data_8RPT
# 
_entry.id   8RPT 
# 
_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   8RPT         pdb_00008rpt 10.2210/pdb8rpt/pdb 
WWPDB D_1292135975 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2024-11-20 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        8RPT 
_pdbx_database_status.recvd_initial_deposition_date   2024-01-17 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_database_related.db_name        PDB 
_pdbx_database_related.details        . 
_pdbx_database_related.db_id          8RPS 
_pdbx_database_related.content_type   unspecified 
# 
_pdbx_contact_author.id                 3 
_pdbx_contact_author.email              rgds@st-andrews.ac.uk 
_pdbx_contact_author.name_first         Rafael 
_pdbx_contact_author.name_last          'da Silva' 
_pdbx_contact_author.name_mi            Guimaraes 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-1308-8190 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Devi, S.'       1 0000-0001-8651-2987 
'da Silva, R.G.' 2 0000-0002-1308-8190 
# 
_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                   GE 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Chembiochem 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           1439-7633 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            25 
_citation.language                  ? 
_citation.page_first                e202400047 
_citation.page_last                 e202400047 
_citation.title                     
;Human 2'-Deoxynucleoside 5'-Phosphate N-Hydrolase 1: The Catalytic Roles of Tyr24 and Asp80.
;
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1002/cbic.202400047 
_citation.pdbx_database_id_PubMed   38350003 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Carberry, A.E.' 1 ? 
primary 'Devi, S.'       2 ? 
primary 'Harrison, D.J.' 3 ? 
primary 'da Silva, R.G.' 4 ? 
# 
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 
;2'-deoxynucleoside 5'-phosphate N-hydrolase 1
;
16150.210 2   3.2.2.- D80A ? ? 
2 non-polymer syn 'CHLORIDE ION'                                  35.453    8   ?       ?    ? ? 
3 non-polymer syn 'DI(HYDROXYETHYL)ETHER'                         106.120   2   ?       ?    ? ? 
4 non-polymer syn 1,2-ETHANEDIOL                                  62.068    4   ?       ?    ? ? 
5 water       nat water                                           18.015    145 ?       ?    ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'c-Myc-responsive protein RCL' 
# 
_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       
;GMRPALYFCGSIRGGREDRTLYERIVSRLRRFGTVLTEHVAAAELGARGEEAAGGDRLIHEQALEWLQQADVVVAEVTQP
SLGVGYELGRAVAFNKRILCLFRPQSGRVLSAMIRGAADGSRFQVWDYEEGEVEALLDRYFEADP
;
_entity_poly.pdbx_seq_one_letter_code_can   
;GMRPALYFCGSIRGGREDRTLYERIVSRLRRFGTVLTEHVAAAELGARGEEAAGGDRLIHEQALEWLQQADVVVAEVTQP
SLGVGYELGRAVAFNKRILCLFRPQSGRVLSAMIRGAADGSRFQVWDYEEGEVEALLDRYFEADP
;
_entity_poly.pdbx_strand_id                 B,A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'CHLORIDE ION'          CL  
3 'DI(HYDROXYETHYL)ETHER' PEG 
4 1,2-ETHANEDIOL          EDO 
5 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   MET n 
1 3   ARG n 
1 4   PRO n 
1 5   ALA n 
1 6   LEU n 
1 7   TYR n 
1 8   PHE n 
1 9   CYS n 
1 10  GLY n 
1 11  SER n 
1 12  ILE n 
1 13  ARG n 
1 14  GLY n 
1 15  GLY n 
1 16  ARG n 
1 17  GLU n 
1 18  ASP n 
1 19  ARG n 
1 20  THR n 
1 21  LEU n 
1 22  TYR n 
1 23  GLU n 
1 24  ARG n 
1 25  ILE n 
1 26  VAL n 
1 27  SER n 
1 28  ARG n 
1 29  LEU n 
1 30  ARG n 
1 31  ARG n 
1 32  PHE n 
1 33  GLY n 
1 34  THR n 
1 35  VAL n 
1 36  LEU n 
1 37  THR n 
1 38  GLU n 
1 39  HIS n 
1 40  VAL n 
1 41  ALA n 
1 42  ALA n 
1 43  ALA n 
1 44  GLU n 
1 45  LEU n 
1 46  GLY n 
1 47  ALA n 
1 48  ARG n 
1 49  GLY n 
1 50  GLU n 
1 51  GLU n 
1 52  ALA n 
1 53  ALA n 
1 54  GLY n 
1 55  GLY n 
1 56  ASP n 
1 57  ARG n 
1 58  LEU n 
1 59  ILE n 
1 60  HIS n 
1 61  GLU n 
1 62  GLN n 
1 63  ALA n 
1 64  LEU n 
1 65  GLU n 
1 66  TRP n 
1 67  LEU n 
1 68  GLN n 
1 69  GLN n 
1 70  ALA n 
1 71  ASP n 
1 72  VAL n 
1 73  VAL n 
1 74  VAL n 
1 75  ALA n 
1 76  GLU n 
1 77  VAL n 
1 78  THR n 
1 79  GLN n 
1 80  PRO n 
1 81  SER n 
1 82  LEU n 
1 83  GLY n 
1 84  VAL n 
1 85  GLY n 
1 86  TYR n 
1 87  GLU n 
1 88  LEU n 
1 89  GLY n 
1 90  ARG n 
1 91  ALA n 
1 92  VAL n 
1 93  ALA n 
1 94  PHE n 
1 95  ASN n 
1 96  LYS n 
1 97  ARG n 
1 98  ILE n 
1 99  LEU n 
1 100 CYS n 
1 101 LEU n 
1 102 PHE n 
1 103 ARG n 
1 104 PRO n 
1 105 GLN n 
1 106 SER n 
1 107 GLY n 
1 108 ARG n 
1 109 VAL n 
1 110 LEU n 
1 111 SER n 
1 112 ALA n 
1 113 MET n 
1 114 ILE n 
1 115 ARG n 
1 116 GLY n 
1 117 ALA n 
1 118 ALA n 
1 119 ASP n 
1 120 GLY n 
1 121 SER n 
1 122 ARG n 
1 123 PHE n 
1 124 GLN n 
1 125 VAL n 
1 126 TRP n 
1 127 ASP n 
1 128 TYR n 
1 129 GLU n 
1 130 GLU n 
1 131 GLY n 
1 132 GLU n 
1 133 VAL n 
1 134 GLU n 
1 135 ALA n 
1 136 LEU n 
1 137 LEU n 
1 138 ASP n 
1 139 ARG n 
1 140 TYR n 
1 141 PHE n 
1 142 GLU n 
1 143 ALA n 
1 144 ASP n 
1 145 PRO 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                   145 
_entity_src_gen.gene_src_common_name               human 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'DNPH1, C6orf108, RCL' 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Homo sapiens' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     9606 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     562 
_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 
CL  non-polymer         . 'CHLORIDE ION'          ?                 'Cl -1'          35.453  
CYS 'L-peptide linking' y CYSTEINE                ?                 'C3 H7 N O2 S'   121.158 
EDO non-polymer         . 1,2-ETHANEDIOL          'ETHYLENE GLYCOL' 'C2 H6 O2'       62.068  
GLN 'L-peptide linking' y GLUTAMINE               ?                 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'         ?                 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE                 ?                 'C2 H5 N O2'     75.067  
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 
PEG non-polymer         . 'DI(HYDROXYETHYL)ETHER' ?                 'C4 H10 O3'      106.120 
PHE 'L-peptide linking' y PHENYLALANINE           ?                 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE                 ?                 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE                  ?                 'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE               ?                 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN              ?                 'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE                ?                 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE                  ?                 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   GLY 1   18  18  GLY GLY B . n 
A 1 2   MET 2   19  19  MET MET B . n 
A 1 3   ARG 3   20  20  ARG ARG B . n 
A 1 4   PRO 4   21  21  PRO PRO B . n 
A 1 5   ALA 5   22  22  ALA ALA B . n 
A 1 6   LEU 6   23  23  LEU LEU B . n 
A 1 7   TYR 7   24  24  TYR TYR B . n 
A 1 8   PHE 8   25  25  PHE PHE B . n 
A 1 9   CYS 9   26  26  CYS CYS B . n 
A 1 10  GLY 10  27  27  GLY GLY B . n 
A 1 11  SER 11  28  28  SER SER B . n 
A 1 12  ILE 12  29  29  ILE ILE B . n 
A 1 13  ARG 13  30  30  ARG ARG B . n 
A 1 14  GLY 14  31  31  GLY GLY B . n 
A 1 15  GLY 15  32  32  GLY GLY B . n 
A 1 16  ARG 16  33  33  ARG ARG B . n 
A 1 17  GLU 17  34  34  GLU GLU B . n 
A 1 18  ASP 18  35  35  ASP ASP B . n 
A 1 19  ARG 19  36  36  ARG ARG B . n 
A 1 20  THR 20  37  37  THR THR B . n 
A 1 21  LEU 21  38  38  LEU LEU B . n 
A 1 22  TYR 22  39  39  TYR TYR B . n 
A 1 23  GLU 23  40  40  GLU GLU B . n 
A 1 24  ARG 24  41  41  ARG ARG B . n 
A 1 25  ILE 25  42  42  ILE ILE B . n 
A 1 26  VAL 26  43  43  VAL VAL B . n 
A 1 27  SER 27  44  44  SER SER B . n 
A 1 28  ARG 28  45  45  ARG ARG B . n 
A 1 29  LEU 29  46  46  LEU LEU B . n 
A 1 30  ARG 30  47  47  ARG ARG B . n 
A 1 31  ARG 31  48  48  ARG ARG B . n 
A 1 32  PHE 32  49  49  PHE PHE B . n 
A 1 33  GLY 33  50  50  GLY GLY B . n 
A 1 34  THR 34  51  51  THR THR B . n 
A 1 35  VAL 35  52  52  VAL VAL B . n 
A 1 36  LEU 36  53  53  LEU LEU B . n 
A 1 37  THR 37  54  54  THR THR B . n 
A 1 38  GLU 38  55  55  GLU GLU B . n 
A 1 39  HIS 39  56  56  HIS HIS B . n 
A 1 40  VAL 40  57  57  VAL VAL B . n 
A 1 41  ALA 41  58  58  ALA ALA B . n 
A 1 42  ALA 42  59  59  ALA ALA B . n 
A 1 43  ALA 43  60  60  ALA ALA B . n 
A 1 44  GLU 44  61  61  GLU GLU B . n 
A 1 45  LEU 45  62  62  LEU LEU B . n 
A 1 46  GLY 46  63  63  GLY GLY B . n 
A 1 47  ALA 47  64  64  ALA ALA B . n 
A 1 48  ARG 48  65  65  ARG ARG B . n 
A 1 49  GLY 49  66  66  GLY GLY B . n 
A 1 50  GLU 50  67  ?   ?   ?   B . n 
A 1 51  GLU 51  68  ?   ?   ?   B . n 
A 1 52  ALA 52  69  69  ALA ALA B . n 
A 1 53  ALA 53  70  70  ALA ALA B . n 
A 1 54  GLY 54  71  71  GLY GLY B . n 
A 1 55  GLY 55  72  72  GLY GLY B . n 
A 1 56  ASP 56  73  73  ASP ASP B . n 
A 1 57  ARG 57  74  74  ARG ARG B . n 
A 1 58  LEU 58  75  75  LEU LEU B . n 
A 1 59  ILE 59  76  76  ILE ILE B . n 
A 1 60  HIS 60  77  77  HIS HIS B . n 
A 1 61  GLU 61  78  78  GLU GLU B . n 
A 1 62  GLN 62  79  79  GLN GLN B . n 
A 1 63  ALA 63  80  80  ALA ALA B . n 
A 1 64  LEU 64  81  81  LEU LEU B . n 
A 1 65  GLU 65  82  82  GLU GLU B . n 
A 1 66  TRP 66  83  83  TRP TRP B . n 
A 1 67  LEU 67  84  84  LEU LEU B . n 
A 1 68  GLN 68  85  85  GLN GLN B . n 
A 1 69  GLN 69  86  86  GLN GLN B . n 
A 1 70  ALA 70  87  87  ALA ALA B . n 
A 1 71  ASP 71  88  88  ASP ASP B . n 
A 1 72  VAL 72  89  89  VAL VAL B . n 
A 1 73  VAL 73  90  90  VAL VAL B . n 
A 1 74  VAL 74  91  91  VAL VAL B . n 
A 1 75  ALA 75  92  92  ALA ALA B . n 
A 1 76  GLU 76  93  93  GLU GLU B . n 
A 1 77  VAL 77  94  94  VAL VAL B . n 
A 1 78  THR 78  95  95  THR THR B . n 
A 1 79  GLN 79  96  96  GLN GLN B . n 
A 1 80  PRO 80  97  97  PRO PRO B . n 
A 1 81  SER 81  98  98  SER SER B . n 
A 1 82  LEU 82  99  99  LEU LEU B . n 
A 1 83  GLY 83  100 100 GLY GLY B . n 
A 1 84  VAL 84  101 101 VAL VAL B . n 
A 1 85  GLY 85  102 102 GLY GLY B . n 
A 1 86  TYR 86  103 103 TYR TYR B . n 
A 1 87  GLU 87  104 104 GLU GLU B . n 
A 1 88  LEU 88  105 105 LEU LEU B . n 
A 1 89  GLY 89  106 106 GLY GLY B . n 
A 1 90  ARG 90  107 107 ARG ARG B . n 
A 1 91  ALA 91  108 108 ALA ALA B . n 
A 1 92  VAL 92  109 109 VAL VAL B . n 
A 1 93  ALA 93  110 110 ALA ALA B . n 
A 1 94  PHE 94  111 111 PHE PHE B . n 
A 1 95  ASN 95  112 112 ASN ASN B . n 
A 1 96  LYS 96  113 113 LYS LYS B . n 
A 1 97  ARG 97  114 114 ARG ARG B . n 
A 1 98  ILE 98  115 115 ILE ILE B . n 
A 1 99  LEU 99  116 116 LEU LEU B . n 
A 1 100 CYS 100 117 117 CYS CYS B . n 
A 1 101 LEU 101 118 118 LEU LEU B . n 
A 1 102 PHE 102 119 119 PHE PHE B . n 
A 1 103 ARG 103 120 120 ARG ARG B . n 
A 1 104 PRO 104 121 121 PRO PRO B . n 
A 1 105 GLN 105 122 122 GLN GLN B . n 
A 1 106 SER 106 123 123 SER SER B . n 
A 1 107 GLY 107 124 124 GLY GLY B . n 
A 1 108 ARG 108 125 125 ARG ARG B . n 
A 1 109 VAL 109 126 126 VAL VAL B . n 
A 1 110 LEU 110 127 127 LEU LEU B . n 
A 1 111 SER 111 128 128 SER SER B . n 
A 1 112 ALA 112 129 129 ALA ALA B . n 
A 1 113 MET 113 130 130 MET MET B . n 
A 1 114 ILE 114 131 131 ILE ILE B . n 
A 1 115 ARG 115 132 132 ARG ARG B . n 
A 1 116 GLY 116 133 133 GLY GLY B . n 
A 1 117 ALA 117 134 134 ALA ALA B . n 
A 1 118 ALA 118 135 135 ALA ALA B . n 
A 1 119 ASP 119 136 136 ASP ASP B . n 
A 1 120 GLY 120 137 137 GLY GLY B . n 
A 1 121 SER 121 138 138 SER SER B . n 
A 1 122 ARG 122 139 139 ARG ARG B . n 
A 1 123 PHE 123 140 140 PHE PHE B . n 
A 1 124 GLN 124 141 141 GLN GLN B . n 
A 1 125 VAL 125 142 142 VAL VAL B . n 
A 1 126 TRP 126 143 143 TRP TRP B . n 
A 1 127 ASP 127 144 144 ASP ASP B . n 
A 1 128 TYR 128 145 145 TYR TYR B . n 
A 1 129 GLU 129 146 146 GLU GLU B . n 
A 1 130 GLU 130 147 147 GLU GLU B . n 
A 1 131 GLY 131 148 148 GLY GLY B . n 
A 1 132 GLU 132 149 149 GLU GLU B . n 
A 1 133 VAL 133 150 150 VAL VAL B . n 
A 1 134 GLU 134 151 151 GLU GLU B . n 
A 1 135 ALA 135 152 152 ALA ALA B . n 
A 1 136 LEU 136 153 153 LEU LEU B . n 
A 1 137 LEU 137 154 154 LEU LEU B . n 
A 1 138 ASP 138 155 155 ASP ASP B . n 
A 1 139 ARG 139 156 156 ARG ARG B . n 
A 1 140 TYR 140 157 157 TYR TYR B . n 
A 1 141 PHE 141 158 158 PHE PHE B . n 
A 1 142 GLU 142 159 159 GLU GLU B . n 
A 1 143 ALA 143 160 160 ALA ALA B . n 
A 1 144 ASP 144 161 161 ASP ASP B . n 
A 1 145 PRO 145 162 162 PRO PRO B . n 
B 1 1   GLY 1   18  ?   ?   ?   A . n 
B 1 2   MET 2   19  19  MET MET A . n 
B 1 3   ARG 3   20  20  ARG ARG A . n 
B 1 4   PRO 4   21  21  PRO PRO A . n 
B 1 5   ALA 5   22  22  ALA ALA A . n 
B 1 6   LEU 6   23  23  LEU LEU A . n 
B 1 7   TYR 7   24  24  TYR TYR A . n 
B 1 8   PHE 8   25  25  PHE PHE A . n 
B 1 9   CYS 9   26  26  CYS CYS A . n 
B 1 10  GLY 10  27  27  GLY GLY A . n 
B 1 11  SER 11  28  28  SER SER A . n 
B 1 12  ILE 12  29  ?   ?   ?   A . n 
B 1 13  ARG 13  30  ?   ?   ?   A . n 
B 1 14  GLY 14  31  ?   ?   ?   A . n 
B 1 15  GLY 15  32  32  GLY GLY A . n 
B 1 16  ARG 16  33  33  ARG ARG A . n 
B 1 17  GLU 17  34  34  GLU GLU A . n 
B 1 18  ASP 18  35  35  ASP ASP A . n 
B 1 19  ARG 19  36  36  ARG ARG A . n 
B 1 20  THR 20  37  37  THR THR A . n 
B 1 21  LEU 21  38  38  LEU LEU A . n 
B 1 22  TYR 22  39  39  TYR TYR A . n 
B 1 23  GLU 23  40  40  GLU GLU A . n 
B 1 24  ARG 24  41  41  ARG ARG A . n 
B 1 25  ILE 25  42  42  ILE ILE A . n 
B 1 26  VAL 26  43  43  VAL VAL A . n 
B 1 27  SER 27  44  44  SER SER A . n 
B 1 28  ARG 28  45  45  ARG ARG A . n 
B 1 29  LEU 29  46  46  LEU LEU A . n 
B 1 30  ARG 30  47  47  ARG ARG A . n 
B 1 31  ARG 31  48  48  ARG ARG A . n 
B 1 32  PHE 32  49  49  PHE PHE A . n 
B 1 33  GLY 33  50  50  GLY GLY A . n 
B 1 34  THR 34  51  51  THR THR A . n 
B 1 35  VAL 35  52  52  VAL VAL A . n 
B 1 36  LEU 36  53  53  LEU LEU A . n 
B 1 37  THR 37  54  54  THR THR A . n 
B 1 38  GLU 38  55  55  GLU GLU A . n 
B 1 39  HIS 39  56  56  HIS HIS A . n 
B 1 40  VAL 40  57  57  VAL VAL A . n 
B 1 41  ALA 41  58  58  ALA ALA A . n 
B 1 42  ALA 42  59  59  ALA ALA A . n 
B 1 43  ALA 43  60  60  ALA ALA A . n 
B 1 44  GLU 44  61  61  GLU GLU A . n 
B 1 45  LEU 45  62  62  LEU LEU A . n 
B 1 46  GLY 46  63  63  GLY GLY A . n 
B 1 47  ALA 47  64  64  ALA ALA A . n 
B 1 48  ARG 48  65  ?   ?   ?   A . n 
B 1 49  GLY 49  66  ?   ?   ?   A . n 
B 1 50  GLU 50  67  ?   ?   ?   A . n 
B 1 51  GLU 51  68  ?   ?   ?   A . n 
B 1 52  ALA 52  69  69  ALA ALA A . n 
B 1 53  ALA 53  70  70  ALA ALA A . n 
B 1 54  GLY 54  71  71  GLY GLY A . n 
B 1 55  GLY 55  72  72  GLY GLY A . n 
B 1 56  ASP 56  73  73  ASP ASP A . n 
B 1 57  ARG 57  74  74  ARG ARG A . n 
B 1 58  LEU 58  75  75  LEU LEU A . n 
B 1 59  ILE 59  76  76  ILE ILE A . n 
B 1 60  HIS 60  77  77  HIS HIS A . n 
B 1 61  GLU 61  78  78  GLU GLU A . n 
B 1 62  GLN 62  79  79  GLN GLN A . n 
B 1 63  ALA 63  80  80  ALA ALA A . n 
B 1 64  LEU 64  81  81  LEU LEU A . n 
B 1 65  GLU 65  82  82  GLU GLU A . n 
B 1 66  TRP 66  83  83  TRP TRP A . n 
B 1 67  LEU 67  84  84  LEU LEU A . n 
B 1 68  GLN 68  85  85  GLN GLN A . n 
B 1 69  GLN 69  86  86  GLN GLN A . n 
B 1 70  ALA 70  87  87  ALA ALA A . n 
B 1 71  ASP 71  88  88  ASP ASP A . n 
B 1 72  VAL 72  89  89  VAL VAL A . n 
B 1 73  VAL 73  90  90  VAL VAL A . n 
B 1 74  VAL 74  91  91  VAL VAL A . n 
B 1 75  ALA 75  92  92  ALA ALA A . n 
B 1 76  GLU 76  93  93  GLU GLU A . n 
B 1 77  VAL 77  94  94  VAL VAL A . n 
B 1 78  THR 78  95  95  THR THR A . n 
B 1 79  GLN 79  96  96  GLN GLN A . n 
B 1 80  PRO 80  97  97  PRO PRO A . n 
B 1 81  SER 81  98  98  SER SER A . n 
B 1 82  LEU 82  99  99  LEU LEU A . n 
B 1 83  GLY 83  100 100 GLY GLY A . n 
B 1 84  VAL 84  101 101 VAL VAL A . n 
B 1 85  GLY 85  102 102 GLY GLY A . n 
B 1 86  TYR 86  103 103 TYR TYR A . n 
B 1 87  GLU 87  104 104 GLU GLU A . n 
B 1 88  LEU 88  105 105 LEU LEU A . n 
B 1 89  GLY 89  106 106 GLY GLY A . n 
B 1 90  ARG 90  107 107 ARG ARG A . n 
B 1 91  ALA 91  108 108 ALA ALA A . n 
B 1 92  VAL 92  109 109 VAL VAL A . n 
B 1 93  ALA 93  110 110 ALA ALA A . n 
B 1 94  PHE 94  111 111 PHE PHE A . n 
B 1 95  ASN 95  112 112 ASN ASN A . n 
B 1 96  LYS 96  113 113 LYS LYS A . n 
B 1 97  ARG 97  114 114 ARG ARG A . n 
B 1 98  ILE 98  115 115 ILE ILE A . n 
B 1 99  LEU 99  116 116 LEU LEU A . n 
B 1 100 CYS 100 117 117 CYS CYS A . n 
B 1 101 LEU 101 118 118 LEU LEU A . n 
B 1 102 PHE 102 119 119 PHE PHE A . n 
B 1 103 ARG 103 120 120 ARG ARG A . n 
B 1 104 PRO 104 121 121 PRO PRO A . n 
B 1 105 GLN 105 122 122 GLN GLN A . n 
B 1 106 SER 106 123 123 SER SER A . n 
B 1 107 GLY 107 124 124 GLY GLY A . n 
B 1 108 ARG 108 125 125 ARG ARG A . n 
B 1 109 VAL 109 126 126 VAL VAL A . n 
B 1 110 LEU 110 127 127 LEU LEU A . n 
B 1 111 SER 111 128 128 SER SER A . n 
B 1 112 ALA 112 129 129 ALA ALA A . n 
B 1 113 MET 113 130 130 MET MET A . n 
B 1 114 ILE 114 131 131 ILE ILE A . n 
B 1 115 ARG 115 132 132 ARG ARG A . n 
B 1 116 GLY 116 133 133 GLY GLY A . n 
B 1 117 ALA 117 134 134 ALA ALA A . n 
B 1 118 ALA 118 135 135 ALA ALA A . n 
B 1 119 ASP 119 136 136 ASP ASP A . n 
B 1 120 GLY 120 137 137 GLY GLY A . n 
B 1 121 SER 121 138 138 SER SER A . n 
B 1 122 ARG 122 139 139 ARG ARG A . n 
B 1 123 PHE 123 140 140 PHE PHE A . n 
B 1 124 GLN 124 141 141 GLN GLN A . n 
B 1 125 VAL 125 142 142 VAL VAL A . n 
B 1 126 TRP 126 143 143 TRP TRP A . n 
B 1 127 ASP 127 144 144 ASP ASP A . n 
B 1 128 TYR 128 145 145 TYR TYR A . n 
B 1 129 GLU 129 146 146 GLU GLU A . n 
B 1 130 GLU 130 147 147 GLU GLU A . n 
B 1 131 GLY 131 148 148 GLY GLY A . n 
B 1 132 GLU 132 149 149 GLU GLU A . n 
B 1 133 VAL 133 150 150 VAL VAL A . n 
B 1 134 GLU 134 151 151 GLU GLU A . n 
B 1 135 ALA 135 152 152 ALA ALA A . n 
B 1 136 LEU 136 153 153 LEU LEU A . n 
B 1 137 LEU 137 154 154 LEU LEU A . n 
B 1 138 ASP 138 155 155 ASP ASP A . n 
B 1 139 ARG 139 156 156 ARG ARG A . n 
B 1 140 TYR 140 157 157 TYR TYR A . n 
B 1 141 PHE 141 158 158 PHE PHE A . n 
B 1 142 GLU 142 159 159 GLU GLU A . n 
B 1 143 ALA 143 160 ?   ?   ?   A . n 
B 1 144 ASP 144 161 ?   ?   ?   A . n 
B 1 145 PRO 145 162 ?   ?   ?   A . n 
# 
loop_
_pdbx_entity_instance_feature.ordinal 
_pdbx_entity_instance_feature.comp_id 
_pdbx_entity_instance_feature.asym_id 
_pdbx_entity_instance_feature.seq_num 
_pdbx_entity_instance_feature.auth_comp_id 
_pdbx_entity_instance_feature.auth_asym_id 
_pdbx_entity_instance_feature.auth_seq_num 
_pdbx_entity_instance_feature.feature_type 
_pdbx_entity_instance_feature.details 
1 PEG ? ? PEG ? ? 'SUBJECT OF INVESTIGATION' ? 
2 EDO ? ? EDO ? ? 'SUBJECT OF INVESTIGATION' ? 
3 CL  ? ? CL  ? ? 'SUBJECT OF INVESTIGATION' ? 
# 
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 
C 2 CL  1  201 2   CL  CL  B . 
D 2 CL  1  202 3   CL  CL  B . 
E 3 PEG 1  203 2   PEG PEG B . 
F 4 EDO 1  204 1   EDO EDO B . 
G 4 EDO 1  205 3   EDO EDO B . 
H 2 CL  1  201 1   CL  CL  A . 
I 2 CL  1  202 4   CL  CL  A . 
J 2 CL  1  203 5   CL  CL  A . 
K 2 CL  1  204 6   CL  CL  A . 
L 2 CL  1  205 7   CL  CL  A . 
M 2 CL  1  206 8   CL  CL  A . 
N 3 PEG 1  207 1   PEG PEG A . 
O 4 EDO 1  208 2   EDO EDO A . 
P 4 EDO 1  209 4   EDO EDO A . 
Q 5 HOH 1  301 122 HOH HOH B . 
Q 5 HOH 2  302 117 HOH HOH B . 
Q 5 HOH 3  303 76  HOH HOH B . 
Q 5 HOH 4  304 72  HOH HOH B . 
Q 5 HOH 5  305 144 HOH HOH B . 
Q 5 HOH 6  306 58  HOH HOH B . 
Q 5 HOH 7  307 8   HOH HOH B . 
Q 5 HOH 8  308 111 HOH HOH B . 
Q 5 HOH 9  309 96  HOH HOH B . 
Q 5 HOH 10 310 89  HOH HOH B . 
Q 5 HOH 11 311 61  HOH HOH B . 
Q 5 HOH 12 312 55  HOH HOH B . 
Q 5 HOH 13 313 68  HOH HOH B . 
Q 5 HOH 14 314 18  HOH HOH B . 
Q 5 HOH 15 315 81  HOH HOH B . 
Q 5 HOH 16 316 28  HOH HOH B . 
Q 5 HOH 17 317 12  HOH HOH B . 
Q 5 HOH 18 318 106 HOH HOH B . 
Q 5 HOH 19 319 74  HOH HOH B . 
Q 5 HOH 20 320 60  HOH HOH B . 
Q 5 HOH 21 321 21  HOH HOH B . 
Q 5 HOH 22 322 15  HOH HOH B . 
Q 5 HOH 23 323 109 HOH HOH B . 
Q 5 HOH 24 324 135 HOH HOH B . 
Q 5 HOH 25 325 16  HOH HOH B . 
Q 5 HOH 26 326 136 HOH HOH B . 
Q 5 HOH 27 327 84  HOH HOH B . 
Q 5 HOH 28 328 48  HOH HOH B . 
Q 5 HOH 29 329 24  HOH HOH B . 
Q 5 HOH 30 330 41  HOH HOH B . 
Q 5 HOH 31 331 57  HOH HOH B . 
Q 5 HOH 32 332 14  HOH HOH B . 
Q 5 HOH 33 333 120 HOH HOH B . 
Q 5 HOH 34 334 140 HOH HOH B . 
Q 5 HOH 35 335 73  HOH HOH B . 
Q 5 HOH 36 336 5   HOH HOH B . 
Q 5 HOH 37 337 105 HOH HOH B . 
Q 5 HOH 38 338 38  HOH HOH B . 
Q 5 HOH 39 339 75  HOH HOH B . 
Q 5 HOH 40 340 7   HOH HOH B . 
Q 5 HOH 41 341 43  HOH HOH B . 
Q 5 HOH 42 342 129 HOH HOH B . 
Q 5 HOH 43 343 107 HOH HOH B . 
Q 5 HOH 44 344 3   HOH HOH B . 
Q 5 HOH 45 345 27  HOH HOH B . 
Q 5 HOH 46 346 87  HOH HOH B . 
Q 5 HOH 47 347 125 HOH HOH B . 
Q 5 HOH 48 348 9   HOH HOH B . 
Q 5 HOH 49 349 97  HOH HOH B . 
Q 5 HOH 50 350 10  HOH HOH B . 
Q 5 HOH 51 351 40  HOH HOH B . 
Q 5 HOH 52 352 22  HOH HOH B . 
Q 5 HOH 53 353 56  HOH HOH B . 
Q 5 HOH 54 354 101 HOH HOH B . 
Q 5 HOH 55 355 17  HOH HOH B . 
Q 5 HOH 56 356 69  HOH HOH B . 
Q 5 HOH 57 357 42  HOH HOH B . 
Q 5 HOH 58 358 143 HOH HOH B . 
Q 5 HOH 59 359 13  HOH HOH B . 
Q 5 HOH 60 360 19  HOH HOH B . 
Q 5 HOH 61 361 2   HOH HOH B . 
Q 5 HOH 62 362 11  HOH HOH B . 
Q 5 HOH 63 363 112 HOH HOH B . 
Q 5 HOH 64 364 123 HOH HOH B . 
Q 5 HOH 65 365 23  HOH HOH B . 
Q 5 HOH 66 366 79  HOH HOH B . 
Q 5 HOH 67 367 25  HOH HOH B . 
Q 5 HOH 68 368 1   HOH HOH B . 
Q 5 HOH 69 369 103 HOH HOH B . 
Q 5 HOH 70 370 63  HOH HOH B . 
Q 5 HOH 71 371 134 HOH HOH B . 
Q 5 HOH 72 372 78  HOH HOH B . 
Q 5 HOH 73 373 4   HOH HOH B . 
Q 5 HOH 74 374 113 HOH HOH B . 
Q 5 HOH 75 375 142 HOH HOH B . 
Q 5 HOH 76 376 132 HOH HOH B . 
Q 5 HOH 77 377 100 HOH HOH B . 
Q 5 HOH 78 378 67  HOH HOH B . 
Q 5 HOH 79 379 88  HOH HOH B . 
Q 5 HOH 80 380 59  HOH HOH B . 
Q 5 HOH 81 381 91  HOH HOH B . 
Q 5 HOH 82 382 137 HOH HOH B . 
Q 5 HOH 83 383 114 HOH HOH B . 
Q 5 HOH 84 384 86  HOH HOH B . 
Q 5 HOH 85 385 26  HOH HOH B . 
Q 5 HOH 86 386 98  HOH HOH B . 
R 5 HOH 1  301 83  HOH HOH A . 
R 5 HOH 2  302 46  HOH HOH A . 
R 5 HOH 3  303 44  HOH HOH A . 
R 5 HOH 4  304 64  HOH HOH A . 
R 5 HOH 5  305 62  HOH HOH A . 
R 5 HOH 6  306 32  HOH HOH A . 
R 5 HOH 7  307 90  HOH HOH A . 
R 5 HOH 8  308 53  HOH HOH A . 
R 5 HOH 9  309 34  HOH HOH A . 
R 5 HOH 10 310 128 HOH HOH A . 
R 5 HOH 11 311 94  HOH HOH A . 
R 5 HOH 12 312 119 HOH HOH A . 
R 5 HOH 13 313 85  HOH HOH A . 
R 5 HOH 14 314 33  HOH HOH A . 
R 5 HOH 15 315 116 HOH HOH A . 
R 5 HOH 16 316 45  HOH HOH A . 
R 5 HOH 17 317 51  HOH HOH A . 
R 5 HOH 18 318 54  HOH HOH A . 
R 5 HOH 19 319 35  HOH HOH A . 
R 5 HOH 20 320 77  HOH HOH A . 
R 5 HOH 21 321 145 HOH HOH A . 
R 5 HOH 22 322 36  HOH HOH A . 
R 5 HOH 23 323 37  HOH HOH A . 
R 5 HOH 24 324 30  HOH HOH A . 
R 5 HOH 25 325 121 HOH HOH A . 
R 5 HOH 26 326 146 HOH HOH A . 
R 5 HOH 27 327 93  HOH HOH A . 
R 5 HOH 28 328 70  HOH HOH A . 
R 5 HOH 29 329 95  HOH HOH A . 
R 5 HOH 30 330 110 HOH HOH A . 
R 5 HOH 31 331 6   HOH HOH A . 
R 5 HOH 32 332 118 HOH HOH A . 
R 5 HOH 33 333 31  HOH HOH A . 
R 5 HOH 34 334 139 HOH HOH A . 
R 5 HOH 35 335 99  HOH HOH A . 
R 5 HOH 36 336 104 HOH HOH A . 
R 5 HOH 37 337 80  HOH HOH A . 
R 5 HOH 38 338 130 HOH HOH A . 
R 5 HOH 39 339 49  HOH HOH A . 
R 5 HOH 40 340 102 HOH HOH A . 
R 5 HOH 41 341 39  HOH HOH A . 
R 5 HOH 42 342 66  HOH HOH A . 
R 5 HOH 43 343 71  HOH HOH A . 
R 5 HOH 44 344 52  HOH HOH A . 
R 5 HOH 45 345 47  HOH HOH A . 
R 5 HOH 46 346 29  HOH HOH A . 
R 5 HOH 47 347 20  HOH HOH A . 
R 5 HOH 48 348 50  HOH HOH A . 
R 5 HOH 49 349 115 HOH HOH A . 
R 5 HOH 50 350 82  HOH HOH A . 
R 5 HOH 51 351 65  HOH HOH A . 
R 5 HOH 52 352 124 HOH HOH A . 
R 5 HOH 53 353 92  HOH HOH A . 
R 5 HOH 54 354 131 HOH HOH A . 
R 5 HOH 55 355 141 HOH HOH A . 
R 5 HOH 56 356 127 HOH HOH A . 
R 5 HOH 57 357 108 HOH HOH A . 
R 5 HOH 58 358 138 HOH HOH A . 
R 5 HOH 59 359 133 HOH HOH A . 
# 
loop_
_pdbx_unobs_or_zero_occ_atoms.id 
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num 
_pdbx_unobs_or_zero_occ_atoms.polymer_flag 
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag 
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id 
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id 
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id 
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code 
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id 
_pdbx_unobs_or_zero_occ_atoms.label_alt_id 
_pdbx_unobs_or_zero_occ_atoms.label_asym_id 
_pdbx_unobs_or_zero_occ_atoms.label_comp_id 
_pdbx_unobs_or_zero_occ_atoms.label_seq_id 
_pdbx_unobs_or_zero_occ_atoms.label_atom_id 
1  1 Y 1 B ARG 30  ? CG  ? A ARG 13  CG  
2  1 Y 1 B ARG 30  ? CD  ? A ARG 13  CD  
3  1 Y 1 B ARG 30  ? NE  ? A ARG 13  NE  
4  1 Y 1 B ARG 30  ? CZ  ? A ARG 13  CZ  
5  1 Y 1 B ARG 30  ? NH1 ? A ARG 13  NH1 
6  1 Y 1 B ARG 30  ? NH2 ? A ARG 13  NH2 
7  1 Y 1 B ARG 33  ? CG  ? A ARG 16  CG  
8  1 Y 1 B ARG 33  ? CD  ? A ARG 16  CD  
9  1 Y 1 B ARG 33  ? NE  ? A ARG 16  NE  
10 1 Y 1 B ARG 33  ? CZ  ? A ARG 16  CZ  
11 1 Y 1 B ARG 33  ? NH1 ? A ARG 16  NH1 
12 1 Y 1 B ARG 33  ? NH2 ? A ARG 16  NH2 
13 1 Y 1 B GLN 122 ? CG  ? A GLN 105 CG  
14 1 Y 1 B GLN 122 ? CD  ? A GLN 105 CD  
15 1 Y 1 B GLN 122 ? OE1 ? A GLN 105 OE1 
16 1 Y 1 B GLN 122 ? NE2 ? A GLN 105 NE2 
17 1 Y 1 B ASP 161 ? CG  ? A ASP 144 CG  
18 1 Y 1 B ASP 161 ? OD1 ? A ASP 144 OD1 
19 1 Y 1 B ASP 161 ? OD2 ? A ASP 144 OD2 
20 1 Y 1 A ARG 33  ? CG  ? B ARG 16  CG  
21 1 Y 1 A ARG 33  ? CD  ? B ARG 16  CD  
22 1 Y 1 A ARG 33  ? NE  ? B ARG 16  NE  
23 1 Y 1 A ARG 33  ? CZ  ? B ARG 16  CZ  
24 1 Y 1 A ARG 33  ? NH1 ? B ARG 16  NH1 
25 1 Y 1 A ARG 33  ? NH2 ? B ARG 16  NH2 
26 1 Y 1 A GLU 34  ? CG  ? B GLU 17  CG  
27 1 Y 1 A GLU 34  ? CD  ? B GLU 17  CD  
28 1 Y 1 A GLU 34  ? OE1 ? B GLU 17  OE1 
29 1 Y 1 A GLU 34  ? OE2 ? B GLU 17  OE2 
30 1 Y 1 A ASP 35  ? CG  ? B ASP 18  CG  
31 1 Y 1 A ASP 35  ? OD1 ? B ASP 18  OD1 
32 1 Y 1 A ASP 35  ? OD2 ? B ASP 18  OD2 
33 1 Y 1 A ARG 36  ? CG  ? B ARG 19  CG  
34 1 Y 1 A ARG 36  ? CD  ? B ARG 19  CD  
35 1 Y 1 A ARG 36  ? NE  ? B ARG 19  NE  
36 1 Y 1 A ARG 36  ? CZ  ? B ARG 19  CZ  
37 1 Y 1 A ARG 36  ? NH1 ? B ARG 19  NH1 
38 1 Y 1 A ARG 36  ? NH2 ? B ARG 19  NH2 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX  ? ? ? '(1.20.1_4487: ???)' 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? DIALS   ? ? ? .                    2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? .                    3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER  ? ? ? .                    4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.00 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8RPT 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     56.481 
_cell.length_a_esd                 ? 
_cell.length_b                     65.584 
_cell.length_b_esd                 ? 
_cell.length_c                     69.209 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         8RPT 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                18 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 2 21 21' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   8RPT 
_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             1.98 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          37.96 
_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              4.6 
_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    '8 % PEG 4000, 100 mM Sodium acetate pH 4.6' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293.15 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER2 X 9M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-12-08 
_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   0.6199 
_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                        'DIAMOND BEAMLINE I24' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.6199 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   I24 
_diffrn_source.pdbx_synchrotron_site       Diamond 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       8RPT 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.95 
_reflns.d_resolution_low                               47.64 
_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                                     19407 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           100.0 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                16.8 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          11.8 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.193 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.999 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.182 
_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                                    1.95 
_reflns_shell.d_res_low                                     2 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             1320 
_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                               17.5 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_reflns_shell.pdbx_Rpim_I_all                               0.520 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.836 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  2.4 
_reflns_shell.percent_possible_all                          100 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  1.476 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               ? 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 8RPT 
_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                            1.95 
_refine.ls_d_res_low                             47.60 
_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                     19353 
_refine.ls_number_reflns_R_free                  936 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.77 
_refine.ls_percent_reflns_R_free                 4.84 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1798 
_refine.ls_R_factor_R_free                       0.2195 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1778 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.34 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ML 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.10 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.90 
_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                 23.01 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.22 
_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.pdbx_number_atoms_protein        2137 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         38 
_refine_hist.number_atoms_solvent             145 
_refine_hist.number_atoms_total               2320 
_refine_hist.d_res_high                       1.95 
_refine_hist.d_res_low                        47.60 
# 
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' ? 0.007 ? ?   ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.871 ? ?   ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 8.901 ? 333 ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.055 ? 323 ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.012 ? 400 ? f_plane_restr      ? ? 
# 
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' 1.95 2.05  . . 137 2536 99.00  . . . . 0.2240 . . . . . . . . . . . 0.2960 
'X-RAY DIFFRACTION' 2.05 2.18  . . 160 2578 100.00 . . . . 0.1970 . . . . . . . . . . . 0.2657 
'X-RAY DIFFRACTION' 2.18 2.35  . . 132 2585 100.00 . . . . 0.1774 . . . . . . . . . . . 0.2326 
'X-RAY DIFFRACTION' 2.35 2.58  . . 118 2626 100.00 . . . . 0.1845 . . . . . . . . . . . 0.2355 
'X-RAY DIFFRACTION' 2.58 2.96  . . 127 2631 100.00 . . . . 0.1851 . . . . . . . . . . . 0.2262 
'X-RAY DIFFRACTION' 2.96 3.72  . . 159 2641 100.00 . . . . 0.1622 . . . . . . . . . . . 0.2068 
'X-RAY DIFFRACTION' 3.73 47.60 . . 103 2820 100.00 . . . . 0.1715 . . . . . . . . . . . 0.1849 
# 
_struct.entry_id                     8RPT 
_struct.title                        'Crystal structure of human DNPH1 mutant- D80A' 
_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        8RPT 
_struct_keywords.text            
;deoxyribonucleoside 5'-monophosphate N-glycosidase activity, HYDROLASE
;
_struct_keywords.pdbx_keywords   HYDROLASE 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 1 ? 
C N N 2 ? 
D N N 2 ? 
E N N 3 ? 
F N N 4 ? 
G N N 4 ? 
H N N 2 ? 
I N N 2 ? 
J N N 2 ? 
K N N 2 ? 
L N N 2 ? 
M N N 2 ? 
N N N 3 ? 
O N N 4 ? 
P N N 4 ? 
Q N N 5 ? 
R N N 5 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    DNPH1_HUMAN 
_struct_ref.pdbx_db_accession          O43598 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;RPALYFCGSIRGGREDRTLYERIVSRLRRFGTVLTEHVAAAELGARGEEAAGGDRLIHEQDLEWLQQADVVVAEVTQPSL
GVGYELGRAVAFNKRILCLFRPQSGRVLSAMIRGAADGSRFQVWDYEEGEVEALLDRYFEADP
;
_struct_ref.pdbx_align_begin           20 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 8RPT B 3 ? 145 ? O43598 20 ? 162 ? 20 162 
2 1 8RPT A 3 ? 145 ? O43598 20 ? 162 ? 20 162 
# 
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 8RPT GLY B 1  ? UNP O43598 ?   ?  'expression tag'      18 1 
1 8RPT MET B 2  ? UNP O43598 ?   ?  'expression tag'      19 2 
1 8RPT ALA B 63 ? UNP O43598 ASP 80 'engineered mutation' 80 3 
2 8RPT GLY A 1  ? UNP O43598 ?   ?  'expression tag'      18 4 
2 8RPT MET A 2  ? UNP O43598 ?   ?  'expression tag'      19 5 
2 8RPT ALA A 63 ? UNP O43598 ASP 80 'engineered mutation' 80 6 
# 
_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   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
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)' 4910  ? 
1 MORE         -95   ? 
1 'SSA (A^2)'  12820 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 GLY A 15  ? ARG A 30  ? GLY B 32  ARG B 47  1 ? 16 
HELX_P HELX_P2  AA2 THR A 37  ? GLY A 46  ? THR B 54  GLY B 63  1 ? 10 
HELX_P HELX_P3  AA3 ALA A 47  ? GLY A 49  ? ALA B 64  GLY B 66  5 ? 3  
HELX_P HELX_P4  AA4 GLY A 54  ? ALA A 70  ? GLY B 71  ALA B 87  1 ? 17 
HELX_P HELX_P5  AA5 SER A 81  ? PHE A 94  ? SER B 98  PHE B 111 1 ? 14 
HELX_P HELX_P6  AA6 ARG A 103 ? GLY A 107 ? ARG B 120 GLY B 124 5 ? 5  
HELX_P HELX_P7  AA7 SER A 111 ? GLY A 116 ? SER B 128 GLY B 133 1 ? 6  
HELX_P HELX_P8  AA8 GLU A 132 ? ASP A 144 ? GLU B 149 ASP B 161 1 ? 13 
HELX_P HELX_P9  AA9 ARG B 16  ? ARG B 30  ? ARG A 33  ARG A 47  1 ? 15 
HELX_P HELX_P10 AB1 GLU B 38  ? GLU B 44  ? GLU A 55  GLU A 61  1 ? 7  
HELX_P HELX_P11 AB2 GLY B 54  ? ALA B 70  ? GLY A 71  ALA A 87  1 ? 17 
HELX_P HELX_P12 AB3 SER B 81  ? PHE B 94  ? SER A 98  PHE A 111 1 ? 14 
HELX_P HELX_P13 AB4 ARG B 103 ? GLY B 107 ? ARG A 120 GLY A 124 5 ? 5  
HELX_P HELX_P14 AB5 SER B 111 ? GLY B 116 ? SER A 128 GLY A 133 1 ? 6  
HELX_P HELX_P15 AB6 GLU B 129 ? GLY B 131 ? GLU A 146 GLY A 148 5 ? 3  
HELX_P HELX_P16 AB7 GLU B 132 ? GLU B 142 ? GLU A 149 GLU A 159 1 ? 11 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 5 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? parallel 
AA1 2 3 ? parallel 
AA1 3 4 ? parallel 
AA1 4 5 ? parallel 
AA2 1 2 ? parallel 
AA2 2 3 ? parallel 
AA2 3 4 ? parallel 
AA2 4 5 ? 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 THR A 34  ? LEU A 36  ? THR B 51  LEU B 53  
AA1 2 ALA A 5   ? CYS A 9   ? ALA B 22  CYS B 26  
AA1 3 VAL A 72  ? GLU A 76  ? VAL B 89  GLU B 93  
AA1 4 ARG A 97  ? PHE A 102 ? ARG B 114 PHE B 119 
AA1 5 PHE A 123 ? ASP A 127 ? PHE B 140 ASP B 144 
AA2 1 THR B 34  ? THR B 37  ? THR A 51  THR A 54  
AA2 2 ALA B 5   ? CYS B 9   ? ALA A 22  CYS A 26  
AA2 3 VAL B 72  ? GLU B 76  ? VAL A 89  GLU A 93  
AA2 4 ARG B 97  ? PHE B 102 ? ARG A 114 PHE A 119 
AA2 5 PHE B 123 ? ASP B 127 ? PHE A 140 ASP A 144 
# 
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 THR A 34  ? O THR B 51  N LEU A 6   ? N LEU B 23  
AA1 2 3 N CYS A 9   ? N CYS B 26  O GLU A 76  ? O GLU B 93  
AA1 3 4 N ALA A 75  ? N ALA B 92  O LEU A 101 ? O LEU B 118 
AA1 4 5 N CYS A 100 ? N CYS B 117 O TRP A 126 ? O TRP B 143 
AA2 1 2 O THR B 34  ? O THR A 51  N LEU B 6   ? N LEU A 23  
AA2 2 3 N CYS B 9   ? N CYS A 26  O VAL B 74  ? O VAL A 91  
AA2 3 4 N ALA B 75  ? N ALA A 92  O LEU B 101 ? O LEU A 118 
AA2 4 5 N CYS B 100 ? N CYS A 117 O GLN B 124 ? O GLN A 141 
# 
_pdbx_entry_details.entry_id                   8RPT 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   N 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 SER B 128 ? ? -38.09  132.12 
2 1 SER B 138 ? ? -134.44 -72.68 
3 1 SER A 138 ? ? -127.65 -83.82 
# 
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 B GLU 67  ? A GLU 50  
2  1 Y 1 B GLU 68  ? A GLU 51  
3  1 Y 1 A GLY 18  ? B GLY 1   
4  1 Y 1 A ILE 29  ? B ILE 12  
5  1 Y 1 A ARG 30  ? B ARG 13  
6  1 Y 1 A GLY 31  ? B GLY 14  
7  1 Y 1 A ARG 65  ? B ARG 48  
8  1 Y 1 A GLY 66  ? B GLY 49  
9  1 Y 1 A GLU 67  ? B GLU 50  
10 1 Y 1 A GLU 68  ? B GLU 51  
11 1 Y 1 A ALA 160 ? B ALA 143 
12 1 Y 1 A ASP 161 ? B ASP 144 
13 1 Y 1 A PRO 162 ? B PRO 145 
# 
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  
CL  CL   CL N N 74  
CYS N    N  N N 75  
CYS CA   C  N R 76  
CYS C    C  N N 77  
CYS O    O  N N 78  
CYS CB   C  N N 79  
CYS SG   S  N N 80  
CYS OXT  O  N N 81  
CYS H    H  N N 82  
CYS H2   H  N N 83  
CYS HA   H  N N 84  
CYS HB2  H  N N 85  
CYS HB3  H  N N 86  
CYS HG   H  N N 87  
CYS HXT  H  N N 88  
EDO C1   C  N N 89  
EDO O1   O  N N 90  
EDO C2   C  N N 91  
EDO O2   O  N N 92  
EDO H11  H  N N 93  
EDO H12  H  N N 94  
EDO HO1  H  N N 95  
EDO H21  H  N N 96  
EDO H22  H  N N 97  
EDO HO2  H  N N 98  
GLN N    N  N N 99  
GLN CA   C  N S 100 
GLN C    C  N N 101 
GLN O    O  N N 102 
GLN CB   C  N N 103 
GLN CG   C  N N 104 
GLN CD   C  N N 105 
GLN OE1  O  N N 106 
GLN NE2  N  N N 107 
GLN OXT  O  N N 108 
GLN H    H  N N 109 
GLN H2   H  N N 110 
GLN HA   H  N N 111 
GLN HB2  H  N N 112 
GLN HB3  H  N N 113 
GLN HG2  H  N N 114 
GLN HG3  H  N N 115 
GLN HE21 H  N N 116 
GLN HE22 H  N N 117 
GLN HXT  H  N N 118 
GLU N    N  N N 119 
GLU CA   C  N S 120 
GLU C    C  N N 121 
GLU O    O  N N 122 
GLU CB   C  N N 123 
GLU CG   C  N N 124 
GLU CD   C  N N 125 
GLU OE1  O  N N 126 
GLU OE2  O  N N 127 
GLU OXT  O  N N 128 
GLU H    H  N N 129 
GLU H2   H  N N 130 
GLU HA   H  N N 131 
GLU HB2  H  N N 132 
GLU HB3  H  N N 133 
GLU HG2  H  N N 134 
GLU HG3  H  N N 135 
GLU HE2  H  N N 136 
GLU HXT  H  N N 137 
GLY N    N  N N 138 
GLY CA   C  N N 139 
GLY C    C  N N 140 
GLY O    O  N N 141 
GLY OXT  O  N N 142 
GLY H    H  N N 143 
GLY H2   H  N N 144 
GLY HA2  H  N N 145 
GLY HA3  H  N N 146 
GLY HXT  H  N N 147 
HIS N    N  N N 148 
HIS CA   C  N S 149 
HIS C    C  N N 150 
HIS O    O  N N 151 
HIS CB   C  N N 152 
HIS CG   C  Y N 153 
HIS ND1  N  Y N 154 
HIS CD2  C  Y N 155 
HIS CE1  C  Y N 156 
HIS NE2  N  Y N 157 
HIS OXT  O  N N 158 
HIS H    H  N N 159 
HIS H2   H  N N 160 
HIS HA   H  N N 161 
HIS HB2  H  N N 162 
HIS HB3  H  N N 163 
HIS HD1  H  N N 164 
HIS HD2  H  N N 165 
HIS HE1  H  N N 166 
HIS HE2  H  N N 167 
HIS HXT  H  N N 168 
HOH O    O  N N 169 
HOH H1   H  N N 170 
HOH H2   H  N N 171 
ILE N    N  N N 172 
ILE CA   C  N S 173 
ILE C    C  N N 174 
ILE O    O  N N 175 
ILE CB   C  N S 176 
ILE CG1  C  N N 177 
ILE CG2  C  N N 178 
ILE CD1  C  N N 179 
ILE OXT  O  N N 180 
ILE H    H  N N 181 
ILE H2   H  N N 182 
ILE HA   H  N N 183 
ILE HB   H  N N 184 
ILE HG12 H  N N 185 
ILE HG13 H  N N 186 
ILE HG21 H  N N 187 
ILE HG22 H  N N 188 
ILE HG23 H  N N 189 
ILE HD11 H  N N 190 
ILE HD12 H  N N 191 
ILE HD13 H  N N 192 
ILE HXT  H  N N 193 
LEU N    N  N N 194 
LEU CA   C  N S 195 
LEU C    C  N N 196 
LEU O    O  N N 197 
LEU CB   C  N N 198 
LEU CG   C  N N 199 
LEU CD1  C  N N 200 
LEU CD2  C  N N 201 
LEU OXT  O  N N 202 
LEU H    H  N N 203 
LEU H2   H  N N 204 
LEU HA   H  N N 205 
LEU HB2  H  N N 206 
LEU HB3  H  N N 207 
LEU HG   H  N N 208 
LEU HD11 H  N N 209 
LEU HD12 H  N N 210 
LEU HD13 H  N N 211 
LEU HD21 H  N N 212 
LEU HD22 H  N N 213 
LEU HD23 H  N N 214 
LEU HXT  H  N N 215 
LYS N    N  N N 216 
LYS CA   C  N S 217 
LYS C    C  N N 218 
LYS O    O  N N 219 
LYS CB   C  N N 220 
LYS CG   C  N N 221 
LYS CD   C  N N 222 
LYS CE   C  N N 223 
LYS NZ   N  N N 224 
LYS OXT  O  N N 225 
LYS H    H  N N 226 
LYS H2   H  N N 227 
LYS HA   H  N N 228 
LYS HB2  H  N N 229 
LYS HB3  H  N N 230 
LYS HG2  H  N N 231 
LYS HG3  H  N N 232 
LYS HD2  H  N N 233 
LYS HD3  H  N N 234 
LYS HE2  H  N N 235 
LYS HE3  H  N N 236 
LYS HZ1  H  N N 237 
LYS HZ2  H  N N 238 
LYS HZ3  H  N N 239 
LYS HXT  H  N N 240 
MET N    N  N N 241 
MET CA   C  N S 242 
MET C    C  N N 243 
MET O    O  N N 244 
MET CB   C  N N 245 
MET CG   C  N N 246 
MET SD   S  N N 247 
MET CE   C  N N 248 
MET OXT  O  N N 249 
MET H    H  N N 250 
MET H2   H  N N 251 
MET HA   H  N N 252 
MET HB2  H  N N 253 
MET HB3  H  N N 254 
MET HG2  H  N N 255 
MET HG3  H  N N 256 
MET HE1  H  N N 257 
MET HE2  H  N N 258 
MET HE3  H  N N 259 
MET HXT  H  N N 260 
PEG C1   C  N N 261 
PEG O1   O  N N 262 
PEG C2   C  N N 263 
PEG O2   O  N N 264 
PEG C3   C  N N 265 
PEG C4   C  N N 266 
PEG O4   O  N N 267 
PEG H11  H  N N 268 
PEG H12  H  N N 269 
PEG HO1  H  N N 270 
PEG H21  H  N N 271 
PEG H22  H  N N 272 
PEG H31  H  N N 273 
PEG H32  H  N N 274 
PEG H41  H  N N 275 
PEG H42  H  N N 276 
PEG HO4  H  N N 277 
PHE N    N  N N 278 
PHE CA   C  N S 279 
PHE C    C  N N 280 
PHE O    O  N N 281 
PHE CB   C  N N 282 
PHE CG   C  Y N 283 
PHE CD1  C  Y N 284 
PHE CD2  C  Y N 285 
PHE CE1  C  Y N 286 
PHE CE2  C  Y N 287 
PHE CZ   C  Y N 288 
PHE OXT  O  N N 289 
PHE H    H  N N 290 
PHE H2   H  N N 291 
PHE HA   H  N N 292 
PHE HB2  H  N N 293 
PHE HB3  H  N N 294 
PHE HD1  H  N N 295 
PHE HD2  H  N N 296 
PHE HE1  H  N N 297 
PHE HE2  H  N N 298 
PHE HZ   H  N N 299 
PHE HXT  H  N N 300 
PRO N    N  N N 301 
PRO CA   C  N S 302 
PRO C    C  N N 303 
PRO O    O  N N 304 
PRO CB   C  N N 305 
PRO CG   C  N N 306 
PRO CD   C  N N 307 
PRO OXT  O  N N 308 
PRO H    H  N N 309 
PRO HA   H  N N 310 
PRO HB2  H  N N 311 
PRO HB3  H  N N 312 
PRO HG2  H  N N 313 
PRO HG3  H  N N 314 
PRO HD2  H  N N 315 
PRO HD3  H  N N 316 
PRO HXT  H  N N 317 
SER N    N  N N 318 
SER CA   C  N S 319 
SER C    C  N N 320 
SER O    O  N N 321 
SER CB   C  N N 322 
SER OG   O  N N 323 
SER OXT  O  N N 324 
SER H    H  N N 325 
SER H2   H  N N 326 
SER HA   H  N N 327 
SER HB2  H  N N 328 
SER HB3  H  N N 329 
SER HG   H  N N 330 
SER HXT  H  N N 331 
THR N    N  N N 332 
THR CA   C  N S 333 
THR C    C  N N 334 
THR O    O  N N 335 
THR CB   C  N R 336 
THR OG1  O  N N 337 
THR CG2  C  N N 338 
THR OXT  O  N N 339 
THR H    H  N N 340 
THR H2   H  N N 341 
THR HA   H  N N 342 
THR HB   H  N N 343 
THR HG1  H  N N 344 
THR HG21 H  N N 345 
THR HG22 H  N N 346 
THR HG23 H  N N 347 
THR HXT  H  N N 348 
TRP N    N  N N 349 
TRP CA   C  N S 350 
TRP C    C  N N 351 
TRP O    O  N N 352 
TRP CB   C  N N 353 
TRP CG   C  Y N 354 
TRP CD1  C  Y N 355 
TRP CD2  C  Y N 356 
TRP NE1  N  Y N 357 
TRP CE2  C  Y N 358 
TRP CE3  C  Y N 359 
TRP CZ2  C  Y N 360 
TRP CZ3  C  Y N 361 
TRP CH2  C  Y N 362 
TRP OXT  O  N N 363 
TRP H    H  N N 364 
TRP H2   H  N N 365 
TRP HA   H  N N 366 
TRP HB2  H  N N 367 
TRP HB3  H  N N 368 
TRP HD1  H  N N 369 
TRP HE1  H  N N 370 
TRP HE3  H  N N 371 
TRP HZ2  H  N N 372 
TRP HZ3  H  N N 373 
TRP HH2  H  N N 374 
TRP HXT  H  N N 375 
TYR N    N  N N 376 
TYR CA   C  N S 377 
TYR C    C  N N 378 
TYR O    O  N N 379 
TYR CB   C  N N 380 
TYR CG   C  Y N 381 
TYR CD1  C  Y N 382 
TYR CD2  C  Y N 383 
TYR CE1  C  Y N 384 
TYR CE2  C  Y N 385 
TYR CZ   C  Y N 386 
TYR OH   O  N N 387 
TYR OXT  O  N N 388 
TYR H    H  N N 389 
TYR H2   H  N N 390 
TYR HA   H  N N 391 
TYR HB2  H  N N 392 
TYR HB3  H  N N 393 
TYR HD1  H  N N 394 
TYR HD2  H  N N 395 
TYR HE1  H  N N 396 
TYR HE2  H  N N 397 
TYR HH   H  N N 398 
TYR HXT  H  N N 399 
VAL N    N  N N 400 
VAL CA   C  N S 401 
VAL C    C  N N 402 
VAL O    O  N N 403 
VAL CB   C  N N 404 
VAL CG1  C  N N 405 
VAL CG2  C  N N 406 
VAL OXT  O  N N 407 
VAL H    H  N N 408 
VAL H2   H  N N 409 
VAL HA   H  N N 410 
VAL HB   H  N N 411 
VAL HG11 H  N N 412 
VAL HG12 H  N N 413 
VAL HG13 H  N N 414 
VAL HG21 H  N N 415 
VAL HG22 H  N N 416 
VAL HG23 H  N N 417 
VAL HXT  H  N N 418 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
EDO C1  O1   sing N N 83  
EDO C1  C2   sing N N 84  
EDO C1  H11  sing N N 85  
EDO C1  H12  sing N N 86  
EDO O1  HO1  sing N N 87  
EDO C2  O2   sing N N 88  
EDO C2  H21  sing N N 89  
EDO C2  H22  sing N N 90  
EDO O2  HO2  sing N N 91  
GLN N   CA   sing N N 92  
GLN N   H    sing N N 93  
GLN N   H2   sing N N 94  
GLN CA  C    sing N N 95  
GLN CA  CB   sing N N 96  
GLN CA  HA   sing N N 97  
GLN C   O    doub N N 98  
GLN C   OXT  sing N N 99  
GLN CB  CG   sing N N 100 
GLN CB  HB2  sing N N 101 
GLN CB  HB3  sing N N 102 
GLN CG  CD   sing N N 103 
GLN CG  HG2  sing N N 104 
GLN CG  HG3  sing N N 105 
GLN CD  OE1  doub N N 106 
GLN CD  NE2  sing N N 107 
GLN NE2 HE21 sing N N 108 
GLN NE2 HE22 sing N N 109 
GLN OXT HXT  sing N N 110 
GLU N   CA   sing N N 111 
GLU N   H    sing N N 112 
GLU N   H2   sing N N 113 
GLU CA  C    sing N N 114 
GLU CA  CB   sing N N 115 
GLU CA  HA   sing N N 116 
GLU C   O    doub N N 117 
GLU C   OXT  sing N N 118 
GLU CB  CG   sing N N 119 
GLU CB  HB2  sing N N 120 
GLU CB  HB3  sing N N 121 
GLU CG  CD   sing N N 122 
GLU CG  HG2  sing N N 123 
GLU CG  HG3  sing N N 124 
GLU CD  OE1  doub N N 125 
GLU CD  OE2  sing N N 126 
GLU OE2 HE2  sing N N 127 
GLU OXT HXT  sing N N 128 
GLY N   CA   sing N N 129 
GLY N   H    sing N N 130 
GLY N   H2   sing N N 131 
GLY CA  C    sing N N 132 
GLY CA  HA2  sing N N 133 
GLY CA  HA3  sing N N 134 
GLY C   O    doub N N 135 
GLY C   OXT  sing N N 136 
GLY OXT HXT  sing N N 137 
HIS N   CA   sing N N 138 
HIS N   H    sing N N 139 
HIS N   H2   sing N N 140 
HIS CA  C    sing N N 141 
HIS CA  CB   sing N N 142 
HIS CA  HA   sing N N 143 
HIS C   O    doub N N 144 
HIS C   OXT  sing N N 145 
HIS CB  CG   sing N N 146 
HIS CB  HB2  sing N N 147 
HIS CB  HB3  sing N N 148 
HIS CG  ND1  sing Y N 149 
HIS CG  CD2  doub Y N 150 
HIS ND1 CE1  doub Y N 151 
HIS ND1 HD1  sing N N 152 
HIS CD2 NE2  sing Y N 153 
HIS CD2 HD2  sing N N 154 
HIS CE1 NE2  sing Y N 155 
HIS CE1 HE1  sing N N 156 
HIS NE2 HE2  sing N N 157 
HIS OXT HXT  sing N N 158 
HOH O   H1   sing N N 159 
HOH O   H2   sing N N 160 
ILE N   CA   sing N N 161 
ILE N   H    sing N N 162 
ILE N   H2   sing N N 163 
ILE CA  C    sing N N 164 
ILE CA  CB   sing N N 165 
ILE CA  HA   sing N N 166 
ILE C   O    doub N N 167 
ILE C   OXT  sing N N 168 
ILE CB  CG1  sing N N 169 
ILE CB  CG2  sing N N 170 
ILE CB  HB   sing N N 171 
ILE CG1 CD1  sing N N 172 
ILE CG1 HG12 sing N N 173 
ILE CG1 HG13 sing N N 174 
ILE CG2 HG21 sing N N 175 
ILE CG2 HG22 sing N N 176 
ILE CG2 HG23 sing N N 177 
ILE CD1 HD11 sing N N 178 
ILE CD1 HD12 sing N N 179 
ILE CD1 HD13 sing N N 180 
ILE OXT HXT  sing N N 181 
LEU N   CA   sing N N 182 
LEU N   H    sing N N 183 
LEU N   H2   sing N N 184 
LEU CA  C    sing N N 185 
LEU CA  CB   sing N N 186 
LEU CA  HA   sing N N 187 
LEU C   O    doub N N 188 
LEU C   OXT  sing N N 189 
LEU CB  CG   sing N N 190 
LEU CB  HB2  sing N N 191 
LEU CB  HB3  sing N N 192 
LEU CG  CD1  sing N N 193 
LEU CG  CD2  sing N N 194 
LEU CG  HG   sing N N 195 
LEU CD1 HD11 sing N N 196 
LEU CD1 HD12 sing N N 197 
LEU CD1 HD13 sing N N 198 
LEU CD2 HD21 sing N N 199 
LEU CD2 HD22 sing N N 200 
LEU CD2 HD23 sing N N 201 
LEU OXT HXT  sing N N 202 
LYS N   CA   sing N N 203 
LYS N   H    sing N N 204 
LYS N   H2   sing N N 205 
LYS CA  C    sing N N 206 
LYS CA  CB   sing N N 207 
LYS CA  HA   sing N N 208 
LYS C   O    doub N N 209 
LYS C   OXT  sing N N 210 
LYS CB  CG   sing N N 211 
LYS CB  HB2  sing N N 212 
LYS CB  HB3  sing N N 213 
LYS CG  CD   sing N N 214 
LYS CG  HG2  sing N N 215 
LYS CG  HG3  sing N N 216 
LYS CD  CE   sing N N 217 
LYS CD  HD2  sing N N 218 
LYS CD  HD3  sing N N 219 
LYS CE  NZ   sing N N 220 
LYS CE  HE2  sing N N 221 
LYS CE  HE3  sing N N 222 
LYS NZ  HZ1  sing N N 223 
LYS NZ  HZ2  sing N N 224 
LYS NZ  HZ3  sing N N 225 
LYS OXT HXT  sing N N 226 
MET N   CA   sing N N 227 
MET N   H    sing N N 228 
MET N   H2   sing N N 229 
MET CA  C    sing N N 230 
MET CA  CB   sing N N 231 
MET CA  HA   sing N N 232 
MET C   O    doub N N 233 
MET C   OXT  sing N N 234 
MET CB  CG   sing N N 235 
MET CB  HB2  sing N N 236 
MET CB  HB3  sing N N 237 
MET CG  SD   sing N N 238 
MET CG  HG2  sing N N 239 
MET CG  HG3  sing N N 240 
MET SD  CE   sing N N 241 
MET CE  HE1  sing N N 242 
MET CE  HE2  sing N N 243 
MET CE  HE3  sing N N 244 
MET OXT HXT  sing N N 245 
PEG C1  O1   sing N N 246 
PEG C1  C2   sing N N 247 
PEG C1  H11  sing N N 248 
PEG C1  H12  sing N N 249 
PEG O1  HO1  sing N N 250 
PEG C2  O2   sing N N 251 
PEG C2  H21  sing N N 252 
PEG C2  H22  sing N N 253 
PEG O2  C3   sing N N 254 
PEG C3  C4   sing N N 255 
PEG C3  H31  sing N N 256 
PEG C3  H32  sing N N 257 
PEG C4  O4   sing N N 258 
PEG C4  H41  sing N N 259 
PEG C4  H42  sing N N 260 
PEG O4  HO4  sing N N 261 
PHE N   CA   sing N N 262 
PHE N   H    sing N N 263 
PHE N   H2   sing N N 264 
PHE CA  C    sing N N 265 
PHE CA  CB   sing N N 266 
PHE CA  HA   sing N N 267 
PHE C   O    doub N N 268 
PHE C   OXT  sing N N 269 
PHE CB  CG   sing N N 270 
PHE CB  HB2  sing N N 271 
PHE CB  HB3  sing N N 272 
PHE CG  CD1  doub Y N 273 
PHE CG  CD2  sing Y N 274 
PHE CD1 CE1  sing Y N 275 
PHE CD1 HD1  sing N N 276 
PHE CD2 CE2  doub Y N 277 
PHE CD2 HD2  sing N N 278 
PHE CE1 CZ   doub Y N 279 
PHE CE1 HE1  sing N N 280 
PHE CE2 CZ   sing Y N 281 
PHE CE2 HE2  sing N N 282 
PHE CZ  HZ   sing N N 283 
PHE OXT HXT  sing N N 284 
PRO N   CA   sing N N 285 
PRO N   CD   sing N N 286 
PRO N   H    sing N N 287 
PRO CA  C    sing N N 288 
PRO CA  CB   sing N N 289 
PRO CA  HA   sing N N 290 
PRO C   O    doub N N 291 
PRO C   OXT  sing N N 292 
PRO CB  CG   sing N N 293 
PRO CB  HB2  sing N N 294 
PRO CB  HB3  sing N N 295 
PRO CG  CD   sing N N 296 
PRO CG  HG2  sing N N 297 
PRO CG  HG3  sing N N 298 
PRO CD  HD2  sing N N 299 
PRO CD  HD3  sing N N 300 
PRO OXT HXT  sing N N 301 
SER N   CA   sing N N 302 
SER N   H    sing N N 303 
SER N   H2   sing N N 304 
SER CA  C    sing N N 305 
SER CA  CB   sing N N 306 
SER CA  HA   sing N N 307 
SER C   O    doub N N 308 
SER C   OXT  sing N N 309 
SER CB  OG   sing N N 310 
SER CB  HB2  sing N N 311 
SER CB  HB3  sing N N 312 
SER OG  HG   sing N N 313 
SER OXT HXT  sing N N 314 
THR N   CA   sing N N 315 
THR N   H    sing N N 316 
THR N   H2   sing N N 317 
THR CA  C    sing N N 318 
THR CA  CB   sing N N 319 
THR CA  HA   sing N N 320 
THR C   O    doub N N 321 
THR C   OXT  sing N N 322 
THR CB  OG1  sing N N 323 
THR CB  CG2  sing N N 324 
THR CB  HB   sing N N 325 
THR OG1 HG1  sing N N 326 
THR CG2 HG21 sing N N 327 
THR CG2 HG22 sing N N 328 
THR CG2 HG23 sing N N 329 
THR OXT HXT  sing N N 330 
TRP N   CA   sing N N 331 
TRP N   H    sing N N 332 
TRP N   H2   sing N N 333 
TRP CA  C    sing N N 334 
TRP CA  CB   sing N N 335 
TRP CA  HA   sing N N 336 
TRP C   O    doub N N 337 
TRP C   OXT  sing N N 338 
TRP CB  CG   sing N N 339 
TRP CB  HB2  sing N N 340 
TRP CB  HB3  sing N N 341 
TRP CG  CD1  doub Y N 342 
TRP CG  CD2  sing Y N 343 
TRP CD1 NE1  sing Y N 344 
TRP CD1 HD1  sing N N 345 
TRP CD2 CE2  doub Y N 346 
TRP CD2 CE3  sing Y N 347 
TRP NE1 CE2  sing Y N 348 
TRP NE1 HE1  sing N N 349 
TRP CE2 CZ2  sing Y N 350 
TRP CE3 CZ3  doub Y N 351 
TRP CE3 HE3  sing N N 352 
TRP CZ2 CH2  doub Y N 353 
TRP CZ2 HZ2  sing N N 354 
TRP CZ3 CH2  sing Y N 355 
TRP CZ3 HZ3  sing N N 356 
TRP CH2 HH2  sing N N 357 
TRP OXT HXT  sing N N 358 
TYR N   CA   sing N N 359 
TYR N   H    sing N N 360 
TYR N   H2   sing N N 361 
TYR CA  C    sing N N 362 
TYR CA  CB   sing N N 363 
TYR CA  HA   sing N N 364 
TYR C   O    doub N N 365 
TYR C   OXT  sing N N 366 
TYR CB  CG   sing N N 367 
TYR CB  HB2  sing N N 368 
TYR CB  HB3  sing N N 369 
TYR CG  CD1  doub Y N 370 
TYR CG  CD2  sing Y N 371 
TYR CD1 CE1  sing Y N 372 
TYR CD1 HD1  sing N N 373 
TYR CD2 CE2  doub Y N 374 
TYR CD2 HD2  sing N N 375 
TYR CE1 CZ   doub Y N 376 
TYR CE1 HE1  sing N N 377 
TYR CE2 CZ   sing Y N 378 
TYR CE2 HE2  sing N N 379 
TYR CZ  OH   sing N N 380 
TYR OH  HH   sing N N 381 
TYR OXT HXT  sing N N 382 
VAL N   CA   sing N N 383 
VAL N   H    sing N N 384 
VAL N   H2   sing N N 385 
VAL CA  C    sing N N 386 
VAL CA  CB   sing N N 387 
VAL CA  HA   sing N N 388 
VAL C   O    doub N N 389 
VAL C   OXT  sing N N 390 
VAL CB  CG1  sing N N 391 
VAL CB  CG2  sing N N 392 
VAL CB  HB   sing N N 393 
VAL CG1 HG11 sing N N 394 
VAL CG1 HG12 sing N N 395 
VAL CG1 HG13 sing N N 396 
VAL CG2 HG21 sing N N 397 
VAL CG2 HG22 sing N N 398 
VAL CG2 HG23 sing N N 399 
VAL OXT HXT  sing N N 400 
# 
_pdbx_audit_support.funding_organization   'Other private' 
_pdbx_audit_support.country                'United Kingdom' 
_pdbx_audit_support.grant_number           'IBioIC 2021-01-01' 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   8OS9 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    8RPT 
_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]   0.017705 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.015248 
_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]   0.014449 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C  
CL 
N  
O  
S  
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N  N   . GLY A 1 1   ? -15.658 -11.388 32.763 1.00 51.56  ? 18  GLY B N   1 
ATOM   2    C  CA  . GLY A 1 1   ? -15.209 -10.015 32.606 1.00 55.37  ? 18  GLY B CA  1 
ATOM   3    C  C   . GLY A 1 1   ? -13.919 -9.930  31.820 1.00 44.45  ? 18  GLY B C   1 
ATOM   4    O  O   . GLY A 1 1   ? -13.612 -8.895  31.228 1.00 48.20  ? 18  GLY B O   1 
ATOM   5    N  N   . MET A 1 2   ? -13.173 -11.040 31.826 1.00 50.29  ? 19  MET B N   1 
ATOM   6    C  CA  . MET A 1 2   ? -11.938 -11.153 31.051 1.00 50.39  ? 19  MET B CA  1 
ATOM   7    C  C   . MET A 1 2   ? -12.152 -10.704 29.608 1.00 45.73  ? 19  MET B C   1 
ATOM   8    O  O   . MET A 1 2   ? -11.398 -9.882  29.077 1.00 44.24  ? 19  MET B O   1 
ATOM   9    C  CB  . MET A 1 2   ? -11.441 -12.605 31.084 1.00 62.10  ? 19  MET B CB  1 
ATOM   10   C  CG  . MET A 1 2   ? -9.959  -12.836 30.759 1.00 63.36  ? 19  MET B CG  1 
ATOM   11   S  SD  . MET A 1 2   ? -8.895  -12.884 32.220 1.00 77.21  ? 19  MET B SD  1 
ATOM   12   C  CE  . MET A 1 2   ? -8.354  -11.195 32.352 1.00 63.37  ? 19  MET B CE  1 
ATOM   13   N  N   . ARG A 1 3   ? -13.191 -11.220 28.970 1.00 31.28  ? 20  ARG B N   1 
ATOM   14   C  CA  . ARG A 1 3   ? -13.491 -10.903 27.593 1.00 28.04  ? 20  ARG B CA  1 
ATOM   15   C  C   . ARG A 1 3   ? -14.809 -10.143 27.526 1.00 26.62  ? 20  ARG B C   1 
ATOM   16   O  O   . ARG A 1 3   ? -15.687 -10.374 28.360 1.00 26.11  ? 20  ARG B O   1 
ATOM   17   C  CB  . ARG A 1 3   ? -13.634 -12.179 26.751 1.00 25.27  ? 20  ARG B CB  1 
ATOM   18   C  CG  . ARG A 1 3   ? -12.394 -13.049 26.673 1.00 25.76  ? 20  ARG B CG  1 
ATOM   19   C  CD  . ARG A 1 3   ? -12.326 -13.739 25.333 1.00 21.22  ? 20  ARG B CD  1 
ATOM   20   N  NE  . ARG A 1 3   ? -11.932 -12.777 24.308 1.00 21.37  ? 20  ARG B NE  1 
ATOM   21   C  CZ  . ARG A 1 3   ? -12.088 -12.956 23.004 1.00 22.04  ? 20  ARG B CZ  1 
ATOM   22   N  NH1 . ARG A 1 3   ? -12.667 -14.048 22.520 1.00 19.60  ? 20  ARG B NH1 1 
ATOM   23   N  NH2 . ARG A 1 3   ? -11.681 -12.007 22.166 1.00 22.76  ? 20  ARG B NH2 1 
ATOM   24   N  N   . PRO A 1 4   ? -14.995 -9.262  26.542 1.00 21.92  ? 21  PRO B N   1 
ATOM   25   C  CA  . PRO A 1 4   ? -16.335 -8.721  26.300 1.00 23.39  ? 21  PRO B CA  1 
ATOM   26   C  C   . PRO A 1 4   ? -17.317 -9.868  26.096 1.00 23.27  ? 21  PRO B C   1 
ATOM   27   O  O   . PRO A 1 4   ? -16.990 -10.903 25.502 1.00 20.60  ? 21  PRO B O   1 
ATOM   28   C  CB  . PRO A 1 4   ? -16.160 -7.873  25.035 1.00 22.31  ? 21  PRO B CB  1 
ATOM   29   C  CG  . PRO A 1 4   ? -14.666 -7.549  24.976 1.00 24.16  ? 21  PRO B CG  1 
ATOM   30   C  CD  . PRO A 1 4   ? -14.013 -8.795  25.548 1.00 23.83  ? 21  PRO B CD  1 
ATOM   31   N  N   . ALA A 1 5   ? -18.501 -9.717  26.667 1.00 22.83  ? 22  ALA B N   1 
ATOM   32   C  CA  . ALA A 1 5   ? -19.562 -10.709 26.538 1.00 21.27  ? 22  ALA B CA  1 
ATOM   33   C  C   . ALA A 1 5   ? -20.489 -10.266 25.419 1.00 23.67  ? 22  ALA B C   1 
ATOM   34   O  O   . ALA A 1 5   ? -21.105 -9.194  25.506 1.00 19.22  ? 22  ALA B O   1 
ATOM   35   C  CB  . ALA A 1 5   ? -20.336 -10.867 27.846 1.00 22.66  ? 22  ALA B CB  1 
ATOM   36   N  N   . LEU A 1 6   ? -20.574 -11.076 24.366 1.00 15.88  ? 23  LEU B N   1 
ATOM   37   C  CA  . LEU A 1 6   ? -21.377 -10.749 23.199 1.00 18.74  ? 23  LEU B CA  1 
ATOM   38   C  C   . LEU A 1 6   ? -22.600 -11.655 23.184 1.00 18.17  ? 23  LEU B C   1 
ATOM   39   O  O   . LEU A 1 6   ? -22.492 -12.845 23.471 1.00 20.33  ? 23  LEU B O   1 
ATOM   40   C  CB  . LEU A 1 6   ? -20.570 -10.924 21.915 1.00 16.92  ? 23  LEU B CB  1 
ATOM   41   C  CG  . LEU A 1 6   ? -19.193 -10.239 21.938 1.00 17.51  ? 23  LEU B CG  1 
ATOM   42   C  CD1 . LEU A 1 6   ? -18.431 -10.585 20.679 1.00 17.79  ? 23  LEU B CD1 1 
ATOM   43   C  CD2 . LEU A 1 6   ? -19.347 -8.729  22.111 1.00 18.19  ? 23  LEU B CD2 1 
ATOM   44   N  N   . TYR A 1 7   ? -23.764 -11.090 22.874 1.00 15.72  ? 24  TYR B N   1 
ATOM   45   C  CA  . TYR A 1 7   ? -25.001 -11.863 22.775 1.00 16.96  ? 24  TYR B CA  1 
ATOM   46   C  C   . TYR A 1 7   ? -25.551 -11.712 21.365 1.00 16.19  ? 24  TYR B C   1 
ATOM   47   O  O   . TYR A 1 7   ? -25.761 -10.585 20.915 1.00 19.70  ? 24  TYR B O   1 
ATOM   48   C  CB  . TYR A 1 7   ? -26.042 -11.395 23.805 1.00 16.58  ? 24  TYR B CB  1 
ATOM   49   C  CG  . TYR A 1 7   ? -27.350 -12.204 23.782 1.00 18.15  ? 24  TYR B CG  1 
ATOM   50   C  CD1 . TYR A 1 7   ? -28.358 -11.932 22.858 1.00 22.18  ? 24  TYR B CD1 1 
ATOM   51   C  CD2 . TYR A 1 7   ? -27.551 -13.245 24.672 1.00 21.63  ? 24  TYR B CD2 1 
ATOM   52   C  CE1 . TYR A 1 7   ? -29.551 -12.661 22.852 1.00 20.21  ? 24  TYR B CE1 1 
ATOM   53   C  CE2 . TYR A 1 7   ? -28.721 -13.990 24.660 1.00 21.84  ? 24  TYR B CE2 1 
ATOM   54   C  CZ  . TYR A 1 7   ? -29.714 -13.693 23.749 1.00 20.81  ? 24  TYR B CZ  1 
ATOM   55   O  OH  . TYR A 1 7   ? -30.879 -14.430 23.758 1.00 24.54  ? 24  TYR B OH  1 
ATOM   56   N  N   . PHE A 1 8   ? -25.809 -12.832 20.674 1.00 16.77  ? 25  PHE B N   1 
ATOM   57   C  CA  . PHE A 1 8   ? -26.232 -12.794 19.270 1.00 14.55  ? 25  PHE B CA  1 
ATOM   58   C  C   . PHE A 1 8   ? -27.671 -13.284 19.131 1.00 17.53  ? 25  PHE B C   1 
ATOM   59   O  O   . PHE A 1 8   ? -28.053 -14.256 19.787 1.00 18.23  ? 25  PHE B O   1 
ATOM   60   C  CB  . PHE A 1 8   ? -25.313 -13.649 18.384 1.00 15.36  ? 25  PHE B CB  1 
ATOM   61   C  CG  . PHE A 1 8   ? -25.760 -13.740 16.935 1.00 17.88  ? 25  PHE B CG  1 
ATOM   62   C  CD1 . PHE A 1 8   ? -25.691 -12.616 16.102 1.00 16.29  ? 25  PHE B CD1 1 
ATOM   63   C  CD2 . PHE A 1 8   ? -26.215 -14.938 16.396 1.00 22.71  ? 25  PHE B CD2 1 
ATOM   64   C  CE1 . PHE A 1 8   ? -26.083 -12.699 14.764 1.00 18.31  ? 25  PHE B CE1 1 
ATOM   65   C  CE2 . PHE A 1 8   ? -26.611 -15.023 15.043 1.00 20.88  ? 25  PHE B CE2 1 
ATOM   66   C  CZ  . PHE A 1 8   ? -26.541 -13.910 14.235 1.00 17.01  ? 25  PHE B CZ  1 
ATOM   67   N  N   . CYS A 1 9   ? -28.454 -12.598 18.272 1.00 15.48  ? 26  CYS B N   1 
ATOM   68   C  CA  . CYS A 1 9   ? -29.866 -12.872 17.981 1.00 19.89  ? 26  CYS B CA  1 
ATOM   69   C  C   . CYS A 1 9   ? -30.008 -13.147 16.493 1.00 21.18  ? 26  CYS B C   1 
ATOM   70   O  O   . CYS A 1 9   ? -29.594 -12.326 15.670 1.00 17.18  ? 26  CYS B O   1 
ATOM   71   C  CB  . CYS A 1 9   ? -30.782 -11.646 18.282 1.00 18.48  ? 26  CYS B CB  1 
ATOM   72   S  SG  . CYS A 1 9   ? -30.445 -10.692 19.730 1.00 30.24  ? 26  CYS B SG  1 
ATOM   73   N  N   . GLY A 1 10  ? -30.627 -14.256 16.132 1.00 20.61  ? 27  GLY B N   1 
ATOM   74   C  CA  . GLY A 1 10  ? -30.876 -14.480 14.723 1.00 23.01  ? 27  GLY B CA  1 
ATOM   75   C  C   . GLY A 1 10  ? -31.884 -15.585 14.518 1.00 29.05  ? 27  GLY B C   1 
ATOM   76   O  O   . GLY A 1 10  ? -32.027 -16.479 15.357 1.00 30.94  ? 27  GLY B O   1 
ATOM   77   N  N   . SER A 1 11  ? -32.517 -15.561 13.347 1.00 26.92  ? 28  SER B N   1 
ATOM   78   C  CA  . SER A 1 11  ? -33.503 -16.599 12.962 1.00 32.15  ? 28  SER B CA  1 
ATOM   79   C  C   . SER A 1 11  ? -32.889 -17.582 11.953 1.00 32.48  ? 28  SER B C   1 
ATOM   80   O  O   . SER A 1 11  ? -32.070 -17.151 11.140 1.00 33.25  ? 28  SER B O   1 
ATOM   81   C  CB  . SER A 1 11  ? -34.728 -15.971 12.371 1.00 29.94  ? 28  SER B CB  1 
ATOM   82   O  OG  . SER A 1 11  ? -35.599 -16.952 11.830 1.00 31.89  ? 28  SER B OG  1 
ATOM   83   N  N   . ILE A 1 12  ? -33.307 -18.842 12.002 1.00 29.92  ? 29  ILE B N   1 
ATOM   84   C  CA  . ILE A 1 12  ? -32.825 -19.890 11.055 1.00 35.03  ? 29  ILE B CA  1 
ATOM   85   C  C   . ILE A 1 12  ? -34.025 -20.483 10.299 1.00 36.56  ? 29  ILE B C   1 
ATOM   86   O  O   . ILE A 1 12  ? -33.882 -21.572 9.743  1.00 35.35  ? 29  ILE B O   1 
ATOM   87   C  CB  . ILE A 1 12  ? -32.055 -20.979 11.813 1.00 31.67  ? 29  ILE B CB  1 
ATOM   88   C  CG1 . ILE A 1 12  ? -32.899 -21.573 12.935 1.00 31.89  ? 29  ILE B CG1 1 
ATOM   89   C  CG2 . ILE A 1 12  ? -30.719 -20.442 12.326 1.00 34.36  ? 29  ILE B CG2 1 
ATOM   90   C  CD1 . ILE A 1 12  ? -32.251 -22.749 13.637 1.00 37.59  ? 29  ILE B CD1 1 
ATOM   91   N  N   . ARG A 1 13  ? -35.153 -19.771 10.293 1.00 43.52  ? 30  ARG B N   1 
ATOM   92   C  CA  . ARG A 1 13  ? -36.431 -20.282 9.730  1.00 43.95  ? 30  ARG B CA  1 
ATOM   93   C  C   . ARG A 1 13  ? -36.320 -20.444 8.206  1.00 50.59  ? 30  ARG B C   1 
ATOM   94   O  O   . ARG A 1 13  ? -37.097 -21.227 7.641  1.00 51.60  ? 30  ARG B O   1 
ATOM   95   C  CB  . ARG A 1 13  ? -37.605 -19.355 10.044 1.00 30.00  ? 30  ARG B CB  1 
ATOM   96   N  N   . GLY A 1 14  ? -35.380 -19.743 7.584  1.00 47.28  ? 31  GLY B N   1 
ATOM   97   C  CA  . GLY A 1 14  ? -35.245 -19.794 6.121  1.00 48.55  ? 31  GLY B CA  1 
ATOM   98   C  C   . GLY A 1 14  ? -34.454 -21.003 5.663  1.00 47.05  ? 31  GLY B C   1 
ATOM   99   O  O   . GLY A 1 14  ? -34.318 -21.176 4.443  1.00 54.61  ? 31  GLY B O   1 
ATOM   100  N  N   . GLY A 1 15  ? -33.938 -21.803 6.594  1.00 43.33  ? 32  GLY B N   1 
ATOM   101  C  CA  . GLY A 1 15  ? -33.348 -23.099 6.225  1.00 39.30  ? 32  GLY B CA  1 
ATOM   102  C  C   . GLY A 1 15  ? -31.835 -23.178 6.297  1.00 44.07  ? 32  GLY B C   1 
ATOM   103  O  O   . GLY A 1 15  ? -31.236 -22.387 7.039  1.00 39.62  ? 32  GLY B O   1 
ATOM   104  N  N   . ARG A 1 16  ? -31.241 -24.101 5.531  1.00 44.44  ? 33  ARG B N   1 
ATOM   105  C  CA  . ARG A 1 16  ? -29.779 -24.369 5.584  1.00 39.87  ? 33  ARG B CA  1 
ATOM   106  C  C   . ARG A 1 16  ? -28.923 -23.110 5.405  1.00 45.16  ? 33  ARG B C   1 
ATOM   107  O  O   . ARG A 1 16  ? -27.968 -22.955 6.170  1.00 38.25  ? 33  ARG B O   1 
ATOM   108  C  CB  . ARG A 1 16  ? -29.400 -25.400 4.519  1.00 30.00  ? 33  ARG B CB  1 
ATOM   109  N  N   . GLU A 1 17  ? -29.239 -22.260 4.433  1.00 40.66  ? 34  GLU B N   1 
ATOM   110  C  CA  . GLU A 1 17  ? -28.364 -21.093 4.171  1.00 41.26  ? 34  GLU B CA  1 
ATOM   111  C  C   . GLU A 1 17  ? -28.413 -20.134 5.371  1.00 43.05  ? 34  GLU B C   1 
ATOM   112  O  O   . GLU A 1 17  ? -27.384 -19.532 5.675  1.00 38.54  ? 34  GLU B O   1 
ATOM   113  C  CB  . GLU A 1 17  ? -28.789 -20.499 2.833  1.00 44.40  ? 34  GLU B CB  1 
ATOM   114  C  CG  . GLU A 1 17  ? -28.853 -21.550 1.729  1.00 45.69  ? 34  GLU B CG  1 
ATOM   115  C  CD  . GLU A 1 17  ? -28.781 -21.028 0.307  1.00 47.57  ? 34  GLU B CD  1 
ATOM   116  O  OE1 . GLU A 1 17  ? -29.317 -19.936 0.044  1.00 46.89  ? 34  GLU B OE1 1 
ATOM   117  O  OE2 . GLU A 1 17  ? -28.188 -21.723 -0.537 1.00 41.25  ? 34  GLU B OE2 1 
ATOM   118  N  N   . ASP A 1 18  ? -29.572 -20.019 6.015  1.00 40.75  ? 35  ASP B N   1 
ATOM   119  C  CA  . ASP A 1 18  ? -29.707 -19.171 7.224  1.00 37.75  ? 35  ASP B CA  1 
ATOM   120  C  C   . ASP A 1 18  ? -28.846 -19.761 8.342  1.00 34.16  ? 35  ASP B C   1 
ATOM   121  O  O   . ASP A 1 18  ? -28.182 -18.991 9.039  1.00 29.76  ? 35  ASP B O   1 
ATOM   122  C  CB  . ASP A 1 18  ? -31.160 -19.021 7.628  1.00 38.78  ? 35  ASP B CB  1 
ATOM   123  C  CG  . ASP A 1 18  ? -31.920 -17.874 6.982  1.00 48.16  ? 35  ASP B CG  1 
ATOM   124  O  OD1 . ASP A 1 18  ? -31.471 -17.401 5.922  1.00 47.21  ? 35  ASP B OD1 1 
ATOM   125  O  OD2 . ASP A 1 18  ? -32.953 -17.468 7.551  1.00 46.17  ? 35  ASP B OD2 1 
ATOM   126  N  N   . ARG A 1 19  ? -28.876 -21.078 8.495  1.00 27.60  ? 36  ARG B N   1 
ATOM   127  C  CA  . ARG A 1 19  ? -28.084 -21.735 9.559  1.00 26.43  ? 36  ARG B CA  1 
ATOM   128  C  C   . ARG A 1 19  ? -26.593 -21.471 9.304  1.00 31.22  ? 36  ARG B C   1 
ATOM   129  O  O   . ARG A 1 19  ? -25.886 -21.143 10.253 1.00 27.45  ? 36  ARG B O   1 
ATOM   130  C  CB  . ARG A 1 19  ? -28.404 -23.228 9.656  1.00 29.69  ? 36  ARG B CB  1 
ATOM   131  C  CG  . ARG A 1 19  ? -29.772 -23.570 10.227 1.00 39.18  ? 36  ARG B CG  1 
ATOM   132  C  CD  . ARG A 1 19  ? -29.971 -25.074 10.334 1.00 37.94  ? 36  ARG B CD  1 
ATOM   133  N  NE  . ARG A 1 19  ? -31.342 -25.433 10.706 1.00 46.13  ? 36  ARG B NE  1 
ATOM   134  C  CZ  . ARG A 1 19  ? -31.734 -25.732 11.937 1.00 48.80  ? 36  ARG B CZ  1 
ATOM   135  N  NH1 . ARG A 1 19  ? -30.836 -25.929 12.885 1.00 45.98  ? 36  ARG B NH1 1 
ATOM   136  N  NH2 . ARG A 1 19  ? -33.022 -25.831 12.221 1.00 39.26  ? 36  ARG B NH2 1 
ATOM   137  N  N   . THR A 1 20  ? -26.158 -21.589 8.052  1.00 28.55  ? 37  THR B N   1 
ATOM   138  C  CA  . THR A 1 20  ? -24.738 -21.377 7.721  1.00 29.35  ? 37  THR B CA  1 
ATOM   139  C  C   . THR A 1 20  ? -24.342 -19.946 8.061  1.00 30.46  ? 37  THR B C   1 
ATOM   140  O  O   . THR A 1 20  ? -23.305 -19.775 8.697  1.00 28.97  ? 37  THR B O   1 
ATOM   141  C  CB  . THR A 1 20  ? -24.482 -21.744 6.255  1.00 36.86  ? 37  THR B CB  1 
ATOM   142  O  OG1 . THR A 1 20  ? -25.249 -20.861 5.445  1.00 48.40  ? 37  THR B OG1 1 
ATOM   143  C  CG2 . THR A 1 20  ? -24.852 -23.184 5.951  1.00 32.84  ? 37  THR B CG2 1 
ATOM   144  N  N   . LEU A 1 21  ? -25.144 -18.962 7.657  1.00 28.64  ? 38  LEU B N   1 
ATOM   145  C  CA  . LEU A 1 21  ? -24.886 -17.543 8.005  1.00 26.92  ? 38  LEU B CA  1 
ATOM   146  C  C   . LEU A 1 21  ? -24.848 -17.370 9.528  1.00 23.57  ? 38  LEU B C   1 
ATOM   147  O  O   . LEU A 1 21  ? -23.941 -16.700 10.015 1.00 28.05  ? 38  LEU B O   1 
ATOM   148  C  CB  . LEU A 1 21  ? -25.996 -16.705 7.393  1.00 27.44  ? 38  LEU B CB  1 
ATOM   149  C  CG  . LEU A 1 21  ? -25.770 -15.194 7.336  1.00 32.00  ? 38  LEU B CG  1 
ATOM   150  C  CD1 . LEU A 1 21  ? -24.313 -14.866 7.073  1.00 32.22  ? 38  LEU B CD1 1 
ATOM   151  C  CD2 . LEU A 1 21  ? -26.641 -14.674 6.215  1.00 35.12  ? 38  LEU B CD2 1 
ATOM   152  N  N   . TYR A 1 22  ? -25.828 -17.928 10.218 1.00 23.37  ? 39  TYR B N   1 
ATOM   153  C  CA  . TYR A 1 22  ? -25.858 -17.868 11.697 1.00 25.60  ? 39  TYR B CA  1 
ATOM   154  C  C   . TYR A 1 22  ? -24.510 -18.353 12.207 1.00 25.38  ? 39  TYR B C   1 
ATOM   155  O  O   . TYR A 1 22  ? -23.879 -17.641 12.990 1.00 22.03  ? 39  TYR B O   1 
ATOM   156  C  CB  . TYR A 1 22  ? -27.034 -18.688 12.226 1.00 20.92  ? 39  TYR B CB  1 
ATOM   157  C  CG  . TYR A 1 22  ? -27.387 -18.478 13.691 1.00 21.38  ? 39  TYR B CG  1 
ATOM   158  C  CD1 . TYR A 1 22  ? -26.566 -18.957 14.702 1.00 23.08  ? 39  TYR B CD1 1 
ATOM   159  C  CD2 . TYR A 1 22  ? -28.553 -17.823 14.062 1.00 24.44  ? 39  TYR B CD2 1 
ATOM   160  C  CE1 . TYR A 1 22  ? -26.881 -18.774 16.037 1.00 23.25  ? 39  TYR B CE1 1 
ATOM   161  C  CE2 . TYR A 1 22  ? -28.878 -17.630 15.394 1.00 24.65  ? 39  TYR B CE2 1 
ATOM   162  C  CZ  . TYR A 1 22  ? -28.040 -18.107 16.384 1.00 24.13  ? 39  TYR B CZ  1 
ATOM   163  O  OH  . TYR A 1 22  ? -28.351 -17.937 17.698 1.00 24.73  ? 39  TYR B OH  1 
ATOM   164  N  N   . GLU A 1 23  ? -24.083 -19.531 11.753 1.00 23.97  ? 40  GLU B N   1 
ATOM   165  C  CA  . GLU A 1 23  ? -22.837 -20.066 12.300 1.00 26.85  ? 40  GLU B CA  1 
ATOM   166  C  C   . GLU A 1 23  ? -21.637 -19.215 11.903 1.00 22.72  ? 40  GLU B C   1 
ATOM   167  O  O   . GLU A 1 23  ? -20.681 -19.089 12.677 1.00 24.08  ? 40  GLU B O   1 
ATOM   168  C  CB  . GLU A 1 23  ? -22.607 -21.516 11.845 1.00 28.66  ? 40  GLU B CB  1 
ATOM   169  C  CG  . GLU A 1 23  ? -23.542 -22.545 12.464 1.00 41.23  ? 40  GLU B CG  1 
ATOM   170  C  CD  . GLU A 1 23  ? -23.551 -23.880 11.716 1.00 58.25  ? 40  GLU B CD  1 
ATOM   171  O  OE1 . GLU A 1 23  ? -22.565 -24.186 11.001 1.00 60.40  ? 40  GLU B OE1 1 
ATOM   172  O  OE2 . GLU A 1 23  ? -24.531 -24.640 11.866 1.00 57.75  ? 40  GLU B OE2 1 
ATOM   173  N  N   . ARG A 1 24  ? -21.649 -18.665 10.683 1.00 24.22  ? 41  ARG B N   1 
ATOM   174  C  CA  . ARG A 1 24  ? -20.556 -17.794 10.237 1.00 28.53  ? 41  ARG B CA  1 
ATOM   175  C  C   . ARG A 1 24  ? -20.428 -16.553 11.111 1.00 21.76  ? 41  ARG B C   1 
ATOM   176  O  O   . ARG A 1 24  ? -19.310 -16.120 11.436 1.00 19.80  ? 41  ARG B O   1 
ATOM   177  C  CB  . ARG A 1 24  ? -20.766 -17.382 8.777  1.00 27.50  ? 41  ARG B CB  1 
ATOM   178  C  CG  . ARG A 1 24  ? -19.615 -16.585 8.178  1.00 33.34  ? 41  ARG B CG  1 
ATOM   179  C  CD  . ARG A 1 24  ? -19.916 -16.186 6.738  1.00 33.14  ? 41  ARG B CD  1 
ATOM   180  N  NE  . ARG A 1 24  ? -19.968 -17.363 5.878  1.00 35.98  ? 41  ARG B NE  1 
ATOM   181  C  CZ  . ARG A 1 24  ? -20.704 -17.470 4.779  1.00 45.77  ? 41  ARG B CZ  1 
ATOM   182  N  NH1 . ARG A 1 24  ? -21.486 -16.482 4.369  1.00 40.23  ? 41  ARG B NH1 1 
ATOM   183  N  NH2 . ARG A 1 24  ? -20.650 -18.597 4.069  1.00 43.51  ? 41  ARG B NH2 1 
ATOM   184  N  N   . ILE A 1 25  ? -21.558 -15.944 11.469 1.00 22.99  ? 42  ILE B N   1 
ATOM   185  C  CA  . ILE A 1 25  ? -21.524 -14.748 12.306 1.00 17.51  ? 42  ILE B CA  1 
ATOM   186  C  C   . ILE A 1 25  ? -21.027 -15.098 13.696 1.00 19.51  ? 42  ILE B C   1 
ATOM   187  O  O   . ILE A 1 25  ? -20.077 -14.489 14.207 1.00 19.11  ? 42  ILE B O   1 
ATOM   188  C  CB  . ILE A 1 25  ? -22.910 -14.078 12.346 1.00 20.83  ? 42  ILE B CB  1 
ATOM   189  C  CG1 . ILE A 1 25  ? -23.248 -13.490 10.964 1.00 20.66  ? 42  ILE B CG1 1 
ATOM   190  C  CG2 . ILE A 1 25  ? -22.949 -13.011 13.441 1.00 18.38  ? 42  ILE B CG2 1 
ATOM   191  C  CD1 . ILE A 1 25  ? -24.747 -13.171 10.753 1.00 18.17  ? 42  ILE B CD1 1 
ATOM   192  N  N   . VAL A 1 26  ? -21.637 -16.107 14.317 1.00 18.80  ? 43  VAL B N   1 
ATOM   193  C  CA  . VAL A 1 26  ? -21.227 -16.495 15.664 1.00 20.10  ? 43  VAL B CA  1 
ATOM   194  C  C   . VAL A 1 26  ? -19.745 -16.878 15.684 1.00 25.67  ? 43  VAL B C   1 
ATOM   195  O  O   . VAL A 1 26  ? -19.010 -16.526 16.618 1.00 22.58  ? 43  VAL B O   1 
ATOM   196  C  CB  . VAL A 1 26  ? -22.113 -17.638 16.193 1.00 24.08  ? 43  VAL B CB  1 
ATOM   197  C  CG1 . VAL A 1 26  ? -21.491 -18.231 17.442 1.00 25.76  ? 43  VAL B CG1 1 
ATOM   198  C  CG2 . VAL A 1 26  ? -23.534 -17.142 16.460 1.00 23.18  ? 43  VAL B CG2 1 
ATOM   199  N  N   . SER A 1 27  ? -19.261 -17.544 14.634 1.00 22.46  ? 44  SER B N   1 
ATOM   200  C  CA  A SER A 1 27  ? -17.853 -17.934 14.640 0.20 24.79  ? 44  SER B CA  1 
ATOM   201  C  CA  B SER A 1 27  ? -17.850 -17.934 14.611 0.80 24.56  ? 44  SER B CA  1 
ATOM   202  C  C   . SER A 1 27  ? -16.936 -16.715 14.606 1.00 25.25  ? 44  SER B C   1 
ATOM   203  O  O   . SER A 1 27  ? -15.919 -16.691 15.302 1.00 25.60  ? 44  SER B O   1 
ATOM   204  C  CB  A SER A 1 27  ? -17.544 -18.886 13.483 0.20 24.99  ? 44  SER B CB  1 
ATOM   205  C  CB  B SER A 1 27  ? -17.565 -18.819 13.399 0.80 25.99  ? 44  SER B CB  1 
ATOM   206  O  OG  A SER A 1 27  ? -18.308 -18.584 12.334 0.20 24.97  ? 44  SER B OG  1 
ATOM   207  O  OG  B SER A 1 27  ? -18.259 -20.045 13.507 0.80 27.36  ? 44  SER B OG  1 
ATOM   208  N  N   . ARG A 1 28  ? -17.283 -15.685 13.819 1.00 19.26  ? 45  ARG B N   1 
ATOM   209  C  CA  . ARG A 1 28  ? -16.449 -14.486 13.776 1.00 21.15  ? 45  ARG B CA  1 
ATOM   210  C  C   . ARG A 1 28  ? -16.601 -13.659 15.049 1.00 23.69  ? 45  ARG B C   1 
ATOM   211  O  O   . ARG A 1 28  ? -15.620 -13.073 15.523 1.00 23.38  ? 45  ARG B O   1 
ATOM   212  C  CB  . ARG A 1 28  ? -16.773 -13.634 12.540 1.00 20.10  ? 45  ARG B CB  1 
ATOM   213  C  CG  . ARG A 1 28  ? -15.884 -12.383 12.381 1.00 17.52  ? 45  ARG B CG  1 
ATOM   214  C  CD  . ARG A 1 28  ? -14.391 -12.674 12.601 1.00 24.39  ? 45  ARG B CD  1 
ATOM   215  N  NE  . ARG A 1 28  ? -13.849 -13.635 11.642 1.00 32.75  ? 45  ARG B NE  1 
ATOM   216  C  CZ  . ARG A 1 28  ? -13.255 -13.307 10.500 1.00 28.38  ? 45  ARG B CZ  1 
ATOM   217  N  NH1 . ARG A 1 28  ? -12.968 -12.046 10.201 1.00 23.48  ? 45  ARG B NH1 1 
ATOM   218  N  NH2 . ARG A 1 28  ? -12.919 -14.269 9.645  1.00 31.40  ? 45  ARG B NH2 1 
ATOM   219  N  N   . LEU A 1 29  ? -17.809 -13.616 15.629 1.00 22.36  ? 46  LEU B N   1 
ATOM   220  C  CA  . LEU A 1 29  ? -18.005 -12.938 16.908 1.00 18.83  ? 46  LEU B CA  1 
ATOM   221  C  C   . LEU A 1 29  ? -17.072 -13.487 17.988 1.00 19.91  ? 46  LEU B C   1 
ATOM   222  O  O   . LEU A 1 29  ? -16.571 -12.726 18.828 1.00 18.54  ? 46  LEU B O   1 
ATOM   223  C  CB  . LEU A 1 29  ? -19.465 -13.069 17.347 1.00 16.54  ? 46  LEU B CB  1 
ATOM   224  C  CG  . LEU A 1 29  ? -20.457 -12.179 16.583 1.00 15.94  ? 46  LEU B CG  1 
ATOM   225  C  CD1 . LEU A 1 29  ? -21.872 -12.355 17.132 1.00 15.29  ? 46  LEU B CD1 1 
ATOM   226  C  CD2 . LEU A 1 29  ? -20.054 -10.732 16.709 1.00 15.03  ? 46  LEU B CD2 1 
ATOM   227  N  N   . ARG A 1 30  ? -16.825 -14.805 17.989 1.00 18.99  ? 47  ARG B N   1 
ATOM   228  C  CA  A ARG A 1 30  ? -15.931 -15.381 18.990 0.49 22.37  ? 47  ARG B CA  1 
ATOM   229  C  CA  B ARG A 1 30  ? -15.931 -15.392 18.982 0.51 22.54  ? 47  ARG B CA  1 
ATOM   230  C  C   . ARG A 1 30  ? -14.537 -14.780 18.927 1.00 22.96  ? 47  ARG B C   1 
ATOM   231  O  O   . ARG A 1 30  ? -13.813 -14.811 19.931 1.00 21.53  ? 47  ARG B O   1 
ATOM   232  C  CB  A ARG A 1 30  ? -15.847 -16.898 18.825 0.49 25.67  ? 47  ARG B CB  1 
ATOM   233  C  CB  B ARG A 1 30  ? -15.824 -16.902 18.779 0.51 25.64  ? 47  ARG B CB  1 
ATOM   234  C  CG  A ARG A 1 30  ? -17.142 -17.627 19.125 0.49 24.09  ? 47  ARG B CG  1 
ATOM   235  C  CG  B ARG A 1 30  ? -17.110 -17.658 19.044 0.51 26.14  ? 47  ARG B CG  1 
ATOM   236  C  CD  A ARG A 1 30  ? -16.880 -19.107 19.442 0.49 26.35  ? 47  ARG B CD  1 
ATOM   237  C  CD  B ARG A 1 30  ? -16.847 -19.154 19.268 0.51 26.34  ? 47  ARG B CD  1 
ATOM   238  N  NE  A ARG A 1 30  ? -17.985 -19.922 18.958 0.49 27.03  ? 47  ARG B NE  1 
ATOM   239  N  NE  B ARG A 1 30  ? -18.105 -19.861 19.469 0.51 26.43  ? 47  ARG B NE  1 
ATOM   240  C  CZ  A ARG A 1 30  ? -19.098 -20.163 19.639 0.49 27.46  ? 47  ARG B CZ  1 
ATOM   241  C  CZ  B ARG A 1 30  ? -18.823 -20.404 18.493 0.51 28.47  ? 47  ARG B CZ  1 
ATOM   242  N  NH1 A ARG A 1 30  ? -19.206 -19.854 20.921 0.49 24.85  ? 47  ARG B NH1 1 
ATOM   243  N  NH1 B ARG A 1 30  ? -18.354 -20.506 17.257 0.51 25.53  ? 47  ARG B NH1 1 
ATOM   244  N  NH2 A ARG A 1 30  ? -20.124 -20.739 19.020 0.49 29.39  ? 47  ARG B NH2 1 
ATOM   245  N  NH2 B ARG A 1 30  ? -20.046 -20.851 18.760 0.51 29.44  ? 47  ARG B NH2 1 
ATOM   246  N  N   . ARG A 1 31  ? -14.142 -14.227 17.783 1.00 20.48  ? 48  ARG B N   1 
ATOM   247  C  CA  . ARG A 1 31  ? -12.845 -13.566 17.734 1.00 24.57  ? 48  ARG B CA  1 
ATOM   248  C  C   . ARG A 1 31  ? -12.789 -12.420 18.727 1.00 23.79  ? 48  ARG B C   1 
ATOM   249  O  O   . ARG A 1 31  ? -11.728 -12.148 19.293 1.00 23.50  ? 48  ARG B O   1 
ATOM   250  C  CB  . ARG A 1 31  ? -12.552 -13.061 16.320 1.00 21.17  ? 48  ARG B CB  1 
ATOM   251  C  CG  . ARG A 1 31  ? -11.276 -12.256 16.195 1.00 24.72  ? 48  ARG B CG  1 
ATOM   252  C  CD  . ARG A 1 31  ? -11.048 -11.800 14.748 1.00 28.18  ? 48  ARG B CD  1 
ATOM   253  N  NE  . ARG A 1 31  ? -10.792 -12.930 13.862 1.00 30.76  ? 48  ARG B NE  1 
ATOM   254  C  CZ  . ARG A 1 31  ? -10.323 -12.822 12.625 1.00 31.29  ? 48  ARG B CZ  1 
ATOM   255  N  NH1 . ARG A 1 31  ? -10.066 -11.646 12.086 1.00 29.51  ? 48  ARG B NH1 1 
ATOM   256  N  NH2 . ARG A 1 31  ? -10.131 -13.924 11.904 1.00 32.10  ? 48  ARG B NH2 1 
ATOM   257  N  N   . PHE A 1 32  ? -13.933 -11.781 18.997 1.00 20.81  ? 49  PHE B N   1 
ATOM   258  C  CA  . PHE A 1 32  ? -13.972 -10.520 19.732 1.00 18.81  ? 49  PHE B CA  1 
ATOM   259  C  C   . PHE A 1 32  ? -14.555 -10.634 21.141 1.00 21.67  ? 49  PHE B C   1 
ATOM   260  O  O   . PHE A 1 32  ? -14.501 -9.655  21.899 1.00 23.78  ? 49  PHE B O   1 
ATOM   261  C  CB  . PHE A 1 32  ? -14.759 -9.480  18.915 1.00 20.40  ? 49  PHE B CB  1 
ATOM   262  C  CG  . PHE A 1 32  ? -14.154 -9.235  17.557 1.00 22.83  ? 49  PHE B CG  1 
ATOM   263  C  CD1 . PHE A 1 32  ? -12.917 -8.622  17.438 1.00 23.25  ? 49  PHE B CD1 1 
ATOM   264  C  CD2 . PHE A 1 32  ? -14.802 -9.652  16.405 1.00 21.69  ? 49  PHE B CD2 1 
ATOM   265  C  CE1 . PHE A 1 32  ? -12.336 -8.419  16.184 1.00 26.51  ? 49  PHE B CE1 1 
ATOM   266  C  CE2 . PHE A 1 32  ? -14.229 -9.455  15.150 1.00 20.80  ? 49  PHE B CE2 1 
ATOM   267  C  CZ  . PHE A 1 32  ? -12.998 -8.830  15.045 1.00 24.87  ? 49  PHE B CZ  1 
ATOM   268  N  N   . GLY A 1 33  ? -15.091 -11.788 21.518 1.00 21.17  ? 50  GLY B N   1 
ATOM   269  C  CA  . GLY A 1 33  ? -15.568 -11.977 22.876 1.00 18.66  ? 50  GLY B CA  1 
ATOM   270  C  C   . GLY A 1 33  ? -16.184 -13.350 23.022 1.00 19.84  ? 50  GLY B C   1 
ATOM   271  O  O   . GLY A 1 33  ? -16.198 -14.153 22.084 1.00 20.41  ? 50  GLY B O   1 
ATOM   272  N  N   . THR A 1 34  ? -16.692 -13.617 24.222 1.00 17.86  ? 51  THR B N   1 
ATOM   273  C  CA  . THR A 1 34  ? -17.463 -14.823 24.430 1.00 17.80  ? 51  THR B CA  1 
ATOM   274  C  C   . THR A 1 34  ? -18.851 -14.594 23.849 1.00 22.38  ? 51  THR B C   1 
ATOM   275  O  O   . THR A 1 34  ? -19.365 -13.478 23.867 1.00 22.89  ? 51  THR B O   1 
ATOM   276  C  CB  . THR A 1 34  ? -17.562 -15.171 25.914 1.00 20.75  ? 51  THR B CB  1 
ATOM   277  O  OG1 . THR A 1 34  ? -18.112 -14.069 26.627 1.00 26.39  ? 51  THR B OG1 1 
ATOM   278  C  CG2 . THR A 1 34  ? -16.162 -15.424 26.485 1.00 24.47  ? 51  THR B CG2 1 
ATOM   279  N  N   . VAL A 1 35  ? -19.463 -15.648 23.317 1.00 21.26  ? 52  VAL B N   1 
ATOM   280  C  CA  . VAL A 1 35  ? -20.716 -15.490 22.586 1.00 18.73  ? 52  VAL B CA  1 
ATOM   281  C  C   . VAL A 1 35  ? -21.766 -16.381 23.220 1.00 23.40  ? 52  VAL B C   1 
ATOM   282  O  O   . VAL A 1 35  ? -21.520 -17.570 23.452 1.00 23.41  ? 52  VAL B O   1 
ATOM   283  C  CB  . VAL A 1 35  ? -20.558 -15.805 21.088 1.00 21.42  ? 52  VAL B CB  1 
ATOM   284  C  CG1 . VAL A 1 35  ? -21.872 -15.523 20.329 1.00 21.89  ? 52  VAL B CG1 1 
ATOM   285  C  CG2 . VAL A 1 35  ? -19.431 -14.996 20.489 1.00 21.85  ? 52  VAL B CG2 1 
ATOM   286  N  N   . LEU A 1 36  ? -22.929 -15.803 23.516 1.00 19.67  ? 53  LEU B N   1 
ATOM   287  C  CA  . LEU A 1 36  ? -24.069 -16.564 24.004 1.00 18.82  ? 53  LEU B CA  1 
ATOM   288  C  C   . LEU A 1 36  ? -25.278 -16.218 23.148 1.00 23.19  ? 53  LEU B C   1 
ATOM   289  O  O   . LEU A 1 36  ? -25.372 -15.114 22.595 1.00 18.66  ? 53  LEU B O   1 
ATOM   290  C  CB  . LEU A 1 36  ? -24.333 -16.260 25.487 1.00 21.73  ? 53  LEU B CB  1 
ATOM   291  C  CG  . LEU A 1 36  ? -23.218 -16.770 26.427 1.00 23.03  ? 53  LEU B CG  1 
ATOM   292  C  CD1 . LEU A 1 36  ? -23.478 -16.288 27.866 1.00 22.08  ? 53  LEU B CD1 1 
ATOM   293  C  CD2 . LEU A 1 36  ? -23.106 -18.305 26.384 1.00 23.81  ? 53  LEU B CD2 1 
ATOM   294  N  N   . THR A 1 37  ? -26.177 -17.193 23.000 1.00 20.44  ? 54  THR B N   1 
ATOM   295  C  CA  . THR A 1 37  ? -27.351 -17.061 22.149 1.00 17.63  ? 54  THR B CA  1 
ATOM   296  C  C   . THR A 1 37  ? -28.498 -17.877 22.739 1.00 20.82  ? 54  THR B C   1 
ATOM   297  O  O   . THR A 1 37  ? -28.302 -18.741 23.597 1.00 15.51  ? 54  THR B O   1 
ATOM   298  C  CB  . THR A 1 37  ? -27.107 -17.579 20.718 1.00 21.87  ? 54  THR B CB  1 
ATOM   299  O  OG1 . THR A 1 37  ? -27.079 -19.023 20.749 1.00 25.31  ? 54  THR B OG1 1 
ATOM   300  C  CG2 . THR A 1 37  ? -25.790 -17.041 20.113 1.00 22.58  ? 54  THR B CG2 1 
ATOM   301  N  N   . GLU A 1 38  ? -29.708 -17.609 22.240 1.00 17.43  ? 55  GLU B N   1 
ATOM   302  C  CA  . GLU A 1 38  ? -30.845 -18.462 22.583 1.00 22.09  ? 55  GLU B CA  1 
ATOM   303  C  C   . GLU A 1 38  ? -30.608 -19.921 22.184 1.00 21.92  ? 55  GLU B C   1 
ATOM   304  O  O   . GLU A 1 38  ? -31.139 -20.827 22.835 1.00 25.63  ? 55  GLU B O   1 
ATOM   305  C  CB  . GLU A 1 38  ? -32.114 -17.904 21.933 1.00 23.76  ? 55  GLU B CB  1 
ATOM   306  C  CG  . GLU A 1 38  ? -33.437 -18.605 22.312 1.00 19.98  ? 55  GLU B CG  1 
ATOM   307  C  CD  . GLU A 1 38  ? -33.719 -19.828 21.463 1.00 31.53  ? 55  GLU B CD  1 
ATOM   308  O  OE1 . GLU A 1 38  ? -33.050 -19.984 20.422 1.00 34.36  ? 55  GLU B OE1 1 
ATOM   309  O  OE2 . GLU A 1 38  ? -34.633 -20.611 21.813 1.00 34.33  ? 55  GLU B OE2 1 
ATOM   310  N  N   . HIS A 1 39  ? -29.829 -20.169 21.125 1.00 20.51  ? 56  HIS B N   1 
ATOM   311  C  CA  . HIS A 1 39  ? -29.516 -21.545 20.731 1.00 24.06  ? 56  HIS B CA  1 
ATOM   312  C  C   . HIS A 1 39  ? -28.716 -22.256 21.817 1.00 25.62  ? 56  HIS B C   1 
ATOM   313  O  O   . HIS A 1 39  ? -28.933 -23.446 22.091 1.00 25.40  ? 56  HIS B O   1 
ATOM   314  C  CB  . HIS A 1 39  ? -28.725 -21.571 19.419 1.00 24.86  ? 56  HIS B CB  1 
ATOM   315  C  CG  . HIS A 1 39  ? -29.513 -21.141 18.218 1.00 28.31  ? 56  HIS B CG  1 
ATOM   316  N  ND1 . HIS A 1 39  ? -29.045 -21.298 16.930 1.00 29.56  ? 56  HIS B ND1 1 
ATOM   317  C  CD2 . HIS A 1 39  ? -30.711 -20.515 18.110 1.00 26.92  ? 56  HIS B CD2 1 
ATOM   318  C  CE1 . HIS A 1 39  ? -29.933 -20.813 16.080 1.00 32.13  ? 56  HIS B CE1 1 
ATOM   319  N  NE2 . HIS A 1 39  ? -30.950 -20.326 16.770 1.00 32.32  ? 56  HIS B NE2 1 
ATOM   320  N  N   . VAL A 1 40  ? -27.776 -21.544 22.440 1.00 17.20  ? 57  VAL B N   1 
ATOM   321  C  CA  . VAL A 1 40  ? -26.999 -22.129 23.527 1.00 21.86  ? 57  VAL B CA  1 
ATOM   322  C  C   . VAL A 1 40  ? -27.906 -22.476 24.695 1.00 23.40  ? 57  VAL B C   1 
ATOM   323  O  O   . VAL A 1 40  ? -27.756 -23.526 25.328 1.00 22.31  ? 57  VAL B O   1 
ATOM   324  C  CB  . VAL A 1 40  ? -25.863 -21.181 23.957 1.00 25.29  ? 57  VAL B CB  1 
ATOM   325  C  CG1 . VAL A 1 40  ? -25.104 -21.775 25.145 1.00 29.20  ? 57  VAL B CG1 1 
ATOM   326  C  CG2 . VAL A 1 40  ? -24.910 -20.920 22.793 1.00 26.92  ? 57  VAL B CG2 1 
ATOM   327  N  N   . ALA A 1 41  ? -28.874 -21.610 24.997 1.00 21.80  ? 58  ALA B N   1 
ATOM   328  C  CA  . ALA A 1 41  ? -29.778 -21.911 26.102 1.00 21.73  ? 58  ALA B CA  1 
ATOM   329  C  C   . ALA A 1 41  ? -30.605 -23.154 25.791 1.00 25.07  ? 58  ALA B C   1 
ATOM   330  O  O   . ALA A 1 41  ? -30.710 -24.062 26.619 1.00 25.07  ? 58  ALA B O   1 
ATOM   331  C  CB  . ALA A 1 41  ? -30.679 -20.712 26.399 1.00 21.84  ? 58  ALA B CB  1 
ATOM   332  N  N   . ALA A 1 42  ? -31.160 -23.229 24.578 1.00 22.26  ? 59  ALA B N   1 
ATOM   333  C  CA  . ALA A 1 42  ? -31.977 -24.377 24.192 1.00 25.62  ? 59  ALA B CA  1 
ATOM   334  C  C   . ALA A 1 42  ? -31.142 -25.648 24.135 1.00 28.86  ? 59  ALA B C   1 
ATOM   335  O  O   . ALA A 1 42  ? -31.604 -26.719 24.539 1.00 28.35  ? 59  ALA B O   1 
ATOM   336  C  CB  . ALA A 1 42  ? -32.646 -24.113 22.841 1.00 22.41  ? 59  ALA B CB  1 
ATOM   337  N  N   . ALA A 1 43  ? -29.906 -25.547 23.639 1.00 23.52  ? 60  ALA B N   1 
ATOM   338  C  CA  . ALA A 1 43  ? -29.013 -26.699 23.621 1.00 28.71  ? 60  ALA B CA  1 
ATOM   339  C  C   . ALA A 1 43  ? -28.759 -27.220 25.033 1.00 30.76  ? 60  ALA B C   1 
ATOM   340  O  O   . ALA A 1 43  ? -28.889 -28.418 25.287 1.00 28.26  ? 60  ALA B O   1 
ATOM   341  C  CB  . ALA A 1 43  ? -27.701 -26.347 22.919 1.00 22.17  ? 60  ALA B CB  1 
ATOM   342  N  N   . GLU A 1 44  ? -28.449 -26.331 25.980 1.00 29.73  ? 61  GLU B N   1 
ATOM   343  C  CA  . GLU A 1 44  ? -28.166 -26.783 27.344 1.00 29.18  ? 61  GLU B CA  1 
ATOM   344  C  C   . GLU A 1 44  ? -29.388 -27.395 28.014 1.00 33.15  ? 61  GLU B C   1 
ATOM   345  O  O   . GLU A 1 44  ? -29.252 -28.331 28.807 1.00 29.55  ? 61  GLU B O   1 
ATOM   346  C  CB  . GLU A 1 44  ? -27.638 -25.638 28.199 1.00 37.31  ? 61  GLU B CB  1 
ATOM   347  C  CG  . GLU A 1 44  ? -26.460 -24.922 27.596 1.00 45.11  ? 61  GLU B CG  1 
ATOM   348  C  CD  . GLU A 1 44  ? -25.808 -23.974 28.572 1.00 60.82  ? 61  GLU B CD  1 
ATOM   349  O  OE1 . GLU A 1 44  ? -24.564 -23.829 28.508 1.00 58.39  ? 61  GLU B OE1 1 
ATOM   350  O  OE2 . GLU A 1 44  ? -26.545 -23.378 29.397 1.00 55.87  ? 61  GLU B OE2 1 
ATOM   351  N  N   . LEU A 1 45  ? -30.586 -26.865 27.743 1.00 22.19  ? 62  LEU B N   1 
ATOM   352  C  CA  . LEU A 1 45  ? -31.770 -27.374 28.428 1.00 24.55  ? 62  LEU B CA  1 
ATOM   353  C  C   . LEU A 1 45  ? -32.206 -28.734 27.903 1.00 26.61  ? 62  LEU B C   1 
ATOM   354  O  O   . LEU A 1 45  ? -32.879 -29.481 28.626 1.00 28.13  ? 62  LEU B O   1 
ATOM   355  C  CB  . LEU A 1 45  ? -32.919 -26.363 28.310 1.00 21.37  ? 62  LEU B CB  1 
ATOM   356  C  CG  . LEU A 1 45  ? -32.731 -25.178 29.254 1.00 31.93  ? 62  LEU B CG  1 
ATOM   357  C  CD1 . LEU A 1 45  ? -33.477 -23.933 28.776 1.00 22.40  ? 62  LEU B CD1 1 
ATOM   358  C  CD2 . LEU A 1 45  ? -33.193 -25.578 30.642 1.00 28.01  ? 62  LEU B CD2 1 
ATOM   359  N  N   . GLY A 1 46  ? -31.852 -29.062 26.665 1.00 25.18  ? 63  GLY B N   1 
ATOM   360  C  CA  . GLY A 1 46  ? -32.175 -30.351 26.085 1.00 27.11  ? 63  GLY B CA  1 
ATOM   361  C  C   . GLY A 1 46  ? -33.635 -30.737 26.195 1.00 28.41  ? 63  GLY B C   1 
ATOM   362  O  O   . GLY A 1 46  ? -34.527 -30.001 25.753 1.00 26.11  ? 63  GLY B O   1 
ATOM   363  N  N   . ALA A 1 47  ? -33.891 -31.891 26.815 1.00 27.56  ? 64  ALA B N   1 
ATOM   364  C  CA  . ALA A 1 47  ? -35.262 -32.369 26.953 1.00 27.86  ? 64  ALA B CA  1 
ATOM   365  C  C   . ALA A 1 47  ? -36.137 -31.387 27.730 1.00 30.35  ? 64  ALA B C   1 
ATOM   366  O  O   . ALA A 1 47  ? -37.348 -31.317 27.496 1.00 32.48  ? 64  ALA B O   1 
ATOM   367  C  CB  . ALA A 1 47  ? -35.267 -33.733 27.642 1.00 30.66  ? 64  ALA B CB  1 
ATOM   368  N  N   . ARG A 1 48  ? -35.553 -30.642 28.669 1.00 30.15  ? 65  ARG B N   1 
ATOM   369  C  CA  . ARG A 1 48  ? -36.334 -29.728 29.498 1.00 33.10  ? 65  ARG B CA  1 
ATOM   370  C  C   . ARG A 1 48  ? -36.766 -28.475 28.749 1.00 29.55  ? 65  ARG B C   1 
ATOM   371  O  O   . ARG A 1 48  ? -37.599 -27.726 29.268 1.00 35.49  ? 65  ARG B O   1 
ATOM   372  C  CB  . ARG A 1 48  ? -35.540 -29.317 30.745 1.00 36.67  ? 65  ARG B CB  1 
ATOM   373  C  CG  . ARG A 1 48  ? -35.453 -30.364 31.847 1.00 43.83  ? 65  ARG B CG  1 
ATOM   374  C  CD  . ARG A 1 48  ? -36.771 -31.129 32.021 1.00 57.94  ? 65  ARG B CD  1 
ATOM   375  N  NE  . ARG A 1 48  ? -36.593 -32.556 31.760 1.00 69.79  ? 65  ARG B NE  1 
ATOM   376  C  CZ  . ARG A 1 48  ? -37.553 -33.470 31.819 1.00 68.27  ? 65  ARG B CZ  1 
ATOM   377  N  NH1 . ARG A 1 48  ? -38.799 -33.147 32.123 1.00 78.55  ? 65  ARG B NH1 1 
ATOM   378  N  NH2 . ARG A 1 48  ? -37.253 -34.740 31.561 1.00 61.36  ? 65  ARG B NH2 1 
ATOM   379  N  N   . GLY A 1 49  ? -36.219 -28.219 27.567 1.00 29.77  ? 66  GLY B N   1 
ATOM   380  C  CA  . GLY A 1 49  ? -36.603 -27.057 26.793 1.00 30.70  ? 66  GLY B CA  1 
ATOM   381  C  C   . GLY A 1 49  ? -37.950 -27.262 26.127 1.00 34.90  ? 66  GLY B C   1 
ATOM   382  O  O   . GLY A 1 49  ? -38.279 -26.576 25.160 1.00 38.01  ? 66  GLY B O   1 
ATOM   383  N  N   . ALA A 1 52  ? -41.052 -29.588 25.999 1.00 50.39  ? 69  ALA B N   1 
ATOM   384  C  CA  . ALA A 1 52  ? -41.577 -29.893 27.328 1.00 47.46  ? 69  ALA B CA  1 
ATOM   385  C  C   . ALA A 1 52  ? -42.525 -28.815 27.839 1.00 52.96  ? 69  ALA B C   1 
ATOM   386  O  O   . ALA A 1 52  ? -42.460 -27.676 27.399 1.00 50.66  ? 69  ALA B O   1 
ATOM   387  C  CB  . ALA A 1 52  ? -40.431 -30.072 28.326 1.00 42.34  ? 69  ALA B CB  1 
ATOM   388  N  N   . ALA A 1 53  ? -43.410 -29.181 28.755 1.00 49.22  ? 70  ALA B N   1 
ATOM   389  C  CA  . ALA A 1 53  ? -44.237 -28.177 29.411 1.00 49.74  ? 70  ALA B CA  1 
ATOM   390  C  C   . ALA A 1 53  ? -43.376 -27.215 30.229 1.00 43.05  ? 70  ALA B C   1 
ATOM   391  O  O   . ALA A 1 53  ? -42.516 -27.648 31.001 1.00 43.47  ? 70  ALA B O   1 
ATOM   392  C  CB  . ALA A 1 53  ? -45.254 -28.876 30.314 1.00 56.24  ? 70  ALA B CB  1 
ATOM   393  N  N   . GLY A 1 54  ? -43.609 -25.909 30.061 1.00 37.64  ? 71  GLY B N   1 
ATOM   394  C  CA  . GLY A 1 54  ? -42.798 -24.914 30.705 1.00 35.40  ? 71  GLY B CA  1 
ATOM   395  C  C   . GLY A 1 54  ? -41.408 -24.756 30.133 1.00 28.07  ? 71  GLY B C   1 
ATOM   396  O  O   . GLY A 1 54  ? -40.626 -23.950 30.659 1.00 31.87  ? 71  GLY B O   1 
ATOM   397  N  N   . GLY A 1 55  ? -41.076 -25.479 29.061 1.00 28.54  ? 72  GLY B N   1 
ATOM   398  C  CA  . GLY A 1 55  ? -39.716 -25.439 28.551 1.00 24.20  ? 72  GLY B CA  1 
ATOM   399  C  C   . GLY A 1 55  ? -39.348 -24.083 27.978 1.00 27.33  ? 72  GLY B C   1 
ATOM   400  O  O   . GLY A 1 55  ? -38.225 -23.600 28.160 1.00 21.71  ? 72  GLY B O   1 
ATOM   401  N  N   . ASP A 1 56  ? -40.289 -23.453 27.280 1.00 21.09  ? 73  ASP B N   1 
ATOM   402  C  CA  . ASP A 1 56  ? -40.023 -22.152 26.690 1.00 26.27  ? 73  ASP B CA  1 
ATOM   403  C  C   . ASP A 1 56  ? -39.739 -21.122 27.771 1.00 19.12  ? 73  ASP B C   1 
ATOM   404  O  O   . ASP A 1 56  ? -38.914 -20.232 27.575 1.00 20.67  ? 73  ASP B O   1 
ATOM   405  C  CB  . ASP A 1 56  ? -41.210 -21.737 25.827 1.00 25.88  ? 73  ASP B CB  1 
ATOM   406  C  CG  . ASP A 1 56  ? -41.241 -22.461 24.501 1.00 24.69  ? 73  ASP B CG  1 
ATOM   407  O  OD1 . ASP A 1 56  ? -40.292 -23.238 24.210 1.00 32.36  ? 73  ASP B OD1 1 
ATOM   408  O  OD2 . ASP A 1 56  ? -42.192 -22.232 23.729 1.00 31.25  ? 73  ASP B OD2 1 
ATOM   409  N  N   . ARG A 1 57  ? -40.380 -21.257 28.931 1.00 20.89  ? 74  ARG B N   1 
ATOM   410  C  CA  . ARG A 1 57  ? -40.124 -20.344 30.036 1.00 25.67  ? 74  ARG B CA  1 
ATOM   411  C  C   . ARG A 1 57  ? -38.681 -20.447 30.522 1.00 24.81  ? 74  ARG B C   1 
ATOM   412  O  O   . ARG A 1 57  ? -38.059 -19.437 30.888 1.00 21.58  ? 74  ARG B O   1 
ATOM   413  C  CB  . ARG A 1 57  ? -41.109 -20.638 31.167 1.00 29.84  ? 74  ARG B CB  1 
ATOM   414  C  CG  . ARG A 1 57  ? -40.872 -19.817 32.397 1.00 30.84  ? 74  ARG B CG  1 
ATOM   415  C  CD  . ARG A 1 57  ? -41.062 -18.368 32.076 1.00 33.07  ? 74  ARG B CD  1 
ATOM   416  N  NE  . ARG A 1 57  ? -41.032 -17.516 33.258 1.00 38.81  ? 74  ARG B NE  1 
ATOM   417  C  CZ  . ARG A 1 57  ? -41.062 -16.191 33.202 1.00 37.83  ? 74  ARG B CZ  1 
ATOM   418  N  NH1 . ARG A 1 57  ? -41.133 -15.556 32.044 1.00 30.63  ? 74  ARG B NH1 1 
ATOM   419  N  NH2 . ARG A 1 57  ? -41.029 -15.490 34.332 1.00 36.68  ? 74  ARG B NH2 1 
ATOM   420  N  N   . LEU A 1 58  ? -38.125 -21.661 30.538 1.00 20.69  ? 75  LEU B N   1 
ATOM   421  C  CA  . LEU A 1 58  ? -36.747 -21.807 30.996 1.00 21.55  ? 75  LEU B CA  1 
ATOM   422  C  C   . LEU A 1 58  ? -35.777 -21.256 29.959 1.00 17.86  ? 75  LEU B C   1 
ATOM   423  O  O   . LEU A 1 58  ? -34.766 -20.628 30.307 1.00 15.65  ? 75  LEU B O   1 
ATOM   424  C  CB  . LEU A 1 58  ? -36.440 -23.282 31.295 1.00 23.56  ? 75  LEU B CB  1 
ATOM   425  C  CG  . LEU A 1 58  ? -37.336 -23.978 32.330 1.00 23.28  ? 75  LEU B CG  1 
ATOM   426  C  CD1 . LEU A 1 58  ? -36.953 -25.466 32.511 1.00 25.71  ? 75  LEU B CD1 1 
ATOM   427  C  CD2 . LEU A 1 58  ? -37.334 -23.255 33.668 1.00 22.00  ? 75  LEU B CD2 1 
ATOM   428  N  N   . ILE A 1 59  ? -36.076 -21.470 28.680 1.00 18.39  ? 76  ILE B N   1 
ATOM   429  C  CA  . ILE A 1 59  ? -35.256 -20.882 27.626 1.00 20.54  ? 76  ILE B CA  1 
ATOM   430  C  C   . ILE A 1 59  ? -35.240 -19.368 27.761 1.00 20.71  ? 76  ILE B C   1 
ATOM   431  O  O   . ILE A 1 59  ? -34.174 -18.738 27.737 1.00 20.13  ? 76  ILE B O   1 
ATOM   432  C  CB  . ILE A 1 59  ? -35.768 -21.307 26.242 1.00 19.65  ? 76  ILE B CB  1 
ATOM   433  C  CG1 . ILE A 1 59  ? -35.485 -22.792 26.005 1.00 22.17  ? 76  ILE B CG1 1 
ATOM   434  C  CG2 . ILE A 1 59  ? -35.133 -20.446 25.153 1.00 21.34  ? 76  ILE B CG2 1 
ATOM   435  C  CD1 . ILE A 1 59  ? -36.162 -23.327 24.789 1.00 27.29  ? 76  ILE B CD1 1 
ATOM   436  N  N   . HIS A 1 60  ? -36.428 -18.769 27.914 1.00 19.23  ? 77  HIS B N   1 
ATOM   437  C  CA  . HIS A 1 60  ? -36.550 -17.315 28.015 1.00 16.37  ? 77  HIS B CA  1 
ATOM   438  C  C   . HIS A 1 60  ? -35.760 -16.776 29.201 1.00 18.89  ? 77  HIS B C   1 
ATOM   439  O  O   . HIS A 1 60  ? -34.994 -15.815 29.061 1.00 20.25  ? 77  HIS B O   1 
ATOM   440  C  CB  . HIS A 1 60  ? -38.030 -16.911 28.123 1.00 16.98  ? 77  HIS B CB  1 
ATOM   441  C  CG  . HIS A 1 60  ? -38.246 -15.445 28.394 1.00 21.66  ? 77  HIS B CG  1 
ATOM   442  N  ND1 . HIS A 1 60  ? -38.193 -14.904 29.661 1.00 22.59  ? 77  HIS B ND1 1 
ATOM   443  C  CD2 . HIS A 1 60  ? -38.518 -14.414 27.558 1.00 21.66  ? 77  HIS B CD2 1 
ATOM   444  C  CE1 . HIS A 1 60  ? -38.412 -13.598 29.592 1.00 26.62  ? 77  HIS B CE1 1 
ATOM   445  N  NE2 . HIS A 1 60  ? -38.602 -13.274 28.325 1.00 21.09  ? 77  HIS B NE2 1 
ATOM   446  N  N   . GLU A 1 61  ? -35.932 -17.381 30.378 1.00 16.29  ? 78  GLU B N   1 
ATOM   447  C  CA  . GLU A 1 61  ? -35.270 -16.865 31.575 1.00 19.18  ? 78  GLU B CA  1 
ATOM   448  C  C   . GLU A 1 61  ? -33.754 -16.933 31.430 1.00 21.62  ? 78  GLU B C   1 
ATOM   449  O  O   . GLU A 1 61  ? -33.046 -15.980 31.785 1.00 20.30  ? 78  GLU B O   1 
ATOM   450  C  CB  . GLU A 1 61  ? -35.732 -17.636 32.808 1.00 22.09  ? 78  GLU B CB  1 
ATOM   451  C  CG  . GLU A 1 61  ? -37.223 -17.442 33.086 1.00 32.51  ? 78  GLU B CG  1 
ATOM   452  C  CD  . GLU A 1 61  ? -37.573 -16.012 33.430 1.00 39.36  ? 78  GLU B CD  1 
ATOM   453  O  OE1 . GLU A 1 61  ? -38.174 -15.324 32.575 1.00 37.46  ? 78  GLU B OE1 1 
ATOM   454  O  OE2 . GLU A 1 61  ? -37.273 -15.587 34.567 1.00 42.52  ? 78  GLU B OE2 1 
ATOM   455  N  N   . GLN A 1 62  ? -33.240 -18.026 30.859 1.00 17.84  ? 79  GLN B N   1 
ATOM   456  C  CA  . GLN A 1 62  ? -31.795 -18.168 30.699 1.00 18.40  ? 79  GLN B CA  1 
ATOM   457  C  C   . GLN A 1 62  ? -31.253 -17.196 29.659 1.00 19.32  ? 79  GLN B C   1 
ATOM   458  O  O   . GLN A 1 62  ? -30.204 -16.579 29.863 1.00 18.73  ? 79  GLN B O   1 
ATOM   459  C  CB  . GLN A 1 62  ? -31.442 -19.599 30.297 1.00 20.24  ? 79  GLN B CB  1 
ATOM   460  C  CG  . GLN A 1 62  ? -29.951 -19.790 30.135 1.00 22.46  ? 79  GLN B CG  1 
ATOM   461  C  CD  . GLN A 1 62  ? -29.203 -19.468 31.429 1.00 30.24  ? 79  GLN B CD  1 
ATOM   462  O  OE1 . GLN A 1 62  ? -28.679 -18.369 31.613 1.00 28.54  ? 79  GLN B OE1 1 
ATOM   463  N  NE2 . GLN A 1 62  ? -29.205 -20.413 32.348 1.00 33.91  ? 79  GLN B NE2 1 
ATOM   464  N  N   . ALA A 1 63  ? -31.947 -17.066 28.529 1.00 19.29  ? 80  ALA B N   1 
ATOM   465  C  CA  . ALA A 1 63  ? -31.517 -16.129 27.500 1.00 20.60  ? 80  ALA B CA  1 
ATOM   466  C  C   . ALA A 1 63  ? -31.536 -14.689 28.011 1.00 22.86  ? 80  ALA B C   1 
ATOM   467  O  O   . ALA A 1 63  ? -30.597 -13.923 27.760 1.00 19.88  ? 80  ALA B O   1 
ATOM   468  C  CB  . ALA A 1 63  ? -32.402 -16.292 26.264 1.00 16.57  ? 80  ALA B CB  1 
ATOM   469  N  N   . LEU A 1 64  ? -32.592 -14.300 28.735 1.00 19.91  ? 81  LEU B N   1 
ATOM   470  C  CA  . LEU A 1 64  ? -32.670 -12.922 29.228 1.00 22.74  ? 81  LEU B CA  1 
ATOM   471  C  C   . LEU A 1 64  ? -31.582 -12.635 30.243 1.00 25.42  ? 81  LEU B C   1 
ATOM   472  O  O   . LEU A 1 64  ? -31.143 -11.487 30.395 1.00 23.05  ? 81  LEU B O   1 
ATOM   473  C  CB  . LEU A 1 64  ? -34.041 -12.651 29.861 1.00 19.51  ? 81  LEU B CB  1 
ATOM   474  C  CG  . LEU A 1 64  ? -34.986 -11.793 29.030 1.00 26.94  ? 81  LEU B CG  1 
ATOM   475  C  CD1 . LEU A 1 64  ? -34.434 -10.378 28.851 1.00 24.79  ? 81  LEU B CD1 1 
ATOM   476  C  CD2 . LEU A 1 64  ? -35.164 -12.460 27.702 1.00 22.51  ? 81  LEU B CD2 1 
ATOM   477  N  N   . GLU A 1 65  ? -31.137 -13.669 30.941 1.00 23.24  ? 82  GLU B N   1 
ATOM   478  C  CA  . GLU A 1 65  ? -30.110 -13.489 31.949 1.00 27.85  ? 82  GLU B CA  1 
ATOM   479  C  C   . GLU A 1 65  ? -28.786 -13.158 31.251 1.00 25.37  ? 82  GLU B C   1 
ATOM   480  O  O   . GLU A 1 65  ? -28.044 -12.257 31.662 1.00 20.59  ? 82  GLU B O   1 
ATOM   481  C  CB  . GLU A 1 65  ? -30.028 -14.790 32.751 1.00 30.42  ? 82  GLU B CB  1 
ATOM   482  C  CG  . GLU A 1 65  ? -30.953 -14.825 33.989 1.00 38.92  ? 82  GLU B CG  1 
ATOM   483  C  CD  . GLU A 1 65  ? -30.645 -13.840 35.074 1.00 54.24  ? 82  GLU B CD  1 
ATOM   484  O  OE1 . GLU A 1 65  ? -29.496 -13.426 35.170 1.00 52.64  ? 82  GLU B OE1 1 
ATOM   485  O  OE2 . GLU A 1 65  ? -31.572 -13.438 35.805 1.00 60.27  ? 82  GLU B OE2 1 
ATOM   486  N  N   . TRP A 1 66  ? -28.508 -13.857 30.150 1.00 20.78  ? 83  TRP B N   1 
ATOM   487  C  CA  . TRP A 1 66  ? -27.304 -13.615 29.358 1.00 20.00  ? 83  TRP B CA  1 
ATOM   488  C  C   . TRP A 1 66  ? -27.377 -12.286 28.617 1.00 19.75  ? 83  TRP B C   1 
ATOM   489  O  O   . TRP A 1 66  ? -26.372 -11.556 28.502 1.00 18.65  ? 83  TRP B O   1 
ATOM   490  C  CB  . TRP A 1 66  ? -27.133 -14.763 28.362 1.00 18.22  ? 83  TRP B CB  1 
ATOM   491  C  CG  . TRP A 1 66  ? -26.724 -16.056 28.993 1.00 23.95  ? 83  TRP B CG  1 
ATOM   492  C  CD1 . TRP A 1 66  ? -26.109 -16.227 30.202 1.00 23.66  ? 83  TRP B CD1 1 
ATOM   493  C  CD2 . TRP A 1 66  ? -26.913 -17.372 28.447 1.00 16.78  ? 83  TRP B CD2 1 
ATOM   494  N  NE1 . TRP A 1 66  ? -25.886 -17.568 30.431 1.00 22.53  ? 83  TRP B NE1 1 
ATOM   495  C  CE2 . TRP A 1 66  ? -26.366 -18.289 29.368 1.00 23.80  ? 83  TRP B CE2 1 
ATOM   496  C  CE3 . TRP A 1 66  ? -27.466 -17.857 27.256 1.00 20.12  ? 83  TRP B CE3 1 
ATOM   497  C  CZ2 . TRP A 1 66  ? -26.374 -19.670 29.144 1.00 21.15  ? 83  TRP B CZ2 1 
ATOM   498  C  CZ3 . TRP A 1 66  ? -27.471 -19.230 27.035 1.00 22.29  ? 83  TRP B CZ3 1 
ATOM   499  C  CH2 . TRP A 1 66  ? -26.928 -20.115 27.974 1.00 23.97  ? 83  TRP B CH2 1 
ATOM   500  N  N   . LEU A 1 67  ? -28.558 -11.969 28.086 1.00 17.63  ? 84  LEU B N   1 
ATOM   501  C  CA  . LEU A 1 67  ? -28.758 -10.697 27.411 1.00 20.52  ? 84  LEU B CA  1 
ATOM   502  C  C   . LEU A 1 67  ? -28.456 -9.532  28.348 1.00 20.37  ? 84  LEU B C   1 
ATOM   503  O  O   . LEU A 1 67  ? -27.763 -8.581  27.975 1.00 18.35  ? 84  LEU B O   1 
ATOM   504  C  CB  . LEU A 1 67  ? -30.193 -10.646 26.880 1.00 18.90  ? 84  LEU B CB  1 
ATOM   505  C  CG  . LEU A 1 67  ? -30.644 -9.545  25.925 1.00 24.66  ? 84  LEU B CG  1 
ATOM   506  C  CD1 . LEU A 1 67  ? -29.689 -9.426  24.799 1.00 25.38  ? 84  LEU B CD1 1 
ATOM   507  C  CD2 . LEU A 1 67  ? -31.982 -9.987  25.375 1.00 27.69  ? 84  LEU B CD2 1 
ATOM   508  N  N   . GLN A 1 68  ? -28.939 -9.611  29.587 1.00 20.61  ? 85  GLN B N   1 
ATOM   509  C  CA  . GLN A 1 68  ? -28.720 -8.524  30.532 1.00 22.24  ? 85  GLN B CA  1 
ATOM   510  C  C   . GLN A 1 68  ? -27.249 -8.330  30.868 1.00 18.76  ? 85  GLN B C   1 
ATOM   511  O  O   . GLN A 1 68  ? -26.849 -7.220  31.237 1.00 19.77  ? 85  GLN B O   1 
ATOM   512  C  CB  . GLN A 1 68  ? -29.522 -8.771  31.813 1.00 24.87  ? 85  GLN B CB  1 
ATOM   513  C  CG  . GLN A 1 68  ? -29.446 -7.614  32.819 1.00 29.58  ? 85  GLN B CG  1 
ATOM   514  C  CD  . GLN A 1 68  ? -30.262 -7.870  34.082 1.00 37.71  ? 85  GLN B CD  1 
ATOM   515  O  OE1 . GLN A 1 68  ? -31.304 -8.525  34.045 1.00 33.79  ? 85  GLN B OE1 1 
ATOM   516  N  NE2 . GLN A 1 68  ? -29.745 -7.413  35.218 1.00 42.57  ? 85  GLN B NE2 1 
ATOM   517  N  N   . GLN A 1 69  ? -26.439 -9.388  30.791 1.00 21.17  ? 86  GLN B N   1 
ATOM   518  C  CA  . GLN A 1 69  ? -25.021 -9.302  31.108 1.00 26.81  ? 86  GLN B CA  1 
ATOM   519  C  C   . GLN A 1 69  ? -24.160 -8.894  29.921 1.00 23.64  ? 86  GLN B C   1 
ATOM   520  O  O   . GLN A 1 69  ? -22.961 -8.677  30.098 1.00 22.80  ? 86  GLN B O   1 
ATOM   521  C  CB  . GLN A 1 69  ? -24.504 -10.647 31.630 1.00 26.07  ? 86  GLN B CB  1 
ATOM   522  C  CG  . GLN A 1 69  ? -24.998 -10.975 33.013 1.00 33.38  ? 86  GLN B CG  1 
ATOM   523  C  CD  . GLN A 1 69  ? -24.597 -12.370 33.465 1.00 40.85  ? 86  GLN B CD  1 
ATOM   524  O  OE1 . GLN A 1 69  ? -24.444 -13.290 32.652 1.00 43.21  ? 86  GLN B OE1 1 
ATOM   525  N  NE2 . GLN A 1 69  ? -24.462 -12.543 34.778 1.00 46.72  ? 86  GLN B NE2 1 
ATOM   526  N  N   . ALA A 1 70  ? -24.722 -8.808  28.723 1.00 19.34  ? 87  ALA B N   1 
ATOM   527  C  CA  . ALA A 1 70  ? -23.890 -8.621  27.546 1.00 21.50  ? 87  ALA B CA  1 
ATOM   528  C  C   . ALA A 1 70  ? -23.293 -7.224  27.529 1.00 22.27  ? 87  ALA B C   1 
ATOM   529  O  O   . ALA A 1 70  ? -23.879 -6.263  28.038 1.00 19.68  ? 87  ALA B O   1 
ATOM   530  C  CB  . ALA A 1 70  ? -24.697 -8.841  26.262 1.00 21.35  ? 87  ALA B CB  1 
ATOM   531  N  N   . ASP A 1 71  ? -22.121 -7.119  26.910 1.00 21.22  ? 88  ASP B N   1 
ATOM   532  C  CA  . ASP A 1 71  ? -21.527 -5.825  26.611 1.00 21.65  ? 88  ASP B CA  1 
ATOM   533  C  C   . ASP A 1 71  ? -21.968 -5.288  25.256 1.00 22.59  ? 88  ASP B C   1 
ATOM   534  O  O   . ASP A 1 71  ? -22.095 -4.064  25.090 1.00 20.31  ? 88  ASP B O   1 
ATOM   535  C  CB  . ASP A 1 71  ? -20.005 -5.926  26.660 1.00 21.86  ? 88  ASP B CB  1 
ATOM   536  C  CG  . ASP A 1 71  ? -19.511 -6.328  28.028 1.00 26.73  ? 88  ASP B CG  1 
ATOM   537  O  OD1 . ASP A 1 71  ? -19.776 -5.577  28.982 1.00 29.22  ? 88  ASP B OD1 1 
ATOM   538  O  OD2 . ASP A 1 71  ? -18.881 -7.406  28.153 1.00 28.08  ? 88  ASP B OD2 1 
ATOM   539  N  N   . VAL A 1 72  ? -22.202 -6.169  24.285 1.00 14.52  ? 89  VAL B N   1 
ATOM   540  C  CA  . VAL A 1 72  ? -22.721 -5.792  22.970 1.00 16.76  ? 89  VAL B CA  1 
ATOM   541  C  C   . VAL A 1 72  ? -23.737 -6.841  22.537 1.00 16.31  ? 89  VAL B C   1 
ATOM   542  O  O   . VAL A 1 72  ? -23.507 -8.047  22.692 1.00 16.06  ? 89  VAL B O   1 
ATOM   543  C  CB  . VAL A 1 72  ? -21.600 -5.665  21.909 1.00 19.41  ? 89  VAL B CB  1 
ATOM   544  C  CG1 . VAL A 1 72  ? -22.191 -5.249  20.549 1.00 17.95  ? 89  VAL B CG1 1 
ATOM   545  C  CG2 . VAL A 1 72  ? -20.532 -4.642  22.351 1.00 24.23  ? 89  VAL B CG2 1 
ATOM   546  N  N   . VAL A 1 73  ? -24.847 -6.386  21.969 1.00 15.42  ? 90  VAL B N   1 
ATOM   547  C  CA  . VAL A 1 73  ? -25.880 -7.271  21.432 1.00 16.48  ? 90  VAL B CA  1 
ATOM   548  C  C   . VAL A 1 73  ? -25.858 -7.116  19.919 1.00 16.26  ? 90  VAL B C   1 
ATOM   549  O  O   . VAL A 1 73  ? -25.940 -5.995  19.405 1.00 18.25  ? 90  VAL B O   1 
ATOM   550  C  CB  . VAL A 1 73  ? -27.272 -6.928  21.996 1.00 16.86  ? 90  VAL B CB  1 
ATOM   551  C  CG1 . VAL A 1 73  ? -28.374 -7.729  21.281 1.00 18.95  ? 90  VAL B CG1 1 
ATOM   552  C  CG2 . VAL A 1 73  ? -27.319 -7.106  23.514 1.00 20.01  ? 90  VAL B CG2 1 
ATOM   553  N  N   . VAL A 1 74  ? -25.715 -8.230  19.210 1.00 14.60  ? 91  VAL B N   1 
ATOM   554  C  CA  . VAL A 1 74  ? -25.681 -8.266  17.755 1.00 14.93  ? 91  VAL B CA  1 
ATOM   555  C  C   . VAL A 1 74  ? -26.911 -9.024  17.287 1.00 14.95  ? 91  VAL B C   1 
ATOM   556  O  O   . VAL A 1 74  ? -27.238 -10.067 17.851 1.00 15.70  ? 91  VAL B O   1 
ATOM   557  C  CB  . VAL A 1 74  ? -24.395 -8.956  17.253 1.00 17.84  ? 91  VAL B CB  1 
ATOM   558  C  CG1 . VAL A 1 74  ? -24.360 -9.025  15.731 1.00 14.48  ? 91  VAL B CG1 1 
ATOM   559  C  CG2 . VAL A 1 74  ? -23.181 -8.237  17.809 1.00 15.99  ? 91  VAL B CG2 1 
ATOM   560  N  N   . ALA A 1 75  ? -27.604 -8.499  16.276 1.00 19.15  ? 92  ALA B N   1 
ATOM   561  C  CA  . ALA A 1 75  ? -28.796 -9.167  15.767 1.00 20.13  ? 92  ALA B CA  1 
ATOM   562  C  C   . ALA A 1 75  ? -28.800 -9.156  14.242 1.00 20.11  ? 92  ALA B C   1 
ATOM   563  O  O   . ALA A 1 75  ? -28.518 -8.135  13.607 1.00 18.58  ? 92  ALA B O   1 
ATOM   564  C  CB  . ALA A 1 75  ? -30.096 -8.511  16.308 1.00 15.03  ? 92  ALA B CB  1 
ATOM   565  N  N   . GLU A 1 76  ? -29.125 -10.297 13.664 1.00 17.68  ? 93  GLU B N   1 
ATOM   566  C  CA  . GLU A 1 76  ? -29.333 -10.432 12.230 1.00 19.22  ? 93  GLU B CA  1 
ATOM   567  C  C   . GLU A 1 76  ? -30.832 -10.248 12.002 1.00 20.27  ? 93  GLU B C   1 
ATOM   568  O  O   . GLU A 1 76  ? -31.633 -11.081 12.435 1.00 20.38  ? 93  GLU B O   1 
ATOM   569  C  CB  . GLU A 1 76  ? -28.816 -11.789 11.738 1.00 19.21  ? 93  GLU B CB  1 
ATOM   570  C  CG  . GLU A 1 76  ? -28.213 -11.778 10.319 1.00 22.41  ? 93  GLU B CG  1 
ATOM   571  C  CD  . GLU A 1 76  ? -29.248 -11.425 9.249  1.00 27.80  ? 93  GLU B CD  1 
ATOM   572  O  OE1 . GLU A 1 76  ? -30.460 -11.476 9.544  1.00 23.85  ? 93  GLU B OE1 1 
ATOM   573  O  OE2 . GLU A 1 76  ? -28.857 -11.062 8.121  1.00 25.39  ? 93  GLU B OE2 1 
ATOM   574  N  N   . VAL A 1 77  ? -31.214 -9.143  11.353 1.00 22.02  ? 94  VAL B N   1 
ATOM   575  C  CA  . VAL A 1 77  ? -32.614 -8.707  11.294 1.00 21.07  ? 94  VAL B CA  1 
ATOM   576  C  C   . VAL A 1 77  ? -33.197 -8.852  9.886  1.00 23.59  ? 94  VAL B C   1 
ATOM   577  O  O   . VAL A 1 77  ? -34.191 -8.190  9.550  1.00 23.29  ? 94  VAL B O   1 
ATOM   578  C  CB  . VAL A 1 77  ? -32.773 -7.261  11.806 1.00 17.35  ? 94  VAL B CB  1 
ATOM   579  C  CG1 . VAL A 1 77  ? -32.320 -7.151  13.274 1.00 17.20  ? 94  VAL B CG1 1 
ATOM   580  C  CG2 . VAL A 1 77  ? -32.002 -6.274  10.923 1.00 20.27  ? 94  VAL B CG2 1 
ATOM   581  N  N   . THR A 1 78  ? -32.589 -9.686  9.044  1.00 21.37  ? 95  THR B N   1 
ATOM   582  C  CA  . THR A 1 78  ? -33.122 -9.884  7.698  1.00 28.66  ? 95  THR B CA  1 
ATOM   583  C  C   . THR A 1 78  ? -34.450 -10.637 7.720  1.00 29.30  ? 95  THR B C   1 
ATOM   584  O  O   . THR A 1 78  ? -35.406 -10.231 7.059  1.00 29.17  ? 95  THR B O   1 
ATOM   585  C  CB  . THR A 1 78  ? -32.100 -10.629 6.844  1.00 27.46  ? 95  THR B CB  1 
ATOM   586  O  OG1 . THR A 1 78  ? -30.900 -9.845  6.757  1.00 28.41  ? 95  THR B OG1 1 
ATOM   587  C  CG2 . THR A 1 78  ? -32.654 -10.889 5.447  1.00 27.38  ? 95  THR B CG2 1 
ATOM   588  N  N   . GLN A 1 79  ? -34.523 -11.727 8.474  1.00 24.50  ? 96  GLN B N   1 
ATOM   589  C  CA  . GLN A 1 79  ? -35.727 -12.563 8.539  1.00 31.82  ? 96  GLN B CA  1 
ATOM   590  C  C   . GLN A 1 79  ? -36.675 -12.019 9.601  1.00 31.90  ? 96  GLN B C   1 
ATOM   591  O  O   . GLN A 1 79  ? -36.269 -11.901 10.765 1.00 29.84  ? 96  GLN B O   1 
ATOM   592  C  CB  . GLN A 1 79  ? -35.341 -13.987 8.896  1.00 33.29  ? 96  GLN B CB  1 
ATOM   593  C  CG  . GLN A 1 79  ? -36.460 -15.015 8.864  1.00 43.63  ? 96  GLN B CG  1 
ATOM   594  C  CD  . GLN A 1 79  ? -36.696 -15.558 7.470  1.00 50.23  ? 96  GLN B CD  1 
ATOM   595  O  OE1 . GLN A 1 79  ? -35.783 -15.580 6.642  1.00 56.70  ? 96  GLN B OE1 1 
ATOM   596  N  NE2 . GLN A 1 79  ? -37.920 -15.999 7.201  1.00 53.68  ? 96  GLN B NE2 1 
ATOM   597  N  N   . PRO A 1 80  ? -37.934 -11.718 9.281  1.00 33.71  ? 97  PRO B N   1 
ATOM   598  C  CA  . PRO A 1 80  ? -38.875 -11.304 10.334 1.00 27.31  ? 97  PRO B CA  1 
ATOM   599  C  C   . PRO A 1 80  ? -38.909 -12.325 11.470 1.00 27.36  ? 97  PRO B C   1 
ATOM   600  O  O   . PRO A 1 80  ? -38.951 -13.531 11.237 1.00 29.04  ? 97  PRO B O   1 
ATOM   601  C  CB  . PRO A 1 80  ? -40.220 -11.228 9.601  1.00 27.08  ? 97  PRO B CB  1 
ATOM   602  C  CG  . PRO A 1 80  ? -39.865 -11.009 8.167  1.00 30.73  ? 97  PRO B CG  1 
ATOM   603  C  CD  . PRO A 1 80  ? -38.574 -11.773 7.954  1.00 33.34  ? 97  PRO B CD  1 
ATOM   604  N  N   . SER A 1 81  ? -38.869 -11.835 12.715 1.00 23.32  ? 98  SER B N   1 
ATOM   605  C  CA  . SER A 1 81  ? -38.776 -12.724 13.873 1.00 24.49  ? 98  SER B CA  1 
ATOM   606  C  C   . SER A 1 81  ? -39.295 -12.006 15.107 1.00 23.22  ? 98  SER B C   1 
ATOM   607  O  O   . SER A 1 81  ? -38.787 -10.934 15.461 1.00 19.93  ? 98  SER B O   1 
ATOM   608  C  CB  . SER A 1 81  ? -37.329 -13.182 14.102 1.00 25.85  ? 98  SER B CB  1 
ATOM   609  O  OG  . SER A 1 81  ? -37.211 -13.906 15.319 1.00 20.76  ? 98  SER B OG  1 
ATOM   610  N  N   . LEU A 1 82  ? -40.300 -12.591 15.762 1.00 18.66  ? 99  LEU B N   1 
ATOM   611  C  CA  . LEU A 1 82  ? -40.784 -12.016 17.013 1.00 20.95  ? 99  LEU B CA  1 
ATOM   612  C  C   . LEU A 1 82  ? -39.710 -12.086 18.089 1.00 19.98  ? 99  LEU B C   1 
ATOM   613  O  O   . LEU A 1 82  ? -39.520 -11.131 18.846 1.00 17.54  ? 99  LEU B O   1 
ATOM   614  C  CB  . LEU A 1 82  ? -42.042 -12.748 17.472 1.00 21.41  ? 99  LEU B CB  1 
ATOM   615  C  CG  . LEU A 1 82  ? -43.334 -12.554 16.679 1.00 22.15  ? 99  LEU B CG  1 
ATOM   616  C  CD1 . LEU A 1 82  ? -44.290 -13.728 17.002 1.00 20.32  ? 99  LEU B CD1 1 
ATOM   617  C  CD2 . LEU A 1 82  ? -43.993 -11.218 16.995 1.00 18.55  ? 99  LEU B CD2 1 
ATOM   618  N  N   . GLY A 1 83  ? -38.994 -13.210 18.157 1.00 16.70  ? 100 GLY B N   1 
ATOM   619  C  CA  . GLY A 1 83  ? -37.967 -13.379 19.172 1.00 17.20  ? 100 GLY B CA  1 
ATOM   620  C  C   . GLY A 1 83  ? -36.808 -12.409 19.024 1.00 15.13  ? 100 GLY B C   1 
ATOM   621  O  O   . GLY A 1 83  ? -36.326 -11.854 20.015 1.00 16.69  ? 100 GLY B O   1 
ATOM   622  N  N   . VAL A 1 84  ? -36.333 -12.197 17.794 1.00 18.65  ? 101 VAL B N   1 
ATOM   623  C  CA  . VAL A 1 84  ? -35.244 -11.236 17.594 1.00 16.87  ? 101 VAL B CA  1 
ATOM   624  C  C   . VAL A 1 84  ? -35.716 -9.822  17.934 1.00 18.53  ? 101 VAL B C   1 
ATOM   625  O  O   . VAL A 1 84  ? -35.007 -9.053  18.596 1.00 16.50  ? 101 VAL B O   1 
ATOM   626  C  CB  . VAL A 1 84  ? -34.699 -11.327 16.156 1.00 16.28  ? 101 VAL B CB  1 
ATOM   627  C  CG1 . VAL A 1 84  ? -33.674 -10.219 15.890 1.00 17.39  ? 101 VAL B CG1 1 
ATOM   628  C  CG2 . VAL A 1 84  ? -34.079 -12.728 15.879 1.00 19.88  ? 101 VAL B CG2 1 
ATOM   629  N  N   . GLY A 1 85  ? -36.912 -9.450  17.487 1.00 16.42  ? 102 GLY B N   1 
ATOM   630  C  CA  . GLY A 1 85  ? -37.451 -8.150  17.870 1.00 16.82  ? 102 GLY B CA  1 
ATOM   631  C  C   . GLY A 1 85  ? -37.559 -7.996  19.372 1.00 14.75  ? 102 GLY B C   1 
ATOM   632  O  O   . GLY A 1 85  ? -37.193 -6.958  19.929 1.00 15.38  ? 102 GLY B O   1 
ATOM   633  N  N   . TYR A 1 86  ? -37.999 -9.051  20.053 1.00 16.30  ? 103 TYR B N   1 
ATOM   634  C  CA  . TYR A 1 86  ? -38.166 -8.997  21.503 1.00 18.33  ? 103 TYR B CA  1 
ATOM   635  C  C   . TYR A 1 86  ? -36.822 -8.857  22.212 1.00 18.16  ? 103 TYR B C   1 
ATOM   636  O  O   . TYR A 1 86  ? -36.681 -8.028  23.122 1.00 17.26  ? 103 TYR B O   1 
ATOM   637  C  CB  . TYR A 1 86  ? -38.932 -10.238 21.988 1.00 16.06  ? 103 TYR B CB  1 
ATOM   638  C  CG  . TYR A 1 86  ? -39.007 -10.389 23.494 1.00 17.78  ? 103 TYR B CG  1 
ATOM   639  C  CD1 . TYR A 1 86  ? -39.998 -9.730  24.227 1.00 18.52  ? 103 TYR B CD1 1 
ATOM   640  C  CD2 . TYR A 1 86  ? -38.109 -11.200 24.184 1.00 19.14  ? 103 TYR B CD2 1 
ATOM   641  C  CE1 . TYR A 1 86  ? -40.081 -9.860  25.620 1.00 18.47  ? 103 TYR B CE1 1 
ATOM   642  C  CE2 . TYR A 1 86  ? -38.183 -11.338 25.569 1.00 18.23  ? 103 TYR B CE2 1 
ATOM   643  C  CZ  . TYR A 1 86  ? -39.161 -10.668 26.276 1.00 20.24  ? 103 TYR B CZ  1 
ATOM   644  O  OH  . TYR A 1 86  ? -39.229 -10.809 27.642 1.00 25.21  ? 103 TYR B OH  1 
ATOM   645  N  N   . GLU A 1 87  ? -35.813 -9.644  21.803 1.00 17.19  ? 104 GLU B N   1 
ATOM   646  C  CA  . GLU A 1 87  ? -34.468 -9.482  22.379 1.00 15.31  ? 104 GLU B CA  1 
ATOM   647  C  C   . GLU A 1 87  ? -33.930 -8.065  22.164 1.00 16.71  ? 104 GLU B C   1 
ATOM   648  O  O   . GLU A 1 87  ? -33.342 -7.472  23.075 1.00 17.25  ? 104 GLU B O   1 
ATOM   649  C  CB  . GLU A 1 87  ? -33.496 -10.522 21.802 1.00 18.51  ? 104 GLU B CB  1 
ATOM   650  C  CG  . GLU A 1 87  ? -33.796 -11.980 22.190 1.00 19.85  ? 104 GLU B CG  1 
ATOM   651  C  CD  . GLU A 1 87  ? -33.097 -13.017 21.289 1.00 26.44  ? 104 GLU B CD  1 
ATOM   652  O  OE1 . GLU A 1 87  ? -33.129 -12.887 20.041 1.00 31.42  ? 104 GLU B OE1 1 
ATOM   653  O  OE2 . GLU A 1 87  ? -32.478 -13.952 21.829 1.00 26.19  ? 104 GLU B OE2 1 
ATOM   654  N  N   . LEU A 1 88  ? -34.127 -7.504  20.968 1.00 16.02  ? 105 LEU B N   1 
ATOM   655  C  CA  . LEU A 1 88  ? -33.689 -6.137  20.702 1.00 15.33  ? 105 LEU B CA  1 
ATOM   656  C  C   . LEU A 1 88  ? -34.392 -5.142  21.617 1.00 18.15  ? 105 LEU B C   1 
ATOM   657  O  O   . LEU A 1 88  ? -33.762 -4.232  22.163 1.00 19.45  ? 105 LEU B O   1 
ATOM   658  C  CB  . LEU A 1 88  ? -33.946 -5.785  19.232 1.00 16.68  ? 105 LEU B CB  1 
ATOM   659  C  CG  . LEU A 1 88  ? -32.951 -6.402  18.248 1.00 17.73  ? 105 LEU B CG  1 
ATOM   660  C  CD1 . LEU A 1 88  ? -33.414 -6.154  16.822 1.00 16.78  ? 105 LEU B CD1 1 
ATOM   661  C  CD2 . LEU A 1 88  ? -31.542 -5.786  18.471 1.00 21.24  ? 105 LEU B CD2 1 
ATOM   662  N  N   . GLY A 1 89  ? -35.701 -5.300  21.795 1.00 14.30  ? 106 GLY B N   1 
ATOM   663  C  CA  . GLY A 1 89  ? -36.435 -4.394  22.658 1.00 18.03  ? 106 GLY B CA  1 
ATOM   664  C  C   . GLY A 1 89  ? -35.981 -4.465  24.098 1.00 17.05  ? 106 GLY B C   1 
ATOM   665  O  O   . GLY A 1 89  ? -35.829 -3.436  24.757 1.00 18.93  ? 106 GLY B O   1 
ATOM   666  N  N   . ARG A 1 90  ? -35.757 -5.679  24.610 1.00 14.61  ? 107 ARG B N   1 
ATOM   667  C  CA  . ARG A 1 90  ? -35.201 -5.811  25.959 1.00 18.18  ? 107 ARG B CA  1 
ATOM   668  C  C   . ARG A 1 90  ? -33.810 -5.211  26.035 1.00 19.70  ? 107 ARG B C   1 
ATOM   669  O  O   . ARG A 1 90  ? -33.442 -4.616  27.057 1.00 18.43  ? 107 ARG B O   1 
ATOM   670  C  CB  . ARG A 1 90  ? -35.143 -7.284  26.385 1.00 17.78  ? 107 ARG B CB  1 
ATOM   671  C  CG  . ARG A 1 90  ? -36.499 -7.969  26.467 1.00 19.18  ? 107 ARG B CG  1 
ATOM   672  C  CD  . ARG A 1 90  ? -37.459 -7.366  27.505 1.00 18.30  ? 107 ARG B CD  1 
ATOM   673  N  NE  . ARG A 1 90  ? -36.870 -7.299  28.836 1.00 22.02  ? 107 ARG B NE  1 
ATOM   674  C  CZ  . ARG A 1 90  ? -37.103 -8.196  29.787 1.00 24.02  ? 107 ARG B CZ  1 
ATOM   675  N  NH1 . ARG A 1 90  ? -37.747 -9.321  29.528 1.00 23.68  ? 107 ARG B NH1 1 
ATOM   676  N  NH2 . ARG A 1 90  ? -36.643 -7.981  31.017 1.00 22.66  ? 107 ARG B NH2 1 
ATOM   677  N  N   . ALA A 1 91  ? -33.006 -5.412  24.978 1.00 20.81  ? 108 ALA B N   1 
ATOM   678  C  CA  . ALA A 1 91  ? -31.642 -4.887  24.930 1.00 17.78  ? 108 ALA B CA  1 
ATOM   679  C  C   . ALA A 1 91  ? -31.634 -3.369  24.974 1.00 19.94  ? 108 ALA B C   1 
ATOM   680  O  O   . ALA A 1 91  ? -30.835 -2.774  25.700 1.00 21.59  ? 108 ALA B O   1 
ATOM   681  C  CB  . ALA A 1 91  ? -30.929 -5.365  23.664 1.00 17.14  ? 108 ALA B CB  1 
ATOM   682  N  N   . VAL A 1 92  ? -32.503 -2.725  24.189 1.00 18.85  ? 109 VAL B N   1 
ATOM   683  C  CA  . VAL A 1 92  ? -32.579 -1.266  24.227 1.00 19.91  ? 109 VAL B CA  1 
ATOM   684  C  C   . VAL A 1 92  ? -32.887 -0.786  25.644 1.00 23.50  ? 109 VAL B C   1 
ATOM   685  O  O   . VAL A 1 92  ? -32.251 0.138   26.161 1.00 20.81  ? 109 VAL B O   1 
ATOM   686  C  CB  . VAL A 1 92  ? -33.620 -0.752  23.218 1.00 24.54  ? 109 VAL B CB  1 
ATOM   687  C  CG1 . VAL A 1 92  ? -33.888 0.770   23.428 1.00 20.57  ? 109 VAL B CG1 1 
ATOM   688  C  CG2 . VAL A 1 92  ? -33.143 -1.040  21.808 1.00 20.97  ? 109 VAL B CG2 1 
ATOM   689  N  N   . ALA A 1 93  ? -33.860 -1.408  26.297 1.00 19.30  ? 110 ALA B N   1 
ATOM   690  C  CA  . ALA A 1 93  ? -34.213 -0.947  27.635 1.00 20.98  ? 110 ALA B CA  1 
ATOM   691  C  C   . ALA A 1 93  ? -33.137 -1.264  28.665 1.00 21.62  ? 110 ALA B C   1 
ATOM   692  O  O   . ALA A 1 93  ? -33.106 -0.620  29.716 1.00 20.69  ? 110 ALA B O   1 
ATOM   693  C  CB  . ALA A 1 93  ? -35.544 -1.541  28.066 1.00 19.61  ? 110 ALA B CB  1 
ATOM   694  N  N   . PHE A 1 94  ? -32.258 -2.235  28.396 1.00 19.28  ? 111 PHE B N   1 
ATOM   695  C  CA  . PHE A 1 94  ? -31.085 -2.450  29.236 1.00 21.39  ? 111 PHE B CA  1 
ATOM   696  C  C   . PHE A 1 94  ? -29.949 -1.486  28.900 1.00 22.34  ? 111 PHE B C   1 
ATOM   697  O  O   . PHE A 1 94  ? -28.851 -1.625  29.459 1.00 22.55  ? 111 PHE B O   1 
ATOM   698  C  CB  . PHE A 1 94  ? -30.561 -3.879  29.077 1.00 20.98  ? 111 PHE B CB  1 
ATOM   699  C  CG  . PHE A 1 94  ? -31.391 -4.937  29.770 1.00 25.05  ? 111 PHE B CG  1 
ATOM   700  C  CD1 . PHE A 1 94  ? -31.863 -4.752  31.061 1.00 22.79  ? 111 PHE B CD1 1 
ATOM   701  C  CD2 . PHE A 1 94  ? -31.645 -6.142  29.138 1.00 22.73  ? 111 PHE B CD2 1 
ATOM   702  C  CE1 . PHE A 1 94  ? -32.604 -5.741  31.692 1.00 26.27  ? 111 PHE B CE1 1 
ATOM   703  C  CE2 . PHE A 1 94  ? -32.387 -7.139  29.769 1.00 25.92  ? 111 PHE B CE2 1 
ATOM   704  C  CZ  . PHE A 1 94  ? -32.869 -6.930  31.049 1.00 28.74  ? 111 PHE B CZ  1 
ATOM   705  N  N   . ASN A 1 95  ? -30.188 -0.563  27.967 1.00 19.43  ? 112 ASN B N   1 
ATOM   706  C  CA  A ASN A 1 95  ? -29.184 0.403   27.508 0.44 23.73  ? 112 ASN B CA  1 
ATOM   707  C  CA  B ASN A 1 95  ? -29.187 0.406   27.500 0.56 23.99  ? 112 ASN B CA  1 
ATOM   708  C  C   . ASN A 1 95  ? -27.960 -0.302  26.921 1.00 26.63  ? 112 ASN B C   1 
ATOM   709  O  O   . ASN A 1 95  ? -26.819 0.097   27.154 1.00 25.10  ? 112 ASN B O   1 
ATOM   710  C  CB  A ASN A 1 95  ? -28.771 1.354   28.635 0.44 23.42  ? 112 ASN B CB  1 
ATOM   711  C  CB  B ASN A 1 95  ? -28.781 1.380   28.614 0.56 24.43  ? 112 ASN B CB  1 
ATOM   712  C  CG  A ASN A 1 95  ? -29.945 2.141   29.193 0.44 26.51  ? 112 ASN B CG  1 
ATOM   713  C  CG  B ASN A 1 95  ? -27.884 2.502   28.110 0.56 26.64  ? 112 ASN B CG  1 
ATOM   714  O  OD1 A ASN A 1 95  ? -30.245 2.057   30.381 0.44 36.22  ? 112 ASN B OD1 1 
ATOM   715  O  OD1 B ASN A 1 95  ? -28.213 3.167   27.123 0.56 26.04  ? 112 ASN B OD1 1 
ATOM   716  N  ND2 A ASN A 1 95  ? -30.641 2.869   28.329 0.44 24.65  ? 112 ASN B ND2 1 
ATOM   717  N  ND2 B ASN A 1 95  ? -26.752 2.715   28.779 0.56 28.92  ? 112 ASN B ND2 1 
ATOM   718  N  N   . LYS A 1 96  ? -28.190 -1.366  26.148 1.00 20.79  ? 113 LYS B N   1 
ATOM   719  C  CA  . LYS A 1 96  ? -27.077 -2.093  25.556 1.00 17.64  ? 113 LYS B CA  1 
ATOM   720  C  C   . LYS A 1 96  ? -26.654 -1.420  24.262 1.00 19.92  ? 113 LYS B C   1 
ATOM   721  O  O   . LYS A 1 96  ? -27.473 -0.863  23.528 1.00 21.62  ? 113 LYS B O   1 
ATOM   722  C  CB  . LYS A 1 96  ? -27.451 -3.551  25.268 1.00 17.94  ? 113 LYS B CB  1 
ATOM   723  C  CG  . LYS A 1 96  ? -27.766 -4.346  26.515 1.00 21.76  ? 113 LYS B CG  1 
ATOM   724  C  CD  . LYS A 1 96  ? -26.657 -4.254  27.551 1.00 19.78  ? 113 LYS B CD  1 
ATOM   725  C  CE  . LYS A 1 96  ? -26.893 -5.233  28.687 1.00 20.95  ? 113 LYS B CE  1 
ATOM   726  N  NZ  . LYS A 1 96  ? -25.811 -5.212  29.699 1.00 19.25  ? 113 LYS B NZ  1 
ATOM   727  N  N   . ARG A 1 97  ? -25.364 -1.480  23.980 1.00 19.17  ? 114 ARG B N   1 
ATOM   728  C  CA  . ARG A 1 97  ? -24.883 -1.164  22.645 1.00 18.45  ? 114 ARG B CA  1 
ATOM   729  C  C   . ARG A 1 97  ? -25.267 -2.286  21.683 1.00 18.26  ? 114 ARG B C   1 
ATOM   730  O  O   . ARG A 1 97  ? -25.077 -3.465  21.992 1.00 18.48  ? 114 ARG B O   1 
ATOM   731  C  CB  . ARG A 1 97  ? -23.373 -0.972  22.708 1.00 24.68  ? 114 ARG B CB  1 
ATOM   732  C  CG  . ARG A 1 97  ? -22.629 -0.995  21.417 1.00 25.02  ? 114 ARG B CG  1 
ATOM   733  C  CD  . ARG A 1 97  ? -21.496 -0.023  21.538 1.00 31.34  ? 114 ARG B CD  1 
ATOM   734  N  NE  . ARG A 1 97  ? -20.325 -0.704  22.060 1.00 34.68  ? 114 ARG B NE  1 
ATOM   735  C  CZ  . ARG A 1 97  ? -19.388 -1.295  21.333 1.00 43.74  ? 114 ARG B CZ  1 
ATOM   736  N  NH1 . ARG A 1 97  ? -19.470 -1.352  20.016 1.00 40.40  ? 114 ARG B NH1 1 
ATOM   737  N  NH2 . ARG A 1 97  ? -18.347 -1.849  21.950 1.00 49.25  ? 114 ARG B NH2 1 
ATOM   738  N  N   . ILE A 1 98  ? -25.809 -1.918  20.520 1.00 16.62  ? 115 ILE B N   1 
ATOM   739  C  CA  . ILE A 1 98  ? -26.518 -2.845  19.641 1.00 17.37  ? 115 ILE B CA  1 
ATOM   740  C  C   . ILE A 1 98  ? -26.043 -2.640  18.211 1.00 20.30  ? 115 ILE B C   1 
ATOM   741  O  O   . ILE A 1 98  ? -25.918 -1.496  17.745 1.00 18.44  ? 115 ILE B O   1 
ATOM   742  C  CB  . ILE A 1 98  ? -28.042 -2.639  19.721 1.00 16.38  ? 115 ILE B CB  1 
ATOM   743  C  CG1 . ILE A 1 98  ? -28.595 -3.127  21.052 1.00 17.58  ? 115 ILE B CG1 1 
ATOM   744  C  CG2 . ILE A 1 98  ? -28.756 -3.365  18.597 1.00 20.84  ? 115 ILE B CG2 1 
ATOM   745  C  CD1 . ILE A 1 98  ? -29.955 -2.561  21.348 1.00 19.41  ? 115 ILE B CD1 1 
ATOM   746  N  N   . LEU A 1 99  ? -25.765 -3.743  17.524 1.00 17.27  ? 116 LEU B N   1 
ATOM   747  C  CA  . LEU A 1 99  ? -25.468 -3.758  16.095 1.00 14.49  ? 116 LEU B CA  1 
ATOM   748  C  C   . LEU A 1 99  ? -26.458 -4.689  15.426 1.00 18.89  ? 116 LEU B C   1 
ATOM   749  O  O   . LEU A 1 99  ? -26.521 -5.867  15.781 1.00 16.96  ? 116 LEU B O   1 
ATOM   750  C  CB  . LEU A 1 99  ? -24.046 -4.246  15.820 1.00 18.46  ? 116 LEU B CB  1 
ATOM   751  C  CG  . LEU A 1 99  ? -23.726 -4.504  14.350 1.00 19.53  ? 116 LEU B CG  1 
ATOM   752  C  CD1 . LEU A 1 99  ? -23.792 -3.213  13.547 1.00 21.41  ? 116 LEU B CD1 1 
ATOM   753  C  CD2 . LEU A 1 99  ? -22.332 -5.159  14.224 1.00 19.88  ? 116 LEU B CD2 1 
ATOM   754  N  N   . CYS A 1 100 ? -27.218 -4.172  14.462 1.00 16.48  ? 117 CYS B N   1 
ATOM   755  C  CA  . CYS A 1 100 ? -28.134 -4.987  13.670 1.00 18.51  ? 117 CYS B CA  1 
ATOM   756  C  C   . CYS A 1 100 ? -27.544 -5.166  12.278 1.00 24.05  ? 117 CYS B C   1 
ATOM   757  O  O   . CYS A 1 100 ? -26.966 -4.224  11.720 1.00 20.81  ? 117 CYS B O   1 
ATOM   758  C  CB  . CYS A 1 100 ? -29.516 -4.321  13.562 1.00 19.11  ? 117 CYS B CB  1 
ATOM   759  S  SG  . CYS A 1 100 ? -30.481 -4.293  15.076 1.00 20.54  ? 117 CYS B SG  1 
ATOM   760  N  N   . LEU A 1 101 ? -27.699 -6.366  11.714 1.00 17.57  ? 118 LEU B N   1 
ATOM   761  C  CA  . LEU A 1 101 ? -27.174 -6.703  10.396 1.00 17.53  ? 118 LEU B CA  1 
ATOM   762  C  C   . LEU A 1 101 ? -28.330 -7.047  9.467  1.00 21.59  ? 118 LEU B C   1 
ATOM   763  O  O   . LEU A 1 101 ? -29.138 -7.922  9.789  1.00 21.43  ? 118 LEU B O   1 
ATOM   764  C  CB  . LEU A 1 101 ? -26.212 -7.896  10.485 1.00 17.09  ? 118 LEU B CB  1 
ATOM   765  C  CG  . LEU A 1 101 ? -25.025 -7.684  11.431 1.00 20.47  ? 118 LEU B CG  1 
ATOM   766  C  CD1 . LEU A 1 101 ? -24.381 -9.007  11.779 1.00 23.42  ? 118 LEU B CD1 1 
ATOM   767  C  CD2 . LEU A 1 101 ? -24.032 -6.739  10.806 1.00 22.31  ? 118 LEU B CD2 1 
ATOM   768  N  N   . PHE A 1 102 ? -28.377 -6.405  8.294  1.00 20.18  ? 119 PHE B N   1 
ATOM   769  C  CA  . PHE A 1 102 ? -29.493 -6.545  7.363  1.00 20.76  ? 119 PHE B CA  1 
ATOM   770  C  C   . PHE A 1 102 ? -28.997 -6.780  5.941  1.00 26.50  ? 119 PHE B C   1 
ATOM   771  O  O   . PHE A 1 102 ? -28.056 -6.126  5.492  1.00 27.57  ? 119 PHE B O   1 
ATOM   772  C  CB  . PHE A 1 102 ? -30.393 -5.284  7.413  1.00 21.78  ? 119 PHE B CB  1 
ATOM   773  C  CG  . PHE A 1 102 ? -31.612 -5.365  6.536  1.00 21.71  ? 119 PHE B CG  1 
ATOM   774  C  CD1 . PHE A 1 102 ? -32.602 -6.306  6.774  1.00 25.47  ? 119 PHE B CD1 1 
ATOM   775  C  CD2 . PHE A 1 102 ? -31.772 -4.475  5.474  1.00 27.20  ? 119 PHE B CD2 1 
ATOM   776  C  CE1 . PHE A 1 102 ? -33.732 -6.383  5.956  1.00 29.14  ? 119 PHE B CE1 1 
ATOM   777  C  CE2 . PHE A 1 102 ? -32.904 -4.536  4.651  1.00 28.29  ? 119 PHE B CE2 1 
ATOM   778  C  CZ  . PHE A 1 102 ? -33.887 -5.494  4.896  1.00 32.54  ? 119 PHE B CZ  1 
ATOM   779  N  N   . ARG A 1 103 ? -29.661 -7.689  5.228  1.00 23.48  ? 120 ARG B N   1 
ATOM   780  C  CA  . ARG A 1 103 ? -29.343 -7.988  3.809  1.00 25.71  ? 120 ARG B CA  1 
ATOM   781  C  C   . ARG A 1 103 ? -30.424 -7.381  2.895  1.00 30.79  ? 120 ARG B C   1 
ATOM   782  O  O   . ARG A 1 103 ? -31.516 -7.934  2.818  1.00 28.57  ? 120 ARG B O   1 
ATOM   783  C  CB  . ARG A 1 103 ? -29.209 -9.494  3.579  1.00 24.96  ? 120 ARG B CB  1 
ATOM   784  C  CG  . ARG A 1 103 ? -27.834 -10.094 3.820  1.00 29.55  ? 120 ARG B CG  1 
ATOM   785  C  CD  . ARG A 1 103 ? -27.867 -11.606 3.718  1.00 33.50  ? 120 ARG B CD  1 
ATOM   786  N  NE  . ARG A 1 103 ? -28.514 -12.196 4.893  1.00 35.54  ? 120 ARG B NE  1 
ATOM   787  C  CZ  . ARG A 1 103 ? -29.565 -12.997 4.847  1.00 37.99  ? 120 ARG B CZ  1 
ATOM   788  N  NH1 . ARG A 1 103 ? -30.071 -13.351 3.682  1.00 41.16  ? 120 ARG B NH1 1 
ATOM   789  N  NH2 . ARG A 1 103 ? -30.101 -13.447 5.965  1.00 40.81  ? 120 ARG B NH2 1 
ATOM   790  N  N   . PRO A 1 104 ? -30.131 -6.258  2.209  1.00 33.54  ? 121 PRO B N   1 
ATOM   791  C  CA  . PRO A 1 104 ? -31.078 -5.649  1.283  1.00 35.66  ? 121 PRO B CA  1 
ATOM   792  C  C   . PRO A 1 104 ? -31.408 -6.544  0.082  1.00 45.51  ? 121 PRO B C   1 
ATOM   793  O  O   . PRO A 1 104 ? -32.490 -6.436  -0.509 1.00 48.19  ? 121 PRO B O   1 
ATOM   794  C  CB  . PRO A 1 104 ? -30.368 -4.358  0.883  1.00 33.36  ? 121 PRO B CB  1 
ATOM   795  C  CG  . PRO A 1 104 ? -29.348 -4.135  1.966  1.00 31.08  ? 121 PRO B CG  1 
ATOM   796  C  CD  . PRO A 1 104 ? -28.888 -5.531  2.314  1.00 33.55  ? 121 PRO B CD  1 
ATOM   797  N  N   . GLN A 1 105 ? -30.491 -7.445  -0.243 1.00 43.58  ? 122 GLN B N   1 
ATOM   798  C  CA  . GLN A 1 105 ? -30.722 -8.496  -1.268 1.00 58.05  ? 122 GLN B CA  1 
ATOM   799  C  C   . GLN A 1 105 ? -32.104 -9.163  -1.093 1.00 64.75  ? 122 GLN B C   1 
ATOM   800  O  O   . GLN A 1 105 ? -32.698 -9.558  -2.109 1.00 62.28  ? 122 GLN B O   1 
ATOM   801  C  CB  . GLN A 1 105 ? -29.628 -9.553  -1.154 1.00 30.00  ? 122 GLN B CB  1 
ATOM   802  N  N   . SER A 1 106 ? -32.566 -9.285  0.160  1.00 64.02  ? 123 SER B N   1 
ATOM   803  C  CA  . SER A 1 106 ? -33.753 -10.069 0.595  1.00 62.00  ? 123 SER B CA  1 
ATOM   804  C  C   . SER A 1 106 ? -35.033 -9.524  -0.059 1.00 65.11  ? 123 SER B C   1 
ATOM   805  O  O   . SER A 1 106 ? -36.083 -10.177 0.073  1.00 68.89  ? 123 SER B O   1 
ATOM   806  C  CB  . SER A 1 106 ? -33.872 -10.048 2.099  1.00 46.98  ? 123 SER B CB  1 
ATOM   807  O  OG  . SER A 1 106 ? -34.210 -8.753  2.571  1.00 50.83  ? 123 SER B OG  1 
ATOM   808  N  N   . GLY A 1 107 ? -34.935 -8.362  -0.709 1.00 64.32  ? 124 GLY B N   1 
ATOM   809  C  CA  . GLY A 1 107 ? -36.081 -7.652  -1.310 1.00 69.38  ? 124 GLY B CA  1 
ATOM   810  C  C   . GLY A 1 107 ? -36.926 -6.960  -0.258 1.00 68.92  ? 124 GLY B C   1 
ATOM   811  O  O   . GLY A 1 107 ? -37.806 -6.161  -0.630 1.00 65.56  ? 124 GLY B O   1 
ATOM   812  N  N   . ARG A 1 108 ? -36.647 -7.241  1.016  1.00 67.07  ? 125 ARG B N   1 
ATOM   813  C  CA  . ARG A 1 108 ? -37.558 -6.845  2.114  1.00 62.25  ? 125 ARG B CA  1 
ATOM   814  C  C   . ARG A 1 108 ? -37.311 -5.380  2.471  1.00 50.92  ? 125 ARG B C   1 
ATOM   815  O  O   . ARG A 1 108 ? -36.259 -4.839  2.106  1.00 57.28  ? 125 ARG B O   1 
ATOM   816  C  CB  . ARG A 1 108 ? -37.359 -7.749  3.333  1.00 60.51  ? 125 ARG B CB  1 
ATOM   817  C  CG  . ARG A 1 108 ? -37.617 -9.234  3.136  1.00 62.08  ? 125 ARG B CG  1 
ATOM   818  C  CD  . ARG A 1 108 ? -37.369 -9.987  4.432  1.00 58.46  ? 125 ARG B CD  1 
ATOM   819  N  NE  . ARG A 1 108 ? -37.451 -11.443 4.270  1.00 61.81  ? 125 ARG B NE  1 
ATOM   820  C  CZ  . ARG A 1 108 ? -38.566 -12.144 4.419  1.00 58.56  ? 125 ARG B CZ  1 
ATOM   821  N  NH1 . ARG A 1 108 ? -39.723 -11.522 4.548  1.00 58.81  ? 125 ARG B NH1 1 
ATOM   822  N  NH2 . ARG A 1 108 ? -38.521 -13.463 4.449  1.00 56.50  ? 125 ARG B NH2 1 
ATOM   823  N  N   . VAL A 1 109 ? -38.282 -4.774  3.138  1.00 48.51  ? 126 VAL B N   1 
ATOM   824  C  CA  . VAL A 1 109 ? -38.078 -3.469  3.818  1.00 47.90  ? 126 VAL B CA  1 
ATOM   825  C  C   . VAL A 1 109 ? -37.903 -3.779  5.312  1.00 44.59  ? 126 VAL B C   1 
ATOM   826  O  O   . VAL A 1 109 ? -38.776 -4.451  5.884  1.00 42.31  ? 126 VAL B O   1 
ATOM   827  C  CB  . VAL A 1 109 ? -39.221 -2.462  3.581  1.00 48.88  ? 126 VAL B CB  1 
ATOM   828  C  CG1 . VAL A 1 109 ? -38.972 -1.141  4.295  1.00 40.13  ? 126 VAL B CG1 1 
ATOM   829  C  CG2 . VAL A 1 109 ? -39.474 -2.234  2.098  1.00 57.32  ? 126 VAL B CG2 1 
ATOM   830  N  N   . LEU A 1 110 ? -36.797 -3.321  5.891  1.00 38.98  ? 127 LEU B N   1 
ATOM   831  C  CA  . LEU A 1 110 ? -36.581 -3.505  7.344  1.00 33.43  ? 127 LEU B CA  1 
ATOM   832  C  C   . LEU A 1 110 ? -37.683 -2.803  8.146  1.00 32.32  ? 127 LEU B C   1 
ATOM   833  O  O   . LEU A 1 110 ? -38.000 -1.652  7.823  1.00 30.57  ? 127 LEU B O   1 
ATOM   834  C  CB  . LEU A 1 110 ? -35.200 -3.004  7.754  1.00 32.09  ? 127 LEU B CB  1 
ATOM   835  C  CG  . LEU A 1 110 ? -34.833 -3.215  9.224  1.00 31.83  ? 127 LEU B CG  1 
ATOM   836  C  CD1 . LEU A 1 110 ? -35.022 -4.665  9.620  1.00 23.76  ? 127 LEU B CD1 1 
ATOM   837  C  CD2 . LEU A 1 110 ? -33.417 -2.761  9.500  1.00 26.79  ? 127 LEU B CD2 1 
ATOM   838  N  N   . SER A 1 111 ? -38.218 -3.483  9.156  1.00 30.53  ? 128 SER B N   1 
ATOM   839  C  CA  . SER A 1 111 ? -39.208 -2.875  10.074 1.00 33.75  ? 128 SER B CA  1 
ATOM   840  C  C   . SER A 1 111 ? -38.860 -1.413  10.372 1.00 31.60  ? 128 SER B C   1 
ATOM   841  O  O   . SER A 1 111 ? -37.720 -1.147  10.774 1.00 25.08  ? 128 SER B O   1 
ATOM   842  C  CB  . SER A 1 111 ? -39.277 -3.639  11.370 1.00 29.28  ? 128 SER B CB  1 
ATOM   843  O  OG  . SER A 1 111 ? -40.024 -2.953  12.360 1.00 27.59  ? 128 SER B OG  1 
ATOM   844  N  N   . ALA A 1 112 ? -39.849 -0.530  10.267 1.00 28.52  ? 129 ALA B N   1 
ATOM   845  C  CA  . ALA A 1 112 ? -39.646 0.891   10.620 1.00 29.87  ? 129 ALA B CA  1 
ATOM   846  C  C   . ALA A 1 112 ? -39.275 1.002   12.092 1.00 27.50  ? 129 ALA B C   1 
ATOM   847  O  O   . ALA A 1 112 ? -38.534 1.906   12.445 1.00 24.93  ? 129 ALA B O   1 
ATOM   848  C  CB  . ALA A 1 112 ? -40.904 1.661   10.341 1.00 34.08  ? 129 ALA B CB  1 
ATOM   849  N  N   . MET A 1 113 ? -39.823 0.111   12.912 1.00 23.76  ? 130 MET B N   1 
ATOM   850  C  CA  . MET A 1 113 ? -39.559 0.155   14.366 1.00 27.17  ? 130 MET B CA  1 
ATOM   851  C  C   . MET A 1 113 ? -38.067 -0.130  14.593 1.00 30.52  ? 130 MET B C   1 
ATOM   852  O  O   . MET A 1 113 ? -37.469 0.536   15.442 1.00 29.96  ? 130 MET B O   1 
ATOM   853  C  CB  . MET A 1 113 ? -40.425 -0.867  15.107 1.00 27.29  ? 130 MET B CB  1 
ATOM   854  C  CG  . MET A 1 113 ? -41.861 -0.429  15.312 1.00 33.17  ? 130 MET B CG  1 
ATOM   855  S  SD  . MET A 1 113 ? -42.047 1.147   16.165 1.00 32.95  ? 130 MET B SD  1 
ATOM   856  C  CE  . MET A 1 113 ? -41.657 0.697   17.858 1.00 27.76  ? 130 MET B CE  1 
ATOM   857  N  N   . ILE A 1 114 ? -37.511 -1.075  13.834 1.00 27.41  ? 131 ILE B N   1 
ATOM   858  C  CA  . ILE A 1 114 ? -36.083 -1.344  13.984 1.00 23.89  ? 131 ILE B CA  1 
ATOM   859  C  C   . ILE A 1 114 ? -35.246 -0.266  13.298 1.00 21.29  ? 131 ILE B C   1 
ATOM   860  O  O   . ILE A 1 114 ? -34.294 0.265   13.879 1.00 19.60  ? 131 ILE B O   1 
ATOM   861  C  CB  . ILE A 1 114 ? -35.737 -2.742  13.442 1.00 22.15  ? 131 ILE B CB  1 
ATOM   862  C  CG1 . ILE A 1 114 ? -36.510 -3.841  14.191 1.00 25.25  ? 131 ILE B CG1 1 
ATOM   863  C  CG2 . ILE A 1 114 ? -34.234 -2.976  13.544 1.00 25.84  ? 131 ILE B CG2 1 
ATOM   864  C  CD1 . ILE A 1 114 ? -36.325 -3.827  15.718 1.00 21.71  ? 131 ILE B CD1 1 
ATOM   865  N  N   . ARG A 1 115 ? -35.551 0.053   12.037 1.00 20.64  ? 132 ARG B N   1 
ATOM   866  C  CA  . ARG A 1 115 ? -34.790 1.114   11.378 1.00 25.79  ? 132 ARG B CA  1 
ATOM   867  C  C   . ARG A 1 115 ? -34.872 2.410   12.174 1.00 25.12  ? 132 ARG B C   1 
ATOM   868  O  O   . ARG A 1 115 ? -33.871 3.125   12.314 1.00 28.03  ? 132 ARG B O   1 
ATOM   869  C  CB  . ARG A 1 115 ? -35.276 1.322   9.938  1.00 29.60  ? 132 ARG B CB  1 
ATOM   870  C  CG  . ARG A 1 115 ? -34.194 1.886   9.004  1.00 41.65  ? 132 ARG B CG  1 
ATOM   871  C  CD  . ARG A 1 115 ? -34.397 1.504   7.530  1.00 47.88  ? 132 ARG B CD  1 
ATOM   872  N  NE  . ARG A 1 115 ? -33.625 0.357   7.046  1.00 47.47  ? 132 ARG B NE  1 
ATOM   873  C  CZ  . ARG A 1 115 ? -32.297 0.257   7.045  1.00 49.99  ? 132 ARG B CZ  1 
ATOM   874  N  NH1 . ARG A 1 115 ? -31.527 1.180   7.603  1.00 55.99  ? 132 ARG B NH1 1 
ATOM   875  N  NH2 . ARG A 1 115 ? -31.723 -0.789  6.453  1.00 43.15  ? 132 ARG B NH2 1 
ATOM   876  N  N   . GLY A 1 116 ? -36.039 2.692   12.760 1.00 22.80  ? 133 GLY B N   1 
ATOM   877  C  CA  . GLY A 1 116 ? -36.283 3.895   13.541 1.00 25.89  ? 133 GLY B CA  1 
ATOM   878  C  C   . GLY A 1 116 ? -35.602 3.929   14.893 1.00 27.10  ? 133 GLY B C   1 
ATOM   879  O  O   . GLY A 1 116 ? -35.529 4.999   15.503 1.00 30.54  ? 133 GLY B O   1 
ATOM   880  N  N   . ALA A 1 117 ? -35.110 2.799   15.381 1.00 25.99  ? 134 ALA B N   1 
ATOM   881  C  CA  . ALA A 1 117 ? -34.415 2.798   16.655 1.00 25.74  ? 134 ALA B CA  1 
ATOM   882  C  C   . ALA A 1 117 ? -32.941 3.165   16.518 1.00 26.91  ? 134 ALA B C   1 
ATOM   883  O  O   . ALA A 1 117 ? -32.299 3.468   17.529 1.00 27.37  ? 134 ALA B O   1 
ATOM   884  C  CB  . ALA A 1 117 ? -34.577 1.435   17.340 1.00 26.06  ? 134 ALA B CB  1 
ATOM   885  N  N   . ALA A 1 118 ? -32.401 3.185   15.299 1.00 25.77  ? 135 ALA B N   1 
ATOM   886  C  CA  . ALA A 1 118 ? -30.975 3.430   15.110 1.00 22.25  ? 135 ALA B CA  1 
ATOM   887  C  C   . ALA A 1 118 ? -30.638 4.897   15.344 1.00 28.60  ? 135 ALA B C   1 
ATOM   888  O  O   . ALA A 1 118 ? -31.335 5.792   14.871 1.00 30.14  ? 135 ALA B O   1 
ATOM   889  C  CB  . ALA A 1 118 ? -30.544 3.017   13.703 1.00 22.24  ? 135 ALA B CB  1 
ATOM   890  N  N   . ASP A 1 119 ? -29.549 5.140   16.069 1.00 28.32  ? 136 ASP B N   1 
ATOM   891  C  CA  . ASP A 1 119 ? -29.077 6.488   16.340 1.00 32.23  ? 136 ASP B CA  1 
ATOM   892  C  C   . ASP A 1 119 ? -27.680 6.739   15.787 1.00 28.76  ? 136 ASP B C   1 
ATOM   893  O  O   . ASP A 1 119 ? -27.112 7.811   16.021 1.00 35.65  ? 136 ASP B O   1 
ATOM   894  C  CB  . ASP A 1 119 ? -29.150 6.771   17.850 1.00 31.74  ? 136 ASP B CB  1 
ATOM   895  C  CG  . ASP A 1 119 ? -28.136 5.966   18.671 1.00 32.62  ? 136 ASP B CG  1 
ATOM   896  O  OD1 . ASP A 1 119 ? -27.377 5.145   18.104 1.00 30.45  ? 136 ASP B OD1 1 
ATOM   897  O  OD2 . ASP A 1 119 ? -28.084 6.178   19.900 1.00 38.13  ? 136 ASP B OD2 1 
ATOM   898  N  N   . GLY A 1 120 ? -27.119 5.788   15.047 1.00 31.29  ? 137 GLY B N   1 
ATOM   899  C  CA  . GLY A 1 120 ? -25.804 5.947   14.464 1.00 27.21  ? 137 GLY B CA  1 
ATOM   900  C  C   . GLY A 1 120 ? -24.645 5.609   15.369 1.00 27.93  ? 137 GLY B C   1 
ATOM   901  O  O   . GLY A 1 120 ? -23.506 5.540   14.889 1.00 31.26  ? 137 GLY B O   1 
ATOM   902  N  N   . SER A 1 121 ? -24.879 5.392   16.658 1.00 23.80  ? 138 SER B N   1 
ATOM   903  C  CA  . SER A 1 121 ? -23.761 5.098   17.543 1.00 20.58  ? 138 SER B CA  1 
ATOM   904  C  C   . SER A 1 121 ? -24.087 3.920   18.456 1.00 27.12  ? 138 SER B C   1 
ATOM   905  O  O   . SER A 1 121 ? -23.568 2.821   18.247 1.00 24.72  ? 138 SER B O   1 
ATOM   906  C  CB  . SER A 1 121 ? -23.371 6.348   18.340 1.00 28.82  ? 138 SER B CB  1 
ATOM   907  O  OG  . SER A 1 121 ? -24.398 6.752   19.236 1.00 33.56  ? 138 SER B OG  1 
ATOM   908  N  N   . ARG A 1 122 ? -24.955 4.115   19.447 1.00 20.87  ? 139 ARG B N   1 
ATOM   909  C  CA  . ARG A 1 122 ? -25.264 3.033   20.381 1.00 26.13  ? 139 ARG B CA  1 
ATOM   910  C  C   . ARG A 1 122 ? -26.210 1.980   19.796 1.00 24.31  ? 139 ARG B C   1 
ATOM   911  O  O   . ARG A 1 122 ? -26.236 0.843   20.284 1.00 23.93  ? 139 ARG B O   1 
ATOM   912  C  CB  . ARG A 1 122 ? -25.869 3.619   21.655 1.00 29.74  ? 139 ARG B CB  1 
ATOM   913  C  CG  . ARG A 1 122 ? -25.793 2.722   22.858 1.00 37.03  ? 139 ARG B CG  1 
ATOM   914  C  CD  . ARG A 1 122 ? -25.477 3.516   24.119 1.00 35.05  ? 139 ARG B CD  1 
ATOM   915  N  NE  . ARG A 1 122 ? -25.274 2.616   25.246 1.00 34.12  ? 139 ARG B NE  1 
ATOM   916  C  CZ  . ARG A 1 122 ? -24.143 1.988   25.535 1.00 36.79  ? 139 ARG B CZ  1 
ATOM   917  N  NH1 . ARG A 1 122 ? -23.019 2.245   24.878 1.00 34.86  ? 139 ARG B NH1 1 
ATOM   918  N  NH2 . ARG A 1 122 ? -24.138 1.084   26.515 1.00 33.33  ? 139 ARG B NH2 1 
ATOM   919  N  N   . PHE A 1 123 ? -26.993 2.338   18.782 1.00 18.61  ? 140 PHE B N   1 
ATOM   920  C  CA  . PHE A 1 123 ? -27.849 1.407   18.046 1.00 20.83  ? 140 PHE B CA  1 
ATOM   921  C  C   . PHE A 1 123 ? -27.588 1.665   16.570 1.00 24.93  ? 140 PHE B C   1 
ATOM   922  O  O   . PHE A 1 123 ? -27.895 2.751   16.061 1.00 17.89  ? 140 PHE B O   1 
ATOM   923  C  CB  . PHE A 1 123 ? -29.325 1.612   18.415 1.00 20.38  ? 140 PHE B CB  1 
ATOM   924  C  CG  . PHE A 1 123 ? -30.274 0.530   17.929 1.00 24.04  ? 140 PHE B CG  1 
ATOM   925  C  CD1 . PHE A 1 123 ? -30.363 0.186   16.582 1.00 24.46  ? 140 PHE B CD1 1 
ATOM   926  C  CD2 . PHE A 1 123 ? -31.100 -0.130  18.828 1.00 19.49  ? 140 PHE B CD2 1 
ATOM   927  C  CE1 . PHE A 1 123 ? -31.267 -0.795  16.154 1.00 20.35  ? 140 PHE B CE1 1 
ATOM   928  C  CE2 . PHE A 1 123 ? -31.991 -1.115  18.404 1.00 22.55  ? 140 PHE B CE2 1 
ATOM   929  C  CZ  . PHE A 1 123 ? -32.075 -1.441  17.069 1.00 21.92  ? 140 PHE B CZ  1 
ATOM   930  N  N   . GLN A 1 124 ? -26.996 0.691   15.892 1.00 18.11  ? 141 GLN B N   1 
ATOM   931  C  CA  . GLN A 1 124 ? -26.645 0.848   14.494 1.00 17.85  ? 141 GLN B CA  1 
ATOM   932  C  C   . GLN A 1 124 ? -27.218 -0.293  13.687 1.00 23.33  ? 141 GLN B C   1 
ATOM   933  O  O   . GLN A 1 124 ? -27.377 -1.403  14.189 1.00 19.34  ? 141 GLN B O   1 
ATOM   934  C  CB  . GLN A 1 124 ? -25.137 0.914   14.292 1.00 21.11  ? 141 GLN B CB  1 
ATOM   935  C  CG  . GLN A 1 124 ? -24.485 2.041   15.096 1.00 25.71  ? 141 GLN B CG  1 
ATOM   936  C  CD  . GLN A 1 124 ? -23.023 2.203   14.748 1.00 26.62  ? 141 GLN B CD  1 
ATOM   937  O  OE1 . GLN A 1 124 ? -22.670 2.345   13.578 1.00 25.79  ? 141 GLN B OE1 1 
ATOM   938  N  NE2 . GLN A 1 124 ? -22.168 2.153   15.750 1.00 22.50  ? 141 GLN B NE2 1 
ATOM   939  N  N   . VAL A 1 125 ? -27.570 0.004   12.443 1.00 19.38  ? 142 VAL B N   1 
ATOM   940  C  CA  . VAL A 1 125 ? -28.077 -0.994  11.513 1.00 23.69  ? 142 VAL B CA  1 
ATOM   941  C  C   . VAL A 1 125 ? -27.159 -0.965  10.306 1.00 25.20  ? 142 VAL B C   1 
ATOM   942  O  O   . VAL A 1 125 ? -27.012 0.079   9.666  1.00 25.19  ? 142 VAL B O   1 
ATOM   943  C  CB  . VAL A 1 125 ? -29.531 -0.731  11.098 1.00 27.79  ? 142 VAL B CB  1 
ATOM   944  C  CG1 . VAL A 1 125 ? -29.947 -1.753  10.048 1.00 25.35  ? 142 VAL B CG1 1 
ATOM   945  C  CG2 . VAL A 1 125 ? -30.466 -0.757  12.318 1.00 22.66  ? 142 VAL B CG2 1 
ATOM   946  N  N   . TRP A 1 126 ? -26.495 -2.078  10.031 1.00 22.33  ? 143 TRP B N   1 
ATOM   947  C  CA  . TRP A 1 126 ? -25.551 -2.149  8.923  1.00 24.87  ? 143 TRP B CA  1 
ATOM   948  C  C   . TRP A 1 126 ? -26.109 -3.051  7.836  1.00 28.98  ? 143 TRP B C   1 
ATOM   949  O  O   . TRP A 1 126 ? -26.531 -4.181  8.117  1.00 25.79  ? 143 TRP B O   1 
ATOM   950  C  CB  . TRP A 1 126 ? -24.192 -2.667  9.382  1.00 18.33  ? 143 TRP B CB  1 
ATOM   951  C  CG  . TRP A 1 126 ? -23.394 -1.677  10.138 1.00 24.91  ? 143 TRP B CG  1 
ATOM   952  C  CD1 . TRP A 1 126 ? -23.841 -0.520  10.719 1.00 22.48  ? 143 TRP B CD1 1 
ATOM   953  C  CD2 . TRP A 1 126 ? -21.989 -1.737  10.389 1.00 23.16  ? 143 TRP B CD2 1 
ATOM   954  N  NE1 . TRP A 1 126 ? -22.794 0.136   11.327 1.00 28.41  ? 143 TRP B NE1 1 
ATOM   955  C  CE2 . TRP A 1 126 ? -21.646 -0.587  11.130 1.00 24.52  ? 143 TRP B CE2 1 
ATOM   956  C  CE3 . TRP A 1 126 ? -20.981 -2.643  10.043 1.00 23.14  ? 143 TRP B CE3 1 
ATOM   957  C  CZ2 . TRP A 1 126 ? -20.346 -0.327  11.540 1.00 23.28  ? 143 TRP B CZ2 1 
ATOM   958  C  CZ3 . TRP A 1 126 ? -19.686 -2.392  10.461 1.00 24.43  ? 143 TRP B CZ3 1 
ATOM   959  C  CH2 . TRP A 1 126 ? -19.378 -1.240  11.201 1.00 26.95  ? 143 TRP B CH2 1 
ATOM   960  N  N   . ASP A 1 127 ? -26.114 -2.551  6.606  1.00 26.23  ? 144 ASP B N   1 
ATOM   961  C  CA  . ASP A 1 127 ? -26.459 -3.369  5.456  1.00 26.42  ? 144 ASP B CA  1 
ATOM   962  C  C   . ASP A 1 127 ? -25.243 -4.163  5.007  1.00 26.81  ? 144 ASP B C   1 
ATOM   963  O  O   . ASP A 1 127 ? -24.109 -3.685  5.078  1.00 28.17  ? 144 ASP B O   1 
ATOM   964  C  CB  . ASP A 1 127 ? -26.978 -2.504  4.308  1.00 27.19  ? 144 ASP B CB  1 
ATOM   965  C  CG  . ASP A 1 127 ? -28.347 -1.927  4.587  1.00 34.75  ? 144 ASP B CG  1 
ATOM   966  O  OD1 . ASP A 1 127 ? -28.998 -2.386  5.547  1.00 36.48  ? 144 ASP B OD1 1 
ATOM   967  O  OD2 . ASP A 1 127 ? -28.776 -1.009  3.851  1.00 42.66  ? 144 ASP B OD2 1 
ATOM   968  N  N   . TYR A 1 128 ? -25.480 -5.393  4.564  1.00 23.68  ? 145 TYR B N   1 
ATOM   969  C  CA  . TYR A 1 128 ? -24.387 -6.235  4.112  1.00 29.05  ? 145 TYR B CA  1 
ATOM   970  C  C   . TYR A 1 128 ? -24.902 -7.205  3.061  1.00 30.48  ? 145 TYR B C   1 
ATOM   971  O  O   . TYR A 1 128 ? -26.108 -7.431  2.920  1.00 24.74  ? 145 TYR B O   1 
ATOM   972  C  CB  . TYR A 1 128 ? -23.714 -6.980  5.281  1.00 28.17  ? 145 TYR B CB  1 
ATOM   973  C  CG  . TYR A 1 128 ? -24.436 -8.215  5.760  1.00 21.77  ? 145 TYR B CG  1 
ATOM   974  C  CD1 . TYR A 1 128 ? -25.487 -8.111  6.645  1.00 24.90  ? 145 TYR B CD1 1 
ATOM   975  C  CD2 . TYR A 1 128 ? -24.057 -9.492  5.336  1.00 24.70  ? 145 TYR B CD2 1 
ATOM   976  C  CE1 . TYR A 1 128 ? -26.172 -9.229  7.089  1.00 24.50  ? 145 TYR B CE1 1 
ATOM   977  C  CE2 . TYR A 1 128 ? -24.737 -10.632 5.790  1.00 25.93  ? 145 TYR B CE2 1 
ATOM   978  C  CZ  . TYR A 1 128 ? -25.795 -10.482 6.670  1.00 27.98  ? 145 TYR B CZ  1 
ATOM   979  O  OH  . TYR A 1 128 ? -26.506 -11.571 7.136  1.00 24.44  ? 145 TYR B OH  1 
ATOM   980  N  N   . GLU A 1 129 ? -23.957 -7.755  2.307  1.00 32.20  ? 146 GLU B N   1 
ATOM   981  C  CA  . GLU A 1 129 ? -24.236 -8.739  1.280  1.00 35.82  ? 146 GLU B CA  1 
ATOM   982  C  C   . GLU A 1 129 ? -23.526 -10.021 1.673  1.00 32.38  ? 146 GLU B C   1 
ATOM   983  O  O   . GLU A 1 129 ? -22.512 -9.979  2.378  1.00 26.76  ? 146 GLU B O   1 
ATOM   984  C  CB  . GLU A 1 129 ? -23.730 -8.272  -0.090 1.00 39.90  ? 146 GLU B CB  1 
ATOM   985  C  CG  . GLU A 1 129 ? -24.346 -6.973  -0.580 1.00 50.37  ? 146 GLU B CG  1 
ATOM   986  C  CD  . GLU A 1 129 ? -25.780 -7.123  -1.016 1.00 54.16  ? 146 GLU B CD  1 
ATOM   987  O  OE1 . GLU A 1 129 ? -26.045 -7.929  -1.932 1.00 82.91  ? 146 GLU B OE1 1 
ATOM   988  O  OE2 . GLU A 1 129 ? -26.647 -6.424  -0.448 1.00 58.51  ? 146 GLU B OE2 1 
ATOM   989  N  N   . GLU A 1 130 ? -24.081 -11.157 1.244  1.00 32.70  ? 147 GLU B N   1 
ATOM   990  C  CA  . GLU A 1 130 ? -23.385 -12.436 1.301  1.00 35.10  ? 147 GLU B CA  1 
ATOM   991  C  C   . GLU A 1 130 ? -21.951 -12.275 0.822  1.00 27.57  ? 147 GLU B C   1 
ATOM   992  O  O   . GLU A 1 130 ? -21.705 -11.801 -0.294 1.00 25.97  ? 147 GLU B O   1 
ATOM   993  C  CB  . GLU A 1 130 ? -24.111 -13.467 0.427  1.00 37.03  ? 147 GLU B CB  1 
ATOM   994  C  CG  . GLU A 1 130 ? -25.452 -13.949 0.956  1.00 46.33  ? 147 GLU B CG  1 
ATOM   995  C  CD  . GLU A 1 130 ? -25.331 -15.109 1.928  0.80 53.13  ? 147 GLU B CD  1 
ATOM   996  O  OE1 . GLU A 1 130 ? -24.279 -15.788 1.925  0.87 55.26  ? 147 GLU B OE1 1 
ATOM   997  O  OE2 . GLU A 1 130 ? -26.292 -15.345 2.690  0.75 50.81  ? 147 GLU B OE2 1 
ATOM   998  N  N   . GLY A 1 131 ? -21.007 -12.637 1.678  1.00 23.56  ? 148 GLY B N   1 
ATOM   999  C  CA  . GLY A 1 131 ? -19.597 -12.555 1.361  1.00 29.47  ? 148 GLY B CA  1 
ATOM   1000 C  C   . GLY A 1 131 ? -18.838 -11.500 2.131  1.00 31.36  ? 148 GLY B C   1 
ATOM   1001 O  O   . GLY A 1 131 ? -17.598 -11.513 2.099  1.00 32.26  ? 148 GLY B O   1 
ATOM   1002 N  N   . GLU A 1 132 ? -19.501 -10.571 2.825  1.00 29.76  ? 149 GLU B N   1 
ATOM   1003 C  CA  . GLU A 1 132 ? -18.765 -9.531  3.531  1.00 31.87  ? 149 GLU B CA  1 
ATOM   1004 C  C   . GLU A 1 132 ? -19.092 -9.433  5.016  1.00 29.33  ? 149 GLU B C   1 
ATOM   1005 O  O   . GLU A 1 132 ? -18.618 -8.500  5.669  1.00 25.99  ? 149 GLU B O   1 
ATOM   1006 C  CB  . GLU A 1 132 ? -18.994 -8.162  2.888  1.00 37.77  ? 149 GLU B CB  1 
ATOM   1007 C  CG  . GLU A 1 132 ? -20.404 -7.709  2.954  1.00 31.12  ? 149 GLU B CG  1 
ATOM   1008 C  CD  . GLU A 1 132 ? -20.637 -6.381  2.239  1.00 41.00  ? 149 GLU B CD  1 
ATOM   1009 O  OE1 . GLU A 1 132 ? -19.653 -5.713  1.850  1.00 49.51  ? 149 GLU B OE1 1 
ATOM   1010 O  OE2 . GLU A 1 132 ? -21.814 -6.011  2.065  1.00 30.04  ? 149 GLU B OE2 1 
ATOM   1011 N  N   . VAL A 1 133 ? -19.865 -10.363 5.584  1.00 28.99  ? 150 VAL B N   1 
ATOM   1012 C  CA  . VAL A 1 133 ? -20.244 -10.168 6.978  1.00 26.51  ? 150 VAL B CA  1 
ATOM   1013 C  C   . VAL A 1 133 ? -19.030 -10.285 7.895  1.00 28.37  ? 150 VAL B C   1 
ATOM   1014 O  O   . VAL A 1 133 ? -18.912 -9.538  8.876  1.00 27.07  ? 150 VAL B O   1 
ATOM   1015 C  CB  . VAL A 1 133 ? -21.385 -11.117 7.390  1.00 26.03  ? 150 VAL B CB  1 
ATOM   1016 C  CG1 . VAL A 1 133 ? -20.878 -12.525 7.684  1.00 25.96  ? 150 VAL B CG1 1 
ATOM   1017 C  CG2 . VAL A 1 133 ? -22.078 -10.541 8.606  1.00 24.28  ? 150 VAL B CG2 1 
ATOM   1018 N  N   . GLU A 1 134 ? -18.088 -11.183 7.583  1.00 25.37  ? 151 GLU B N   1 
ATOM   1019 C  CA  . GLU A 1 134 ? -16.901 -11.294 8.430  1.00 23.21  ? 151 GLU B CA  1 
ATOM   1020 C  C   . GLU A 1 134 ? -16.088 -10.003 8.402  1.00 24.35  ? 151 GLU B C   1 
ATOM   1021 O  O   . GLU A 1 134 ? -15.658 -9.505  9.447  1.00 24.47  ? 151 GLU B O   1 
ATOM   1022 C  CB  . GLU A 1 134 ? -16.049 -12.495 8.003  1.00 26.13  ? 151 GLU B CB  1 
ATOM   1023 C  CG  . GLU A 1 134 ? -16.703 -13.815 8.377  1.00 29.75  ? 151 GLU B CG  1 
ATOM   1024 C  CD  . GLU A 1 134 ? -16.234 -14.970 7.521  1.00 41.80  ? 151 GLU B CD  1 
ATOM   1025 O  OE1 . GLU A 1 134 ? -15.758 -14.708 6.397  1.00 46.18  ? 151 GLU B OE1 1 
ATOM   1026 O  OE2 . GLU A 1 134 ? -16.364 -16.136 7.961  1.00 39.44  ? 151 GLU B OE2 1 
ATOM   1027 N  N   . ALA A 1 135 ? -15.880 -9.440  7.208  1.00 24.73  ? 152 ALA B N   1 
ATOM   1028 C  CA  . ALA A 1 135 ? -15.153 -8.176  7.094  1.00 24.00  ? 152 ALA B CA  1 
ATOM   1029 C  C   . ALA A 1 135 ? -15.861 -7.046  7.833  1.00 25.59  ? 152 ALA B C   1 
ATOM   1030 O  O   . ALA A 1 135 ? -15.209 -6.160  8.413  1.00 21.52  ? 152 ALA B O   1 
ATOM   1031 C  CB  . ALA A 1 135 ? -14.982 -7.806  5.623  1.00 27.04  ? 152 ALA B CB  1 
ATOM   1032 N  N   . LEU A 1 136 ? -17.196 -7.023  7.789  1.00 23.06  ? 153 LEU B N   1 
ATOM   1033 C  CA  . LEU A 1 136 ? -17.907 -5.934  8.456  1.00 25.37  ? 153 LEU B CA  1 
ATOM   1034 C  C   . LEU A 1 136 ? -17.857 -6.088  9.968  1.00 24.10  ? 153 LEU B C   1 
ATOM   1035 O  O   . LEU A 1 136 ? -17.692 -5.101  10.691 1.00 22.70  ? 153 LEU B O   1 
ATOM   1036 C  CB  . LEU A 1 136 ? -19.348 -5.862  7.969  1.00 22.13  ? 153 LEU B CB  1 
ATOM   1037 C  CG  . LEU A 1 136 ? -19.424 -5.440  6.504  1.00 32.89  ? 153 LEU B CG  1 
ATOM   1038 C  CD1 . LEU A 1 136 ? -20.850 -5.302  6.072  1.00 28.90  ? 153 LEU B CD1 1 
ATOM   1039 C  CD2 . LEU A 1 136 ? -18.680 -4.117  6.305  1.00 31.44  ? 153 LEU B CD2 1 
ATOM   1040 N  N   . LEU A 1 137 ? -18.007 -7.315  10.465 1.00 19.61  ? 154 LEU B N   1 
ATOM   1041 C  CA  . LEU A 1 137 ? -17.853 -7.551  11.898 1.00 20.99  ? 154 LEU B CA  1 
ATOM   1042 C  C   . LEU A 1 137 ? -16.469 -7.108  12.379 1.00 22.80  ? 154 LEU B C   1 
ATOM   1043 O  O   . LEU A 1 137 ? -16.347 -6.431  13.407 1.00 22.49  ? 154 LEU B O   1 
ATOM   1044 C  CB  . LEU A 1 137 ? -18.097 -9.030  12.196 1.00 18.59  ? 154 LEU B CB  1 
ATOM   1045 C  CG  . LEU A 1 137 ? -19.576 -9.486  12.066 1.00 21.37  ? 154 LEU B CG  1 
ATOM   1046 C  CD1 . LEU A 1 137 ? -19.679 -11.007 12.226 1.00 18.18  ? 154 LEU B CD1 1 
ATOM   1047 C  CD2 . LEU A 1 137 ? -20.515 -8.768  13.040 1.00 16.05  ? 154 LEU B CD2 1 
ATOM   1048 N  N   . ASP A 1 138 ? -15.416 -7.452  11.629 1.00 24.12  ? 155 ASP B N   1 
ATOM   1049 C  CA  . ASP A 1 138 ? -14.078 -6.956  11.945 1.00 22.89  ? 155 ASP B CA  1 
ATOM   1050 C  C   . ASP A 1 138 ? -14.074 -5.433  12.034 1.00 24.82  ? 155 ASP B C   1 
ATOM   1051 O  O   . ASP A 1 138 ? -13.496 -4.848  12.956 1.00 24.59  ? 155 ASP B O   1 
ATOM   1052 C  CB  . ASP A 1 138 ? -13.064 -7.379  10.875 1.00 24.32  ? 155 ASP B CB  1 
ATOM   1053 C  CG  . ASP A 1 138 ? -12.775 -8.852  10.871 1.00 29.91  ? 155 ASP B CG  1 
ATOM   1054 O  OD1 . ASP A 1 138 ? -13.171 -9.557  11.823 1.00 27.24  ? 155 ASP B OD1 1 
ATOM   1055 O  OD2 . ASP A 1 138 ? -12.123 -9.304  9.906  1.00 34.04  ? 155 ASP B OD2 1 
ATOM   1056 N  N   . ARG A 1 139 ? -14.685 -4.778  11.052 1.00 22.77  ? 156 ARG B N   1 
ATOM   1057 C  CA  . ARG A 1 139 ? -14.679 -3.321  11.030 1.00 23.17  ? 156 ARG B CA  1 
ATOM   1058 C  C   . ARG A 1 139 ? -15.372 -2.763  12.264 1.00 25.40  ? 156 ARG B C   1 
ATOM   1059 O  O   . ARG A 1 139 ? -14.878 -1.820  12.887 1.00 25.81  ? 156 ARG B O   1 
ATOM   1060 C  CB  . ARG A 1 139 ? -15.362 -2.815  9.767  1.00 24.22  ? 156 ARG B CB  1 
ATOM   1061 C  CG  . ARG A 1 139 ? -15.490 -1.294  9.748  1.00 31.23  ? 156 ARG B CG  1 
ATOM   1062 C  CD  . ARG A 1 139 ? -16.285 -0.805  8.561  1.00 32.77  ? 156 ARG B CD  1 
ATOM   1063 N  NE  . ARG A 1 139 ? -15.714 -1.261  7.303  1.00 37.06  ? 156 ARG B NE  1 
ATOM   1064 C  CZ  . ARG A 1 139 ? -16.314 -1.138  6.128  1.00 37.39  ? 156 ARG B CZ  1 
ATOM   1065 N  NH1 . ARG A 1 139 ? -17.471 -0.512  6.008  1.00 38.43  ? 156 ARG B NH1 1 
ATOM   1066 N  NH2 . ARG A 1 139 ? -15.736 -1.650  5.047  1.00 41.03  ? 156 ARG B NH2 1 
ATOM   1067 N  N   . TYR A 1 140 ? -16.512 -3.347  12.638 1.00 21.27  ? 157 TYR B N   1 
ATOM   1068 C  CA  . TYR A 1 140 ? -17.243 -2.878  13.810 1.00 22.47  ? 157 TYR B CA  1 
ATOM   1069 C  C   . TYR A 1 140 ? -16.431 -3.057  15.087 1.00 22.28  ? 157 TYR B C   1 
ATOM   1070 O  O   . TYR A 1 140 ? -16.355 -2.151  15.920 1.00 20.51  ? 157 TYR B O   1 
ATOM   1071 C  CB  . TYR A 1 140 ? -18.585 -3.615  13.921 1.00 19.01  ? 157 TYR B CB  1 
ATOM   1072 C  CG  . TYR A 1 140 ? -19.404 -3.135  15.094 1.00 20.48  ? 157 TYR B CG  1 
ATOM   1073 C  CD1 . TYR A 1 140 ? -20.238 -2.032  14.971 1.00 19.68  ? 157 TYR B CD1 1 
ATOM   1074 C  CD2 . TYR A 1 140 ? -19.348 -3.789  16.327 1.00 24.33  ? 157 TYR B CD2 1 
ATOM   1075 C  CE1 . TYR A 1 140 ? -20.983 -1.562  16.041 1.00 17.62  ? 157 TYR B CE1 1 
ATOM   1076 C  CE2 . TYR A 1 140 ? -20.090 -3.327  17.421 1.00 18.87  ? 157 TYR B CE2 1 
ATOM   1077 C  CZ  . TYR A 1 140 ? -20.910 -2.215  17.258 1.00 23.40  ? 157 TYR B CZ  1 
ATOM   1078 O  OH  . TYR A 1 140 ? -21.654 -1.747  18.313 1.00 19.45  ? 157 TYR B OH  1 
ATOM   1079 N  N   . PHE A 1 141 ? -15.838 -4.237  15.282 1.00 24.14  ? 158 PHE B N   1 
ATOM   1080 C  CA  . PHE A 1 141 ? -15.238 -4.540  16.578 1.00 25.14  ? 158 PHE B CA  1 
ATOM   1081 C  C   . PHE A 1 141 ? -13.795 -4.063  16.686 1.00 33.75  ? 158 PHE B C   1 
ATOM   1082 O  O   . PHE A 1 141 ? -13.297 -3.887  17.803 1.00 32.05  ? 158 PHE B O   1 
ATOM   1083 C  CB  . PHE A 1 141 ? -15.341 -6.038  16.858 1.00 23.63  ? 158 PHE B CB  1 
ATOM   1084 C  CG  . PHE A 1 141 ? -16.720 -6.450  17.310 1.00 22.49  ? 158 PHE B CG  1 
ATOM   1085 C  CD1 . PHE A 1 141 ? -17.176 -6.130  18.578 1.00 22.93  ? 158 PHE B CD1 1 
ATOM   1086 C  CD2 . PHE A 1 141 ? -17.594 -7.058  16.422 1.00 19.16  ? 158 PHE B CD2 1 
ATOM   1087 C  CE1 . PHE A 1 141 ? -18.468 -6.455  18.978 1.00 25.19  ? 158 PHE B CE1 1 
ATOM   1088 C  CE2 . PHE A 1 141 ? -18.906 -7.391  16.817 1.00 18.46  ? 158 PHE B CE2 1 
ATOM   1089 C  CZ  . PHE A 1 141 ? -19.333 -7.090  18.095 1.00 21.35  ? 158 PHE B CZ  1 
ATOM   1090 N  N   . GLU A 1 142 ? -13.132 -3.821  15.564 1.00 29.17  ? 159 GLU B N   1 
ATOM   1091 C  CA  . GLU A 1 142 ? -11.733 -3.325  15.587 1.00 33.84  ? 159 GLU B CA  1 
ATOM   1092 C  C   . GLU A 1 142 ? -11.779 -1.821  15.876 1.00 38.75  ? 159 GLU B C   1 
ATOM   1093 O  O   . GLU A 1 142 ? -10.747 -1.259  16.246 1.00 44.57  ? 159 GLU B O   1 
ATOM   1094 C  CB  . GLU A 1 142 ? -10.995 -3.710  14.303 1.00 29.99  ? 159 GLU B CB  1 
ATOM   1095 C  CG  . GLU A 1 142 ? -10.456 -5.136  14.346 1.00 33.52  ? 159 GLU B CG  1 
ATOM   1096 C  CD  . GLU A 1 142 ? -10.081 -5.726  13.001 0.62 37.85  ? 159 GLU B CD  1 
ATOM   1097 O  OE1 . GLU A 1 142 ? -9.954  -4.953  12.031 0.62 39.68  ? 159 GLU B OE1 1 
ATOM   1098 O  OE2 . GLU A 1 142 ? -9.915  -6.961  12.928 0.63 38.35  ? 159 GLU B OE2 1 
ATOM   1099 N  N   . ALA A 1 143 ? -12.956 -1.219  15.775 1.00 39.91  ? 160 ALA B N   1 
ATOM   1100 C  CA  . ALA A 1 143 ? -13.106 0.209   16.111 1.00 43.04  ? 160 ALA B CA  1 
ATOM   1101 C  C   . ALA A 1 143 ? -13.769 0.352   17.478 1.00 56.46  ? 160 ALA B C   1 
ATOM   1102 O  O   . ALA A 1 143 ? -13.462 1.329   18.182 1.00 58.63  ? 160 ALA B O   1 
ATOM   1103 C  CB  . ALA A 1 143 ? -13.948 0.866   15.064 1.00 43.27  ? 160 ALA B CB  1 
ATOM   1104 N  N   . ASP A 1 144 ? -14.684 -0.564  17.823 1.00 30.00  ? 161 ASP B N   1 
ATOM   1105 C  CA  . ASP A 1 144 ? -15.448 -0.443  19.098 1.00 30.00  ? 161 ASP B CA  1 
ATOM   1106 C  C   . ASP A 1 144 ? -15.508 -1.799  19.824 1.00 30.00  ? 161 ASP B C   1 
ATOM   1107 O  O   . ASP A 1 144 ? -16.610 -2.365  19.949 1.00 30.00  ? 161 ASP B O   1 
ATOM   1108 C  CB  . ASP A 1 144 ? -16.812 0.165   18.824 1.00 30.00  ? 161 ASP B CB  1 
ATOM   1109 N  N   . PRO A 1 145 ? -14.374 -2.334  20.312 1.00 30.00  ? 162 PRO B N   1 
ATOM   1110 C  CA  . PRO A 1 145 ? -14.369 -3.600  21.026 1.00 30.00  ? 162 PRO B CA  1 
ATOM   1111 C  C   . PRO A 1 145 ? -15.543 -3.742  22.007 1.00 30.00  ? 162 PRO B C   1 
ATOM   1112 O  O   . PRO A 1 145 ? -16.182 -4.812  22.119 1.00 30.00  ? 162 PRO B O   1 
ATOM   1113 C  CB  . PRO A 1 145 ? -13.031 -3.523  21.729 1.00 30.00  ? 162 PRO B CB  1 
ATOM   1114 C  CG  . PRO A 1 145 ? -12.149 -2.812  20.747 1.00 30.00  ? 162 PRO B CG  1 
ATOM   1115 C  CD  . PRO A 1 145 ? -13.058 -1.716  20.238 1.00 30.00  ? 162 PRO B CD  1 
ATOM   1116 N  N   . MET B 1 2   ? -59.482 8.974   33.113 1.00 89.27  ? 19  MET A N   1 
ATOM   1117 C  CA  . MET B 1 2   ? -60.243 8.862   31.839 1.00 91.80  ? 19  MET A CA  1 
ATOM   1118 C  C   . MET B 1 2   ? -60.277 7.386   31.430 1.00 85.90  ? 19  MET A C   1 
ATOM   1119 O  O   . MET B 1 2   ? -60.109 6.526   32.305 1.00 85.24  ? 19  MET A O   1 
ATOM   1120 C  CB  . MET B 1 2   ? -59.590 9.683   30.721 1.00 92.90  ? 19  MET A CB  1 
ATOM   1121 C  CG  . MET B 1 2   ? -60.563 10.374  29.789 1.00 98.49  ? 19  MET A CG  1 
ATOM   1122 S  SD  . MET B 1 2   ? -59.689 11.449  28.636 1.00 103.09 ? 19  MET A SD  1 
ATOM   1123 C  CE  . MET B 1 2   ? -61.058 12.051  27.639 1.00 82.99  ? 19  MET A CE  1 
ATOM   1124 N  N   . ARG B 1 3   ? -60.465 7.114   30.144 1.00 82.60  ? 20  ARG A N   1 
ATOM   1125 C  CA  . ARG B 1 3   ? -60.571 5.730   29.705 1.00 68.45  ? 20  ARG A CA  1 
ATOM   1126 C  C   . ARG B 1 3   ? -59.215 5.027   29.804 1.00 56.84  ? 20  ARG A C   1 
ATOM   1127 O  O   . ARG B 1 3   ? -58.163 5.662   29.687 1.00 57.18  ? 20  ARG A O   1 
ATOM   1128 C  CB  . ARG B 1 3   ? -61.069 5.682   28.259 1.00 64.79  ? 20  ARG A CB  1 
ATOM   1129 C  CG  . ARG B 1 3   ? -62.502 6.161   28.067 1.00 72.07  ? 20  ARG A CG  1 
ATOM   1130 C  CD  . ARG B 1 3   ? -63.534 5.148   28.540 1.00 77.04  ? 20  ARG A CD  1 
ATOM   1131 N  NE  . ARG B 1 3   ? -63.831 4.172   27.493 1.00 73.00  ? 20  ARG A NE  1 
ATOM   1132 C  CZ  . ARG B 1 3   ? -64.424 3.003   27.691 1.00 65.01  ? 20  ARG A CZ  1 
ATOM   1133 N  NH1 . ARG B 1 3   ? -64.745 2.584   28.906 1.00 61.96  ? 20  ARG A NH1 1 
ATOM   1134 N  NH2 . ARG B 1 3   ? -64.707 2.238   26.642 1.00 56.09  ? 20  ARG A NH2 1 
ATOM   1135 N  N   . PRO B 1 4   ? -59.211 3.715   30.045 1.00 52.98  ? 21  PRO A N   1 
ATOM   1136 C  CA  . PRO B 1 4   ? -57.971 2.935   29.900 1.00 43.68  ? 21  PRO A CA  1 
ATOM   1137 C  C   . PRO B 1 4   ? -57.358 3.132   28.521 1.00 39.03  ? 21  PRO A C   1 
ATOM   1138 O  O   . PRO B 1 4   ? -58.047 3.078   27.503 1.00 37.62  ? 21  PRO A O   1 
ATOM   1139 C  CB  . PRO B 1 4   ? -58.456 1.495   30.088 1.00 41.38  ? 21  PRO A CB  1 
ATOM   1140 C  CG  . PRO B 1 4   ? -59.560 1.627   31.067 1.00 49.23  ? 21  PRO A CG  1 
ATOM   1141 C  CD  . PRO B 1 4   ? -60.254 2.937   30.755 1.00 53.84  ? 21  PRO A CD  1 
ATOM   1142 N  N   . ALA B 1 5   ? -56.054 3.369   28.491 1.00 34.65  ? 22  ALA A N   1 
ATOM   1143 C  CA  . ALA B 1 5   ? -55.327 3.506   27.237 1.00 31.92  ? 22  ALA A CA  1 
ATOM   1144 C  C   . ALA B 1 5   ? -54.814 2.137   26.813 1.00 26.76  ? 22  ALA A C   1 
ATOM   1145 O  O   . ALA B 1 5   ? -54.108 1.471   27.576 1.00 28.22  ? 22  ALA A O   1 
ATOM   1146 C  CB  . ALA B 1 5   ? -54.170 4.489   27.371 1.00 30.76  ? 22  ALA A CB  1 
ATOM   1147 N  N   . LEU B 1 6   ? -55.160 1.729   25.596 1.00 21.80  ? 23  LEU A N   1 
ATOM   1148 C  CA  . LEU B 1 6   ? -54.792 0.426   25.065 1.00 22.45  ? 23  LEU A CA  1 
ATOM   1149 C  C   . LEU B 1 6   ? -53.884 0.614   23.861 1.00 23.58  ? 23  LEU A C   1 
ATOM   1150 O  O   . LEU B 1 6   ? -54.136 1.474   23.006 1.00 28.60  ? 23  LEU A O   1 
ATOM   1151 C  CB  . LEU B 1 6   ? -56.040 -0.367  24.669 1.00 23.42  ? 23  LEU A CB  1 
ATOM   1152 C  CG  . LEU B 1 6   ? -57.104 -0.511  25.764 1.00 20.14  ? 23  LEU A CG  1 
ATOM   1153 C  CD1 . LEU B 1 6   ? -58.331 -1.251  25.229 1.00 27.99  ? 23  LEU A CD1 1 
ATOM   1154 C  CD2 . LEU B 1 6   ? -56.584 -1.201  27.029 1.00 23.77  ? 23  LEU A CD2 1 
ATOM   1155 N  N   . TYR B 1 7   ? -52.814 -0.169  23.800 1.00 18.72  ? 24  TYR A N   1 
ATOM   1156 C  CA  . TYR B 1 7   ? -51.895 -0.124  22.671 1.00 20.31  ? 24  TYR A CA  1 
ATOM   1157 C  C   . TYR B 1 7   ? -51.932 -1.479  21.995 1.00 20.43  ? 24  TYR A C   1 
ATOM   1158 O  O   . TYR B 1 7   ? -51.711 -2.494  22.660 1.00 23.31  ? 24  TYR A O   1 
ATOM   1159 C  CB  . TYR B 1 7   ? -50.466 0.216   23.114 1.00 21.33  ? 24  TYR A CB  1 
ATOM   1160 C  CG  . TYR B 1 7   ? -49.520 0.425   21.951 1.00 24.04  ? 24  TYR A CG  1 
ATOM   1161 C  CD1 . TYR B 1 7   ? -48.888 -0.652  21.336 1.00 25.56  ? 24  TYR A CD1 1 
ATOM   1162 C  CD2 . TYR B 1 7   ? -49.277 1.694   21.453 1.00 25.98  ? 24  TYR A CD2 1 
ATOM   1163 C  CE1 . TYR B 1 7   ? -48.036 -0.467  20.261 1.00 25.21  ? 24  TYR A CE1 1 
ATOM   1164 C  CE2 . TYR B 1 7   ? -48.429 1.890   20.381 1.00 27.33  ? 24  TYR A CE2 1 
ATOM   1165 C  CZ  . TYR B 1 7   ? -47.810 0.811   19.786 1.00 26.54  ? 24  TYR A CZ  1 
ATOM   1166 O  OH  . TYR B 1 7   ? -46.963 1.008   18.712 1.00 29.73  ? 24  TYR A OH  1 
ATOM   1167 N  N   . PHE B 1 8   ? -52.206 -1.509  20.692 1.00 17.78  ? 25  PHE A N   1 
ATOM   1168 C  CA  . PHE B 1 8   ? -52.309 -2.781  19.981 1.00 23.14  ? 25  PHE A CA  1 
ATOM   1169 C  C   . PHE B 1 8   ? -51.159 -2.931  18.987 1.00 26.23  ? 25  PHE A C   1 
ATOM   1170 O  O   . PHE B 1 8   ? -50.870 -2.002  18.219 1.00 21.52  ? 25  PHE A O   1 
ATOM   1171 C  CB  . PHE B 1 8   ? -53.661 -2.921  19.271 1.00 20.22  ? 25  PHE A CB  1 
ATOM   1172 C  CG  . PHE B 1 8   ? -53.757 -4.149  18.386 1.00 23.58  ? 25  PHE A CG  1 
ATOM   1173 C  CD1 . PHE B 1 8   ? -53.772 -5.414  18.941 1.00 19.90  ? 25  PHE A CD1 1 
ATOM   1174 C  CD2 . PHE B 1 8   ? -53.857 -4.037  17.016 1.00 24.45  ? 25  PHE A CD2 1 
ATOM   1175 C  CE1 . PHE B 1 8   ? -53.855 -6.553  18.138 1.00 21.55  ? 25  PHE A CE1 1 
ATOM   1176 C  CE2 . PHE B 1 8   ? -53.953 -5.157  16.218 1.00 27.53  ? 25  PHE A CE2 1 
ATOM   1177 C  CZ  . PHE B 1 8   ? -53.953 -6.425  16.779 1.00 20.55  ? 25  PHE A CZ  1 
ATOM   1178 N  N   . CYS B 1 9   ? -50.510 -4.106  19.013 1.00 23.33  ? 26  CYS A N   1 
ATOM   1179 C  CA  . CYS B 1 9   ? -49.376 -4.448  18.152 1.00 26.67  ? 26  CYS A CA  1 
ATOM   1180 C  C   . CYS B 1 9   ? -49.796 -5.521  17.154 1.00 27.70  ? 26  CYS A C   1 
ATOM   1181 O  O   . CYS B 1 9   ? -50.177 -6.632  17.549 1.00 27.29  ? 26  CYS A O   1 
ATOM   1182 C  CB  . CYS B 1 9   ? -48.179 -4.969  18.962 1.00 26.83  ? 26  CYS A CB  1 
ATOM   1183 S  SG  . CYS B 1 9   ? -47.754 -4.126  20.484 1.00 29.17  ? 26  CYS A SG  1 
ATOM   1184 N  N   . GLY B 1 10  ? -49.689 -5.216  15.866 1.00 27.22  ? 27  GLY A N   1 
ATOM   1185 C  CA  . GLY B 1 10  ? -50.050 -6.234  14.895 1.00 35.34  ? 27  GLY A CA  1 
ATOM   1186 C  C   . GLY B 1 10  ? -49.387 -5.965  13.567 1.00 43.12  ? 27  GLY A C   1 
ATOM   1187 O  O   . GLY B 1 10  ? -48.815 -4.898  13.335 1.00 44.82  ? 27  GLY A O   1 
ATOM   1188 N  N   . SER B 1 11  ? -49.471 -6.957  12.689 1.00 55.25  ? 28  SER A N   1 
ATOM   1189 C  CA  . SER B 1 11  ? -48.804 -6.880  11.391 1.00 61.79  ? 28  SER A CA  1 
ATOM   1190 C  C   . SER B 1 11  ? -49.770 -6.505  10.273 1.00 58.68  ? 28  SER A C   1 
ATOM   1191 O  O   . SER B 1 11  ? -49.346 -6.028  9.219  1.00 68.97  ? 28  SER A O   1 
ATOM   1192 C  CB  . SER B 1 11  ? -48.122 -8.210  11.073 1.00 58.77  ? 28  SER A CB  1 
ATOM   1193 O  OG  . SER B 1 11  ? -47.569 -8.783  12.245 1.00 49.93  ? 28  SER A OG  1 
ATOM   1194 N  N   . GLY B 1 15  ? -52.287 -10.182 4.550  1.00 85.79  ? 32  GLY A N   1 
ATOM   1195 C  CA  . GLY B 1 15  ? -53.175 -11.332 4.310  1.00 85.02  ? 32  GLY A CA  1 
ATOM   1196 C  C   . GLY B 1 15  ? -54.600 -10.987 4.661  1.00 80.40  ? 32  GLY A C   1 
ATOM   1197 O  O   . GLY B 1 15  ? -54.793 -10.199 5.597  1.00 78.44  ? 32  GLY A O   1 
ATOM   1198 N  N   . ARG B 1 16  ? -55.561 -11.543 3.926  1.00 79.50  ? 33  ARG A N   1 
ATOM   1199 C  CA  . ARG B 1 16  ? -56.991 -11.230 4.170  1.00 76.53  ? 33  ARG A CA  1 
ATOM   1200 C  C   . ARG B 1 16  ? -57.364 -11.577 5.617  1.00 73.16  ? 33  ARG A C   1 
ATOM   1201 O  O   . ARG B 1 16  ? -57.906 -10.702 6.306  1.00 69.37  ? 33  ARG A O   1 
ATOM   1202 C  CB  . ARG B 1 16  ? -57.877 -12.008 3.194  1.00 30.00  ? 33  ARG A CB  1 
ATOM   1203 N  N   . GLU B 1 17  ? -57.117 -12.823 6.039  1.00 74.94  ? 34  GLU A N   1 
ATOM   1204 C  CA  . GLU B 1 17  ? -57.509 -13.255 7.402  1.00 67.99  ? 34  GLU A CA  1 
ATOM   1205 C  C   . GLU B 1 17  ? -56.847 -12.306 8.390  1.00 66.24  ? 34  GLU A C   1 
ATOM   1206 O  O   . GLU B 1 17  ? -57.522 -11.871 9.328  1.00 52.07  ? 34  GLU A O   1 
ATOM   1207 C  CB  . GLU B 1 17  ? -57.028 -14.662 7.744  1.00 30.00  ? 34  GLU A CB  1 
ATOM   1208 N  N   . ASP B 1 18  ? -55.579 -11.987 8.139  1.00 69.30  ? 35  ASP A N   1 
ATOM   1209 C  CA  . ASP B 1 18  ? -54.808 -11.144 9.087  1.00 67.21  ? 35  ASP A CA  1 
ATOM   1210 C  C   . ASP B 1 18  ? -55.432 -9.744  9.157  1.00 58.63  ? 35  ASP A C   1 
ATOM   1211 O  O   . ASP B 1 18  ? -55.655 -9.266  10.282 1.00 49.43  ? 35  ASP A O   1 
ATOM   1212 C  CB  . ASP B 1 18  ? -53.328 -11.213 8.746  1.00 30.00  ? 35  ASP A CB  1 
ATOM   1213 N  N   . ARG B 1 19  ? -55.722 -9.125  8.014  1.00 58.81  ? 36  ARG A N   1 
ATOM   1214 C  CA  . ARG B 1 19  ? -56.249 -7.737  8.018  1.00 57.71  ? 36  ARG A CA  1 
ATOM   1215 C  C   . ARG B 1 19  ? -57.597 -7.695  8.743  1.00 47.17  ? 36  ARG A C   1 
ATOM   1216 O  O   . ARG B 1 19  ? -57.761 -6.834  9.609  1.00 37.61  ? 36  ARG A O   1 
ATOM   1217 C  CB  . ARG B 1 19  ? -56.407 -7.176  6.604  1.00 30.00  ? 36  ARG A CB  1 
ATOM   1218 N  N   . THR B 1 20  ? -58.515 -8.597  8.391  1.00 49.56  ? 37  THR A N   1 
ATOM   1219 C  CA  . THR B 1 20  ? -59.867 -8.595  8.995  1.00 41.54  ? 37  THR A CA  1 
ATOM   1220 C  C   . THR B 1 20  ? -59.758 -8.861  10.477 1.00 31.65  ? 37  THR A C   1 
ATOM   1221 O  O   . THR B 1 20  ? -60.485 -8.221  11.239 1.00 34.36  ? 37  THR A O   1 
ATOM   1222 C  CB  . THR B 1 20  ? -60.748 -9.614  8.274  1.00 42.26  ? 37  THR A CB  1 
ATOM   1223 O  OG1 . THR B 1 20  ? -60.034 -10.844 8.308  1.00 53.25  ? 37  THR A OG1 1 
ATOM   1224 C  CG2 . THR B 1 20  ? -61.022 -9.211  6.837  1.00 50.36  ? 37  THR A CG2 1 
ATOM   1225 N  N   . LEU B 1 21  ? -58.870 -9.770  10.869 1.00 34.67  ? 38  LEU A N   1 
ATOM   1226 C  CA  . LEU B 1 21  ? -58.661 -10.078 12.306 1.00 35.00  ? 38  LEU A CA  1 
ATOM   1227 C  C   . LEU B 1 21  ? -58.121 -8.828  13.019 1.00 33.19  ? 38  LEU A C   1 
ATOM   1228 O  O   . LEU B 1 21  ? -58.604 -8.532  14.108 1.00 29.18  ? 38  LEU A O   1 
ATOM   1229 C  CB  . LEU B 1 21  ? -57.724 -11.268 12.451 1.00 33.92  ? 38  LEU A CB  1 
ATOM   1230 C  CG  . LEU B 1 21  ? -58.110 -12.338 13.472 1.00 37.97  ? 38  LEU A CG  1 
ATOM   1231 C  CD1 . LEU B 1 21  ? -59.596 -12.610 13.445 1.00 30.64  ? 38  LEU A CD1 1 
ATOM   1232 C  CD2 . LEU B 1 21  ? -57.347 -13.579 13.077 1.00 37.18  ? 38  LEU A CD2 1 
ATOM   1233 N  N   . TYR B 1 22  ? -57.158 -8.138  12.411 1.00 34.11  ? 39  TYR A N   1 
ATOM   1234 C  CA  . TYR B 1 22  ? -56.613 -6.881  12.995 1.00 30.36  ? 39  TYR A CA  1 
ATOM   1235 C  C   . TYR B 1 22  ? -57.782 -5.939  13.196 1.00 29.17  ? 39  TYR A C   1 
ATOM   1236 O  O   . TYR B 1 22  ? -57.981 -5.416  14.292 1.00 29.27  ? 39  TYR A O   1 
ATOM   1237 C  CB  . TYR B 1 22  ? -55.517 -6.344  12.069 1.00 30.79  ? 39  TYR A CB  1 
ATOM   1238 C  CG  . TYR B 1 22  ? -54.824 -5.047  12.458 1.00 41.12  ? 39  TYR A CG  1 
ATOM   1239 C  CD1 . TYR B 1 22  ? -55.489 -3.828  12.408 1.00 41.06  ? 39  TYR A CD1 1 
ATOM   1240 C  CD2 . TYR B 1 22  ? -53.488 -5.037  12.838 1.00 42.00  ? 39  TYR A CD2 1 
ATOM   1241 C  CE1 . TYR B 1 22  ? -54.858 -2.646  12.754 1.00 33.22  ? 39  TYR A CE1 1 
ATOM   1242 C  CE2 . TYR B 1 22  ? -52.845 -3.861  13.183 1.00 39.56  ? 39  TYR A CE2 1 
ATOM   1243 C  CZ  . TYR B 1 22  ? -53.533 -2.663  13.143 1.00 40.84  ? 39  TYR A CZ  1 
ATOM   1244 O  OH  . TYR B 1 22  ? -52.915 -1.498  13.483 1.00 40.40  ? 39  TYR A OH  1 
ATOM   1245 N  N   . GLU B 1 23  ? -58.566 -5.764  12.132 1.00 31.86  ? 40  GLU A N   1 
ATOM   1246 C  CA  . GLU B 1 23  ? -59.694 -4.847  12.245 1.00 27.56  ? 40  GLU A CA  1 
ATOM   1247 C  C   . GLU B 1 23  ? -60.664 -5.287  13.333 1.00 28.57  ? 40  GLU A C   1 
ATOM   1248 O  O   . GLU B 1 23  ? -61.176 -4.452  14.091 1.00 25.60  ? 40  GLU A O   1 
ATOM   1249 C  CB  . GLU B 1 23  ? -60.406 -4.739  10.896 1.00 34.39  ? 40  GLU A CB  1 
ATOM   1250 C  CG  . GLU B 1 23  ? -59.545 -4.114  9.792  1.00 50.03  ? 40  GLU A CG  1 
ATOM   1251 C  CD  . GLU B 1 23  ? -60.276 -3.976  8.461  1.00 64.03  ? 40  GLU A CD  1 
ATOM   1252 O  OE1 . GLU B 1 23  ? -59.667 -3.453  7.499  1.00 66.77  ? 40  GLU A OE1 1 
ATOM   1253 O  OE2 . GLU B 1 23  ? -61.452 -4.395  8.375  1.00 64.25  ? 40  GLU A OE2 1 
ATOM   1254 N  N   . ARG B 1 24  ? -60.947 -6.596  13.413 1.00 26.78  ? 41  ARG A N   1 
ATOM   1255 C  CA  . ARG B 1 24  ? -61.866 -7.104  14.430 1.00 24.61  ? 41  ARG A CA  1 
ATOM   1256 C  C   . ARG B 1 24  ? -61.326 -6.851  15.831 1.00 24.31  ? 41  ARG A C   1 
ATOM   1257 O  O   . ARG B 1 24  ? -62.078 -6.486  16.744 1.00 25.38  ? 41  ARG A O   1 
ATOM   1258 C  CB  . ARG B 1 24  ? -62.117 -8.610  14.212 1.00 24.71  ? 41  ARG A CB  1 
ATOM   1259 C  CG  . ARG B 1 24  ? -63.137 -8.944  13.118 1.00 29.45  ? 41  ARG A CG  1 
ATOM   1260 C  CD  . ARG B 1 24  ? -63.217 -10.446 12.831 1.00 26.75  ? 41  ARG A CD  1 
ATOM   1261 N  NE  . ARG B 1 24  ? -63.647 -11.271 13.958 1.00 23.73  ? 41  ARG A NE  1 
ATOM   1262 C  CZ  . ARG B 1 24  ? -63.473 -12.587 14.012 1.00 29.43  ? 41  ARG A CZ  1 
ATOM   1263 N  NH1 . ARG B 1 24  ? -62.862 -13.242 13.037 1.00 23.35  ? 41  ARG A NH1 1 
ATOM   1264 N  NH2 . ARG B 1 24  ? -63.919 -13.263 15.071 1.00 22.31  ? 41  ARG A NH2 1 
ATOM   1265 N  N   . ILE B 1 25  ? -60.022 -7.046  16.021 1.00 21.06  ? 42  ILE A N   1 
ATOM   1266 C  CA  . ILE B 1 25  ? -59.436 -6.906  17.348 1.00 21.60  ? 42  ILE A CA  1 
ATOM   1267 C  C   . ILE B 1 25  ? -59.453 -5.450  17.784 1.00 23.07  ? 42  ILE A C   1 
ATOM   1268 O  O   . ILE B 1 25  ? -59.841 -5.137  18.914 1.00 22.84  ? 42  ILE A O   1 
ATOM   1269 C  CB  . ILE B 1 25  ? -58.006 -7.469  17.365 1.00 21.89  ? 42  ILE A CB  1 
ATOM   1270 C  CG1 . ILE B 1 25  ? -58.053 -9.001  17.269 1.00 22.82  ? 42  ILE A CG1 1 
ATOM   1271 C  CG2 . ILE B 1 25  ? -57.287 -7.019  18.634 1.00 24.77  ? 42  ILE A CG2 1 
ATOM   1272 C  CD1 . ILE B 1 25  ? -56.699 -9.629  17.043 1.00 24.48  ? 42  ILE A CD1 1 
ATOM   1273 N  N   . VAL B 1 26  ? -58.998 -4.548  16.906 1.00 22.36  ? 43  VAL A N   1 
ATOM   1274 C  CA  . VAL B 1 26  ? -59.006 -3.114  17.219 1.00 21.17  ? 43  VAL A CA  1 
ATOM   1275 C  C   . VAL B 1 26  ? -60.424 -2.657  17.533 1.00 24.05  ? 43  VAL A C   1 
ATOM   1276 O  O   . VAL B 1 26  ? -60.670 -1.964  18.530 1.00 22.82  ? 43  VAL A O   1 
ATOM   1277 C  CB  . VAL B 1 26  ? -58.400 -2.308  16.057 1.00 25.68  ? 43  VAL A CB  1 
ATOM   1278 C  CG1 . VAL B 1 26  ? -58.733 -0.828  16.192 1.00 28.99  ? 43  VAL A CG1 1 
ATOM   1279 C  CG2 . VAL B 1 26  ? -56.891 -2.517  15.997 1.00 29.87  ? 43  VAL A CG2 1 
ATOM   1280 N  N   . SER B 1 27  ? -61.392 -3.086  16.716 1.00 24.41  ? 44  SER A N   1 
ATOM   1281 C  CA  A SER B 1 27  ? -62.780 -2.700  16.966 0.43 25.39  ? 44  SER A CA  1 
ATOM   1282 C  CA  B SER B 1 27  ? -62.781 -2.711  16.960 0.57 25.38  ? 44  SER A CA  1 
ATOM   1283 C  C   . SER B 1 27  ? -63.238 -3.148  18.347 1.00 25.11  ? 44  SER A C   1 
ATOM   1284 O  O   . SER B 1 27  ? -63.828 -2.362  19.099 1.00 24.41  ? 44  SER A O   1 
ATOM   1285 C  CB  A SER B 1 27  ? -63.702 -3.265  15.886 0.43 25.76  ? 44  SER A CB  1 
ATOM   1286 C  CB  B SER B 1 27  ? -63.674 -3.314  15.881 0.57 25.77  ? 44  SER A CB  1 
ATOM   1287 O  OG  A SER B 1 27  ? -63.503 -2.603  14.653 0.43 25.61  ? 44  SER A OG  1 
ATOM   1288 O  OG  B SER B 1 27  ? -64.928 -2.679  15.870 0.57 26.86  ? 44  SER A OG  1 
ATOM   1289 N  N   . ARG B 1 28  ? -62.961 -4.402  18.713 1.00 21.96  ? 45  ARG A N   1 
ATOM   1290 C  CA  . ARG B 1 28  ? -63.459 -4.884  19.999 1.00 22.39  ? 45  ARG A CA  1 
ATOM   1291 C  C   . ARG B 1 28  ? -62.737 -4.217  21.165 1.00 22.74  ? 45  ARG A C   1 
ATOM   1292 O  O   . ARG B 1 28  ? -63.346 -3.965  22.216 1.00 21.36  ? 45  ARG A O   1 
ATOM   1293 C  CB  . ARG B 1 28  ? -63.331 -6.400  20.086 1.00 24.37  ? 45  ARG A CB  1 
ATOM   1294 C  CG  . ARG B 1 28  ? -64.104 -6.982  21.259 1.00 24.93  ? 45  ARG A CG  1 
ATOM   1295 C  CD  . ARG B 1 28  ? -65.603 -6.773  21.049 1.00 26.77  ? 45  ARG A CD  1 
ATOM   1296 N  NE  . ARG B 1 28  ? -66.400 -7.602  21.950 1.00 24.88  ? 45  ARG A NE  1 
ATOM   1297 C  CZ  . ARG B 1 28  ? -67.719 -7.712  21.877 1.00 21.54  ? 45  ARG A CZ  1 
ATOM   1298 N  NH1 . ARG B 1 28  ? -68.411 -7.094  20.928 1.00 22.38  ? 45  ARG A NH1 1 
ATOM   1299 N  NH2 . ARG B 1 28  ? -68.358 -8.438  22.788 1.00 21.01  ? 45  ARG A NH2 1 
ATOM   1300 N  N   . LEU B 1 29  ? -61.435 -3.944  21.010 1.00 20.53  ? 46  LEU A N   1 
ATOM   1301 C  CA  . LEU B 1 29  ? -60.703 -3.281  22.079 1.00 23.79  ? 46  LEU A CA  1 
ATOM   1302 C  C   . LEU B 1 29  ? -61.315 -1.921  22.395 1.00 19.47  ? 46  LEU A C   1 
ATOM   1303 O  O   . LEU B 1 29  ? -61.289 -1.480  23.547 1.00 22.70  ? 46  LEU A O   1 
ATOM   1304 C  CB  . LEU B 1 29  ? -59.238 -3.110  21.677 1.00 18.99  ? 46  LEU A CB  1 
ATOM   1305 C  CG  . LEU B 1 29  ? -58.350 -4.361  21.777 1.00 18.33  ? 46  LEU A CG  1 
ATOM   1306 C  CD1 . LEU B 1 29  ? -56.931 -3.969  21.350 1.00 24.98  ? 46  LEU A CD1 1 
ATOM   1307 C  CD2 . LEU B 1 29  ? -58.358 -4.893  23.193 1.00 20.19  ? 46  LEU A CD2 1 
ATOM   1308 N  N   . ARG B 1 30  ? -61.859 -1.243  21.381 1.00 21.13  ? 47  ARG A N   1 
ATOM   1309 C  CA  . ARG B 1 30  ? -62.503 0.052   21.607 1.00 25.64  ? 47  ARG A CA  1 
ATOM   1310 C  C   . ARG B 1 30  ? -63.650 -0.033  22.597 1.00 29.55  ? 47  ARG A C   1 
ATOM   1311 O  O   . ARG B 1 30  ? -64.045 0.992   23.158 1.00 32.45  ? 47  ARG A O   1 
ATOM   1312 C  CB  . ARG B 1 30  ? -63.016 0.645   20.291 1.00 27.19  ? 47  ARG A CB  1 
ATOM   1313 C  CG  . ARG B 1 30  ? -61.910 1.036   19.314 1.00 31.03  ? 47  ARG A CG  1 
ATOM   1314 C  CD  . ARG B 1 30  ? -62.483 1.717   18.069 1.00 39.07  ? 47  ARG A CD  1 
ATOM   1315 N  NE  . ARG B 1 30  ? -61.414 2.136   17.169 1.00 45.46  ? 47  ARG A NE  1 
ATOM   1316 C  CZ  . ARG B 1 30  ? -61.293 1.720   15.915 1.00 45.30  ? 47  ARG A CZ  1 
ATOM   1317 N  NH1 . ARG B 1 30  ? -62.202 0.929   15.358 1.00 42.37  ? 47  ARG A NH1 1 
ATOM   1318 N  NH2 . ARG B 1 30  ? -60.227 2.093   15.208 1.00 41.11  ? 47  ARG A NH2 1 
ATOM   1319 N  N   . ARG B 1 31  ? -64.216 -1.219  22.812 1.00 27.01  ? 48  ARG A N   1 
ATOM   1320 C  CA  . ARG B 1 31  ? -65.258 -1.347  23.820 1.00 27.12  ? 48  ARG A CA  1 
ATOM   1321 C  C   . ARG B 1 31  ? -64.719 -1.115  25.229 1.00 33.54  ? 48  ARG A C   1 
ATOM   1322 O  O   . ARG B 1 31  ? -65.500 -0.813  26.139 1.00 27.62  ? 48  ARG A O   1 
ATOM   1323 C  CB  . ARG B 1 31  ? -65.935 -2.724  23.670 1.00 28.49  ? 48  ARG A CB  1 
ATOM   1324 C  CG  . ARG B 1 31  ? -66.779 -3.164  24.831 1.00 34.33  ? 48  ARG A CG  1 
ATOM   1325 C  CD  . ARG B 1 31  ? -67.471 -4.513  24.584 1.00 35.38  ? 48  ARG A CD  1 
ATOM   1326 N  NE  . ARG B 1 31  ? -68.450 -4.770  25.634 1.00 36.81  ? 48  ARG A NE  1 
ATOM   1327 C  CZ  . ARG B 1 31  ? -68.387 -5.776  26.496 1.00 35.42  ? 48  ARG A CZ  1 
ATOM   1328 N  NH1 . ARG B 1 31  ? -67.492 -6.741  26.367 1.00 32.69  ? 48  ARG A NH1 1 
ATOM   1329 N  NH2 . ARG B 1 31  ? -69.252 -5.822  27.506 1.00 37.09  ? 48  ARG A NH2 1 
ATOM   1330 N  N   . PHE B 1 32  ? -63.397 -1.196  25.429 1.00 23.57  ? 49  PHE A N   1 
ATOM   1331 C  CA  . PHE B 1 32  ? -62.835 -1.140  26.773 1.00 27.50  ? 49  PHE A CA  1 
ATOM   1332 C  C   . PHE B 1 32  ? -61.996 0.101   27.026 1.00 26.67  ? 49  PHE A C   1 
ATOM   1333 O  O   . PHE B 1 32  ? -61.697 0.394   28.187 1.00 33.39  ? 49  PHE A O   1 
ATOM   1334 C  CB  . PHE B 1 32  ? -61.957 -2.371  27.030 1.00 23.21  ? 49  PHE A CB  1 
ATOM   1335 C  CG  . PHE B 1 32  ? -62.640 -3.655  26.677 1.00 28.31  ? 49  PHE A CG  1 
ATOM   1336 C  CD1 . PHE B 1 32  ? -63.767 -4.063  27.360 1.00 25.88  ? 49  PHE A CD1 1 
ATOM   1337 C  CD2 . PHE B 1 32  ? -62.141 -4.458  25.662 1.00 25.40  ? 49  PHE A CD2 1 
ATOM   1338 C  CE1 . PHE B 1 32  ? -64.403 -5.244  27.020 1.00 29.92  ? 49  PHE A CE1 1 
ATOM   1339 C  CE2 . PHE B 1 32  ? -62.765 -5.645  25.331 1.00 28.41  ? 49  PHE A CE2 1 
ATOM   1340 C  CZ  . PHE B 1 32  ? -63.901 -6.028  26.011 1.00 25.58  ? 49  PHE A CZ  1 
ATOM   1341 N  N   . GLY B 1 33  ? -61.605 0.815   25.978 1.00 23.76  ? 50  GLY A N   1 
ATOM   1342 C  CA  . GLY B 1 33  ? -60.719 1.952   26.127 1.00 25.08  ? 50  GLY A CA  1 
ATOM   1343 C  C   . GLY B 1 33  ? -60.450 2.579   24.780 1.00 25.85  ? 50  GLY A C   1 
ATOM   1344 O  O   . GLY B 1 33  ? -61.021 2.179   23.767 1.00 30.06  ? 50  GLY A O   1 
ATOM   1345 N  N   . THR B 1 34  ? -59.569 3.573   24.774 1.00 28.00  ? 51  THR A N   1 
ATOM   1346 C  CA  . THR B 1 34  ? -59.081 4.129   23.523 1.00 23.84  ? 51  THR A CA  1 
ATOM   1347 C  C   . THR B 1 34  ? -57.897 3.307   23.038 1.00 28.56  ? 51  THR A C   1 
ATOM   1348 O  O   . THR B 1 34  ? -57.136 2.762   23.839 1.00 29.38  ? 51  THR A O   1 
ATOM   1349 C  CB  . THR B 1 34  ? -58.669 5.591   23.697 1.00 27.63  ? 51  THR A CB  1 
ATOM   1350 O  OG1 . THR B 1 34  ? -57.810 5.700   24.836 1.00 25.92  ? 51  THR A OG1 1 
ATOM   1351 C  CG2 . THR B 1 34  ? -59.911 6.455   23.931 1.00 29.66  ? 51  THR A CG2 1 
ATOM   1352 N  N   . VAL B 1 35  ? -57.730 3.243   21.716 1.00 25.73  ? 52  VAL A N   1 
ATOM   1353 C  CA  . VAL B 1 35  ? -56.770 2.345   21.092 1.00 28.34  ? 52  VAL A CA  1 
ATOM   1354 C  C   . VAL B 1 35  ? -55.815 3.145   20.212 1.00 26.91  ? 52  VAL A C   1 
ATOM   1355 O  O   . VAL B 1 35  ? -56.249 3.898   19.329 1.00 26.15  ? 52  VAL A O   1 
ATOM   1356 C  CB  . VAL B 1 35  ? -57.480 1.251   20.265 1.00 28.83  ? 52  VAL A CB  1 
ATOM   1357 C  CG1 . VAL B 1 35  ? -56.461 0.336   19.584 1.00 27.98  ? 52  VAL A CG1 1 
ATOM   1358 C  CG2 . VAL B 1 35  ? -58.438 0.449   21.141 1.00 22.51  ? 52  VAL A CG2 1 
ATOM   1359 N  N   . LEU B 1 36  ? -54.519 2.951   20.431 1.00 22.43  ? 53  LEU A N   1 
ATOM   1360 C  CA  . LEU B 1 36  ? -53.472 3.424   19.540 1.00 23.77  ? 53  LEU A CA  1 
ATOM   1361 C  C   . LEU B 1 36  ? -52.642 2.246   19.048 1.00 30.23  ? 53  LEU A C   1 
ATOM   1362 O  O   . LEU B 1 36  ? -52.526 1.223   19.731 1.00 25.37  ? 53  LEU A O   1 
ATOM   1363 C  CB  . LEU B 1 36  ? -52.563 4.448   20.238 1.00 26.20  ? 53  LEU A CB  1 
ATOM   1364 C  CG  . LEU B 1 36  ? -53.198 5.845   20.361 1.00 27.58  ? 53  LEU A CG  1 
ATOM   1365 C  CD1 . LEU B 1 36  ? -52.489 6.703   21.419 1.00 28.99  ? 53  LEU A CD1 1 
ATOM   1366 C  CD2 . LEU B 1 36  ? -53.204 6.530   19.000 1.00 24.96  ? 53  LEU A CD2 1 
ATOM   1367 N  N   . THR B 1 37  ? -52.068 2.394   17.853 1.00 29.61  ? 54  THR A N   1 
ATOM   1368 C  CA  . THR B 1 37  ? -51.259 1.351   17.227 1.00 30.84  ? 54  THR A CA  1 
ATOM   1369 C  C   . THR B 1 37  ? -50.085 1.981   16.490 1.00 30.14  ? 54  THR A C   1 
ATOM   1370 O  O   . THR B 1 37  ? -50.049 3.190   16.249 1.00 31.13  ? 54  THR A O   1 
ATOM   1371 C  CB  . THR B 1 37  ? -52.049 0.517   16.212 1.00 30.62  ? 54  THR A CB  1 
ATOM   1372 O  OG1 . THR B 1 37  ? -52.302 1.335   15.061 1.00 38.80  ? 54  THR A OG1 1 
ATOM   1373 C  CG2 . THR B 1 37  ? -53.368 -0.019  16.795 1.00 22.31  ? 54  THR A CG2 1 
ATOM   1374 N  N   . GLU B 1 38  ? -49.144 1.133   16.065 1.00 25.74  ? 55  GLU A N   1 
ATOM   1375 C  CA  . GLU B 1 38  ? -48.036 1.638   15.260 1.00 28.51  ? 55  GLU A CA  1 
ATOM   1376 C  C   . GLU B 1 38  ? -48.524 2.207   13.930 1.00 31.37  ? 55  GLU A C   1 
ATOM   1377 O  O   . GLU B 1 38  ? -47.934 3.165   13.420 1.00 30.34  ? 55  GLU A O   1 
ATOM   1378 C  CB  . GLU B 1 38  ? -47.001 0.528   15.033 1.00 32.81  ? 55  GLU A CB  1 
ATOM   1379 C  CG  . GLU B 1 38  ? -45.765 0.948   14.235 1.00 35.07  ? 55  GLU A CG  1 
ATOM   1380 C  CD  . GLU B 1 38  ? -45.925 0.856   12.727 1.00 39.70  ? 55  GLU A CD  1 
ATOM   1381 O  OE1 . GLU B 1 38  ? -46.906 0.235   12.253 1.00 39.08  ? 55  GLU A OE1 1 
ATOM   1382 O  OE2 . GLU B 1 38  ? -45.038 1.391   12.015 1.00 36.94  ? 55  GLU A OE2 1 
ATOM   1383 N  N   . HIS B 1 39  ? -49.588 1.635   13.348 1.00 29.86  ? 56  HIS A N   1 
ATOM   1384 C  CA  . HIS B 1 39  ? -50.089 2.130   12.065 1.00 31.97  ? 56  HIS A CA  1 
ATOM   1385 C  C   . HIS B 1 39  ? -50.611 3.557   12.173 1.00 33.73  ? 56  HIS A C   1 
ATOM   1386 O  O   . HIS B 1 39  ? -50.543 4.314   11.198 1.00 35.34  ? 56  HIS A O   1 
ATOM   1387 C  CB  . HIS B 1 39  ? -51.198 1.223   11.527 1.00 39.46  ? 56  HIS A CB  1 
ATOM   1388 C  CG  . HIS B 1 39  ? -51.722 1.635   10.183 1.00 50.17  ? 56  HIS A CG  1 
ATOM   1389 N  ND1 . HIS B 1 39  ? -53.008 1.358   9.769  1.00 62.66  ? 56  HIS A ND1 1 
ATOM   1390 C  CD2 . HIS B 1 39  ? -51.129 2.284   9.151  1.00 53.58  ? 56  HIS A CD2 1 
ATOM   1391 C  CE1 . HIS B 1 39  ? -53.190 1.835   8.550  1.00 58.15  ? 56  HIS A CE1 1 
ATOM   1392 N  NE2 . HIS B 1 39  ? -52.065 2.398   8.150  1.00 56.20  ? 56  HIS A NE2 1 
ATOM   1393 N  N   . VAL B 1 40  ? -51.147 3.939   13.335 1.00 29.33  ? 57  VAL A N   1 
ATOM   1394 C  CA  . VAL B 1 40  ? -51.578 5.324   13.527 1.00 37.83  ? 57  VAL A CA  1 
ATOM   1395 C  C   . VAL B 1 40  ? -50.377 6.263   13.492 1.00 33.20  ? 57  VAL A C   1 
ATOM   1396 O  O   . VAL B 1 40  ? -50.447 7.361   12.928 1.00 36.65  ? 57  VAL A O   1 
ATOM   1397 C  CB  . VAL B 1 40  ? -52.382 5.467   14.833 1.00 31.31  ? 57  VAL A CB  1 
ATOM   1398 C  CG1 . VAL B 1 40  ? -52.758 6.936   15.061 1.00 34.92  ? 57  VAL A CG1 1 
ATOM   1399 C  CG2 . VAL B 1 40  ? -53.635 4.585   14.787 1.00 32.48  ? 57  VAL A CG2 1 
ATOM   1400 N  N   . ALA B 1 41  ? -49.246 5.838   14.069 1.00 29.41  ? 58  ALA A N   1 
ATOM   1401 C  CA  . ALA B 1 41  ? -48.016 6.627   13.954 1.00 33.73  ? 58  ALA A CA  1 
ATOM   1402 C  C   . ALA B 1 41  ? -47.574 6.764   12.496 1.00 37.16  ? 58  ALA A C   1 
ATOM   1403 O  O   . ALA B 1 41  ? -47.255 7.867   12.035 1.00 37.75  ? 58  ALA A O   1 
ATOM   1404 C  CB  . ALA B 1 41  ? -46.904 5.999   14.800 1.00 29.73  ? 58  ALA A CB  1 
ATOM   1405 N  N   . ALA B 1 42  ? -47.523 5.649   11.757 1.00 32.44  ? 59  ALA A N   1 
ATOM   1406 C  CA  . ALA B 1 42  ? -47.067 5.703   10.368 1.00 37.07  ? 59  ALA A CA  1 
ATOM   1407 C  C   . ALA B 1 42  ? -47.983 6.571   9.518  1.00 43.94  ? 59  ALA A C   1 
ATOM   1408 O  O   . ALA B 1 42  ? -47.514 7.315   8.649  1.00 43.69  ? 59  ALA A O   1 
ATOM   1409 C  CB  . ALA B 1 42  ? -46.980 4.295   9.776  1.00 36.23  ? 59  ALA A CB  1 
ATOM   1410 N  N   . ALA B 1 43  ? -49.296 6.485   9.754  1.00 43.39  ? 60  ALA A N   1 
ATOM   1411 C  CA  . ALA B 1 43  ? -50.253 7.311   9.027  1.00 47.37  ? 60  ALA A CA  1 
ATOM   1412 C  C   . ALA B 1 43  ? -50.016 8.796   9.257  1.00 48.94  ? 60  ALA A C   1 
ATOM   1413 O  O   . ALA B 1 43  ? -50.408 9.614   8.419  1.00 56.81  ? 60  ALA A O   1 
ATOM   1414 C  CB  . ALA B 1 43  ? -51.681 6.938   9.432  1.00 43.94  ? 60  ALA A CB  1 
ATOM   1415 N  N   . GLU B 1 44  ? -49.380 9.160   10.373 1.00 49.30  ? 61  GLU A N   1 
ATOM   1416 C  CA  . GLU B 1 44  ? -49.002 10.547  10.610 1.00 46.82  ? 61  GLU A CA  1 
ATOM   1417 C  C   . GLU B 1 44  ? -48.034 11.064  9.551  1.00 55.37  ? 61  GLU A C   1 
ATOM   1418 O  O   . GLU B 1 44  ? -47.968 12.277  9.327  1.00 56.68  ? 61  GLU A O   1 
ATOM   1419 C  CB  . GLU B 1 44  ? -48.373 10.687  12.000 1.00 46.54  ? 61  GLU A CB  1 
ATOM   1420 C  CG  . GLU B 1 44  ? -49.363 10.545  13.156 1.00 43.35  ? 61  GLU A CG  1 
ATOM   1421 C  CD  . GLU B 1 44  ? -48.807 11.048  14.481 1.00 47.22  ? 61  GLU A CD  1 
ATOM   1422 O  OE1 . GLU B 1 44  ? -47.578 11.291  14.574 1.00 50.03  ? 61  GLU A OE1 1 
ATOM   1423 O  OE2 . GLU B 1 44  ? -49.600 11.187  15.438 1.00 42.77  ? 61  GLU A OE2 1 
ATOM   1424 N  N   . LEU B 1 45  ? -47.281 10.179  8.900  1.00 56.64  ? 62  LEU A N   1 
ATOM   1425 C  CA  . LEU B 1 45  ? -46.362 10.586  7.848  1.00 62.11  ? 62  LEU A CA  1 
ATOM   1426 C  C   . LEU B 1 45  ? -47.114 10.827  6.545  1.00 68.54  ? 62  LEU A C   1 
ATOM   1427 O  O   . LEU B 1 45  ? -47.941 10.007  6.130  1.00 69.52  ? 62  LEU A O   1 
ATOM   1428 C  CB  . LEU B 1 45  ? -45.283 9.526   7.622  1.00 63.06  ? 62  LEU A CB  1 
ATOM   1429 C  CG  . LEU B 1 45  ? -44.131 9.335   8.609  1.00 56.45  ? 62  LEU A CG  1 
ATOM   1430 C  CD1 . LEU B 1 45  ? -43.179 8.266   8.079  1.00 53.43  ? 62  LEU A CD1 1 
ATOM   1431 C  CD2 . LEU B 1 45  ? -43.385 10.637  8.841  1.00 53.12  ? 62  LEU A CD2 1 
ATOM   1432 N  N   . GLY B 1 46  ? -46.819 11.953  5.902  1.00 77.41  ? 63  GLY A N   1 
ATOM   1433 C  CA  . GLY B 1 46  ? -47.233 12.190  4.534  1.00 83.84  ? 63  GLY A CA  1 
ATOM   1434 C  C   . GLY B 1 46  ? -46.024 12.160  3.624  1.00 91.24  ? 63  GLY A C   1 
ATOM   1435 O  O   . GLY B 1 46  ? -46.093 11.683  2.486  1.00 89.67  ? 63  GLY A O   1 
ATOM   1436 N  N   . ALA B 1 47  ? -44.902 12.664  4.134  1.00 95.81  ? 64  ALA A N   1 
ATOM   1437 C  CA  . ALA B 1 47  ? -43.630 12.630  3.421  1.00 94.29  ? 64  ALA A CA  1 
ATOM   1438 C  C   . ALA B 1 47  ? -42.902 11.315  3.678  1.00 89.44  ? 64  ALA A C   1 
ATOM   1439 O  O   . ALA B 1 47  ? -42.291 10.745  2.774  1.00 91.17  ? 64  ALA A O   1 
ATOM   1440 C  CB  . ALA B 1 47  ? -42.761 13.804  3.831  1.00 82.38  ? 64  ALA A CB  1 
ATOM   1441 N  N   . ALA B 1 52  ? -39.333 9.739   3.693  1.00 75.31  ? 69  ALA A N   1 
ATOM   1442 C  CA  . ALA B 1 52  ? -38.434 10.865  3.941  1.00 75.12  ? 69  ALA A CA  1 
ATOM   1443 C  C   . ALA B 1 52  ? -37.376 10.503  4.976  1.00 63.64  ? 69  ALA A C   1 
ATOM   1444 O  O   . ALA B 1 52  ? -37.592 9.627   5.817  1.00 61.02  ? 69  ALA A O   1 
ATOM   1445 C  CB  . ALA B 1 52  ? -39.223 12.088  4.395  1.00 74.13  ? 69  ALA A CB  1 
ATOM   1446 N  N   . ALA B 1 53  ? -36.227 11.171  4.912  1.00 57.54  ? 70  ALA A N   1 
ATOM   1447 C  CA  . ALA B 1 53  ? -35.186 10.923  5.897  1.00 50.40  ? 70  ALA A CA  1 
ATOM   1448 C  C   . ALA B 1 53  ? -35.694 11.296  7.285  1.00 51.58  ? 70  ALA A C   1 
ATOM   1449 O  O   . ALA B 1 53  ? -36.420 12.281  7.459  1.00 44.07  ? 70  ALA A O   1 
ATOM   1450 C  CB  . ALA B 1 53  ? -33.922 11.710  5.549  1.00 49.48  ? 70  ALA A CB  1 
ATOM   1451 N  N   . GLY B 1 54  ? -35.337 10.477  8.273  1.00 44.01  ? 71  GLY A N   1 
ATOM   1452 C  CA  . GLY B 1 54  ? -35.865 10.641  9.610  1.00 46.36  ? 71  GLY A CA  1 
ATOM   1453 C  C   . GLY B 1 54  ? -37.306 10.203  9.802  1.00 42.93  ? 71  GLY A C   1 
ATOM   1454 O  O   . GLY B 1 54  ? -37.828 10.333  10.920 1.00 38.28  ? 71  GLY A O   1 
ATOM   1455 N  N   . GLY B 1 55  ? -37.969 9.693   8.758  1.00 44.02  ? 72  GLY A N   1 
ATOM   1456 C  CA  . GLY B 1 55  ? -39.371 9.319   8.895  1.00 35.99  ? 72  GLY A CA  1 
ATOM   1457 C  C   . GLY B 1 55  ? -39.584 8.125   9.808  1.00 38.20  ? 72  GLY A C   1 
ATOM   1458 O  O   . GLY B 1 55  ? -40.501 8.121   10.637 1.00 35.73  ? 72  GLY A O   1 
ATOM   1459 N  N   . ASP B 1 56  ? -38.758 7.087   9.659  1.00 33.76  ? 73  ASP A N   1 
ATOM   1460 C  CA  . ASP B 1 56  ? -38.858 5.925   10.542 1.00 34.59  ? 73  ASP A CA  1 
ATOM   1461 C  C   . ASP B 1 56  ? -38.562 6.307   11.985 1.00 30.89  ? 73  ASP A C   1 
ATOM   1462 O  O   . ASP B 1 56  ? -39.185 5.789   12.918 1.00 25.83  ? 73  ASP A O   1 
ATOM   1463 C  CB  . ASP B 1 56  ? -37.898 4.833   10.072 1.00 33.75  ? 73  ASP A CB  1 
ATOM   1464 C  CG  . ASP B 1 56  ? -38.466 4.014   8.927  1.00 40.38  ? 73  ASP A CG  1 
ATOM   1465 O  OD1 . ASP B 1 56  ? -39.664 4.180   8.617  1.00 38.26  ? 73  ASP A OD1 1 
ATOM   1466 O  OD2 . ASP B 1 56  ? -37.713 3.225   8.324  1.00 39.14  ? 73  ASP A OD2 1 
ATOM   1467 N  N   . ARG B 1 57  ? -37.620 7.230   12.181 1.00 32.22  ? 74  ARG A N   1 
ATOM   1468 C  CA  . ARG B 1 57  ? -37.287 7.705   13.517 1.00 29.26  ? 74  ARG A CA  1 
ATOM   1469 C  C   . ARG B 1 57  ? -38.495 8.357   14.180 1.00 28.73  ? 74  ARG A C   1 
ATOM   1470 O  O   . ARG B 1 57  ? -38.736 8.161   15.377 1.00 27.77  ? 74  ARG A O   1 
ATOM   1471 C  CB  . ARG B 1 57  ? -36.095 8.669   13.424 1.00 30.85  ? 74  ARG A CB  1 
ATOM   1472 C  CG  . ARG B 1 57  ? -35.475 9.085   14.752 1.00 37.23  ? 74  ARG A CG  1 
ATOM   1473 C  CD  . ARG B 1 57  ? -34.824 7.931   15.499 1.00 40.37  ? 74  ARG A CD  1 
ATOM   1474 N  NE  . ARG B 1 57  ? -34.377 8.316   16.834 1.00 40.21  ? 74  ARG A NE  1 
ATOM   1475 C  CZ  . ARG B 1 57  ? -33.843 7.484   17.717 1.00 40.04  ? 74  ARG A CZ  1 
ATOM   1476 N  NH1 . ARG B 1 57  ? -33.677 6.201   17.445 1.00 40.68  ? 74  ARG A NH1 1 
ATOM   1477 N  NH2 . ARG B 1 57  ? -33.483 7.948   18.910 1.00 47.63  ? 74  ARG A NH2 1 
ATOM   1478 N  N   . LEU B 1 58  ? -39.287 9.114   13.414 1.00 28.23  ? 75  LEU A N   1 
ATOM   1479 C  CA  . LEU B 1 58  ? -40.495 9.711   13.981 1.00 27.94  ? 75  LEU A CA  1 
ATOM   1480 C  C   . LEU B 1 58  ? -41.496 8.630   14.390 1.00 22.06  ? 75  LEU A C   1 
ATOM   1481 O  O   . LEU B 1 58  ? -42.050 8.671   15.493 1.00 20.47  ? 75  LEU A O   1 
ATOM   1482 C  CB  . LEU B 1 58  ? -41.108 10.701  12.981 1.00 24.25  ? 75  LEU A CB  1 
ATOM   1483 C  CG  . LEU B 1 58  ? -42.349 11.565  13.272 1.00 29.23  ? 75  LEU A CG  1 
ATOM   1484 C  CD1 . LEU B 1 58  ? -42.492 12.624  12.176 1.00 29.73  ? 75  LEU A CD1 1 
ATOM   1485 C  CD2 . LEU B 1 58  ? -43.650 10.743  13.354 1.00 35.58  ? 75  LEU A CD2 1 
ATOM   1486 N  N   . ILE B 1 59  ? -41.740 7.653   13.512 1.00 25.83  ? 76  ILE A N   1 
ATOM   1487 C  CA  . ILE B 1 59  ? -42.655 6.558   13.854 1.00 23.18  ? 76  ILE A CA  1 
ATOM   1488 C  C   . ILE B 1 59  ? -42.214 5.882   15.143 1.00 25.47  ? 76  ILE A C   1 
ATOM   1489 O  O   . ILE B 1 59  ? -43.017 5.657   16.059 1.00 25.30  ? 76  ILE A O   1 
ATOM   1490 C  CB  . ILE B 1 59  ? -42.752 5.545   12.696 1.00 30.52  ? 76  ILE A CB  1 
ATOM   1491 C  CG1 . ILE B 1 59  ? -43.524 6.140   11.521 1.00 31.80  ? 76  ILE A CG1 1 
ATOM   1492 C  CG2 . ILE B 1 59  ? -43.388 4.186   13.167 1.00 26.11  ? 76  ILE A CG2 1 
ATOM   1493 C  CD1 . ILE B 1 59  ? -43.298 5.394   10.228 1.00 37.87  ? 76  ILE A CD1 1 
ATOM   1494 N  N   . HIS B 1 60  ? -40.923 5.546   15.231 1.00 21.59  ? 77  HIS A N   1 
ATOM   1495 C  CA  . HIS B 1 60  ? -40.417 4.868   16.417 1.00 24.05  ? 77  HIS A CA  1 
ATOM   1496 C  C   . HIS B 1 60  ? -40.688 5.686   17.676 1.00 25.34  ? 77  HIS A C   1 
ATOM   1497 O  O   . HIS B 1 60  ? -41.246 5.176   18.655 1.00 23.72  ? 77  HIS A O   1 
ATOM   1498 C  CB  . HIS B 1 60  ? -38.923 4.578   16.236 1.00 26.45  ? 77  HIS A CB  1 
ATOM   1499 C  CG  . HIS B 1 60  ? -38.258 4.020   17.456 1.00 27.51  ? 77  HIS A CG  1 
ATOM   1500 N  ND1 . HIS B 1 60  ? -37.851 4.810   18.510 1.00 25.57  ? 77  HIS A ND1 1 
ATOM   1501 C  CD2 . HIS B 1 60  ? -37.956 2.745   17.801 1.00 27.57  ? 77  HIS A CD2 1 
ATOM   1502 C  CE1 . HIS B 1 60  ? -37.306 4.047   19.443 1.00 31.65  ? 77  HIS A CE1 1 
ATOM   1503 N  NE2 . HIS B 1 60  ? -37.360 2.790   19.039 1.00 29.35  ? 77  HIS A NE2 1 
ATOM   1504 N  N   . GLU B 1 61  ? -40.335 6.977   17.660 1.00 29.29  ? 78  GLU A N   1 
ATOM   1505 C  CA  . GLU B 1 61  ? -40.466 7.769   18.879 1.00 25.52  ? 78  GLU A CA  1 
ATOM   1506 C  C   . GLU B 1 61  ? -41.930 7.969   19.249 1.00 23.92  ? 78  GLU A C   1 
ATOM   1507 O  O   . GLU B 1 61  ? -42.271 8.003   20.436 1.00 28.57  ? 78  GLU A O   1 
ATOM   1508 C  CB  . GLU B 1 61  ? -39.777 9.131   18.714 1.00 30.82  ? 78  GLU A CB  1 
ATOM   1509 C  CG  . GLU B 1 61  ? -38.273 9.083   18.378 1.00 34.83  ? 78  GLU A CG  1 
ATOM   1510 C  CD  . GLU B 1 61  ? -37.403 8.452   19.457 1.00 41.85  ? 78  GLU A CD  1 
ATOM   1511 O  OE1 . GLU B 1 61  ? -37.331 7.208   19.512 1.00 35.22  ? 78  GLU A OE1 1 
ATOM   1512 O  OE2 . GLU B 1 61  ? -36.794 9.194   20.256 1.00 49.93  ? 78  GLU A OE2 1 
ATOM   1513 N  N   . GLN B 1 62  ? -42.806 8.112   18.254 1.00 22.84  ? 79  GLN A N   1 
ATOM   1514 C  CA  . GLN B 1 62  ? -44.232 8.269   18.540 1.00 26.15  ? 79  GLN A CA  1 
ATOM   1515 C  C   . GLN B 1 62  ? -44.833 6.988   19.113 1.00 27.58  ? 79  GLN A C   1 
ATOM   1516 O  O   . GLN B 1 62  ? -45.579 7.023   20.099 1.00 28.21  ? 79  GLN A O   1 
ATOM   1517 C  CB  . GLN B 1 62  ? -44.981 8.668   17.270 1.00 28.07  ? 79  GLN A CB  1 
ATOM   1518 C  CG  . GLN B 1 62  ? -46.398 9.140   17.527 1.00 36.85  ? 79  GLN A CG  1 
ATOM   1519 C  CD  . GLN B 1 62  ? -46.457 10.165  18.651 1.00 38.98  ? 79  GLN A CD  1 
ATOM   1520 O  OE1 . GLN B 1 62  ? -46.675 9.827   19.816 1.00 39.61  ? 79  GLN A OE1 1 
ATOM   1521 N  NE2 . GLN B 1 62  ? -46.217 11.420  18.308 1.00 39.80  ? 79  GLN A NE2 1 
ATOM   1522 N  N   . ALA B 1 63  ? -44.538 5.846   18.489 1.00 24.85  ? 80  ALA A N   1 
ATOM   1523 C  CA  . ALA B 1 63  ? -45.071 4.584   18.992 1.00 23.64  ? 80  ALA A CA  1 
ATOM   1524 C  C   . ALA B 1 63  ? -44.576 4.314   20.406 1.00 22.43  ? 80  ALA A C   1 
ATOM   1525 O  O   . ALA B 1 63  ? -45.349 3.897   21.279 1.00 29.33  ? 80  ALA A O   1 
ATOM   1526 C  CB  . ALA B 1 63  ? -44.692 3.444   18.041 1.00 28.23  ? 80  ALA A CB  1 
ATOM   1527 N  N   . LEU B 1 64  ? -43.304 4.612   20.665 1.00 24.66  ? 81  LEU A N   1 
ATOM   1528 C  CA  . LEU B 1 64  ? -42.732 4.410   21.991 1.00 27.50  ? 81  LEU A CA  1 
ATOM   1529 C  C   . LEU B 1 64  ? -43.425 5.266   23.038 1.00 26.72  ? 81  LEU A C   1 
ATOM   1530 O  O   . LEU B 1 64  ? -43.621 4.827   24.177 1.00 25.64  ? 81  LEU A O   1 
ATOM   1531 C  CB  . LEU B 1 64  ? -41.240 4.731   21.971 1.00 26.86  ? 81  LEU A CB  1 
ATOM   1532 C  CG  . LEU B 1 64  ? -40.310 3.523   22.019 1.00 39.47  ? 81  LEU A CG  1 
ATOM   1533 C  CD1 . LEU B 1 64  ? -40.435 2.768   23.337 1.00 35.55  ? 81  LEU A CD1 1 
ATOM   1534 C  CD2 . LEU B 1 64  ? -40.638 2.606   20.853 1.00 36.07  ? 81  LEU A CD2 1 
ATOM   1535 N  N   . GLU B 1 65  ? -43.763 6.511   22.685 1.00 24.75  ? 82  GLU A N   1 
ATOM   1536 C  CA  . GLU B 1 65  ? -44.482 7.351   23.633 1.00 29.64  ? 82  GLU A CA  1 
ATOM   1537 C  C   . GLU B 1 65  ? -45.848 6.755   23.949 1.00 22.47  ? 82  GLU A C   1 
ATOM   1538 O  O   . GLU B 1 65  ? -46.239 6.660   25.117 1.00 23.98  ? 82  GLU A O   1 
ATOM   1539 C  CB  . GLU B 1 65  ? -44.611 8.774   23.082 1.00 32.12  ? 82  GLU A CB  1 
ATOM   1540 C  CG  . GLU B 1 65  ? -43.314 9.585   23.183 1.00 38.09  ? 82  GLU A CG  1 
ATOM   1541 C  CD  . GLU B 1 65  ? -43.421 10.954  22.529 1.00 52.58  ? 82  GLU A CD  1 
ATOM   1542 O  OE1 . GLU B 1 65  ? -44.411 11.655  22.811 1.00 50.24  ? 82  GLU A OE1 1 
ATOM   1543 O  OE2 . GLU B 1 65  ? -42.516 11.333  21.745 1.00 52.10  ? 82  GLU A OE2 1 
ATOM   1544 N  N   . TRP B 1 66  ? -46.571 6.308   22.921 1.00 22.63  ? 83  TRP A N   1 
ATOM   1545 C  CA  . TRP B 1 66  ? -47.890 5.722   23.158 1.00 26.70  ? 83  TRP A CA  1 
ATOM   1546 C  C   . TRP B 1 66  ? -47.787 4.431   23.950 1.00 27.74  ? 83  TRP A C   1 
ATOM   1547 O  O   . TRP B 1 66  ? -48.608 4.176   24.837 1.00 23.91  ? 83  TRP A O   1 
ATOM   1548 C  CB  . TRP B 1 66  ? -48.603 5.468   21.840 1.00 26.14  ? 83  TRP A CB  1 
ATOM   1549 C  CG  . TRP B 1 66  ? -48.974 6.737   21.119 1.00 27.33  ? 83  TRP A CG  1 
ATOM   1550 C  CD1 . TRP B 1 66  ? -49.123 7.983   21.659 1.00 31.63  ? 83  TRP A CD1 1 
ATOM   1551 C  CD2 . TRP B 1 66  ? -49.241 6.868   19.719 1.00 26.95  ? 83  TRP A CD2 1 
ATOM   1552 N  NE1 . TRP B 1 66  ? -49.477 8.888   20.672 1.00 33.61  ? 83  TRP A NE1 1 
ATOM   1553 C  CE2 . TRP B 1 66  ? -49.540 8.223   19.472 1.00 30.45  ? 83  TRP A CE2 1 
ATOM   1554 C  CE3 . TRP B 1 66  ? -49.246 5.967   18.647 1.00 30.74  ? 83  TRP A CE3 1 
ATOM   1555 C  CZ2 . TRP B 1 66  ? -49.853 8.695   18.198 1.00 35.40  ? 83  TRP A CZ2 1 
ATOM   1556 C  CZ3 . TRP B 1 66  ? -49.556 6.439   17.385 1.00 30.82  ? 83  TRP A CZ3 1 
ATOM   1557 C  CH2 . TRP B 1 66  ? -49.859 7.788   17.172 1.00 33.99  ? 83  TRP A CH2 1 
ATOM   1558 N  N   . LEU B 1 67  ? -46.787 3.600   23.636 1.00 24.61  ? 84  LEU A N   1 
ATOM   1559 C  CA  . LEU B 1 67  ? -46.565 2.382   24.407 1.00 23.41  ? 84  LEU A CA  1 
ATOM   1560 C  C   . LEU B 1 67  ? -46.327 2.690   25.877 1.00 23.68  ? 84  LEU A C   1 
ATOM   1561 O  O   . LEU B 1 67  ? -46.880 2.021   26.759 1.00 25.16  ? 84  LEU A O   1 
ATOM   1562 C  CB  . LEU B 1 67  ? -45.376 1.612   23.824 1.00 23.20  ? 84  LEU A CB  1 
ATOM   1563 C  CG  . LEU B 1 67  ? -45.155 0.142   24.139 1.00 28.86  ? 84  LEU A CG  1 
ATOM   1564 C  CD1 . LEU B 1 67  ? -46.268 -0.761  23.642 1.00 26.84  ? 84  LEU A CD1 1 
ATOM   1565 C  CD2 . LEU B 1 67  ? -43.838 -0.256  23.489 1.00 29.58  ? 84  LEU A CD2 1 
ATOM   1566 N  N   . GLN B 1 68  ? -45.510 3.705   26.168 1.00 23.40  ? 85  GLN A N   1 
ATOM   1567 C  CA  . GLN B 1 68  ? -45.194 3.993   27.561 1.00 23.23  ? 85  GLN A CA  1 
ATOM   1568 C  C   . GLN B 1 68  ? -46.427 4.486   28.318 1.00 24.36  ? 85  GLN A C   1 
ATOM   1569 O  O   . GLN B 1 68  ? -46.540 4.270   29.530 1.00 31.77  ? 85  GLN A O   1 
ATOM   1570 C  CB  . GLN B 1 68  ? -44.060 5.020   27.619 1.00 29.23  ? 85  GLN A CB  1 
ATOM   1571 C  CG  . GLN B 1 68  ? -43.669 5.465   29.010 1.00 34.98  ? 85  GLN A CG  1 
ATOM   1572 C  CD  . GLN B 1 68  ? -42.362 6.243   29.007 1.00 43.59  ? 85  GLN A CD  1 
ATOM   1573 O  OE1 . GLN B 1 68  ? -41.659 6.308   27.993 1.00 38.65  ? 85  GLN A OE1 1 
ATOM   1574 N  NE2 . GLN B 1 68  ? -42.021 6.821   30.149 1.00 48.69  ? 85  GLN A NE2 1 
ATOM   1575 N  N   . GLN B 1 69  ? -47.358 5.135   27.616 1.00 24.24  ? 86  GLN A N   1 
ATOM   1576 C  CA  . GLN B 1 69  ? -48.586 5.693   28.184 1.00 30.69  ? 86  GLN A CA  1 
ATOM   1577 C  C   . GLN B 1 69  ? -49.696 4.659   28.354 1.00 31.92  ? 86  GLN A C   1 
ATOM   1578 O  O   . GLN B 1 69  ? -50.721 4.963   28.979 1.00 25.62  ? 86  GLN A O   1 
ATOM   1579 C  CB  . GLN B 1 69  ? -49.107 6.799   27.269 1.00 28.05  ? 86  GLN A CB  1 
ATOM   1580 C  CG  . GLN B 1 69  ? -48.372 8.109   27.392 1.00 35.21  ? 86  GLN A CG  1 
ATOM   1581 C  CD  . GLN B 1 69  ? -48.678 9.030   26.218 1.00 37.69  ? 86  GLN A CD  1 
ATOM   1582 O  OE1 . GLN B 1 69  ? -49.628 8.810   25.466 1.00 38.63  ? 86  GLN A OE1 1 
ATOM   1583 N  NE2 . GLN B 1 69  ? -47.845 10.041  26.034 1.00 46.34  ? 86  GLN A NE2 1 
ATOM   1584 N  N   . ALA B 1 70  ? -49.527 3.463   27.797 1.00 28.12  ? 87  ALA A N   1 
ATOM   1585 C  CA  . ALA B 1 70  ? -50.620 2.504   27.728 1.00 24.84  ? 87  ALA A CA  1 
ATOM   1586 C  C   . ALA B 1 70  ? -50.869 1.848   29.077 1.00 26.30  ? 87  ALA A C   1 
ATOM   1587 O  O   . ALA B 1 70  ? -49.939 1.607   29.845 1.00 28.11  ? 87  ALA A O   1 
ATOM   1588 C  CB  . ALA B 1 70  ? -50.310 1.435   26.685 1.00 26.53  ? 87  ALA A CB  1 
ATOM   1589 N  N   . ASP B 1 71  ? -52.140 1.553   29.358 1.00 26.46  ? 88  ASP A N   1 
ATOM   1590 C  CA  . ASP B 1 71  ? -52.473 0.745   30.520 1.00 24.32  ? 88  ASP A CA  1 
ATOM   1591 C  C   . ASP B 1 71  ? -52.351 -0.743  30.218 1.00 25.56  ? 88  ASP A C   1 
ATOM   1592 O  O   . ASP B 1 71  ? -52.027 -1.532  31.114 1.00 26.21  ? 88  ASP A O   1 
ATOM   1593 C  CB  . ASP B 1 71  ? -53.893 1.060   30.983 1.00 25.99  ? 88  ASP A CB  1 
ATOM   1594 C  CG  . ASP B 1 71  ? -54.042 2.497   31.451 1.00 36.45  ? 88  ASP A CG  1 
ATOM   1595 O  OD1 . ASP B 1 71  ? -53.422 2.853   32.476 1.00 42.11  ? 88  ASP A OD1 1 
ATOM   1596 O  OD2 . ASP B 1 71  ? -54.757 3.274   30.787 1.00 36.67  ? 88  ASP A OD2 1 
ATOM   1597 N  N   . VAL B 1 72  ? -52.604 -1.143  28.975 1.00 20.02  ? 89  VAL A N   1 
ATOM   1598 C  CA  . VAL B 1 72  ? -52.530 -2.546  28.570 1.00 21.36  ? 89  VAL A CA  1 
ATOM   1599 C  C   . VAL B 1 72  ? -51.990 -2.590  27.156 1.00 17.65  ? 89  VAL A C   1 
ATOM   1600 O  O   . VAL B 1 72  ? -52.387 -1.789  26.305 1.00 21.52  ? 89  VAL A O   1 
ATOM   1601 C  CB  . VAL B 1 72  ? -53.902 -3.268  28.639 1.00 21.71  ? 89  VAL A CB  1 
ATOM   1602 C  CG1 . VAL B 1 72  ? -53.743 -4.755  28.252 1.00 18.23  ? 89  VAL A CG1 1 
ATOM   1603 C  CG2 . VAL B 1 72  ? -54.510 -3.182  30.020 1.00 24.92  ? 89  VAL A CG2 1 
ATOM   1604 N  N   . VAL B 1 73  ? -51.084 -3.526  26.904 1.00 19.62  ? 90  VAL A N   1 
ATOM   1605 C  CA  . VAL B 1 73  ? -50.552 -3.780  25.571 1.00 19.96  ? 90  VAL A CA  1 
ATOM   1606 C  C   . VAL B 1 73  ? -51.124 -5.104  25.078 1.00 20.32  ? 90  VAL A C   1 
ATOM   1607 O  O   . VAL B 1 73  ? -51.036 -6.126  25.774 1.00 23.43  ? 90  VAL A O   1 
ATOM   1608 C  CB  . VAL B 1 73  ? -49.015 -3.806  25.586 1.00 18.44  ? 90  VAL A CB  1 
ATOM   1609 C  CG1 . VAL B 1 73  ? -48.470 -4.085  24.202 1.00 21.12  ? 90  VAL A CG1 1 
ATOM   1610 C  CG2 . VAL B 1 73  ? -48.471 -2.462  26.134 1.00 18.00  ? 90  VAL A CG2 1 
ATOM   1611 N  N   . VAL B 1 74  ? -51.700 -5.098  23.879 1.00 19.85  ? 91  VAL A N   1 
ATOM   1612 C  CA  . VAL B 1 74  ? -52.246 -6.313  23.275 1.00 15.12  ? 91  VAL A CA  1 
ATOM   1613 C  C   . VAL B 1 74  ? -51.492 -6.565  21.980 1.00 22.92  ? 91  VAL A C   1 
ATOM   1614 O  O   . VAL B 1 74  ? -51.307 -5.646  21.178 1.00 23.52  ? 91  VAL A O   1 
ATOM   1615 C  CB  . VAL B 1 74  ? -53.752 -6.186  22.988 1.00 18.68  ? 91  VAL A CB  1 
ATOM   1616 C  CG1 . VAL B 1 74  ? -54.270 -7.454  22.292 1.00 21.91  ? 91  VAL A CG1 1 
ATOM   1617 C  CG2 . VAL B 1 74  ? -54.525 -5.867  24.251 1.00 23.54  ? 91  VAL A CG2 1 
ATOM   1618 N  N   . ALA B 1 75  ? -51.069 -7.804  21.758 1.00 20.66  ? 92  ALA A N   1 
ATOM   1619 C  CA  . ALA B 1 75  ? -50.330 -8.099  20.546 1.00 20.99  ? 92  ALA A CA  1 
ATOM   1620 C  C   . ALA B 1 75  ? -50.889 -9.362  19.902 1.00 21.37  ? 92  ALA A C   1 
ATOM   1621 O  O   . ALA B 1 75  ? -51.180 -10.344 20.590 1.00 20.79  ? 92  ALA A O   1 
ATOM   1622 C  CB  . ALA B 1 75  ? -48.836 -8.254  20.844 1.00 20.81  ? 92  ALA A CB  1 
ATOM   1623 N  N   . GLU B 1 76  ? -51.062 -9.326  18.586 1.00 20.24  ? 93  GLU A N   1 
ATOM   1624 C  CA  . GLU B 1 76  ? -51.363 -10.532 17.825 1.00 21.03  ? 93  GLU A CA  1 
ATOM   1625 C  C   . GLU B 1 76  ? -50.028 -11.054 17.314 1.00 21.93  ? 93  GLU A C   1 
ATOM   1626 O  O   . GLU B 1 76  ? -49.336 -10.357 16.560 1.00 24.00  ? 93  GLU A O   1 
ATOM   1627 C  CB  . GLU B 1 76  ? -52.327 -10.242 16.672 1.00 24.64  ? 93  GLU A CB  1 
ATOM   1628 C  CG  . GLU B 1 76  ? -53.303 -11.388 16.363 1.00 22.47  ? 93  GLU A CG  1 
ATOM   1629 C  CD  . GLU B 1 76  ? -52.656 -12.608 15.733 1.00 25.38  ? 93  GLU A CD  1 
ATOM   1630 O  OE1 . GLU B 1 76  ? -51.521 -12.511 15.228 1.00 20.38  ? 93  GLU A OE1 1 
ATOM   1631 O  OE2 . GLU B 1 76  ? -53.302 -13.675 15.737 1.00 22.08  ? 93  GLU A OE2 1 
ATOM   1632 N  N   . VAL B 1 77  ? -49.648 -12.248 17.761 1.00 20.28  ? 94  VAL A N   1 
ATOM   1633 C  CA  . VAL B 1 77  ? -48.295 -12.759 17.546 1.00 18.27  ? 94  VAL A CA  1 
ATOM   1634 C  C   . VAL B 1 77  ? -48.303 -13.993 16.648 1.00 25.42  ? 94  VAL A C   1 
ATOM   1635 O  O   . VAL B 1 77  ? -47.408 -14.841 16.741 1.00 19.44  ? 94  VAL A O   1 
ATOM   1636 C  CB  . VAL B 1 77  ? -47.617 -13.080 18.890 1.00 18.70  ? 94  VAL A CB  1 
ATOM   1637 C  CG1 . VAL B 1 77  ? -47.404 -11.801 19.719 1.00 21.83  ? 94  VAL A CG1 1 
ATOM   1638 C  CG2 . VAL B 1 77  ? -48.456 -14.099 19.676 1.00 19.63  ? 94  VAL A CG2 1 
ATOM   1639 N  N   . THR B 1 78  ? -49.260 -14.107 15.740 1.00 20.39  ? 95  THR A N   1 
ATOM   1640 C  CA  . THR B 1 78  ? -49.292 -15.272 14.837 1.00 24.23  ? 95  THR A CA  1 
ATOM   1641 C  C   . THR B 1 78  ? -48.277 -15.077 13.719 1.00 26.21  ? 95  THR A C   1 
ATOM   1642 O  O   . THR B 1 78  ? -47.551 -16.015 13.413 1.00 29.21  ? 95  THR A O   1 
ATOM   1643 C  CB  . THR B 1 78  ? -50.718 -15.522 14.333 1.00 22.51  ? 95  THR A CB  1 
ATOM   1644 O  OG1 . THR B 1 78  ? -51.546 -15.741 15.469 1.00 23.14  ? 95  THR A OG1 1 
ATOM   1645 C  CG2 . THR B 1 78  ? -50.793 -16.719 13.405 1.00 24.82  ? 95  THR A CG2 1 
ATOM   1646 N  N   . GLN B 1 79  ? -48.222 -13.881 13.155 1.00 20.10  ? 96  GLN A N   1 
ATOM   1647 C  CA  . GLN B 1 79  ? -47.294 -13.607 12.042 1.00 25.89  ? 96  GLN A CA  1 
ATOM   1648 C  C   . GLN B 1 79  ? -45.939 -13.119 12.574 1.00 27.78  ? 96  GLN A C   1 
ATOM   1649 O  O   . GLN B 1 79  ? -45.909 -12.193 13.386 1.00 26.06  ? 96  GLN A O   1 
ATOM   1650 C  CB  . GLN B 1 79  ? -47.899 -12.570 11.108 1.00 35.02  ? 96  GLN A CB  1 
ATOM   1651 C  CG  . GLN B 1 79  ? -48.948 -13.143 10.162 1.00 46.17  ? 96  GLN A CG  1 
ATOM   1652 C  CD  . GLN B 1 79  ? -48.408 -14.245 9.277  1.00 53.06  ? 96  GLN A CD  1 
ATOM   1653 O  OE1 . GLN B 1 79  ? -48.917 -15.370 9.264  1.00 54.86  ? 96  GLN A OE1 1 
ATOM   1654 N  NE2 . GLN B 1 79  ? -47.357 -13.931 8.535  1.00 49.80  ? 96  GLN A NE2 1 
ATOM   1655 N  N   . PRO B 1 80  ? -44.823 -13.734 12.153 1.00 22.28  ? 97  PRO A N   1 
ATOM   1656 C  CA  . PRO B 1 80  ? -43.510 -13.233 12.531 1.00 24.83  ? 97  PRO A CA  1 
ATOM   1657 C  C   . PRO B 1 80  ? -43.332 -11.755 12.224 1.00 21.21  ? 97  PRO A C   1 
ATOM   1658 O  O   . PRO B 1 80  ? -43.593 -11.347 11.092 1.00 23.92  ? 97  PRO A O   1 
ATOM   1659 C  CB  . PRO B 1 80  ? -42.602 -14.112 11.678 1.00 27.02  ? 97  PRO A CB  1 
ATOM   1660 C  CG  . PRO B 1 80  ? -43.372 -15.399 11.541 1.00 29.00  ? 97  PRO A CG  1 
ATOM   1661 C  CD  . PRO B 1 80  ? -44.793 -14.925 11.337 1.00 27.58  ? 97  PRO A CD  1 
ATOM   1662 N  N   . SER B 1 81  ? -42.881 -10.977 13.209 1.00 23.79  ? 98  SER A N   1 
ATOM   1663 C  CA  . SER B 1 81  ? -42.673 -9.512  13.057 1.00 20.28  ? 98  SER A CA  1 
ATOM   1664 C  C   . SER B 1 81  ? -41.583 -9.013  14.024 1.00 22.10  ? 98  SER A C   1 
ATOM   1665 O  O   . SER B 1 81  ? -41.731 -9.241  15.224 1.00 20.14  ? 98  SER A O   1 
ATOM   1666 C  CB  . SER B 1 81  ? -43.948 -8.723  13.288 1.00 21.57  ? 98  SER A CB  1 
ATOM   1667 O  OG  . SER B 1 81  ? -43.678 -7.348  13.508 1.00 23.70  ? 98  SER A OG  1 
ATOM   1668 N  N   . LEU B 1 82  ? -40.557 -8.344  13.508 1.00 17.25  ? 99  LEU A N   1 
ATOM   1669 C  CA  . LEU B 1 82  ? -39.531 -7.714  14.375 1.00 20.13  ? 99  LEU A CA  1 
ATOM   1670 C  C   . LEU B 1 82  ? -40.194 -6.583  15.184 1.00 22.96  ? 99  LEU A C   1 
ATOM   1671 O  O   . LEU B 1 82  ? -39.929 -6.481  16.375 1.00 20.66  ? 99  LEU A O   1 
ATOM   1672 C  CB  . LEU B 1 82  ? -38.404 -7.192  13.493 1.00 20.88  ? 99  LEU A CB  1 
ATOM   1673 C  CG  . LEU B 1 82  ? -37.590 -8.242  12.737 1.00 20.64  ? 99  LEU A CG  1 
ATOM   1674 C  CD1 . LEU B 1 82  ? -36.847 -7.569  11.609 1.00 22.46  ? 99  LEU A CD1 1 
ATOM   1675 C  CD2 . LEU B 1 82  ? -36.618 -8.924  13.672 1.00 19.39  ? 99  LEU A CD2 1 
ATOM   1676 N  N   . GLY B 1 83  ? -41.050 -5.794  14.537 1.00 21.33  ? 100 GLY A N   1 
ATOM   1677 C  CA  . GLY B 1 83  ? -41.730 -4.678  15.222 1.00 20.83  ? 100 GLY A CA  1 
ATOM   1678 C  C   . GLY B 1 83  ? -42.566 -5.128  16.411 1.00 22.87  ? 100 GLY A C   1 
ATOM   1679 O  O   . GLY B 1 83  ? -42.432 -4.538  17.487 1.00 18.09  ? 100 GLY A O   1 
ATOM   1680 N  N   . VAL B 1 84  ? -43.408 -6.138  16.210 1.00 18.11  ? 101 VAL A N   1 
ATOM   1681 C  CA  . VAL B 1 84  ? -44.299 -6.603  17.310 1.00 18.89  ? 101 VAL A CA  1 
ATOM   1682 C  C   . VAL B 1 84  ? -43.414 -7.106  18.463 1.00 17.16  ? 101 VAL A C   1 
ATOM   1683 O  O   . VAL B 1 84  ? -43.682 -6.738  19.599 1.00 15.31  ? 101 VAL A O   1 
ATOM   1684 C  CB  . VAL B 1 84  ? -45.324 -7.656  16.839 1.00 19.26  ? 101 VAL A CB  1 
ATOM   1685 C  CG1 . VAL B 1 84  ? -46.077 -8.287  18.001 1.00 21.42  ? 101 VAL A CG1 1 
ATOM   1686 C  CG2 . VAL B 1 84  ? -46.290 -7.088  15.807 1.00 21.79  ? 101 VAL A CG2 1 
ATOM   1687 N  N   . GLY B 1 85  ? -42.370 -7.871  18.150 1.00 18.18  ? 102 GLY A N   1 
ATOM   1688 C  CA  . GLY B 1 85  ? -41.444 -8.355  19.190 1.00 14.97  ? 102 GLY A CA  1 
ATOM   1689 C  C   . GLY B 1 85  ? -40.772 -7.200  19.910 1.00 16.38  ? 102 GLY A C   1 
ATOM   1690 O  O   . GLY B 1 85  ? -40.715 -7.218  21.136 1.00 17.56  ? 102 GLY A O   1 
ATOM   1691 N  N   . TYR B 1 86  ? -40.302 -6.225  19.152 1.00 15.00  ? 103 TYR A N   1 
ATOM   1692 C  CA  . TYR B 1 86  ? -39.637 -5.040  19.742 1.00 15.72  ? 103 TYR A CA  1 
ATOM   1693 C  C   . TYR B 1 86  ? -40.600 -4.344  20.705 1.00 15.83  ? 103 TYR A C   1 
ATOM   1694 O  O   . TYR B 1 86  ? -40.233 -4.084  21.835 1.00 15.52  ? 103 TYR A O   1 
ATOM   1695 C  CB  . TYR B 1 86  ? -39.149 -4.132  18.618 1.00 18.39  ? 103 TYR A CB  1 
ATOM   1696 C  CG  . TYR B 1 86  ? -38.472 -2.868  19.117 1.00 19.81  ? 103 TYR A CG  1 
ATOM   1697 C  CD1 . TYR B 1 86  ? -37.163 -2.896  19.575 1.00 20.77  ? 103 TYR A CD1 1 
ATOM   1698 C  CD2 . TYR B 1 86  ? -39.150 -1.658  19.154 1.00 18.62  ? 103 TYR A CD2 1 
ATOM   1699 C  CE1 . TYR B 1 86  ? -36.543 -1.755  20.051 1.00 20.60  ? 103 TYR A CE1 1 
ATOM   1700 C  CE2 . TYR B 1 86  ? -38.538 -0.508  19.620 1.00 23.02  ? 103 TYR A CE2 1 
ATOM   1701 C  CZ  . TYR B 1 86  ? -37.232 -0.556  20.070 1.00 22.68  ? 103 TYR A CZ  1 
ATOM   1702 O  OH  . TYR B 1 86  ? -36.624 0.570   20.535 1.00 20.93  ? 103 TYR A OH  1 
ATOM   1703 N  N   . GLU B 1 87  ? -41.814 -4.081  20.237 1.00 18.45  ? 104 GLU A N   1 
ATOM   1704 C  CA  . GLU B 1 87  ? -42.844 -3.415  21.074 1.00 15.56  ? 104 GLU A CA  1 
ATOM   1705 C  C   . GLU B 1 87  ? -43.047 -4.210  22.374 1.00 18.84  ? 104 GLU A C   1 
ATOM   1706 O  O   . GLU B 1 87  ? -43.027 -3.600  23.433 1.00 17.43  ? 104 GLU A O   1 
ATOM   1707 C  CB  . GLU B 1 87  ? -44.081 -3.256  20.189 1.00 20.19  ? 104 GLU A CB  1 
ATOM   1708 C  CG  . GLU B 1 87  ? -43.944 -2.140  19.158 1.00 21.84  ? 104 GLU A CG  1 
ATOM   1709 C  CD  . GLU B 1 87  ? -45.111 -2.039  18.197 1.00 29.90  ? 104 GLU A CD  1 
ATOM   1710 O  OE1 . GLU B 1 87  ? -45.667 -3.085  17.820 1.00 32.72  ? 104 GLU A OE1 1 
ATOM   1711 O  OE2 . GLU B 1 87  ? -45.467 -0.907  17.832 1.00 33.13  ? 104 GLU A OE2 1 
ATOM   1712 N  N   . LEU B 1 88  ? -43.230 -5.523  22.264 1.00 18.13  ? 105 LEU A N   1 
ATOM   1713 C  CA  . LEU B 1 88  ? -43.372 -6.395  23.454 1.00 15.59  ? 105 LEU A CA  1 
ATOM   1714 C  C   . LEU B 1 88  ? -42.153 -6.246  24.390 1.00 19.25  ? 105 LEU A C   1 
ATOM   1715 O  O   . LEU B 1 88  ? -42.358 -6.129  25.595 1.00 18.68  ? 105 LEU A O   1 
ATOM   1716 C  CB  . LEU B 1 88  ? -43.566 -7.828  22.973 1.00 17.25  ? 105 LEU A CB  1 
ATOM   1717 C  CG  . LEU B 1 88  ? -44.939 -8.141  22.375 1.00 19.16  ? 105 LEU A CG  1 
ATOM   1718 C  CD1 . LEU B 1 88  ? -44.994 -9.553  21.833 1.00 19.26  ? 105 LEU A CD1 1 
ATOM   1719 C  CD2 . LEU B 1 88  ? -46.013 -7.923  23.419 1.00 18.80  ? 105 LEU A CD2 1 
ATOM   1720 N  N   . GLY B 1 89  ? -40.946 -6.250  23.834 1.00 14.34  ? 106 GLY A N   1 
ATOM   1721 C  CA  . GLY B 1 89  ? -39.735 -6.112  24.649 1.00 17.15  ? 106 GLY A CA  1 
ATOM   1722 C  C   . GLY B 1 89  ? -39.764 -4.814  25.427 1.00 19.73  ? 106 GLY A C   1 
ATOM   1723 O  O   . GLY B 1 89  ? -39.544 -4.839  26.637 1.00 16.90  ? 106 GLY A O   1 
ATOM   1724 N  N   . ARG B 1 90  ? -40.112 -3.728  24.750 1.00 17.55  ? 107 ARG A N   1 
ATOM   1725 C  CA  . ARG B 1 90  ? -40.126 -2.397  25.400 1.00 18.23  ? 107 ARG A CA  1 
ATOM   1726 C  C   . ARG B 1 90  ? -41.248 -2.383  26.444 1.00 21.42  ? 107 ARG A C   1 
ATOM   1727 O  O   . ARG B 1 90  ? -41.022 -1.851  27.530 1.00 21.64  ? 107 ARG A O   1 
ATOM   1728 C  CB  . ARG B 1 90  ? -40.272 -1.330  24.312 1.00 19.27  ? 107 ARG A CB  1 
ATOM   1729 C  CG  . ARG B 1 90  ? -39.119 -1.177  23.331 1.00 21.68  ? 107 ARG A CG  1 
ATOM   1730 C  CD  . ARG B 1 90  ? -37.792 -0.876  23.998 1.00 22.11  ? 107 ARG A CD  1 
ATOM   1731 N  NE  . ARG B 1 90  ? -37.832 0.301   24.871 1.00 23.41  ? 107 ARG A NE  1 
ATOM   1732 C  CZ  . ARG B 1 90  ? -37.433 1.519   24.533 1.00 26.52  ? 107 ARG A CZ  1 
ATOM   1733 N  NH1 . ARG B 1 90  ? -37.105 1.794   23.286 1.00 20.60  ? 107 ARG A NH1 1 
ATOM   1734 N  NH2 . ARG B 1 90  ? -37.379 2.471   25.443 1.00 24.08  ? 107 ARG A NH2 1 
ATOM   1735 N  N   . ALA B 1 91  ? -42.387 -2.989  26.115 1.00 19.88  ? 108 ALA A N   1 
ATOM   1736 C  CA  . ALA B 1 91  ? -43.545 -3.021  27.043 1.00 19.73  ? 108 ALA A CA  1 
ATOM   1737 C  C   . ALA B 1 91  ? -43.196 -3.788  28.315 1.00 19.41  ? 108 ALA A C   1 
ATOM   1738 O  O   . ALA B 1 91  ? -43.587 -3.357  29.398 1.00 22.12  ? 108 ALA A O   1 
ATOM   1739 C  CB  . ALA B 1 91  ? -44.730 -3.623  26.359 1.00 18.01  ? 108 ALA A CB  1 
ATOM   1740 N  N   . VAL B 1 92  ? -42.491 -4.900  28.168 1.00 16.85  ? 109 VAL A N   1 
ATOM   1741 C  CA  . VAL B 1 92  ? -42.056 -5.679  29.362 1.00 16.99  ? 109 VAL A CA  1 
ATOM   1742 C  C   . VAL B 1 92  ? -41.202 -4.760  30.250 1.00 23.68  ? 109 VAL A C   1 
ATOM   1743 O  O   . VAL B 1 92  ? -41.438 -4.709  31.453 1.00 22.88  ? 109 VAL A O   1 
ATOM   1744 C  CB  . VAL B 1 92  ? -41.304 -6.979  29.027 1.00 17.61  ? 109 VAL A CB  1 
ATOM   1745 C  CG1 . VAL B 1 92  ? -40.685 -7.616  30.264 1.00 21.65  ? 109 VAL A CG1 1 
ATOM   1746 C  CG2 . VAL B 1 92  ? -42.189 -7.973  28.294 1.00 18.55  ? 109 VAL A CG2 1 
ATOM   1747 N  N   . ALA B 1 93  ? -40.256 -4.053  29.648 1.00 20.77  ? 110 ALA A N   1 
ATOM   1748 C  CA  . ALA B 1 93  ? -39.370 -3.164  30.429 1.00 24.36  ? 110 ALA A CA  1 
ATOM   1749 C  C   . ALA B 1 93  ? -40.164 -1.995  31.020 1.00 23.27  ? 110 ALA A C   1 
ATOM   1750 O  O   . ALA B 1 93  ? -39.752 -1.472  32.049 1.00 21.70  ? 110 ALA A O   1 
ATOM   1751 C  CB  . ALA B 1 93  ? -38.251 -2.673  29.566 1.00 22.49  ? 110 ALA A CB  1 
ATOM   1752 N  N   . PHE B 1 94  ? -41.248 -1.596  30.360 1.00 22.70  ? 111 PHE A N   1 
ATOM   1753 C  CA  . PHE B 1 94  ? -42.125 -0.528  30.908 1.00 25.83  ? 111 PHE A CA  1 
ATOM   1754 C  C   . PHE B 1 94  ? -43.060 -1.123  31.984 1.00 24.22  ? 111 PHE A C   1 
ATOM   1755 O  O   . PHE B 1 94  ? -43.945 -0.399  32.446 1.00 29.67  ? 111 PHE A O   1 
ATOM   1756 C  CB  . PHE B 1 94  ? -42.854 0.166   29.756 1.00 21.69  ? 111 PHE A CB  1 
ATOM   1757 C  CG  . PHE B 1 94  ? -42.050 1.150   28.921 1.00 21.57  ? 111 PHE A CG  1 
ATOM   1758 C  CD1 . PHE B 1 94  ? -41.050 1.926   29.490 1.00 29.78  ? 111 PHE A CD1 1 
ATOM   1759 C  CD2 . PHE B 1 94  ? -42.317 1.307   27.569 1.00 23.30  ? 111 PHE A CD2 1 
ATOM   1760 C  CE1 . PHE B 1 94  ? -40.330 2.823   28.719 1.00 28.32  ? 111 PHE A CE1 1 
ATOM   1761 C  CE2 . PHE B 1 94  ? -41.592 2.204   26.805 1.00 29.50  ? 111 PHE A CE2 1 
ATOM   1762 C  CZ  . PHE B 1 94  ? -40.603 2.961   27.381 1.00 28.38  ? 111 PHE A CZ  1 
ATOM   1763 N  N   . ASN B 1 95  ? -42.870 -2.383  32.368 1.00 24.36  ? 112 ASN A N   1 
ATOM   1764 C  CA  . ASN B 1 95  ? -43.698 -3.051  33.416 1.00 25.70  ? 112 ASN A CA  1 
ATOM   1765 C  C   . ASN B 1 95  ? -45.187 -3.006  33.044 1.00 28.36  ? 112 ASN A C   1 
ATOM   1766 O  O   . ASN B 1 95  ? -46.021 -2.838  33.942 1.00 26.13  ? 112 ASN A O   1 
ATOM   1767 C  CB  . ASN B 1 95  ? -43.471 -2.474  34.810 1.00 25.51  ? 112 ASN A CB  1 
ATOM   1768 C  CG  . ASN B 1 95  ? -42.006 -2.388  35.162 1.00 28.44  ? 112 ASN A CG  1 
ATOM   1769 O  OD1 . ASN B 1 95  ? -41.416 -1.304  35.118 1.00 30.02  ? 112 ASN A OD1 1 
ATOM   1770 N  ND2 . ASN B 1 95  ? -41.403 -3.514  35.509 1.00 29.90  ? 112 ASN A ND2 1 
ATOM   1771 N  N   . LYS B 1 96  ? -45.495 -3.193  31.770 1.00 21.73  ? 113 LYS A N   1 
ATOM   1772 C  CA  . LYS B 1 96  ? -46.896 -3.136  31.306 1.00 21.99  ? 113 LYS A CA  1 
ATOM   1773 C  C   . LYS B 1 96  ? -47.622 -4.486  31.400 1.00 24.64  ? 113 LYS A C   1 
ATOM   1774 O  O   . LYS B 1 96  ? -46.967 -5.528  31.297 1.00 25.23  ? 113 LYS A O   1 
ATOM   1775 C  CB  . LYS B 1 96  ? -46.915 -2.698  29.839 1.00 21.31  ? 113 LYS A CB  1 
ATOM   1776 C  CG  . LYS B 1 96  ? -46.344 -1.336  29.549 1.00 21.98  ? 113 LYS A CG  1 
ATOM   1777 C  CD  . LYS B 1 96  ? -47.172 -0.275  30.252 1.00 26.99  ? 113 LYS A CD  1 
ATOM   1778 C  CE  . LYS B 1 96  ? -46.676 1.090   29.943 1.00 25.95  ? 113 LYS A CE  1 
ATOM   1779 N  NZ  . LYS B 1 96  ? -47.292 2.070   30.835 1.00 28.24  ? 113 LYS A NZ  1 
ATOM   1780 N  N   . ARG B 1 97  ? -48.932 -4.450  31.622 1.00 19.97  ? 114 ARG A N   1 
ATOM   1781 C  CA  . ARG B 1 97  ? -49.737 -5.683  31.507 1.00 20.90  ? 114 ARG A CA  1 
ATOM   1782 C  C   . ARG B 1 97  ? -49.817 -5.999  30.006 1.00 21.65  ? 114 ARG A C   1 
ATOM   1783 O  O   . ARG B 1 97  ? -50.170 -5.107  29.231 1.00 20.51  ? 114 ARG A O   1 
ATOM   1784 C  CB  . ARG B 1 97  ? -51.126 -5.513  32.124 1.00 26.38  ? 114 ARG A CB  1 
ATOM   1785 C  CG  . ARG B 1 97  ? -51.115 -5.478  33.644 1.00 33.58  ? 114 ARG A CG  1 
ATOM   1786 C  CD  . ARG B 1 97  ? -52.428 -4.945  34.181 1.00 49.16  ? 114 ARG A CD  1 
ATOM   1787 N  NE  . ARG B 1 97  ? -53.583 -5.585  33.543 1.00 52.43  ? 114 ARG A NE  1 
ATOM   1788 C  CZ  . ARG B 1 97  ? -54.840 -5.328  33.875 1.00 62.09  ? 114 ARG A CZ  1 
ATOM   1789 N  NH1 . ARG B 1 97  ? -55.101 -4.431  34.808 1.00 54.63  ? 114 ARG A NH1 1 
ATOM   1790 N  NH2 . ARG B 1 97  ? -55.829 -5.967  33.278 1.00 59.58  ? 114 ARG A NH2 1 
ATOM   1791 N  N   . ILE B 1 98  ? -49.515 -7.236  29.641 1.00 19.00  ? 115 ILE A N   1 
ATOM   1792 C  CA  . ILE B 1 98  ? -49.447 -7.625  28.205 1.00 19.89  ? 115 ILE A CA  1 
ATOM   1793 C  C   . ILE B 1 98  ? -50.327 -8.843  27.921 1.00 20.19  ? 115 ILE A C   1 
ATOM   1794 O  O   . ILE B 1 98  ? -50.285 -9.796  28.700 1.00 20.98  ? 115 ILE A O   1 
ATOM   1795 C  CB  . ILE B 1 98  ? -47.996 -7.910  27.781 1.00 17.77  ? 115 ILE A CB  1 
ATOM   1796 C  CG1 . ILE B 1 98  ? -47.162 -6.634  27.775 1.00 21.64  ? 115 ILE A CG1 1 
ATOM   1797 C  CG2 . ILE B 1 98  ? -47.929 -8.636  26.440 1.00 19.41  ? 115 ILE A CG2 1 
ATOM   1798 C  CD1 . ILE B 1 98  ? -45.721 -6.837  28.192 1.00 22.86  ? 115 ILE A CD1 1 
ATOM   1799 N  N   . LEU B 1 99  ? -51.062 -8.777  26.820 1.00 19.51  ? 116 LEU A N   1 
ATOM   1800 C  CA  . LEU B 1 99  ? -51.857 -9.941  26.371 1.00 22.01  ? 116 LEU A CA  1 
ATOM   1801 C  C   . LEU B 1 99  ? -51.431 -10.266 24.937 1.00 19.52  ? 116 LEU A C   1 
ATOM   1802 O  O   . LEU B 1 99  ? -51.617 -9.406  24.076 1.00 19.44  ? 116 LEU A O   1 
ATOM   1803 C  CB  . LEU B 1 99  ? -53.359 -9.700  26.435 1.00 19.54  ? 116 LEU A CB  1 
ATOM   1804 C  CG  . LEU B 1 99  ? -54.236 -10.793 25.817 1.00 20.95  ? 116 LEU A CG  1 
ATOM   1805 C  CD1 . LEU B 1 99  ? -54.142 -12.090 26.595 1.00 22.52  ? 116 LEU A CD1 1 
ATOM   1806 C  CD2 . LEU B 1 99  ? -55.679 -10.347 25.682 1.00 17.22  ? 116 LEU A CD2 1 
ATOM   1807 N  N   . CYS B 1 100 ? -50.877 -11.451 24.713 1.00 12.79  ? 117 CYS A N   1 
ATOM   1808 C  CA  . CYS B 1 100 ? -50.578 -11.859 23.323 1.00 18.48  ? 117 CYS A CA  1 
ATOM   1809 C  C   . CYS B 1 100 ? -51.624 -12.875 22.823 1.00 18.56  ? 117 CYS A C   1 
ATOM   1810 O  O   . CYS B 1 100 ? -52.056 -13.723 23.624 1.00 21.52  ? 117 CYS A O   1 
ATOM   1811 C  CB  . CYS B 1 100 ? -49.172 -12.423 23.174 1.00 17.94  ? 117 CYS A CB  1 
ATOM   1812 S  SG  . CYS B 1 100 ? -47.855 -11.313 23.726 1.00 20.74  ? 117 CYS A SG  1 
ATOM   1813 N  N   . LEU B 1 101 ? -51.949 -12.802 21.534 1.00 15.96  ? 118 LEU A N   1 
ATOM   1814 C  CA  . LEU B 1 101 ? -52.958 -13.698 20.931 1.00 22.05  ? 118 LEU A CA  1 
ATOM   1815 C  C   . LEU B 1 101 ? -52.300 -14.498 19.801 1.00 19.04  ? 118 LEU A C   1 
ATOM   1816 O  O   . LEU B 1 101 ? -51.729 -13.874 18.906 1.00 17.57  ? 118 LEU A O   1 
ATOM   1817 C  CB  . LEU B 1 101 ? -54.150 -12.867 20.465 1.00 21.25  ? 118 LEU A CB  1 
ATOM   1818 C  CG  . LEU B 1 101 ? -54.900 -12.120 21.569 1.00 23.78  ? 118 LEU A CG  1 
ATOM   1819 C  CD1 . LEU B 1 101 ? -55.780 -11.028 21.002 1.00 26.82  ? 118 LEU A CD1 1 
ATOM   1820 C  CD2 . LEU B 1 101 ? -55.707 -13.090 22.405 1.00 24.23  ? 118 LEU A CD2 1 
ATOM   1821 N  N   . PHE B 1 102 ? -52.400 -15.828 19.875 1.00 21.10  ? 119 PHE A N   1 
ATOM   1822 C  CA  . PHE B 1 102 ? -51.780 -16.722 18.862 1.00 17.72  ? 119 PHE A CA  1 
ATOM   1823 C  C   . PHE B 1 102 ? -52.790 -17.746 18.291 1.00 21.54  ? 119 PHE A C   1 
ATOM   1824 O  O   . PHE B 1 102 ? -53.543 -18.332 19.058 1.00 20.61  ? 119 PHE A O   1 
ATOM   1825 C  CB  . PHE B 1 102 ? -50.604 -17.464 19.490 1.00 16.95  ? 119 PHE A CB  1 
ATOM   1826 C  CG  . PHE B 1 102 ? -49.904 -18.414 18.531 1.00 20.24  ? 119 PHE A CG  1 
ATOM   1827 C  CD1 . PHE B 1 102 ? -49.099 -17.925 17.513 1.00 21.41  ? 119 PHE A CD1 1 
ATOM   1828 C  CD2 . PHE B 1 102 ? -50.069 -19.788 18.636 1.00 24.38  ? 119 PHE A CD2 1 
ATOM   1829 C  CE1 . PHE B 1 102 ? -48.468 -18.787 16.633 1.00 23.21  ? 119 PHE A CE1 1 
ATOM   1830 C  CE2 . PHE B 1 102 ? -49.437 -20.644 17.753 1.00 21.10  ? 119 PHE A CE2 1 
ATOM   1831 C  CZ  . PHE B 1 102 ? -48.641 -20.142 16.755 1.00 26.60  ? 119 PHE A CZ  1 
ATOM   1832 N  N   . ARG B 1 103 ? -52.743 -17.962 16.982 1.00 17.76  ? 120 ARG A N   1 
ATOM   1833 C  CA  . ARG B 1 103 ? -53.660 -18.920 16.322 1.00 22.06  ? 120 ARG A CA  1 
ATOM   1834 C  C   . ARG B 1 103 ? -52.905 -20.211 15.992 1.00 23.71  ? 120 ARG A C   1 
ATOM   1835 O  O   . ARG B 1 103 ? -52.188 -20.231 15.000 1.00 25.95  ? 120 ARG A O   1 
ATOM   1836 C  CB  . ARG B 1 103 ? -54.216 -18.318 15.033 1.00 23.38  ? 120 ARG A CB  1 
ATOM   1837 C  CG  . ARG B 1 103 ? -54.921 -16.993 15.253 1.00 29.07  ? 120 ARG A CG  1 
ATOM   1838 C  CD  . ARG B 1 103 ? -55.900 -16.660 14.153 1.00 24.27  ? 120 ARG A CD  1 
ATOM   1839 N  NE  . ARG B 1 103 ? -55.267 -16.564 12.835 1.00 29.60  ? 120 ARG A NE  1 
ATOM   1840 C  CZ  . ARG B 1 103 ? -54.350 -15.690 12.438 1.00 38.14  ? 120 ARG A CZ  1 
ATOM   1841 N  NH1 . ARG B 1 103 ? -54.007 -14.668 13.201 1.00 34.39  ? 120 ARG A NH1 1 
ATOM   1842 N  NH2 . ARG B 1 103 ? -53.781 -15.840 11.258 1.00 43.98  ? 120 ARG A NH2 1 
ATOM   1843 N  N   . PRO B 1 104 ? -53.070 -21.280 16.783 1.00 23.29  ? 121 PRO A N   1 
ATOM   1844 C  CA  . PRO B 1 104 ? -52.421 -22.541 16.475 1.00 24.89  ? 121 PRO A CA  1 
ATOM   1845 C  C   . PRO B 1 104 ? -52.785 -23.077 15.083 1.00 28.80  ? 121 PRO A C   1 
ATOM   1846 O  O   . PRO B 1 104 ? -51.936 -23.692 14.429 1.00 23.85  ? 121 PRO A O   1 
ATOM   1847 C  CB  . PRO B 1 104 ? -52.900 -23.451 17.592 1.00 26.53  ? 121 PRO A CB  1 
ATOM   1848 C  CG  . PRO B 1 104 ? -53.357 -22.521 18.681 1.00 27.00  ? 121 PRO A CG  1 
ATOM   1849 C  CD  . PRO B 1 104 ? -53.903 -21.316 17.958 1.00 25.65  ? 121 PRO A CD  1 
ATOM   1850 N  N   . GLN B 1 105 ? -53.997 -22.781 14.604 1.00 25.39  ? 122 GLN A N   1 
ATOM   1851 C  CA  . GLN B 1 105 ? -54.455 -23.265 13.272 1.00 24.22  ? 122 GLN A CA  1 
ATOM   1852 C  C   . GLN B 1 105 ? -53.636 -22.610 12.147 1.00 25.49  ? 122 GLN A C   1 
ATOM   1853 O  O   . GLN B 1 105 ? -53.851 -22.989 10.991 1.00 27.97  ? 122 GLN A O   1 
ATOM   1854 C  CB  . GLN B 1 105 ? -55.968 -23.097 13.166 1.00 27.27  ? 122 GLN A CB  1 
ATOM   1855 C  CG  . GLN B 1 105 ? -56.743 -23.836 14.250 1.00 27.22  ? 122 GLN A CG  1 
ATOM   1856 C  CD  . GLN B 1 105 ? -56.493 -25.329 14.263 1.00 25.71  ? 122 GLN A CD  1 
ATOM   1857 O  OE1 . GLN B 1 105 ? -56.462 -25.987 13.220 0.61 22.65  ? 122 GLN A OE1 1 
ATOM   1858 N  NE2 . GLN B 1 105 ? -56.317 -25.879 15.454 0.71 21.63  ? 122 GLN A NE2 1 
ATOM   1859 N  N   . SER B 1 106 ? -52.759 -21.659 12.466 1.00 25.92  ? 123 SER A N   1 
ATOM   1860 C  CA  . SER B 1 106 ? -51.811 -21.085 11.478 1.00 29.76  ? 123 SER A CA  1 
ATOM   1861 C  C   . SER B 1 106 ? -50.861 -22.188 10.997 1.00 31.62  ? 123 SER A C   1 
ATOM   1862 O  O   . SER B 1 106 ? -50.349 -22.082 9.871  1.00 29.93  ? 123 SER A O   1 
ATOM   1863 C  CB  . SER B 1 106 ? -50.996 -19.979 12.121 1.00 31.78  ? 123 SER A CB  1 
ATOM   1864 O  OG  . SER B 1 106 ? -50.160 -20.482 13.151 1.00 24.98  ? 123 SER A OG  1 
ATOM   1865 N  N   . GLY B 1 107 ? -50.615 -23.180 11.849 1.00 26.17  ? 124 GLY A N   1 
ATOM   1866 C  CA  . GLY B 1 107 ? -49.647 -24.239 11.525 1.00 28.67  ? 124 GLY A CA  1 
ATOM   1867 C  C   . GLY B 1 107 ? -48.286 -23.926 12.118 1.00 35.12  ? 124 GLY A C   1 
ATOM   1868 O  O   . GLY B 1 107 ? -47.410 -24.797 12.074 1.00 32.99  ? 124 GLY A O   1 
ATOM   1869 N  N   . ARG B 1 108 ? -48.138 -22.742 12.704 1.00 30.12  ? 125 ARG A N   1 
ATOM   1870 C  CA  . ARG B 1 108 ? -46.814 -22.316 13.190 1.00 28.72  ? 125 ARG A CA  1 
ATOM   1871 C  C   . ARG B 1 108 ? -46.596 -22.690 14.649 1.00 30.47  ? 125 ARG A C   1 
ATOM   1872 O  O   . ARG B 1 108 ? -47.583 -22.968 15.350 1.00 30.10  ? 125 ARG A O   1 
ATOM   1873 C  CB  . ARG B 1 108 ? -46.733 -20.794 13.087 1.00 32.23  ? 125 ARG A CB  1 
ATOM   1874 C  CG  . ARG B 1 108 ? -46.991 -20.147 11.739 1.00 31.54  ? 125 ARG A CG  1 
ATOM   1875 C  CD  . ARG B 1 108 ? -46.657 -18.676 11.873 1.00 34.58  ? 125 ARG A CD  1 
ATOM   1876 N  NE  . ARG B 1 108 ? -46.898 -17.917 10.644 1.00 38.17  ? 125 ARG A NE  1 
ATOM   1877 C  CZ  . ARG B 1 108 ? -46.007 -17.768 9.676  1.00 42.42  ? 125 ARG A CZ  1 
ATOM   1878 N  NH1 . ARG B 1 108 ? -44.803 -18.289 9.800  1.00 43.48  ? 125 ARG A NH1 1 
ATOM   1879 N  NH2 . ARG B 1 108 ? -46.319 -17.084 8.594  1.00 45.95  ? 125 ARG A NH2 1 
ATOM   1880 N  N   . VAL B 1 109 ? -45.335 -22.726 15.065 1.00 26.48  ? 126 VAL A N   1 
ATOM   1881 C  CA  . VAL B 1 109 ? -45.007 -22.930 16.499 1.00 30.46  ? 126 VAL A CA  1 
ATOM   1882 C  C   . VAL B 1 109 ? -44.528 -21.553 16.989 1.00 29.77  ? 126 VAL A C   1 
ATOM   1883 O  O   . VAL B 1 109 ? -43.540 -21.044 16.446 1.00 30.79  ? 126 VAL A O   1 
ATOM   1884 C  CB  . VAL B 1 109 ? -43.952 -24.017 16.758 1.00 30.51  ? 126 VAL A CB  1 
ATOM   1885 C  CG1 . VAL B 1 109 ? -43.636 -24.141 18.242 1.00 36.63  ? 126 VAL A CG1 1 
ATOM   1886 C  CG2 . VAL B 1 109 ? -44.376 -25.360 16.180 1.00 35.90  ? 126 VAL A CG2 1 
ATOM   1887 N  N   . LEU B 1 110 ? -45.252 -20.958 17.925 1.00 23.73  ? 127 LEU A N   1 
ATOM   1888 C  CA  . LEU B 1 110 ? -44.895 -19.604 18.408 1.00 23.54  ? 127 LEU A CA  1 
ATOM   1889 C  C   . LEU B 1 110 ? -43.459 -19.556 18.947 1.00 20.32  ? 127 LEU A C   1 
ATOM   1890 O  O   . LEU B 1 110 ? -43.058 -20.475 19.670 1.00 24.89  ? 127 LEU A O   1 
ATOM   1891 C  CB  . LEU B 1 110 ? -45.882 -19.149 19.478 1.00 23.65  ? 127 LEU A CB  1 
ATOM   1892 C  CG  . LEU B 1 110 ? -45.601 -17.794 20.131 1.00 23.65  ? 127 LEU A CG  1 
ATOM   1893 C  CD1 . LEU B 1 110 ? -45.731 -16.691 19.107 1.00 21.57  ? 127 LEU A CD1 1 
ATOM   1894 C  CD2 . LEU B 1 110 ? -46.557 -17.569 21.282 1.00 24.55  ? 127 LEU A CD2 1 
ATOM   1895 N  N   . SER B 1 111 ? -42.762 -18.466 18.657 1.00 25.98  ? 128 SER A N   1 
ATOM   1896 C  CA  . SER B 1 111 ? -41.389 -18.239 19.161 1.00 26.69  ? 128 SER A CA  1 
ATOM   1897 C  C   . SER B 1 111 ? -41.258 -18.574 20.644 1.00 25.82  ? 128 SER A C   1 
ATOM   1898 O  O   . SER B 1 111 ? -42.050 -18.057 21.441 1.00 23.10  ? 128 SER A O   1 
ATOM   1899 C  CB  . SER B 1 111 ? -40.974 -16.812 18.957 1.00 26.15  ? 128 SER A CB  1 
ATOM   1900 O  OG  . SER B 1 111 ? -39.975 -16.415 19.883 1.00 28.21  ? 128 SER A OG  1 
ATOM   1901 N  N   . ALA B 1 112 ? -40.220 -19.331 20.975 1.00 22.70  ? 129 ALA A N   1 
ATOM   1902 C  CA  . ALA B 1 112 ? -39.936 -19.674 22.382 1.00 24.39  ? 129 ALA A CA  1 
ATOM   1903 C  C   . ALA B 1 112 ? -39.780 -18.413 23.240 1.00 20.62  ? 129 ALA A C   1 
ATOM   1904 O  O   . ALA B 1 112 ? -40.190 -18.434 24.393 1.00 18.26  ? 129 ALA A O   1 
ATOM   1905 C  CB  . ALA B 1 112 ? -38.697 -20.515 22.407 1.00 23.22  ? 129 ALA A CB  1 
ATOM   1906 N  N   . MET B 1 113 ? -39.174 -17.366 22.682 1.00 20.88  ? 130 MET A N   1 
ATOM   1907 C  CA  . MET B 1 113 ? -38.920 -16.135 23.474 1.00 19.58  ? 130 MET A CA  1 
ATOM   1908 C  C   . MET B 1 113 ? -40.262 -15.443 23.801 1.00 24.11  ? 130 MET A C   1 
ATOM   1909 O  O   . MET B 1 113 ? -40.350 -14.842 24.870 1.00 25.30  ? 130 MET A O   1 
ATOM   1910 C  CB  . MET B 1 113 ? -37.962 -15.189 22.748 1.00 22.45  ? 130 MET A CB  1 
ATOM   1911 C  CG  . MET B 1 113 ? -36.543 -15.705 22.659 1.00 29.78  ? 130 MET A CG  1 
ATOM   1912 S  SD  . MET B 1 113 ? -35.794 -15.985 24.274 1.00 30.61  ? 130 MET A SD  1 
ATOM   1913 C  CE  . MET B 1 113 ? -35.563 -14.286 24.799 1.00 24.12  ? 130 MET A CE  1 
ATOM   1914 N  N   . ILE B 1 114 ? -41.251 -15.540 22.915 1.00 20.24  ? 131 ILE A N   1 
ATOM   1915 C  CA  . ILE B 1 114 ? -42.566 -14.978 23.220 1.00 19.76  ? 131 ILE A CA  1 
ATOM   1916 C  C   . ILE B 1 114 ? -43.358 -15.911 24.121 1.00 21.34  ? 131 ILE A C   1 
ATOM   1917 O  O   . ILE B 1 114 ? -43.866 -15.504 25.171 1.00 18.89  ? 131 ILE A O   1 
ATOM   1918 C  CB  . ILE B 1 114 ? -43.334 -14.667 21.927 1.00 21.11  ? 131 ILE A CB  1 
ATOM   1919 C  CG1 . ILE B 1 114 ? -42.489 -13.779 21.022 1.00 24.10  ? 131 ILE A CG1 1 
ATOM   1920 C  CG2 . ILE B 1 114 ? -44.686 -13.992 22.255 1.00 21.10  ? 131 ILE A CG2 1 
ATOM   1921 C  CD1 . ILE B 1 114 ? -42.108 -12.431 21.698 1.00 24.40  ? 131 ILE A CD1 1 
ATOM   1922 N  N   . ARG B 1 115 ? -43.501 -17.174 23.721 1.00 21.61  ? 132 ARG A N   1 
ATOM   1923 C  CA  . ARG B 1 115 ? -44.190 -18.122 24.585 1.00 24.65  ? 132 ARG A CA  1 
ATOM   1924 C  C   . ARG B 1 115 ? -43.560 -18.163 25.973 1.00 26.27  ? 132 ARG A C   1 
ATOM   1925 O  O   . ARG B 1 115 ? -44.274 -18.182 26.980 1.00 23.30  ? 132 ARG A O   1 
ATOM   1926 C  CB  . ARG B 1 115 ? -44.220 -19.504 23.921 1.00 23.59  ? 132 ARG A CB  1 
ATOM   1927 C  CG  . ARG B 1 115 ? -44.803 -20.621 24.777 1.00 26.78  ? 132 ARG A CG  1 
ATOM   1928 C  CD  . ARG B 1 115 ? -46.309 -20.671 24.700 1.00 29.37  ? 132 ARG A CD  1 
ATOM   1929 N  NE  . ARG B 1 115 ? -46.855 -20.967 23.380 1.00 27.08  ? 132 ARG A NE  1 
ATOM   1930 C  CZ  . ARG B 1 115 ? -48.143 -20.813 23.085 1.00 30.35  ? 132 ARG A CZ  1 
ATOM   1931 N  NH1 . ARG B 1 115 ? -49.022 -20.437 24.003 1.00 25.59  ? 132 ARG A NH1 1 
ATOM   1932 N  NH2 . ARG B 1 115 ? -48.558 -21.032 21.842 1.00 24.80  ? 132 ARG A NH2 1 
ATOM   1933 N  N   . GLY B 1 116 ? -42.226 -18.098 26.048 1.00 24.57  ? 133 GLY A N   1 
ATOM   1934 C  CA  . GLY B 1 116 ? -41.553 -18.158 27.333 1.00 24.71  ? 133 GLY A CA  1 
ATOM   1935 C  C   . GLY B 1 116 ? -41.612 -16.874 28.142 1.00 21.70  ? 133 GLY A C   1 
ATOM   1936 O  O   . GLY B 1 116 ? -41.307 -16.895 29.337 1.00 23.29  ? 133 GLY A O   1 
ATOM   1937 N  N   . ALA B 1 117 ? -41.979 -15.755 27.523 1.00 22.00  ? 134 ALA A N   1 
ATOM   1938 C  CA  . ALA B 1 117 ? -42.130 -14.522 28.285 1.00 25.13  ? 134 ALA A CA  1 
ATOM   1939 C  C   . ALA B 1 117 ? -43.331 -14.578 29.214 1.00 24.93  ? 134 ALA A C   1 
ATOM   1940 O  O   . ALA B 1 117 ? -43.394 -13.815 30.181 1.00 27.84  ? 134 ALA A O   1 
ATOM   1941 C  CB  . ALA B 1 117 ? -42.263 -13.326 27.341 1.00 20.78  ? 134 ALA A CB  1 
ATOM   1942 N  N   . ALA B 1 118 ? -44.283 -15.462 28.943 1.00 25.33  ? 135 ALA A N   1 
ATOM   1943 C  CA  . ALA B 1 118 ? -45.509 -15.484 29.723 1.00 23.61  ? 135 ALA A CA  1 
ATOM   1944 C  C   . ALA B 1 118 ? -45.228 -15.934 31.151 1.00 30.94  ? 135 ALA A C   1 
ATOM   1945 O  O   . ALA B 1 118 ? -44.459 -16.869 31.390 1.00 32.39  ? 135 ALA A O   1 
ATOM   1946 C  CB  . ALA B 1 118 ? -46.538 -16.395 29.068 1.00 24.98  ? 135 ALA A CB  1 
ATOM   1947 N  N   . ASP B 1 119 ? -45.844 -15.242 32.105 1.00 31.24  ? 136 ASP A N   1 
ATOM   1948 C  CA  . ASP B 1 119 ? -45.780 -15.607 33.516 1.00 34.81  ? 136 ASP A CA  1 
ATOM   1949 C  C   . ASP B 1 119 ? -47.154 -15.949 34.092 1.00 35.61  ? 136 ASP A C   1 
ATOM   1950 O  O   . ASP B 1 119 ? -47.278 -16.146 35.307 1.00 40.28  ? 136 ASP A O   1 
ATOM   1951 C  CB  . ASP B 1 119 ? -45.104 -14.478 34.303 1.00 37.68  ? 136 ASP A CB  1 
ATOM   1952 C  CG  . ASP B 1 119 ? -45.847 -13.150 34.199 1.00 37.86  ? 136 ASP A CG  1 
ATOM   1953 O  OD1 . ASP B 1 119 ? -47.030 -13.133 33.804 1.00 32.40  ? 136 ASP A OD1 1 
ATOM   1954 O  OD2 . ASP B 1 119 ? -45.229 -12.103 34.484 1.00 41.55  ? 136 ASP A OD2 1 
ATOM   1955 N  N   . GLY B 1 120 ? -48.190 -16.029 33.252 1.00 33.68  ? 137 GLY A N   1 
ATOM   1956 C  CA  . GLY B 1 120 ? -49.532 -16.327 33.703 1.00 32.89  ? 137 GLY A CA  1 
ATOM   1957 C  C   . GLY B 1 120 ? -50.310 -15.149 34.248 1.00 35.87  ? 137 GLY A C   1 
ATOM   1958 O  O   . GLY B 1 120 ? -51.526 -15.272 34.443 1.00 38.11  ? 137 GLY A O   1 
ATOM   1959 N  N   . SER B 1 121 ? -49.665 -14.006 34.492 1.00 34.73  ? 138 SER A N   1 
ATOM   1960 C  CA  . SER B 1 121 ? -50.353 -12.870 35.097 1.00 36.37  ? 138 SER A CA  1 
ATOM   1961 C  C   . SER B 1 121 ? -50.174 -11.588 34.291 1.00 32.18  ? 138 SER A C   1 
ATOM   1962 O  O   . SER B 1 121 ? -51.043 -11.222 33.491 1.00 31.60  ? 138 SER A O   1 
ATOM   1963 C  CB  . SER B 1 121 ? -49.865 -12.647 36.529 1.00 38.77  ? 138 SER A CB  1 
ATOM   1964 O  OG  . SER B 1 121 ? -48.538 -12.139 36.547 1.00 50.19  ? 138 SER A OG  1 
ATOM   1965 N  N   . ARG B 1 122 ? -49.066 -10.880 34.501 1.00 28.12  ? 139 ARG A N   1 
ATOM   1966 C  CA  . ARG B 1 122 ? -48.896 -9.611  33.810 1.00 27.14  ? 139 ARG A CA  1 
ATOM   1967 C  C   . ARG B 1 122 ? -48.520 -9.805  32.345 1.00 27.95  ? 139 ARG A C   1 
ATOM   1968 O  O   . ARG B 1 122 ? -48.659 -8.871  31.552 1.00 27.58  ? 139 ARG A O   1 
ATOM   1969 C  CB  . ARG B 1 122 ? -47.839 -8.761  34.509 1.00 37.80  ? 139 ARG A CB  1 
ATOM   1970 C  CG  . ARG B 1 122 ? -48.350 -8.138  35.793 1.00 45.77  ? 139 ARG A CG  1 
ATOM   1971 C  CD  . ARG B 1 122 ? -47.266 -7.333  36.520 1.00 47.21  ? 139 ARG A CD  1 
ATOM   1972 N  NE  . ARG B 1 122 ? -47.274 -5.923  36.133 1.00 37.06  ? 139 ARG A NE  1 
ATOM   1973 C  CZ  . ARG B 1 122 ? -48.353 -5.150  36.134 1.00 38.23  ? 139 ARG A CZ  1 
ATOM   1974 N  NH1 . ARG B 1 122 ? -49.507 -5.575  36.621 1.00 39.14  ? 139 ARG A NH1 1 
ATOM   1975 N  NH2 . ARG B 1 122 ? -48.265 -3.907  35.661 1.00 41.03  ? 139 ARG A NH2 1 
ATOM   1976 N  N   . PHE B 1 123 ? -48.048 -10.993 31.965 1.00 25.26  ? 140 PHE A N   1 
ATOM   1977 C  CA  . PHE B 1 123 ? -47.732 -11.305 30.574 1.00 21.84  ? 140 PHE A CA  1 
ATOM   1978 C  C   . PHE B 1 123 ? -48.428 -12.618 30.252 1.00 24.44  ? 140 PHE A C   1 
ATOM   1979 O  O   . PHE B 1 123 ? -48.044 -13.667 30.778 1.00 23.30  ? 140 PHE A O   1 
ATOM   1980 C  CB  . PHE B 1 123 ? -46.212 -11.377 30.361 1.00 22.79  ? 140 PHE A CB  1 
ATOM   1981 C  CG  . PHE B 1 123 ? -45.784 -11.374 28.911 1.00 21.28  ? 140 PHE A CG  1 
ATOM   1982 C  CD1 . PHE B 1 123 ? -46.291 -12.299 28.004 1.00 22.42  ? 140 PHE A CD1 1 
ATOM   1983 C  CD2 . PHE B 1 123 ? -44.940 -10.372 28.444 1.00 20.02  ? 140 PHE A CD2 1 
ATOM   1984 C  CE1 . PHE B 1 123 ? -45.916 -12.275 26.678 1.00 21.61  ? 140 PHE A CE1 1 
ATOM   1985 C  CE2 . PHE B 1 123 ? -44.567 -10.326 27.114 1.00 20.19  ? 140 PHE A CE2 1 
ATOM   1986 C  CZ  . PHE B 1 123 ? -45.051 -11.280 26.226 1.00 18.30  ? 140 PHE A CZ  1 
ATOM   1987 N  N   . GLN B 1 124 ? -49.469 -12.560 29.424 1.00 19.10  ? 141 GLN A N   1 
ATOM   1988 C  CA  . GLN B 1 124 ? -50.287 -13.732 29.132 1.00 22.59  ? 141 GLN A CA  1 
ATOM   1989 C  C   . GLN B 1 124 ? -50.286 -13.995 27.639 1.00 23.32  ? 141 GLN A C   1 
ATOM   1990 O  O   . GLN B 1 124 ? -50.382 -13.060 26.843 1.00 22.26  ? 141 GLN A O   1 
ATOM   1991 C  CB  . GLN B 1 124 ? -51.726 -13.537 29.638 1.00 20.71  ? 141 GLN A CB  1 
ATOM   1992 C  CG  . GLN B 1 124 ? -51.821 -13.677 31.156 1.00 22.42  ? 141 GLN A CG  1 
ATOM   1993 C  CD  . GLN B 1 124 ? -53.245 -13.680 31.670 1.00 29.80  ? 141 GLN A CD  1 
ATOM   1994 O  OE1 . GLN B 1 124 ? -54.015 -14.607 31.408 1.00 36.84  ? 141 GLN A OE1 1 
ATOM   1995 N  NE2 . GLN B 1 124 ? -53.592 -12.659 32.429 1.00 29.89  ? 141 GLN A NE2 1 
ATOM   1996 N  N   . VAL B 1 125 ? -50.153 -15.270 27.269 1.00 20.20  ? 142 VAL A N   1 
ATOM   1997 C  CA  . VAL B 1 125 ? -50.172 -15.707 25.880 1.00 18.75  ? 142 VAL A CA  1 
ATOM   1998 C  C   . VAL B 1 125 ? -51.331 -16.684 25.717 1.00 19.92  ? 142 VAL A C   1 
ATOM   1999 O  O   . VAL B 1 125 ? -51.318 -17.761 26.315 1.00 19.38  ? 142 VAL A O   1 
ATOM   2000 C  CB  . VAL B 1 125 ? -48.837 -16.352 25.475 1.00 20.32  ? 142 VAL A CB  1 
ATOM   2001 C  CG1 . VAL B 1 125 ? -48.902 -16.885 24.052 1.00 20.75  ? 142 VAL A CG1 1 
ATOM   2002 C  CG2 . VAL B 1 125 ? -47.698 -15.321 25.606 1.00 17.15  ? 142 VAL A CG2 1 
ATOM   2003 N  N   . TRP B 1 126 ? -52.333 -16.305 24.931 1.00 19.16  ? 143 TRP A N   1 
ATOM   2004 C  CA  . TRP B 1 126 ? -53.557 -17.090 24.778 1.00 23.43  ? 143 TRP A CA  1 
ATOM   2005 C  C   . TRP B 1 126 ? -53.654 -17.611 23.348 1.00 25.28  ? 143 TRP A C   1 
ATOM   2006 O  O   . TRP B 1 126 ? -53.642 -16.825 22.395 1.00 22.94  ? 143 TRP A O   1 
ATOM   2007 C  CB  . TRP B 1 126 ? -54.798 -16.255 25.121 1.00 21.47  ? 143 TRP A CB  1 
ATOM   2008 C  CG  . TRP B 1 126 ? -54.969 -15.986 26.586 1.00 24.57  ? 143 TRP A CG  1 
ATOM   2009 C  CD1 . TRP B 1 126 ? -54.106 -16.324 27.591 1.00 29.10  ? 143 TRP A CD1 1 
ATOM   2010 C  CD2 . TRP B 1 126 ? -56.062 -15.298 27.211 1.00 25.99  ? 143 TRP A CD2 1 
ATOM   2011 N  NE1 . TRP B 1 126 ? -54.603 -15.900 28.800 1.00 27.95  ? 143 TRP A NE1 1 
ATOM   2012 C  CE2 . TRP B 1 126 ? -55.805 -15.275 28.595 1.00 27.43  ? 143 TRP A CE2 1 
ATOM   2013 C  CE3 . TRP B 1 126 ? -57.243 -14.717 26.735 1.00 29.40  ? 143 TRP A CE3 1 
ATOM   2014 C  CZ2 . TRP B 1 126 ? -56.681 -14.688 29.511 1.00 30.22  ? 143 TRP A CZ2 1 
ATOM   2015 C  CZ3 . TRP B 1 126 ? -58.120 -14.122 27.655 1.00 26.95  ? 143 TRP A CZ3 1 
ATOM   2016 C  CH2 . TRP B 1 126 ? -57.831 -14.120 29.022 1.00 29.83  ? 143 TRP A CH2 1 
ATOM   2017 N  N   . ASP B 1 127 ? -53.756 -18.930 23.202 1.00 22.54  ? 144 ASP A N   1 
ATOM   2018 C  CA  . ASP B 1 127 ? -54.130 -19.516 21.921 1.00 24.82  ? 144 ASP A CA  1 
ATOM   2019 C  C   . ASP B 1 127 ? -55.605 -19.259 21.633 1.00 26.94  ? 144 ASP A C   1 
ATOM   2020 O  O   . ASP B 1 127 ? -56.439 -19.279 22.535 1.00 26.05  ? 144 ASP A O   1 
ATOM   2021 C  CB  . ASP B 1 127 ? -53.896 -21.026 21.926 1.00 25.13  ? 144 ASP A CB  1 
ATOM   2022 C  CG  . ASP B 1 127 ? -52.429 -21.396 21.989 1.00 30.38  ? 144 ASP A CG  1 
ATOM   2023 O  OD1 . ASP B 1 127 ? -51.583 -20.476 22.012 1.00 28.86  ? 144 ASP A OD1 1 
ATOM   2024 O  OD2 . ASP B 1 127 ? -52.125 -22.608 22.007 1.00 35.58  ? 144 ASP A OD2 1 
ATOM   2025 N  N   . TYR B 1 128 ? -55.934 -19.053 20.360 1.00 23.78  ? 145 TYR A N   1 
ATOM   2026 C  CA  . TYR B 1 128 ? -57.330 -18.843 20.005 1.00 24.40  ? 145 TYR A CA  1 
ATOM   2027 C  C   . TYR B 1 128 ? -57.571 -19.293 18.577 1.00 26.33  ? 145 TYR A C   1 
ATOM   2028 O  O   . TYR B 1 128 ? -56.650 -19.351 17.759 1.00 24.92  ? 145 TYR A O   1 
ATOM   2029 C  CB  . TYR B 1 128 ? -57.736 -17.368 20.162 1.00 22.55  ? 145 TYR A CB  1 
ATOM   2030 C  CG  . TYR B 1 128 ? -57.231 -16.438 19.077 1.00 26.54  ? 145 TYR A CG  1 
ATOM   2031 C  CD1 . TYR B 1 128 ? -55.912 -15.985 19.079 1.00 23.36  ? 145 TYR A CD1 1 
ATOM   2032 C  CD2 . TYR B 1 128 ? -58.082 -15.976 18.080 1.00 25.11  ? 145 TYR A CD2 1 
ATOM   2033 C  CE1 . TYR B 1 128 ? -55.450 -15.137 18.108 1.00 23.71  ? 145 TYR A CE1 1 
ATOM   2034 C  CE2 . TYR B 1 128 ? -57.623 -15.119 17.100 1.00 21.99  ? 145 TYR A CE2 1 
ATOM   2035 C  CZ  . TYR B 1 128 ? -56.307 -14.700 17.124 1.00 21.93  ? 145 TYR A CZ  1 
ATOM   2036 O  OH  . TYR B 1 128 ? -55.854 -13.857 16.144 1.00 21.11  ? 145 TYR A OH  1 
ATOM   2037 N  N   . GLU B 1 129 ? -58.830 -19.625 18.300 1.00 24.68  ? 146 GLU A N   1 
ATOM   2038 C  CA  . GLU B 1 129 ? -59.339 -19.794 16.949 1.00 23.10  ? 146 GLU A CA  1 
ATOM   2039 C  C   . GLU B 1 129 ? -60.026 -18.493 16.538 1.00 21.04  ? 146 GLU A C   1 
ATOM   2040 O  O   . GLU B 1 129 ? -60.627 -17.814 17.372 1.00 24.03  ? 146 GLU A O   1 
ATOM   2041 C  CB  . GLU B 1 129 ? -60.344 -20.950 16.880 1.00 25.84  ? 146 GLU A CB  1 
ATOM   2042 C  CG  . GLU B 1 129 ? -59.684 -22.292 16.968 1.00 30.49  ? 146 GLU A CG  1 
ATOM   2043 C  CD  . GLU B 1 129 ? -59.252 -22.582 18.391 1.00 30.14  ? 146 GLU A CD  1 
ATOM   2044 O  OE1 . GLU B 1 129 ? -60.084 -22.401 19.308 1.00 34.13  ? 146 GLU A OE1 1 
ATOM   2045 O  OE2 . GLU B 1 129 ? -58.084 -22.952 18.602 1.00 35.17  ? 146 GLU A OE2 1 
ATOM   2046 N  N   . GLU B 1 130 ? -59.939 -18.161 15.245 1.00 19.05  ? 147 GLU A N   1 
ATOM   2047 C  CA  . GLU B 1 130 ? -60.419 -16.864 14.748 1.00 27.08  ? 147 GLU A CA  1 
ATOM   2048 C  C   . GLU B 1 130 ? -61.828 -16.505 15.227 1.00 26.06  ? 147 GLU A C   1 
ATOM   2049 O  O   . GLU B 1 130 ? -62.096 -15.346 15.564 1.00 26.20  ? 147 GLU A O   1 
ATOM   2050 C  CB  . GLU B 1 130 ? -60.345 -16.841 13.214 1.00 30.22  ? 147 GLU A CB  1 
ATOM   2051 C  CG  . GLU B 1 130 ? -61.295 -17.822 12.519 1.00 34.70  ? 147 GLU A CG  1 
ATOM   2052 C  CD  . GLU B 1 130 ? -62.659 -17.253 12.167 0.85 40.27  ? 147 GLU A CD  1 
ATOM   2053 O  OE1 . GLU B 1 130 ? -62.975 -16.112 12.565 1.00 29.64  ? 147 GLU A OE1 1 
ATOM   2054 O  OE2 . GLU B 1 130 ? -63.436 -17.981 11.511 0.89 41.10  ? 147 GLU A OE2 1 
ATOM   2055 N  N   . GLY B 1 131 ? -62.751 -17.467 15.268 1.00 26.19  ? 148 GLY A N   1 
ATOM   2056 C  CA  . GLY B 1 131 ? -64.130 -17.085 15.555 1.00 25.24  ? 148 GLY A CA  1 
ATOM   2057 C  C   . GLY B 1 131 ? -64.366 -16.571 16.961 1.00 28.65  ? 148 GLY A C   1 
ATOM   2058 O  O   . GLY B 1 131 ? -65.363 -15.878 17.199 1.00 27.01  ? 148 GLY A O   1 
ATOM   2059 N  N   . GLU B 1 132 ? -63.485 -16.897 17.904 1.00 24.39  ? 149 GLU A N   1 
ATOM   2060 C  CA  . GLU B 1 132 ? -63.705 -16.572 19.310 1.00 21.93  ? 149 GLU A CA  1 
ATOM   2061 C  C   . GLU B 1 132 ? -62.894 -15.364 19.799 1.00 21.21  ? 149 GLU A C   1 
ATOM   2062 O  O   . GLU B 1 132 ? -62.866 -15.103 21.006 1.00 19.50  ? 149 GLU A O   1 
ATOM   2063 C  CB  . GLU B 1 132 ? -63.376 -17.798 20.161 1.00 26.64  ? 149 GLU A CB  1 
ATOM   2064 C  CG  . GLU B 1 132 ? -61.891 -18.063 20.209 1.00 27.13  ? 149 GLU A CG  1 
ATOM   2065 C  CD  . GLU B 1 132 ? -61.466 -19.070 21.256 1.00 33.46  ? 149 GLU A CD  1 
ATOM   2066 O  OE1 . GLU B 1 132 ? -62.186 -19.259 22.260 1.00 36.60  ? 149 GLU A OE1 1 
ATOM   2067 O  OE2 . GLU B 1 132 ? -60.404 -19.695 21.046 1.00 29.49  ? 149 GLU A OE2 1 
ATOM   2068 N  N   . VAL B 1 133 ? -62.249 -14.610 18.906 1.00 23.92  ? 150 VAL A N   1 
ATOM   2069 C  CA  . VAL B 1 133 ? -61.304 -13.601 19.389 1.00 22.32  ? 150 VAL A CA  1 
ATOM   2070 C  C   . VAL B 1 133 ? -62.020 -12.516 20.199 1.00 20.98  ? 150 VAL A C   1 
ATOM   2071 O  O   . VAL B 1 133 ? -61.510 -12.079 21.237 1.00 23.23  ? 150 VAL A O   1 
ATOM   2072 C  CB  . VAL B 1 133 ? -60.463 -13.024 18.232 1.00 23.53  ? 150 VAL A CB  1 
ATOM   2073 C  CG1 . VAL B 1 133 ? -61.236 -12.008 17.402 1.00 21.09  ? 150 VAL A CG1 1 
ATOM   2074 C  CG2 . VAL B 1 133 ? -59.177 -12.415 18.789 1.00 20.60  ? 150 VAL A CG2 1 
ATOM   2075 N  N   . GLU B 1 134 ? -63.232 -12.101 19.785 1.00 19.86  ? 151 GLU A N   1 
ATOM   2076 C  CA  . GLU B 1 134 ? -63.964 -11.102 20.574 1.00 19.92  ? 151 GLU A CA  1 
ATOM   2077 C  C   . GLU B 1 134 ? -64.314 -11.624 21.961 1.00 22.75  ? 151 GLU A C   1 
ATOM   2078 O  O   . GLU B 1 134 ? -64.243 -10.883 22.954 1.00 22.03  ? 151 GLU A O   1 
ATOM   2079 C  CB  . GLU B 1 134 ? -65.245 -10.644 19.862 1.00 24.16  ? 151 GLU A CB  1 
ATOM   2080 C  CG  . GLU B 1 134 ? -65.047 -9.809  18.580 1.00 24.04  ? 151 GLU A CG  1 
ATOM   2081 C  CD  . GLU B 1 134 ? -64.779 -10.652 17.362 1.00 29.39  ? 151 GLU A CD  1 
ATOM   2082 O  OE1 . GLU B 1 134 ? -64.638 -11.881 17.503 1.00 25.92  ? 151 GLU A OE1 1 
ATOM   2083 O  OE2 . GLU B 1 134 ? -64.702 -10.080 16.265 1.00 29.20  ? 151 GLU A OE2 1 
ATOM   2084 N  N   . ALA B 1 135 ? -64.708 -12.896 22.045 1.00 23.58  ? 152 ALA A N   1 
ATOM   2085 C  CA  . ALA B 1 135 ? -65.053 -13.487 23.331 1.00 20.25  ? 152 ALA A CA  1 
ATOM   2086 C  C   . ALA B 1 135 ? -63.837 -13.552 24.251 1.00 21.27  ? 152 ALA A C   1 
ATOM   2087 O  O   . ALA B 1 135 ? -63.950 -13.308 25.455 1.00 22.15  ? 152 ALA A O   1 
ATOM   2088 C  CB  . ALA B 1 135 ? -65.669 -14.871 23.106 1.00 20.11  ? 152 ALA A CB  1 
ATOM   2089 N  N   . LEU B 1 136 ? -62.657 -13.846 23.706 1.00 22.93  ? 153 LEU A N   1 
ATOM   2090 C  CA  . LEU B 1 136 ? -61.471 -13.845 24.559 1.00 21.07  ? 153 LEU A CA  1 
ATOM   2091 C  C   . LEU B 1 136 ? -61.148 -12.446 25.044 1.00 21.35  ? 153 LEU A C   1 
ATOM   2092 O  O   . LEU B 1 136 ? -60.853 -12.247 26.230 1.00 24.73  ? 153 LEU A O   1 
ATOM   2093 C  CB  . LEU B 1 136 ? -60.271 -14.446 23.828 1.00 23.60  ? 153 LEU A CB  1 
ATOM   2094 C  CG  . LEU B 1 136 ? -60.346 -15.960 23.667 1.00 30.80  ? 153 LEU A CG  1 
ATOM   2095 C  CD1 . LEU B 1 136 ? -59.055 -16.404 23.070 1.00 31.18  ? 153 LEU A CD1 1 
ATOM   2096 C  CD2 . LEU B 1 136 ? -60.587 -16.649 25.006 1.00 33.12  ? 153 LEU A CD2 1 
ATOM   2097 N  N   . LEU B 1 137 ? -61.218 -11.456 24.157 1.00 20.32  ? 154 LEU A N   1 
ATOM   2098 C  CA  . LEU B 1 137 ? -61.007 -10.087 24.616 1.00 20.56  ? 154 LEU A CA  1 
ATOM   2099 C  C   . LEU B 1 137 ? -62.004 -9.716  25.710 1.00 26.25  ? 154 LEU A C   1 
ATOM   2100 O  O   . LEU B 1 137 ? -61.626 -9.090  26.711 1.00 23.30  ? 154 LEU A O   1 
ATOM   2101 C  CB  . LEU B 1 137 ? -61.081 -9.109  23.441 1.00 23.16  ? 154 LEU A CB  1 
ATOM   2102 C  CG  . LEU B 1 137 ? -59.978 -9.297  22.391 1.00 21.83  ? 154 LEU A CG  1 
ATOM   2103 C  CD1 . LEU B 1 137 ? -60.279 -8.493  21.130 1.00 19.02  ? 154 LEU A CD1 1 
ATOM   2104 C  CD2 . LEU B 1 137 ? -58.622 -8.886  22.976 1.00 19.89  ? 154 LEU A CD2 1 
ATOM   2105 N  N   . ASP B 1 138 ? -63.276 -10.117 25.556 1.00 24.71  ? 155 ASP A N   1 
ATOM   2106 C  CA  . ASP B 1 138 ? -64.255 -9.814  26.600 1.00 24.38  ? 155 ASP A CA  1 
ATOM   2107 C  C   . ASP B 1 138 ? -63.842 -10.442 27.924 1.00 24.07  ? 155 ASP A C   1 
ATOM   2108 O  O   . ASP B 1 138 ? -63.974 -9.821  28.984 1.00 30.36  ? 155 ASP A O   1 
ATOM   2109 C  CB  . ASP B 1 138 ? -65.656 -10.323 26.236 1.00 25.25  ? 155 ASP A CB  1 
ATOM   2110 C  CG  . ASP B 1 138 ? -66.248 -9.667  24.998 1.00 25.44  ? 155 ASP A CG  1 
ATOM   2111 O  OD1 . ASP B 1 138 ? -65.837 -8.548  24.613 1.00 23.80  ? 155 ASP A OD1 1 
ATOM   2112 O  OD2 . ASP B 1 138 ? -67.181 -10.283 24.428 1.00 24.96  ? 155 ASP A OD2 1 
ATOM   2113 N  N   . ARG B 1 139 ? -63.348 -11.679 27.878 1.00 24.42  ? 156 ARG A N   1 
ATOM   2114 C  CA  . ARG B 1 139 ? -62.916 -12.362 29.095 1.00 25.85  ? 156 ARG A CA  1 
ATOM   2115 C  C   . ARG B 1 139 ? -61.771 -11.609 29.768 1.00 29.43  ? 156 ARG A C   1 
ATOM   2116 O  O   . ARG B 1 139 ? -61.787 -11.383 30.981 1.00 26.21  ? 156 ARG A O   1 
ATOM   2117 C  CB  . ARG B 1 139 ? -62.508 -13.798 28.762 1.00 32.22  ? 156 ARG A CB  1 
ATOM   2118 C  CG  . ARG B 1 139 ? -61.654 -14.501 29.821 1.00 36.92  ? 156 ARG A CG  1 
ATOM   2119 C  CD  . ARG B 1 139 ? -61.246 -15.916 29.374 1.00 46.11  ? 156 ARG A CD  1 
ATOM   2120 N  NE  . ARG B 1 139 ? -62.371 -16.693 28.860 1.00 60.26  ? 156 ARG A NE  1 
ATOM   2121 C  CZ  . ARG B 1 139 ? -62.282 -17.930 28.385 1.00 70.19  ? 156 ARG A CZ  1 
ATOM   2122 N  NH1 . ARG B 1 139 ? -61.124 -18.570 28.328 1.00 73.10  ? 156 ARG A NH1 1 
ATOM   2123 N  NH2 . ARG B 1 139 ? -63.384 -18.542 27.955 1.00 63.09  ? 156 ARG A NH2 1 
ATOM   2124 N  N   . TYR B 1 140 ? -60.775 -11.188 28.985 1.00 26.42  ? 157 TYR A N   1 
ATOM   2125 C  CA  . TYR B 1 140 ? -59.621 -10.504 29.570 1.00 27.36  ? 157 TYR A CA  1 
ATOM   2126 C  C   . TYR B 1 140 ? -60.015 -9.166  30.183 1.00 26.93  ? 157 TYR A C   1 
ATOM   2127 O  O   . TYR B 1 140 ? -59.592 -8.836  31.297 1.00 26.95  ? 157 TYR A O   1 
ATOM   2128 C  CB  . TYR B 1 140 ? -58.535 -10.303 28.510 1.00 26.34  ? 157 TYR A CB  1 
ATOM   2129 C  CG  . TYR B 1 140 ? -57.231 -9.753  29.065 1.00 23.76  ? 157 TYR A CG  1 
ATOM   2130 C  CD1 . TYR B 1 140 ? -56.249 -10.619 29.556 1.00 27.44  ? 157 TYR A CD1 1 
ATOM   2131 C  CD2 . TYR B 1 140 ? -56.992 -8.387  29.128 1.00 27.28  ? 157 TYR A CD2 1 
ATOM   2132 C  CE1 . TYR B 1 140 ? -55.053 -10.136 30.072 1.00 23.49  ? 157 TYR A CE1 1 
ATOM   2133 C  CE2 . TYR B 1 140 ? -55.789 -7.887  29.639 1.00 25.91  ? 157 TYR A CE2 1 
ATOM   2134 C  CZ  . TYR B 1 140 ? -54.834 -8.767  30.118 1.00 26.54  ? 157 TYR A CZ  1 
ATOM   2135 O  OH  . TYR B 1 140 ? -53.656 -8.275  30.633 1.00 29.67  ? 157 TYR A OH  1 
ATOM   2136 N  N   . PHE B 1 141 ? -60.834 -8.386  29.481 1.00 24.58  ? 158 PHE A N   1 
ATOM   2137 C  CA  . PHE B 1 141 ? -61.038 -6.992  29.842 1.00 27.98  ? 158 PHE A CA  1 
ATOM   2138 C  C   . PHE B 1 141 ? -62.210 -6.746  30.775 1.00 38.19  ? 158 PHE A C   1 
ATOM   2139 O  O   . PHE B 1 141 ? -62.295 -5.655  31.345 1.00 42.25  ? 158 PHE A O   1 
ATOM   2140 C  CB  . PHE B 1 141 ? -61.200 -6.144  28.578 1.00 27.96  ? 158 PHE A CB  1 
ATOM   2141 C  CG  . PHE B 1 141 ? -59.893 -5.782  27.963 1.00 25.85  ? 158 PHE A CG  1 
ATOM   2142 C  CD1 . PHE B 1 141 ? -59.105 -4.802  28.542 1.00 27.51  ? 158 PHE A CD1 1 
ATOM   2143 C  CD2 . PHE B 1 141 ? -59.398 -6.494  26.889 1.00 24.86  ? 158 PHE A CD2 1 
ATOM   2144 C  CE1 . PHE B 1 141 ? -57.870 -4.497  28.014 1.00 30.85  ? 158 PHE A CE1 1 
ATOM   2145 C  CE2 . PHE B 1 141 ? -58.166 -6.195  26.360 1.00 26.94  ? 158 PHE A CE2 1 
ATOM   2146 C  CZ  . PHE B 1 141 ? -57.402 -5.205  26.915 1.00 27.05  ? 158 PHE A CZ  1 
ATOM   2147 N  N   . GLU B 1 142 ? -63.115 -7.697  30.956 1.00 36.43  ? 159 GLU A N   1 
ATOM   2148 C  CA  . GLU B 1 142 ? -64.245 -7.413  31.840 1.00 50.69  ? 159 GLU A CA  1 
ATOM   2149 C  C   . GLU B 1 142 ? -63.999 -7.892  33.266 1.00 54.90  ? 159 GLU A C   1 
ATOM   2150 O  O   . GLU B 1 142 ? -64.394 -7.210  34.215 1.00 62.02  ? 159 GLU A O   1 
ATOM   2151 C  CB  . GLU B 1 142 ? -65.533 -8.017  31.276 1.00 57.84  ? 159 GLU A CB  1 
ATOM   2152 C  CG  . GLU B 1 142 ? -66.114 -7.233  30.117 1.00 50.82  ? 159 GLU A CG  1 
ATOM   2153 C  CD  . GLU B 1 142 ? -66.740 -5.903  30.558 1.00 59.93  ? 159 GLU A CD  1 
ATOM   2154 O  OE1 . GLU B 1 142 ? -67.738 -5.938  31.313 1.00 66.04  ? 159 GLU A OE1 1 
ATOM   2155 O  OE2 . GLU B 1 142 ? -66.256 -4.824  30.144 1.00 64.65  ? 159 GLU A OE2 1 
HETATM 2156 CL CL  . CL  C 2 .   ? -41.218 -15.510 14.866 1.00 27.97  ? 201 CL  B CL  1 
HETATM 2157 CL CL  . CL  D 2 .   ? -31.594 -22.577 2.231  1.00 53.56  ? 202 CL  B CL  1 
HETATM 2158 C  C1  . PEG E 3 .   ? -28.199 -30.739 26.842 1.00 39.57  ? 203 PEG B C1  1 
HETATM 2159 O  O1  . PEG E 3 .   ? -27.100 -31.250 26.103 1.00 49.57  ? 203 PEG B O1  1 
HETATM 2160 C  C2  . PEG E 3 .   ? -28.676 -31.696 27.883 1.00 48.81  ? 203 PEG B C2  1 
HETATM 2161 O  O2  . PEG E 3 .   ? -29.821 -31.156 28.528 1.00 44.64  ? 203 PEG B O2  1 
HETATM 2162 C  C3  . PEG E 3 .   ? -30.227 -31.943 29.638 1.00 43.94  ? 203 PEG B C3  1 
HETATM 2163 C  C4  . PEG E 3 .   ? -31.698 -32.219 29.560 1.00 41.30  ? 203 PEG B C4  1 
HETATM 2164 O  O4  . PEG E 3 .   ? -31.996 -33.169 28.554 1.00 35.64  ? 203 PEG B O4  1 
HETATM 2165 C  C1  . EDO F 4 .   ? -30.397 -30.166 23.206 1.00 32.02  ? 204 EDO B C1  1 
HETATM 2166 O  O1  . EDO F 4 .   ? -29.059 -30.025 22.729 1.00 27.03  ? 204 EDO B O1  1 
HETATM 2167 C  C2  . EDO F 4 .   ? -31.313 -29.129 22.581 1.00 28.32  ? 204 EDO B C2  1 
HETATM 2168 O  O2  . EDO F 4 .   ? -32.644 -29.233 23.079 1.00 34.57  ? 204 EDO B O2  1 
HETATM 2169 C  C1  . EDO G 4 .   ? -29.060 -15.517 10.533 1.00 36.85  ? 205 EDO B C1  1 
HETATM 2170 O  O1  . EDO G 4 .   ? -30.126 -15.320 11.473 1.00 39.68  ? 205 EDO B O1  1 
HETATM 2171 C  C2  . EDO G 4 .   ? -29.619 -16.079 9.232  1.00 36.50  ? 205 EDO B C2  1 
HETATM 2172 O  O2  . EDO G 4 .   ? -30.597 -15.184 8.676  1.00 45.67  ? 205 EDO B O2  1 
HETATM 2173 CL CL  . CL  H 2 .   ? -40.601 -7.775  10.436 1.00 35.72  ? 201 CL  A CL  1 
HETATM 2174 CL CL  . CL  I 2 .   ? -35.493 7.474   9.916  1.00 63.77  ? 202 CL  A CL  1 
HETATM 2175 CL CL  . CL  J 2 .   ? -58.046 -19.906 13.418 1.00 30.43  ? 203 CL  A CL  1 
HETATM 2176 CL CL  . CL  K 2 .   ? -50.014 12.334  20.154 1.00 39.07  ? 204 CL  A CL  1 
HETATM 2177 CL CL  . CL  L 2 .   ? -50.080 -17.203 29.972 1.00 34.58  ? 205 CL  A CL  1 
HETATM 2178 CL CL  . CL  M 2 .   ? -38.778 0.008   27.313 1.00 46.72  ? 206 CL  A CL  1 
HETATM 2179 C  C1  . PEG N 3 .   ? -57.355 -18.966 28.231 1.00 47.31  ? 207 PEG A C1  1 
HETATM 2180 O  O1  . PEG N 3 .   ? -58.199 -17.857 28.460 1.00 54.09  ? 207 PEG A O1  1 
HETATM 2181 C  C2  . PEG N 3 .   ? -57.595 -19.592 26.899 1.00 53.29  ? 207 PEG A C2  1 
HETATM 2182 O  O2  . PEG N 3 .   ? -56.503 -19.315 26.030 1.00 55.11  ? 207 PEG A O2  1 
HETATM 2183 C  C3  . PEG N 3 .   ? -55.786 -20.484 25.653 1.00 47.82  ? 207 PEG A C3  1 
HETATM 2184 C  C4  . PEG N 3 .   ? -54.427 -20.471 26.270 1.00 33.29  ? 207 PEG A C4  1 
HETATM 2185 O  O4  . PEG N 3 .   ? -53.411 -20.694 25.324 1.00 40.70  ? 207 PEG A O4  1 
HETATM 2186 C  C1  . EDO O 4 .   ? -43.826 -2.810  13.386 1.00 38.95  ? 208 EDO A C1  1 
HETATM 2187 O  O1  . EDO O 4 .   ? -42.955 -2.152  12.450 1.00 36.73  ? 208 EDO A O1  1 
HETATM 2188 C  C2  . EDO O 4 .   ? -45.305 -2.591  13.103 1.00 49.65  ? 208 EDO A C2  1 
HETATM 2189 O  O2  . EDO O 4 .   ? -46.009 -3.828  13.289 1.00 48.86  ? 208 EDO A O2  1 
HETATM 2190 C  C1  . EDO P 4 .   ? -52.656 -26.918 16.243 1.00 20.00  ? 209 EDO A C1  1 
HETATM 2191 O  O1  . EDO P 4 .   ? -52.141 -27.650 17.335 1.00 20.00  ? 209 EDO A O1  1 
HETATM 2192 C  C2  . EDO P 4 .   ? -53.476 -27.738 15.325 1.00 20.00  ? 209 EDO A C2  1 
HETATM 2193 O  O2  . EDO P 4 .   ? -52.713 -28.626 14.542 1.00 20.00  ? 209 EDO A O2  1 
HETATM 2194 O  O   . HOH Q 5 .   ? -25.824 -9.883  -2.952 1.00 41.65  ? 301 HOH B O   1 
HETATM 2195 O  O   . HOH Q 5 .   ? -19.768 -20.950 14.899 1.00 42.31  ? 302 HOH B O   1 
HETATM 2196 O  O   . HOH Q 5 .   ? -32.595 -19.001 15.822 1.00 31.96  ? 303 HOH B O   1 
HETATM 2197 O  O   . HOH Q 5 .   ? -31.914 -13.288 9.662  1.00 34.90  ? 304 HOH B O   1 
HETATM 2198 O  O   . HOH Q 5 .   ? -43.757 -28.207 25.348 1.00 58.03  ? 305 HOH B O   1 
HETATM 2199 O  O   . HOH Q 5 .   ? -23.613 -2.420  26.182 1.00 20.46  ? 306 HOH B O   1 
HETATM 2200 O  O   . HOH Q 5 .   ? -17.080 -16.893 10.233 1.00 31.14  ? 307 HOH B O   1 
HETATM 2201 O  O   . HOH Q 5 .   ? -33.643 -8.004  35.140 1.00 44.23  ? 308 HOH B O   1 
HETATM 2202 O  O   . HOH Q 5 .   ? -10.979 -7.816  8.053  1.00 40.66  ? 309 HOH B O   1 
HETATM 2203 O  O   . HOH Q 5 .   ? -39.147 -28.227 31.349 1.00 39.00  ? 310 HOH B O   1 
HETATM 2204 O  O   . HOH Q 5 .   ? -23.624 -0.042  17.831 1.00 19.18  ? 311 HOH B O   1 
HETATM 2205 O  O   . HOH Q 5 .   ? -41.376 -23.721 33.192 1.00 50.30  ? 312 HOH B O   1 
HETATM 2206 O  O   . HOH Q 5 .   ? -32.589 -10.438 32.732 1.00 43.74  ? 313 HOH B O   1 
HETATM 2207 O  O   . HOH Q 5 .   ? -34.005 -12.509 12.011 1.00 26.93  ? 314 HOH B O   1 
HETATM 2208 O  O   . HOH Q 5 .   ? -23.285 -11.025 -2.293 1.00 30.04  ? 315 HOH B O   1 
HETATM 2209 O  O   . HOH Q 5 .   ? -34.202 -27.345 24.469 1.00 34.66  ? 316 HOH B O   1 
HETATM 2210 O  O   . HOH Q 5 .   ? -14.678 -6.901  21.371 1.00 25.07  ? 317 HOH B O   1 
HETATM 2211 O  O   . HOH Q 5 .   ? -22.091 -17.301 1.552  1.00 44.17  ? 318 HOH B O   1 
HETATM 2212 O  O   . HOH Q 5 .   ? -20.512 -14.885 27.516 1.00 31.95  ? 319 HOH B O   1 
HETATM 2213 O  O   . HOH Q 5 .   ? -26.325 -2.703  30.619 1.00 40.34  ? 320 HOH B O   1 
HETATM 2214 O  O   . HOH Q 5 .   ? -34.984 -22.727 20.138 1.00 36.71  ? 321 HOH B O   1 
HETATM 2215 O  O   . HOH Q 5 .   ? -23.785 -12.324 28.120 1.00 24.98  ? 322 HOH B O   1 
HETATM 2216 O  O   . HOH Q 5 .   ? -40.943 -12.947 33.321 1.00 46.19  ? 323 HOH B O   1 
HETATM 2217 O  O   . HOH Q 5 .   ? -22.105 3.779   22.800 1.00 49.27  ? 324 HOH B O   1 
HETATM 2218 O  O   . HOH Q 5 .   ? -30.399 -15.428 20.620 1.00 18.22  ? 325 HOH B O   1 
HETATM 2219 O  O   . HOH Q 5 .   ? -41.807 -22.865 21.078 1.00 41.93  ? 326 HOH B O   1 
HETATM 2220 O  O   . HOH Q 5 .   ? -25.831 8.891   18.227 1.00 36.15  ? 327 HOH B O   1 
HETATM 2221 O  O   . HOH Q 5 .   ? -35.286 -5.069  29.294 1.00 20.39  ? 328 HOH B O   1 
HETATM 2222 O  O   . HOH Q 5 .   ? -26.529 -22.455 16.625 1.00 35.61  ? 329 HOH B O   1 
HETATM 2223 O  O   . HOH Q 5 .   ? -36.353 -7.649  7.871  1.00 31.23  ? 330 HOH B O   1 
HETATM 2224 O  O   . HOH Q 5 .   ? -34.301 -14.226 33.564 1.00 39.47  ? 331 HOH B O   1 
HETATM 2225 O  O   . HOH Q 5 .   ? -22.329 -13.553 26.173 1.00 25.72  ? 332 HOH B O   1 
HETATM 2226 O  O   . HOH Q 5 .   ? -33.418 -15.030 18.263 1.00 49.77  ? 333 HOH B O   1 
HETATM 2227 O  O   . HOH Q 5 .   ? -12.849 -0.130  11.950 1.00 41.32  ? 334 HOH B O   1 
HETATM 2228 O  O   . HOH Q 5 .   ? -16.860 -12.893 28.846 1.00 28.95  ? 335 HOH B O   1 
HETATM 2229 O  O   . HOH Q 5 .   ? -9.656  -14.046 19.435 1.00 25.29  ? 336 HOH B O   1 
HETATM 2230 O  O   . HOH Q 5 .   ? -21.412 0.468   26.907 1.00 51.36  ? 337 HOH B O   1 
HETATM 2231 O  O   . HOH Q 5 .   ? -40.001 -15.263 9.261  1.00 39.19  ? 338 HOH B O   1 
HETATM 2232 O  O   . HOH Q 5 .   ? -22.578 -13.364 30.524 1.00 31.18  ? 339 HOH B O   1 
HETATM 2233 O  O   . HOH Q 5 .   ? -14.291 -16.424 11.887 1.00 30.16  ? 340 HOH B O   1 
HETATM 2234 O  O   . HOH Q 5 .   ? -33.073 3.361   20.266 1.00 41.54  ? 341 HOH B O   1 
HETATM 2235 O  O   . HOH Q 5 .   ? -21.998 -6.474  31.626 1.00 43.08  ? 342 HOH B O   1 
HETATM 2236 O  O   . HOH Q 5 .   ? -12.651 -5.225  7.551  1.00 37.21  ? 343 HOH B O   1 
HETATM 2237 O  O   . HOH Q 5 .   ? -15.326 -16.878 22.214 1.00 26.70  ? 344 HOH B O   1 
HETATM 2238 O  O   . HOH Q 5 .   ? -20.878 -21.301 8.578  1.00 27.57  ? 345 HOH B O   1 
HETATM 2239 O  O   . HOH Q 5 .   ? -29.667 0.987   23.308 1.00 30.19  ? 346 HOH B O   1 
HETATM 2240 O  O   . HOH Q 5 .   ? -10.915 -4.971  19.002 1.00 43.74  ? 347 HOH B O   1 
HETATM 2241 O  O   . HOH Q 5 .   ? -16.105 -10.733 4.606  1.00 31.01  ? 348 HOH B O   1 
HETATM 2242 O  O   . HOH Q 5 .   ? -8.819  -7.682  10.312 1.00 44.72  ? 349 HOH B O   1 
HETATM 2243 O  O   . HOH Q 5 .   ? -18.017 -12.944 5.242  1.00 36.48  ? 350 HOH B O   1 
HETATM 2244 O  O   . HOH Q 5 .   ? -38.601 -6.343  8.628  1.00 25.02  ? 351 HOH B O   1 
HETATM 2245 O  O   . HOH Q 5 .   ? -36.978 -16.793 14.822 1.00 30.29  ? 352 HOH B O   1 
HETATM 2246 O  O   . HOH Q 5 .   ? -40.783 -18.830 35.883 1.00 46.80  ? 353 HOH B O   1 
HETATM 2247 O  O   . HOH Q 5 .   ? -12.989 -16.997 15.484 1.00 39.95  ? 354 HOH B O   1 
HETATM 2248 O  O   . HOH Q 5 .   ? -31.051 -16.832 18.257 1.00 21.87  ? 355 HOH B O   1 
HETATM 2249 O  O   . HOH Q 5 .   ? -38.514 -10.756 32.041 1.00 45.57  ? 356 HOH B O   1 
HETATM 2250 O  O   . HOH Q 5 .   ? -42.113 -4.974  11.622 1.00 35.57  ? 357 HOH B O   1 
HETATM 2251 O  O   . HOH Q 5 .   ? -24.070 3.932   29.389 1.00 50.11  ? 358 HOH B O   1 
HETATM 2252 O  O   . HOH Q 5 .   ? -17.161 -4.444  24.946 1.00 28.53  ? 359 HOH B O   1 
HETATM 2253 O  O   . HOH Q 5 .   ? -38.847 -16.025 17.066 1.00 27.01  ? 360 HOH B O   1 
HETATM 2254 O  O   . HOH Q 5 .   ? -13.009 -16.804 23.722 1.00 25.84  ? 361 HOH B O   1 
HETATM 2255 O  O   . HOH Q 5 .   ? -21.219 -13.370 4.624  1.00 20.07  ? 362 HOH B O   1 
HETATM 2256 O  O   . HOH Q 5 .   ? -24.029 -5.213  32.190 1.00 45.21  ? 363 HOH B O   1 
HETATM 2257 O  O   . HOH Q 5 .   ? -15.510 -20.080 16.151 1.00 39.75  ? 364 HOH B O   1 
HETATM 2258 O  O   . HOH Q 5 .   ? -35.418 -19.158 14.237 1.00 28.40  ? 365 HOH B O   1 
HETATM 2259 O  O   . HOH Q 5 .   ? -24.883 -20.431 19.059 1.00 28.86  ? 366 HOH B O   1 
HETATM 2260 O  O   . HOH Q 5 .   ? -32.991 -25.914 3.590  1.00 49.12  ? 367 HOH B O   1 
HETATM 2261 O  O   . HOH Q 5 .   ? -14.283 -14.092 29.843 1.00 42.55  ? 368 HOH B O   1 
HETATM 2262 O  O   . HOH Q 5 .   ? -43.236 -24.360 26.446 1.00 41.49  ? 369 HOH B O   1 
HETATM 2263 O  O   . HOH Q 5 .   ? -36.479 -5.120  32.433 1.00 35.18  ? 370 HOH B O   1 
HETATM 2264 O  O   . HOH Q 5 .   ? -8.442  -11.475 9.336  1.00 46.00  ? 371 HOH B O   1 
HETATM 2265 O  O   . HOH Q 5 .   ? -43.342 -22.471 28.567 1.00 25.38  ? 372 HOH B O   1 
HETATM 2266 O  O   . HOH Q 5 .   ? -17.614 -18.307 23.289 1.00 17.91  ? 373 HOH B O   1 
HETATM 2267 O  O   . HOH Q 5 .   ? -41.746 -0.568  7.584  1.00 48.68  ? 374 HOH B O   1 
HETATM 2268 O  O   . HOH Q 5 .   ? -41.405 -26.868 24.113 1.00 46.84  ? 375 HOH B O   1 
HETATM 2269 O  O   . HOH Q 5 .   ? -36.254 -12.602 32.830 1.00 52.05  ? 376 HOH B O   1 
HETATM 2270 O  O   . HOH Q 5 .   ? -16.782 -19.436 9.462  1.00 33.87  ? 377 HOH B O   1 
HETATM 2271 O  O   . HOH Q 5 .   ? -34.888 -9.975  33.164 1.00 50.09  ? 378 HOH B O   1 
HETATM 2272 O  O   . HOH Q 5 .   ? -10.987 -16.750 20.088 1.00 34.19  ? 379 HOH B O   1 
HETATM 2273 O  O   . HOH Q 5 .   ? -23.862 -2.435  29.036 1.00 37.11  ? 380 HOH B O   1 
HETATM 2274 O  O   . HOH Q 5 .   ? -25.123 -0.441  30.255 1.00 54.14  ? 381 HOH B O   1 
HETATM 2275 O  O   . HOH Q 5 .   ? -10.526 1.252   13.623 1.00 50.36  ? 382 HOH B O   1 
HETATM 2276 O  O   . HOH Q 5 .   ? -18.287 -13.244 31.031 1.00 40.14  ? 383 HOH B O   1 
HETATM 2277 O  O   . HOH Q 5 .   ? -35.075 -3.209  31.788 1.00 34.42  ? 384 HOH B O   1 
HETATM 2278 O  O   . HOH Q 5 .   ? -35.575 -25.329 4.565  1.00 55.47  ? 385 HOH B O   1 
HETATM 2279 O  O   . HOH Q 5 .   ? -42.118 -14.338 7.735  1.00 40.35  ? 386 HOH B O   1 
HETATM 2280 O  O   . HOH R 5 .   ? -51.619 7.562   25.633 1.00 37.77  ? 301 HOH A O   1 
HETATM 2281 O  O   . HOH R 5 .   ? -50.463 -1.255  13.691 1.00 33.75  ? 302 HOH A O   1 
HETATM 2282 O  O   . HOH R 5 .   ? -46.981 -3.494  15.762 1.00 29.49  ? 303 HOH A O   1 
HETATM 2283 O  O   . HOH R 5 .   ? -55.111 -18.648 11.498 1.00 38.80  ? 304 HOH A O   1 
HETATM 2284 O  O   . HOH R 5 .   ? -44.963 1.287   9.513  1.00 39.19  ? 305 HOH A O   1 
HETATM 2285 O  O   . HOH R 5 .   ? -49.936 -1.720  32.494 1.00 31.21  ? 306 HOH A O   1 
HETATM 2286 O  O   . HOH R 5 .   ? -57.710 -26.608 11.113 1.00 34.91  ? 307 HOH A O   1 
HETATM 2287 O  O   . HOH R 5 .   ? -59.454 -20.854 23.136 1.00 37.78  ? 308 HOH A O   1 
HETATM 2288 O  O   . HOH R 5 .   ? -51.858 -10.075 31.092 1.00 24.98  ? 309 HOH A O   1 
HETATM 2289 O  O   . HOH R 5 .   ? -66.725 -2.378  29.360 1.00 53.00  ? 310 HOH A O   1 
HETATM 2290 O  O   . HOH R 5 .   ? -44.441 -19.128 29.415 1.00 37.61  ? 311 HOH A O   1 
HETATM 2291 O  O   . HOH R 5 .   ? -34.470 10.874  17.452 1.00 42.09  ? 312 HOH A O   1 
HETATM 2292 O  O   . HOH R 5 .   ? -32.849 5.745   20.208 1.00 47.84  ? 313 HOH A O   1 
HETATM 2293 O  O   . HOH R 5 .   ? -46.559 1.071   33.168 1.00 34.09  ? 314 HOH A O   1 
HETATM 2294 O  O   . HOH R 5 .   ? -50.058 -11.351 13.330 1.00 29.55  ? 315 HOH A O   1 
HETATM 2295 O  O   . HOH R 5 .   ? -48.902 -1.507  16.493 1.00 33.97  ? 316 HOH A O   1 
HETATM 2296 O  O   . HOH R 5 .   ? -48.930 -20.006 26.632 1.00 34.11  ? 317 HOH A O   1 
HETATM 2297 O  O   . HOH R 5 .   ? -37.120 6.727   7.570  1.00 46.27  ? 318 HOH A O   1 
HETATM 2298 O  O   . HOH R 5 .   ? -45.847 -16.728 15.366 1.00 28.94  ? 319 HOH A O   1 
HETATM 2299 O  O   . HOH R 5 .   ? -64.728 -7.380  16.437 1.00 25.47  ? 320 HOH A O   1 
HETATM 2300 O  O   . HOH R 5 .   ? -45.529 -6.355  11.792 1.00 30.00  ? 321 HOH A O   1 
HETATM 2301 O  O   . HOH R 5 .   ? -47.348 -10.220 14.578 1.00 29.74  ? 322 HOH A O   1 
HETATM 2302 O  O   . HOH R 5 .   ? -43.652 -12.371 8.575  1.00 35.74  ? 323 HOH A O   1 
HETATM 2303 O  O   . HOH R 5 .   ? -51.252 4.789   25.093 1.00 26.98  ? 324 HOH A O   1 
HETATM 2304 O  O   . HOH R 5 .   ? -49.660 -24.740 15.554 1.00 38.08  ? 325 HOH A O   1 
HETATM 2305 O  O   . HOH R 5 .   ? -56.051 -21.000 15.655 1.00 30.00  ? 326 HOH A O   1 
HETATM 2306 O  O   . HOH R 5 .   ? -36.603 2.471   28.141 1.00 34.02  ? 327 HOH A O   1 
HETATM 2307 O  O   . HOH R 5 .   ? -44.915 -7.397  31.764 1.00 35.14  ? 328 HOH A O   1 
HETATM 2308 O  O   . HOH R 5 .   ? -64.883 -0.060  14.818 1.00 44.99  ? 329 HOH A O   1 
HETATM 2309 O  O   . HOH R 5 .   ? -42.884 -1.391  9.720  1.00 41.82  ? 330 HOH A O   1 
HETATM 2310 O  O   . HOH R 5 .   ? -67.282 -15.548 15.112 1.00 34.20  ? 331 HOH A O   1 
HETATM 2311 O  O   . HOH R 5 .   ? -32.958 10.713  19.412 1.00 47.30  ? 332 HOH A O   1 
HETATM 2312 O  O   . HOH R 5 .   ? -53.393 4.203   23.478 1.00 28.60  ? 333 HOH A O   1 
HETATM 2313 O  O   . HOH R 5 .   ? -52.263 7.280   29.692 1.00 44.22  ? 334 HOH A O   1 
HETATM 2314 O  O   . HOH R 5 .   ? -37.502 -17.893 19.959 1.00 42.04  ? 335 HOH A O   1 
HETATM 2315 O  O   . HOH R 5 .   ? -50.442 -28.687 12.762 1.00 37.89  ? 336 HOH A O   1 
HETATM 2316 O  O   . HOH R 5 .   ? -71.748 -6.104  28.994 1.00 37.46  ? 337 HOH A O   1 
HETATM 2317 O  O   . HOH R 5 .   ? -56.448 -15.493 32.864 1.00 47.01  ? 338 HOH A O   1 
HETATM 2318 O  O   . HOH R 5 .   ? -47.061 -22.736 19.498 1.00 24.69  ? 339 HOH A O   1 
HETATM 2319 O  O   . HOH R 5 .   ? -44.761 -22.108 21.557 1.00 35.86  ? 340 HOH A O   1 
HETATM 2320 O  O   . HOH R 5 .   ? -43.187 -22.426 12.950 1.00 32.63  ? 341 HOH A O   1 
HETATM 2321 O  O   . HOH R 5 .   ? -41.914 -11.488 31.468 1.00 40.80  ? 342 HOH A O   1 
HETATM 2322 O  O   . HOH R 5 .   ? -42.960 -6.754  33.147 1.00 36.83  ? 343 HOH A O   1 
HETATM 2323 O  O   . HOH R 5 .   ? -52.780 -17.402 31.135 1.00 38.04  ? 344 HOH A O   1 
HETATM 2324 O  O   . HOH R 5 .   ? -54.729 0.982   13.177 1.00 26.06  ? 345 HOH A O   1 
HETATM 2325 O  O   . HOH R 5 .   ? -40.188 8.885   22.559 1.00 44.83  ? 346 HOH A O   1 
HETATM 2326 O  O   . HOH R 5 .   ? -43.357 -17.329 15.776 1.00 26.64  ? 347 HOH A O   1 
HETATM 2327 O  O   . HOH R 5 .   ? -38.194 -20.334 18.752 1.00 38.73  ? 348 HOH A O   1 
HETATM 2328 O  O   . HOH R 5 .   ? -40.032 7.383   5.723  1.00 50.86  ? 349 HOH A O   1 
HETATM 2329 O  O   . HOH R 5 .   ? -36.927 15.308  6.164  1.00 36.28  ? 350 HOH A O   1 
HETATM 2330 O  O   . HOH R 5 .   ? -43.710 -9.684  32.648 1.00 40.23  ? 351 HOH A O   1 
HETATM 2331 O  O   . HOH R 5 .   ? -48.427 -27.601 13.856 1.00 49.78  ? 352 HOH A O   1 
HETATM 2332 O  O   . HOH R 5 .   ? -72.649 -4.498  27.337 1.00 42.95  ? 353 HOH A O   1 
HETATM 2333 O  O   . HOH R 5 .   ? -58.692 -24.023 10.588 1.00 38.05  ? 354 HOH A O   1 
HETATM 2334 O  O   . HOH R 5 .   ? -50.255 -9.367  38.845 1.00 45.05  ? 355 HOH A O   1 
HETATM 2335 O  O   . HOH R 5 .   ? -37.700 1.259   29.909 1.00 35.09  ? 356 HOH A O   1 
HETATM 2336 O  O   . HOH R 5 .   ? -45.973 14.679  12.265 1.00 37.16  ? 357 HOH A O   1 
HETATM 2337 O  O   . HOH R 5 .   ? -58.759 -14.186 32.809 1.00 54.45  ? 358 HOH A O   1 
HETATM 2338 O  O   . HOH R 5 .   ? -45.717 -9.104  7.177  1.00 49.39  ? 359 HOH A O   1 
# 
