ? 149 ARG A HD2  1 ? 
ATOM   1414 H  HD3  . ARG A 1 111 ? 15.838  -19.875 1.316   1 58.289  ? 149 ARG A HD3  1 ? 
ATOM   1415 H  HE   . ARG A 1 111 ? 14.355  -19.76  -0.296  1 58.869  ? 149 ARG A HE   1 ? 
ATOM   1416 H  HH11 . ARG A 1 111 ? 17.152  -18.463 -1.708  1 61.721  ? 149 ARG A HH11 1 ? 
ATOM   1417 H  HH12 . ARG A 1 111 ? 16.689  -18.722 -3.126  1 61.804  ? 149 ARG A HH12 1 ? 
ATOM   1418 H  HH21 . ARG A 1 111 ? 13.668  -19.867 -2.439  1 62.595  ? 149 ARG A HH21 1 ? 
ATOM   1419 H  HH22 . ARG A 1 111 ? 14.46   -19.12  -3.509  1 62.644  ? 149 ARG A HH22 1 ? 
ATOM   1420 N  N    . ASN A 1 112 ? 16.608  -14.56  1.484   1 68.829  ? 150 ASN A N    1 ? 
ATOM   1421 C  CA   . ASN A 1 112 ? 17.271  -13.694 0.513   1 63.948  ? 150 ASN A CA   1 ? 
ATOM   1422 C  C    . ASN A 1 112 ? 17.988  -14.583 -0.506  1 55.724  ? 150 ASN A C    1 ? 
ATOM   1423 O  O    . ASN A 1 112 ? 19.068  -15.087 -0.172  1 53.218  ? 150 ASN A O    1 ? 
ATOM   1424 C  CB   . ASN A 1 112 ? 18.237  -12.729 1.195   1 62.963  ? 150 ASN A CB   1 ? 
ATOM   1425 C  CG   . ASN A 1 112 ? 18.796  -11.658 0.264   1 71.227  ? 150 ASN A CG   1 ? 
ATOM   1426 O  OD1  . ASN A 1 112 ? 18.812  -11.797 -0.971  1 62.412  ? 150 ASN A OD1  1 ? 
ATOM   1427 N  ND2  . ASN A 1 112 ? 19.276  -10.57  0.855   1 63.713  ? 150 ASN A ND2  1 ? 
ATOM   1428 H  H    . ASN A 1 112 ? 17.079  -14.803 2.229   1 65.208  ? 150 ASN A H    1 ? 
ATOM   1429 H  HA   . ASN A 1 112 ? 16.598  -13.146 0.071   1 62.958  ? 150 ASN A HA   1 ? 
ATOM   1430 H  HB2  . ASN A 1 112 ? 17.766  -12.288 1.931   1 64.982  ? 150 ASN A HB2  1 ? 
ATOM   1431 H  HB3  . ASN A 1 112 ? 18.979  -13.233 1.582   1 64.915  ? 150 ASN A HB3  1 ? 
ATOM   1432 H  HD21 . ASN A 1 112 ? 19.511  -9.871  0.361   1 65.903  ? 150 ASN A HD21 1 ? 
ATOM   1433 H  HD22 . ASN A 1 112 ? 19.365  -10.536 1.737   1 65.902  ? 150 ASN A HD22 1 ? 
ATOM   1434 N  N    . PRO A 1 113 ? 17.446  -14.79  -1.753  1 52.798  ? 151 PRO A N    1 ? 
ATOM   1435 C  CA   . PRO A 1 113 ? 18.105  -15.612 -2.767  1 57.328  ? 151 PRO A CA   1 ? 
ATOM   1436 C  C    . PRO A 1 113 ? 19.533  -15.203 -3.125  1 62.492  ? 151 PRO A C    1 ? 
ATOM   1437 O  O    . PRO A 1 113 ? 20.264  -16.062 -3.613  1 68.097  ? 151 PRO A O    1 ? 
ATOM   1438 C  CB   . PRO A 1 113 ? 17.161  -15.602 -3.968  1 57.788  ? 151 PRO A CB   1 ? 
ATOM   1439 C  CG   . PRO A 1 113 ? 16.302  -14.388 -3.743  1 65.443  ? 151 PRO A CG   1 ? 
ATOM   1440 C  CD   . PRO A 1 113 ? 16.167  -14.253 -2.26   1 55.967  ? 151 PRO A CD   1 ? 
ATOM   1441 H  HA   . PRO A 1 113 ? 18.136  -16.528 -2.434  1 57.48   ? 151 PRO A HA   1 ? 
ATOM   1442 H  HB2  . PRO A 1 113 ? 17.656  -15.529 -4.808  1 59.368  ? 151 PRO A HB2  1 ? 
ATOM   1443 H  HB3  . PRO A 1 113 ? 16.618  -16.414 -3.991  1 59.353  ? 151 PRO A HB3  1 ? 
ATOM   1444 H  HG2  . PRO A 1 113 ? 16.723  -13.591 -4.122  1 61.378  ? 151 PRO A HG2  1 ? 
ATOM   1445 H  HG3  . PRO A 1 113 ? 15.423  -14.504 -4.157  1 61.378  ? 151 PRO A HG3  1 ? 
ATOM   1446 H  HD2  . PRO A 1 113 ? 16.049  -13.318 -2.01   1 57.309  ? 151 PRO A HD2  1 ? 
ATOM   1447 H  HD3  . PRO A 1 113 ? 15.416  -14.775 -1.93   1 57.241  ? 151 PRO A HD3  1 ? 
ATOM   1448 N  N    . ALA A 1 114 ? 19.946  -13.962 -2.793  1 66.115  ? 152 ALA A N    1 ? 
ATOM   1449 C  CA   . ALA A 1 114 ? 21.341  -13.541 -2.914  1 74.694  ? 152 ALA A CA   1 ? 
ATOM   1450 C  C    . ALA A 1 114 ? 22.25   -14.249 -1.906  1 79.047  ? 152 ALA A C    1 ? 
ATOM   1451 O  O    . ALA A 1 114 ? 23.401  -14.515 -2.24   1 68.226  ? 152 ALA A O    1 ? 
ATOM   1452 C  CB   . ALA A 1 114 ? 21.466  -12.024 -2.788  1 69.273  ? 152 ALA A CB   1 ? 
ATOM   1453 H  H    . ALA A 1 114 ? 19.331  -13.333 -2.55   1 66.828  ? 152 ALA A H    1 ? 
ATOM   1454 H  HA   . ALA A 1 114 ? 21.652  -13.8   -3.825  1 72.595  ? 152 ALA A HA   1 ? 
ATOM   1455 H  HB1  . ALA A 1 114 ? 20.867  -11.593 -3.421  1 70.812  ? 152 ALA A HB1  1 ? 
ATOM   1456 H  HB2  . ALA A 1 114 ? 21.237  -11.749 -1.886  1 70.772  ? 152 ALA A HB2  1 ? 
ATOM   1457 H  HB3  . ALA A 1 114 ? 22.381  -11.757 -2.981  1 70.815  ? 152 ALA A HB3  1 ? 
ATOM   1458 N  N    . ASN A 1 115 ? 21.741  -14.548 -0.695  1 75.073  ? 153 ASN A N    1 ? 
ATOM   1459 C  CA   . ASN A 1 115 ? 22.533  -15.128 0.386   1 79.63   ? 153 ASN A CA   1 ? 
ATOM   1460 C  C    . ASN A 1 115 ? 22.355  -16.64  0.574   1 84.608  ? 153 ASN A C    1 ? 
ATOM   1461 O  O    . ASN A 1 115 ? 23.275  -17.286 1.078   1 86.177  ? 153 ASN A O    1 ? 
ATOM   1462 C  CB   . ASN A 1 115 ? 22.19   -14.452 1.704   1 74.817  ? 153 ASN A CB   1 ? 
ATOM   1463 C  CG   . ASN A 1 115 ? 22.642  -13.014 1.749   1 78.932  ? 153 ASN A CG   1 ? 
ATOM   1464 O  OD1  . ASN A 1 115 ? 23.676  -12.657 1.175   1 81.21   ? 153 ASN A OD1  1 ? 
ATOM   1465 N  ND2  . ASN A 1 115 ? 21.913  -12.179 2.474   1 69.354  ? 153 ASN A ND2  1 ? 
ATOM   1466 H  H    . ASN A 1 115 ? 20.864  -14.36  -0.524  1 76.782  ? 153 ASN A H    1 ? 
ATOM   1467 H  HA   . ASN A 1 115 ? 23.486  -14.964 0.209   1 78.651  ? 153 ASN A HA   1 ? 
ATOM   1468 H  HB2  . ASN A 1 115 ? 21.222  -14.489 1.838   1 76.765  ? 153 ASN A HB2  1 ? 
ATOM   1469 H  HB3  . ASN A 1 115 ? 22.616  -14.94  2.437   1 76.858  ? 153 ASN A HB3  1 ? 
ATOM   1470 H  HD21 . ASN A 1 115 ? 21.985  -11.304 2.342   1 72.25   ? 153 ASN A HD21 1 ? 
ATOM   1471 H  HD22 . ASN A 1 115 ? 21.357  -12.488 3.094   1 72.242  ? 153 ASN A HD22 1 ? 
ATOM   1472 N  N    . ASN A 1 116 ? 21.176  -17.193 0.246   1 79.44   ? 154 ASN A N    1 ? 
ATOM   1473 C  CA   . ASN A 1 116 ? 20.846  -18.576 0.57    1 66.317  ? 154 ASN A CA   1 ? 
ATOM   1474 C  C    . ASN A 1 116 ? 20.033  -19.193 -0.552  1 55.855  ? 154 ASN A C    1 ? 
ATOM   1475 O  O    . ASN A 1 116 ? 19.053  -18.591 -0.997  1 63.224  ? 154 ASN A O    1 ? 
ATOM   1476 C  CB   . ASN A 1 116 ? 19.935  -18.683 1.786   1 68.555  ? 154 ASN A CB   1 ? 
ATOM   1477 C  CG   . ASN A 1 116 ? 20.542  -18.057 3.007   1 55.747  ? 154 ASN A CG   1 ? 
ATOM   1478 O  OD1  . ASN A 1 116 ? 21.484  -18.612 3.573   1 72.636  ? 154 ASN A OD1  1 ? 
ATOM   1479 N  ND2  . ASN A 1 116 ? 20.04   -16.906 3.417   1 62.531  ? 154 ASN A ND2  1 ? 
ATOM   1480 H  H    . ASN A 1 116 ? 20.548  -16.69  -0.186  1 77.24   ? 154 ASN A H    1 ? 
ATOM   1481 H  HA   . ASN A 1 116 ? 21.66   -19.099 0.738   1 66.952  ? 154 ASN A HA   1 ? 
ATOM   1482 H  HB2  . ASN A 1 116 ? 19.083  -18.248 1.594   1 64.69   ? 154 ASN A HB2  1 ? 
ATOM   1483 H  HB3  . ASN A 1 116 ? 19.756  -19.627 1.971   1 64.769  ? 154 ASN A HB3  1 ? 
ATOM   1484 H  HD21 . ASN A 1 116 ? 20.267  -16.591 4.216   1 60.466  ? 154 ASN A HD21 1 ? 
ATOM   1485 H  HD22 . ASN A 1 116 ? 19.485  -16.437 2.907   1 60.469  ? 154 ASN A HD22 1 ? 
ATOM   1486 N  N    . ALA A 1 117 ? 20.444  -20.392 -0.983  1 54.238  ? 155 ALA A N    1 ? 
ATOM   1487 C  CA   . ALA A 1 117 ? 19.606  -21.231 -1.824  1 54.026  ? 155 ALA A CA   1 ? 
ATOM   1488 C  C    . ALA A 1 117 ? 18.422  -21.784 -1.007  1 61.994  ? 155 ALA A C    1 ? 
ATOM   1489 O  O    . ALA A 1 117 ? 18.495  -21.875 0.207   1 59.233  ? 155 ALA A O    1 ? 
ATOM   1490 C  CB   . ALA A 1 117 ? 20.428  -22.356 -2.385  1 59.223  ? 155 ALA A CB   1 ? 
ATOM   1491 H  H    . ALA A 1 117 ? 21.274  -20.696 -0.75   1 54.771  ? 155 ALA A H    1 ? 
ATOM   1492 H  HA   . ALA A 1 117 ? 19.25   -20.678 -2.574  1 56.424  ? 155 ALA A HA   1 ? 
ATOM   1493 H  HB1  . ALA A 1 117 ? 21.165  -21.995 -2.906  1 57.622  ? 155 ALA A HB1  1 ? 
ATOM   1494 H  HB2  . ALA A 1 117 ? 20.783  -22.896 -1.659  1 57.622  ? 155 ALA A HB2  1 ? 
ATOM   1495 H  HB3  . ALA A 1 117 ? 19.873  -22.912 -2.957  1 57.622  ? 155 ALA A HB3  1 ? 
ATOM   1496 N  N    . ALA A 1 118 ? 17.333  -22.141 -1.696  1 59.131  ? 156 ALA A N    1 ? 
ATOM   1497 C  CA   . ALA A 1 118 ? 16.194  -22.803 -1.097  1 58.911  ? 156 ALA A CA   1 ? 
ATOM   1498 C  C    . ALA A 1 118 ? 16.628  -24.091 -0.383  1 62.307  ? 156 ALA A C    1 ? 
ATOM   1499 O  O    . ALA A 1 118 ? 17.416  -24.865 -0.925  1 67.257  ? 156 ALA A O    1 ? 
ATOM   1500 C  CB   . ALA A 1 118 ? 15.189  -23.04  -2.183  1 56.111  ? 156 ALA A CB   1 ? 
ATOM   1501 H  H    . ALA A 1 118 ? 17.304  -21.951 -2.59   1 59.633  ? 156 ALA A H    1 ? 
ATOM   1502 H  HA   . ALA A 1 118 ? 15.8    -22.183 -0.425  1 59.072  ? 156 ALA A HA   1 ? 
ATOM   1503 H  HB1  . ALA A 1 118 ? 14.901  -22.19  -2.555  1 56.939  ? 156 ALA A HB1  1 ? 
ATOM   1504 H  HB2  . ALA A 1 118 ? 15.59   -23.579 -2.886  1 56.95   ? 156 ALA A HB2  1 ? 
ATOM   1505 H  HB3  . ALA A 1 118 ? 14.42   -23.509 -1.82   1 56.938  ? 156 ALA A HB3  1 ? 
ATOM   1506 N  N    . ILE A 1 119 ? 16.128  -24.299 0.849   1 64.488  ? 157 ILE A N    1 ? 
ATOM   1507 C  CA   . ILE A 1 119 ? 16.263  -25.557 1.59    1 59.086  ? 157 ILE A CA   1 ? 
ATOM   1508 C  C    . ILE A 1 119 ? 15.373  -26.6   0.899   1 53.565  ? 157 ILE A C    1 ? 
ATOM   1509 O  O    . ILE A 1 119 ? 14.247  -26.314 0.507   1 57.489  ? 157 ILE A O    1 ? 
ATOM   1510 C  CB   . ILE A 1 119 ? 15.923  -25.366 3.087   1 64.725  ? 157 ILE A CB   1 ? 
ATOM   1511 C  CG1  . ILE A 1 119 ? 16.777  -24.246 3.736   1 62.228  ? 157 ILE A CG1  1 ? 
ATOM   1512 C  CG2  . ILE A 1 119 ? 16.065  -26.676 3.869   1 68.105  ? 157 ILE A CG2  1 ? 
ATOM   1513 C  CD1  . ILE A 1 119 ? 16.335  -23.793 5.118   1 63.924  ? 157 ILE A CD1  1 ? 
ATOM   1514 H  H    . ILE A 1 119 ? 15.636  -23.631 1.231   1 62.669  ? 157 ILE A H    1 ? 
ATOM   1515 H  HA   . ILE A 1 119 ? 17.193  -25.847 1.528   1 60.011  ? 157 ILE A HA   1 ? 
ATOM   1516 H  HB   . ILE A 1 119 ? 14.987  -25.088 3.141   1 63.67   ? 157 ILE A HB   1 ? 
ATOM   1517 H  HG12 . ILE A 1 119 ? 17.701  -24.565 3.799   1 63.171  ? 157 ILE A HG12 1 ? 
ATOM   1518 H  HG13 . ILE A 1 119 ? 16.78   -23.464 3.152   1 63.173  ? 157 ILE A HG13 1 ? 
ATOM   1519 H  HG21 . ILE A 1 119 ? 15.872  -26.523 4.807   1 67.036  ? 157 ILE A HG21 1 ? 
ATOM   1520 H  HG22 . ILE A 1 119 ? 16.973  -27.011 3.778   1 67.068  ? 157 ILE A HG22 1 ? 
ATOM   1521 H  HG23 . ILE A 1 119 ? 15.443  -27.337 3.524   1 67.009  ? 157 ILE A HG23 1 ? 
ATOM   1522 H  HD11 . ILE A 1 119 ? 15.392  -23.545 5.096   1 63.43   ? 157 ILE A HD11 1 ? 
ATOM   1523 H  HD12 . ILE A 1 119 ? 16.867  -23.02  5.386   1 63.428  ? 157 ILE A HD12 1 ? 
ATOM   1524 H  HD13 . ILE A 1 119 ? 16.467  -24.512 5.764   1 63.463  ? 157 ILE A HD13 1 ? 
ATOM   1525 N  N    . VAL A 1 120 ? 15.891  -27.823 0.715   1 52.811  ? 158 VAL A N    1 ? 
ATOM   1526 C  CA   . VAL A 1 120 ? 15.108  -28.879 0.093   1 64.287  ? 158 VAL A CA   1 ? 
ATOM   1527 C  C    . VAL A 1 120 ? 14.016  -29.273 1.094   1 65.695  ? 158 VAL A C    1 ? 
ATOM   1528 O  O    . VAL A 1 120 ? 14.304  -29.651 2.232   1 63.15   ? 158 VAL A O    1 ? 
ATOM   1529 C  CB   . VAL A 1 120 ? 15.942  -30.088 -0.369  1 67.263  ? 158 VAL A CB   1 ? 
ATOM   1530 C  CG1  . VAL A 1 120 ? 15.081  -31.246 -0.858  1 70.127  ? 158 VAL A CG1  1 ? 
ATOM   1531 C  CG2  . VAL A 1 120 ? 16.894  -29.696 -1.496  1 73.706  ? 158 VAL A CG2  1 ? 
ATOM   1532 H  H    . VAL A 1 120 ? 16.746  -28.006 0.982   1 55.466  ? 158 VAL A H    1 ? 
ATOM   1533 H  HA   . VAL A 1 120 ? 14.683  -28.505 -0.702  1 62.51   ? 158 VAL A HA   1 ? 
ATOM   1534 H  HB   . VAL A 1 120 ? 16.476  -30.394 0.402   1 68.368  ? 158 VAL A HB   1 ? 
ATOM   1535 H  HG11 . VAL A 1 120 ? 14.424  -30.917 -1.494  1 69.276  ? 158 VAL A HG11 1 ? 
ATOM   1536 H  HG12 . VAL A 1 120 ? 14.626  -31.661 -0.106  1 69.263  ? 158 VAL A HG12 1 ? 
ATOM   1537 H  HG13 . VAL A 1 120 ? 15.645  -31.911 -1.292  1 69.307  ? 158 VAL A HG13 1 ? 
ATOM   1538 H  HG21 . VAL A 1 120 ? 17.448  -30.459 -1.735  1 71.704  ? 158 VAL A HG21 1 ? 
ATOM   1539 H  HG22 . VAL A 1 120 ? 17.463  -28.965 -1.202  1 71.628  ? 158 VAL A HG22 1 ? 
ATOM   1540 H  HG23 . VAL A 1 120 ? 16.381  -29.414 -2.271  1 71.716  ? 158 VAL A HG23 1 ? 
ATOM   1541 N  N    . LEU A 1 121 ? 12.766  -29.166 0.653   1 59.5    ? 159 LEU A N    1 ? 
ATOM   1542 C  CA   . LEU A 1 121 ? 11.646  -29.405 1.54    1 67.395  ? 159 LEU A CA   1 ? 
ATOM   1543 C  C    . LEU A 1 121 ? 11.604  -30.879 1.931   1 65.689  ? 159 LEU A C    1 ? 
ATOM   1544 O  O    . LEU A 1 121 ? 11.455  -31.742 1.067   1 64.912  ? 159 LEU A O    1 ? 
ATOM   1545 C  CB   . LEU A 1 121 ? 10.358  -28.969 0.867   1 68.757  ? 159 LEU A CB   1 ? 
ATOM   1546 C  CG   . LEU A 1 121 ? 9.16    -28.855 1.814   1 72.273  ? 159 LEU A CG   1 ? 
ATOM   1547 C  CD1  . LEU A 1 121 ? 8.196   -27.85  1.25    1 64.577  ? 159 LEU A CD1  1 ? 
ATOM   1548 C  CD2  . LEU A 1 121 ? 8.467   -30.2   2.041   1 75.37   ? 159 LEU A CD2  1 ? 
ATOM   1549 H  H    . LEU A 1 121 ? 12.602  -28.959 -0.222  1 62.756  ? 159 LEU A H    1 ? 
ATOM   1550 H  HA   . LEU A 1 121 ? 11.778  -28.851 2.351   1 65.768  ? 159 LEU A HA   1 ? 
ATOM   1551 H  HB2  . LEU A 1 121 ? 10.519  -28.093 0.452   1 69.05   ? 159 LEU A HB2  1 ? 
ATOM   1552 H  HB3  . LEU A 1 121 ? 10.141  -29.611 0.153   1 69.208  ? 159 LEU A HB3  1 ? 
ATOM   1553 H  HG   . LEU A 1 121 ? 9.481   -28.519 2.689   1 70.574  ? 159 LEU A HG   1 ? 
ATOM   1554 H  HD11 . LEU A 1 121 ? 8.611   -26.972 1.237   1 66.792  ? 159 LEU A HD11 1 ? 
ATOM   1555 H  HD12 . LEU A 1 121 ? 7.399   -27.818 1.805   1 66.769  ? 159 LEU A HD12 1 ? 
ATOM   1556 H  HD13 . LEU A 1 121 ? 7.949   -28.106 0.346   1 66.784  ? 159 LEU A HD13 1 ? 
ATOM   1557 H  HD21 . LEU A 1 121 ? 9.011   -30.761 2.615   1 74.359  ? 159 LEU A HD21 1 ? 
ATOM   1558 H  HD22 . LEU A 1 121 ? 8.329   -30.646 1.188   1 74.357  ? 159 LEU A HD22 1 ? 
ATOM   1559 H  HD23 . LEU A 1 121 ? 7.606   -30.053 2.468   1 74.317  ? 159 LEU A HD23 1 ? 
ATOM   1560 N  N    . GLN A 1 122 ? 11.747  -31.124 3.242   1 69.984  ? 160 GLN A N    1 ? 
ATOM   1561 C  CA   . GLN A 1 122 ? 11.664  -32.447 3.839   1 64.988  ? 160 GLN A CA   1 ? 
ATOM   1562 C  C    . GLN A 1 122 ? 10.679  -32.423 5.003   1 69.973  ? 160 GLN A C    1 ? 
ATOM   1563 O  O    . GLN A 1 122 ? 10.73   -31.489 5.816   1 58.348  ? 160 GLN A O    1 ? 
ATOM   1564 C  CB   . GLN A 1 122 ? 12.98   -32.876 4.466   1 57.22   ? 160 GLN A CB   1 ? 
ATOM   1565 C  CG   . GLN A 1 122 ? 14.096  -33.069 3.447   1 82.24   ? 160 GLN A CG   1 ? 
ATOM   1566 C  CD   . GLN A 1 122 ? 15.451  -33.248 4.092   1 88.534  ? 160 GLN A CD   1 ? 
ATOM   1567 O  OE1  . GLN A 1 122 ? 15.634  -33.084 5.309   1 88.269  ? 160 GLN A OE1  1 ? 
ATOM   1568 N  NE2  . GLN A 1 122 ? 16.427  -33.585 3.264   1 104.543 ? 160 GLN A NE2  1 ? 
ATOM   1569 H  H    . GLN A 1 122 ? 11.911  -30.422 3.803   1 67.776  ? 160 GLN A H    1 ? 
ATOM   1570 H  HA   . GLN A 1 122 ? 11.377  -33.105 3.159   1 65.436  ? 160 GLN A HA   1 ? 
ATOM   1571 H  HB2  . GLN A 1 122 ? 13.252  -32.191 5.113   1 64.231  ? 160 GLN A HB2  1 ? 
ATOM   1572 H  HB3  . GLN A 1 122 ? 12.848  -33.716 4.955   1 64.082  ? 160 GLN A HB3  1 ? 
ATOM   1573 H  HG2  . GLN A 1 122 ? 13.899  -33.857 2.897   1 76.963  ? 160 GLN A HG2  1 ? 
ATOM   1574 H  HG3  . GLN A 1 122 ? 14.132  -32.29  2.852   1 76.882  ? 160 GLN A HG3  1 ? 
ATOM   1575 H  HE21 . GLN A 1 122 ? 17.225  -33.797 3.588   1 99.201  ? 160 GLN A HE21 1 ? 
ATOM   1576 H  HE22 . GLN A 1 122 ? 16.29   -33.603 2.386   1 99.163  ? 160 GLN A HE22 1 ? 
ATOM   1577 N  N    . LEU A 1 123 ? 9.873   -33.5   5.08    1 79.011  ? 161 LEU A N    1 ? 
ATOM   1578 C  CA   . LEU A 1 123 ? 8.866   -33.738 6.109   1 81.768  ? 161 LEU A CA   1 ? 
ATOM   1579 C  C    . LEU A 1 123 ? 9.216   -35.017 6.866   1 75.702  ? 161 LEU A C    1 ? 
ATOM   1580 O  O    . LEU A 1 123 ? 9.712   -35.966 6.251   1 85.843  ? 161 LEU A O    1 ? 
ATOM   1581 C  CB   . LEU A 1 123 ? 7.526   -33.882 5.397   1 74.51   ? 161 LEU A CB   1 ? 
ATOM   1582 C  CG   . LEU A 1 123 ? 7.108   -32.681 4.539   1 81.544  ? 161 LEU A CG   1 ? 
ATOM   1583 C  CD1  . LEU A 1 123 ? 5.935   -32.998 3.634   1 83.392  ? 161 LEU A CD1  1 ? 
ATOM   1584 C  CD2  . LEU A 1 123 ? 6.802   -31.493 5.426   1 78.22   ? 161 LEU A CD2  1 ? 
ATOM   1585 H  H    . LEU A 1 123 ? 9.965   -34.147 4.441   1 77.155  ? 161 LEU A H    1 ? 
ATOM   1586 H  HA   . LEU A 1 123 ? 8.842   -32.969 6.723   1 78.634  ? 161 LEU A HA   1 ? 
ATOM   1587 H  HB2  . LEU A 1 123 ? 7.568   -34.678 4.819   1 77.684  ? 161 LEU A HB2  1 ? 
ATOM   1588 H  HB3  . LEU A 1 123 ? 6.831   -34.038 6.077   1 77.691  ? 161 LEU A HB3  1 ? 
ATOM   1589 H  HG   . LEU A 1 123 ? 7.869   -32.432 3.956   1 79.918  ? 161 LEU A HG   1 ? 
ATOM   1590 H  HD11 . LEU A 1 123 ? 6.18    -33.714 3.024   1 82.882  ? 161 LEU A HD11 1 ? 
ATOM   1591 H  HD12 . LEU A 1 123 ? 5.696   -32.206 3.123   1 82.831  ? 161 LEU A HD12 1 ? 
ATOM   1592 H  HD13 . LEU A 1 123 ? 5.175   -33.277 4.172   1 82.846  ? 161 LEU A HD13 1 ? 
ATOM   1593 H  HD21 . LEU A 1 123 ? 7.618   -31.182 5.85    1 79.202  ? 161 LEU A HD21 1 ? 
ATOM   1594 H  HD22 . LEU A 1 123 ? 6.162   -31.754 6.109   1 79.189  ? 161 LEU A HD22 1 ? 
ATOM   1595 H  HD23 . LEU A 1 123 ? 6.426   -30.776 4.889   1 79.218  ? 161 LEU A HD23 1 ? 
ATOM   1596 N  N    . PRO A 1 124 ? 8.972   -35.099 8.197   1 76.976  ? 162 PRO A N    1 ? 
ATOM   1597 C  CA   . PRO A 1 124 ? 9.364   -36.275 8.977   1 85.168  ? 162 PRO A CA   1 ? 
ATOM   1598 C  C    . PRO A 1 124 ? 8.687   -37.575 8.533   1 89.052  ? 162 PRO A C    1 ? 
ATOM   1599 O  O    . PRO A 1 124 ? 7.759   -37.569 7.715   1 75.104  ? 162 PRO A O    1 ? 
ATOM   1600 C  CB   . PRO A 1 124 ? 9.048   -35.904 10.424  1 81.651  ? 162 PRO A CB   1 ? 
ATOM   1601 C  CG   . PRO A 1 124 ? 8.175   -34.67  10.357  1 87.687  ? 162 PRO A CG   1 ? 
ATOM   1602 C  CD   . PRO A 1 124 ? 8.334   -34.047 9.004   1 84.29   ? 162 PRO A CD   1 ? 
ATOM   1603 H  HA   . PRO A 1 124 ? 10.334  -36.389 8.899   1 83.551  ? 162 PRO A HA   1 ? 
ATOM   1604 H  HB2  . PRO A 1 124 ? 8.575   -36.631 10.877  1 83.807  ? 162 PRO A HB2  1 ? 
ATOM   1605 H  HB3  . PRO A 1 124 ? 9.868   -35.719 10.921  1 83.782  ? 162 PRO A HB3  1 ? 
ATOM   1606 H  HG2  . PRO A 1 124 ? 7.239   -34.907 10.506  1 85.501  ? 162 PRO A HG2  1 ? 
ATOM   1607 H  HG3  . PRO A 1 124 ? 8.442   -34.031 11.049  1 85.5    ? 162 PRO A HG3  1 ? 
ATOM   1608 H  HD2  . PRO A 1 124 ? 7.469   -33.798 8.626   1 83.255  ? 162 PRO A HD2  1 ? 
ATOM   1609 H  HD3  . PRO A 1 124 ? 8.905   -33.255 9.049   1 83.23   ? 162 PRO A HD3  1 ? 
ATOM   1610 N  N    . GLN A 1 125 ? 9.174   -38.705 9.069   1 114.208 ? 163 GLN A N    1 ? 
ATOM   1611 C  CA   . GLN A 1 125 ? 8.708   -40.011 8.618   1 122.147 ? 163 GLN A CA   1 ? 
ATOM   1612 C  C    . GLN A 1 125 ? 7.218   -40.197 8.928   1 111.942 ? 163 GLN A C    1 ? 
ATOM   1613 O  O    . GLN A 1 125 ? 6.677   -39.634 9.889   1 88.579  ? 163 GLN A O    1 ? 
ATOM   1614 C  CB   . GLN A 1 125 ? 9.491   -41.22  9.136   1 126.912 ? 163 GLN A CB   1 ? 
ATOM   1615 C  CG   . GLN A 1 125 ? 9.035   -42.522 8.472   1 139.476 ? 163 GLN A CG   1 ? 
ATOM   1616 C  CD   . GLN A 1 125 ? 9.968   -43.705 8.575   1 144.082 ? 163 GLN A CD   1 ? 
ATOM   1617 O  OE1  . GLN A 1 125 ? 11.112  -43.611 9.031   1 146.604 ? 163 GLN A OE1  1 ? 
ATOM   1618 N  NE2  . GLN A 1 125 ? 9.466   -44.849 8.128   1 143.285 ? 163 GLN A NE2  1 ? 
ATOM   1619 H  H    . GLN A 1 125 ? 9.816   -38.662 9.719   1 109.031 ? 163 GLN A H    1 ? 
ATOM   1620 H  HA   . GLN A 1 125 ? 8.817   -40.023 7.633   1 119.138 ? 163 GLN A HA   1 ? 
ATOM   1621 H  HB2  . GLN A 1 125 ? 10.444  -41.08  8.961   1 128.619 ? 163 GLN A HB2  1 ? 
ATOM   1622 H  HB3  . GLN A 1 125 ? 9.367   -41.291 10.106  1 128.552 ? 163 GLN A HB3  1 ? 
ATOM   1623 H  HG2  . GLN A 1 125 ? 8.182   -42.8   8.866   1 137.298 ? 163 GLN A HG2  1 ? 
ATOM   1624 H  HG3  . GLN A 1 125 ? 8.879   -42.355 7.52    1 137.144 ? 163 GLN A HG3  1 ? 
ATOM   1625 H  HE21 . GLN A 1 125 ? 9.938   -45.597 8.2     1 143.534 ? 163 GLN A HE21 1 ? 
ATOM   1626 H  HE22 . GLN A 1 125 ? 8.658   -44.874 7.757   1 143.455 ? 163 GLN A HE22 1 ? 
ATOM   1627 N  N    . GLY A 1 126 ? 6.551   -40.936 8.028   1 117.073 ? 164 GLY A N    1 ? 
ATOM   1628 C  CA   . GLY A 1 126 ? 5.158   -41.319 8.168   1 123.609 ? 164 GLY A CA   1 ? 
ATOM   1629 C  C    . GLY A 1 126 ? 4.251   -40.342 7.432   1 123.26  ? 164 GLY A C    1 ? 
ATOM   1630 O  O    . GLY A 1 126 ? 3.245   -40.787 6.878   1 130.665 ? 164 GLY A O    1 ? 
ATOM   1631 H  H    . GLY A 1 126 ? 6.971   -41.174 7.252   1 117.606 ? 164 GLY A H    1 ? 
ATOM   1632 H  HA2  . GLY A 1 126 ? 5.037   -42.222 7.792   1 121.937 ? 164 GLY A HA2  1 ? 
ATOM   1633 H  HA3  . GLY A 1 126 ? 4.906   -41.356 9.121   1 121.691 ? 164 GLY A HA3  1 ? 
ATOM   1634 N  N    . THR A 1 127 ? 4.647   -39.047 7.393   1 111.481 ? 165 THR A N    1 ? 
ATOM   1635 C  CA   . THR A 1 127 ? 3.814   -37.937 6.954   1 102.148 ? 165 THR A CA   1 ? 
ATOM   1636 C  C    . THR A 1 127 ? 3.083   -38.308 5.665   1 99.866  ? 165 THR A C    1 ? 
ATOM   1637 O  O    . THR A 1 127 ? 3.652   -38.898 4.746   1 90.449  ? 165 THR A O    1 ? 
ATOM   1638 C  CB   . THR A 1 127 ? 4.616   -36.643 6.768   1 104.641 ? 165 THR A CB   1 ? 
ATOM   1639 O  OG1  . THR A 1 127 ? 5.388   -36.376 7.934   1 105.674 ? 165 THR A OG1  1 ? 
ATOM   1640 C  CG2  . THR A 1 127 ? 3.728   -35.429 6.554   1 99.612  ? 165 THR A CG2  1 ? 
ATOM   1641 H  H    . THR A 1 127 ? 5.491   -38.837 7.662   1 111.952 ? 165 THR A H    1 ? 
ATOM   1642 H  HA   . THR A 1 127 ? 3.151   -37.778 7.659   1 103.948 ? 165 THR A HA   1 ? 
ATOM   1643 H  HB   . THR A 1 127 ? 5.221   -36.739 5.994   1 103.445 ? 165 THR A HB   1 ? 
ATOM   1644 H  HG21 . THR A 1 127 ? 4.272   -34.623 6.574   1 101.07  ? 165 THR A HG21 1 ? 
ATOM   1645 H  HG22 . THR A 1 127 ? 3.063   -35.385 7.262   1 101.07  ? 165 THR A HG22 1 ? 
ATOM   1646 H  HG23 . THR A 1 127 ? 3.281   -35.493 5.694   1 101.062 ? 165 THR A HG23 1 ? 
ATOM   1647 N  N    . THR A 1 128 ? 1.804   -37.938 5.647   1 104.454 ? 166 THR A N    1 ? 
ATOM   1648 C  CA   . THR A 1 128 ? 0.871   -38.307 4.606   1 111.018 ? 166 THR A CA   1 ? 
ATOM   1649 C  C    . THR A 1 128 ? 0.783   -37.11  3.658   1 110.311 ? 166 THR A C    1 ? 
ATOM   1650 O  O    . THR A 1 128 ? 0.134   -36.11  3.964   1 107.764 ? 166 THR A O    1 ? 
ATOM   1651 C  CB   . THR A 1 128 ? -0.438  -38.733 5.295   1 119.904 ? 166 THR A CB   1 ? 
ATOM   1652 O  OG1  . THR A 1 128 ? -1.21   -39.435 4.328   1 122.245 ? 166 THR A OG1  1 ? 
ATOM   1653 C  CG2  . THR A 1 128 ? -1.276  -37.622 5.915   1 112.048 ? 166 THR A CG2  1 ? 
ATOM   1654 H  H    . THR A 1 128 ? 1.499   -37.402 6.321   1 104.98  ? 166 THR A H    1 ? 
ATOM   1655 H  HA   . THR A 1 128 ? 1.222   -39.081 4.114   1 110.817 ? 166 THR A HA   1 ? 
ATOM   1656 H  HB   . THR A 1 128 ? -0.207  -39.357 6.024   1 117.105 ? 166 THR A HB   1 ? 
ATOM   1657 H  HG21 . THR A 1 128 ? -1.862  -38.002 6.592   1 114.22  ? 166 THR A HG21 1 ? 
ATOM   1658 H  HG22 . THR A 1 128 ? -1.816  -37.198 5.228   1 114.184 ? 166 THR A HG22 1 ? 
ATOM   1659 H  HG23 . THR A 1 128 ? -0.698  -36.962 6.327   1 113.962 ? 166 THR A HG23 1 ? 
ATOM   1660 N  N    . LEU A 1 129 ? 1.529   -37.17  2.543   1 93.677  ? 167 LEU A N    1 ? 
ATOM   1661 C  CA   . LEU A 1 129 ? 1.319   -36.217 1.459   1 95.207  ? 167 LEU A CA   1 ? 
ATOM   1662 C  C    . LEU A 1 129 ? -0.008  -36.559 0.78    1 90.746  ? 167 LEU A C    1 ? 
ATOM   1663 O  O    . LEU A 1 129 ? -0.255  -37.726 0.503   1 100.127 ? 167 LEU A O    1 ? 
ATOM   1664 C  CB   . LEU A 1 129 ? 2.462   -36.248 0.445   1 102.046 ? 167 LEU A CB   1 ? 
ATOM   1665 C  CG   . LEU A 1 129 ? 3.801   -35.653 0.891   1 99.978  ? 167 LEU A CG   1 ? 
ATOM   1666 C  CD1  . LEU A 1 129 ? 4.886   -36.074 -0.078  1 96.79   ? 167 LEU A CD1  1 ? 
ATOM   1667 C  CD2  . LEU A 1 129 ? 3.742   -34.133 0.97    1 100.399 ? 167 LEU A CD2  1 ? 
ATOM   1668 H  H    . LEU A 1 129 ? 2.182   -37.804 2.458   1 97.975  ? 167 LEU A H    1 ? 
ATOM   1669 H  HA   . LEU A 1 129 ? 1.274   -35.316 1.851   1 95.496  ? 167 LEU A HA   1 ? 
ATOM   1670 H  HB2  . LEU A 1 129 ? 2.608   -37.186 0.183   1 99.928  ? 167 LEU A HB2  1 ? 
ATOM   1671 H  HB3  . LEU A 1 129 ? 2.168   -35.765 -0.362  1 99.915  ? 167 LEU A HB3  1 ? 
ATOM   1672 H  HG   . LEU A 1 129 ? 4.022   -36.01  1.79    1 99.828  ? 167 LEU A HG   1 ? 
ATOM   1673 H  HD11 . LEU A 1 129 ? 4.948   -37.044 -0.099  1 97.743  ? 167 LEU A HD11 1 ? 
ATOM   1674 H  HD12 . LEU A 1 129 ? 5.737   -35.701 0.204   1 97.732  ? 167 LEU A HD12 1 ? 
ATOM   1675 H  HD13 . LEU A 1 129 ? 4.667   -35.745 -0.963  1 97.75   ? 167 LEU A HD13 1 ? 
ATOM   1676 H  HD21 . LEU A 1 129 ? 3.109   -33.865 1.657   1 100.207 ? 167 LEU A HD21 1 ? 
ATOM   1677 H  HD22 . LEU A 1 129 ? 3.46    -33.774 0.112   1 100.233 ? 167 LEU A HD22 1 ? 
ATOM   1678 H  HD23 . LEU A 1 129 ? 4.622   -33.786 1.191   1 100.124 ? 167 LEU A HD23 1 ? 
ATOM   1679 N  N    . PRO A 1 130 ? -0.895  -35.591 0.447   1 94.633  ? 168 PRO A N    1 ? 
ATOM   1680 C  CA   . PRO A 1 130 ? -2.103  -35.923 -0.301  1 97.6    ? 168 PRO A CA   1 ? 
ATOM   1681 C  C    . PRO A 1 130 ? -1.807  -36.552 -1.663  1 102.788 ? 168 PRO A C    1 ? 
ATOM   1682 O  O    . PRO A 1 130 ? -0.696  -36.419 -2.183  1 108.855 ? 168 PRO A O    1 ? 
ATOM   1683 C  CB   . PRO A 1 130 ? -2.855  -34.602 -0.439  1 89.728  ? 168 PRO A CB   1 ? 
ATOM   1684 C  CG   . PRO A 1 130 ? -2.131  -33.615 0.436   1 92.307  ? 168 PRO A CG   1 ? 
ATOM   1685 C  CD   . PRO A 1 130 ? -0.773  -34.154 0.747   1 97.162  ? 168 PRO A CD   1 ? 
ATOM   1686 H  HA   . PRO A 1 130 ? -2.646  -36.543 0.231   1 96.497  ? 168 PRO A HA   1 ? 
ATOM   1687 H  HB2  . PRO A 1 130 ? -2.865  -34.296 -1.367  1 92.346  ? 168 PRO A HB2  1 ? 
ATOM   1688 H  HB3  . PRO A 1 130 ? -3.775  -34.705 -0.132  1 92.333  ? 168 PRO A HB3  1 ? 
ATOM   1689 H  HG2  . PRO A 1 130 ? -2.056  -32.753 -0.015  1 92.648  ? 168 PRO A HG2  1 ? 
ATOM   1690 H  HG3  . PRO A 1 130 ? -2.628  -33.486 1.258   1 92.632  ? 168 PRO A HG3  1 ? 
ATOM   1691 H  HD2  . PRO A 1 130 ? -0.088  -33.74  0.186   1 95.453  ? 168 PRO A HD2  1 ? 
ATOM   1692 H  HD3  . PRO A 1 130 ? -0.55   -34.012 1.687   1 95.449  ? 168 PRO A HD3  1 ? 
ATOM   1693 N  N    . LYS A 1 131 ? -2.803  -37.265 -2.206  1 97.514  ? 169 LYS A N    1 ? 
ATOM   1694 C  CA   . LYS A 1 131 ? -2.74   -37.814 -3.553  1 114.542 ? 169 LYS A CA   1 ? 
ATOM   1695 C  C    . LYS A 1 131 ? -2.386  -36.703 -4.555  1 108.069 ? 169 LYS A C    1 ? 
ATOM   1696 O  O    . LYS A 1 131 ? -2.938  -35.596 -4.506  1 89.144  ? 169 LYS A O    1 ? 
ATOM   1697 C  CB   . LYS A 1 131 ? -4.042  -38.548 -3.918  1 131.056 ? 169 LYS A CB   1 ? 
ATOM   1698 C  CG   . LYS A 1 131 ? -5.349  -37.73  -3.886  1 151.465 ? 169 LYS A CG   1 ? 
ATOM   1699 C  CD   . LYS A 1 131 ? -6.607  -38.423 -4.415  1 155.208 ? 169 LYS A CD   1 ? 
ATOM   1700 C  CE   . LYS A 1 131 ? -7.26   -39.416 -3.49   1 150.65  ? 169 LYS A CE   1 ? 
ATOM   1701 N  NZ   . LYS A 1 131 ? -7.904  -38.796 -2.327  1 147.705 ? 169 LYS A NZ   1 ? 
ATOM   1702 H  H    . LYS A 1 131 ? -3.547  -37.432 -1.702  1 102.994 ? 169 LYS A H    1 ? 
ATOM   1703 H  HA   . LYS A 1 131 ? -2.015  -38.489 -3.56   1 112.374 ? 169 LYS A HA   1 ? 
ATOM   1704 H  HB2  . LYS A 1 131 ? -3.939  -38.917 -4.821  1 131.351 ? 169 LYS A HB2  1 ? 
ATOM   1705 H  HB3  . LYS A 1 131 ? -4.146  -39.306 -3.304  1 131.352 ? 169 LYS A HB3  1 ? 
ATOM   1706 H  HG2  . LYS A 1 131 ? -5.514  -37.453 -2.96   1 146.924 ? 169 LYS A HG2  1 ? 
ATOM   1707 H  HG3  . LYS A 1 131 ? -5.212  -36.911 -4.408  1 146.718 ? 169 LYS A HG3  1 ? 
ATOM   1708 H  HD2  . LYS A 1 131 ? -7.264  -37.729 -4.643  1 153.268 ? 169 LYS A HD2  1 ? 
ATOM   1709 H  HD3  . LYS A 1 131 ? -6.374  -38.881 -5.251  1 153.286 ? 169 LYS A HD3  1 ? 
ATOM   1710 H  HE2  . LYS A 1 131 ? -7.932  -39.916 -3.987  1 150.971 ? 169 LYS A HE2  1 ? 
ATOM   1711 H  HE3  . LYS A 1 131 ? -6.589  -40.049 -3.176  1 150.97  ? 169 LYS A HE3  1 ? 
ATOM   1712 H  HZ1  . LYS A 1 131 ? -8.434  -38.112 -2.596  1 148.638 ? 169 LYS A HZ1  1 ? 
ATOM   1713 H  HZ2  . LYS A 1 131 ? -7.274  -38.478 -1.758  1 148.602 ? 169 LYS A HZ2  1 ? 
ATOM   1714 H  HZ3  . LYS A 1 131 ? -8.409  -39.41  -1.893  1 148.611 ? 169 LYS A HZ3  1 ? 
ATOM   1715 N  N    . GLY A 1 132 ? -1.404  -36.987 -5.427  1 94.794  ? 170 GLY A N    1 ? 
ATOM   1716 C  CA   . GLY A 1 132 ? -0.974  -36.05  -6.453  1 98.783  ? 170 GLY A CA   1 ? 
ATOM   1717 C  C    . GLY A 1 132 ? -0.02   -34.97  -5.936  1 102.274 ? 170 GLY A C    1 ? 
ATOM   1718 O  O    . GLY A 1 132 ? 0.236   -34.016 -6.671  1 91.203  ? 170 GLY A O    1 ? 
ATOM   1719 H  H    . GLY A 1 132 ? -0.985  -37.798 -5.383  1 98.929  ? 170 GLY A H    1 ? 
ATOM   1720 H  HA2  . GLY A 1 132 ? -0.528  -36.555 -7.173  1 98.573  ? 170 GLY A HA2  1 ? 
ATOM   1721 H  HA3  . GLY A 1 132 ? -1.77   -35.617 -6.846  1 98.573  ? 170 GLY A HA3  1 ? 
ATOM   1722 N  N    . PHE A 1 133 ? 0.477   -35.107 -4.688  1 93.142  ? 171 PHE A N    1 ? 
ATOM   1723 C  CA   . PHE A 1 133 ? 1.577   -34.31  -4.177  1 82.986  ? 171 PHE A CA   1 ? 
ATOM   1724 C  C    . PHE A 1 133 ? 2.781   -35.199 -3.896  1 88.404  ? 171 PHE A C    1 ? 
ATOM   1725 O  O    . PHE A 1 133 ? 2.639   -36.332 -3.437  1 93.514  ? 171 PHE A O    1 ? 
ATOM   1726 C  CB   . PHE A 1 133 ? 1.24    -33.592 -2.872  1 85.781  ? 171 PHE A CB   1 ? 
ATOM   1727 C  CG   . PHE A 1 133 ? 0.357   -32.377 -3.074  1 84.734  ? 171 PHE A CG   1 ? 
ATOM   1728 C  CD1  . PHE A 1 133 ? -1.031  -32.498 -3.147  1 91.044  ? 171 PHE A CD1  1 ? 
ATOM   1729 C  CD2  . PHE A 1 133 ? 0.928   -31.121 -3.2    1 74.105  ? 171 PHE A CD2  1 ? 
ATOM   1730 C  CE1  . PHE A 1 133 ? -1.826  -31.375 -3.328  1 92.719  ? 171 PHE A CE1  1 ? 
ATOM   1731 C  CE2  . PHE A 1 133 ? 0.134   -30.006 -3.372  1 86.681  ? 171 PHE A CE2  1 ? 
ATOM   1732 C  CZ   . PHE A 1 133 ? -1.239  -30.128 -3.433  1 92.833  ? 171 PHE A CZ   1 ? 
ATOM   1733 H  H    . PHE A 1 133 ? 0.105   -35.714 -4.118  1 92.875  ? 171 PHE A H    1 ? 
ATOM   1734 H  HA   . PHE A 1 133 ? 1.824   -33.633 -4.849  1 86.575  ? 171 PHE A HA   1 ? 
ATOM   1735 H  HB2  . PHE A 1 133 ? 0.786   -34.222 -2.272  1 84.997  ? 171 PHE A HB2  1 ? 
ATOM   1736 H  HB3  . PHE A 1 133 ? 2.077   -33.307 -2.438  1 84.845  ? 171 PHE A HB3  1 ? 
ATOM   1737 H  HD1  . PHE A 1 133 ? -1.43   -33.35  -3.068  1 89.814  ? 171 PHE A HD1  1 ? 
ATOM   1738 H  HD2  . PHE A 1 133 ? 1.866   -31.026 -3.144  1 79.613  ? 171 PHE A HD2  1 ? 
ATOM   1739 H  HE1  . PHE A 1 133 ? -2.764  -31.463 -3.372  1 92.159  ? 171 PHE A HE1  1 ? 
ATOM   1740 H  HE2  . PHE A 1 133 ? 0.534   -29.169 -3.44   1 84.902  ? 171 PHE A HE2  1 ? 
ATOM   1741 H  HZ   . PHE A 1 133 ? -1.776  -29.362 -3.561  1 91.148  ? 171 PHE A HZ   1 ? 
ATOM   1742 N  N    . TYR A 1 134 ? 3.963   -34.637 -4.191  1 103.067 ? 172 TYR A N    1 ? 
ATOM   1743 C  CA   . TYR A 1 134 ? 5.261   -35.238 -3.919  1 100.907 ? 172 TYR A CA   1 ? 
ATOM   1744 C  C    . TYR A 1 134 ? 6.223   -34.085 -3.616  1 95.301  ? 172 TYR A C    1 ? 
ATOM   1745 O  O    . TYR A 1 134 ? 6.044   -32.974 -4.131  1 86.45   ? 172 TYR A O    1 ? 
ATOM   1746 C  CB   . TYR A 1 134 ? 5.742   -36.095 -5.1    1 101.943 ? 172 TYR A CB   1 ? 
ATOM   1747 C  CG   . TYR A 1 134 ? 4.733   -37.084 -5.683  1 100.784 ? 172 TYR A CG   1 ? 
ATOM   1748 C  CD1  . TYR A 1 134 ? 3.742   -36.654 -6.569  1 98.61   ? 172 TYR A CD1  1 ? 
ATOM   1749 C  CD2  . TYR A 1 134 ? 4.768   -38.442 -5.365  1 94.904  ? 172 TYR A CD2  1 ? 
ATOM   1750 C  CE1  . TYR A 1 134 ? 2.804   -37.528 -7.095  1 87.697  ? 172 TYR A CE1  1 ? 
ATOM   1751 C  CE2  . TYR A 1 134 ? 3.841   -39.33  -5.894  1 88.243  ? 172 TYR A CE2  1 ? 
ATOM   1752 C  CZ   . TYR A 1 134 ? 2.859   -38.869 -6.759  1 91.944  ? 172 TYR A CZ   1 ? 
ATOM   1753 O  OH   . TYR A 1 134 ? 1.92    -39.694 -7.301  1 90.008  ? 172 TYR A OH   1 ? 
ATOM   1754 H  H    . TYR A 1 134 ? 3.96    -33.816 -4.595  1 98.626  ? 172 TYR A H    1 ? 
ATOM   1755 H  HA   . TYR A 1 134 ? 5.188   -35.816 -3.12   1 100.327 ? 172 TYR A HA   1 ? 
ATOM   1756 H  HB2  . TYR A 1 134 ? 6.031   -35.489 -5.819  1 101.407 ? 172 TYR A HB2  1 ? 
ATOM   1757 H  HB3  . TYR A 1 134 ? 6.536   -36.596 -4.81   1 101.433 ? 172 TYR A HB3  1 ? 
ATOM   1758 H  HD1  . TYR A 1 134 ? 3.684   -35.738 -6.784  1 96.109  ? 172 TYR A HD1  1 ? 
ATOM   1759 H  HD2  . TYR A 1 134 ? 5.433   -38.763 -4.777  1 94.597  ? 172 TYR A HD2  1 ? 
ATOM   1760 H  HE1  . TYR A 1 134 ? 2.135   -37.213 -7.679  1 91.198  ? 172 TYR A HE1  1 ? 
ATOM   1761 H  HE2  . TYR A 1 134 ? 3.879   -40.244 -5.668  1 90.71   ? 172 TYR A HE2  1 ? 
ATOM   1762 N  N    . ALA A 1 135 ? 7.234   -34.341 -2.772  1 99.034  ? 173 ALA A N    1 ? 
ATOM   1763 C  CA   . ALA A 1 135 ? 8.365   -33.434 -2.632  1 100.771 ? 173 ALA A CA   1 ? 
ATOM   1764 C  C    . ALA A 1 135 ? 9.296   -33.657 -3.831  1 107.972 ? 173 ALA A C    1 ? 
ATOM   1765 O  O    . ALA A 1 135 ? 10.213  -34.471 -3.741  1 96.224  ? 173 ALA A O    1 ? 
ATOM   1766 C  CB   . ALA A 1 135 ? 9.036   -33.635 -1.286  1 100.598 ? 173 ALA A CB   1 ? 
ATOM   1767 H  H    . ALA A 1 135 ? 7.216   -35.101 -2.266  1 98.559  ? 173 ALA A H    1 ? 
ATOM   1768 H  HA   . ALA A 1 135 ? 8.028   -32.496 -2.667  1 101.637 ? 173 ALA A HA   1 ? 
ATOM   1769 H  HB1  . ALA A 1 135 ? 8.403   -33.437 -0.575  1 100.643 ? 173 ALA A HB1  1 ? 
ATOM   1770 H  HB2  . ALA A 1 135 ? 9.336   -34.554 -1.201  1 100.625 ? 173 ALA A HB2  1 ? 
ATOM   1771 H  HB3  . ALA A 1 135 ? 9.8     -33.038 -1.209  1 100.643 ? 173 ALA A HB3  1 ? 
ATOM   1772 N  N    . GLU A 1 136 ? 8.948   -32.982 -4.955  1 119.964 ? 174 GLU A N    1 ? 
ATOM   1773 C  CA   . GLU A 1 136 ? 9.542   -33.041 -6.295  1 118.079 ? 174 GLU A CA   1 ? 
ATOM   1774 C  C    . GLU A 1 136 ? 8.931   -34.189 -7.146  1 111.888 ? 174 GLU A C    1 ? 
ATOM   1775 O  O    . GLU A 1 136 ? 9.425   -35.325 -6.979  1 115.912 ? 174 GLU A O    1 ? 
ATOM   1776 C  CB   . GLU A 1 136 ? 11.073  -32.965 -6.299  1 117.77  ? 174 GLU A CB   1 ? 
ATOM   1777 C  CG   . GLU A 1 136 ? 11.582  -31.636 -5.74   1 122.432 ? 174 GLU A CG   1 ? 
ATOM   1778 C  CD   . GLU A 1 136 ? 13.019  -31.256 -6.057  1 139.958 ? 174 GLU A CD   1 ? 
ATOM   1779 O  OE1  . GLU A 1 136 ? 13.469  -31.45  -7.213  1 143.827 ? 174 GLU A OE1  1 ? 
ATOM   1780 O  OE2  . GLU A 1 136 ? 13.676  -30.712 -5.14   1 141.779 ? 174 GLU A OE2  1 ? 
ATOM   1781 O  OXT  . GLU A 1 136 ? 8.002   -33.905 -7.992  1 85.489  ? 174 GLU A OXT  1 ? 
ATOM   1782 H  H    . GLU A 1 136 ? 8.241   -32.41  -4.868  1 116.201 ? 174 GLU A H    1 ? 
ATOM   1783 H  HA   . GLU A 1 136 ? 9.262   -32.207 -6.75   1 117.073 ? 174 GLU A HA   1 ? 
ATOM   1784 H  HB2  . GLU A 1 136 ? 11.443  -33.709 -5.784  1 118.702 ? 174 GLU A HB2  1 ? 
ATOM   1785 H  HB3  . GLU A 1 136 ? 11.384  -33.064 -7.222  1 118.964 ? 174 GLU A HB3  1 ? 
ATOM   1786 H  HG2  . GLU A 1 136 ? 11.004  -30.916 -6.068  1 125.024 ? 174 GLU A HG2  1 ? 
ATOM   1787 H  HG3  . GLU A 1 136 ? 11.482  -31.655 -4.765  1 124.874 ? 174 GLU A HG3  1 ? 
HETATM 1788 ZN ZN   . ZN  B 2 .   ? 13.563  -19.092 16.4    1 65.551  ? 201 ZN  A ZN   1 ? 
HETATM 1789 O  O    . HOH C 3 .   ? 6.738   -24.341 22.759  1 67.793  ? 301 HOH A O    1 ? 
HETATM 1790 O  O    . HOH C 3 .   ? -6.926  -27.135 15.226  1 71.648  ? 302 HOH A O    1 ? 
HETATM 1791 O  O    . HOH C 3 .   ? 10.609  -25.347 10.18   1 48.016  ? 303 HOH A O    1 ? 
HETATM 1792 O  O    . HOH C 3 .   ? 16.346  -30.124 3.673   1 69.213  ? 304 HOH A O    1 ? 
HETATM 1793 O  O    . HOH C 3 .   ? 10.553  -29.764 -3.088  1 70.106  ? 305 HOH A O    1 ? 
HETATM 1794 O  O    . HOH C 3 .   ? 7.963   -11.538 4.949   1 76.953  ? 306 HOH A O    1 ? 
HETATM 1795 O  O    . HOH C 3 .   ? 4.545   -36.168 10.357  1 82.978  ? 307 HOH A O    1 ? 
HETATM 1796 O  O    . HOH C 3 .   ? 13.572  -27.185 14.013  1 57.415  ? 308 HOH A O    1 ? 
HETATM 1797 O  O    . HOH C 3 .   ? 8.335   -23.751 0.236   1 58.763  ? 309 HOH A O    1 ? 
HETATM 1798 O  O    . HOH C 3 .   ? 12.898  -29.04  4.836   1 57.909  ? 310 HOH A O    1 ? 
HETATM 1799 O  O    . HOH C 3 .   ? 0.279   -13.593 11.528  1 78.114  ? 311 HOH A O    1 ? 
HETATM 1800 O  O    . HOH C 3 .   ? 8.476   -18.249 17.802  1 60.013  ? 312 HOH A O    1 ? 
HETATM 1801 O  O    . HOH C 3 .   ? -1.86   -16.086 14.308  1 70.8    ? 313 HOH A O    1 ? 
HETATM 1802 O  O    . HOH C 3 .   ? 9.659   -20.015 4.059   1 49.696  ? 314 HOH A O    1 ? 
HETATM 1803 O  O    . HOH C 3 .   ? 2.599   -16.131 -7.195  1 74.755  ? 315 HOH A O    1 ? 
HETATM 1804 O  O    . HOH C 3 .   ? 7.116   -27.302 17.672  1 66.203  ? 316 HOH A O    1 ? 
HETATM 1805 O  O    . HOH C 3 .   ? 12.451  -11.981 -4.585  1 83.051  ? 317 HOH A O    1 ? 
HETATM 1806 O  O    . HOH C 3 .   ? 0.932   -15.574 8.519   1 69.155  ? 318 HOH A O    1 ? 
HETATM 1807 O  O    . HOH C 3 .   ? -2.401  -18.204 -3.787  1 84.868  ? 319 HOH A O    1 ? 
HETATM 1808 O  O    . HOH C 3 .   ? 3.302   -18.906 -3.074  1 65.748  ? 320 HOH A O    1 ? 
HETATM 1809 O  O    . HOH C 3 .   ? -3.639  -32.851 -5.95   1 96.185  ? 321 HOH A O    1 ? 
HETATM 1810 O  O    . HOH C 3 .   ? -4.674  -25.915 -7.163  1 92.106  ? 322 HOH A O    1 ? 
HETATM 1811 O  O    . HOH C 3 .   ? 9.172   -17.538 5.819   1 58.534  ? 323 HOH A O    1 ? 
HETATM 1812 O  O    . HOH C 3 .   ? 4.026   -30.166 11.202  1 60.057  ? 324 HOH A O    1 ? 
HETATM 1813 O  O    . HOH C 3 .   ? 10.442  -13.181 15.875  1 74.19   ? 325 HOH A O    1 ? 
HETATM 1814 O  O    . HOH C 3 .   ? -5.758  -24.485 6.205   1 59.624  ? 326 HOH A O    1 ? 
HETATM 1815 O  O    . HOH C 3 .   ? 18.507  -28.673 1.533   1 75.51   ? 327 HOH A O    1 ? 
HETATM 1816 O  O    . HOH C 3 .   ? 11.837  -21.331 -2.827  1 64.259  ? 328 HOH A O    1 ? 
HETATM 1817 O  O    . HOH C 3 .   ? 1.23    -19.023 21.403  1 62.698  ? 329 HOH A O    1 ? 
HETATM 1818 O  O    . HOH C 3 .   ? -1.808  -10.666 4.607   1 100.342 ? 330 HOH A O    1 ? 
HETATM 1819 O  O    . HOH C 3 .   ? 10.926  -25.457 -6.058  1 57.759  ? 331 HOH A O    1 ? 
HETATM 1820 O  O    . HOH C 3 .   ? -1.177  -14.422 19.79   1 92.528  ? 332 HOH A O    1 ? 
HETATM 1821 O  O    . HOH C 3 .   ? -1.352  -28.66  10.602  1 53.177  ? 333 HOH A O    1 ? 
HETATM 1822 O  O    . HOH C 3 .   ? -4.164  -26.996 12.526  1 72.972  ? 334 HOH A O    1 ? 
HETATM 1823 O  O    . HOH C 3 .   ? -8.89   -24.398 -6.165  1 74.234  ? 335 HOH A O    1 ? 
HETATM 1824 O  O    . HOH C 3 .   ? 22.844  -16.295 -5.602  1 87.25   ? 336 HOH A O    1 ? 
HETATM 1825 O  O    . HOH C 3 .   ? 11.611  -27.754 16.167  1 59.808  ? 337 HOH A O    1 ? 
HETATM 1826 O  O    . HOH C 3 .   ? 19.13   -12.005 4.278   1 76.694  ? 338 HOH A O    1 ? 
HETATM 1827 O  O    . HOH C 3 .   ? 15.88   -20.351 7.824   1 59.835  ? 339 HOH A O    1 ? 
HETATM 1828 O  O    . HOH C 3 .   ? 8.824   -37.978 3.722   1 86.826  ? 340 HOH A O    1 ? 
HETATM 1829 O  O    . HOH C 3 .   ? 10.203  -35.776 2.592   1 68.583  ? 341 HOH A O    1 ? 
HETATM 1830 O  O    . HOH C 3 .   ? 16.084  -18.792 -5.634  1 64.734  ? 342 HOH A O    1 ? 
HETATM 1831 O  O    . HOH C 3 .   ? -2.368  -16.437 20.607  1 71.342  ? 343 HOH A O    1 ? 
HETATM 1832 O  O    . HOH C 3 .   ? -3.143  -19.403 -8.007  1 78.078  ? 344 HOH A O    1 ? 
HETATM 1833 O  O    . HOH C 3 .   ? 16.333  -18.36  9.316   1 71.206  ? 345 HOH A O    1 ? 
HETATM 1834 O  O    . HOH C 3 .   ? 12.622  -38.255 5.788   1 81.125  ? 346 HOH A O    1 ? 
HETATM 1835 O  O    . HOH C 3 .   ? 10.757  -39.222 4.612   1 73.962  ? 347 HOH A O    1 ? 
HETATM 1836 O  O    . HOH C 3 .   ? 18.25   -14.823 6.111   1 74.633  ? 348 HOH A O    1 ? 
HETATM 1837 O  O    . HOH C 3 .   ? 1.002   -10.994 -8.543  1 88.658  ? 349 HOH A O    1 ? 
HETATM 1838 O  O    . HOH C 3 .   ? 4.931   -19.216 -20.146 1 72.903  ? 350 HOH A O    1 ? 
# 
