data_9C65
# 
_entry.id   9C65 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.404 
_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   9C65         pdb_00009c65 10.2210/pdb9c65/pdb 
WWPDB D_1000284826 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-06-18 
_pdbx_audit_revision_history.part_number         ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9C65 
_pdbx_database_status.recvd_initial_deposition_date   2024-06-07 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           N 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              gbirrane@bidmc.harvard.edu 
_pdbx_contact_author.name_first         Gabriel 
_pdbx_contact_author.name_last          Birrane 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-1759-5499 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Finton, S.'  1 0009-0009-0567-0357 
'Birrane, G.' 2 0000-0002-1759-5499 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     'Structure of SB618 in Complex with SSL11' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Finton, S.'  1 0009-0009-0567-0357 
primary 'Birrane, G.' 2 0000-0002-1759-5499 
# 
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 'Superantigen-like protein 11'                                22687.262 1   ? ? ? ? 
2 non-polymer syn GLYCEROL                                                      92.094    2   ? ? ? ? 
3 non-polymer syn '(4S)-2-METHYL-2,4-PENTANEDIOL'                               118.174   1   ? ? ? ? 
4 non-polymer syn 'N-acetyl-alpha-neuraminic acid'                              309.270   1   ? ? ? ? 
5 non-polymer syn '4-(hydroxymethyl)-1-beta-L-mannopyranosyl-1H-1,2,3-triazole' 261.232   1   ? ? ? ? 
6 water       nat water                                                         18.015    103 ? ? ? ? 
# 
_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       
;STLEVRSQATQDLSEYYNRPYFDLRNLSGYREGNTVTFINHYQQTDVKLEGKDKDKIKDGNNENLDVFVVREGSGRQADN
NSIGGITKTNRTQHIDTVQNVNLLVSKSTGQHTTSVTSTNYSIYKEEISLKELDFKLRKHLIDKHDLYKTEPKDSKIRVT
MKNGDFYTFELNKKLQTHRMGDVIDGRNIEKIEVNL
;
_entity_poly.pdbx_seq_one_letter_code_can   
;STLEVRSQATQDLSEYYNRPYFDLRNLSGYREGNTVTFINHYQQTDVKLEGKDKDKIKDGNNENLDVFVVREGSGRQADN
NSIGGITKTNRTQHIDTVQNVNLLVSKSTGQHTTSVTSTNYSIYKEEISLKELDFKLRKHLIDKHDLYKTEPKDSKIRVT
MKNGDFYTFELNKKLQTHRMGDVIDGRNIEKIEVNL
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 GLYCEROL                                                      GOL   
3 '(4S)-2-METHYL-2,4-PENTANEDIOL'                               MPD   
4 'N-acetyl-alpha-neuraminic acid'                              SIA   
5 '4-(hydroxymethyl)-1-beta-L-mannopyranosyl-1H-1,2,3-triazole' A1AUS 
6 water                                                         HOH   
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   SER n 
1 2   THR n 
1 3   LEU n 
1 4   GLU n 
1 5   VAL n 
1 6   ARG n 
1 7   SER n 
1 8   GLN n 
1 9   ALA n 
1 10  THR n 
1 11  GLN n 
1 12  ASP n 
1 13  LEU n 
1 14  SER n 
1 15  GLU n 
1 16  TYR n 
1 17  TYR n 
1 18  ASN n 
1 19  ARG n 
1 20  PRO n 
1 21  TYR n 
1 22  PHE n 
1 23  ASP n 
1 24  LEU n 
1 25  ARG n 
1 26  ASN n 
1 27  LEU n 
1 28  SER n 
1 29  GLY n 
1 30  TYR n 
1 31  ARG n 
1 32  GLU n 
1 33  GLY n 
1 34  ASN n 
1 35  THR n 
1 36  VAL n 
1 37  THR n 
1 38  PHE n 
1 39  ILE n 
1 40  ASN n 
1 41  HIS n 
1 42  TYR n 
1 43  GLN n 
1 44  GLN n 
1 45  THR n 
1 46  ASP n 
1 47  VAL n 
1 48  LYS n 
1 49  LEU n 
1 50  GLU n 
1 51  GLY n 
1 52  LYS n 
1 53  ASP n 
1 54  LYS n 
1 55  ASP n 
1 56  LYS n 
1 57  ILE n 
1 58  LYS n 
1 59  ASP n 
1 60  GLY n 
1 61  ASN n 
1 62  ASN n 
1 63  GLU n 
1 64  ASN n 
1 65  LEU n 
1 66  ASP n 
1 67  VAL n 
1 68  PHE n 
1 69  VAL n 
1 70  VAL n 
1 71  ARG n 
1 72  GLU n 
1 73  GLY n 
1 74  SER n 
1 75  GLY n 
1 76  ARG n 
1 77  GLN n 
1 78  ALA n 
1 79  ASP n 
1 80  ASN n 
1 81  ASN n 
1 82  SER n 
1 83  ILE n 
1 84  GLY n 
1 85  GLY n 
1 86  ILE n 
1 87  THR n 
1 88  LYS n 
1 89  THR n 
1 90  ASN n 
1 91  ARG n 
1 92  THR n 
1 93  GLN n 
1 94  HIS n 
1 95  ILE n 
1 96  ASP n 
1 97  THR n 
1 98  VAL n 
1 99  GLN n 
1 100 ASN n 
1 101 VAL n 
1 102 ASN n 
1 103 LEU n 
1 104 LEU n 
1 105 VAL n 
1 106 SER n 
1 107 LYS n 
1 108 SER n 
1 109 THR n 
1 110 GLY n 
1 111 GLN n 
1 112 HIS n 
1 113 THR n 
1 114 THR n 
1 115 SER n 
1 116 VAL n 
1 117 THR n 
1 118 SER n 
1 119 THR n 
1 120 ASN n 
1 121 TYR n 
1 122 SER n 
1 123 ILE n 
1 124 TYR n 
1 125 LYS n 
1 126 GLU n 
1 127 GLU n 
1 128 ILE n 
1 129 SER n 
1 130 LEU n 
1 131 LYS n 
1 132 GLU n 
1 133 LEU n 
1 134 ASP n 
1 135 PHE n 
1 136 LYS n 
1 137 LEU n 
1 138 ARG n 
1 139 LYS n 
1 140 HIS n 
1 141 LEU n 
1 142 ILE n 
1 143 ASP n 
1 144 LYS n 
1 145 HIS n 
1 146 ASP n 
1 147 LEU n 
1 148 TYR n 
1 149 LYS n 
1 150 THR n 
1 151 GLU n 
1 152 PRO n 
1 153 LYS n 
1 154 ASP n 
1 155 SER n 
1 156 LYS n 
1 157 ILE n 
1 158 ARG n 
1 159 VAL n 
1 160 THR n 
1 161 MET n 
1 162 LYS n 
1 163 ASN n 
1 164 GLY n 
1 165 ASP n 
1 166 PHE n 
1 167 TYR n 
1 168 THR n 
1 169 PHE n 
1 170 GLU n 
1 171 LEU n 
1 172 ASN n 
1 173 LYS n 
1 174 LYS n 
1 175 LEU n 
1 176 GLN n 
1 177 THR n 
1 178 HIS n 
1 179 ARG n 
1 180 MET n 
1 181 GLY n 
1 182 ASP n 
1 183 VAL n 
1 184 ILE n 
1 185 ASP n 
1 186 GLY n 
1 187 ARG n 
1 188 ASN n 
1 189 ILE n 
1 190 GLU n 
1 191 LYS n 
1 192 ILE n 
1 193 GLU n 
1 194 VAL n 
1 195 ASN n 
1 196 LEU 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                   196 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 sl11 
_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      'Staphylococcus aureus' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     1280 
_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 
A1AUS non-polymer                   . '4-(hydroxymethyl)-1-beta-L-mannopyranosyl-1H-1,2,3-triazole' ? 'C9 H15 N3 O6'   261.232 
ALA   'L-peptide linking'           y ALANINE                                                       ? 'C3 H7 N O2'     89.093  
ARG   'L-peptide linking'           y ARGININE                                                      ? 'C6 H15 N4 O2 1' 175.209 
ASN   'L-peptide linking'           y ASPARAGINE                                                    ? 'C4 H8 N2 O3'    132.118 
ASP   'L-peptide linking'           y 'ASPARTIC ACID'                                               ? 'C4 H7 N O4'     133.103 
GLN   'L-peptide linking'           y GLUTAMINE                                                     ? 'C5 H10 N2 O3'   146.144 
GLU   'L-peptide linking'           y 'GLUTAMIC ACID'                                               ? 'C5 H9 N O4'     147.129 
GLY   'peptide linking'             y GLYCINE                                                       ? 'C2 H5 N O2'     75.067  
GOL   non-polymer                   . GLYCEROL                                                      
'GLYCERIN; PROPANE-1,2,3-TRIOL'                                          'C3 H8 O3'       92.094  
HIS   'L-peptide linking'           y HISTIDINE                                                     ? 'C6 H10 N3 O2 1' 156.162 
HOH   non-polymer                   . WATER                                                         ? 'H2 O'           18.015  
ILE   'L-peptide linking'           y ISOLEUCINE                                                    ? 'C6 H13 N O2'    131.173 
LEU   'L-peptide linking'           y LEUCINE                                                       ? 'C6 H13 N O2'    131.173 
LYS   'L-peptide linking'           y LYSINE                                                        ? 'C6 H15 N2 O2 1' 147.195 
MET   'L-peptide linking'           y METHIONINE                                                    ? 'C5 H11 N O2 S'  149.211 
MPD   non-polymer                   . '(4S)-2-METHYL-2,4-PENTANEDIOL'                               ? 'C6 H14 O2'      118.174 
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 
SIA   'D-saccharide, alpha linking' . 'N-acetyl-alpha-neuraminic acid'                              
'N-acetylneuraminic acid; sialic acid; alpha-sialic acid; O-SIALIC ACID' 'C11 H19 N O9'   309.270 
THR   'L-peptide linking'           y THREONINE                                                     ? 'C4 H9 N O3'     119.119 
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_chem_comp_identifier.comp_id 
_pdbx_chem_comp_identifier.type 
_pdbx_chem_comp_identifier.program 
_pdbx_chem_comp_identifier.program_version 
_pdbx_chem_comp_identifier.identifier 
SIA 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML     1.0 DNeup5Aca                      
SIA 'COMMON NAME'                         GMML     1.0 'N-acetyl-a-D-neuraminic acid' 
SIA 'IUPAC CARBOHYDRATE SYMBOL'           PDB-CARE 1.0 a-D-Neup5Ac                    
SIA 'SNFG CARBOHYDRATE SYMBOL'            GMML     1.0 Neu5Ac                         
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   SER 1   1   ?   ?   ?   A . n 
A 1 2   THR 2   2   ?   ?   ?   A . n 
A 1 3   LEU 3   3   ?   ?   ?   A . n 
A 1 4   GLU 4   4   ?   ?   ?   A . n 
A 1 5   VAL 5   5   ?   ?   ?   A . n 
A 1 6   ARG 6   6   ?   ?   ?   A . n 
A 1 7   SER 7   7   ?   ?   ?   A . n 
A 1 8   GLN 8   8   ?   ?   ?   A . n 
A 1 9   ALA 9   9   9   ALA ALA A . n 
A 1 10  THR 10  10  10  THR THR A . n 
A 1 11  GLN 11  11  11  GLN GLN A . n 
A 1 12  ASP 12  12  12  ASP ASP A . n 
A 1 13  LEU 13  13  13  LEU LEU A . n 
A 1 14  SER 14  14  14  SER SER A . n 
A 1 15  GLU 15  15  15  GLU GLU A . n 
A 1 16  TYR 16  16  16  TYR TYR A . n 
A 1 17  TYR 17  17  17  TYR TYR A . n 
A 1 18  ASN 18  18  18  ASN ASN A . n 
A 1 19  ARG 19  19  19  ARG ARG A . n 
A 1 20  PRO 20  20  20  PRO PRO A . n 
A 1 21  TYR 21  21  21  TYR TYR A . n 
A 1 22  PHE 22  22  22  PHE PHE A . n 
A 1 23  ASP 23  23  23  ASP ASP A . n 
A 1 24  LEU 24  24  24  LEU LEU A . n 
A 1 25  ARG 25  25  25  ARG ARG A . n 
A 1 26  ASN 26  26  26  ASN ASN A . n 
A 1 27  LEU 27  27  27  LEU LEU A . n 
A 1 28  SER 28  28  28  SER SER A . n 
A 1 29  GLY 29  29  29  GLY GLY A . n 
A 1 30  TYR 30  30  30  TYR TYR A . n 
A 1 31  ARG 31  31  31  ARG ARG A . n 
A 1 32  GLU 32  32  32  GLU GLU A . n 
A 1 33  GLY 33  33  33  GLY GLY A . n 
A 1 34  ASN 34  34  34  ASN ASN A . n 
A 1 35  THR 35  35  35  THR THR A . n 
A 1 36  VAL 36  36  36  VAL VAL A . n 
A 1 37  THR 37  37  37  THR THR A . n 
A 1 38  PHE 38  38  38  PHE PHE A . n 
A 1 39  ILE 39  39  39  ILE ILE A . n 
A 1 40  ASN 40  40  40  ASN ASN A . n 
A 1 41  HIS 41  41  41  HIS HIS A . n 
A 1 42  TYR 42  42  42  TYR TYR A . n 
A 1 43  GLN 43  43  43  GLN GLN A . n 
A 1 44  GLN 44  44  44  GLN GLN A . n 
A 1 45  THR 45  45  45  THR THR A . n 
A 1 46  ASP 46  46  46  ASP ASP A . n 
A 1 47  VAL 47  47  47  VAL VAL A . n 
A 1 48  LYS 48  48  48  LYS LYS A . n 
A 1 49  LEU 49  49  49  LEU LEU A . n 
A 1 50  GLU 50  50  50  GLU GLU A . n 
A 1 51  GLY 51  51  51  GLY GLY A . n 
A 1 52  LYS 52  52  52  LYS LYS A . n 
A 1 53  ASP 53  53  53  ASP ASP A . n 
A 1 54  LYS 54  54  54  LYS LYS A . n 
A 1 55  ASP 55  55  55  ASP ASP A . n 
A 1 56  LYS 56  56  56  LYS LYS A . n 
A 1 57  ILE 57  57  57  ILE ILE A . n 
A 1 58  LYS 58  58  58  LYS LYS A . n 
A 1 59  ASP 59  59  59  ASP ASP A . n 
A 1 60  GLY 60  60  60  GLY GLY A . n 
A 1 61  ASN 61  61  61  ASN ASN A . n 
A 1 62  ASN 62  62  62  ASN ASN A . n 
A 1 63  GLU 63  63  63  GLU GLU A . n 
A 1 64  ASN 64  64  64  ASN ASN A . n 
A 1 65  LEU 65  65  65  LEU LEU A . n 
A 1 66  ASP 66  66  66  ASP ASP A . n 
A 1 67  VAL 67  67  67  VAL VAL A . n 
A 1 68  PHE 68  68  68  PHE PHE A . n 
A 1 69  VAL 69  69  69  VAL VAL A . n 
A 1 70  VAL 70  70  70  VAL VAL A . n 
A 1 71  ARG 71  71  71  ARG ARG A . n 
A 1 72  GLU 72  72  72  GLU GLU A . n 
A 1 73  GLY 73  73  73  GLY GLY A . n 
A 1 74  SER 74  74  ?   ?   ?   A . n 
A 1 75  GLY 75  75  ?   ?   ?   A . n 
A 1 76  ARG 76  76  ?   ?   ?   A . n 
A 1 77  GLN 77  77  ?   ?   ?   A . n 
A 1 78  ALA 78  78  ?   ?   ?   A . n 
A 1 79  ASP 79  79  ?   ?   ?   A . n 
A 1 80  ASN 80  80  80  ASN ASN A . n 
A 1 81  ASN 81  81  81  ASN ASN A . n 
A 1 82  SER 82  82  82  SER SER A . n 
A 1 83  ILE 83  83  83  ILE ILE A . n 
A 1 84  GLY 84  84  84  GLY GLY A . n 
A 1 85  GLY 85  85  85  GLY GLY A . n 
A 1 86  ILE 86  86  86  ILE ILE A . n 
A 1 87  THR 87  87  87  THR THR A . n 
A 1 88  LYS 88  88  88  LYS LYS A . n 
A 1 89  THR 89  89  89  THR THR A . n 
A 1 90  ASN 90  90  90  ASN ASN A . n 
A 1 91  ARG 91  91  91  ARG ARG A . n 
A 1 92  THR 92  92  92  THR THR A . n 
A 1 93  GLN 93  93  93  GLN GLN A . n 
A 1 94  HIS 94  94  94  HIS HIS A . n 
A 1 95  ILE 95  95  95  ILE ILE A . n 
A 1 96  ASP 96  96  96  ASP ASP A . n 
A 1 97  THR 97  97  97  THR THR A . n 
A 1 98  VAL 98  98  98  VAL VAL A . n 
A 1 99  GLN 99  99  99  GLN GLN A . n 
A 1 100 ASN 100 100 100 ASN ASN A . n 
A 1 101 VAL 101 101 101 VAL VAL A . n 
A 1 102 ASN 102 102 102 ASN ASN A . n 
A 1 103 LEU 103 103 103 LEU LEU A . n 
A 1 104 LEU 104 104 104 LEU LEU A . n 
A 1 105 VAL 105 105 105 VAL VAL A . n 
A 1 106 SER 106 106 106 SER SER A . n 
A 1 107 LYS 107 107 107 LYS LYS A . n 
A 1 108 SER 108 108 108 SER SER A . n 
A 1 109 THR 109 109 109 THR THR A . n 
A 1 110 GLY 110 110 110 GLY GLY A . n 
A 1 111 GLN 111 111 111 GLN GLN A . n 
A 1 112 HIS 112 112 112 HIS HIS A . n 
A 1 113 THR 113 113 113 THR THR A . n 
A 1 114 THR 114 114 114 THR THR A . n 
A 1 115 SER 115 115 115 SER SER A . n 
A 1 116 VAL 116 116 116 VAL VAL A . n 
A 1 117 THR 117 117 117 THR THR A . n 
A 1 118 SER 118 118 118 SER SER A . n 
A 1 119 THR 119 119 119 THR THR A . n 
A 1 120 ASN 120 120 120 ASN ASN A . n 
A 1 121 TYR 121 121 121 TYR TYR A . n 
A 1 122 SER 122 122 122 SER SER A . n 
A 1 123 ILE 123 123 123 ILE ILE A . n 
A 1 124 TYR 124 124 124 TYR TYR A . n 
A 1 125 LYS 125 125 125 LYS LYS A . n 
A 1 126 GLU 126 126 126 GLU GLU A . n 
A 1 127 GLU 127 127 127 GLU GLU A . n 
A 1 128 ILE 128 128 128 ILE ILE A . n 
A 1 129 SER 129 129 129 SER SER A . n 
A 1 130 LEU 130 130 130 LEU LEU A . n 
A 1 131 LYS 131 131 131 LYS LYS A . n 
A 1 132 GLU 132 132 132 GLU GLU A . n 
A 1 133 LEU 133 133 133 LEU LEU A . n 
A 1 134 ASP 134 134 134 ASP ASP A . n 
A 1 135 PHE 135 135 135 PHE PHE A . n 
A 1 136 LYS 136 136 136 LYS LYS A . n 
A 1 137 LEU 137 137 137 LEU LEU A . n 
A 1 138 ARG 138 138 138 ARG ARG A . n 
A 1 139 LYS 139 139 139 LYS LYS A . n 
A 1 140 HIS 140 140 140 HIS HIS A . n 
A 1 141 LEU 141 141 141 LEU LEU A . n 
A 1 142 ILE 142 142 142 ILE ILE A . n 
A 1 143 ASP 143 143 143 ASP ASP A . n 
A 1 144 LYS 144 144 144 LYS LYS A . n 
A 1 145 HIS 145 145 145 HIS HIS A . n 
A 1 146 ASP 146 146 146 ASP ASP A . n 
A 1 147 LEU 147 147 147 LEU LEU A . n 
A 1 148 TYR 148 148 148 TYR TYR A . n 
A 1 149 LYS 149 149 149 LYS LYS A . n 
A 1 150 THR 150 150 150 THR THR A . n 
A 1 151 GLU 151 151 151 GLU GLU A . n 
A 1 152 PRO 152 152 152 PRO PRO A . n 
A 1 153 LYS 153 153 153 LYS LYS A . n 
A 1 154 ASP 154 154 154 ASP ASP A . n 
A 1 155 SER 155 155 155 SER SER A . n 
A 1 156 LYS 156 156 156 LYS LYS A . n 
A 1 157 ILE 157 157 157 ILE ILE A . n 
A 1 158 ARG 158 158 158 ARG ARG A . n 
A 1 159 VAL 159 159 159 VAL VAL A . n 
A 1 160 THR 160 160 160 THR THR A . n 
A 1 161 MET 161 161 161 MET MET A . n 
A 1 162 LYS 162 162 162 LYS LYS A . n 
A 1 163 ASN 163 163 163 ASN ASN A . n 
A 1 164 GLY 164 164 164 GLY GLY A . n 
A 1 165 ASP 165 165 165 ASP ASP A . n 
A 1 166 PHE 166 166 166 PHE PHE A . n 
A 1 167 TYR 167 167 167 TYR TYR A . n 
A 1 168 THR 168 168 168 THR THR A . n 
A 1 169 PHE 169 169 169 PHE PHE A . n 
A 1 170 GLU 170 170 170 GLU GLU A . n 
A 1 171 LEU 171 171 171 LEU LEU A . n 
A 1 172 ASN 172 172 172 ASN ASN A . n 
A 1 173 LYS 173 173 173 LYS LYS A . n 
A 1 174 LYS 174 174 174 LYS LYS A . n 
A 1 175 LEU 175 175 175 LEU LEU A . n 
A 1 176 GLN 176 176 176 GLN GLN A . n 
A 1 177 THR 177 177 177 THR THR A . n 
A 1 178 HIS 178 178 178 HIS HIS A . n 
A 1 179 ARG 179 179 179 ARG ARG A . n 
A 1 180 MET 180 180 180 MET MET A . n 
A 1 181 GLY 181 181 181 GLY GLY A . n 
A 1 182 ASP 182 182 182 ASP ASP A . n 
A 1 183 VAL 183 183 183 VAL VAL A . n 
A 1 184 ILE 184 184 184 ILE ILE A . n 
A 1 185 ASP 185 185 185 ASP ASP A . n 
A 1 186 GLY 186 186 186 GLY GLY A . n 
A 1 187 ARG 187 187 187 ARG ARG A . n 
A 1 188 ASN 188 188 188 ASN ASN A . n 
A 1 189 ILE 189 189 189 ILE ILE A . n 
A 1 190 GLU 190 190 190 GLU GLU A . n 
A 1 191 LYS 191 191 191 LYS LYS A . n 
A 1 192 ILE 192 192 192 ILE ILE A . n 
A 1 193 GLU 193 193 193 GLU GLU A . n 
A 1 194 VAL 194 194 194 VAL VAL A . n 
A 1 195 ASN 195 195 195 ASN ASN A . n 
A 1 196 LEU 196 196 196 LEU LEU A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        A1AUS 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   A1AUS 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
B 2 GOL   1   201 201 GOL   GOL A . 
C 3 MPD   1   202 202 MPD   MPD A . 
D 2 GOL   1   203 203 GOL   GOL A . 
E 4 SIA   1   204 1   SIA   SIA A . 
F 5 A1AUS 1   205 2   A1AUS Z1Z A . 
G 6 HOH   1   301 246 HOH   HOH A . 
G 6 HOH   2   302 249 HOH   HOH A . 
G 6 HOH   3   303 282 HOH   HOH A . 
G 6 HOH   4   304 220 HOH   HOH A . 
G 6 HOH   5   305 232 HOH   HOH A . 
G 6 HOH   6   306 280 HOH   HOH A . 
G 6 HOH   7   307 248 HOH   HOH A . 
G 6 HOH   8   308 261 HOH   HOH A . 
G 6 HOH   9   309 212 HOH   HOH A . 
G 6 HOH   10  310 208 HOH   HOH A . 
G 6 HOH   11  311 260 HOH   HOH A . 
G 6 HOH   12  312 285 HOH   HOH A . 
G 6 HOH   13  313 236 HOH   HOH A . 
G 6 HOH   14  314 305 HOH   HOH A . 
G 6 HOH   15  315 266 HOH   HOH A . 
G 6 HOH   16  316 211 HOH   HOH A . 
G 6 HOH   17  317 241 HOH   HOH A . 
G 6 HOH   18  318 258 HOH   HOH A . 
G 6 HOH   19  319 306 HOH   HOH A . 
G 6 HOH   20  320 253 HOH   HOH A . 
G 6 HOH   21  321 216 HOH   HOH A . 
G 6 HOH   22  322 294 HOH   HOH A . 
G 6 HOH   23  323 209 HOH   HOH A . 
G 6 HOH   24  324 239 HOH   HOH A . 
G 6 HOH   25  325 215 HOH   HOH A . 
G 6 HOH   26  326 257 HOH   HOH A . 
G 6 HOH   27  327 247 HOH   HOH A . 
G 6 HOH   28  328 233 HOH   HOH A . 
G 6 HOH   29  329 230 HOH   HOH A . 
G 6 HOH   30  330 207 HOH   HOH A . 
G 6 HOH   31  331 256 HOH   HOH A . 
G 6 HOH   32  332 229 HOH   HOH A . 
G 6 HOH   33  333 296 HOH   HOH A . 
G 6 HOH   34  334 206 HOH   HOH A . 
G 6 HOH   35  335 234 HOH   HOH A . 
G 6 HOH   36  336 227 HOH   HOH A . 
G 6 HOH   37  337 213 HOH   HOH A . 
G 6 HOH   38  338 288 HOH   HOH A . 
G 6 HOH   39  339 240 HOH   HOH A . 
G 6 HOH   40  340 250 HOH   HOH A . 
G 6 HOH   41  341 235 HOH   HOH A . 
G 6 HOH   42  342 243 HOH   HOH A . 
G 6 HOH   43  343 244 HOH   HOH A . 
G 6 HOH   44  344 204 HOH   HOH A . 
G 6 HOH   45  345 226 HOH   HOH A . 
G 6 HOH   46  346 252 HOH   HOH A . 
G 6 HOH   47  347 224 HOH   HOH A . 
G 6 HOH   48  348 210 HOH   HOH A . 
G 6 HOH   49  349 284 HOH   HOH A . 
G 6 HOH   50  350 205 HOH   HOH A . 
G 6 HOH   51  351 283 HOH   HOH A . 
G 6 HOH   52  352 217 HOH   HOH A . 
G 6 HOH   53  353 223 HOH   HOH A . 
G 6 HOH   54  354 291 HOH   HOH A . 
G 6 HOH   55  355 231 HOH   HOH A . 
G 6 HOH   56  356 301 HOH   HOH A . 
G 6 HOH   57  357 287 HOH   HOH A . 
G 6 HOH   58  358 290 HOH   HOH A . 
G 6 HOH   59  359 277 HOH   HOH A . 
G 6 HOH   60  360 218 HOH   HOH A . 
G 6 HOH   61  361 228 HOH   HOH A . 
G 6 HOH   62  362 238 HOH   HOH A . 
G 6 HOH   63  363 214 HOH   HOH A . 
G 6 HOH   64  364 300 HOH   HOH A . 
G 6 HOH   65  365 295 HOH   HOH A . 
G 6 HOH   66  366 281 HOH   HOH A . 
G 6 HOH   67  367 219 HOH   HOH A . 
G 6 HOH   68  368 221 HOH   HOH A . 
G 6 HOH   69  369 268 HOH   HOH A . 
G 6 HOH   70  370 265 HOH   HOH A . 
G 6 HOH   71  371 289 HOH   HOH A . 
G 6 HOH   72  372 262 HOH   HOH A . 
G 6 HOH   73  373 278 HOH   HOH A . 
G 6 HOH   74  374 222 HOH   HOH A . 
G 6 HOH   75  375 274 HOH   HOH A . 
G 6 HOH   76  376 275 HOH   HOH A . 
G 6 HOH   77  377 225 HOH   HOH A . 
G 6 HOH   78  378 276 HOH   HOH A . 
G 6 HOH   79  379 297 HOH   HOH A . 
G 6 HOH   80  380 292 HOH   HOH A . 
G 6 HOH   81  381 293 HOH   HOH A . 
G 6 HOH   82  382 269 HOH   HOH A . 
G 6 HOH   83  383 251 HOH   HOH A . 
G 6 HOH   84  384 254 HOH   HOH A . 
G 6 HOH   85  385 298 HOH   HOH A . 
G 6 HOH   86  386 259 HOH   HOH A . 
G 6 HOH   87  387 255 HOH   HOH A . 
G 6 HOH   88  388 302 HOH   HOH A . 
G 6 HOH   89  389 279 HOH   HOH A . 
G 6 HOH   90  390 273 HOH   HOH A . 
G 6 HOH   91  391 272 HOH   HOH A . 
G 6 HOH   92  392 264 HOH   HOH A . 
G 6 HOH   93  393 263 HOH   HOH A . 
G 6 HOH   94  394 242 HOH   HOH A . 
G 6 HOH   95  395 245 HOH   HOH A . 
G 6 HOH   96  396 286 HOH   HOH A . 
G 6 HOH   97  397 303 HOH   HOH A . 
G 6 HOH   98  398 237 HOH   HOH A . 
G 6 HOH   99  399 267 HOH   HOH A . 
G 6 HOH   100 400 304 HOH   HOH A . 
G 6 HOH   101 401 299 HOH   HOH A . 
G 6 HOH   102 402 271 HOH   HOH A . 
G 6 HOH   103 403 270 HOH   HOH A . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0425 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .        2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XSCALE ? ? ? .        3 
? 'model building' ? ? ? ? ? ? ? ? ? ? ? Coot   ? ? ? .        4 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .        5 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9C65 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     104.464 
_cell.length_a_esd                 ? 
_cell.length_b                     104.464 
_cell.length_b_esd                 ? 
_cell.length_c                     62.136 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        6 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9C65 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                152 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 31 2 1' 
_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                   9C65 
_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             4.31 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          71.49 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, HANGING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '100 mM HEPES/NaOH pH 7.0, 55% MPD' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            291 
# 
_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                      Rigaku 
_diffrn_detector.detector                     CCD 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'RIGAKU SATURN 944' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-10-23 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.54 
_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                      'ROTATING ANODE' 
_diffrn_source.target                      ? 
_diffrn_source.type                        'RIGAKU MICROMAX-007 HF' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.54 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   ? 
_diffrn_source.pdbx_synchrotron_site       ? 
# 
_reflns.B_iso_Wilson_estimate                          44.13 
_reflns.entry_id                                       9C65 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              2.458 
_reflns.d_resolution_low                               13.813 
_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                                     14193 
_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                           97.89 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                9.9 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          12.51 
_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                                0.2502 
_reflns.pdbx_Rpim_I_all                                .06434 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.996 
_reflns.pdbx_CC_star                                   0.999 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    2.458 
_reflns_shell.d_res_low                                     2.520 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           1.60 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             895 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               ? 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_reflns_shell.pdbx_Rpim_I_all                               ? 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.507 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          92.21 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            -0.332 
_refine.aniso_B[1][2]                            -0.166 
_refine.aniso_B[1][3]                            -0.000 
_refine.aniso_B[2][2]                            -0.332 
_refine.aniso_B[2][3]                            0.000 
_refine.aniso_B[3][3]                            1.077 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               53.223 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.963 
_refine.correlation_coeff_Fo_to_Fc_free          0.944 
_refine.details                                  'Hydrogens have been added in their riding positions' 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9C65 
_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                            2.458 
_refine.ls_d_res_low                             13.813 
_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                     14193 
_refine.ls_number_reflns_R_free                  658 
_refine.ls_number_reflns_R_work                  13535 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    97.613 
_refine.ls_percent_reflns_R_free                 4.636 
_refine.ls_R_factor_all                          0.175 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.2077 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1738 
_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                      0.172 
_refine.ls_wR_factor_R_work                      0.142 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'MASK BULK SOLVENT' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.215 
_refine.pdbx_overall_ESU_R_Free                  0.183 
_refine.pdbx_solvent_vdw_probe_radii             1.200 
_refine.pdbx_solvent_ion_probe_radii             0.800 
_refine.pdbx_solvent_shrinkage_radii             0.800 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             12.528 
_refine.overall_SU_ML                            0.148 
_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                    0.9754 
_refine.pdbx_average_fsc_free                    0.9642 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       2.458 
_refine_hist.d_res_low                        13.813 
_refine_hist.number_atoms_solvent             103 
_refine_hist.number_atoms_total               1651 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        1490 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         58 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.016  0.012  1584 ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.016  1497 ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 2.672  1.869  2134 ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 0.926  1.828  3455 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 8.019  5.000  184  ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 10.148 5.000  9    ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 16.974 10.000 295  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 14.771 10.000 82   ? r_dihedral_angle_6_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.134  0.200  244  ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.044  0.200  2    ? r_chiral_restr_other           ? ? 
'X-RAY DIFFRACTION' ? 0.012  0.020  1812 ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.002  0.020  356  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.269  0.200  289  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.215  0.200  1479 ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.193  0.200  756  ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.102  0.200  953  ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.166  0.200  98   ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.248  0.200  14   ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.250  0.200  64   ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.244  0.200  10   ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 5.430  3.366  733  ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 5.425  3.365  733  ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 8.126  6.012  915  ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 8.127  6.014  916  ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 6.941  4.068  851  ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 6.937  4.070  852  ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 10.214 7.164  1218 ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 10.212 7.165  1219 ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 14.371 42.591 7352 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 14.371 42.592 7353 ? r_lrange_other                 ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 2.458 2.520  1027 . 52 895 92.2103  . 0.356 . . 0.355 . . . . . 0.344 . 20 . 0.941 0.898 0.369 
'X-RAY DIFFRACTION' 2.520 2.587  1012 . 41 939 96.8379  . 0.289 . . 0.288 . . . . . 0.260 . 20 . 0.955 0.967 0.312 
'X-RAY DIFFRACTION' 2.587 2.659  970  . 39 925 99.3814  . 0.243 . . 0.240 . . . . . 0.213 . 20 . 0.965 0.940 0.322 
'X-RAY DIFFRACTION' 2.659 2.738  934  . 39 870 97.3233  . 0.248 . . 0.248 . . . . . 0.211 . 20 . 0.964 0.967 0.248 
'X-RAY DIFFRACTION' 2.738 2.824  948  . 28 897 97.5738  . 0.230 . . 0.228 . . . . . 0.191 . 20 . 0.968 0.961 0.307 
'X-RAY DIFFRACTION' 2.824 2.918  877  . 43 834 100.0000 . 0.219 . . 0.218 . . . . . 0.180 . 20 . 0.972 0.959 0.243 
'X-RAY DIFFRACTION' 2.918 3.023  860  . 35 807 97.9070  . 0.210 . . 0.205 . . . . . 0.165 . 20 . 0.973 0.939 0.320 
'X-RAY DIFFRACTION' 3.023 3.141  846  . 45 785 98.1087  . 0.193 . . 0.194 . . . . . 0.159 . 20 . 0.976 0.976 0.191 
'X-RAY DIFFRACTION' 3.141 3.273  808  . 44 754 98.7624  . 0.184 . . 0.181 . . . . . 0.154 . 20 . 0.982 0.969 0.229 
'X-RAY DIFFRACTION' 3.273 3.423  761  . 50 711 100.0000 . 0.168 . . 0.167 . . . . . 0.143 . 20 . 0.985 0.982 0.182 
'X-RAY DIFFRACTION' 3.423 3.596  743  . 23 711 98.7887  . 0.162 . . 0.161 . . . . . 0.142 . 20 . 0.987 0.977 0.200 
'X-RAY DIFFRACTION' 3.596 3.798  701  . 35 659 99.0014  . 0.162 . . 0.161 . . . . . 0.143 . 20 . 0.989 0.982 0.182 
'X-RAY DIFFRACTION' 3.798 4.038  672  . 20 647 99.2560  . 0.147 . . 0.147 . . . . . 0.130 . 20 . 0.989 0.983 0.148 
'X-RAY DIFFRACTION' 4.038 4.331  626  . 28 594 99.3610  . 0.129 . . 0.128 . . . . . 0.107 . 20 . 0.990 0.988 0.154 
'X-RAY DIFFRACTION' 4.331 4.698  570  . 21 546 99.4737  . 0.114 . . 0.112 . . . . . 0.098 . 20 . 0.993 0.978 0.167 
'X-RAY DIFFRACTION' 4.698 5.179  540  . 30 505 99.0741  . 0.117 . . 0.116 . . . . . 0.101 . 20 . 0.992 0.987 0.133 
'X-RAY DIFFRACTION' 5.179 5.844  483  . 12 469 99.5859  . 0.133 . . 0.133 . . . . . 0.117 . 20 . 0.991 0.992 0.136 
'X-RAY DIFFRACTION' 5.844 6.858  431  . 25 406 100.0000 . 0.206 . . 0.199 . . . . . 0.168 . 20 . 0.980 0.951 0.326 
'X-RAY DIFFRACTION' 6.858 8.686  362  . 32 330 100.0000 . 0.200 . . 0.195 . . . . . 0.168 . 20 . 0.980 0.975 0.261 
'X-RAY DIFFRACTION' 8.686 13.813 268  . 16 251 99.6269  . 0.161 . . 0.163 . . . . . 0.158 . 20 . 0.986 0.989 0.140 
# 
_struct.entry_id                     9C65 
_struct.title                        'Crystal structure of Staphylococcal Superantigen-Like protein 11 in complex with SB618' 
_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        9C65 
_struct_keywords.text            'Complex, CARBOHYDRATE, SUGAR BINDING PROTEIN' 
_struct_keywords.pdbx_keywords   'SUGAR BINDING PROTEIN' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 2 ? 
E N N 4 ? 
F N N 5 ? 
G N N 6 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    SLL11_STAAU 
_struct_ref.pdbx_db_accession          A8E1U5 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;STLEVRSQATQDLSEYYNRPYFDLRNLSGYREGNTVTFINHYQQTDVKLEGKDKDKIKDGNNENLDVFVVREGSGRQADN
NSIGGITKTNRTQHIDTVQNVNLLVSKSTGQHTTSVTSTNYSIYKEEISLKELDFKLRKHLIDKHDLYKTEPKDSKIRVT
MKNGDFYTFELNKKLQTHRMGDVIDGRNIEKIEVNL
;
_struct_ref.pdbx_align_begin           1 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9C65 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 1 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 196 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             A8E1U5 
_struct_ref_seq.db_align_beg                  1 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  196 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       1 
_struct_ref_seq.pdbx_auth_seq_align_end       196 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F,G 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'isothermal titration calorimetry' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 ALA A 9   ? ASN A 18  ? ALA A 9   ASN A 18  1 ? 10 
HELX_P HELX_P2 AA2 GLY A 51  ? LYS A 56  ? GLY A 51  LYS A 56  5 ? 6  
HELX_P HELX_P3 AA3 LEU A 130 ? HIS A 145 ? LEU A 130 HIS A 145 1 ? 16 
HELX_P HELX_P4 AA4 GLN A 176 ? MET A 180 ? GLN A 176 MET A 180 5 ? 5  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
_struct_conn.id                            covale1 
_struct_conn.conn_type_id                  covale 
_struct_conn.pdbx_leaving_atom_flag        one 
_struct_conn.pdbx_PDB_id                   ? 
_struct_conn.ptnr1_label_asym_id           E 
_struct_conn.ptnr1_label_comp_id           SIA 
_struct_conn.ptnr1_label_seq_id            . 
_struct_conn.ptnr1_label_atom_id           C2 
_struct_conn.pdbx_ptnr1_label_alt_id       ? 
_struct_conn.pdbx_ptnr1_PDB_ins_code       ? 
_struct_conn.pdbx_ptnr1_standard_comp_id   ? 
_struct_conn.ptnr1_symmetry                1_555 
_struct_conn.ptnr2_label_asym_id           F 
_struct_conn.ptnr2_label_comp_id           A1AUS 
_struct_conn.ptnr2_label_seq_id            . 
_struct_conn.ptnr2_label_atom_id           O17 
_struct_conn.pdbx_ptnr2_label_alt_id       ? 
_struct_conn.pdbx_ptnr2_PDB_ins_code       ? 
_struct_conn.ptnr1_auth_asym_id            A 
_struct_conn.ptnr1_auth_comp_id            SIA 
_struct_conn.ptnr1_auth_seq_id             204 
_struct_conn.ptnr2_auth_asym_id            A 
_struct_conn.ptnr2_auth_comp_id            A1AUS 
_struct_conn.ptnr2_auth_seq_id             205 
_struct_conn.ptnr2_symmetry                1_555 
_struct_conn.pdbx_ptnr3_label_atom_id      ? 
_struct_conn.pdbx_ptnr3_label_seq_id       ? 
_struct_conn.pdbx_ptnr3_label_comp_id      ? 
_struct_conn.pdbx_ptnr3_label_asym_id      ? 
_struct_conn.pdbx_ptnr3_label_alt_id       ? 
_struct_conn.pdbx_ptnr3_PDB_ins_code       ? 
_struct_conn.details                       ? 
_struct_conn.pdbx_dist_value               1.450 
_struct_conn.pdbx_value_order              ? 
_struct_conn.pdbx_role                     ? 
# 
_struct_conn_type.id          covale 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 6 ? 
AA2 ? 5 ? 
AA3 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? parallel      
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA1 5 6 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA2 2 3 ? parallel      
AA2 3 4 ? anti-parallel 
AA2 4 5 ? anti-parallel 
AA3 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 ASN A 81  ? ILE A 83  ? ASN A 81  ILE A 83  
AA1 2 GLN A 44  ? LYS A 48  ? GLN A 44  LYS A 48  
AA1 3 THR A 35  ? ILE A 39  ? THR A 35  ILE A 39  
AA1 4 PHE A 22  ? GLU A 32  ? PHE A 22  GLU A 32  
AA1 5 GLY A 60  ? VAL A 69  ? GLY A 60  VAL A 69  
AA1 6 ILE A 86  ? LYS A 88  ? ILE A 86  LYS A 88  
AA2 1 THR A 114 ? ILE A 123 ? THR A 114 ILE A 123 
AA2 2 GLN A 99  ? SER A 108 ? GLN A 99  SER A 108 
AA2 3 ILE A 189 ? LEU A 196 ? ILE A 189 LEU A 196 
AA2 4 LYS A 156 ? MET A 161 ? LYS A 156 MET A 161 
AA2 5 PHE A 166 ? GLU A 170 ? PHE A 166 GLU A 170 
AA3 1 GLU A 127 ? SER A 129 ? GLU A 127 SER A 129 
AA3 2 VAL A 183 ? ASP A 185 ? VAL A 183 ASP A 185 
# 
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 SER A 82  ? O SER A 82  N LYS A 48  ? N LYS A 48  
AA1 2 3 O VAL A 47  ? O VAL A 47  N VAL A 36  ? N VAL A 36  
AA1 3 4 O THR A 35  ? O THR A 35  N GLU A 32  ? N GLU A 32  
AA1 4 5 N GLY A 29  ? N GLY A 29  O ASN A 62  ? O ASN A 62  
AA1 5 6 N ASP A 66  ? N ASP A 66  O THR A 87  ? O THR A 87  
AA2 1 2 O TYR A 121 ? O TYR A 121 N VAL A 101 ? N VAL A 101 
AA2 2 3 N LEU A 104 ? N LEU A 104 O VAL A 194 ? O VAL A 194 
AA2 3 4 O GLU A 190 ? O GLU A 190 N THR A 160 ? N THR A 160 
AA2 4 5 N ILE A 157 ? N ILE A 157 O PHE A 169 ? O PHE A 169 
AA3 1 2 N ILE A 128 ? N ILE A 128 O ILE A 184 ? O ILE A 184 
# 
_pdbx_entry_details.entry_id                   9C65 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   N 
# 
loop_
_pdbx_validate_rmsd_angle.id 
_pdbx_validate_rmsd_angle.PDB_model_num 
_pdbx_validate_rmsd_angle.auth_atom_id_1 
_pdbx_validate_rmsd_angle.auth_asym_id_1 
_pdbx_validate_rmsd_angle.auth_comp_id_1 
_pdbx_validate_rmsd_angle.auth_seq_id_1 
_pdbx_validate_rmsd_angle.PDB_ins_code_1 
_pdbx_validate_rmsd_angle.label_alt_id_1 
_pdbx_validate_rmsd_angle.auth_atom_id_2 
_pdbx_validate_rmsd_angle.auth_asym_id_2 
_pdbx_validate_rmsd_angle.auth_comp_id_2 
_pdbx_validate_rmsd_angle.auth_seq_id_2 
_pdbx_validate_rmsd_angle.PDB_ins_code_2 
_pdbx_validate_rmsd_angle.label_alt_id_2 
_pdbx_validate_rmsd_angle.auth_atom_id_3 
_pdbx_validate_rmsd_angle.auth_asym_id_3 
_pdbx_validate_rmsd_angle.auth_comp_id_3 
_pdbx_validate_rmsd_angle.auth_seq_id_3 
_pdbx_validate_rmsd_angle.PDB_ins_code_3 
_pdbx_validate_rmsd_angle.label_alt_id_3 
_pdbx_validate_rmsd_angle.angle_value 
_pdbx_validate_rmsd_angle.angle_target_value 
_pdbx_validate_rmsd_angle.angle_deviation 
_pdbx_validate_rmsd_angle.angle_standard_deviation 
_pdbx_validate_rmsd_angle.linker_flag 
1 1 NE A ARG 25  ? ? CZ A ARG 25  ? ? NH2 A ARG 25  ? ? 123.37 120.30 3.07   0.50 N 
2 1 NE A ARG 31  ? ? CZ A ARG 31  ? ? NH1 A ARG 31  ? ? 116.08 120.30 -4.22  0.50 N 
3 1 NE A ARG 31  ? ? CZ A ARG 31  ? ? NH2 A ARG 31  ? ? 124.00 120.30 3.70   0.50 N 
4 1 N  A LYS 156 ? ? CA A LYS 156 ? ? CB  A LYS 156 ? ? 97.15  110.60 -13.45 1.80 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 HIS A 41  ? A -62.31  20.94   
2 1 HIS A 41  ? B -58.38  -0.88   
3 1 TYR A 42  ? ? -146.57 -38.43  
4 1 HIS A 145 ? ? -143.12 26.54   
5 1 LYS A 153 ? ? 57.63   -116.29 
6 1 ASP A 165 ? ? -48.77  150.84  
# 
_pdbx_validate_planes.id              1 
_pdbx_validate_planes.PDB_model_num   1 
_pdbx_validate_planes.auth_comp_id    ARG 
_pdbx_validate_planes.auth_asym_id    A 
_pdbx_validate_planes.auth_seq_id     187 
_pdbx_validate_planes.PDB_ins_code    ? 
_pdbx_validate_planes.label_alt_id    ? 
_pdbx_validate_planes.rmsd            0.112 
_pdbx_validate_planes.type            'SIDE CHAIN' 
# 
loop_
_pdbx_struct_special_symmetry.id 
_pdbx_struct_special_symmetry.PDB_model_num 
_pdbx_struct_special_symmetry.auth_asym_id 
_pdbx_struct_special_symmetry.auth_comp_id 
_pdbx_struct_special_symmetry.auth_seq_id 
_pdbx_struct_special_symmetry.PDB_ins_code 
_pdbx_struct_special_symmetry.label_asym_id 
_pdbx_struct_special_symmetry.label_comp_id 
_pdbx_struct_special_symmetry.label_seq_id 
1 1 A HOH 378 ? G HOH . 
2 1 A HOH 398 ? G HOH . 
# 
_pdbx_refine_tls.id               1 
_pdbx_refine_tls.pdbx_refine_id   'X-RAY DIFFRACTION' 
_pdbx_refine_tls.details          ? 
_pdbx_refine_tls.method           refined 
_pdbx_refine_tls.origin_x         35.7130 
_pdbx_refine_tls.origin_y         -34.1200 
_pdbx_refine_tls.origin_z         -12.9720 
_pdbx_refine_tls.T[1][1]          0.1700 
_pdbx_refine_tls.T[1][1]_esd      ? 
_pdbx_refine_tls.T[1][2]          -0.1386 
_pdbx_refine_tls.T[1][2]_esd      ? 
_pdbx_refine_tls.T[1][3]          0.0263 
_pdbx_refine_tls.T[1][3]_esd      ? 
_pdbx_refine_tls.T[2][2]          0.3687 
_pdbx_refine_tls.T[2][2]_esd      ? 
_pdbx_refine_tls.T[2][3]          0.0603 
_pdbx_refine_tls.T[2][3]_esd      ? 
_pdbx_refine_tls.T[3][3]          0.0516 
_pdbx_refine_tls.T[3][3]_esd      ? 
_pdbx_refine_tls.L[1][1]          0.7692 
_pdbx_refine_tls.L[1][1]_esd      ? 
_pdbx_refine_tls.L[1][2]          0.7729 
_pdbx_refine_tls.L[1][2]_esd      ? 
_pdbx_refine_tls.L[1][3]          -0.5556 
_pdbx_refine_tls.L[1][3]_esd      ? 
_pdbx_refine_tls.L[2][2]          0.9364 
_pdbx_refine_tls.L[2][2]_esd      ? 
_pdbx_refine_tls.L[2][3]          -0.9198 
_pdbx_refine_tls.L[2][3]_esd      ? 
_pdbx_refine_tls.L[3][3]          2.1343 
_pdbx_refine_tls.L[3][3]_esd      ? 
_pdbx_refine_tls.S[1][1]          0.0998 
_pdbx_refine_tls.S[1][1]_esd      ? 
_pdbx_refine_tls.S[1][2]          -0.0773 
_pdbx_refine_tls.S[1][2]_esd      ? 
_pdbx_refine_tls.S[1][3]          -0.0529 
_pdbx_refine_tls.S[1][3]_esd      ? 
_pdbx_refine_tls.S[2][1]          -0.0370 
_pdbx_refine_tls.S[2][1]_esd      ? 
_pdbx_refine_tls.S[2][2]          0.0484 
_pdbx_refine_tls.S[2][2]_esd      ? 
_pdbx_refine_tls.S[2][3]          -0.0576 
_pdbx_refine_tls.S[2][3]_esd      ? 
_pdbx_refine_tls.S[3][1]          0.0723 
_pdbx_refine_tls.S[3][1]_esd      ? 
_pdbx_refine_tls.S[3][2]          -0.3310 
_pdbx_refine_tls.S[3][2]_esd      ? 
_pdbx_refine_tls.S[3][3]          -0.1482 
_pdbx_refine_tls.S[3][3]_esd      ? 
# 
_pdbx_refine_tls_group.id                  1 
_pdbx_refine_tls_group.pdbx_refine_id      'X-RAY DIFFRACTION' 
_pdbx_refine_tls_group.refine_tls_id       1 
_pdbx_refine_tls_group.beg_label_asym_id   ? 
_pdbx_refine_tls_group.beg_label_seq_id    ? 
_pdbx_refine_tls_group.beg_auth_asym_id    A 
_pdbx_refine_tls_group.beg_auth_seq_id     9 
_pdbx_refine_tls_group.beg_PDB_ins_code    ? 
_pdbx_refine_tls_group.end_label_asym_id   ? 
_pdbx_refine_tls_group.end_label_seq_id    ? 
_pdbx_refine_tls_group.end_auth_asym_id    A 
_pdbx_refine_tls_group.end_auth_seq_id     203 
_pdbx_refine_tls_group.end_PDB_ins_code    ? 
_pdbx_refine_tls_group.selection           ALL 
_pdbx_refine_tls_group.selection_details   ? 
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? A HOH 402 ? 7.88 . 
2 1 O ? A HOH 403 ? 8.17 . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 A SER 1  ? A SER 1  
2  1 Y 1 A THR 2  ? A THR 2  
3  1 Y 1 A LEU 3  ? A LEU 3  
4  1 Y 1 A GLU 4  ? A GLU 4  
5  1 Y 1 A VAL 5  ? A VAL 5  
6  1 Y 1 A ARG 6  ? A ARG 6  
7  1 Y 1 A SER 7  ? A SER 7  
8  1 Y 1 A GLN 8  ? A GLN 8  
9  1 Y 1 A SER 74 ? A SER 74 
10 1 Y 1 A GLY 75 ? A GLY 75 
11 1 Y 1 A ARG 76 ? A ARG 76 
12 1 Y 1 A GLN 77 ? A GLN 77 
13 1 Y 1 A ALA 78 ? A ALA 78 
14 1 Y 1 A ASP 79 ? A ASP 79 
# 
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 
A1AUS C10  C N S 1   
A1AUS C11  C N R 2   
A1AUS C15  C N N 3   
A1AUS C02  C Y N 4   
A1AUS C03  C Y N 5   
A1AUS C06  C N N 6   
A1AUS C08  C N R 7   
A1AUS N01  N Y N 8   
A1AUS N04  N Y N 9   
A1AUS O18  O N N 10  
A1AUS C09  C N R 11  
A1AUS O17  O N N 12  
A1AUS O12  O N N 13  
A1AUS C13  C N R 14  
A1AUS O16  O N N 15  
A1AUS O14  O N N 16  
A1AUS N05  N Y N 17  
A1AUS O07  O N N 18  
A1AUS H10  H N N 19  
A1AUS H11  H N N 20  
A1AUS H16  H N N 21  
A1AUS H15  H N N 22  
A1AUS H02  H N N 23  
A1AUS H06  H N N 24  
A1AUS H07  H N N 25  
A1AUS H08  H N N 26  
A1AUS H2A  H N N 27  
A1AUS H09  H N N 28  
A1AUS H19  H N N 29  
A1AUS H12  H N N 30  
A1AUS H13  H N N 31  
A1AUS H18  H N N 32  
A1AUS H17  H N N 33  
ALA   N    N N N 34  
ALA   CA   C N S 35  
ALA   C    C N N 36  
ALA   O    O N N 37  
ALA   CB   C N N 38  
ALA   OXT  O N N 39  
ALA   H    H N N 40  
ALA   H2   H N N 41  
ALA   HA   H N N 42  
ALA   HB1  H N N 43  
ALA   HB2  H N N 44  
ALA   HB3  H N N 45  
ALA   HXT  H N N 46  
ARG   N    N N N 47  
ARG   CA   C N S 48  
ARG   C    C N N 49  
ARG   O    O N N 50  
ARG   CB   C N N 51  
ARG   CG   C N N 52  
ARG   CD   C N N 53  
ARG   NE   N N N 54  
ARG   CZ   C N N 55  
ARG   NH1  N N N 56  
ARG   NH2  N N N 57  
ARG   OXT  O N N 58  
ARG   H    H N N 59  
ARG   H2   H N N 60  
ARG   HA   H N N 61  
ARG   HB2  H N N 62  
ARG   HB3  H N N 63  
ARG   HG2  H N N 64  
ARG   HG3  H N N 65  
ARG   HD2  H N N 66  
ARG   HD3  H N N 67  
ARG   HE   H N N 68  
ARG   HH11 H N N 69  
ARG   HH12 H N N 70  
ARG   HH21 H N N 71  
ARG   HH22 H N N 72  
ARG   HXT  H N N 73  
ASN   N    N N N 74  
ASN   CA   C N S 75  
ASN   C    C N N 76  
ASN   O    O N N 77  
ASN   CB   C N N 78  
ASN   CG   C N N 79  
ASN   OD1  O N N 80  
ASN   ND2  N N N 81  
ASN   OXT  O N N 82  
ASN   H    H N N 83  
ASN   H2   H N N 84  
ASN   HA   H N N 85  
ASN   HB2  H N N 86  
ASN   HB3  H N N 87  
ASN   HD21 H N N 88  
ASN   HD22 H N N 89  
ASN   HXT  H N N 90  
ASP   N    N N N 91  
ASP   CA   C N S 92  
ASP   C    C N N 93  
ASP   O    O N N 94  
ASP   CB   C N N 95  
ASP   CG   C N N 96  
ASP   OD1  O N N 97  
ASP   OD2  O N N 98  
ASP   OXT  O N N 99  
ASP   H    H N N 100 
ASP   H2   H N N 101 
ASP   HA   H N N 102 
ASP   HB2  H N N 103 
ASP   HB3  H N N 104 
ASP   HD2  H N N 105 
ASP   HXT  H N N 106 
GLN   N    N N N 107 
GLN   CA   C N S 108 
GLN   C    C N N 109 
GLN   O    O N N 110 
GLN   CB   C N N 111 
GLN   CG   C N N 112 
GLN   CD   C N N 113 
GLN   OE1  O N N 114 
GLN   NE2  N N N 115 
GLN   OXT  O N N 116 
GLN   H    H N N 117 
GLN   H2   H N N 118 
GLN   HA   H N N 119 
GLN   HB2  H N N 120 
GLN   HB3  H N N 121 
GLN   HG2  H N N 122 
GLN   HG3  H N N 123 
GLN   HE21 H N N 124 
GLN   HE22 H N N 125 
GLN   HXT  H N N 126 
GLU   N    N N N 127 
GLU   CA   C N S 128 
GLU   C    C N N 129 
GLU   O    O N N 130 
GLU   CB   C N N 131 
GLU   CG   C N N 132 
GLU   CD   C N N 133 
GLU   OE1  O N N 134 
GLU   OE2  O N N 135 
GLU   OXT  O N N 136 
GLU   H    H N N 137 
GLU   H2   H N N 138 
GLU   HA   H N N 139 
GLU   HB2  H N N 140 
GLU   HB3  H N N 141 
GLU   HG2  H N N 142 
GLU   HG3  H N N 143 
GLU   HE2  H N N 144 
GLU   HXT  H N N 145 
GLY   N    N N N 146 
GLY   CA   C N N 147 
GLY   C    C N N 148 
GLY   O    O N N 149 
GLY   OXT  O N N 150 
GLY   H    H N N 151 
GLY   H2   H N N 152 
GLY   HA2  H N N 153 
GLY   HA3  H N N 154 
GLY   HXT  H N N 155 
GOL   C1   C N N 156 
GOL   O1   O N N 157 
GOL   C2   C N N 158 
GOL   O2   O N N 159 
GOL   C3   C N N 160 
GOL   O3   O N N 161 
GOL   H11  H N N 162 
GOL   H12  H N N 163 
GOL   HO1  H N N 164 
GOL   H2   H N N 165 
GOL   HO2  H N N 166 
GOL   H31  H N N 167 
GOL   H32  H N N 168 
GOL   HO3  H N N 169 
HIS   N    N N N 170 
HIS   CA   C N S 171 
HIS   C    C N N 172 
HIS   O    O N N 173 
HIS   CB   C N N 174 
HIS   CG   C Y N 175 
HIS   ND1  N Y N 176 
HIS   CD2  C Y N 177 
HIS   CE1  C Y N 178 
HIS   NE2  N Y N 179 
HIS   OXT  O N N 180 
HIS   H    H N N 181 
HIS   H2   H N N 182 
HIS   HA   H N N 183 
HIS   HB2  H N N 184 
HIS   HB3  H N N 185 
HIS   HD1  H N N 186 
HIS   HD2  H N N 187 
HIS   HE1  H N N 188 
HIS   HE2  H N N 189 
HIS   HXT  H N N 190 
HOH   O    O N N 191 
HOH   H1   H N N 192 
HOH   H2   H N N 193 
ILE   N    N N N 194 
ILE   CA   C N S 195 
ILE   C    C N N 196 
ILE   O    O N N 197 
ILE   CB   C N S 198 
ILE   CG1  C N N 199 
ILE   CG2  C N N 200 
ILE   CD1  C N N 201 
ILE   OXT  O N N 202 
ILE   H    H N N 203 
ILE   H2   H N N 204 
ILE   HA   H N N 205 
ILE   HB   H N N 206 
ILE   HG12 H N N 207 
ILE   HG13 H N N 208 
ILE   HG21 H N N 209 
ILE   HG22 H N N 210 
ILE   HG23 H N N 211 
ILE   HD11 H N N 212 
ILE   HD12 H N N 213 
ILE   HD13 H N N 214 
ILE   HXT  H N N 215 
LEU   N    N N N 216 
LEU   CA   C N S 217 
LEU   C    C N N 218 
LEU   O    O N N 219 
LEU   CB   C N N 220 
LEU   CG   C N N 221 
LEU   CD1  C N N 222 
LEU   CD2  C N N 223 
LEU   OXT  O N N 224 
LEU   H    H N N 225 
LEU   H2   H N N 226 
LEU   HA   H N N 227 
LEU   HB2  H N N 228 
LEU   HB3  H N N 229 
LEU   HG   H N N 230 
LEU   HD11 H N N 231 
LEU   HD12 H N N 232 
LEU   HD13 H N N 233 
LEU   HD21 H N N 234 
LEU   HD22 H N N 235 
LEU   HD23 H N N 236 
LEU   HXT  H N N 237 
LYS   N    N N N 238 
LYS   CA   C N S 239 
LYS   C    C N N 240 
LYS   O    O N N 241 
LYS   CB   C N N 242 
LYS   CG   C N N 243 
LYS   CD   C N N 244 
LYS   CE   C N N 245 
LYS   NZ   N N N 246 
LYS   OXT  O N N 247 
LYS   H    H N N 248 
LYS   H2   H N N 249 
LYS   HA   H N N 250 
LYS   HB2  H N N 251 
LYS   HB3  H N N 252 
LYS   HG2  H N N 253 
LYS   HG3  H N N 254 
LYS   HD2  H N N 255 
LYS   HD3  H N N 256 
LYS   HE2  H N N 257 
LYS   HE3  H N N 258 
LYS   HZ1  H N N 259 
LYS   HZ2  H N N 260 
LYS   HZ3  H N N 261 
LYS   HXT  H N N 262 
MET   N    N N N 263 
MET   CA   C N S 264 
MET   C    C N N 265 
MET   O    O N N 266 
MET   CB   C N N 267 
MET   CG   C N N 268 
MET   SD   S N N 269 
MET   CE   C N N 270 
MET   OXT  O N N 271 
MET   H    H N N 272 
MET   H2   H N N 273 
MET   HA   H N N 274 
MET   HB2  H N N 275 
MET   HB3  H N N 276 
MET   HG2  H N N 277 
MET   HG3  H N N 278 
MET   HE1  H N N 279 
MET   HE2  H N N 280 
MET   HE3  H N N 281 
MET   HXT  H N N 282 
MPD   C1   C N N 283 
MPD   C2   C N N 284 
MPD   O2   O N N 285 
MPD   CM   C N N 286 
MPD   C3   C N N 287 
MPD   C4   C N S 288 
MPD   O4   O N N 289 
MPD   C5   C N N 290 
MPD   H11  H N N 291 
MPD   H12  H N N 292 
MPD   H13  H N N 293 
MPD   HO2  H N N 294 
MPD   HM1  H N N 295 
MPD   HM2  H N N 296 
MPD   HM3  H N N 297 
MPD   H31  H N N 298 
MPD   H32  H N N 299 
MPD   H4   H N N 300 
MPD   HO4  H N N 301 
MPD   H51  H N N 302 
MPD   H52  H N N 303 
MPD   H53  H N N 304 
PHE   N    N N N 305 
PHE   CA   C N S 306 
PHE   C    C N N 307 
PHE   O    O N N 308 
PHE   CB   C N N 309 
PHE   CG   C Y N 310 
PHE   CD1  C Y N 311 
PHE   CD2  C Y N 312 
PHE   CE1  C Y N 313 
PHE   CE2  C Y N 314 
PHE   CZ   C Y N 315 
PHE   OXT  O N N 316 
PHE   H    H N N 317 
PHE   H2   H N N 318 
PHE   HA   H N N 319 
PHE   HB2  H N N 320 
PHE   HB3  H N N 321 
PHE   HD1  H N N 322 
PHE   HD2  H N N 323 
PHE   HE1  H N N 324 
PHE   HE2  H N N 325 
PHE   HZ   H N N 326 
PHE   HXT  H N N 327 
PRO   N    N N N 328 
PRO   CA   C N S 329 
PRO   C    C N N 330 
PRO   O    O N N 331 
PRO   CB   C N N 332 
PRO   CG   C N N 333 
PRO   CD   C N N 334 
PRO   OXT  O N N 335 
PRO   H    H N N 336 
PRO   HA   H N N 337 
PRO   HB2  H N N 338 
PRO   HB3  H N N 339 
PRO   HG2  H N N 340 
PRO   HG3  H N N 341 
PRO   HD2  H N N 342 
PRO   HD3  H N N 343 
PRO   HXT  H N N 344 
SER   N    N N N 345 
SER   CA   C N S 346 
SER   C    C N N 347 
SER   O    O N N 348 
SER   CB   C N N 349 
SER   OG   O N N 350 
SER   OXT  O N N 351 
SER   H    H N N 352 
SER   H2   H N N 353 
SER   HA   H N N 354 
SER   HB2  H N N 355 
SER   HB3  H N N 356 
SER   HG   H N N 357 
SER   HXT  H N N 358 
SIA   C1   C N N 359 
SIA   C2   C N R 360 
SIA   C3   C N N 361 
SIA   C4   C N S 362 
SIA   C5   C N R 363 
SIA   C6   C N R 364 
SIA   C7   C N R 365 
SIA   C8   C N R 366 
SIA   C9   C N N 367 
SIA   C10  C N N 368 
SIA   C11  C N N 369 
SIA   N5   N N N 370 
SIA   O1A  O N N 371 
SIA   O1B  O N N 372 
SIA   O2   O N N 373 
SIA   O4   O N N 374 
SIA   O6   O N N 375 
SIA   O7   O N N 376 
SIA   O8   O N N 377 
SIA   O9   O N N 378 
SIA   O10  O N N 379 
SIA   H32  H N N 380 
SIA   H31  H N N 381 
SIA   H4   H N N 382 
SIA   H5   H N N 383 
SIA   H6   H N N 384 
SIA   H7   H N N 385 
SIA   H8   H N N 386 
SIA   H92  H N N 387 
SIA   H91  H N N 388 
SIA   H111 H N N 389 
SIA   H113 H N N 390 
SIA   H112 H N N 391 
SIA   HN5  H N N 392 
SIA   HO1B H N N 393 
SIA   HO2  H N N 394 
SIA   HO4  H N N 395 
SIA   HO7  H N N 396 
SIA   HO8  H N N 397 
SIA   HO9  H N N 398 
THR   N    N N N 399 
THR   CA   C N S 400 
THR   C    C N N 401 
THR   O    O N N 402 
THR   CB   C N R 403 
THR   OG1  O N N 404 
THR   CG2  C N N 405 
THR   OXT  O N N 406 
THR   H    H N N 407 
THR   H2   H N N 408 
THR   HA   H N N 409 
THR   HB   H N N 410 
THR   HG1  H N N 411 
THR   HG21 H N N 412 
THR   HG22 H N N 413 
THR   HG23 H N N 414 
THR   HXT  H N N 415 
TYR   N    N N N 416 
TYR   CA   C N S 417 
TYR   C    C N N 418 
TYR   O    O N N 419 
TYR   CB   C N N 420 
TYR   CG   C Y N 421 
TYR   CD1  C Y N 422 
TYR   CD2  C Y N 423 
TYR   CE1  C Y N 424 
TYR   CE2  C Y N 425 
TYR   CZ   C Y N 426 
TYR   OH   O N N 427 
TYR   OXT  O N N 428 
TYR   H    H N N 429 
TYR   H2   H N N 430 
TYR   HA   H N N 431 
TYR   HB2  H N N 432 
TYR   HB3  H N N 433 
TYR   HD1  H N N 434 
TYR   HD2  H N N 435 
TYR   HE1  H N N 436 
TYR   HE2  H N N 437 
TYR   HH   H N N 438 
TYR   HXT  H N N 439 
VAL   N    N N N 440 
VAL   CA   C N S 441 
VAL   C    C N N 442 
VAL   O    O N N 443 
VAL   CB   C N N 444 
VAL   CG1  C N N 445 
VAL   CG2  C N N 446 
VAL   OXT  O N N 447 
VAL   H    H N N 448 
VAL   H2   H N N 449 
VAL   HA   H N N 450 
VAL   HB   H N N 451 
VAL   HG11 H N N 452 
VAL   HG12 H N N 453 
VAL   HG13 H N N 454 
VAL   HG21 H N N 455 
VAL   HG22 H N N 456 
VAL   HG23 H N N 457 
VAL   HXT  H N N 458 
# 
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 
A1AUS C09 O18  sing N N 1   
A1AUS C09 C10  sing N N 2   
A1AUS C09 C08  sing N N 3   
A1AUS C10 O17  sing N N 4   
A1AUS C10 C11  sing N N 5   
A1AUS C11 O12  sing N N 6   
A1AUS C11 C13  sing N N 7   
A1AUS C13 C15  sing N N 8   
A1AUS C13 O14  sing N N 9   
A1AUS C15 O16  sing N N 10  
A1AUS C08 O14  sing N N 11  
A1AUS C08 N01  sing N N 12  
A1AUS N01 C02  sing Y N 13  
A1AUS N01 N05  sing Y N 14  
A1AUS C03 C02  doub Y N 15  
A1AUS N05 N04  doub Y N 16  
A1AUS C03 N04  sing Y N 17  
A1AUS C03 C06  sing N N 18  
A1AUS C06 O07  sing N N 19  
A1AUS C10 H10  sing N N 20  
A1AUS C11 H11  sing N N 21  
A1AUS C15 H16  sing N N 22  
A1AUS C15 H15  sing N N 23  
A1AUS C02 H02  sing N N 24  
A1AUS C06 H06  sing N N 25  
A1AUS C06 H07  sing N N 26  
A1AUS C08 H08  sing N N 27  
A1AUS O18 H2A  sing N N 28  
A1AUS C09 H09  sing N N 29  
A1AUS O17 H19  sing N N 30  
A1AUS O12 H12  sing N N 31  
A1AUS C13 H13  sing N N 32  
A1AUS O16 H18  sing N N 33  
A1AUS O07 H17  sing N N 34  
ALA   N   CA   sing N N 35  
ALA   N   H    sing N N 36  
ALA   N   H2   sing N N 37  
ALA   CA  C    sing N N 38  
ALA   CA  CB   sing N N 39  
ALA   CA  HA   sing N N 40  
ALA   C   O    doub N N 41  
ALA   C   OXT  sing N N 42  
ALA   CB  HB1  sing N N 43  
ALA   CB  HB2  sing N N 44  
ALA   CB  HB3  sing N N 45  
ALA   OXT HXT  sing N N 46  
ARG   N   CA   sing N N 47  
ARG   N   H    sing N N 48  
ARG   N   H2   sing N N 49  
ARG   CA  C    sing N N 50  
ARG   CA  CB   sing N N 51  
ARG   CA  HA   sing N N 52  
ARG   C   O    doub N N 53  
ARG   C   OXT  sing N N 54  
ARG   CB  CG   sing N N 55  
ARG   CB  HB2  sing N N 56  
ARG   CB  HB3  sing N N 57  
ARG   CG  CD   sing N N 58  
ARG   CG  HG2  sing N N 59  
ARG   CG  HG3  sing N N 60  
ARG   CD  NE   sing N N 61  
ARG   CD  HD2  sing N N 62  
ARG   CD  HD3  sing N N 63  
ARG   NE  CZ   sing N N 64  
ARG   NE  HE   sing N N 65  
ARG   CZ  NH1  sing N N 66  
ARG   CZ  NH2  doub N N 67  
ARG   NH1 HH11 sing N N 68  
ARG   NH1 HH12 sing N N 69  
ARG   NH2 HH21 sing N N 70  
ARG   NH2 HH22 sing N N 71  
ARG   OXT HXT  sing N N 72  
ASN   N   CA   sing N N 73  
ASN   N   H    sing N N 74  
ASN   N   H2   sing N N 75  
ASN   CA  C    sing N N 76  
ASN   CA  CB   sing N N 77  
ASN   CA  HA   sing N N 78  
ASN   C   O    doub N N 79  
ASN   C   OXT  sing N N 80  
ASN   CB  CG   sing N N 81  
ASN   CB  HB2  sing N N 82  
ASN   CB  HB3  sing N N 83  
ASN   CG  OD1  doub N N 84  
ASN   CG  ND2  sing N N 85  
ASN   ND2 HD21 sing N N 86  
ASN   ND2 HD22 sing N N 87  
ASN   OXT HXT  sing N N 88  
ASP   N   CA   sing N N 89  
ASP   N   H    sing N N 90  
ASP   N   H2   sing N N 91  
ASP   CA  C    sing N N 92  
ASP   CA  CB   sing N N 93  
ASP   CA  HA   sing N N 94  
ASP   C   O    doub N N 95  
ASP   C   OXT  sing N N 96  
ASP   CB  CG   sing N N 97  
ASP   CB  HB2  sing N N 98  
ASP   CB  HB3  sing N N 99  
ASP   CG  OD1  doub N N 100 
ASP   CG  OD2  sing N N 101 
ASP   OD2 HD2  sing N N 102 
ASP   OXT HXT  sing N N 103 
GLN   N   CA   sing N N 104 
GLN   N   H    sing N N 105 
GLN   N   H2   sing N N 106 
GLN   CA  C    sing N N 107 
GLN   CA  CB   sing N N 108 
GLN   CA  HA   sing N N 109 
GLN   C   O    doub N N 110 
GLN   C   OXT  sing N N 111 
GLN   CB  CG   sing N N 112 
GLN   CB  HB2  sing N N 113 
GLN   CB  HB3  sing N N 114 
GLN   CG  CD   sing N N 115 
GLN   CG  HG2  sing N N 116 
GLN   CG  HG3  sing N N 117 
GLN   CD  OE1  doub N N 118 
GLN   CD  NE2  sing N N 119 
GLN   NE2 HE21 sing N N 120 
GLN   NE2 HE22 sing N N 121 
GLN   OXT HXT  sing N N 122 
GLU   N   CA   sing N N 123 
GLU   N   H    sing N N 124 
GLU   N   H2   sing N N 125 
GLU   CA  C    sing N N 126 
GLU   CA  CB   sing N N 127 
GLU   CA  HA   sing N N 128 
GLU   C   O    doub N N 129 
GLU   C   OXT  sing N N 130 
GLU   CB  CG   sing N N 131 
GLU   CB  HB2  sing N N 132 
GLU   CB  HB3  sing N N 133 
GLU   CG  CD   sing N N 134 
GLU   CG  HG2  sing N N 135 
GLU   CG  HG3  sing N N 136 
GLU   CD  OE1  doub N N 137 
GLU   CD  OE2  sing N N 138 
GLU   OE2 HE2  sing N N 139 
GLU   OXT HXT  sing N N 140 
GLY   N   CA   sing N N 141 
GLY   N   H    sing N N 142 
GLY   N   H2   sing N N 143 
GLY   CA  C    sing N N 144 
GLY   CA  HA2  sing N N 145 
GLY   CA  HA3  sing N N 146 
GLY   C   O    doub N N 147 
GLY   C   OXT  sing N N 148 
GLY   OXT HXT  sing N N 149 
GOL   C1  O1   sing N N 150 
GOL   C1  C2   sing N N 151 
GOL   C1  H11  sing N N 152 
GOL   C1  H12  sing N N 153 
GOL   O1  HO1  sing N N 154 
GOL   C2  O2   sing N N 155 
GOL   C2  C3   sing N N 156 
GOL   C2  H2   sing N N 157 
GOL   O2  HO2  sing N N 158 
GOL   C3  O3   sing N N 159 
GOL   C3  H31  sing N N 160 
GOL   C3  H32  sing N N 161 
GOL   O3  HO3  sing N N 162 
HIS   N   CA   sing N N 163 
HIS   N   H    sing N N 164 
HIS   N   H2   sing N N 165 
HIS   CA  C    sing N N 166 
HIS   CA  CB   sing N N 167 
HIS   CA  HA   sing N N 168 
HIS   C   O    doub N N 169 
HIS   C   OXT  sing N N 170 
HIS   CB  CG   sing N N 171 
HIS   CB  HB2  sing N N 172 
HIS   CB  HB3  sing N N 173 
HIS   CG  ND1  sing Y N 174 
HIS   CG  CD2  doub Y N 175 
HIS   ND1 CE1  doub Y N 176 
HIS   ND1 HD1  sing N N 177 
HIS   CD2 NE2  sing Y N 178 
HIS   CD2 HD2  sing N N 179 
HIS   CE1 NE2  sing Y N 180 
HIS   CE1 HE1  sing N N 181 
HIS   NE2 HE2  sing N N 182 
HIS   OXT HXT  sing N N 183 
HOH   O   H1   sing N N 184 
HOH   O   H2   sing N N 185 
ILE   N   CA   sing N N 186 
ILE   N   H    sing N N 187 
ILE   N   H2   sing N N 188 
ILE   CA  C    sing N N 189 
ILE   CA  CB   sing N N 190 
ILE   CA  HA   sing N N 191 
ILE   C   O    doub N N 192 
ILE   C   OXT  sing N N 193 
ILE   CB  CG1  sing N N 194 
ILE   CB  CG2  sing N N 195 
ILE   CB  HB   sing N N 196 
ILE   CG1 CD1  sing N N 197 
ILE   CG1 HG12 sing N N 198 
ILE   CG1 HG13 sing N N 199 
ILE   CG2 HG21 sing N N 200 
ILE   CG2 HG22 sing N N 201 
ILE   CG2 HG23 sing N N 202 
ILE   CD1 HD11 sing N N 203 
ILE   CD1 HD12 sing N N 204 
ILE   CD1 HD13 sing N N 205 
ILE   OXT HXT  sing N N 206 
LEU   N   CA   sing N N 207 
LEU   N   H    sing N N 208 
LEU   N   H2   sing N N 209 
LEU   CA  C    sing N N 210 
LEU   CA  CB   sing N N 211 
LEU   CA  HA   sing N N 212 
LEU   C   O    doub N N 213 
LEU   C   OXT  sing N N 214 
LEU   CB  CG   sing N N 215 
LEU   CB  HB2  sing N N 216 
LEU   CB  HB3  sing N N 217 
LEU   CG  CD1  sing N N 218 
LEU   CG  CD2  sing N N 219 
LEU   CG  HG   sing N N 220 
LEU   CD1 HD11 sing N N 221 
LEU   CD1 HD12 sing N N 222 
LEU   CD1 HD13 sing N N 223 
LEU   CD2 HD21 sing N N 224 
LEU   CD2 HD22 sing N N 225 
LEU   CD2 HD23 sing N N 226 
LEU   OXT HXT  sing N N 227 
LYS   N   CA   sing N N 228 
LYS   N   H    sing N N 229 
LYS   N   H2   sing N N 230 
LYS   CA  C    sing N N 231 
LYS   CA  CB   sing N N 232 
LYS   CA  HA   sing N N 233 
LYS   C   O    doub N N 234 
LYS   C   OXT  sing N N 235 
LYS   CB  CG   sing N N 236 
LYS   CB  HB2  sing N N 237 
LYS   CB  HB3  sing N N 238 
LYS   CG  CD   sing N N 239 
LYS   CG  HG2  sing N N 240 
LYS   CG  HG3  sing N N 241 
LYS   CD  CE   sing N N 242 
LYS   CD  HD2  sing N N 243 
LYS   CD  HD3  sing N N 244 
LYS   CE  NZ   sing N N 245 
LYS   CE  HE2  sing N N 246 
LYS   CE  HE3  sing N N 247 
LYS   NZ  HZ1  sing N N 248 
LYS   NZ  HZ2  sing N N 249 
LYS   NZ  HZ3  sing N N 250 
LYS   OXT HXT  sing N N 251 
MET   N   CA   sing N N 252 
MET   N   H    sing N N 253 
MET   N   H2   sing N N 254 
MET   CA  C    sing N N 255 
MET   CA  CB   sing N N 256 
MET   CA  HA   sing N N 257 
MET   C   O    doub N N 258 
MET   C   OXT  sing N N 259 
MET   CB  CG   sing N N 260 
MET   CB  HB2  sing N N 261 
MET   CB  HB3  sing N N 262 
MET   CG  SD   sing N N 263 
MET   CG  HG2  sing N N 264 
MET   CG  HG3  sing N N 265 
MET   SD  CE   sing N N 266 
MET   CE  HE1  sing N N 267 
MET   CE  HE2  sing N N 268 
MET   CE  HE3  sing N N 269 
MET   OXT HXT  sing N N 270 
MPD   C1  C2   sing N N 271 
MPD   C1  H11  sing N N 272 
MPD   C1  H12  sing N N 273 
MPD   C1  H13  sing N N 274 
MPD   C2  O2   sing N N 275 
MPD   C2  CM   sing N N 276 
MPD   C2  C3   sing N N 277 
MPD   O2  HO2  sing N N 278 
MPD   CM  HM1  sing N N 279 
MPD   CM  HM2  sing N N 280 
MPD   CM  HM3  sing N N 281 
MPD   C3  C4   sing N N 282 
MPD   C3  H31  sing N N 283 
MPD   C3  H32  sing N N 284 
MPD   C4  O4   sing N N 285 
MPD   C4  C5   sing N N 286 
MPD   C4  H4   sing N N 287 
MPD   O4  HO4  sing N N 288 
MPD   C5  H51  sing N N 289 
MPD   C5  H52  sing N N 290 
MPD   C5  H53  sing N N 291 
PHE   N   CA   sing N N 292 
PHE   N   H    sing N N 293 
PHE   N   H2   sing N N 294 
PHE   CA  C    sing N N 295 
PHE   CA  CB   sing N N 296 
PHE   CA  HA   sing N N 297 
PHE   C   O    doub N N 298 
PHE   C   OXT  sing N N 299 
PHE   CB  CG   sing N N 300 
PHE   CB  HB2  sing N N 301 
PHE   CB  HB3  sing N N 302 
PHE   CG  CD1  doub Y N 303 
PHE   CG  CD2  sing Y N 304 
PHE   CD1 CE1  sing Y N 305 
PHE   CD1 HD1  sing N N 306 
PHE   CD2 CE2  doub Y N 307 
PHE   CD2 HD2  sing N N 308 
PHE   CE1 CZ   doub Y N 309 
PHE   CE1 HE1  sing N N 310 
PHE   CE2 CZ   sing Y N 311 
PHE   CE2 HE2  sing N N 312 
PHE   CZ  HZ   sing N N 313 
PHE   OXT HXT  sing N N 314 
PRO   N   CA   sing N N 315 
PRO   N   CD   sing N N 316 
PRO   N   H    sing N N 317 
PRO   CA  C    sing N N 318 
PRO   CA  CB   sing N N 319 
PRO   CA  HA   sing N N 320 
PRO   C   O    doub N N 321 
PRO   C   OXT  sing N N 322 
PRO   CB  CG   sing N N 323 
PRO   CB  HB2  sing N N 324 
PRO   CB  HB3  sing N N 325 
PRO   CG  CD   sing N N 326 
PRO   CG  HG2  sing N N 327 
PRO   CG  HG3  sing N N 328 
PRO   CD  HD2  sing N N 329 
PRO   CD  HD3  sing N N 330 
PRO   OXT HXT  sing N N 331 
SER   N   CA   sing N N 332 
SER   N   H    sing N N 333 
SER   N   H2   sing N N 334 
SER   CA  C    sing N N 335 
SER   CA  CB   sing N N 336 
SER   CA  HA   sing N N 337 
SER   C   O    doub N N 338 
SER   C   OXT  sing N N 339 
SER   CB  OG   sing N N 340 
SER   CB  HB2  sing N N 341 
SER   CB  HB3  sing N N 342 
SER   OG  HG   sing N N 343 
SER   OXT HXT  sing N N 344 
SIA   C1  C2   sing N N 345 
SIA   C1  O1A  doub N N 346 
SIA   C1  O1B  sing N N 347 
SIA   C2  C3   sing N N 348 
SIA   C2  O2   sing N N 349 
SIA   C2  O6   sing N N 350 
SIA   C3  C4   sing N N 351 
SIA   C3  H32  sing N N 352 
SIA   C3  H31  sing N N 353 
SIA   C4  C5   sing N N 354 
SIA   C4  O4   sing N N 355 
SIA   C4  H4   sing N N 356 
SIA   C5  C6   sing N N 357 
SIA   C5  N5   sing N N 358 
SIA   C5  H5   sing N N 359 
SIA   C6  C7   sing N N 360 
SIA   C6  O6   sing N N 361 
SIA   C6  H6   sing N N 362 
SIA   C7  C8   sing N N 363 
SIA   C7  O7   sing N N 364 
SIA   C7  H7   sing N N 365 
SIA   C8  C9   sing N N 366 
SIA   C8  O8   sing N N 367 
SIA   C8  H8   sing N N 368 
SIA   C9  O9   sing N N 369 
SIA   C9  H92  sing N N 370 
SIA   C9  H91  sing N N 371 
SIA   C10 C11  sing N N 372 
SIA   C10 N5   sing N N 373 
SIA   C10 O10  doub N N 374 
SIA   C11 H111 sing N N 375 
SIA   C11 H113 sing N N 376 
SIA   C11 H112 sing N N 377 
SIA   N5  HN5  sing N N 378 
SIA   O1B HO1B sing N N 379 
SIA   O2  HO2  sing N N 380 
SIA   O4  HO4  sing N N 381 
SIA   O7  HO7  sing N N 382 
SIA   O8  HO8  sing N N 383 
SIA   O9  HO9  sing N N 384 
THR   N   CA   sing N N 385 
THR   N   H    sing N N 386 
THR   N   H2   sing N N 387 
THR   CA  C    sing N N 388 
THR   CA  CB   sing N N 389 
THR   CA  HA   sing N N 390 
THR   C   O    doub N N 391 
THR   C   OXT  sing N N 392 
THR   CB  OG1  sing N N 393 
THR   CB  CG2  sing N N 394 
THR   CB  HB   sing N N 395 
THR   OG1 HG1  sing N N 396 
THR   CG2 HG21 sing N N 397 
THR   CG2 HG22 sing N N 398 
THR   CG2 HG23 sing N N 399 
THR   OXT HXT  sing N N 400 
TYR   N   CA   sing N N 401 
TYR   N   H    sing N N 402 
TYR   N   H2   sing N N 403 
TYR   CA  C    sing N N 404 
TYR   CA  CB   sing N N 405 
TYR   CA  HA   sing N N 406 
TYR   C   O    doub N N 407 
TYR   C   OXT  sing N N 408 
TYR   CB  CG   sing N N 409 
TYR   CB  HB2  sing N N 410 
TYR   CB  HB3  sing N N 411 
TYR   CG  CD1  doub Y N 412 
TYR   CG  CD2  sing Y N 413 
TYR   CD1 CE1  sing Y N 414 
TYR   CD1 HD1  sing N N 415 
TYR   CD2 CE2  doub Y N 416 
TYR   CD2 HD2  sing N N 417 
TYR   CE1 CZ   doub Y N 418 
TYR   CE1 HE1  sing N N 419 
TYR   CE2 CZ   sing Y N 420 
TYR   CE2 HE2  sing N N 421 
TYR   CZ  OH   sing N N 422 
TYR   OH  HH   sing N N 423 
TYR   OXT HXT  sing N N 424 
VAL   N   CA   sing N N 425 
VAL   N   H    sing N N 426 
VAL   N   H2   sing N N 427 
VAL   CA  C    sing N N 428 
VAL   CA  CB   sing N N 429 
VAL   CA  HA   sing N N 430 
VAL   C   O    doub N N 431 
VAL   C   OXT  sing N N 432 
VAL   CB  CG1  sing N N 433 
VAL   CB  CG2  sing N N 434 
VAL   CB  HB   sing N N 435 
VAL   CG1 HG11 sing N N 436 
VAL   CG1 HG12 sing N N 437 
VAL   CG1 HG13 sing N N 438 
VAL   CG2 HG21 sing N N 439 
VAL   CG2 HG22 sing N N 440 
VAL   CG2 HG23 sing N N 441 
VAL   OXT HXT  sing N N 442 
# 
_pdbx_audit_support.funding_organization   'Science Foundation Ireland' 
_pdbx_audit_support.country                Ireland 
_pdbx_audit_support.grant_number           16/IA/4419 
_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   2RDG 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9C65 
_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]   0.009573 
_atom_sites.fract_transf_matrix[1][2]   0.005527 
_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]   0.011054 
_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]   0.016094 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.pdbx_scat_Z 
_atom_type.pdbx_N_electrons 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
C 6  6  2.3103  20.8439 1.0201 10.2075 1.5888 0.5687  0.8651 51.6512 0.2156   
H 1  1  0.4930  10.5109 0.3229 26.1257 0.1402 3.1424  0.0408 57.7997 0.0030   
N 7  7  12.2220 0.0057  3.1346 9.8933  2.0141 28.9975 1.1672 0.5826  -11.5379 
O 8  8  3.0487  13.2771 2.2870 5.7011  1.5464 0.3239  0.8671 32.9089 0.2508   
S 16 16 6.9054  1.4679  5.2035 22.2151 1.4379 0.2536  1.5863 56.1720 1.1842   
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
_atom_site.calc_flag 
_atom_site.pdbx_tls_group_id 
ATOM   1    N N   . ALA   A 1 9   ? 25.045 -52.183 -14.812 1.000 72.116  0 9   ALA   A N   1 ? 1 
ATOM   2    C CA  . ALA   A 1 9   ? 25.227 -50.713 -15.008 1.000 71.088  0 9   ALA   A CA  1 ? 1 
ATOM   3    C C   . ALA   A 1 9   ? 25.835 -50.090 -13.757 1.000 68.745  0 9   ALA   A C   1 ? 1 
ATOM   4    O O   . ALA   A 1 9   ? 26.811 -49.408 -13.924 1.000 71.637  0 9   ALA   A O   1 ? 1 
ATOM   5    C CB  . ALA   A 1 9   ? 23.937 -50.002 -15.387 1.000 58.933  0 9   ALA   A CB  1 ? 1 
ATOM   6    N N   . THR   A 1 10  ? 25.272 -50.353 -12.558 1.000 65.902  0 10  THR   A N   1 ? 1 
ATOM   7    C CA  . THR   A 1 10  ? 25.865 -49.955 -11.295 1.000 67.257  0 10  THR   A CA  1 ? 1 
ATOM   8    C C   . THR   A 1 10  ? 27.291 -50.501 -11.219 1.000 70.089  0 10  THR   A C   1 ? 1 
ATOM   9    O O   . THR   A 1 10  ? 28.216 -49.769 -10.849 1.000 68.412  0 10  THR   A O   1 ? 1 
ATOM   10   C CB  . THR   A 1 10  ? 25.014 -50.370 -10.093 1.000 65.663  0 10  THR   A CB  1 ? 1 
ATOM   11   O OG1 . THR   A 1 10  ? 23.938 -49.442 -10.099 1.000 67.582  0 10  THR   A OG1 1 ? 1 
ATOM   12   C CG2 . THR   A 1 10  ? 25.685 -50.180 -8.738  1.000 65.477  0 10  THR   A CG2 1 ? 1 
ATOM   13   N N   . GLN   A 1 11  ? 27.468 -51.761 -11.620 1.000 71.056  0 11  GLN   A N   1 ? 1 
ATOM   14   C CA  . GLN   A 1 11  ? 28.788 -52.393 -11.637 1.000 76.789  0 11  GLN   A CA  1 ? 1 
ATOM   15   C C   . GLN   A 1 11  ? 29.720 -51.610 -12.544 1.000 66.017  0 11  GLN   A C   1 ? 1 
ATOM   16   O O   . GLN   A 1 11  ? 30.910 -51.488 -12.251 1.000 64.094  0 11  GLN   A O   1 ? 1 
ATOM   17   C CB  . GLN   A 1 11  ? 28.817 -53.797 -12.263 1.000 87.543  0 11  GLN   A CB  1 ? 1 
ATOM   18   C CG  . GLN   A 1 11  ? 28.128 -54.887 -11.444 1.000 96.301  0 11  GLN   A CG  1 ? 1 
ATOM   19   C CD  . GLN   A 1 11  ? 27.243 -55.812 -12.268 1.000 108.511 0 11  GLN   A CD  1 ? 1 
ATOM   20   O OE1 . GLN   A 1 11  ? 27.166 -55.761 -13.502 1.000 140.493 0 11  GLN   A OE1 1 ? 1 
ATOM   21   N NE2 . GLN   A 1 11  ? 26.435 -56.566 -11.563 1.000 109.694 0 11  GLN   A NE2 1 ? 1 
ATOM   22   N N   . ASP   A 1 12  ? 29.129 -51.168 -13.662 1.000 61.677  0 12  ASP   A N   1 ? 1 
ATOM   23   C CA  . ASP   A 1 12  ? 29.877 -50.536 -14.723 1.000 63.090  0 12  ASP   A CA  1 ? 1 
ATOM   24   C C   . ASP   A 1 12  ? 30.334 -49.181 -14.236 1.000 57.142  0 12  ASP   A C   1 ? 1 
ATOM   25   O O   . ASP   A 1 12  ? 31.488 -48.819 -14.437 1.000 59.063  0 12  ASP   A O   1 ? 1 
ATOM   26   C CB  . ASP   A 1 12  ? 29.037 -50.287 -15.957 1.000 71.739  0 12  ASP   A CB  1 ? 1 
ATOM   27   C CG  . ASP   A 1 12  ? 28.680 -51.505 -16.794 1.000 81.324  0 12  ASP   A CG  1 ? 1 
ATOM   28   O OD1 . ASP   A 1 12  ? 29.398 -52.533 -16.639 1.000 75.201  0 12  ASP   A OD1 1 ? 1 
ATOM   29   O OD2 . ASP   A 1 12  ? 27.666 -51.395 -17.567 1.000 71.668  0 12  ASP   A OD2 1 ? 1 
ATOM   30   N N   . LEU   A 1 13  ? 29.380 -48.487 -13.613 1.000 49.520  0 13  LEU   A N   1 ? 1 
ATOM   31   C CA  . LEU   A 1 13  ? 29.577 -47.194 -13.013 1.000 50.306  0 13  LEU   A CA  1 ? 1 
ATOM   32   C C   . LEU   A 1 13  ? 30.686 -47.266 -11.957 1.000 49.786  0 13  LEU   A C   1 ? 1 
ATOM   33   O O   . LEU   A 1 13  ? 31.606 -46.455 -12.001 1.000 51.362  0 13  LEU   A O   1 ? 1 
ATOM   34   C CB  . LEU   A 1 13  ? 28.280 -46.659 -12.422 1.000 53.622  0 13  LEU   A CB  1 ? 1 
ATOM   35   C CG  . LEU   A 1 13  ? 27.292 -45.974 -13.376 1.000 53.284  0 13  LEU   A CG  1 ? 1 
ATOM   36   C CD1 . LEU   A 1 13  ? 26.017 -45.492 -12.664 1.000 55.151  0 13  LEU   A CD1 1 ? 1 
ATOM   37   C CD2 . LEU   A 1 13  ? 27.936 -44.794 -14.053 1.000 62.823  0 13  LEU   A CD2 1 ? 1 
ATOM   38   N N   . SER   A 1 14  ? 30.669 -48.260 -11.071 1.000 47.774  0 14  SER   A N   1 ? 1 
ATOM   39   C CA  . SER   A 1 14  ? 31.713 -48.324 -10.073 1.000 52.574  0 14  SER   A CA  1 ? 1 
ATOM   40   C C   . SER   A 1 14  ? 33.046 -48.706 -10.712 1.000 49.631  0 14  SER   A C   1 ? 1 
ATOM   41   O O   . SER   A 1 14  ? 34.098 -48.256 -10.269 1.000 44.593  0 14  SER   A O   1 ? 1 
ATOM   42   C CB  . SER   A 1 14  ? 31.368 -49.226 -8.873  1.000 58.245  0 14  SER   A CB  1 ? 1 
ATOM   43   O OG  . SER   A 1 14  ? 31.832 -50.550 -9.077  1.000 57.567  0 14  SER   A OG  1 ? 1 
ATOM   44   N N   . GLU   A 1 15  ? 33.040 -49.517 -11.768 1.000 51.216  0 15  GLU   A N   1 ? 1 
ATOM   45   C CA  . GLU   A 1 15  ? 34.323 -49.847 -12.383 1.000 55.925  0 15  GLU   A CA  1 ? 1 
ATOM   46   C C   . GLU   A 1 15  ? 34.959 -48.578 -12.962 1.000 48.886  0 15  GLU   A C   1 ? 1 
ATOM   47   O O   . GLU   A 1 15  ? 36.151 -48.372 -12.862 1.000 44.889  0 15  GLU   A O   1 ? 1 
ATOM   48   C CB  . GLU   A 1 15  ? 34.195 -50.926 -13.457 1.000 57.603  0 15  GLU   A CB  1 ? 1 
ATOM   49   C CG  . GLU   A 1 15  ? 35.549 -51.460 -13.935 1.000 59.723  0 15  GLU   A CG  1 ? 1 
ATOM   50   C CD  . GLU   A 1 15  ? 36.305 -50.591 -14.923 1.000 69.007  0 15  GLU   A CD  1 ? 1 
ATOM   51   O OE1 . GLU   A 1 15  ? 35.678 -50.038 -15.860 1.000 57.369  0 15  GLU   A OE1 1 ? 1 
ATOM   52   O OE2 . GLU   A 1 15  ? 37.544 -50.458 -14.741 1.000 77.365  0 15  GLU   A OE2 1 ? 1 
ATOM   53   N N   . TYR   A 1 16  ? 34.108 -47.709 -13.504 1.000 47.501  0 16  TYR   A N   1 ? 1 
ATOM   54   C CA  . TYR   A 1 16  ? 34.542 -46.508 -14.186 1.000 49.088  0 16  TYR   A CA  1 ? 1 
ATOM   55   C C   . TYR   A 1 16  ? 35.098 -45.550 -13.155 1.000 45.721  0 16  TYR   A C   1 ? 1 
ATOM   56   O O   . TYR   A 1 16  ? 36.243 -45.183 -13.242 1.000 40.978  0 16  TYR   A O   1 ? 1 
ATOM   57   C CB  . TYR   A 1 16  ? 33.404 -45.855 -14.990 1.000 50.196  0 16  TYR   A CB  1 ? 1 
ATOM   58   C CG  . TYR   A 1 16  ? 33.863 -44.610 -15.743 1.000 48.383  0 16  TYR   A CG  1 ? 1 
ATOM   59   C CD1 . TYR   A 1 16  ? 34.673 -44.701 -16.874 1.000 46.251  0 16  TYR   A CD1 1 ? 1 
ATOM   60   C CD2 . TYR   A 1 16  ? 33.544 -43.359 -15.259 1.000 43.546  0 16  TYR   A CD2 1 ? 1 
ATOM   61   C CE1 . TYR   A 1 16  ? 35.088 -43.565 -17.537 1.000 48.163  0 16  TYR   A CE1 1 ? 1 
ATOM   62   C CE2 . TYR   A 1 16  ? 33.966 -42.223 -15.895 1.000 44.241  0 16  TYR   A CE2 1 ? 1 
ATOM   63   C CZ  . TYR   A 1 16  ? 34.745 -42.315 -17.039 1.000 47.247  0 16  TYR   A CZ  1 ? 1 
ATOM   64   O OH  . TYR   A 1 16  ? 35.151 -41.165 -17.677 1.000 41.141  0 16  TYR   A OH  1 ? 1 
ATOM   65   N N   . TYR   A 1 17  ? 34.298 -45.240 -12.131 1.000 48.964  0 17  TYR   A N   1 ? 1 
ATOM   66   C CA  . TYR   A 1 17  ? 34.696 -44.256 -11.137 1.000 47.400  0 17  TYR   A CA  1 ? 1 
ATOM   67   C C   . TYR   A 1 17  ? 35.752 -44.801 -10.184 1.000 43.772  0 17  TYR   A C   1 ? 1 
ATOM   68   O O   . TYR   A 1 17  ? 36.435 -44.030 -9.527  1.000 46.078  0 17  TYR   A O   1 ? 1 
ATOM   69   C CB  . TYR   A 1 17  ? 33.413 -43.714 -10.534 1.000 43.611  0 17  TYR   A CB  1 ? 1 
ATOM   70   C CG  . TYR   A 1 17  ? 32.736 -42.754 -11.498 1.000 46.002  0 17  TYR   A CG  1 ? 1 
ATOM   71   C CD1 . TYR   A 1 17  ? 33.241 -41.464 -11.704 1.000 42.636  0 17  TYR   A CD1 1 ? 1 
ATOM   72   C CD2 . TYR   A 1 17  ? 31.584 -43.115 -12.193 1.000 51.680  0 17  TYR   A CD2 1 ? 1 
ATOM   73   C CE1 . TYR   A 1 17  ? 32.589 -40.540 -12.506 1.000 42.971  0 17  TYR   A CE1 1 ? 1 
ATOM   74   C CE2 . TYR   A 1 17  ? 30.940 -42.201 -13.031 1.000 52.557  0 17  TYR   A CE2 1 ? 1 
ATOM   75   C CZ  . TYR   A 1 17  ? 31.445 -40.913 -13.198 1.000 47.078  0 17  TYR   A CZ  1 ? 1 
ATOM   76   O OH  . TYR   A 1 17  ? 30.802 -40.012 -13.996 1.000 43.796  0 17  TYR   A OH  1 ? 1 
ATOM   77   N N   . ASN   A 1 18  ? 36.045 -46.090 -10.257 1.000 45.640  0 18  ASN   A N   1 ? 1 
ATOM   78   C CA  . ASN   A 1 18  ? 37.199 -46.587 -9.530  1.000 47.671  0 18  ASN   A CA  1 ? 1 
ATOM   79   C C   . ASN   A 1 18  ? 38.485 -46.541 -10.319 1.000 48.471  0 18  ASN   A C   1 ? 1 
ATOM   80   O O   . ASN   A 1 18  ? 39.517 -46.866 -9.768  1.000 60.141  0 18  ASN   A O   1 ? 1 
ATOM   81   C CB  . ASN   A 1 18  ? 37.012 -48.004 -9.023  1.000 50.018  0 18  ASN   A CB  1 ? 1 
ATOM   82   C CG  . ASN   A 1 18  ? 36.327 -47.944 -7.684  1.000 49.493  0 18  ASN   A CG  1 ? 1 
ATOM   83   O OD1 . ASN   A 1 18  ? 36.830 -47.304 -6.762  1.000 51.515  0 18  ASN   A OD1 1 ? 1 
ATOM   84   N ND2 . ASN   A 1 18  ? 35.118 -48.462 -7.584  1.000 52.358  0 18  ASN   A ND2 1 ? 1 
ATOM   85   N N   . ARG   A 1 19  ? 38.456 -46.125 -11.566 1.000 46.274  0 19  ARG   A N   1 ? 1 
ATOM   86   C CA  . ARG   A 1 19  ? 39.692 -46.152 -12.317 1.000 46.569  0 19  ARG   A CA  1 ? 1 
ATOM   87   C C   . ARG   A 1 19  ? 40.655 -45.093 -11.810 1.000 41.972  0 19  ARG   A C   1 ? 1 
ATOM   88   O O   . ARG   A 1 19  ? 40.235 -44.062 -11.307 1.000 39.617  0 19  ARG   A O   1 ? 1 
ATOM   89   C CB  . ARG   A 1 19  ? 39.469 -45.733 -13.772 1.000 50.929  0 19  ARG   A CB  1 ? 1 
ATOM   90   C CG  . ARG   A 1 19  ? 38.544 -46.707 -14.462 1.000 52.900  0 19  ARG   A CG  1 ? 1 
ATOM   91   C CD  . ARG   A 1 19  ? 38.288 -46.359 -15.893 1.000 51.515  0 19  ARG   A CD  1 ? 1 
ATOM   92   N NE  . ARG   A 1 19  ? 37.421 -47.402 -16.420 1.000 55.692  0 19  ARG   A NE  1 ? 1 
ATOM   93   C CZ  . ARG   A 1 19  ? 37.033 -47.473 -17.653 1.000 57.798  0 19  ARG   A CZ  1 ? 1 
ATOM   94   N NH1 . ARG   A 1 19  ? 37.465 -46.621 -18.543 1.000 60.429  0 19  ARG   A NH1 1 ? 1 
ATOM   95   N NH2 . ARG   A 1 19  ? 36.248 -48.439 -17.998 1.000 55.212  0 19  ARG   A NH2 1 ? 1 
ATOM   96   N N   . PRO   A 1 20  ? 41.958 -45.220 -12.090 1.000 41.293  0 20  PRO   A N   1 ? 1 
ATOM   97   C CA  . PRO   A 1 20  ? 42.909 -44.191 -11.691 1.000 40.482  0 20  PRO   A CA  1 ? 1 
ATOM   98   C C   . PRO   A 1 20  ? 42.532 -42.949 -12.460 1.000 40.217  0 20  PRO   A C   1 ? 1 
ATOM   99   O O   . PRO   A 1 20  ? 42.037 -43.081 -13.556 1.000 39.329  0 20  PRO   A O   1 ? 1 
ATOM   100  C CB  . PRO   A 1 20  ? 44.261 -44.624 -12.235 1.000 42.662  0 20  PRO   A CB  1 ? 1 
ATOM   101  C CG  . PRO   A 1 20  ? 44.024 -46.018 -12.716 1.000 43.733  0 20  PRO   A CG  1 ? 1 
ATOM   102  C CD  . PRO   A 1 20  ? 42.552 -46.315 -12.851 1.000 41.346  0 20  PRO   A CD  1 ? 1 
ATOM   103  N N   . TYR   A 1 21  ? 43.003 -41.792 -11.995 1.000 39.284  0 21  TYR   A N   1 ? 1 
ATOM   104  C CA  . TYR   A 1 21  ? 43.007 -40.594 -12.780 1.000 35.578  0 21  TYR   A CA  1 ? 1 
ATOM   105  C C   . TYR   A 1 21  ? 44.354 -39.931 -12.670 1.000 35.936  0 21  TYR   A C   1 ? 1 
ATOM   106  O O   . TYR   A 1 21  ? 45.204 -40.357 -11.888 1.000 36.750  0 21  TYR   A O   1 ? 1 
ATOM   107  C CB  . TYR   A 1 21  ? 41.890 -39.663 -12.378 1.000 37.985  0 21  TYR   A CB  1 ? 1 
ATOM   108  C CG  . TYR   A 1 21  ? 42.066 -39.138 -10.980 1.000 41.076  0 21  TYR   A CG  1 ? 1 
ATOM   109  C CD1 . TYR   A 1 21  ? 42.751 -37.969 -10.796 1.000 40.289  0 21  TYR   A CD1 1 ? 1 
ATOM   110  C CD2 . TYR   A 1 21  ? 41.469 -39.761 -9.896  1.000 39.734  0 21  TYR   A CD2 1 ? 1 
ATOM   111  C CE1 . TYR   A 1 21  ? 42.904 -37.443 -9.543  1.000 41.135  0 21  TYR   A CE1 1 ? 1 
ATOM   112  C CE2 . TYR   A 1 21  ? 41.573 -39.213 -8.648  1.000 40.917  0 21  TYR   A CE2 1 ? 1 
ATOM   113  C CZ  . TYR   A 1 21  ? 42.340 -38.077 -8.470  1.000 43.053  0 21  TYR   A CZ  1 ? 1 
ATOM   114  O OH  . TYR   A 1 21  ? 42.543 -37.447 -7.276  1.000 41.771  0 21  TYR   A OH  1 ? 1 
ATOM   115  N N   . PHE   A 1 22  ? 44.590 -39.014 -13.620 1.000 36.259  0 22  PHE   A N   1 ? 1 
ATOM   116  C CA  . PHE   A 1 22  ? 45.876 -38.367 -13.703 1.000 37.085  0 22  PHE   A CA  1 ? 1 
ATOM   117  C C   . PHE   A 1 22  ? 45.644 -36.886 -13.830 1.000 37.373  0 22  PHE   A C   1 ? 1 
ATOM   118  O O   . PHE   A 1 22  ? 44.890 -36.459 -14.697 1.000 40.618  0 22  PHE   A O   1 ? 1 
ATOM   119  C CB  . PHE   A 1 22  ? 46.832 -38.809 -14.797 1.000 38.180  0 22  PHE   A CB  1 ? 1 
ATOM   120  C CG  . PHE   A 1 22  ? 46.983 -40.312 -14.702 1.000 42.184  0 22  PHE   A CG  1 ? 1 
ATOM   121  C CD1 . PHE   A 1 22  ? 46.022 -41.140 -15.248 1.000 44.347  0 22  PHE   A CD1 1 ? 1 
ATOM   122  C CD2 . PHE   A 1 22  ? 48.025 -40.868 -13.983 1.000 47.075  0 22  PHE   A CD2 1 ? 1 
ATOM   123  C CE1 . PHE   A 1 22  ? 46.128 -42.506 -15.116 1.000 48.872  0 22  PHE   A CE1 1 ? 1 
ATOM   124  C CE2 . PHE   A 1 22  ? 48.120 -42.232 -13.827 1.000 52.400  0 22  PHE   A CE2 1 ? 1 
ATOM   125  C CZ  . PHE   A 1 22  ? 47.167 -43.044 -14.392 1.000 53.820  0 22  PHE   A CZ  1 ? 1 
ATOM   126  N N   . ASP   A 1 23  ? 46.379 -36.149 -12.986 1.000 35.940  0 23  ASP   A N   1 ? 1 
ATOM   127  C CA  . ASP   A 1 23  ? 46.106 -34.761 -12.838 1.000 33.460  0 23  ASP   A CA  1 ? 1 
ATOM   128  C C   . ASP   A 1 23  ? 47.322 -34.096 -13.384 1.000 32.049  0 23  ASP   A C   1 ? 1 
ATOM   129  O O   . ASP   A 1 23  ? 48.308 -34.015 -12.643 1.000 33.921  0 23  ASP   A O   1 ? 1 
ATOM   130  C CB  . ASP   A 1 23  ? 45.627 -34.400 -11.451 1.000 35.725  0 23  ASP   A CB  1 ? 1 
ATOM   131  C CG  . ASP   A 1 23  ? 45.457 -32.888 -11.270 1.000 39.233  0 23  ASP   A CG  1 ? 1 
ATOM   132  O OD1 . ASP   A 1 23  ? 45.687 -32.156 -12.288 1.000 45.520  0 23  ASP   A OD1 1 ? 1 
ATOM   133  O OD2 . ASP   A 1 23  ? 45.118 -32.428 -10.123 1.000 40.189  0 23  ASP   A OD2 1 ? 1 
ATOM   134  N N   . LEU   A 1 24  ? 47.254 -33.669 -14.674 1.000 30.667  0 24  LEU   A N   1 ? 1 
ATOM   135  C CA  . LEU   A 1 24  ? 48.463 -33.124 -15.313 1.000 31.299  0 24  LEU   A CA  1 ? 1 
ATOM   136  C C   . LEU   A 1 24  ? 48.436 -31.615 -15.246 1.000 28.734  0 24  LEU   A C   1 ? 1 
ATOM   137  O O   . LEU   A 1 24  ? 47.369 -31.031 -15.296 1.000 28.755  0 24  LEU   A O   1 ? 1 
ATOM   138  C CB  . LEU   A 1 24  ? 48.632 -33.628 -16.740 1.000 33.272  0 24  LEU   A CB  1 ? 1 
ATOM   139  C CG  . LEU   A 1 24  ? 48.548 -35.138 -16.860 1.000 37.664  0 24  LEU   A CG  1 ? 1 
ATOM   140  C CD1 . LEU   A 1 24  ? 48.848 -35.477 -18.334 1.000 45.062  0 24  LEU   A CD1 1 ? 1 
ATOM   141  C CD2 . LEU   A 1 24  ? 49.487 -35.851 -15.897 1.000 37.738  0 24  LEU   A CD2 1 ? 1 
ATOM   142  N N   . ARG   A 1 25  ? 49.593 -30.987 -15.102 1.000 28.987  0 25  ARG   A N   1 ? 1 
ATOM   143  C CA  . ARG   A 1 25  ? 49.580 -29.548 -14.825 1.000 30.855  0 25  ARG   A CA  1 ? 1 
ATOM   144  C C   . ARG   A 1 25  ? 50.584 -28.779 -15.665 1.000 29.964  0 25  ARG   A C   1 ? 1 
ATOM   145  O O   . ARG   A 1 25  ? 51.745 -29.184 -15.870 1.000 30.144  0 25  ARG   A O   1 ? 1 
ATOM   146  C CB  . ARG   A 1 25  ? 49.956 -29.232 -13.349 1.000 32.229  0 25  ARG   A CB  1 ? 1 
ATOM   147  C CG  . ARG   A 1 25  ? 48.997 -29.804 -12.309 1.000 32.444  0 25  ARG   A CG  1 ? 1 
ATOM   148  C CD  . ARG   A 1 25  ? 47.651 -29.195 -12.366 1.000 33.590  0 25  ARG   A CD  1 ? 1 
ATOM   149  N NE  . ARG   A 1 25  ? 46.745 -29.788 -11.392 1.000 38.527  0 25  ARG   A NE  1 ? 1 
ATOM   150  C CZ  . ARG   A 1 25  ? 46.693 -29.285 -10.131 1.000 37.560  0 25  ARG   A CZ  1 ? 1 
ATOM   151  N NH1 . ARG   A 1 25  ? 45.971 -29.849 -9.260  1.000 32.421  0 25  ARG   A NH1 1 ? 1 
ATOM   152  N NH2 . ARG   A 1 25  ? 47.288 -28.173 -9.773  1.000 37.923  0 25  ARG   A NH2 1 ? 1 
ATOM   153  N N   . ASN   A 1 26  ? 50.096 -27.651 -16.127 1.000 29.710  0 26  ASN   A N   1 ? 1 
ATOM   154  C CA  . ASN   A 1 26  ? 50.934 -26.699 -16.811 1.000 33.482  0 26  ASN   A CA  1 ? 1 
ATOM   155  C C   . ASN   A 1 26  ? 51.774 -27.328 -17.919 1.000 32.904  0 26  ASN   A C   1 ? 1 
ATOM   156  O O   . ASN   A 1 26  ? 52.987 -27.181 -17.974 1.000 36.381  0 26  ASN   A O   1 ? 1 
ATOM   157  C CB  . ASN   A 1 26  ? 51.787 -25.962 -15.798 1.000 35.271  0 26  ASN   A CB  1 ? 1 
ATOM   158  C CG  . ASN   A 1 26  ? 52.574 -24.903 -16.502 1.000 36.629  0 26  ASN   A CG  1 ? 1 
ATOM   159  O OD1 . ASN   A 1 26  ? 52.097 -24.326 -17.466 1.000 42.093  0 26  ASN   A OD1 1 ? 1 
ATOM   160  N ND2 . ASN   A 1 26  ? 53.785 -24.650 -16.093 1.000 38.809  0 26  ASN   A ND2 1 ? 1 
ATOM   161  N N   . LEU   A 1 27  ? 51.097 -27.974 -18.849 1.000 33.364  0 27  LEU   A N   1 ? 1 
ATOM   162  C CA  . LEU   A 1 27  ? 51.771 -28.470 -20.033 1.000 37.240  0 27  LEU   A CA  1 ? 1 
ATOM   163  C C   . LEU   A 1 27  ? 51.047 -28.059 -21.318 1.000 36.689  0 27  LEU   A C   1 ? 1 
ATOM   164  O O   . LEU   A 1 27  ? 49.990 -27.439 -21.268 1.000 35.961  0 27  LEU   A O   1 ? 1 
ATOM   165  C CB  . LEU   A 1 27  ? 52.008 -29.967 -19.903 1.000 37.123  0 27  LEU   A CB  1 ? 1 
ATOM   166  C CG  . LEU   A 1 27  ? 50.836 -30.910 -20.054 1.000 41.279  0 27  LEU   A CG  1 ? 1 
ATOM   167  C CD1 . LEU   A 1 27  ? 51.318 -32.317 -19.648 1.000 42.096  0 27  LEU   A CD1 1 ? 1 
ATOM   168  C CD2 . LEU   A 1 27  ? 49.641 -30.592 -19.198 1.000 45.588  0 27  LEU   A CD2 1 ? 1 
ATOM   169  N N   . SER   A 1 28  ? 51.685 -28.370 -22.457 1.000 38.071  0 28  SER   A N   1 ? 1 
ATOM   170  C CA  . SER   A 1 28  ? 51.148 -28.040 -23.779 1.000 34.090  0 28  SER   A CA  1 ? 1 
ATOM   171  C C   . SER   A 1 28  ? 50.232 -29.136 -24.309 1.000 35.817  0 28  SER   A C   1 ? 1 
ATOM   172  O O   . SER   A 1 28  ? 50.547 -30.309 -24.108 1.000 38.529  0 28  SER   A O   1 ? 1 
ATOM   173  C CB  . SER   A 1 28  ? 52.251 -27.805 -24.720 1.000 31.874  0 28  SER   A CB  1 ? 1 
ATOM   174  O OG  . SER   A 1 28  ? 52.894 -26.590 -24.378 1.000 33.014  0 28  SER   A OG  1 ? 1 
ATOM   175  N N   . GLY   A 1 29  ? 49.114 -28.733 -24.947 1.000 34.589  0 29  GLY   A N   1 ? 1 
ATOM   176  C CA  . GLY   A 1 29  ? 48.217 -29.598 -25.703 1.000 36.068  0 29  GLY   A CA  1 ? 1 
ATOM   177  C C   . GLY   A 1 29  ? 48.142 -29.106 -27.168 1.000 39.587  0 29  GLY   A C   1 ? 1 
ATOM   178  O O   . GLY   A 1 29  ? 48.104 -27.895 -27.449 1.000 37.019  0 29  GLY   A O   1 ? 1 
ATOM   179  N N   . TYR   A 1 30  ? 48.254 -30.069 -28.098 1.000 38.765  0 30  TYR   A N   1 ? 1 
ATOM   180  C CA  . TYR   A 1 30  ? 48.358 -29.803 -29.529 1.000 38.906  0 30  TYR   A CA  1 ? 1 
ATOM   181  C C   . TYR   A 1 30  ? 47.055 -30.279 -30.168 1.000 34.541  0 30  TYR   A C   1 ? 1 
ATOM   182  O O   . TYR   A 1 30  ? 46.726 -31.449 -30.058 1.000 31.100  0 30  TYR   A O   1 ? 1 
ATOM   183  C CB  . TYR   A 1 30  ? 49.550 -30.500 -30.165 1.000 38.641  0 30  TYR   A CB  1 ? 1 
ATOM   184  C CG  . TYR   A 1 30  ? 49.720 -30.051 -31.601 1.000 41.757  0 30  TYR   A CG  1 ? 1 
ATOM   185  C CD1 . TYR   A 1 30  ? 50.433 -28.892 -31.868 1.000 41.361  0 30  TYR   A CD1 1 ? 1 
ATOM   186  C CD2 . TYR   A 1 30  ? 49.170 -30.738 -32.668 1.000 41.053  0 30  TYR   A CD2 1 ? 1 
ATOM   187  C CE1 . TYR   A 1 30  ? 50.595 -28.438 -33.151 1.000 41.200  0 30  TYR   A CE1 1 ? 1 
ATOM   188  C CE2 . TYR   A 1 30  ? 49.332 -30.283 -33.980 1.000 40.898  0 30  TYR   A CE2 1 ? 1 
ATOM   189  C CZ  . TYR   A 1 30  ? 50.023 -29.118 -34.206 1.000 39.492  0 30  TYR   A CZ  1 ? 1 
ATOM   190  O OH  . TYR   A 1 30  ? 50.294 -28.572 -35.403 1.000 37.886  0 30  TYR   A OH  1 ? 1 
ATOM   191  N N   . ARG   A 1 31  ? 46.225 -29.337 -30.616 1.000 32.826  0 31  ARG   A N   1 ? 1 
ATOM   192  C CA  . ARG   A 1 31  ? 44.945 -29.736 -31.175 1.000 36.370  0 31  ARG   A CA  1 ? 1 
ATOM   193  C C   . ARG   A 1 31  ? 45.114 -29.990 -32.699 1.000 37.804  0 31  ARG   A C   1 ? 1 
ATOM   194  O O   . ARG   A 1 31  ? 45.683 -29.178 -33.421 1.000 33.367  0 31  ARG   A O   1 ? 1 
ATOM   195  C CB  . ARG   A 1 31  ? 43.890 -28.651 -30.977 1.000 33.923  0 31  ARG   A CB  1 ? 1 
ATOM   196  C CG  . ARG   A 1 31  ? 42.563 -29.163 -31.512 1.000 31.460  0 31  ARG   A CG  1 ? 1 
ATOM   197  C CD  . ARG   A 1 31  ? 41.540 -28.020 -31.409 1.000 31.754  0 31  ARG   A CD  1 ? 1 
ATOM   198  N NE  . ARG   A 1 31  ? 40.267 -28.607 -31.857 1.000 33.982  0 31  ARG   A NE  1 ? 1 
ATOM   199  C CZ  . ARG   A 1 31  ? 39.120 -27.961 -31.786 1.000 37.682  0 31  ARG   A CZ  1 ? 1 
ATOM   200  N NH1 . ARG   A 1 31  ? 39.159 -26.787 -31.230 1.000 39.057  0 31  ARG   A NH1 1 ? 1 
ATOM   201  N NH2 . ARG   A 1 31  ? 37.939 -28.506 -32.074 1.000 42.923  0 31  ARG   A NH2 1 ? 1 
ATOM   202  N N   . GLU   A 1 32  ? 44.717 -31.190 -33.095 1.000 40.681  0 32  GLU   A N   1 ? 1 
ATOM   203  C CA  . GLU   A 1 32  ? 44.542 -31.688 -34.449 1.000 45.152  0 32  GLU   A CA  1 ? 1 
ATOM   204  C C   . GLU   A 1 32  ? 43.138 -32.279 -34.541 1.000 43.615  0 32  GLU   A C   1 ? 1 
ATOM   205  O O   . GLU   A 1 32  ? 42.807 -33.300 -33.897 1.000 41.996  0 32  GLU   A O   1 ? 1 
ATOM   206  C CB  . GLU   A 1 32  ? 45.386 -32.920 -34.745 1.000 50.601  0 32  GLU   A CB  1 ? 1 
ATOM   207  C CG  . GLU   A 1 32  ? 46.846 -32.606 -35.042 1.000 72.220  0 32  GLU   A CG  1 ? 1 
ATOM   208  C CD  . GLU   A 1 32  ? 47.911 -33.725 -35.091 1.000 83.492  0 32  GLU   A CD  1 ? 1 
ATOM   209  O OE1 . GLU   A 1 32  ? 48.204 -34.349 -34.028 1.000 76.637  0 32  GLU   A OE1 1 ? 1 
ATOM   210  O OE2 . GLU   A 1 32  ? 48.521 -33.894 -36.179 1.000 85.852  0 32  GLU   A OE2 1 ? 1 
ATOM   211  N N   . GLY   A 1 33  ? 42.277 -31.584 -35.280 1.000 42.990  0 33  GLY   A N   1 ? 1 
ATOM   212  C CA  . GLY   A 1 33  ? 40.914 -32.051 -35.437 1.000 42.015  0 33  GLY   A CA  1 ? 1 
ATOM   213  C C   . GLY   A 1 33  ? 40.161 -31.787 -34.159 1.000 40.741  0 33  GLY   A C   1 ? 1 
ATOM   214  O O   . GLY   A 1 33  ? 40.147 -30.668 -33.715 1.000 42.972  0 33  GLY   A O   1 ? 1 
ATOM   215  N N   . ASN   A 1 34  ? 39.627 -32.832 -33.569 1.000 44.062  0 34  ASN   A N   1 ? 1 
ATOM   216  C CA  . ASN   A 1 34  ? 38.885 -32.737 -32.315 1.000 46.902  0 34  ASN   A CA  1 ? 1 
ATOM   217  C C   . ASN   A 1 34  ? 39.626 -33.511 -31.215 1.000 44.613  0 34  ASN   A C   1 ? 1 
ATOM   218  O O   . ASN   A 1 34  ? 39.046 -34.090 -30.304 1.000 40.963  0 34  ASN   A O   1 ? 1 
ATOM   219  C CB  . ASN   A 1 34  ? 37.439 -33.166 -32.561 1.000 46.556  0 34  ASN   A CB  1 ? 1 
ATOM   220  C CG  . ASN   A 1 34  ? 36.711 -32.064 -33.289 1.000 46.088  0 34  ASN   A CG  1 ? 1 
ATOM   221  O OD1 . ASN   A 1 34  ? 37.197 -30.938 -33.380 1.000 46.261  0 34  ASN   A OD1 1 ? 1 
ATOM   222  N ND2 . ASN   A 1 34  ? 35.533 -32.339 -33.775 1.000 49.104  0 34  ASN   A ND2 1 ? 1 
ATOM   223  N N   . THR   A 1 35  ? 40.942 -33.586 -31.381 1.000 44.490  0 35  THR   A N   1 ? 1 
ATOM   224  C CA  . THR   A 1 35  ? 41.779 -34.286 -30.448 1.000 43.068  0 35  THR   A CA  1 ? 1 
ATOM   225  C C   . THR   A 1 35  ? 42.892 -33.353 -30.033 1.000 39.279  0 35  THR   A C   1 ? 1 
ATOM   226  O O   . THR   A 1 35  ? 43.484 -32.713 -30.888 1.000 44.276  0 35  THR   A O   1 ? 1 
ATOM   227  C CB  . THR   A 1 35  ? 42.410 -35.543 -31.012 1.000 45.061  0 35  THR   A CB  1 ? 1 
ATOM   228  O OG1 . THR   A 1 35  ? 41.303 -36.417 -31.208 1.000 48.168  0 35  THR   A OG1 1 ? 1 
ATOM   229  C CG2 . THR   A 1 35  ? 43.325 -36.176 -29.985 1.000 48.782  0 35  THR   A CG2 1 ? 1 
ATOM   230  N N   . VAL   A 1 36  ? 43.152 -33.350 -28.717 1.000 35.927  0 36  VAL   A N   1 ? 1 
ATOM   231  C CA  . VAL   A 1 36  ? 44.295 -32.693 -28.128 1.000 34.536  0 36  VAL   A CA  1 ? 1 
ATOM   232  C C   . VAL   A 1 36  ? 45.202 -33.750 -27.569 1.000 33.661  0 36  VAL   A C   1 ? 1 
ATOM   233  O O   . VAL   A 1 36  ? 44.759 -34.572 -26.745 1.000 32.576  0 36  VAL   A O   1 ? 1 
ATOM   234  C CB  . VAL   A 1 36  ? 43.955 -31.737 -27.003 1.000 34.427  0 36  VAL   A CB  1 ? 1 
ATOM   235  C CG1 . VAL   A 1 36  ? 45.162 -30.903 -26.632 1.000 36.958  0 36  VAL   A CG1 1 ? 1 
ATOM   236  C CG2 . VAL   A 1 36  ? 42.818 -30.842 -27.439 1.000 37.576  0 36  VAL   A CG2 1 ? 1 
ATOM   237  N N   . THR   A 1 37  ? 46.434 -33.647 -28.041 1.000 33.006  0 37  THR   A N   1 ? 1 
ATOM   238  C CA  . THR   A 1 37  ? 47.484 -34.549 -27.621 1.000 38.713  0 37  THR   A CA  1 ? 1 
ATOM   239  C C   . THR   A 1 37  ? 48.393 -33.927 -26.548 1.000 40.065  0 37  THR   A C   1 ? 1 
ATOM   240  O O   . THR   A 1 37  ? 48.942 -32.831 -26.760 1.000 36.516  0 37  THR   A O   1 ? 1 
ATOM   241  C CB  . THR   A 1 37  ? 48.287 -34.920 -28.870 1.000 36.338  0 37  THR   A CB  1 ? 1 
ATOM   242  O OG1 . THR   A 1 37  ? 47.509 -35.907 -29.529 1.000 37.183  0 37  THR   A OG1 1 ? 1 
ATOM   243  C CG2 . THR   A 1 37  ? 49.545 -35.679 -28.526 1.000 37.447  0 37  THR   A CG2 1 ? 1 
ATOM   244  N N   . PHE   A 1 38  ? 48.645 -34.689 -25.461 1.000 40.651  0 38  PHE   A N   1 ? 1 
ATOM   245  C CA  . PHE   A 1 38  ? 49.602 -34.268 -24.415 1.000 40.404  0 38  PHE   A CA  1 ? 1 
ATOM   246  C C   . PHE   A 1 38  ? 50.727 -35.294 -24.296 1.000 40.207  0 38  PHE   A C   1 ? 1 
ATOM   247  O O   . PHE   A 1 38  ? 50.453 -36.483 -24.451 1.000 39.745  0 38  PHE   A O   1 ? 1 
ATOM   248  C CB  . PHE   A 1 38  ? 48.867 -34.119 -23.088 1.000 36.488  0 38  PHE   A CB  1 ? 1 
ATOM   249  C CG  . PHE   A 1 38  ? 47.792 -33.064 -23.070 1.000 32.528  0 38  PHE   A CG  1 ? 1 
ATOM   250  C CD1 . PHE   A 1 38  ? 46.488 -33.361 -23.443 1.000 33.082  0 38  PHE   A CD1 1 ? 1 
ATOM   251  C CD2 . PHE   A 1 38  ? 48.082 -31.783 -22.623 1.000 31.799  0 38  PHE   A CD2 1 ? 1 
ATOM   252  C CE1 . PHE   A 1 38  ? 45.456 -32.397 -23.354 1.000 30.654  0 38  PHE   A CE1 1 ? 1 
ATOM   253  C CE2 . PHE   A 1 38  ? 47.076 -30.806 -22.618 1.000 30.923  0 38  PHE   A CE2 1 ? 1 
ATOM   254  C CZ  . PHE   A 1 38  ? 45.780 -31.113 -23.012 1.000 29.916  0 38  PHE   A CZ  1 ? 1 
ATOM   255  N N   . ILE   A 1 39  ? 51.960 -34.830 -24.109 1.000 40.436  0 39  ILE   A N   1 ? 1 
ATOM   256  C CA  . ILE   A 1 39  ? 53.067 -35.738 -23.939 1.000 47.266  0 39  ILE   A CA  1 ? 1 
ATOM   257  C C   . ILE   A 1 39  ? 53.719 -35.436 -22.575 1.000 56.688  0 39  ILE   A C   1 ? 1 
ATOM   258  O O   . ILE   A 1 39  ? 54.062 -34.309 -22.256 1.000 57.146  0 39  ILE   A O   1 ? 1 
ATOM   259  C CB  . ILE   A 1 39  ? 54.040 -35.674 -25.123 1.000 50.293  0 39  ILE   A CB  1 ? 1 
ATOM   260  C CG1 . ILE   A 1 39  ? 53.506 -36.334 -26.314 1.000 59.750  0 39  ILE   A CG1 1 ? 1 
ATOM   261  C CG2 . ILE   A 1 39  ? 55.370 -36.337 -24.817 1.000 56.836  0 39  ILE   A CG2 1 ? 1 
ATOM   262  C CD1 . ILE   A 1 39  ? 53.208 -35.399 -27.462 1.000 72.207  0 39  ILE   A CD1 1 ? 1 
ATOM   263  N N   . ASN   A 1 40  ? 53.914 -36.490 -21.775 1.000 65.463  0 40  ASN   A N   1 ? 1 
ATOM   264  C CA  . ASN   A 1 40  ? 54.636 -36.493 -20.512 1.000 70.150  0 40  ASN   A CA  1 ? 1 
ATOM   265  C C   . ASN   A 1 40  ? 55.957 -37.252 -20.631 1.000 79.403  0 40  ASN   A C   1 ? 1 
ATOM   266  O O   . ASN   A 1 40  ? 56.099 -38.102 -21.528 1.000 89.763  0 40  ASN   A O   1 ? 1 
ATOM   267  C CB  . ASN   A 1 40  ? 53.810 -37.308 -19.510 1.000 72.709  0 40  ASN   A CB  1 ? 1 
ATOM   268  C CG  . ASN   A 1 40  ? 53.214 -36.390 -18.504 1.000 57.535  0 40  ASN   A CG  1 ? 1 
ATOM   269  O OD1 . ASN   A 1 40  ? 53.714 -35.283 -18.380 1.000 65.204  0 40  ASN   A OD1 1 ? 1 
ATOM   270  N ND2 . ASN   A 1 40  ? 52.182 -36.819 -17.816 1.000 59.492  0 40  ASN   A ND2 1 ? 1 
ATOM   271  N N   A HIS   A 1 41  ? 56.889 -36.969 -19.701 0.500 80.226  0 41  HIS   A N   1 ? 1 
ATOM   272  N N   B HIS   A 1 41  ? 56.898 -37.026 -19.696 0.500 82.722  0 41  HIS   A N   1 ? 1 
ATOM   273  C CA  A HIS   A 1 41  ? 58.064 -37.818 -19.498 0.500 78.421  0 41  HIS   A CA  1 ? 1 
ATOM   274  C CA  B HIS   A 1 41  ? 58.099 -37.867 -19.634 0.500 82.157  0 41  HIS   A CA  1 ? 1 
ATOM   275  C C   A HIS   A 1 41  ? 57.584 -39.210 -19.056 0.500 81.582  0 41  HIS   A C   1 ? 1 
ATOM   276  C C   B HIS   A 1 41  ? 57.637 -39.317 -19.436 0.500 84.371  0 41  HIS   A C   1 ? 1 
ATOM   277  O O   A HIS   A 1 41  ? 58.318 -39.958 -18.412 0.500 83.150  0 41  HIS   A O   1 ? 1 
ATOM   278  O O   B HIS   A 1 41  ? 58.450 -40.227 -19.500 0.500 93.857  0 41  HIS   A O   1 ? 1 
ATOM   279  C CB  A HIS   A 1 41  ? 59.083 -37.238 -18.487 0.500 64.039  0 41  HIS   A CB  1 ? 1 
ATOM   280  C CB  B HIS   A 1 41  ? 59.191 -37.307 -18.684 0.500 67.690  0 41  HIS   A CB  1 ? 1 
ATOM   281  C CG  A HIS   A 1 41  ? 60.062 -36.179 -18.910 0.500 59.369  0 41  HIS   A CG  1 ? 1 
ATOM   282  C CG  B HIS   A 1 41  ? 60.437 -38.150 -18.440 0.500 66.363  0 41  HIS   A CG  1 ? 1 
ATOM   283  N ND1 A HIS   A 1 41  ? 60.131 -34.982 -18.229 0.500 58.635  0 41  HIS   A ND1 1 ? 1 
ATOM   284  N ND1 B HIS   A 1 41  ? 61.708 -37.608 -18.400 0.500 68.408  0 41  HIS   A ND1 1 ? 1 
ATOM   285  C CD2 A HIS   A 1 41  ? 61.094 -36.135 -19.792 0.500 62.326  0 41  HIS   A CD2 1 ? 1 
ATOM   286  C CD2 B HIS   A 1 41  ? 60.640 -39.473 -18.176 0.500 70.194  0 41  HIS   A CD2 1 ? 1 
ATOM   287  C CE1 A HIS   A 1 41  ? 61.109 -34.211 -18.742 0.500 61.291  0 41  HIS   A CE1 1 ? 1 
ATOM   288  C CE1 B HIS   A 1 41  ? 62.621 -38.555 -18.150 0.500 70.073  0 41  HIS   A CE1 1 ? 1 
ATOM   289  N NE2 A HIS   A 1 41  ? 61.724 -34.893 -19.691 0.500 60.687  0 41  HIS   A NE2 1 ? 1 
ATOM   290  N NE2 B HIS   A 1 41  ? 61.998 -39.703 -18.000 0.500 69.260  0 41  HIS   A NE2 1 ? 1 
ATOM   291  N N   . TYR   A 1 42  ? 56.321 -39.543 -19.342 1.000 78.012  0 42  TYR   A N   1 ? 1 
ATOM   292  C CA  . TYR   A 1 42  ? 55.813 -40.870 -19.046 1.000 89.462  0 42  TYR   A CA  1 ? 1 
ATOM   293  C C   . TYR   A 1 42  ? 54.778 -41.360 -20.061 1.000 99.489  0 42  TYR   A C   1 ? 1 
ATOM   294  O O   . TYR   A 1 42  ? 54.768 -42.544 -20.371 1.000 114.620 0 42  TYR   A O   1 ? 1 
ATOM   295  C CB  . TYR   A 1 42  ? 55.217 -40.912 -17.642 1.000 94.316  0 42  TYR   A CB  1 ? 1 
ATOM   296  C CG  . TYR   A 1 42  ? 54.297 -42.091 -17.304 1.000 101.112 0 42  TYR   A CG  1 ? 1 
ATOM   297  C CD1 . TYR   A 1 42  ? 54.813 -43.359 -17.003 1.000 97.096  0 42  TYR   A CD1 1 ? 1 
ATOM   298  C CD2 . TYR   A 1 42  ? 52.912 -41.928 -17.205 1.000 92.281  0 42  TYR   A CD2 1 ? 1 
ATOM   299  C CE1 . TYR   A 1 42  ? 53.986 -44.425 -16.651 1.000 84.291  0 42  TYR   A CE1 1 ? 1 
ATOM   300  C CE2 . TYR   A 1 42  ? 52.074 -42.984 -16.862 1.000 89.853  0 42  TYR   A CE2 1 ? 1 
ATOM   301  C CZ  . TYR   A 1 42  ? 52.611 -44.234 -16.579 1.000 85.601  0 42  TYR   A CZ  1 ? 1 
ATOM   302  O OH  . TYR   A 1 42  ? 51.731 -45.234 -16.253 1.000 72.716  0 42  TYR   A OH  1 ? 1 
ATOM   303  N N   . GLN   A 1 43  ? 53.885 -40.504 -20.564 1.000 99.073  0 43  GLN   A N   1 ? 1 
ATOM   304  C CA  . GLN   A 1 43  ? 52.789 -40.996 -21.399 1.000 93.286  0 43  GLN   A CA  1 ? 1 
ATOM   305  C C   . GLN   A 1 43  ? 52.463 -39.956 -22.483 1.000 84.220  0 43  GLN   A C   1 ? 1 
ATOM   306  O O   . GLN   A 1 43  ? 52.573 -38.748 -22.256 1.000 77.926  0 43  GLN   A O   1 ? 1 
ATOM   307  C CB  . GLN   A 1 43  ? 51.607 -41.412 -20.498 1.000 95.810  0 43  GLN   A CB  1 ? 1 
ATOM   308  C CG  . GLN   A 1 43  ? 51.046 -40.304 -19.594 1.000 96.331  0 43  GLN   A CG  1 ? 1 
ATOM   309  C CD  . GLN   A 1 43  ? 49.750 -40.629 -18.863 1.000 88.462  0 43  GLN   A CD  1 ? 1 
ATOM   310  O OE1 . GLN   A 1 43  ? 49.160 -41.713 -18.970 1.000 92.640  0 43  GLN   A OE1 1 ? 1 
ATOM   311  N NE2 . GLN   A 1 43  ? 49.245 -39.646 -18.134 1.000 76.945  0 43  GLN   A NE2 1 ? 1 
ATOM   312  N N   . GLN   A 1 44  ? 52.082 -40.426 -23.678 1.000 68.470  0 44  GLN   A N   1 ? 1 
ATOM   313  C CA  . GLN   A 1 44  ? 51.301 -39.603 -24.593 1.000 59.545  0 44  GLN   A CA  1 ? 1 
ATOM   314  C C   . GLN   A 1 44  ? 49.792 -39.863 -24.438 1.000 53.700  0 44  GLN   A C   1 ? 1 
ATOM   315  O O   . GLN   A 1 44  ? 49.322 -40.965 -24.685 1.000 57.574  0 44  GLN   A O   1 ? 1 
ATOM   316  C CB  . GLN   A 1 44  ? 51.641 -39.824 -26.060 1.000 55.627  0 44  GLN   A CB  1 ? 1 
ATOM   317  C CG  . GLN   A 1 44  ? 50.682 -39.119 -27.017 1.000 60.980  0 44  GLN   A CG  1 ? 1 
ATOM   318  C CD  . GLN   A 1 44  ? 50.955 -39.384 -28.489 1.000 67.710  0 44  GLN   A CD  1 ? 1 
ATOM   319  O OE1 . GLN   A 1 44  ? 52.121 -39.492 -28.903 1.000 60.724  0 44  GLN   A OE1 1 ? 1 
ATOM   320  N NE2 . GLN   A 1 44  ? 49.890 -39.462 -29.300 1.000 66.354  0 44  GLN   A NE2 1 ? 1 
ATOM   321  N N   . THR   A 1 45  ? 49.000 -38.805 -24.197 1.000 49.490  0 45  THR   A N   1 ? 1 
ATOM   322  C CA  . THR   A 1 45  ? 47.554 -38.913 -24.010 1.000 48.141  0 45  THR   A CA  1 ? 1 
ATOM   323  C C   . THR   A 1 45  ? 46.772 -38.068 -25.029 1.000 41.361  0 45  THR   A C   1 ? 1 
ATOM   324  O O   . THR   A 1 45  ? 47.044 -36.893 -25.274 1.000 38.419  0 45  THR   A O   1 ? 1 
ATOM   325  C CB  . THR   A 1 45  ? 47.276 -38.405 -22.593 1.000 52.062  0 45  THR   A CB  1 ? 1 
ATOM   326  O OG1 . THR   A 1 45  ? 48.176 -39.201 -21.835 1.000 56.249  0 45  THR   A OG1 1 ? 1 
ATOM   327  C CG2 . THR   A 1 45  ? 45.806 -38.462 -22.220 1.000 46.482  0 45  THR   A CG2 1 ? 1 
ATOM   328  N N   . ASP   A 1 46  ? 45.717 -38.653 -25.573 1.000 41.391  0 46  ASP   A N   1 ? 1 
ATOM   329  C CA  . ASP   A 1 46  ? 44.942 -37.992 -26.596 1.000 43.456  0 46  ASP   A CA  1 ? 1 
ATOM   330  C C   . ASP   A 1 46  ? 43.571 -37.702 -26.043 1.000 39.311  0 46  ASP   A C   1 ? 1 
ATOM   331  O O   . ASP   A 1 46  ? 42.878 -38.618 -25.624 1.000 38.975  0 46  ASP   A O   1 ? 1 
ATOM   332  C CB  . ASP   A 1 46  ? 44.791 -38.858 -27.830 1.000 48.491  0 46  ASP   A CB  1 ? 1 
ATOM   333  C CG  . ASP   A 1 46  ? 46.002 -38.964 -28.749 1.000 55.862  0 46  ASP   A CG  1 ? 1 
ATOM   334  O OD1 . ASP   A 1 46  ? 46.869 -38.088 -28.746 1.000 54.360  0 46  ASP   A OD1 1 ? 1 
ATOM   335  O OD2 . ASP   A 1 46  ? 46.030 -39.922 -29.520 1.000 76.220  0 46  ASP   A OD2 1 ? 1 
ATOM   336  N N   . VAL   A 1 47  ? 43.169 -36.443 -26.087 1.000 35.910  0 47  VAL   A N   1 ? 1 
ATOM   337  C CA  . VAL   A 1 47  ? 41.945 -36.073 -25.394 1.000 34.950  0 47  VAL   A CA  1 ? 1 
ATOM   338  C C   . VAL   A 1 47  ? 40.956 -35.525 -26.411 1.000 36.707  0 47  VAL   A C   1 ? 1 
ATOM   339  O O   . VAL   A 1 47  ? 41.282 -34.611 -27.200 1.000 38.059  0 47  VAL   A O   1 ? 1 
ATOM   340  C CB  . VAL   A 1 47  ? 42.250 -34.982 -24.352 1.000 33.663  0 47  VAL   A CB  1 ? 1 
ATOM   341  C CG1 . VAL   A 1 47  ? 41.020 -34.453 -23.620 1.000 31.544  0 47  VAL   A CG1 1 ? 1 
ATOM   342  C CG2 . VAL   A 1 47  ? 43.346 -35.433 -23.412 1.000 35.138  0 47  VAL   A CG2 1 ? 1 
ATOM   343  N N   . LYS   A 1 48  ? 39.757 -36.048 -26.299 1.000 34.062  0 48  LYS   A N   1 ? 1 
ATOM   344  C CA  . LYS   A 1 48  ? 38.686 -35.748 -27.205 1.000 40.258  0 48  LYS   A CA  1 ? 1 
ATOM   345  C C   . LYS   A 1 48  ? 37.937 -34.525 -26.706 1.000 37.221  0 48  LYS   A C   1 ? 1 
ATOM   346  O O   . LYS   A 1 48  ? 37.431 -34.479 -25.543 1.000 35.909  0 48  LYS   A O   1 ? 1 
ATOM   347  C CB  . LYS   A 1 48  ? 37.728 -36.947 -27.349 1.000 48.144  0 48  LYS   A CB  1 ? 1 
ATOM   348  C CG  . LYS   A 1 48  ? 38.227 -38.041 -28.229 1.000 61.931  0 48  LYS   A CG  1 ? 1 
ATOM   349  C CD  . LYS   A 1 48  ? 38.172 -37.717 -29.735 1.000 93.041  0 48  LYS   A CD  1 ? 1 
ATOM   350  C CE  . LYS   A 1 48  ? 36.807 -37.441 -30.382 1.000 96.541  0 48  LYS   A CE  1 ? 1 
ATOM   351  N NZ  . LYS   A 1 48  ? 36.931 -37.222 -31.831 1.000 97.759  0 48  LYS   A NZ  1 ? 1 
ATOM   352  N N   . LEU   A 1 49  ? 37.699 -33.659 -27.709 1.000 36.017  0 49  LEU   A N   1 ? 1 
ATOM   353  C CA  . LEU   A 1 49  ? 36.795 -32.539 -27.556 1.000 36.004  0 49  LEU   A CA  1 ? 1 
ATOM   354  C C   . LEU   A 1 49  ? 35.441 -32.954 -28.117 1.000 41.304  0 49  LEU   A C   1 ? 1 
ATOM   355  O O   . LEU   A 1 49  ? 35.305 -33.248 -29.306 1.000 50.075  0 49  LEU   A O   1 ? 1 
ATOM   356  C CB  . LEU   A 1 49  ? 37.390 -31.307 -28.202 1.000 34.103  0 49  LEU   A CB  1 ? 1 
ATOM   357  C CG  . LEU   A 1 49  ? 38.853 -31.049 -27.869 1.000 36.116  0 49  LEU   A CG  1 ? 1 
ATOM   358  C CD1 . LEU   A 1 49  ? 39.340 -29.870 -28.664 1.000 35.702  0 49  LEU   A CD1 1 ? 1 
ATOM   359  C CD2 . LEU   A 1 49  ? 39.015 -30.897 -26.309 1.000 38.085  0 49  LEU   A CD2 1 ? 1 
ATOM   360  N N   . GLU   A 1 50  ? 34.466 -33.046 -27.206 1.000 39.884  0 50  GLU   A N   1 ? 1 
ATOM   361  C CA  . GLU   A 1 50  ? 33.140 -33.504 -27.512 1.000 42.131  0 50  GLU   A CA  1 ? 1 
ATOM   362  C C   . GLU   A 1 50  ? 32.119 -32.441 -27.165 1.000 43.171  0 50  GLU   A C   1 ? 1 
ATOM   363  O O   . GLU   A 1 50  ? 30.957 -32.686 -27.306 1.000 50.762  0 50  GLU   A O   1 ? 1 
ATOM   364  C CB  . GLU   A 1 50  ? 32.691 -34.678 -26.656 1.000 48.177  0 50  GLU   A CB  1 ? 1 
ATOM   365  C CG  . GLU   A 1 50  ? 33.398 -36.000 -26.911 1.000 57.292  0 50  GLU   A CG  1 ? 1 
ATOM   366  C CD  . GLU   A 1 50  ? 32.939 -36.753 -28.126 1.000 74.784  0 50  GLU   A CD  1 ? 1 
ATOM   367  O OE1 . GLU   A 1 50  ? 31.778 -36.527 -28.594 1.000 91.468  0 50  GLU   A OE1 1 ? 1 
ATOM   368  O OE2 . GLU   A 1 50  ? 33.813 -37.510 -28.618 1.000 76.788  0 50  GLU   A OE2 1 ? 1 
ATOM   369  N N   . GLY   A 1 51  ? 32.471 -31.287 -26.640 1.000 41.842  0 51  GLY   A N   1 ? 1 
ATOM   370  C CA  . GLY   A 1 51  ? 31.420 -30.342 -26.300 1.000 40.379  0 51  GLY   A CA  1 ? 1 
ATOM   371  C C   . GLY   A 1 51  ? 31.837 -28.938 -26.708 1.000 43.796  0 51  GLY   A C   1 ? 1 
ATOM   372  O O   . GLY   A 1 51  ? 32.472 -28.776 -27.772 1.000 48.222  0 51  GLY   A O   1 ? 1 
ATOM   373  N N   . LYS   A 1 52  ? 31.507 -27.966 -25.837 1.000 41.227  0 52  LYS   A N   1 ? 1 
ATOM   374  C CA  . LYS   A 1 52  ? 31.872 -26.580 -26.024 1.000 44.196  0 52  LYS   A CA  1 ? 1 
ATOM   375  C C   . LYS   A 1 52  ? 33.366 -26.381 -25.906 1.000 43.323  0 52  LYS   A C   1 ? 1 
ATOM   376  O O   . LYS   A 1 52  ? 33.863 -25.335 -26.366 1.000 44.381  0 52  LYS   A O   1 ? 1 
ATOM   377  C CB  . LYS   A 1 52  ? 31.123 -25.620 -25.131 1.000 52.157  0 52  LYS   A CB  1 ? 1 
ATOM   378  C CG  . LYS   A 1 52  ? 29.648 -25.492 -25.537 1.000 67.162  0 52  LYS   A CG  1 ? 1 
ATOM   379  C CD  . LYS   A 1 52  ? 29.074 -24.560 -24.467 1.000 92.962  0 52  LYS   A CD  1 ? 1 
ATOM   380  C CE  . LYS   A 1 52  ? 27.608 -24.653 -24.212 1.000 106.806 0 52  LYS   A CE  1 ? 1 
ATOM   381  N NZ  . LYS   A 1 52  ? 26.805 -23.998 -25.244 1.000 110.931 0 52  LYS   A NZ  1 ? 1 
ATOM   382  N N   . ASP   A 1 53  ? 34.078 -27.407 -25.388 1.000 42.252  0 53  ASP   A N   1 ? 1 
ATOM   383  C CA  . ASP   A 1 53  ? 35.540 -27.367 -25.437 1.000 40.445  0 53  ASP   A CA  1 ? 1 
ATOM   384  C C   . ASP   A 1 53  ? 35.953 -27.154 -26.890 1.000 37.380  0 53  ASP   A C   1 ? 1 
ATOM   385  O O   . ASP   A 1 53  ? 36.951 -26.498 -27.095 1.000 36.045  0 53  ASP   A O   1 ? 1 
ATOM   386  C CB  . ASP   A 1 53  ? 36.260 -28.486 -24.686 1.000 38.298  0 53  ASP   A CB  1 ? 1 
ATOM   387  C CG  . ASP   A 1 53  ? 35.698 -29.872 -24.964 1.000 46.757  0 53  ASP   A CG  1 ? 1 
ATOM   388  O OD1 . ASP   A 1 53  ? 34.762 -29.911 -25.831 1.000 49.840  0 53  ASP   A OD1 1 ? 1 
ATOM   389  O OD2 . ASP   A 1 53  ? 36.215 -30.891 -24.374 1.000 39.321  0 53  ASP   A OD2 1 ? 1 
ATOM   390  N N   . LYS   A 1 54  ? 35.195 -27.648 -27.889 1.000 42.064  0 54  LYS   A N   1 ? 1 
ATOM   391  C CA  . LYS   A 1 54  ? 35.624 -27.568 -29.296 1.000 44.277  0 54  LYS   A CA  1 ? 1 
ATOM   392  C C   . LYS   A 1 54  ? 35.845 -26.118 -29.715 1.000 40.787  0 54  LYS   A C   1 ? 1 
ATOM   393  O O   . LYS   A 1 54  ? 36.800 -25.808 -30.373 1.000 35.741  0 54  LYS   A O   1 ? 1 
ATOM   394  C CB  . LYS   A 1 54  ? 34.615 -28.196 -30.237 1.000 47.577  0 54  LYS   A CB  1 ? 1 
ATOM   395  C CG  . LYS   A 1 54  ? 34.608 -29.674 -30.303 1.000 51.164  0 54  LYS   A CG  1 ? 1 
ATOM   396  C CD  . LYS   A 1 54  ? 33.203 -30.124 -30.647 1.000 63.468  0 54  LYS   A CD  1 ? 1 
ATOM   397  C CE  . LYS   A 1 54  ? 33.241 -31.203 -31.673 1.000 75.423  0 54  LYS   A CE  1 ? 1 
ATOM   398  N NZ  . LYS   A 1 54  ? 32.464 -32.371 -31.224 1.000 84.551  0 54  LYS   A NZ  1 ? 1 
ATOM   399  N N   . ASP   A 1 55  ? 35.079 -25.230 -29.107 1.000 44.929  0 55  ASP   A N   1 ? 1 
ATOM   400  C CA  . ASP   A 1 55  ? 35.061 -23.815 -29.412 1.000 44.978  0 55  ASP   A CA  1 ? 1 
ATOM   401  C C   . ASP   A 1 55  ? 36.145 -23.020 -28.717 1.000 47.830  0 55  ASP   A C   1 ? 1 
ATOM   402  O O   . ASP   A 1 55  ? 36.296 -21.869 -29.106 1.000 46.685  0 55  ASP   A O   1 ? 1 
ATOM   403  C CB  . ASP   A 1 55  ? 33.692 -23.230 -29.044 1.000 50.235  0 55  ASP   A CB  1 ? 1 
ATOM   404  C CG  . ASP   A 1 55  ? 32.535 -24.024 -29.669 1.000 56.022  0 55  ASP   A CG  1 ? 1 
ATOM   405  O OD1 . ASP   A 1 55  ? 32.664 -24.384 -30.883 1.000 58.610  0 55  ASP   A OD1 1 ? 1 
ATOM   406  O OD2 . ASP   A 1 55  ? 31.586 -24.403 -28.932 1.000 61.577  0 55  ASP   A OD2 1 ? 1 
ATOM   407  N N   . LYS   A 1 56  ? 36.835 -23.523 -27.672 1.000 55.368  0 56  LYS   A N   1 ? 1 
ATOM   408  C CA  . LYS   A 1 56  ? 37.851 -22.670 -27.066 1.000 59.697  0 56  LYS   A CA  1 ? 1 
ATOM   409  C C   . LYS   A 1 56  ? 39.285 -23.095 -27.355 1.000 54.145  0 56  LYS   A C   1 ? 1 
ATOM   410  O O   . LYS   A 1 56  ? 40.140 -22.249 -27.472 1.000 58.259  0 56  LYS   A O   1 ? 1 
ATOM   411  C CB  . LYS   A 1 56  ? 37.720 -22.427 -25.569 1.000 81.867  0 56  LYS   A CB  1 ? 1 
ATOM   412  C CG  . LYS   A 1 56  ? 36.580 -21.506 -25.181 1.000 93.220  0 56  LYS   A CG  1 ? 1 
ATOM   413  C CD  . LYS   A 1 56  ? 35.285 -22.303 -25.077 1.000 94.255  0 56  LYS   A CD  1 ? 1 
ATOM   414  C CE  . LYS   A 1 56  ? 34.406 -21.760 -24.004 1.000 93.582  0 56  LYS   A CE  1 ? 1 
ATOM   415  N NZ  . LYS   A 1 56  ? 33.390 -22.787 -23.791 1.000 100.530 0 56  LYS   A NZ  1 ? 1 
ATOM   416  N N   . ILE   A 1 57  ? 39.582 -24.368 -27.532 1.000 46.960  0 57  ILE   A N   1 ? 1 
ATOM   417  C CA  . ILE   A 1 57  ? 40.967 -24.712 -27.774 1.000 41.878  0 57  ILE   A CA  1 ? 1 
ATOM   418  C C   . ILE   A 1 57  ? 41.339 -24.343 -29.239 1.000 39.538  0 57  ILE   A C   1 ? 1 
ATOM   419  O O   . ILE   A 1 57  ? 40.725 -24.792 -30.179 1.000 39.367  0 57  ILE   A O   1 ? 1 
ATOM   420  C CB  . ILE   A 1 57  ? 41.160 -26.209 -27.500 1.000 37.915  0 57  ILE   A CB  1 ? 1 
ATOM   421  C CG1 . ILE   A 1 57  ? 40.430 -26.709 -26.257 1.000 40.302  0 57  ILE   A CG1 1 ? 1 
ATOM   422  C CG2 . ILE   A 1 57  ? 42.628 -26.602 -27.548 1.000 34.646  0 57  ILE   A CG2 1 ? 1 
ATOM   423  C CD1 . ILE   A 1 57  ? 41.193 -26.525 -25.000 1.000 44.118  0 57  ILE   A CD1 1 ? 1 
ATOM   424  N N   . LYS   A 1 58  ? 42.407 -23.588 -29.468 1.000 36.291  0 58  LYS   A N   1 ? 1 
ATOM   425  C CA  . LYS   A 1 58  ? 42.937 -23.303 -30.803 1.000 36.274  0 58  LYS   A CA  1 ? 1 
ATOM   426  C C   . LYS   A 1 58  ? 43.512 -24.528 -31.516 1.000 39.813  0 58  LYS   A C   1 ? 1 
ATOM   427  O O   . LYS   A 1 58  ? 44.180 -25.388 -30.951 1.000 41.456  0 58  LYS   A O   1 ? 1 
ATOM   428  C CB  . LYS   A 1 58  ? 44.183 -22.410 -30.760 1.000 34.141  0 58  LYS   A CB  1 ? 1 
ATOM   429  C CG  . LYS   A 1 58  ? 44.027 -21.177 -29.992 1.000 31.911  0 58  LYS   A CG  1 ? 1 
ATOM   430  C CD  . LYS   A 1 58  ? 45.164 -20.195 -30.091 1.000 32.252  0 58  LYS   A CD  1 ? 1 
ATOM   431  C CE  . LYS   A 1 58  ? 46.416 -20.566 -29.456 1.000 32.996  0 58  LYS   A CE  1 ? 1 
ATOM   432  N NZ  . LYS   A 1 58  ? 47.385 -19.507 -29.819 1.000 35.308  0 58  LYS   A NZ  1 ? 1 
ATOM   433  N N   . ASP   A 1 59  ? 43.408 -24.527 -32.831 1.000 44.836  0 59  ASP   A N   1 ? 1 
ATOM   434  C CA  . ASP   A 1 59  ? 44.048 -25.580 -33.584 1.000 41.018  0 59  ASP   A CA  1 ? 1 
ATOM   435  C C   . ASP   A 1 59  ? 45.550 -25.438 -33.351 1.000 36.046  0 59  ASP   A C   1 ? 1 
ATOM   436  O O   . ASP   A 1 59  ? 46.018 -24.314 -33.149 1.000 33.384  0 59  ASP   A O   1 ? 1 
ATOM   437  C CB  . ASP   A 1 59  ? 43.582 -25.468 -35.029 1.000 45.955  0 59  ASP   A CB  1 ? 1 
ATOM   438  C CG  . ASP   A 1 59  ? 44.555 -26.105 -36.026 1.000 55.266  0 59  ASP   A CG  1 ? 1 
ATOM   439  O OD1 . ASP   A 1 59  ? 44.607 -27.368 -36.099 1.000 51.175  0 59  ASP   A OD1 1 ? 1 
ATOM   440  O OD2 . ASP   A 1 59  ? 45.329 -25.343 -36.672 1.000 65.264  0 59  ASP   A OD2 1 ? 1 
ATOM   441  N N   . GLY   A 1 60  ? 46.313 -26.548 -33.380 1.000 32.843  0 60  GLY   A N   1 ? 1 
ATOM   442  C CA  . GLY   A 1 60  ? 47.744 -26.450 -33.094 1.000 32.550  0 60  GLY   A CA  1 ? 1 
ATOM   443  C C   . GLY   A 1 60  ? 48.056 -26.381 -31.586 1.000 30.077  0 60  GLY   A C   1 ? 1 
ATOM   444  O O   . GLY   A 1 60  ? 47.332 -26.863 -30.740 1.000 28.288  0 60  GLY   A O   1 ? 1 
ATOM   445  N N   . ASN   A 1 61  ? 49.144 -25.737 -31.264 1.000 33.213  0 61  ASN   A N   1 ? 1 
ATOM   446  C CA  . ASN   A 1 61  ? 49.710 -25.769 -29.929 1.000 36.743  0 61  ASN   A CA  1 ? 1 
ATOM   447  C C   . ASN   A 1 61  ? 49.011 -24.807 -28.991 1.000 34.408  0 61  ASN   A C   1 ? 1 
ATOM   448  O O   . ASN   A 1 61  ? 48.860 -23.640 -29.304 1.000 34.917  0 61  ASN   A O   1 ? 1 
ATOM   449  C CB  . ASN   A 1 61  ? 51.182 -25.405 -29.923 1.000 39.753  0 61  ASN   A CB  1 ? 1 
ATOM   450  C CG  . ASN   A 1 61  ? 51.902 -25.990 -28.735 1.000 39.887  0 61  ASN   A CG  1 ? 1 
ATOM   451  O OD1 . ASN   A 1 61  ? 51.710 -27.137 -28.317 1.000 41.854  0 61  ASN   A OD1 1 ? 1 
ATOM   452  N ND2 . ASN   A 1 61  ? 52.716 -25.164 -28.149 1.000 42.571  0 61  ASN   A ND2 1 ? 1 
ATOM   453  N N   . ASN   A 1 62  ? 48.595 -25.358 -27.854 1.000 35.679  0 62  ASN   A N   1 ? 1 
ATOM   454  C CA  . ASN   A 1 62  ? 48.069 -24.581 -26.720 1.000 36.073  0 62  ASN   A CA  1 ? 1 
ATOM   455  C C   . ASN   A 1 62  ? 48.952 -24.737 -25.467 1.000 34.313  0 62  ASN   A C   1 ? 1 
ATOM   456  O O   . ASN   A 1 62  ? 49.217 -25.842 -25.011 1.000 32.949  0 62  ASN   A O   1 ? 1 
ATOM   457  C CB  . ASN   A 1 62  ? 46.700 -25.110 -26.436 1.000 34.526  0 62  ASN   A CB  1 ? 1 
ATOM   458  C CG  . ASN   A 1 62  ? 45.741 -24.852 -27.565 1.000 36.840  0 62  ASN   A CG  1 ? 1 
ATOM   459  O OD1 . ASN   A 1 62  ? 45.024 -23.847 -27.583 1.000 34.300  0 62  ASN   A OD1 1 ? 1 
ATOM   460  N ND2 . ASN   A 1 62  ? 45.609 -25.826 -28.430 1.000 39.994  0 62  ASN   A ND2 1 ? 1 
ATOM   461  N N   . GLU   A 1 63  ? 49.498 -23.648 -24.964 1.000 35.492  0 63  GLU   A N   1 ? 1 
ATOM   462  C CA  . GLU   A 1 63  ? 50.379 -23.678 -23.806 1.000 37.150  0 63  GLU   A CA  1 ? 1 
ATOM   463  C C   . GLU   A 1 63  ? 49.658 -23.502 -22.481 1.000 34.439  0 63  GLU   A C   1 ? 1 
ATOM   464  O O   . GLU   A 1 63  ? 48.516 -23.010 -22.445 1.000 31.979  0 63  GLU   A O   1 ? 1 
ATOM   465  C CB  . GLU   A 1 63  ? 51.310 -22.491 -23.929 1.000 44.751  0 63  GLU   A CB  1 ? 1 
ATOM   466  C CG  . GLU   A 1 63  ? 52.156 -22.551 -25.195 1.000 50.912  0 63  GLU   A CG  1 ? 1 
ATOM   467  C CD  . GLU   A 1 63  ? 53.261 -21.496 -25.147 1.000 65.096  0 63  GLU   A CD  1 ? 1 
ATOM   468  O OE1 . GLU   A 1 63  ? 53.219 -20.599 -25.994 1.000 60.800  0 63  GLU   A OE1 1 ? 1 
ATOM   469  O OE2 . GLU   A 1 63  ? 54.177 -21.579 -24.277 1.000 95.017  0 63  GLU   A OE2 1 ? 1 
ATOM   470  N N   . ASN   A 1 64  ? 50.306 -24.002 -21.397 1.000 32.997  0 64  ASN   A N   1 ? 1 
ATOM   471  C CA  . ASN   A 1 64  ? 49.873 -23.723 -20.044 1.000 29.208  0 64  ASN   A CA  1 ? 1 
ATOM   472  C C   . ASN   A 1 64  ? 48.462 -24.205 -19.825 1.000 29.379  0 64  ASN   A C   1 ? 1 
ATOM   473  O O   . ASN   A 1 64  ? 47.627 -23.485 -19.220 1.000 28.849  0 64  ASN   A O   1 ? 1 
ATOM   474  C CB  . ASN   A 1 64  ? 49.838 -22.236 -19.698 1.000 28.671  0 64  ASN   A CB  1 ? 1 
ATOM   475  C CG  . ASN   A 1 64  ? 51.146 -21.588 -20.050 1.000 30.321  0 64  ASN   A CG  1 ? 1 
ATOM   476  O OD1 . ASN   A 1 64  ? 51.243 -20.605 -20.776 1.000 34.089  0 64  ASN   A OD1 1 ? 1 
ATOM   477  N ND2 . ASN   A 1 64  ? 52.210 -22.180 -19.594 1.000 33.293  0 64  ASN   A ND2 1 ? 1 
ATOM   478  N N   . LEU   A 1 65  ? 48.280 -25.478 -20.188 1.000 29.268  0 65  LEU   A N   1 ? 1 
ATOM   479  C CA  . LEU   A 1 65  ? 47.054 -26.169 -19.794 1.000 30.812  0 65  LEU   A CA  1 ? 1 
ATOM   480  C C   . LEU   A 1 65  ? 47.256 -27.099 -18.598 1.000 31.618  0 65  LEU   A C   1 ? 1 
ATOM   481  O O   . LEU   A 1 65  ? 48.352 -27.619 -18.352 1.000 30.467  0 65  LEU   A O   1 ? 1 
ATOM   482  C CB  . LEU   A 1 65  ? 46.597 -26.983 -20.995 1.000 31.656  0 65  LEU   A CB  1 ? 1 
ATOM   483  C CG  . LEU   A 1 65  ? 46.391 -26.186 -22.304 1.000 32.419  0 65  LEU   A CG  1 ? 1 
ATOM   484  C CD1 . LEU   A 1 65  ? 46.045 -27.227 -23.384 1.000 34.054  0 65  LEU   A CD1 1 ? 1 
ATOM   485  C CD2 . LEU   A 1 65  ? 45.319 -25.103 -22.156 1.000 32.031  0 65  LEU   A CD2 1 ? 1 
ATOM   486  N N   . ASP   A 1 66  ? 46.153 -27.409 -17.936 1.000 28.282  0 66  ASP   A N   1 ? 1 
ATOM   487  C CA  . ASP   A 1 66  ? 46.128 -28.529 -17.059 1.000 28.856  0 66  ASP   A CA  1 ? 1 
ATOM   488  C C   . ASP   A 1 66  ? 45.134 -29.491 -17.710 1.000 28.424  0 66  ASP   A C   1 ? 1 
ATOM   489  O O   . ASP   A 1 66  ? 44.209 -29.026 -18.379 1.000 31.546  0 66  ASP   A O   1 ? 1 
ATOM   490  C CB  . ASP   A 1 66  ? 45.596 -28.131 -15.671 1.000 34.810  0 66  ASP   A CB  1 ? 1 
ATOM   491  C CG  . ASP   A 1 66  ? 46.394 -27.171 -14.784 1.000 34.653  0 66  ASP   A CG  1 ? 1 
ATOM   492  O OD1 . ASP   A 1 66  ? 47.592 -26.991 -15.082 1.000 34.545  0 66  ASP   A OD1 1 ? 1 
ATOM   493  O OD2 . ASP   A 1 66  ? 45.781 -26.572 -13.816 1.000 37.559  0 66  ASP   A OD2 1 ? 1 
ATOM   494  N N   . VAL   A 1 67  ? 45.223 -30.788 -17.392 1.000 25.809  0 67  VAL   A N   1 ? 1 
ATOM   495  C CA  . VAL   A 1 67  ? 44.247 -31.701 -17.877 1.000 27.856  0 67  VAL   A CA  1 ? 1 
ATOM   496  C C   . VAL   A 1 67  ? 44.052 -32.854 -16.901 1.000 27.309  0 67  VAL   A C   1 ? 1 
ATOM   497  O O   . VAL   A 1 67  ? 44.977 -33.483 -16.436 1.000 29.424  0 67  VAL   A O   1 ? 1 
ATOM   498  C CB  . VAL   A 1 67  ? 44.596 -32.195 -19.321 1.000 30.278  0 67  VAL   A CB  1 ? 1 
ATOM   499  C CG1 . VAL   A 1 67  ? 45.830 -33.059 -19.410 1.000 30.897  0 67  VAL   A CG1 1 ? 1 
ATOM   500  C CG2 . VAL   A 1 67  ? 43.496 -33.075 -19.830 1.000 30.845  0 67  VAL   A CG2 1 ? 1 
ATOM   501  N N   . PHE   A 1 68  ? 42.783 -33.160 -16.685 1.000 27.120  0 68  PHE   A N   1 ? 1 
ATOM   502  C CA  . PHE   A 1 68  ? 42.298 -34.269 -15.886 1.000 27.932  0 68  PHE   A CA  1 ? 1 
ATOM   503  C C   . PHE   A 1 68  ? 41.928 -35.451 -16.785 1.000 30.141  0 68  PHE   A C   1 ? 1 
ATOM   504  O O   . PHE   A 1 68  ? 40.920 -35.402 -17.495 1.000 30.337  0 68  PHE   A O   1 ? 1 
ATOM   505  C CB  . PHE   A 1 68  ? 41.053 -33.843 -15.123 1.000 26.729  0 68  PHE   A CB  1 ? 1 
ATOM   506  C CG  . PHE   A 1 68  ? 40.650 -34.822 -14.042 1.000 28.651  0 68  PHE   A CG  1 ? 1 
ATOM   507  C CD1 . PHE   A 1 68  ? 39.683 -35.832 -14.270 1.000 29.999  0 68  PHE   A CD1 1 ? 1 
ATOM   508  C CD2 . PHE   A 1 68  ? 41.079 -34.609 -12.715 1.000 27.355  0 68  PHE   A CD2 1 ? 1 
ATOM   509  C CE1 . PHE   A 1 68  ? 39.295 -36.687 -13.242 1.000 30.610  0 68  PHE   A CE1 1 ? 1 
ATOM   510  C CE2 . PHE   A 1 68  ? 40.714 -35.506 -11.734 1.000 26.634  0 68  PHE   A CE2 1 ? 1 
ATOM   511  C CZ  . PHE   A 1 68  ? 39.868 -36.541 -11.995 1.000 28.198  0 68  PHE   A CZ  1 ? 1 
ATOM   512  N N   . VAL   A 1 69  ? 42.765 -36.506 -16.688 1.000 31.907  0 69  VAL   A N   1 ? 1 
ATOM   513  C CA  . VAL   A 1 69  ? 42.735 -37.669 -17.537 1.000 32.898  0 69  VAL   A CA  1 ? 1 
ATOM   514  C C   . VAL   A 1 69  ? 42.170 -38.896 -16.834 1.000 35.254  0 69  VAL   A C   1 ? 1 
ATOM   515  O O   . VAL   A 1 69  ? 42.650 -39.260 -15.754 1.000 38.161  0 69  VAL   A O   1 ? 1 
ATOM   516  C CB  . VAL   A 1 69  ? 44.181 -37.945 -17.872 1.000 33.186  0 69  VAL   A CB  1 ? 1 
ATOM   517  C CG1 . VAL   A 1 69  ? 44.245 -39.158 -18.725 1.000 33.393  0 69  VAL   A CG1 1 ? 1 
ATOM   518  C CG2 . VAL   A 1 69  ? 44.832 -36.801 -18.572 1.000 34.604  0 69  VAL   A CG2 1 ? 1 
ATOM   519  N N   . VAL   A 1 70  ? 41.201 -39.531 -17.497 1.000 35.599  0 70  VAL   A N   1 ? 1 
ATOM   520  C CA  . VAL   A 1 70  ? 40.644 -40.853 -17.190 1.000 37.375  0 70  VAL   A CA  1 ? 1 
ATOM   521  C C   . VAL   A 1 70  ? 40.568 -41.621 -18.512 1.000 39.731  0 70  VAL   A C   1 ? 1 
ATOM   522  O O   . VAL   A 1 70  ? 39.953 -41.151 -19.469 1.000 38.470  0 70  VAL   A O   1 ? 1 
ATOM   523  C CB  . VAL   A 1 70  ? 39.263 -40.750 -16.535 1.000 36.472  0 70  VAL   A CB  1 ? 1 
ATOM   524  C CG1 . VAL   A 1 70  ? 38.716 -42.111 -16.154 1.000 38.459  0 70  VAL   A CG1 1 ? 1 
ATOM   525  C CG2 . VAL   A 1 70  ? 39.296 -39.826 -15.311 1.000 37.574  0 70  VAL   A CG2 1 ? 1 
ATOM   526  N N   . ARG   A 1 71  ? 41.294 -42.741 -18.555 1.000 44.913  0 71  ARG   A N   1 ? 1 
ATOM   527  C CA  . ARG   A 1 71  ? 41.413 -43.607 -19.707 1.000 47.864  0 71  ARG   A CA  1 ? 1 
ATOM   528  C C   . ARG   A 1 71  ? 40.074 -44.258 -19.914 1.000 48.707  0 71  ARG   A C   1 ? 1 
ATOM   529  O O   . ARG   A 1 71  ? 39.599 -44.809 -18.913 1.000 44.859  0 71  ARG   A O   1 ? 1 
ATOM   530  C CB  . ARG   A 1 71  ? 42.377 -44.773 -19.548 1.000 54.638  0 71  ARG   A CB  1 ? 1 
ATOM   531  C CG  . ARG   A 1 71  ? 43.794 -44.216 -19.480 1.000 75.871  0 71  ARG   A CG  1 ? 1 
ATOM   532  C CD  . ARG   A 1 71  ? 44.948 -45.228 -19.426 1.000 97.393  0 71  ARG   A CD  1 ? 1 
ATOM   533  N NE  . ARG   A 1 71  ? 44.745 -46.133 -18.286 1.000 113.338 0 71  ARG   A NE  1 ? 1 
ATOM   534  C CZ  . ARG   A 1 71  ? 45.352 -46.134 -17.093 1.000 109.567 0 71  ARG   A CZ  1 ? 1 
ATOM   535  N NH1 . ARG   A 1 71  ? 46.453 -45.426 -16.862 1.000 119.123 0 71  ARG   A NH1 1 ? 1 
ATOM   536  N NH2 . ARG   A 1 71  ? 44.846 -46.907 -16.140 1.000 90.503  0 71  ARG   A NH2 1 ? 1 
ATOM   537  N N   . GLU   A 1 72  ? 39.546 -44.170 -21.176 1.000 44.958  0 72  GLU   A N   1 ? 1 
ATOM   538  C CA  . GLU   A 1 72  ? 38.165 -44.504 -21.476 1.000 49.187  0 72  GLU   A CA  1 ? 1 
ATOM   539  C C   . GLU   A 1 72  ? 38.004 -45.969 -21.861 1.000 53.869  0 72  GLU   A C   1 ? 1 
ATOM   540  O O   . GLU   A 1 72  ? 38.937 -46.587 -22.339 1.000 48.157  0 72  GLU   A O   1 ? 1 
ATOM   541  C CB  . GLU   A 1 72  ? 37.552 -43.579 -22.511 1.000 50.905  0 72  GLU   A CB  1 ? 1 
ATOM   542  C CG  . GLU   A 1 72  ? 37.173 -42.232 -21.909 1.000 56.581  0 72  GLU   A CG  1 ? 1 
ATOM   543  C CD  . GLU   A 1 72  ? 35.927 -42.246 -21.014 1.000 59.596  0 72  GLU   A CD  1 ? 1 
ATOM   544  O OE1 . GLU   A 1 72  ? 35.147 -43.205 -21.201 1.000 55.046  0 72  GLU   A OE1 1 ? 1 
ATOM   545  O OE2 . GLU   A 1 72  ? 35.753 -41.356 -20.121 1.000 58.819  0 72  GLU   A OE2 1 ? 1 
ATOM   546  N N   . GLY   A 1 73  ? 36.827 -46.525 -21.521 1.000 66.799  0 73  GLY   A N   1 ? 1 
ATOM   547  C CA  . GLY   A 1 73  ? 36.410 -47.832 -22.012 1.000 89.558  0 73  GLY   A CA  1 ? 1 
ATOM   548  C C   . GLY   A 1 73  ? 36.576 -48.943 -20.991 1.000 92.426  0 73  GLY   A C   1 ? 1 
ATOM   549  O O   . GLY   A 1 73  ? 37.212 -49.952 -21.372 1.000 110.056 0 73  GLY   A O   1 ? 1 
ATOM   550  N N   . ASN   A 1 80  ? 45.256 -44.960 -24.629 1.000 94.565  0 80  ASN   A N   1 ? 1 
ATOM   551  C CA  . ASN   A 1 80  ? 45.427 -43.668 -23.902 1.000 93.726  0 80  ASN   A CA  1 ? 1 
ATOM   552  C C   . ASN   A 1 80  ? 44.547 -42.574 -24.535 1.000 78.823  0 80  ASN   A C   1 ? 1 
ATOM   553  O O   . ASN   A 1 80  ? 45.052 -41.572 -25.059 1.000 77.385  0 80  ASN   A O   1 ? 1 
ATOM   554  C CB  . ASN   A 1 80  ? 46.908 -43.329 -23.740 1.000 94.652  0 80  ASN   A CB  1 ? 1 
ATOM   555  C CG  . ASN   A 1 80  ? 47.208 -42.915 -22.318 1.000 98.019  0 80  ASN   A CG  1 ? 1 
ATOM   556  O OD1 . ASN   A 1 80  ? 46.309 -42.463 -21.596 1.000 82.773  0 80  ASN   A OD1 1 ? 1 
ATOM   557  N ND2 . ASN   A 1 80  ? 48.456 -43.077 -21.899 1.000 106.218 0 80  ASN   A ND2 1 ? 1 
ATOM   558  N N   . ASN   A 1 81  ? 43.221 -42.765 -24.394 1.000 61.521  0 81  ASN   A N   1 ? 1 
ATOM   559  C CA  . ASN   A 1 81  ? 42.229 -41.777 -24.775 1.000 61.824  0 81  ASN   A CA  1 ? 1 
ATOM   560  C C   . ASN   A 1 81  ? 41.427 -41.314 -23.557 1.000 52.703  0 81  ASN   A C   1 ? 1 
ATOM   561  O O   . ASN   A 1 81  ? 40.886 -42.115 -22.804 1.000 59.614  0 81  ASN   A O   1 ? 1 
ATOM   562  C CB  . ASN   A 1 81  ? 41.340 -42.294 -25.908 1.000 63.695  0 81  ASN   A CB  1 ? 1 
ATOM   563  C CG  . ASN   A 1 81  ? 42.070 -42.311 -27.241 1.000 69.058  0 81  ASN   A CG  1 ? 1 
ATOM   564  O OD1 . ASN   A 1 81  ? 42.348 -41.268 -27.823 1.000 65.257  0 81  ASN   A OD1 1 ? 1 
ATOM   565  N ND2 . ASN   A 1 81  ? 42.441 -43.466 -27.744 1.000 69.130  0 81  ASN   A ND2 1 ? 1 
ATOM   566  N N   . SER   A 1 82  ? 41.223 -40.010 -23.445 1.000 40.864  0 82  SER   A N   1 ? 1 
ATOM   567  C CA  . SER   A 1 82  ? 40.402 -39.495 -22.374 1.000 40.977  0 82  SER   A CA  1 ? 1 
ATOM   568  C C   . SER   A 1 82  ? 39.463 -38.480 -23.004 1.000 36.846  0 82  SER   A C   1 ? 1 
ATOM   569  O O   . SER   A 1 82  ? 39.750 -38.059 -24.061 1.000 35.254  0 82  SER   A O   1 ? 1 
ATOM   570  C CB  . SER   A 1 82  ? 41.305 -38.905 -21.255 1.000 38.894  0 82  SER   A CB  1 ? 1 
ATOM   571  O OG  . SER   A 1 82  ? 40.539 -38.117 -20.371 1.000 38.206  0 82  SER   A OG  1 ? 1 
ATOM   572  N N   . ILE   A 1 83  ? 38.433 -38.006 -22.329 1.000 37.791  0 83  ILE   A N   1 ? 1 
ATOM   573  C CA  . ILE   A 1 83  ? 37.542 -37.028 -22.895 1.000 40.149  0 83  ILE   A CA  1 ? 1 
ATOM   574  C C   . ILE   A 1 83  ? 37.474 -35.807 -21.999 1.000 37.205  0 83  ILE   A C   1 ? 1 
ATOM   575  O O   . ILE   A 1 83  ? 37.058 -35.935 -20.886 1.000 40.262  0 83  ILE   A O   1 ? 1 
ATOM   576  C CB  . ILE   A 1 83  ? 36.156 -37.664 -22.995 1.000 42.128  0 83  ILE   A CB  1 ? 1 
ATOM   577  C CG1 . ILE   A 1 83  ? 36.173 -38.872 -23.915 1.000 42.974  0 83  ILE   A CG1 1 ? 1 
ATOM   578  C CG2 . ILE   A 1 83  ? 35.083 -36.662 -23.410 1.000 42.699  0 83  ILE   A CG2 1 ? 1 
ATOM   579  C CD1 . ILE   A 1 83  ? 34.928 -39.716 -23.751 1.000 40.291  0 83  ILE   A CD1 1 ? 1 
ATOM   580  N N   . GLY   A 1 84  ? 37.745 -34.628 -22.537 1.000 35.551  0 84  GLY   A N   1 ? 1 
ATOM   581  C CA  . GLY   A 1 84  ? 37.496 -33.363 -21.847 1.000 32.797  0 84  GLY   A CA  1 ? 1 
ATOM   582  C C   . GLY   A 1 84  ? 38.565 -33.115 -20.789 1.000 32.286  0 84  GLY   A C   1 ? 1 
ATOM   583  O O   . GLY   A 1 84  ? 39.731 -33.564 -20.906 1.000 27.775  0 84  GLY   A O   1 ? 1 
ATOM   584  N N   . GLY   A 1 85  ? 38.077 -32.464 -19.706 1.000 32.951  0 85  GLY   A N   1 ? 1 
ATOM   585  C CA  . GLY   A 1 85  ? 38.882 -32.239 -18.515 1.000 32.867  0 85  GLY   A CA  1 ? 1 
ATOM   586  C C   . GLY   A 1 85  ? 40.056 -31.275 -18.765 1.000 31.095  0 85  GLY   A C   1 ? 1 
ATOM   587  O O   . GLY   A 1 85  ? 40.998 -31.249 -17.994 1.000 32.242  0 85  GLY   A O   1 ? 1 
ATOM   588  N N   . ILE   A 1 86  ? 40.042 -30.474 -19.831 1.000 28.806  0 86  ILE   A N   1 ? 1 
ATOM   589  C CA  . ILE   A 1 86  ? 41.135 -29.534 -20.034 1.000 29.671  0 86  ILE   A CA  1 ? 1 
ATOM   590  C C   . ILE   A 1 86  ? 40.818 -28.175 -19.425 1.000 28.517  0 86  ILE   A C   1 ? 1 
ATOM   591  O O   . ILE   A 1 86  ? 39.701 -27.700 -19.604 1.000 30.536  0 86  ILE   A O   1 ? 1 
ATOM   592  C CB  . ILE   A 1 86  ? 41.425 -29.330 -21.514 1.000 30.568  0 86  ILE   A CB  1 ? 1 
ATOM   593  C CG1 . ILE   A 1 86  ? 41.876 -30.631 -22.115 1.000 37.140  0 86  ILE   A CG1 1 ? 1 
ATOM   594  C CG2 . ILE   A 1 86  ? 42.435 -28.206 -21.717 1.000 27.319  0 86  ILE   A CG2 1 ? 1 
ATOM   595  C CD1 . ILE   A 1 86  ? 41.924 -30.636 -23.663 1.000 37.310  0 86  ILE   A CD1 1 ? 1 
ATOM   596  N N   . THR   A 1 87  ? 41.802 -27.521 -18.768 1.000 25.919  0 87  THR   A N   1 ? 1 
ATOM   597  C CA  . THR   A 1 87  ? 41.562 -26.211 -18.145 1.000 26.634  0 87  THR   A CA  1 ? 1 
ATOM   598  C C   . THR   A 1 87  ? 42.768 -25.312 -18.353 1.000 27.303  0 87  THR   A C   1 ? 1 
ATOM   599  O O   . THR   A 1 87  ? 43.856 -25.796 -18.705 1.000 29.564  0 87  THR   A O   1 ? 1 
ATOM   600  C CB  . THR   A 1 87  ? 41.306 -26.358 -16.635 1.000 28.744  0 87  THR   A CB  1 ? 1 
ATOM   601  O OG1 . THR   A 1 87  ? 42.342 -27.153 -16.033 1.000 27.043  0 87  THR   A OG1 1 ? 1 
ATOM   602  C CG2 . THR   A 1 87  ? 39.961 -26.982 -16.337 1.000 27.385  0 87  THR   A CG2 1 ? 1 
ATOM   603  N N   . LYS   A 1 88  ? 42.578 -24.005 -18.192 1.000 29.856  0 88  LYS   A N   1 ? 1 
ATOM   604  C CA  . LYS   A 1 88  ? 43.751 -23.113 -18.114 1.000 36.317  0 88  LYS   A CA  1 ? 1 
ATOM   605  C C   . LYS   A 1 88  ? 44.496 -23.475 -16.814 1.000 35.383  0 88  LYS   A C   1 ? 1 
ATOM   606  O O   . LYS   A 1 88  ? 43.856 -23.709 -15.812 1.000 35.036  0 88  LYS   A O   1 ? 1 
ATOM   607  C CB  . LYS   A 1 88  ? 43.490 -21.599 -17.967 1.000 42.155  0 88  LYS   A CB  1 ? 1 
ATOM   608  C CG  . LYS   A 1 88  ? 42.696 -20.775 -19.024 1.000 61.805  0 88  LYS   A CG  1 ? 1 
ATOM   609  C CD  . LYS   A 1 88  ? 42.218 -19.368 -18.612 1.000 70.564  0 88  LYS   A CD  1 ? 1 
ATOM   610  C CE  . LYS   A 1 88  ? 41.356 -19.474 -17.315 1.000 84.660  0 88  LYS   A CE  1 ? 1 
ATOM   611  N NZ  . LYS   A 1 88  ? 41.510 -18.603 -16.121 1.000 80.236  0 88  LYS   A NZ  1 ? 1 
ATOM   612  N N   . THR   A 1 89  ? 45.838 -23.562 -16.806 1.000 37.243  0 89  THR   A N   1 ? 1 
ATOM   613  C CA  . THR   A 1 89  ? 46.594 -23.729 -15.565 1.000 37.014  0 89  THR   A CA  1 ? 1 
ATOM   614  C C   . THR   A 1 89  ? 46.412 -22.508 -14.648 1.000 38.112  0 89  THR   A C   1 ? 1 
ATOM   615  O O   . THR   A 1 89  ? 45.908 -21.477 -15.019 1.000 36.392  0 89  THR   A O   1 ? 1 
ATOM   616  C CB  . THR   A 1 89  ? 48.058 -23.990 -15.871 1.000 38.312  0 89  THR   A CB  1 ? 1 
ATOM   617  O OG1 . THR   A 1 89  ? 48.525 -24.583 -14.674 1.000 44.537  0 89  THR   A OG1 1 ? 1 
ATOM   618  C CG2 . THR   A 1 89  ? 48.813 -22.699 -16.104 1.000 38.088  0 89  THR   A CG2 1 ? 1 
ATOM   619  N N   . ASN   A 1 90  ? 46.757 -22.620 -13.382 1.000 38.942  0 90  ASN   A N   1 ? 1 
ATOM   620  C CA  . ASN   A 1 90  ? 46.686 -21.463 -12.510 1.000 39.112  0 90  ASN   A CA  1 ? 1 
ATOM   621  C C   . ASN   A 1 90  ? 47.678 -20.380 -12.914 1.000 41.684  0 90  ASN   A C   1 ? 1 
ATOM   622  O O   . ASN   A 1 90  ? 48.828 -20.697 -13.181 1.000 37.460  0 90  ASN   A O   1 ? 1 
ATOM   623  C CB  . ASN   A 1 90  ? 47.090 -21.835 -11.100 1.000 36.229  0 90  ASN   A CB  1 ? 1 
ATOM   624  C CG  . ASN   A 1 90  ? 46.044 -22.625 -10.376 1.000 38.466  0 90  ASN   A CG  1 ? 1 
ATOM   625  O OD1 . ASN   A 1 90  ? 44.854 -22.614 -10.702 1.000 41.458  0 90  ASN   A OD1 1 ? 1 
ATOM   626  N ND2 . ASN   A 1 90  ? 46.436 -23.187 -9.245  1.000 49.694  0 90  ASN   A ND2 1 ? 1 
ATOM   627  N N   . ARG   A 1 91  ? 47.271 -19.106 -12.868 1.000 53.415  0 91  ARG   A N   1 ? 1 
ATOM   628  C CA  . ARG   A 1 91  ? 48.175 -18.015 -13.217 1.000 70.314  0 91  ARG   A CA  1 ? 1 
ATOM   629  C C   . ARG   A 1 91  ? 49.273 -17.840 -12.164 1.000 67.307  0 91  ARG   A C   1 ? 1 
ATOM   630  O O   . ARG   A 1 91  ? 50.357 -17.395 -12.493 1.000 70.323  0 91  ARG   A O   1 ? 1 
ATOM   631  C CB  . ARG   A 1 91  ? 47.522 -16.636 -13.345 1.000 79.542  0 91  ARG   A CB  1 ? 1 
ATOM   632  C CG  . ARG   A 1 91  ? 46.362 -16.505 -14.324 1.000 93.022  0 91  ARG   A CG  1 ? 1 
ATOM   633  C CD  . ARG   A 1 91  ? 45.344 -15.631 -13.532 1.000 132.985 0 91  ARG   A CD  1 ? 1 
ATOM   634  N NE  . ARG   A 1 91  ? 44.141 -15.133 -14.222 1.000 151.852 0 91  ARG   A NE  1 ? 1 
ATOM   635  C CZ  . ARG   A 1 91  ? 42.888 -15.558 -14.027 1.000 146.119 0 91  ARG   A CZ  1 ? 1 
ATOM   636  N NH1 . ARG   A 1 91  ? 42.665 -16.698 -13.408 1.000 149.181 0 91  ARG   A NH1 1 ? 1 
ATOM   637  N NH2 . ARG   A 1 91  ? 41.848 -14.897 -14.502 1.000 128.251 0 91  ARG   A NH2 1 ? 1 
ATOM   638  N N   . THR   A 1 92  ? 48.976 -18.157 -10.906 1.000 74.253  0 92  THR   A N   1 ? 1 
ATOM   639  C CA  . THR   A 1 92  ? 49.929 -18.007 -9.814  1.000 80.869  0 92  THR   A CA  1 ? 1 
ATOM   640  C C   . THR   A 1 92  ? 49.998 -19.328 -9.071  1.000 85.475  0 92  THR   A C   1 ? 1 
ATOM   641  O O   . THR   A 1 92  ? 48.957 -19.979 -8.935  1.000 75.055  0 92  THR   A O   1 ? 1 
ATOM   642  C CB  . THR   A 1 92  ? 49.458 -16.908 -8.850  1.000 78.900  0 92  THR   A CB  1 ? 1 
ATOM   643  O OG1 . THR   A 1 92  ? 48.098 -17.147 -8.490  1.000 69.367  0 92  THR   A OG1 1 ? 1 
ATOM   644  C CG2 . THR   A 1 92  ? 49.472 -15.529 -9.475  1.000 76.202  0 92  THR   A CG2 1 ? 1 
ATOM   645  N N   . GLN   A 1 93  ? 51.179 -19.655 -8.524  1.000 98.836  0 93  GLN   A N   1 ? 1 
ATOM   646  C CA  . GLN   A 1 93  ? 51.278 -20.707 -7.508  1.000 115.742 0 93  GLN   A CA  1 ? 1 
ATOM   647  C C   . GLN   A 1 93  ? 50.403 -20.386 -6.294  1.000 107.582 0 93  GLN   A C   1 ? 1 
ATOM   648  O O   . GLN   A 1 93  ? 50.505 -19.332 -5.677  1.000 108.427 0 93  GLN   A O   1 ? 1 
ATOM   649  C CB  . GLN   A 1 93  ? 52.603 -20.940 -6.788  1.000 119.724 0 93  GLN   A CB  1 ? 1 
ATOM   650  C CG  . GLN   A 1 93  ? 53.512 -22.007 -7.380  1.000 126.284 0 93  GLN   A CG  1 ? 1 
ATOM   651  C CD  . GLN   A 1 93  ? 54.933 -21.738 -6.928  1.000 140.283 0 93  GLN   A CD  1 ? 1 
ATOM   652  O OE1 . GLN   A 1 93  ? 55.171 -21.481 -5.736  1.000 136.386 0 93  GLN   A OE1 1 ? 1 
ATOM   653  N NE2 . GLN   A 1 93  ? 55.866 -21.680 -7.874  1.000 123.324 0 93  GLN   A NE2 1 ? 1 
ATOM   654  N N   . HIS   A 1 94  ? 49.518 -21.313 -5.962  1.000 94.427  0 94  HIS   A N   1 ? 1 
ATOM   655  C CA  . HIS   A 1 94  ? 48.686 -21.177 -4.792  1.000 94.937  0 94  HIS   A CA  1 ? 1 
ATOM   656  C C   . HIS   A 1 94  ? 49.126 -22.311 -3.886  1.000 108.124 0 94  HIS   A C   1 ? 1 
ATOM   657  O O   . HIS   A 1 94  ? 48.580 -23.406 -3.994  1.000 98.597  0 94  HIS   A O   1 ? 1 
ATOM   658  C CB  . HIS   A 1 94  ? 47.197 -21.364 -5.137  1.000 91.442  0 94  HIS   A CB  1 ? 1 
ATOM   659  C CG  . HIS   A 1 94  ? 46.505 -20.260 -5.892  1.000 91.423  0 94  HIS   A CG  1 ? 1 
ATOM   660  N ND1 . HIS   A 1 94  ? 45.464 -19.515 -5.359  1.000 96.275  0 94  HIS   A ND1 1 ? 1 
ATOM   661  C CD2 . HIS   A 1 94  ? 46.640 -19.826 -7.162  1.000 81.086  0 94  HIS   A CD2 1 ? 1 
ATOM   662  C CE1 . HIS   A 1 94  ? 45.011 -18.651 -6.266  1.000 79.287  0 94  HIS   A CE1 1 ? 1 
ATOM   663  N NE2 . HIS   A 1 94  ? 45.734 -18.807 -7.355  1.000 79.825  0 94  HIS   A NE2 1 ? 1 
ATOM   664  N N   . ILE   A 1 95  ? 50.121 -22.054 -3.027  1.000 135.739 0 95  ILE   A N   1 ? 1 
ATOM   665  C CA  . ILE   A 1 95  ? 50.487 -23.004 -1.976  1.000 137.888 0 95  ILE   A CA  1 ? 1 
ATOM   666  C C   . ILE   A 1 95  ? 49.322 -23.097 -0.979  1.000 134.112 0 95  ILE   A C   1 ? 1 
ATOM   667  O O   . ILE   A 1 95  ? 48.971 -24.191 -0.553  1.000 103.348 0 95  ILE   A O   1 ? 1 
ATOM   668  C CB  . ILE   A 1 95  ? 51.842 -22.680 -1.297  1.000 127.589 0 95  ILE   A CB  1 ? 1 
ATOM   669  C CG1 . ILE   A 1 95  ? 52.901 -22.198 -2.320  1.000 121.217 0 95  ILE   A CG1 1 ? 1 
ATOM   670  C CG2 . ILE   A 1 95  ? 52.345 -23.879 -0.474  1.000 120.188 0 95  ILE   A CG2 1 ? 1 
ATOM   671  C CD1 . ILE   A 1 95  ? 54.125 -21.528 -1.717  1.000 106.564 0 95  ILE   A CD1 1 ? 1 
ATOM   672  N N   . ASP   A 1 96  ? 48.684 -21.961 -0.652  1.000 155.765 0 96  ASP   A N   1 ? 1 
ATOM   673  C CA  . ASP   A 1 96  ? 47.406 -21.963 0.050   1.000 147.044 0 96  ASP   A CA  1 ? 1 
ATOM   674  C C   . ASP   A 1 96  ? 46.269 -22.313 -0.938  1.000 138.593 0 96  ASP   A C   1 ? 1 
ATOM   675  O O   . ASP   A 1 96  ? 46.426 -22.175 -2.157  1.000 111.760 0 96  ASP   A O   1 ? 1 
ATOM   676  C CB  . ASP   A 1 96  ? 47.256 -20.663 0.829   1.000 137.292 0 96  ASP   A CB  1 ? 1 
ATOM   677  C CG  . ASP   A 1 96  ? 45.829 -20.374 1.272   1.000 156.427 0 96  ASP   A CG  1 ? 1 
ATOM   678  O OD1 . ASP   A 1 96  ? 45.204 -21.281 1.877   1.000 145.547 0 96  ASP   A OD1 1 ? 1 
ATOM   679  O OD2 . ASP   A 1 96  ? 45.335 -19.273 0.963   1.000 177.138 0 96  ASP   A OD2 1 ? 1 
ATOM   680  N N   . THR   A 1 97  ? 45.109 -22.782 -0.436  1.000 105.377 0 97  THR   A N   1 ? 1 
ATOM   681  C CA  . THR   A 1 97  ? 44.031 -23.165 -1.337  1.000 86.429  0 97  THR   A CA  1 ? 1 
ATOM   682  C C   . THR   A 1 97  ? 43.378 -21.934 -1.982  1.000 75.502  0 97  THR   A C   1 ? 1 
ATOM   683  O O   . THR   A 1 97  ? 43.478 -20.820 -1.501  1.000 79.397  0 97  THR   A O   1 ? 1 
ATOM   684  C CB  . THR   A 1 97  ? 42.980 -24.019 -0.625  1.000 86.113  0 97  THR   A CB  1 ? 1 
ATOM   685  O OG1 . THR   A 1 97  ? 42.298 -23.071 0.178   1.000 73.611  0 97  THR   A OG1 1 ? 1 
ATOM   686  C CG2 . THR   A 1 97  ? 43.566 -25.230 0.083   1.000 77.334  0 97  THR   A CG2 1 ? 1 
ATOM   687  N N   . VAL   A 1 98  ? 42.686 -22.171 -3.096  1.000 65.010  0 98  VAL   A N   1 ? 1 
ATOM   688  C CA  . VAL   A 1 98  ? 41.943 -21.171 -3.853  1.000 61.582  0 98  VAL   A CA  1 ? 1 
ATOM   689  C C   . VAL   A 1 98  ? 40.570 -20.920 -3.210  1.000 61.979  0 98  VAL   A C   1 ? 1 
ATOM   690  O O   . VAL   A 1 98  ? 40.074 -19.802 -3.304  1.000 62.575  0 98  VAL   A O   1 ? 1 
ATOM   691  C CB  . VAL   A 1 98  ? 41.786 -21.741 -5.292  1.000 60.568  0 98  VAL   A CB  1 ? 1 
ATOM   692  C CG1 . VAL   A 1 98  ? 40.731 -21.042 -6.139  1.000 57.379  0 98  VAL   A CG1 1 ? 1 
ATOM   693  C CG2 . VAL   A 1 98  ? 43.098 -21.836 -6.038  1.000 58.138  0 98  VAL   A CG2 1 ? 1 
ATOM   694  N N   . GLN   A 1 99  ? 39.908 -21.963 -2.661  1.000 60.446  0 99  GLN   A N   1 ? 1 
ATOM   695  C CA  . GLN   A 1 99  ? 38.561 -21.843 -2.101  1.000 60.775  0 99  GLN   A CA  1 ? 1 
ATOM   696  C C   . GLN   A 1 99  ? 38.345 -23.029 -1.178  1.000 57.690  0 99  GLN   A C   1 ? 1 
ATOM   697  O O   . GLN   A 1 99  ? 38.950 -24.086 -1.377  1.000 61.630  0 99  GLN   A O   1 ? 1 
ATOM   698  C CB  . GLN   A 1 99  ? 37.491 -21.740 -3.193  1.000 60.651  0 99  GLN   A CB  1 ? 1 
ATOM   699  C CG  . GLN   A 1 99  ? 36.033 -21.633 -2.749  1.000 61.174  0 99  GLN   A CG  1 ? 1 
ATOM   700  C CD  . GLN   A 1 99  ? 35.735 -20.409 -1.900  1.000 68.584  0 99  GLN   A CD  1 ? 1 
ATOM   701  O OE1 . GLN   A 1 99  ? 35.916 -19.282 -2.329  1.000 61.991  0 99  GLN   A OE1 1 ? 1 
ATOM   702  N NE2 . GLN   A 1 99  ? 35.268 -20.570 -0.669  1.000 88.196  0 99  GLN   A NE2 1 ? 1 
ATOM   703  N N   . ASN   A 1 100 ? 37.616 -22.769 -0.082  1.000 63.180  0 100 ASN   A N   1 ? 1 
ATOM   704  C CA  . ASN   A 1 100 ? 37.075 -23.824 0.769   1.000 65.755  0 100 ASN   A CA  1 ? 1 
ATOM   705  C C   . ASN   A 1 100 ? 35.574 -23.881 0.578   1.000 60.466  0 100 ASN   A C   1 ? 1 
ATOM   706  O O   . ASN   A 1 100 ? 34.904 -22.842 0.590   1.000 56.327  0 100 ASN   A O   1 ? 1 
ATOM   707  C CB  . ASN   A 1 100 ? 37.400 -23.677 2.248   1.000 66.641  0 100 ASN   A CB  1 ? 1 
ATOM   708  C CG  . ASN   A 1 100 ? 38.890 -23.825 2.420   1.000 75.686  0 100 ASN   A CG  1 ? 1 
ATOM   709  O OD1 . ASN   A 1 100 ? 39.507 -24.828 2.013   1.000 69.757  0 100 ASN   A OD1 1 ? 1 
ATOM   710  N ND2 . ASN   A 1 100 ? 39.500 -22.768 2.925   1.000 81.177  0 100 ASN   A ND2 1 ? 1 
ATOM   711  N N   . VAL   A 1 101 ? 35.098 -25.119 0.416   1.000 61.722  0 101 VAL   A N   1 ? 1 
ATOM   712  C CA  . VAL   A 1 101 ? 33.758 -25.410 -0.055  1.000 63.740  0 101 VAL   A CA  1 ? 1 
ATOM   713  C C   . VAL   A 1 101 ? 33.099 -26.390 0.901   1.000 60.001  0 101 VAL   A C   1 ? 1 
ATOM   714  O O   . VAL   A 1 101 ? 33.665 -27.439 1.214   1.000 62.129  0 101 VAL   A O   1 ? 1 
ATOM   715  C CB  . VAL   A 1 101 ? 33.868 -25.935 -1.500  1.000 62.123  0 101 VAL   A CB  1 ? 1 
ATOM   716  C CG1 . VAL   A 1 101 ? 32.607 -26.578 -2.013  1.000 67.331  0 101 VAL   A CG1 1 ? 1 
ATOM   717  C CG2 . VAL   A 1 101 ? 34.228 -24.799 -2.452  1.000 65.193  0 101 VAL   A CG2 1 ? 1 
ATOM   718  N N   . ASN   A 1 102 ? 31.889 -26.054 1.331   1.000 54.839  0 102 ASN   A N   1 ? 1 
ATOM   719  C CA  . ASN   A 1 102 ? 31.251 -26.980 2.223   1.000 57.875  0 102 ASN   A CA  1 ? 1 
ATOM   720  C C   . ASN   A 1 102 ? 30.670 -28.089 1.351   1.000 55.679  0 102 ASN   A C   1 ? 1 
ATOM   721  O O   . ASN   A 1 102 ? 29.748 -27.821 0.593   1.000 58.702  0 102 ASN   A O   1 ? 1 
ATOM   722  C CB  . ASN   A 1 102 ? 30.343 -26.261 3.240   1.000 63.817  0 102 ASN   A CB  1 ? 1 
ATOM   723  C CG  . ASN   A 1 102 ? 29.549 -27.231 4.108   1.000 70.857  0 102 ASN   A CG  1 ? 1 
ATOM   724  O OD1 . ASN   A 1 102 ? 28.315 -27.101 4.180   1.000 71.346  0 102 ASN   A OD1 1 ? 1 
ATOM   725  N ND2 . ASN   A 1 102 ? 30.197 -28.252 4.687   1.000 64.497  0 102 ASN   A ND2 1 ? 1 
ATOM   726  N N   . LEU   A 1 103 ? 31.143 -29.334 1.561   1.000 55.612  0 103 LEU   A N   1 ? 1 
ATOM   727  C CA  . LEU   A 1 103 ? 30.489 -30.561 1.081   1.000 51.181  0 103 LEU   A CA  1 ? 1 
ATOM   728  C C   . LEU   A 1 103 ? 29.594 -31.208 2.141   1.000 55.572  0 103 LEU   A C   1 ? 1 
ATOM   729  O O   . LEU   A 1 103 ? 30.032 -31.546 3.263   1.000 55.707  0 103 LEU   A O   1 ? 1 
ATOM   730  C CB  . LEU   A 1 103 ? 31.588 -31.552 0.709   1.000 48.276  0 103 LEU   A CB  1 ? 1 
ATOM   731  C CG  . LEU   A 1 103 ? 31.153 -32.964 0.325   1.000 47.630  0 103 LEU   A CG  1 ? 1 
ATOM   732  C CD1 . LEU   A 1 103 ? 30.256 -32.965 -0.922  1.000 50.985  0 103 LEU   A CD1 1 ? 1 
ATOM   733  C CD2 . LEU   A 1 103 ? 32.409 -33.782 0.026   1.000 47.796  0 103 LEU   A CD2 1 ? 1 
ATOM   734  N N   . LEU   A 1 104 ? 28.372 -31.480 1.682   1.000 57.750  0 104 LEU   A N   1 ? 1 
ATOM   735  C CA  . LEU   A 1 104 ? 27.216 -31.876 2.463   1.000 59.303  0 104 LEU   A CA  1 ? 1 
ATOM   736  C C   . LEU   A 1 104 ? 26.634 -33.140 1.862   1.000 59.587  0 104 LEU   A C   1 ? 1 
ATOM   737  O O   . LEU   A 1 104 ? 25.958 -33.062 0.855   1.000 73.559  0 104 LEU   A O   1 ? 1 
ATOM   738  C CB  . LEU   A 1 104 ? 26.175 -30.759 2.399   1.000 65.704  0 104 LEU   A CB  1 ? 1 
ATOM   739  C CG  . LEU   A 1 104 ? 26.320 -29.572 3.371   1.000 81.131  0 104 LEU   A CG  1 ? 1 
ATOM   740  C CD1 . LEU   A 1 104 ? 25.191 -28.522 3.212   1.000 85.009  0 104 LEU   A CD1 1 ? 1 
ATOM   741  C CD2 . LEU   A 1 104 ? 26.371 -30.043 4.836   1.000 79.350  0 104 LEU   A CD2 1 ? 1 
ATOM   742  N N   . VAL   A 1 105 ? 26.907 -34.300 2.451   1.000 56.042  0 105 VAL   A N   1 ? 1 
ATOM   743  C CA  . VAL   A 1 105 ? 26.346 -35.553 1.972   1.000 55.068  0 105 VAL   A CA  1 ? 1 
ATOM   744  C C   . VAL   A 1 105 ? 25.187 -35.934 2.878   1.000 58.042  0 105 VAL   A C   1 ? 1 
ATOM   745  O O   . VAL   A 1 105 ? 25.318 -35.903 4.085   1.000 64.610  0 105 VAL   A O   1 ? 1 
ATOM   746  C CB  . VAL   A 1 105 ? 27.417 -36.657 2.007   1.000 52.614  0 105 VAL   A CB  1 ? 1 
ATOM   747  C CG1 . VAL   A 1 105 ? 27.025 -37.953 1.322   1.000 52.014  0 105 VAL   A CG1 1 ? 1 
ATOM   748  C CG2 . VAL   A 1 105 ? 28.706 -36.169 1.423   1.000 53.075  0 105 VAL   A CG2 1 ? 1 
ATOM   749  N N   . SER   A 1 106 ? 24.069 -36.364 2.311   1.000 61.553  0 106 SER   A N   1 ? 1 
ATOM   750  C CA  . SER   A 1 106 ? 22.939 -36.773 3.110   1.000 61.605  0 106 SER   A CA  1 ? 1 
ATOM   751  C C   . SER   A 1 106 ? 22.542 -38.195 2.694   1.000 69.574  0 106 SER   A C   1 ? 1 
ATOM   752  O O   . SER   A 1 106 ? 22.350 -38.476 1.543   1.000 79.507  0 106 SER   A O   1 ? 1 
ATOM   753  C CB  . SER   A 1 106 ? 21.839 -35.715 3.022   1.000 55.750  0 106 SER   A CB  1 ? 1 
ATOM   754  O OG  . SER   A 1 106 ? 20.925 -36.005 1.989   1.000 60.401  0 106 SER   A OG  1 ? 1 
ATOM   755  N N   . LYS   A 1 107 ? 22.496 -39.134 3.625   1.000 77.746  0 107 LYS   A N   1 ? 1 
ATOM   756  C CA  . LYS   A 1 107 ? 22.166 -40.519 3.339   1.000 78.013  0 107 LYS   A CA  1 ? 1 
ATOM   757  C C   . LYS   A 1 107 ? 20.999 -40.920 4.260   1.000 84.216  0 107 LYS   A C   1 ? 1 
ATOM   758  O O   . LYS   A 1 107 ? 20.965 -40.612 5.458   1.000 81.132  0 107 LYS   A O   1 ? 1 
ATOM   759  C CB  . LYS   A 1 107 ? 23.448 -41.357 3.527   1.000 79.222  0 107 LYS   A CB  1 ? 1 
ATOM   760  C CG  . LYS   A 1 107 ? 23.191 -42.858 3.845   1.000 89.511  0 107 LYS   A CG  1 ? 1 
ATOM   761  C CD  . LYS   A 1 107 ? 23.228 -43.881 2.704   1.000 97.725  0 107 LYS   A CD  1 ? 1 
ATOM   762  C CE  . LYS   A 1 107 ? 21.998 -44.773 2.476   1.000 97.029  0 107 LYS   A CE  1 ? 1 
ATOM   763  N NZ  . LYS   A 1 107 ? 21.123 -44.204 1.421   1.000 91.696  0 107 LYS   A NZ  1 ? 1 
ATOM   764  N N   . SER   A 1 108 ? 20.005 -41.582 3.676   1.000 79.786  0 108 SER   A N   1 ? 1 
ATOM   765  C CA  . SER   A 1 108 ? 18.898 -42.159 4.398   1.000 78.686  0 108 SER   A CA  1 ? 1 
ATOM   766  C C   . SER   A 1 108 ? 19.121 -43.660 4.495   1.000 86.397  0 108 SER   A C   1 ? 1 
ATOM   767  O O   . SER   A 1 108 ? 18.727 -44.377 3.580   1.000 81.861  0 108 SER   A O   1 ? 1 
ATOM   768  C CB  . SER   A 1 108 ? 17.592 -41.838 3.716   1.000 85.031  0 108 SER   A CB  1 ? 1 
ATOM   769  O OG  . SER   A 1 108 ? 17.401 -40.440 3.549   1.000 86.644  0 108 SER   A OG  1 ? 1 
ATOM   770  N N   . THR   A 1 109 ? 19.710 -44.131 5.616   1.000 104.814 0 109 THR   A N   1 ? 1 
ATOM   771  C CA  . THR   A 1 109 ? 19.962 -45.557 5.836   1.000 95.037  0 109 THR   A CA  1 ? 1 
ATOM   772  C C   . THR   A 1 109 ? 18.659 -46.252 6.223   1.000 93.658  0 109 THR   A C   1 ? 1 
ATOM   773  O O   . THR   A 1 109 ? 18.681 -47.333 6.807   1.000 89.666  0 109 THR   A O   1 ? 1 
ATOM   774  C CB  . THR   A 1 109 ? 21.018 -45.788 6.917   1.000 100.786 0 109 THR   A CB  1 ? 1 
ATOM   775  O OG1 . THR   A 1 109 ? 21.671 -44.529 7.080   1.000 114.097 0 109 THR   A OG1 1 ? 1 
ATOM   776  C CG2 . THR   A 1 109 ? 22.022 -46.869 6.549   1.000 99.379  0 109 THR   A CG2 1 ? 1 
ATOM   777  N N   . GLY   A 1 110 ? 17.528 -45.622 5.908   1.000 96.893  0 110 GLY   A N   1 ? 1 
ATOM   778  C CA  . GLY   A 1 110 ? 16.241 -46.298 5.966   1.000 109.877 0 110 GLY   A CA  1 ? 1 
ATOM   779  C C   . GLY   A 1 110 ? 15.115 -45.267 6.016   1.000 127.005 0 110 GLY   A C   1 ? 1 
ATOM   780  O O   . GLY   A 1 110 ? 15.387 -44.058 5.925   1.000 87.710  0 110 GLY   A O   1 ? 1 
ATOM   781  N N   . GLN   A 1 111 ? 13.874 -45.756 6.207   1.000 136.162 0 111 GLN   A N   1 ? 1 
ATOM   782  C CA  . GLN   A 1 111 ? 12.747 -44.877 6.492   1.000 124.690 0 111 GLN   A CA  1 ? 1 
ATOM   783  C C   . GLN   A 1 111 ? 12.862 -44.337 7.912   1.000 126.978 0 111 GLN   A C   1 ? 1 
ATOM   784  O O   . GLN   A 1 111 ? 12.169 -43.378 8.254   1.000 109.945 0 111 GLN   A O   1 ? 1 
ATOM   785  C CB  . GLN   A 1 111 ? 11.387 -45.553 6.370   1.000 123.738 0 111 GLN   A CB  1 ? 1 
ATOM   786  C CG  . GLN   A 1 111 ? 10.540 -45.033 5.208   1.000 131.057 0 111 GLN   A CG  1 ? 1 
ATOM   787  C CD  . GLN   A 1 111 ? 9.680  -46.125 4.633   1.000 135.498 0 111 GLN   A CD  1 ? 1 
ATOM   788  O OE1 . GLN   A 1 111 ? 9.134  -46.946 5.384   1.000 138.051 0 111 GLN   A OE1 1 ? 1 
ATOM   789  N NE2 . GLN   A 1 111 ? 9.632  -46.170 3.309   1.000 131.537 0 111 GLN   A NE2 1 ? 1 
ATOM   790  N N   . HIS   A 1 112 ? 13.762 -44.942 8.707   1.000 113.088 0 112 HIS   A N   1 ? 1 
ATOM   791  C CA  . HIS   A 1 112 ? 13.921 -44.532 10.080  1.000 101.387 0 112 HIS   A CA  1 ? 1 
ATOM   792  C C   . HIS   A 1 112 ? 15.091 -43.572 10.288  1.000 91.995  0 112 HIS   A C   1 ? 1 
ATOM   793  O O   . HIS   A 1 112 ? 14.955 -42.725 11.146  1.000 98.998  0 112 HIS   A O   1 ? 1 
ATOM   794  C CB  . HIS   A 1 112 ? 13.918 -45.741 11.024  1.000 106.553 0 112 HIS   A CB  1 ? 1 
ATOM   795  C CG  . HIS   A 1 112 ? 12.753 -46.702 10.911  1.000 110.405 0 112 HIS   A CG  1 ? 1 
ATOM   796  N ND1 . HIS   A 1 112 ? 11.478 -46.486 10.399  1.000 109.512 0 112 HIS   A ND1 1 ? 1 
ATOM   797  C CD2 . HIS   A 1 112 ? 12.765 -47.985 11.329  1.000 106.103 0 112 HIS   A CD2 1 ? 1 
ATOM   798  C CE1 . HIS   A 1 112 ? 10.750 -47.600 10.508  1.000 105.941 0 112 HIS   A CE1 1 ? 1 
ATOM   799  N NE2 . HIS   A 1 112 ? 11.512 -48.526 11.070  1.000 107.274 0 112 HIS   A NE2 1 ? 1 
ATOM   800  N N   . THR   A 1 113 ? 16.217 -43.664 9.550   1.000 90.302  0 113 THR   A N   1 ? 1 
ATOM   801  C CA  A THR   A 1 113 ? 17.420 -42.901 9.892   0.500 96.751  0 113 THR   A CA  1 ? 1 
ATOM   802  C CA  B THR   A 1 113 ? 17.427 -42.908 9.888   0.500 84.510  0 113 THR   A CA  1 ? 1 
ATOM   803  C C   . THR   A 1 113 ? 17.903 -42.061 8.701   1.000 86.142  0 113 THR   A C   1 ? 1 
ATOM   804  O O   . THR   A 1 113 ? 18.038 -42.553 7.581   1.000 93.356  0 113 THR   A O   1 ? 1 
ATOM   805  C CB  A THR   A 1 113 ? 18.525 -43.842 10.383  0.500 103.696 0 113 THR   A CB  1 ? 1 
ATOM   806  C CB  B THR   A 1 113 ? 18.531 -43.864 10.360  0.500 76.217  0 113 THR   A CB  1 ? 1 
ATOM   807  O OG1 A THR   A 1 113 ? 18.615 -44.858 9.413   0.500 122.221 0 113 THR   A OG1 1 ? 1 
ATOM   808  O OG1 B THR   A 1 113 ? 17.994 -44.689 11.400  0.500 73.526  0 113 THR   A OG1 1 ? 1 
ATOM   809  C CG2 A THR   A 1 113 ? 18.163 -44.710 11.569  0.500 101.434 0 113 THR   A CG2 1 ? 1 
ATOM   810  C CG2 B THR   A 1 113 ? 19.796 -43.141 10.790  0.500 64.866  0 113 THR   A CG2 1 ? 1 
ATOM   811  N N   . THR   A 1 114 ? 18.197 -40.778 8.957   1.000 72.605  0 114 THR   A N   1 ? 1 
ATOM   812  C CA  . THR   A 1 114 ? 18.872 -39.927 7.995   1.000 76.579  0 114 THR   A CA  1 ? 1 
ATOM   813  C C   . THR   A 1 114 ? 20.169 -39.349 8.586   1.000 75.717  0 114 THR   A C   1 ? 1 
ATOM   814  O O   . THR   A 1 114 ? 20.176 -38.986 9.742   1.000 77.179  0 114 THR   A O   1 ? 1 
ATOM   815  C CB  . THR   A 1 114 ? 17.924 -38.813 7.554   1.000 74.383  0 114 THR   A CB  1 ? 1 
ATOM   816  O OG1 . THR   A 1 114 ? 17.918 -37.791 8.542   1.000 79.915  0 114 THR   A OG1 1 ? 1 
ATOM   817  C CG2 . THR   A 1 114 ? 16.538 -39.309 7.188   1.000 68.833  0 114 THR   A CG2 1 ? 1 
ATOM   818  N N   . SER   A 1 115 ? 21.266 -39.233 7.808   1.000 75.274  0 115 SER   A N   1 ? 1 
ATOM   819  C CA  . SER   A 1 115 ? 22.478 -38.514 8.250   1.000 72.267  0 115 SER   A CA  1 ? 1 
ATOM   820  C C   . SER   A 1 115 ? 22.931 -37.412 7.297   1.000 68.872  0 115 SER   A C   1 ? 1 
ATOM   821  O O   . SER   A 1 115 ? 22.625 -37.348 6.129   1.000 69.225  0 115 SER   A O   1 ? 1 
ATOM   822  C CB  . SER   A 1 115 ? 23.665 -39.399 8.478   1.000 68.344  0 115 SER   A CB  1 ? 1 
ATOM   823  O OG  . SER   A 1 115 ? 23.341 -40.689 8.008   1.000 79.830  0 115 SER   A OG  1 ? 1 
ATOM   824  N N   . VAL   A 1 116 ? 23.732 -36.534 7.846   1.000 70.586  0 116 VAL   A N   1 ? 1 
ATOM   825  C CA  . VAL   A 1 116 ? 24.410 -35.507 7.097   1.000 70.363  0 116 VAL   A CA  1 ? 1 
ATOM   826  C C   . VAL   A 1 116 ? 25.868 -35.564 7.529   1.000 71.318  0 116 VAL   A C   1 ? 1 
ATOM   827  O O   . VAL   A 1 116 ? 26.165 -35.454 8.725   1.000 67.134  0 116 VAL   A O   1 ? 1 
ATOM   828  C CB  . VAL   A 1 116 ? 23.775 -34.149 7.433   1.000 69.172  0 116 VAL   A CB  1 ? 1 
ATOM   829  C CG1 . VAL   A 1 116 ? 24.595 -32.995 6.880   1.000 69.769  0 116 VAL   A CG1 1 ? 1 
ATOM   830  C CG2 . VAL   A 1 116 ? 22.337 -34.102 6.963   1.000 66.560  0 116 VAL   A CG2 1 ? 1 
ATOM   831  N N   . THR   A 1 117 ? 26.755 -35.765 6.556   1.000 63.572  0 117 THR   A N   1 ? 1 
ATOM   832  C CA  . THR   A 1 117 ? 28.165 -35.507 6.773   1.000 59.144  0 117 THR   A CA  1 ? 1 
ATOM   833  C C   . THR   A 1 117 ? 28.503 -34.128 6.201   1.000 60.361  0 117 THR   A C   1 ? 1 
ATOM   834  O O   . THR   A 1 117 ? 28.128 -33.779 5.081   1.000 63.731  0 117 THR   A O   1 ? 1 
ATOM   835  C CB  . THR   A 1 117 ? 28.937 -36.640 6.115   1.000 60.231  0 117 THR   A CB  1 ? 1 
ATOM   836  O OG1 . THR   A 1 117 ? 28.345 -37.797 6.699   1.000 61.902  0 117 THR   A OG1 1 ? 1 
ATOM   837  C CG2 . THR   A 1 117 ? 30.441 -36.512 6.267   1.000 57.697  0 117 THR   A CG2 1 ? 1 
ATOM   838  N N   . SER   A 1 118 ? 29.208 -33.312 6.982   1.000 57.744  0 118 SER   A N   1 ? 1 
ATOM   839  C CA  . SER   A 1 118 ? 29.469 -31.972 6.535   1.000 55.124  0 118 SER   A CA  1 ? 1 
ATOM   840  C C   . SER   A 1 118 ? 30.959 -31.783 6.639   1.000 62.450  0 118 SER   A C   1 ? 1 
ATOM   841  O O   . SER   A 1 118 ? 31.480 -31.951 7.703   1.000 60.252  0 118 SER   A O   1 ? 1 
ATOM   842  C CB  . SER   A 1 118 ? 28.708 -30.942 7.256   1.000 54.194  0 118 SER   A CB  1 ? 1 
ATOM   843  O OG  . SER   A 1 118 ? 29.399 -29.701 7.245   1.000 58.234  0 118 SER   A OG  1 ? 1 
ATOM   844  N N   . THR   A 1 119 ? 31.623 -31.527 5.502   1.000 69.103  0 119 THR   A N   1 ? 1 
ATOM   845  C CA  . THR   A 1 119 ? 33.064 -31.372 5.513   1.000 68.633  0 119 THR   A CA  1 ? 1 
ATOM   846  C C   . THR   A 1 119 ? 33.458 -30.227 4.587   1.000 68.023  0 119 THR   A C   1 ? 1 
ATOM   847  O O   . THR   A 1 119 ? 32.596 -29.504 4.070   1.000 63.367  0 119 THR   A O   1 ? 1 
ATOM   848  C CB  . THR   A 1 119 ? 33.754 -32.689 5.159   1.000 65.001  0 119 THR   A CB  1 ? 1 
ATOM   849  O OG1 . THR   A 1 119 ? 33.519 -32.989 3.790   1.000 59.371  0 119 THR   A OG1 1 ? 1 
ATOM   850  C CG2 . THR   A 1 119 ? 33.230 -33.819 6.020   1.000 71.051  0 119 THR   A CG2 1 ? 1 
ATOM   851  N N   . ASN   A 1 120 ? 34.783 -30.057 4.505   1.000 67.349  0 120 ASN   A N   1 ? 1 
ATOM   852  C CA  . ASN   A 1 120 ? 35.431 -29.028 3.718   1.000 75.690  0 120 ASN   A CA  1 ? 1 
ATOM   853  C C   . ASN   A 1 120 ? 36.113 -29.650 2.501   1.000 64.701  0 120 ASN   A C   1 ? 1 
ATOM   854  O O   . ASN   A 1 120 ? 36.962 -30.510 2.642   1.000 63.929  0 120 ASN   A O   1 ? 1 
ATOM   855  C CB  . ASN   A 1 120 ? 36.442 -28.248 4.535   1.000 69.109  0 120 ASN   A CB  1 ? 1 
ATOM   856  C CG  . ASN   A 1 120 ? 36.711 -26.967 3.817   1.000 79.179  0 120 ASN   A CG  1 ? 1 
ATOM   857  O OD1 . ASN   A 1 120 ? 35.814 -26.121 3.750   1.000 102.260 0 120 ASN   A OD1 1 ? 1 
ATOM   858  N ND2 . ASN   A 1 120 ? 37.870 -26.859 3.197   1.000 74.850  0 120 ASN   A ND2 1 ? 1 
ATOM   859  N N   . TYR   A 1 121 ? 35.682 -29.255 1.303   1.000 63.057  0 121 TYR   A N   1 ? 1 
ATOM   860  C CA  . TYR   A 1 121 ? 36.340 -29.652 0.049   1.000 62.326  0 121 TYR   A CA  1 ? 1 
ATOM   861  C C   . TYR   A 1 121 ? 37.222 -28.462 -0.352  1.000 55.699  0 121 TYR   A C   1 ? 1 
ATOM   862  O O   . TYR   A 1 121 ? 36.740 -27.343 -0.508  1.000 61.986  0 121 TYR   A O   1 ? 1 
ATOM   863  C CB  . TYR   A 1 121 ? 35.244 -30.114 -0.937  1.000 58.734  0 121 TYR   A CB  1 ? 1 
ATOM   864  C CG  . TYR   A 1 121 ? 35.696 -30.814 -2.211  1.000 63.688  0 121 TYR   A CG  1 ? 1 
ATOM   865  C CD1 . TYR   A 1 121 ? 36.002 -30.048 -3.310  1.000 58.067  0 121 TYR   A CD1 1 ? 1 
ATOM   866  C CD2 . TYR   A 1 121 ? 35.818 -32.208 -2.338  1.000 67.382  0 121 TYR   A CD2 1 ? 1 
ATOM   867  C CE1 . TYR   A 1 121 ? 36.424 -30.616 -4.494  1.000 64.931  0 121 TYR   A CE1 1 ? 1 
ATOM   868  C CE2 . TYR   A 1 121 ? 36.213 -32.791 -3.543  1.000 64.321  0 121 TYR   A CE2 1 ? 1 
ATOM   869  C CZ  . TYR   A 1 121 ? 36.526 -31.986 -4.622  1.000 62.276  0 121 TYR   A CZ  1 ? 1 
ATOM   870  O OH  . TYR   A 1 121 ? 36.992 -32.406 -5.851  1.000 74.550  0 121 TYR   A OH  1 ? 1 
ATOM   871  N N   . SER   A 1 122 ? 38.534 -28.654 -0.364  1.000 52.151  0 122 SER   A N   1 ? 1 
ATOM   872  C CA  . SER   A 1 122 ? 39.444 -27.636 -0.856  1.000 59.582  0 122 SER   A CA  1 ? 1 
ATOM   873  C C   . SER   A 1 122 ? 39.444 -27.569 -2.382  1.000 58.825  0 122 SER   A C   1 ? 1 
ATOM   874  O O   . SER   A 1 122 ? 39.477 -28.564 -3.100  1.000 54.500  0 122 SER   A O   1 ? 1 
ATOM   875  C CB  . SER   A 1 122 ? 40.825 -27.947 -0.427  1.000 66.776  0 122 SER   A CB  1 ? 1 
ATOM   876  O OG  . SER   A 1 122 ? 40.859 -28.084 0.973   1.000 60.594  0 122 SER   A OG  1 ? 1 
ATOM   877  N N   . ILE   A 1 123 ? 39.524 -26.358 -2.886  1.000 58.759  0 123 ILE   A N   1 ? 1 
ATOM   878  C CA  . ILE   A 1 123 ? 39.686 -26.182 -4.314  1.000 47.353  0 123 ILE   A CA  1 ? 1 
ATOM   879  C C   . ILE   A 1 123 ? 41.064 -25.586 -4.530  1.000 44.795  0 123 ILE   A C   1 ? 1 
ATOM   880  O O   . ILE   A 1 123 ? 41.409 -24.608 -3.893  1.000 48.242  0 123 ILE   A O   1 ? 1 
ATOM   881  C CB  . ILE   A 1 123 ? 38.551 -25.294 -4.808  1.000 43.682  0 123 ILE   A CB  1 ? 1 
ATOM   882  C CG1 . ILE   A 1 123 ? 37.206 -26.002 -4.612  1.000 43.591  0 123 ILE   A CG1 1 ? 1 
ATOM   883  C CG2 . ILE   A 1 123 ? 38.843 -24.846 -6.231  1.000 46.310  0 123 ILE   A CG2 1 ? 1 
ATOM   884  C CD1 . ILE   A 1 123 ? 36.963 -27.218 -5.509  1.000 46.852  0 123 ILE   A CD1 1 ? 1 
ATOM   885  N N   . TYR   A 1 124 ? 41.890 -26.224 -5.355  1.000 49.898  0 124 TYR   A N   1 ? 1 
ATOM   886  C CA  . TYR   A 1 124 ? 43.228 -25.710 -5.675  1.000 51.499  0 124 TYR   A CA  1 ? 1 
ATOM   887  C C   . TYR   A 1 124 ? 43.300 -25.164 -7.120  1.000 47.298  0 124 TYR   A C   1 ? 1 
ATOM   888  O O   . TYR   A 1 124 ? 44.286 -24.539 -7.515  1.000 49.608  0 124 TYR   A O   1 ? 1 
ATOM   889  C CB  . TYR   A 1 124 ? 44.218 -26.826 -5.295  1.000 62.747  0 124 TYR   A CB  1 ? 1 
ATOM   890  C CG  . TYR   A 1 124 ? 44.028 -27.550 -3.949  1.000 73.864  0 124 TYR   A CG  1 ? 1 
ATOM   891  C CD1 . TYR   A 1 124 ? 44.581 -27.059 -2.763  1.000 79.333  0 124 TYR   A CD1 1 ? 1 
ATOM   892  C CD2 . TYR   A 1 124 ? 43.318 -28.758 -3.878  1.000 97.062  0 124 TYR   A CD2 1 ? 1 
ATOM   893  C CE1 . TYR   A 1 124 ? 44.440 -27.742 -1.562  1.000 83.523  0 124 TYR   A CE1 1 ? 1 
ATOM   894  C CE2 . TYR   A 1 124 ? 43.165 -29.447 -2.685  1.000 100.463 0 124 TYR   A CE2 1 ? 1 
ATOM   895  C CZ  . TYR   A 1 124 ? 43.719 -28.928 -1.522  1.000 103.478 0 124 TYR   A CZ  1 ? 1 
ATOM   896  O OH  . TYR   A 1 124 ? 43.517 -29.631 -0.361  1.000 113.462 0 124 TYR   A OH  1 ? 1 
ATOM   897  N N   . LYS   A 1 125 ? 42.219 -25.239 -7.914  1.000 43.105  0 125 LYS   A N   1 ? 1 
ATOM   898  C CA  . LYS   A 1 125 ? 42.314 -24.731 -9.270  1.000 38.448  0 125 LYS   A CA  1 ? 1 
ATOM   899  C C   . LYS   A 1 125 ? 41.453 -23.485 -9.449  1.000 36.569  0 125 LYS   A C   1 ? 1 
ATOM   900  O O   . LYS   A 1 125 ? 40.251 -23.472 -9.137  1.000 31.757  0 125 LYS   A O   1 ? 1 
ATOM   901  C CB  . LYS   A 1 125 ? 42.036 -25.945 -10.175 1.000 39.254  0 125 LYS   A CB  1 ? 1 
ATOM   902  C CG  . LYS   A 1 125 ? 43.338 -26.733 -10.501 1.000 38.864  0 125 LYS   A CG  1 ? 1 
ATOM   903  C CD  . LYS   A 1 125 ? 43.230 -27.938 -11.421 1.000 39.771  0 125 LYS   A CD  1 ? 1 
ATOM   904  C CE  . LYS   A 1 125 ? 42.640 -27.618 -12.831 1.000 37.234  0 125 LYS   A CE  1 ? 1 
ATOM   905  N NZ  . LYS   A 1 125 ? 43.165 -26.387 -13.394 1.000 34.457  0 125 LYS   A NZ  1 ? 1 
ATOM   906  N N   . GLU   A 1 126 ? 42.060 -22.457 -10.050 1.000 38.397  0 126 GLU   A N   1 ? 1 
ATOM   907  C CA  . GLU   A 1 126 ? 41.316 -21.288 -10.545 1.000 41.974  0 126 GLU   A CA  1 ? 1 
ATOM   908  C C   . GLU   A 1 126 ? 40.214 -21.717 -11.525 1.000 38.839  0 126 GLU   A C   1 ? 1 
ATOM   909  O O   . GLU   A 1 126 ? 39.078 -21.231 -11.504 1.000 39.625  0 126 GLU   A O   1 ? 1 
ATOM   910  C CB  . GLU   A 1 126 ? 42.243 -20.223 -11.162 1.000 43.407  0 126 GLU   A CB  1 ? 1 
ATOM   911  C CG  . GLU   A 1 126 ? 43.289 -19.713 -10.153 1.000 50.888  0 126 GLU   A CG  1 ? 1 
ATOM   912  C CD  . GLU   A 1 126 ? 44.515 -18.967 -10.706 1.000 52.519  0 126 GLU   A CD  1 ? 1 
ATOM   913  O OE1 . GLU   A 1 126 ? 44.626 -18.792 -11.941 1.000 58.887  0 126 GLU   A OE1 1 ? 1 
ATOM   914  O OE2 . GLU   A 1 126 ? 45.428 -18.597 -9.959  1.000 55.774  0 126 GLU   A OE2 1 ? 1 
ATOM   915  N N   . GLU   A 1 127 ? 40.534 -22.692 -12.367 1.000 38.591  0 127 GLU   A N   1 ? 1 
ATOM   916  C CA  . GLU   A 1 127 ? 39.584 -23.132 -13.371 1.000 38.585  0 127 GLU   A CA  1 ? 1 
ATOM   917  C C   . GLU   A 1 127 ? 39.454 -24.632 -13.234 1.000 34.775  0 127 GLU   A C   1 ? 1 
ATOM   918  O O   . GLU   A 1 127 ? 40.473 -25.334 -13.342 1.000 31.969  0 127 GLU   A O   1 ? 1 
ATOM   919  C CB  . GLU   A 1 127 ? 40.067 -22.735 -14.765 1.000 37.346  0 127 GLU   A CB  1 ? 1 
ATOM   920  C CG  . GLU   A 1 127 ? 39.111 -23.168 -15.895 1.000 45.009  0 127 GLU   A CG  1 ? 1 
ATOM   921  C CD  . GLU   A 1 127 ? 39.392 -22.481 -17.257 1.000 47.629  0 127 GLU   A CD  1 ? 1 
ATOM   922  O OE1 . GLU   A 1 127 ? 39.239 -21.253 -17.315 1.000 47.644  0 127 GLU   A OE1 1 ? 1 
ATOM   923  O OE2 . GLU   A 1 127 ? 39.900 -23.084 -18.222 1.000 50.827  0 127 GLU   A OE2 1 ? 1 
ATOM   924  N N   . ILE   A 1 128 ? 38.224 -25.112 -13.006 1.000 31.995  0 128 ILE   A N   1 ? 1 
ATOM   925  C CA  . ILE   A 1 128 ? 38.141 -26.538 -12.876 1.000 32.555  0 128 ILE   A CA  1 ? 1 
ATOM   926  C C   . ILE   A 1 128 ? 37.076 -27.105 -13.806 1.000 30.696  0 128 ILE   A C   1 ? 1 
ATOM   927  O O   . ILE   A 1 128 ? 35.986 -26.562 -13.987 1.000 28.921  0 128 ILE   A O   1 ? 1 
ATOM   928  C CB  . ILE   A 1 128 ? 37.970 -26.875 -11.381 1.000 37.582  0 128 ILE   A CB  1 ? 1 
ATOM   929  C CG1 . ILE   A 1 128 ? 37.943 -28.318 -11.150 1.000 42.802  0 128 ILE   A CG1 1 ? 1 
ATOM   930  C CG2 . ILE   A 1 128 ? 36.703 -26.267 -10.845 1.000 42.233  0 128 ILE   A CG2 1 ? 1 
ATOM   931  C CD1 . ILE   A 1 128 ? 38.049 -28.676 -9.680  1.000 50.212  0 128 ILE   A CD1 1 ? 1 
ATOM   932  N N   . SER   A 1 129 ? 37.377 -28.277 -14.346 1.000 30.302  0 129 SER   A N   1 ? 1 
ATOM   933  C CA  . SER   A 1 129 ? 36.399 -28.969 -15.167 1.000 33.282  0 129 SER   A CA  1 ? 1 
ATOM   934  C C   . SER   A 1 129 ? 35.338 -29.676 -14.358 1.000 33.992  0 129 SER   A C   1 ? 1 
ATOM   935  O O   . SER   A 1 129 ? 35.647 -30.240 -13.318 1.000 39.630  0 129 SER   A O   1 ? 1 
ATOM   936  C CB  . SER   A 1 129 ? 37.042 -29.974 -16.135 1.000 32.011  0 129 SER   A CB  1 ? 1 
ATOM   937  O OG  . SER   A 1 129 ? 37.481 -31.171 -15.523 1.000 31.314  0 129 SER   A OG  1 ? 1 
ATOM   938  N N   . LEU   A 1 130 ? 34.161 -29.833 -14.969 1.000 35.452  0 130 LEU   A N   1 ? 1 
ATOM   939  C CA  . LEU   A 1 130 ? 33.139 -30.725 -14.451 1.000 40.160  0 130 LEU   A CA  1 ? 1 
ATOM   940  C C   . LEU   A 1 130 ? 33.638 -32.165 -14.450 1.000 38.326  0 130 LEU   A C   1 ? 1 
ATOM   941  O O   . LEU   A 1 130 ? 33.240 -33.001 -13.643 1.000 38.207  0 130 LEU   A O   1 ? 1 
ATOM   942  C CB  . LEU   A 1 130 ? 31.844 -30.597 -15.245 1.000 42.205  0 130 LEU   A CB  1 ? 1 
ATOM   943  C CG  . LEU   A 1 130 ? 31.171 -29.210 -15.218 1.000 44.924  0 130 LEU   A CG  1 ? 1 
ATOM   944  C CD1 . LEU   A 1 130 ? 29.811 -29.315 -15.918 1.000 48.187  0 130 LEU   A CD1 1 ? 1 
ATOM   945  C CD2 . LEU   A 1 130 ? 30.967 -28.577 -13.880 1.000 43.035  0 130 LEU   A CD2 1 ? 1 
ATOM   946  N N   . LYS   A 1 131 ? 34.524 -32.494 -15.367 1.000 34.958  0 131 LYS   A N   1 ? 1 
ATOM   947  C CA  . LYS   A 1 131 ? 35.016 -33.855 -15.345 1.000 34.040  0 131 LYS   A CA  1 ? 1 
ATOM   948  C C   . LYS   A 1 131 ? 35.648 -34.148 -13.967 1.000 34.821  0 131 LYS   A C   1 ? 1 
ATOM   949  O O   . LYS   A 1 131 ? 35.396 -35.196 -13.405 1.000 33.451  0 131 LYS   A O   1 ? 1 
ATOM   950  C CB  . LYS   A 1 131 ? 35.998 -34.033 -16.506 1.000 31.032  0 131 LYS   A CB  1 ? 1 
ATOM   951  C CG  . LYS   A 1 131 ? 36.453 -35.483 -16.665 1.000 32.411  0 131 LYS   A CG  1 ? 1 
ATOM   952  C CD  . LYS   A 1 131 ? 37.741 -35.503 -17.477 1.000 34.607  0 131 LYS   A CD  1 ? 1 
ATOM   953  C CE  . LYS   A 1 131 ? 38.174 -36.879 -17.899 1.000 36.776  0 131 LYS   A CE  1 ? 1 
ATOM   954  N NZ  . LYS   A 1 131 ? 37.105 -37.640 -18.604 1.000 39.039  0 131 LYS   A NZ  1 ? 1 
ATOM   955  N N   . GLU   A 1 132 ? 36.493 -33.221 -13.494 1.000 32.401  0 132 GLU   A N   1 ? 1 
ATOM   956  C CA  . GLU   A 1 132 ? 37.271 -33.362 -12.286 1.000 36.649  0 132 GLU   A CA  1 ? 1 
ATOM   957  C C   . GLU   A 1 132 ? 36.366 -33.386 -11.071 1.000 35.400  0 132 GLU   A C   1 ? 1 
ATOM   958  O O   . GLU   A 1 132 ? 36.382 -34.357 -10.337 1.000 37.203  0 132 GLU   A O   1 ? 1 
ATOM   959  C CB  . GLU   A 1 132 ? 38.266 -32.202 -12.175 1.000 38.571  0 132 GLU   A CB  1 ? 1 
ATOM   960  C CG  . GLU   A 1 132 ? 39.057 -32.236 -10.884 1.000 36.983  0 132 GLU   A CG  1 ? 1 
ATOM   961  C CD  . GLU   A 1 132 ? 40.319 -31.393 -10.866 1.000 42.106  0 132 GLU   A CD  1 ? 1 
ATOM   962  O OE1 . GLU   A 1 132 ? 40.865 -30.833 -11.882 1.000 43.608  0 132 GLU   A OE1 1 ? 1 
ATOM   963  O OE2 . GLU   A 1 132 ? 40.841 -31.439 -9.689  1.000 50.800  0 132 GLU   A OE2 1 ? 1 
ATOM   964  N N   . LEU   A 1 133 ? 35.422 -32.447 -10.987 1.000 36.727  0 133 LEU   A N   1 ? 1 
ATOM   965  C CA  . LEU   A 1 133 ? 34.517 -32.450 -9.847  1.000 40.989  0 133 LEU   A CA  1 ? 1 
ATOM   966  C C   . LEU   A 1 133 ? 33.725 -33.763 -9.805  1.000 42.183  0 133 LEU   A C   1 ? 1 
ATOM   967  O O   . LEU   A 1 133 ? 33.679 -34.504 -8.800  1.000 42.702  0 133 LEU   A O   1 ? 1 
ATOM   968  C CB  . LEU   A 1 133 ? 33.659 -31.193 -9.918  1.000 44.074  0 133 LEU   A CB  1 ? 1 
ATOM   969  C CG  . LEU   A 1 133 ? 34.393 -29.868 -9.645  1.000 47.986  0 133 LEU   A CG  1 ? 1 
ATOM   970  C CD1 . LEU   A 1 133 ? 33.592 -28.669 -10.045 1.000 49.916  0 133 LEU   A CD1 1 ? 1 
ATOM   971  C CD2 . LEU   A 1 133 ? 34.621 -29.742 -8.179  1.000 53.612  0 133 LEU   A CD2 1 ? 1 
ATOM   972  N N   . ASP   A 1 134 ? 33.157 -34.104 -10.960 1.000 36.948  0 134 ASP   A N   1 ? 1 
ATOM   973  C CA  . ASP   A 1 134 ? 32.296 -35.250 -11.009 1.000 36.141  0 134 ASP   A CA  1 ? 1 
ATOM   974  C C   . ASP   A 1 134 ? 33.090 -36.483 -10.592 1.000 34.591  0 134 ASP   A C   1 ? 1 
ATOM   975  O O   . ASP   A 1 134 ? 32.661 -37.299 -9.789  1.000 31.983  0 134 ASP   A O   1 ? 1 
ATOM   976  C CB  . ASP   A 1 134 ? 31.747 -35.406 -12.401 1.000 40.006  0 134 ASP   A CB  1 ? 1 
ATOM   977  C CG  . ASP   A 1 134 ? 31.013 -36.718 -12.605 1.000 40.319  0 134 ASP   A CG  1 ? 1 
ATOM   978  O OD1 . ASP   A 1 134 ? 29.938 -36.815 -11.983 1.000 45.408  0 134 ASP   A OD1 1 ? 1 
ATOM   979  O OD2 . ASP   A 1 134 ? 31.560 -37.622 -13.326 1.000 36.546  0 134 ASP   A OD2 1 ? 1 
ATOM   980  N N   . PHE   A 1 135 ? 34.263 -36.649 -11.171 1.000 32.685  0 135 PHE   A N   1 ? 1 
ATOM   981  C CA  . PHE   A 1 135 ? 34.973 -37.900 -10.938 1.000 35.968  0 135 PHE   A CA  1 ? 1 
ATOM   982  C C   . PHE   A 1 135 ? 35.483 -38.032 -9.484  1.000 41.022  0 135 PHE   A C   1 ? 1 
ATOM   983  O O   . PHE   A 1 135 ? 35.506 -39.134 -8.933  1.000 38.331  0 135 PHE   A O   1 ? 1 
ATOM   984  C CB  . PHE   A 1 135 ? 36.171 -37.918 -11.892 1.000 34.619  0 135 PHE   A CB  1 ? 1 
ATOM   985  C CG  . PHE   A 1 135 ? 36.693 -39.322 -12.064 1.000 35.931  0 135 PHE   A CG  1 ? 1 
ATOM   986  C CD1 . PHE   A 1 135 ? 36.123 -40.205 -12.961 1.000 36.471  0 135 PHE   A CD1 1 ? 1 
ATOM   987  C CD2 . PHE   A 1 135 ? 37.735 -39.780 -11.307 1.000 37.255  0 135 PHE   A CD2 1 ? 1 
ATOM   988  C CE1 . PHE   A 1 135 ? 36.570 -41.504 -13.064 1.000 38.017  0 135 PHE   A CE1 1 ? 1 
ATOM   989  C CE2 . PHE   A 1 135 ? 38.208 -41.075 -11.470 1.000 38.860  0 135 PHE   A CE2 1 ? 1 
ATOM   990  C CZ  . PHE   A 1 135 ? 37.657 -41.921 -12.372 1.000 37.536  0 135 PHE   A CZ  1 ? 1 
ATOM   991  N N   . LYS   A 1 136 ? 36.006 -36.915 -8.937  1.000 38.464  0 136 LYS   A N   1 ? 1 
ATOM   992  C CA  . LYS   A 1 136 ? 36.639 -36.922 -7.631  1.000 37.905  0 136 LYS   A CA  1 ? 1 
ATOM   993  C C   . LYS   A 1 136 ? 35.613 -37.087 -6.525  1.000 40.254  0 136 LYS   A C   1 ? 1 
ATOM   994  O O   . LYS   A 1 136 ? 35.817 -37.926 -5.660  1.000 40.722  0 136 LYS   A O   1 ? 1 
ATOM   995  C CB  . LYS   A 1 136 ? 37.455 -35.662 -7.423  1.000 35.281  0 136 LYS   A CB  1 ? 1 
ATOM   996  C CG  . LYS   A 1 136 ? 38.792 -35.957 -8.095  1.000 37.815  0 136 LYS   A CG  1 ? 1 
ATOM   997  C CD  . LYS   A 1 136 ? 39.684 -34.750 -7.999  1.000 44.549  0 136 LYS   A CD  1 ? 1 
ATOM   998  C CE  . LYS   A 1 136 ? 40.432 -34.935 -6.736  1.000 48.207  0 136 LYS   A CE  1 ? 1 
ATOM   999  N NZ  . LYS   A 1 136 ? 41.360 -33.807 -6.749  1.000 50.961  0 136 LYS   A NZ  1 ? 1 
ATOM   1000 N N   . LEU   A 1 137 ? 34.502 -36.347 -6.626  1.000 39.835  0 137 LEU   A N   1 ? 1 
ATOM   1001 C CA  . LEU   A 1 137 ? 33.386 -36.484 -5.724  1.000 38.679  0 137 LEU   A CA  1 ? 1 
ATOM   1002 C C   . LEU   A 1 137 ? 32.844 -37.880 -5.785  1.000 40.397  0 137 LEU   A C   1 ? 1 
ATOM   1003 O O   . LEU   A 1 137 ? 32.592 -38.474 -4.749  1.000 40.815  0 137 LEU   A O   1 ? 1 
ATOM   1004 C CB  . LEU   A 1 137 ? 32.300 -35.479 -6.008  1.000 40.069  0 137 LEU   A CB  1 ? 1 
ATOM   1005 C CG  . LEU   A 1 137 ? 32.712 -34.042 -5.705  1.000 43.913  0 137 LEU   A CG  1 ? 1 
ATOM   1006 C CD1 . LEU   A 1 137 ? 31.770 -33.050 -6.362  1.000 45.456  0 137 LEU   A CD1 1 ? 1 
ATOM   1007 C CD2 . LEU   A 1 137 ? 32.678 -33.940 -4.200  1.000 46.756  0 137 LEU   A CD2 1 ? 1 
ATOM   1008 N N   . ARG   A 1 138 ? 32.757 -38.460 -6.965  1.000 43.815  0 138 ARG   A N   1 ? 1 
ATOM   1009 C CA  . ARG   A 1 138 ? 32.225 -39.809 -6.955  1.000 43.016  0 138 ARG   A CA  1 ? 1 
ATOM   1010 C C   . ARG   A 1 138 ? 33.214 -40.773 -6.317  1.000 41.307  0 138 ARG   A C   1 ? 1 
ATOM   1011 O O   . ARG   A 1 138 ? 32.837 -41.779 -5.750  1.000 40.571  0 138 ARG   A O   1 ? 1 
ATOM   1012 C CB  . ARG   A 1 138 ? 31.837 -40.305 -8.327  1.000 43.674  0 138 ARG   A CB  1 ? 1 
ATOM   1013 C CG  . ARG   A 1 138 ? 30.549 -39.633 -8.750  1.000 50.132  0 138 ARG   A CG  1 ? 1 
ATOM   1014 C CD  . ARG   A 1 138 ? 30.095 -40.223 -10.108 1.000 53.498  0 138 ARG   A CD  1 ? 1 
ATOM   1015 N NE  . ARG   A 1 138 ? 29.368 -39.264 -10.954 1.000 55.969  0 138 ARG   A NE  1 ? 1 
ATOM   1016 C CZ  . ARG   A 1 138 ? 28.442 -39.541 -11.879 1.000 55.968  0 138 ARG   A CZ  1 ? 1 
ATOM   1017 N NH1 . ARG   A 1 138 ? 27.958 -40.758 -12.002 1.000 51.412  0 138 ARG   A NH1 1 ? 1 
ATOM   1018 N NH2 . ARG   A 1 138 ? 27.956 -38.570 -12.637 1.000 56.754  0 138 ARG   A NH2 1 ? 1 
ATOM   1019 N N   . LYS   A 1 139 ? 34.501 -40.517 -6.435  1.000 41.795  0 139 LYS   A N   1 ? 1 
ATOM   1020 C CA  . LYS   A 1 139 ? 35.421 -41.455 -5.832  1.000 45.375  0 139 LYS   A CA  1 ? 1 
ATOM   1021 C C   . LYS   A 1 139 ? 35.302 -41.349 -4.306  1.000 48.862  0 139 LYS   A C   1 ? 1 
ATOM   1022 O O   . LYS   A 1 139 ? 35.259 -42.329 -3.557  1.000 45.555  0 139 LYS   A O   1 ? 1 
ATOM   1023 C CB  . LYS   A 1 139 ? 36.773 -41.078 -6.411  1.000 49.084  0 139 LYS   A CB  1 ? 1 
ATOM   1024 C CG  . LYS   A 1 139 ? 37.881 -41.995 -6.027  1.000 56.317  0 139 LYS   A CG  1 ? 1 
ATOM   1025 C CD  . LYS   A 1 139 ? 37.501 -43.474 -5.967  1.000 63.831  0 139 LYS   A CD  1 ? 1 
ATOM   1026 C CE  . LYS   A 1 139 ? 38.798 -44.224 -5.718  1.000 63.288  0 139 LYS   A CE  1 ? 1 
ATOM   1027 N NZ  . LYS   A 1 139 ? 38.526 -45.621 -5.442  1.000 67.187  0 139 LYS   A NZ  1 ? 1 
ATOM   1028 N N   . HIS   A 1 140 ? 35.196 -40.111 -3.868  1.000 45.910  0 140 HIS   A N   1 ? 1 
ATOM   1029 C CA  . HIS   A 1 140 ? 34.983 -39.832 -2.488  1.000 53.347  0 140 HIS   A CA  1 ? 1 
ATOM   1030 C C   . HIS   A 1 140 ? 33.769 -40.610 -1.983  1.000 51.710  0 140 HIS   A C   1 ? 1 
ATOM   1031 O O   . HIS   A 1 140 ? 33.832 -41.221 -0.932  1.000 51.497  0 140 HIS   A O   1 ? 1 
ATOM   1032 C CB  . HIS   A 1 140 ? 34.838 -38.321 -2.333  1.000 58.991  0 140 HIS   A CB  1 ? 1 
ATOM   1033 C CG  . HIS   A 1 140 ? 34.470 -38.028 -0.919  1.000 67.696  0 140 HIS   A CG  1 ? 1 
ATOM   1034 N ND1 . HIS   A 1 140 ? 35.282 -38.511 0.077   1.000 64.979  0 140 HIS   A ND1 1 ? 1 
ATOM   1035 C CD2 . HIS   A 1 140 ? 33.460 -37.359 -0.332  1.000 63.301  0 140 HIS   A CD2 1 ? 1 
ATOM   1036 C CE1 . HIS   A 1 140 ? 34.762 -38.130 1.219   1.000 66.404  0 140 HIS   A CE1 1 ? 1 
ATOM   1037 N NE2 . HIS   A 1 140 ? 33.678 -37.422 0.990   1.000 64.556  0 140 HIS   A NE2 1 ? 1 
ATOM   1038 N N   . LEU   A 1 141 ? 32.685 -40.576 -2.745  1.000 47.573  0 141 LEU   A N   1 ? 1 
ATOM   1039 C CA  . LEU   A 1 141 ? 31.410 -41.084 -2.297  1.000 53.128  0 141 LEU   A CA  1 ? 1 
ATOM   1040 C C   . LEU   A 1 141 ? 31.468 -42.607 -2.276  1.000 58.851  0 141 LEU   A C   1 ? 1 
ATOM   1041 O O   . LEU   A 1 141 ? 30.754 -43.262 -1.495  1.000 53.036  0 141 LEU   A O   1 ? 1 
ATOM   1042 C CB  . LEU   A 1 141 ? 30.273 -40.591 -3.200  1.000 58.083  0 141 LEU   A CB  1 ? 1 
ATOM   1043 C CG  . LEU   A 1 141 ? 29.952 -39.093 -3.124  1.000 53.769  0 141 LEU   A CG  1 ? 1 
ATOM   1044 C CD1 . LEU   A 1 141 ? 29.002 -38.627 -4.204  1.000 50.991  0 141 LEU   A CD1 1 ? 1 
ATOM   1045 C CD2 . LEU   A 1 141 ? 29.406 -38.713 -1.797  1.000 50.443  0 141 LEU   A CD2 1 ? 1 
ATOM   1046 N N   . ILE   A 1 142 ? 32.301 -43.164 -3.155  1.000 55.613  0 142 ILE   A N   1 ? 1 
ATOM   1047 C CA  . ILE   A 1 142 ? 32.481 -44.607 -3.189  1.000 59.728  0 142 ILE   A CA  1 ? 1 
ATOM   1048 C C   . ILE   A 1 142 ? 33.247 -45.038 -1.948  1.000 60.777  0 142 ILE   A C   1 ? 1 
ATOM   1049 O O   . ILE   A 1 142 ? 33.014 -46.114 -1.438  1.000 64.971  0 142 ILE   A O   1 ? 1 
ATOM   1050 C CB  . ILE   A 1 142 ? 33.237 -45.026 -4.465  1.000 60.937  0 142 ILE   A CB  1 ? 1 
ATOM   1051 C CG1 . ILE   A 1 142 ? 32.340 -44.889 -5.729  1.000 65.375  0 142 ILE   A CG1 1 ? 1 
ATOM   1052 C CG2 . ILE   A 1 142 ? 33.799 -46.436 -4.350  1.000 56.583  0 142 ILE   A CG2 1 ? 1 
ATOM   1053 C CD1 . ILE   A 1 142 ? 33.064 -45.033 -7.060  1.000 58.684  0 142 ILE   A CD1 1 ? 1 
ATOM   1054 N N   . ASP   A 1 143 ? 34.230 -44.219 -1.565  1.000 61.981  0 143 ASP   A N   1 ? 1 
ATOM   1055 C CA  . ASP   A 1 143 ? 35.259 -44.603 -0.612  1.000 63.260  0 143 ASP   A CA  1 ? 1 
ATOM   1056 C C   . ASP   A 1 143 ? 34.643 -44.479 0.781   1.000 67.382  0 143 ASP   A C   1 ? 1 
ATOM   1057 O O   . ASP   A 1 143 ? 34.822 -45.322 1.631   1.000 63.251  0 143 ASP   A O   1 ? 1 
ATOM   1058 C CB  . ASP   A 1 143 ? 36.551 -43.803 -0.808  1.000 59.210  0 143 ASP   A CB  1 ? 1 
ATOM   1059 C CG  . ASP   A 1 143 ? 37.457 -44.300 -1.941  1.000 74.583  0 143 ASP   A CG  1 ? 1 
ATOM   1060 O OD1 . ASP   A 1 143 ? 37.208 -45.453 -2.392  1.000 80.555  0 143 ASP   A OD1 1 ? 1 
ATOM   1061 O OD2 . ASP   A 1 143 ? 38.413 -43.558 -2.387  1.000 69.444  0 143 ASP   A OD2 1 ? 1 
ATOM   1062 N N   . LYS   A 1 144 ? 33.846 -43.440 0.983   1.000 64.452  0 144 LYS   A N   1 ? 1 
ATOM   1063 C CA  . LYS   A 1 144 ? 33.436 -43.048 2.304   1.000 54.552  0 144 LYS   A CA  1 ? 1 
ATOM   1064 C C   . LYS   A 1 144 ? 31.938 -43.180 2.483   1.000 56.722  0 144 LYS   A C   1 ? 1 
ATOM   1065 O O   . LYS   A 1 144 ? 31.468 -42.924 3.574   1.000 57.671  0 144 LYS   A O   1 ? 1 
ATOM   1066 C CB  . LYS   A 1 144 ? 33.823 -41.593 2.577   1.000 52.618  0 144 LYS   A CB  1 ? 1 
ATOM   1067 C CG  . LYS   A 1 144 ? 35.337 -41.384 2.622   1.000 66.089  0 144 LYS   A CG  1 ? 1 
ATOM   1068 C CD  . LYS   A 1 144 ? 36.160 -42.654 2.904   1.000 86.742  0 144 LYS   A CD  1 ? 1 
ATOM   1069 C CE  . LYS   A 1 144 ? 37.443 -42.492 3.695   1.000 95.018  0 144 LYS   A CE  1 ? 1 
ATOM   1070 N NZ  . LYS   A 1 144 ? 38.333 -41.643 2.898   1.000 102.515 0 144 LYS   A NZ  1 ? 1 
ATOM   1071 N N   . HIS   A 1 145 ? 31.162 -43.466 1.438   1.000 53.216  0 145 HIS   A N   1 ? 1 
ATOM   1072 C CA  . HIS   A 1 145 ? 29.720 -43.493 1.628   1.000 47.170  0 145 HIS   A CA  1 ? 1 
ATOM   1073 C C   . HIS   A 1 145 ? 29.099 -44.604 0.792   1.000 49.755  0 145 HIS   A C   1 ? 1 
ATOM   1074 O O   . HIS   A 1 145 ? 27.891 -44.564 0.454   1.000 51.688  0 145 HIS   A O   1 ? 1 
ATOM   1075 C CB  . HIS   A 1 145 ? 29.011 -42.142 1.452   1.000 48.669  0 145 HIS   A CB  1 ? 1 
ATOM   1076 C CG  . HIS   A 1 145 ? 29.568 -40.967 2.178   1.000 55.613  0 145 HIS   A CG  1 ? 1 
ATOM   1077 N ND1 . HIS   A 1 145 ? 28.897 -40.294 3.159   1.000 55.321  0 145 HIS   A ND1 1 ? 1 
ATOM   1078 C CD2 . HIS   A 1 145 ? 30.688 -40.252 1.976   1.000 66.803  0 145 HIS   A CD2 1 ? 1 
ATOM   1079 C CE1 . HIS   A 1 145 ? 29.628 -39.257 3.573   1.000 62.150  0 145 HIS   A CE1 1 ? 1 
ATOM   1080 N NE2 . HIS   A 1 145 ? 30.733 -39.202 2.861   1.000 61.120  0 145 HIS   A NE2 1 ? 1 
ATOM   1081 N N   . ASP   A 1 146 ? 29.890 -45.643 0.510   1.000 51.009  0 146 ASP   A N   1 ? 1 
ATOM   1082 C CA  . ASP   A 1 146 ? 29.258 -46.845 -0.027  1.000 63.512  0 146 ASP   A CA  1 ? 1 
ATOM   1083 C C   . ASP   A 1 146 ? 28.554 -46.672 -1.378  1.000 58.277  0 146 ASP   A C   1 ? 1 
ATOM   1084 O O   . ASP   A 1 146 ? 27.680 -47.451 -1.704  1.000 65.150  0 146 ASP   A O   1 ? 1 
ATOM   1085 C CB  . ASP   A 1 146 ? 28.238 -47.356 0.991   1.000 69.666  0 146 ASP   A CB  1 ? 1 
ATOM   1086 C CG  . ASP   A 1 146 ? 28.875 -47.809 2.297   1.000 73.512  0 146 ASP   A CG  1 ? 1 
ATOM   1087 O OD1 . ASP   A 1 146 ? 29.593 -48.830 2.234   1.000 69.452  0 146 ASP   A OD1 1 ? 1 
ATOM   1088 O OD2 . ASP   A 1 146 ? 28.743 -47.078 3.329   1.000 82.405  0 146 ASP   A OD2 1 ? 1 
ATOM   1089 N N   . LEU   A 1 147 ? 28.918 -45.678 -2.188  1.000 65.718  0 147 LEU   A N   1 ? 1 
ATOM   1090 C CA  . LEU   A 1 147 ? 28.198 -45.379 -3.423  1.000 56.441  0 147 LEU   A CA  1 ? 1 
ATOM   1091 C C   . LEU   A 1 147 ? 28.367 -46.553 -4.366  1.000 54.295  0 147 LEU   A C   1 ? 1 
ATOM   1092 O O   . LEU   A 1 147 ? 29.477 -47.025 -4.505  1.000 47.587  0 147 LEU   A O   1 ? 1 
ATOM   1093 C CB  . LEU   A 1 147 ? 28.763 -44.130 -4.087  1.000 53.169  0 147 LEU   A CB  1 ? 1 
ATOM   1094 C CG  . LEU   A 1 147 ? 28.166 -43.733 -5.442  1.000 52.376  0 147 LEU   A CG  1 ? 1 
ATOM   1095 C CD1 . LEU   A 1 147 ? 26.715 -43.214 -5.383  1.000 48.028  0 147 LEU   A CD1 1 ? 1 
ATOM   1096 C CD2 . LEU   A 1 147 ? 29.083 -42.658 -6.001  1.000 50.370  0 147 LEU   A CD2 1 ? 1 
ATOM   1097 N N   . TYR   A 1 148 ? 27.283 -47.013 -4.990  1.000 53.078  0 148 TYR   A N   1 ? 1 
ATOM   1098 C CA  . TYR   A 1 148 ? 27.378 -48.099 -5.950  1.000 62.617  0 148 TYR   A CA  1 ? 1 
ATOM   1099 C C   . TYR   A 1 148 ? 27.527 -49.458 -5.247  1.000 64.378  0 148 TYR   A C   1 ? 1 
ATOM   1100 O O   . TYR   A 1 148 ? 27.567 -50.483 -5.924  1.000 65.911  0 148 TYR   A O   1 ? 1 
ATOM   1101 C CB  . TYR   A 1 148 ? 28.437 -47.860 -7.051  1.000 66.250  0 148 TYR   A CB  1 ? 1 
ATOM   1102 C CG  . TYR   A 1 148 ? 28.294 -46.568 -7.867  1.000 61.468  0 148 TYR   A CG  1 ? 1 
ATOM   1103 C CD1 . TYR   A 1 148 ? 27.040 -46.015 -8.125  1.000 64.324  0 148 TYR   A CD1 1 ? 1 
ATOM   1104 C CD2 . TYR   A 1 148 ? 29.401 -45.893 -8.376  1.000 53.048  0 148 TYR   A CD2 1 ? 1 
ATOM   1105 C CE1 . TYR   A 1 148 ? 26.900 -44.827 -8.827  1.000 61.891  0 148 TYR   A CE1 1 ? 1 
ATOM   1106 C CE2 . TYR   A 1 148 ? 29.268 -44.708 -9.093  1.000 54.197  0 148 TYR   A CE2 1 ? 1 
ATOM   1107 C CZ  . TYR   A 1 148 ? 28.010 -44.164 -9.309  1.000 53.815  0 148 TYR   A CZ  1 ? 1 
ATOM   1108 O OH  . TYR   A 1 148 ? 27.771 -42.999 -9.953  1.000 46.367  0 148 TYR   A OH  1 ? 1 
ATOM   1109 N N   . LYS   A 1 149 ? 27.473 -49.502 -3.910  1.000 65.191  0 149 LYS   A N   1 ? 1 
ATOM   1110 C CA  . LYS   A 1 149 ? 27.110 -50.737 -3.222  1.000 73.381  0 149 LYS   A CA  1 ? 1 
ATOM   1111 C C   . LYS   A 1 149 ? 25.621 -51.061 -3.365  1.000 73.759  0 149 LYS   A C   1 ? 1 
ATOM   1112 O O   . LYS   A 1 149 ? 25.223 -52.224 -3.292  1.000 67.433  0 149 LYS   A O   1 ? 1 
ATOM   1113 C CB  . LYS   A 1 149 ? 27.450 -50.674 -1.734  1.000 76.675  0 149 LYS   A CB  1 ? 1 
ATOM   1114 C CG  . LYS   A 1 149 ? 28.920 -50.870 -1.636  1.000 77.778  0 149 LYS   A CG  1 ? 1 
ATOM   1115 C CD  . LYS   A 1 149 ? 29.379 -50.811 -0.207  1.000 78.376  0 149 LYS   A CD  1 ? 1 
ATOM   1116 C CE  . LYS   A 1 149 ? 30.857 -51.001 -0.242  1.000 80.878  0 149 LYS   A CE  1 ? 1 
ATOM   1117 N NZ  . LYS   A 1 149 ? 31.454 -49.952 0.592   1.000 83.153  0 149 LYS   A NZ  1 ? 1 
ATOM   1118 N N   . THR   A 1 150 ? 24.800 -50.018 -3.511  1.000 71.228  0 150 THR   A N   1 ? 1 
ATOM   1119 C CA  . THR   A 1 150 ? 23.407 -50.171 -3.893  1.000 69.968  0 150 THR   A CA  1 ? 1 
ATOM   1120 C C   . THR   A 1 150 ? 23.144 -49.450 -5.199  1.000 63.748  0 150 THR   A C   1 ? 1 
ATOM   1121 O O   . THR   A 1 150 ? 23.928 -48.607 -5.613  1.000 70.237  0 150 THR   A O   1 ? 1 
ATOM   1122 C CB  . THR   A 1 150 ? 22.538 -49.650 -2.749  1.000 71.791  0 150 THR   A CB  1 ? 1 
ATOM   1123 O OG1 . THR   A 1 150 ? 22.543 -48.223 -2.681  1.000 63.703  0 150 THR   A OG1 1 ? 1 
ATOM   1124 C CG2 . THR   A 1 150 ? 22.988 -50.262 -1.431  1.000 63.367  0 150 THR   A CG2 1 ? 1 
ATOM   1125 N N   . GLU   A 1 151 ? 22.059 -49.831 -5.847  1.000 68.072  0 151 GLU   A N   1 ? 1 
ATOM   1126 C CA  . GLU   A 1 151 ? 21.483 -49.055 -6.936  1.000 75.965  0 151 GLU   A CA  1 ? 1 
ATOM   1127 C C   . GLU   A 1 151 ? 21.313 -47.586 -6.524  1.000 70.462  0 151 GLU   A C   1 ? 1 
ATOM   1128 O O   . GLU   A 1 151 ? 20.766 -47.326 -5.452  1.000 65.875  0 151 GLU   A O   1 ? 1 
ATOM   1129 C CB  . GLU   A 1 151 ? 20.138 -49.660 -7.336  1.000 75.965  0 151 GLU   A CB  1 ? 1 
ATOM   1130 C CG  . GLU   A 1 151 ? 20.271 -50.987 -8.077  1.000 83.127  0 151 GLU   A CG  1 ? 1 
ATOM   1131 C CD  . GLU   A 1 151 ? 21.117 -50.960 -9.341  1.000 96.298  0 151 GLU   A CD  1 ? 1 
ATOM   1132 O OE1 . GLU   A 1 151 ? 21.381 -49.913 -10.017 1.000 123.561 0 151 GLU   A OE1 1 ? 1 
ATOM   1133 O OE2 . GLU   A 1 151 ? 21.550 -52.083 -9.633  1.000 90.407  0 151 GLU   A OE2 1 ? 1 
ATOM   1134 N N   . PRO   A 1 152 ? 21.880 -46.621 -7.310  1.000 63.632  0 152 PRO   A N   1 ? 1 
ATOM   1135 C CA  . PRO   A 1 152 ? 21.833 -45.180 -7.016  1.000 59.693  0 152 PRO   A CA  1 ? 1 
ATOM   1136 C C   . PRO   A 1 152 ? 20.498 -44.489 -7.183  1.000 62.840  0 152 PRO   A C   1 ? 1 
ATOM   1137 O O   . PRO   A 1 152 ? 20.334 -43.424 -6.597  1.000 53.383  0 152 PRO   A O   1 ? 1 
ATOM   1138 C CB  . PRO   A 1 152 ? 22.847 -44.500 -7.984  1.000 57.610  0 152 PRO   A CB  1 ? 1 
ATOM   1139 C CG  . PRO   A 1 152 ? 23.007 -45.506 -9.083  1.000 59.730  0 152 PRO   A CG  1 ? 1 
ATOM   1140 C CD  . PRO   A 1 152 ? 22.806 -46.893 -8.429  1.000 64.310  0 152 PRO   A CD  1 ? 1 
ATOM   1141 N N   . LYS   A 1 153 ? 19.644 -45.024 -8.080  1.000 78.819  0 153 LYS   A N   1 ? 1 
ATOM   1142 C CA  . LYS   A 1 153 ? 18.313 -44.483 -8.261  1.000 82.680  0 153 LYS   A CA  1 ? 1 
ATOM   1143 C C   . LYS   A 1 153 ? 18.473 -43.017 -8.633  1.000 80.121  0 153 LYS   A C   1 ? 1 
ATOM   1144 O O   . LYS   A 1 153 ? 19.182 -42.715 -9.580  1.000 84.822  0 153 LYS   A O   1 ? 1 
ATOM   1145 C CB  . LYS   A 1 153 ? 17.533 -44.773 -6.968  1.000 94.541  0 153 LYS   A CB  1 ? 1 
ATOM   1146 C CG  . LYS   A 1 153 ? 17.224 -46.250 -6.898  1.000 112.485 0 153 LYS   A CG  1 ? 1 
ATOM   1147 C CD  . LYS   A 1 153 ? 16.706 -46.850 -5.600  1.000 124.852 0 153 LYS   A CD  1 ? 1 
ATOM   1148 C CE  . LYS   A 1 153 ? 16.510 -48.320 -5.883  1.000 123.886 0 153 LYS   A CE  1 ? 1 
ATOM   1149 N NZ  . LYS   A 1 153 ? 15.817 -49.019 -4.809  1.000 109.302 0 153 LYS   A NZ  1 ? 1 
ATOM   1150 N N   . ASP   A 1 154 ? 17.974 -42.139 -7.765  1.000 81.553  0 154 ASP   A N   1 ? 1 
ATOM   1151 C CA  . ASP   A 1 154 ? 17.674 -40.760 -8.093  1.000 84.175  0 154 ASP   A CA  1 ? 1 
ATOM   1152 C C   . ASP   A 1 154 ? 18.719 -39.793 -7.564  1.000 76.672  0 154 ASP   A C   1 ? 1 
ATOM   1153 O O   . ASP   A 1 154 ? 18.547 -38.589 -7.733  1.000 76.849  0 154 ASP   A O   1 ? 1 
ATOM   1154 C CB  . ASP   A 1 154 ? 16.351 -40.365 -7.452  1.000 97.170  0 154 ASP   A CB  1 ? 1 
ATOM   1155 C CG  . ASP   A 1 154 ? 15.185 -40.898 -8.257  1.000 113.667 0 154 ASP   A CG  1 ? 1 
ATOM   1156 O OD1 . ASP   A 1 154 ? 15.225 -40.679 -9.498  1.000 96.926  0 154 ASP   A OD1 1 ? 1 
ATOM   1157 O OD2 . ASP   A 1 154 ? 14.331 -41.606 -7.664  1.000 110.696 0 154 ASP   A OD2 1 ? 1 
ATOM   1158 N N   . SER   A 1 155 ? 19.728 -40.307 -6.847  1.000 70.599  0 155 SER   A N   1 ? 1 
ATOM   1159 C CA  . SER   A 1 155 ? 20.680 -39.468 -6.142  1.000 67.736  0 155 SER   A CA  1 ? 1 
ATOM   1160 C C   . SER   A 1 155 ? 21.605 -38.736 -7.128  1.000 66.605  0 155 SER   A C   1 ? 1 
ATOM   1161 O O   . SER   A 1 155 ? 21.988 -39.225 -8.187  1.000 59.358  0 155 SER   A O   1 ? 1 
ATOM   1162 C CB  . SER   A 1 155 ? 21.450 -40.280 -5.183  1.000 69.954  0 155 SER   A CB  1 ? 1 
ATOM   1163 O OG  . SER   A 1 155 ? 21.793 -41.501 -5.814  1.000 79.944  0 155 SER   A OG  1 ? 1 
ATOM   1164 N N   . LYS   A 1 156 ? 21.931 -37.523 -6.716  1.000 61.888  0 156 LYS   A N   1 ? 1 
ATOM   1165 C CA  . LYS   A 1 156 ? 22.566 -36.530 -7.520  1.000 58.379  0 156 LYS   A CA  1 ? 1 
ATOM   1166 C C   . LYS   A 1 156 ? 23.624 -35.800 -6.685  1.000 58.292  0 156 LYS   A C   1 ? 1 
ATOM   1167 O O   . LYS   A 1 156 ? 23.356 -35.511 -5.528  1.000 58.342  0 156 LYS   A O   1 ? 1 
ATOM   1168 C CB  . LYS   A 1 156 ? 21.329 -35.668 -7.770  1.000 60.703  0 156 LYS   A CB  1 ? 1 
ATOM   1169 C CG  . LYS   A 1 156 ? 20.580 -36.068 -9.009  1.000 73.841  0 156 LYS   A CG  1 ? 1 
ATOM   1170 C CD  . LYS   A 1 156 ? 19.093 -35.689 -8.959  1.000 81.362  0 156 LYS   A CD  1 ? 1 
ATOM   1171 C CE  . LYS   A 1 156 ? 18.279 -36.246 -10.155 1.000 82.321  0 156 LYS   A CE  1 ? 1 
ATOM   1172 N NZ  . LYS   A 1 156 ? 18.402 -37.682 -10.490 1.000 80.575  0 156 LYS   A NZ  1 ? 1 
ATOM   1173 N N   . ILE   A 1 157 ? 24.753 -35.409 -7.298  1.000 51.349  0 157 ILE   A N   1 ? 1 
ATOM   1174 C CA  . ILE   A 1 157 ? 25.585 -34.361 -6.754  1.000 48.937  0 157 ILE   A CA  1 ? 1 
ATOM   1175 C C   . ILE   A 1 157 ? 25.053 -33.056 -7.327  1.000 54.298  0 157 ILE   A C   1 ? 1 
ATOM   1176 O O   . ILE   A 1 157 ? 24.599 -32.994 -8.475  1.000 52.615  0 157 ILE   A O   1 ? 1 
ATOM   1177 C CB  . ILE   A 1 157 ? 27.052 -34.595 -7.146  1.000 45.293  0 157 ILE   A CB  1 ? 1 
ATOM   1178 C CG1 . ILE   A 1 157 ? 27.542 -35.923 -6.638  1.000 43.876  0 157 ILE   A CG1 1 ? 1 
ATOM   1179 C CG2 . ILE   A 1 157 ? 27.957 -33.449 -6.708  1.000 42.739  0 157 ILE   A CG2 1 ? 1 
ATOM   1180 C CD1 . ILE   A 1 157 ? 28.841 -36.344 -7.271  1.000 40.598  0 157 ILE   A CD1 1 ? 1 
ATOM   1181 N N   . ARG   A 1 158 ? 25.117 -32.000 -6.515  1.000 57.192  0 158 ARG   A N   1 ? 1 
ATOM   1182 C CA  . ARG   A 1 158 ? 24.828 -30.674 -7.030  1.000 56.708  0 158 ARG   A CA  1 ? 1 
ATOM   1183 C C   . ARG   A 1 158 ? 25.865 -29.675 -6.500  1.000 56.175  0 158 ARG   A C   1 ? 1 
ATOM   1184 O O   . ARG   A 1 158 ? 26.087 -29.566 -5.288  1.000 58.584  0 158 ARG   A O   1 ? 1 
ATOM   1185 C CB  . ARG   A 1 158 ? 23.387 -30.226 -6.782  1.000 58.898  0 158 ARG   A CB  1 ? 1 
ATOM   1186 C CG  . ARG   A 1 158 ? 23.366 -28.740 -7.100  1.000 69.614  0 158 ARG   A CG  1 ? 1 
ATOM   1187 C CD  . ARG   A 1 158 ? 22.022 -28.123 -7.110  1.000 72.356  0 158 ARG   A CD  1 ? 1 
ATOM   1188 N NE  . ARG   A 1 158 ? 21.119 -28.790 -8.053  1.000 80.343  0 158 ARG   A NE  1 ? 1 
ATOM   1189 C CZ  . ARG   A 1 158 ? 19.834 -28.440 -8.102  1.000 85.066  0 158 ARG   A CZ  1 ? 1 
ATOM   1190 N NH1 . ARG   A 1 158 ? 19.404 -27.415 -7.377  1.000 73.273  0 158 ARG   A NH1 1 ? 1 
ATOM   1191 N NH2 . ARG   A 1 158 ? 19.001 -29.079 -8.904  1.000 89.314  0 158 ARG   A NH2 1 ? 1 
ATOM   1192 N N   . VAL   A 1 159 ? 26.442 -28.935 -7.456  1.000 47.870  0 159 VAL   A N   1 ? 1 
ATOM   1193 C CA  . VAL   A 1 159 ? 27.455 -27.941 -7.196  1.000 52.957  0 159 VAL   A CA  1 ? 1 
ATOM   1194 C C   . VAL   A 1 159 ? 26.853 -26.550 -7.385  1.000 58.096  0 159 VAL   A C   1 ? 1 
ATOM   1195 O O   . VAL   A 1 159 ? 26.426 -26.224 -8.479  1.000 63.117  0 159 VAL   A O   1 ? 1 
ATOM   1196 C CB  . VAL   A 1 159 ? 28.647 -28.119 -8.148  1.000 45.491  0 159 VAL   A CB  1 ? 1 
ATOM   1197 C CG1 . VAL   A 1 159 ? 29.658 -27.020 -7.908  1.000 43.542  0 159 VAL   A CG1 1 ? 1 
ATOM   1198 C CG2 . VAL   A 1 159 ? 29.290 -29.496 -8.017  1.000 44.329  0 159 VAL   A CG2 1 ? 1 
ATOM   1199 N N   . THR   A 1 160 ? 26.871 -25.713 -6.340  1.000 55.961  0 160 THR   A N   1 ? 1 
ATOM   1200 C CA  . THR   A 1 160 ? 26.198 -24.439 -6.417  1.000 55.740  0 160 THR   A CA  1 ? 1 
ATOM   1201 C C   . THR   A 1 160 ? 27.250 -23.359 -6.301  1.000 53.669  0 160 THR   A C   1 ? 1 
ATOM   1202 O O   . THR   A 1 160 ? 28.178 -23.477 -5.514  1.000 52.506  0 160 THR   A O   1 ? 1 
ATOM   1203 C CB  . THR   A 1 160 ? 25.095 -24.296 -5.355  1.000 63.823  0 160 THR   A CB  1 ? 1 
ATOM   1204 O OG1 . THR   A 1 160 ? 24.191 -25.409 -5.315  1.000 54.042  0 160 THR   A OG1 1 ? 1 
ATOM   1205 C CG2 . THR   A 1 160 ? 24.240 -23.057 -5.606  1.000 68.985  0 160 THR   A CG2 1 ? 1 
ATOM   1206 N N   . MET   A 1 161 ? 27.092 -22.344 -7.138  1.000 54.204  0 161 MET   A N   1 ? 1 
ATOM   1207 C CA  . MET   A 1 161 ? 28.002 -21.222 -7.162  1.000 60.910  0 161 MET   A CA  1 ? 1 
ATOM   1208 C C   . MET   A 1 161 ? 27.450 -20.086 -6.297  1.000 67.903  0 161 MET   A C   1 ? 1 
ATOM   1209 O O   . MET   A 1 161 ? 26.262 -20.034 -5.989  1.000 78.207  0 161 MET   A O   1 ? 1 
ATOM   1210 C CB  . MET   A 1 161 ? 28.166 -20.696 -8.602  1.000 60.237  0 161 MET   A CB  1 ? 1 
ATOM   1211 C CG  . MET   A 1 161 ? 28.426 -21.759 -9.626  1.000 55.663  0 161 MET   A CG  1 ? 1 
ATOM   1212 S SD  . MET   A 1 161 ? 29.842 -22.843 -9.315  1.000 53.394  0 161 MET   A SD  1 ? 1 
ATOM   1213 C CE  . MET   A 1 161 ? 31.116 -21.689 -9.806  1.000 46.152  0 161 MET   A CE  1 ? 1 
ATOM   1214 N N   . LYS   A 1 162 ? 28.326 -19.120 -6.013  1.000 71.404  0 162 LYS   A N   1 ? 1 
ATOM   1215 C CA  . LYS   A 1 162 ? 28.001 -17.888 -5.315  1.000 71.690  0 162 LYS   A CA  1 ? 1 
ATOM   1216 C C   . LYS   A 1 162 ? 26.905 -17.075 -5.988  1.000 77.921  0 162 LYS   A C   1 ? 1 
ATOM   1217 O O   . LYS   A 1 162 ? 26.175 -16.354 -5.324  1.000 84.066  0 162 LYS   A O   1 ? 1 
ATOM   1218 C CB  . LYS   A 1 162 ? 29.231 -16.989 -5.248  1.000 68.223  0 162 LYS   A CB  1 ? 1 
ATOM   1219 C CG  . LYS   A 1 162 ? 30.120 -17.548 -4.175  1.000 71.795  0 162 LYS   A CG  1 ? 1 
ATOM   1220 C CD  . LYS   A 1 162 ? 31.506 -16.957 -3.953  1.000 67.552  0 162 LYS   A CD  1 ? 1 
ATOM   1221 C CE  . LYS   A 1 162 ? 32.120 -17.995 -3.045  1.000 68.805  0 162 LYS   A CE  1 ? 1 
ATOM   1222 N NZ  . LYS   A 1 162 ? 33.536 -17.860 -2.724  1.000 65.889  0 162 LYS   A NZ  1 ? 1 
ATOM   1223 N N   . ASN   A 1 163 ? 26.802 -17.155 -7.305  1.000 75.256  0 163 ASN   A N   1 ? 1 
ATOM   1224 C CA  . ASN   A 1 163 ? 25.773 -16.401 -7.988  1.000 70.057  0 163 ASN   A CA  1 ? 1 
ATOM   1225 C C   . ASN   A 1 163 ? 24.503 -17.239 -8.083  1.000 71.174  0 163 ASN   A C   1 ? 1 
ATOM   1226 O O   . ASN   A 1 163 ? 23.589 -16.828 -8.769  1.000 74.440  0 163 ASN   A O   1 ? 1 
ATOM   1227 C CB  . ASN   A 1 163 ? 26.233 -15.963 -9.377  1.000 64.767  0 163 ASN   A CB  1 ? 1 
ATOM   1228 C CG  . ASN   A 1 163 ? 26.255 -17.101 -10.369 1.000 65.324  0 163 ASN   A CG  1 ? 1 
ATOM   1229 O OD1 . ASN   A 1 163 ? 26.049 -18.272 -10.011 1.000 66.181  0 163 ASN   A OD1 1 ? 1 
ATOM   1230 N ND2 . ASN   A 1 163 ? 26.511 -16.774 -11.621 1.000 69.409  0 163 ASN   A ND2 1 ? 1 
ATOM   1231 N N   . GLY   A 1 164 ? 24.461 -18.446 -7.509  1.000 71.877  0 164 GLY   A N   1 ? 1 
ATOM   1232 C CA  . GLY   A 1 164 ? 23.240 -19.236 -7.560  1.000 68.694  0 164 GLY   A CA  1 ? 1 
ATOM   1233 C C   . GLY   A 1 164 ? 23.175 -20.223 -8.733  1.000 71.233  0 164 GLY   A C   1 ? 1 
ATOM   1234 O O   . GLY   A 1 164 ? 22.436 -21.217 -8.610  1.000 61.560  0 164 GLY   A O   1 ? 1 
ATOM   1235 N N   . ASP   A 1 165 ? 23.947 -19.978 -9.831  1.000 63.529  0 165 ASP   A N   1 ? 1 
ATOM   1236 C CA  . ASP   A 1 165 ? 24.125 -20.964 -10.886 1.000 59.479  0 165 ASP   A CA  1 ? 1 
ATOM   1237 C C   . ASP   A 1 165 ? 24.490 -22.316 -10.278 1.000 59.454  0 165 ASP   A C   1 ? 1 
ATOM   1238 O O   . ASP   A 1 165 ? 25.094 -22.377 -9.204  1.000 64.737  0 165 ASP   A O   1 ? 1 
ATOM   1239 C CB  . ASP   A 1 165 ? 25.233 -20.569 -11.841 1.000 65.082  0 165 ASP   A CB  1 ? 1 
ATOM   1240 C CG  . ASP   A 1 165 ? 24.958 -19.423 -12.811 1.000 71.125  0 165 ASP   A CG  1 ? 1 
ATOM   1241 O OD1 . ASP   A 1 165 ? 23.797 -18.979 -12.880 1.000 72.952  0 165 ASP   A OD1 1 ? 1 
ATOM   1242 O OD2 . ASP   A 1 165 ? 25.907 -18.991 -13.526 1.000 70.878  0 165 ASP   A OD2 1 ? 1 
ATOM   1243 N N   . PHE   A 1 166 ? 24.120 -23.405 -10.951 1.000 57.404  0 166 PHE   A N   1 ? 1 
ATOM   1244 C CA  . PHE   A 1 166 ? 24.412 -24.722 -10.412 1.000 57.385  0 166 PHE   A CA  1 ? 1 
ATOM   1245 C C   . PHE   A 1 166 ? 24.655 -25.773 -11.504 1.000 53.072  0 166 PHE   A C   1 ? 1 
ATOM   1246 O O   . PHE   A 1 166 ? 24.276 -25.643 -12.666 1.000 55.204  0 166 PHE   A O   1 ? 1 
ATOM   1247 C CB  . PHE   A 1 166 ? 23.300 -25.059 -9.414  1.000 58.830  0 166 PHE   A CB  1 ? 1 
ATOM   1248 C CG  . PHE   A 1 166 ? 21.949 -25.407 -10.017 1.000 70.080  0 166 PHE   A CG  1 ? 1 
ATOM   1249 C CD1 . PHE   A 1 166 ? 21.726 -26.660 -10.583 1.000 71.826  0 166 PHE   A CD1 1 ? 1 
ATOM   1250 C CD2 . PHE   A 1 166 ? 20.880 -24.504 -9.974  1.000 78.572  0 166 PHE   A CD2 1 ? 1 
ATOM   1251 C CE1 . PHE   A 1 166 ? 20.475 -26.990 -11.117 1.000 73.462  0 166 PHE   A CE1 1 ? 1 
ATOM   1252 C CE2 . PHE   A 1 166 ? 19.655 -24.834 -10.537 1.000 79.749  0 166 PHE   A CE2 1 ? 1 
ATOM   1253 C CZ  . PHE   A 1 166 ? 19.457 -26.071 -11.116 1.000 75.827  0 166 PHE   A CZ  1 ? 1 
ATOM   1254 N N   . TYR   A 1 167 ? 25.331 -26.839 -11.098 1.000 47.548  0 167 TYR   A N   1 ? 1 
ATOM   1255 C CA  . TYR   A 1 167 ? 25.629 -27.961 -11.959 1.000 47.579  0 167 TYR   A CA  1 ? 1 
ATOM   1256 C C   . TYR   A 1 167 ? 25.242 -29.258 -11.261 1.000 47.304  0 167 TYR   A C   1 ? 1 
ATOM   1257 O O   . TYR   A 1 167 ? 25.684 -29.549 -10.168 1.000 51.352  0 167 TYR   A O   1 ? 1 
ATOM   1258 C CB  . TYR   A 1 167 ? 27.128 -27.884 -12.252 1.000 45.942  0 167 TYR   A CB  1 ? 1 
ATOM   1259 C CG  . TYR   A 1 167 ? 27.536 -26.536 -12.808 1.000 44.117  0 167 TYR   A CG  1 ? 1 
ATOM   1260 C CD1 . TYR   A 1 167 ? 27.485 -26.313 -14.160 1.000 44.731  0 167 TYR   A CD1 1 ? 1 
ATOM   1261 C CD2 . TYR   A 1 167 ? 27.915 -25.478 -11.990 1.000 46.981  0 167 TYR   A CD2 1 ? 1 
ATOM   1262 C CE1 . TYR   A 1 167 ? 27.819 -25.082 -14.694 1.000 45.045  0 167 TYR   A CE1 1 ? 1 
ATOM   1263 C CE2 . TYR   A 1 167 ? 28.225 -24.226 -12.510 1.000 44.794  0 167 TYR   A CE2 1 ? 1 
ATOM   1264 C CZ  . TYR   A 1 167 ? 28.138 -24.038 -13.865 1.000 44.431  0 167 TYR   A CZ  1 ? 1 
ATOM   1265 O OH  . TYR   A 1 167 ? 28.440 -22.880 -14.448 1.000 46.589  0 167 TYR   A OH  1 ? 1 
ATOM   1266 N N   . THR   A 1 168 ? 24.488 -30.089 -11.958 1.000 49.588  0 168 THR   A N   1 ? 1 
ATOM   1267 C CA  . THR   A 1 168 ? 24.000 -31.350 -11.438 1.000 49.179  0 168 THR   A CA  1 ? 1 
ATOM   1268 C C   . THR   A 1 168 ? 24.731 -32.507 -12.104 1.000 47.485  0 168 THR   A C   1 ? 1 
ATOM   1269 O O   . THR   A 1 168 ? 24.900 -32.542 -13.342 1.000 52.055  0 168 THR   A O   1 ? 1 
ATOM   1270 C CB  . THR   A 1 168 ? 22.516 -31.495 -11.740 1.000 50.041  0 168 THR   A CB  1 ? 1 
ATOM   1271 O OG1 . THR   A 1 168 ? 21.975 -30.318 -11.174 1.000 53.962  0 168 THR   A OG1 1 ? 1 
ATOM   1272 C CG2 . THR   A 1 168 ? 21.960 -32.735 -11.078 1.000 57.788  0 168 THR   A CG2 1 ? 1 
ATOM   1273 N N   . PHE   A 1 169 ? 25.058 -33.483 -11.263 1.000 44.736  0 169 PHE   A N   1 ? 1 
ATOM   1274 C CA  . PHE   A 1 169 ? 25.596 -34.760 -11.678 1.000 44.864  0 169 PHE   A CA  1 ? 1 
ATOM   1275 C C   . PHE   A 1 169 ? 24.679 -35.859 -11.177 1.000 46.710  0 169 PHE   A C   1 ? 1 
ATOM   1276 O O   . PHE   A 1 169 ? 24.482 -36.032 -9.964  1.000 52.803  0 169 PHE   A O   1 ? 1 
ATOM   1277 C CB  . PHE   A 1 169 ? 27.000 -35.033 -11.125 1.000 42.957  0 169 PHE   A CB  1 ? 1 
ATOM   1278 C CG  . PHE   A 1 169 ? 28.011 -33.945 -11.393 1.000 39.723  0 169 PHE   A CG  1 ? 1 
ATOM   1279 C CD1 . PHE   A 1 169 ? 28.039 -33.269 -12.603 1.000 40.814  0 169 PHE   A CD1 1 ? 1 
ATOM   1280 C CD2 . PHE   A 1 169 ? 28.972 -33.651 -10.458 1.000 38.560  0 169 PHE   A CD2 1 ? 1 
ATOM   1281 C CE1 . PHE   A 1 169 ? 28.948 -32.258 -12.804 1.000 42.358  0 169 PHE   A CE1 1 ? 1 
ATOM   1282 C CE2 . PHE   A 1 169 ? 29.929 -32.672 -10.671 1.000 39.632  0 169 PHE   A CE2 1 ? 1 
ATOM   1283 C CZ  . PHE   A 1 169 ? 29.923 -31.972 -11.844 1.000 42.687  0 169 PHE   A CZ  1 ? 1 
ATOM   1284 N N   . GLU   A 1 170 ? 24.083 -36.555 -12.139 1.000 48.478  0 170 GLU   A N   1 ? 1 
ATOM   1285 C CA  . GLU   A 1 170 ? 23.227 -37.678 -11.828 1.000 49.282  0 170 GLU   A CA  1 ? 1 
ATOM   1286 C C   . GLU   A 1 170 ? 24.080 -38.922 -11.661 1.000 47.479  0 170 GLU   A C   1 ? 1 
ATOM   1287 O O   . GLU   A 1 170 ? 24.719 -39.349 -12.623 1.000 45.840  0 170 GLU   A O   1 ? 1 
ATOM   1288 C CB  . GLU   A 1 170 ? 22.230 -37.931 -12.955 1.000 50.245  0 170 GLU   A CB  1 ? 1 
ATOM   1289 C CG  . GLU   A 1 170 ? 21.140 -36.863 -13.068 1.000 55.840  0 170 GLU   A CG  1 ? 1 
ATOM   1290 C CD  . GLU   A 1 170 ? 20.131 -37.224 -14.173 1.000 63.398  0 170 GLU   A CD  1 ? 1 
ATOM   1291 O OE1 . GLU   A 1 170 ? 20.479 -37.320 -15.424 1.000 64.941  0 170 GLU   A OE1 1 ? 1 
ATOM   1292 O OE2 . GLU   A 1 170 ? 18.953 -37.406 -13.716 1.000 81.928  0 170 GLU   A OE2 1 ? 1 
ATOM   1293 N N   . LEU   A 1 171 ? 23.918 -39.566 -10.490 1.000 50.272  0 171 LEU   A N   1 ? 1 
ATOM   1294 C CA  . LEU   A 1 171 ? 24.787 -40.649 -10.052 1.000 51.033  0 171 LEU   A CA  1 ? 1 
ATOM   1295 C C   . LEU   A 1 171 ? 24.373 -41.988 -10.649 1.000 51.387  0 171 LEU   A C   1 ? 1 
ATOM   1296 O O   . LEU   A 1 171 ? 25.136 -42.944 -10.636 1.000 55.383  0 171 LEU   A O   1 ? 1 
ATOM   1297 C CB  . LEU   A 1 171 ? 24.844 -40.603 -8.531  1.000 49.159  0 171 LEU   A CB  1 ? 1 
ATOM   1298 C CG  . LEU   A 1 171 ? 25.480 -39.334 -7.954  1.000 52.394  0 171 LEU   A CG  1 ? 1 
ATOM   1299 C CD1 . LEU   A 1 171 ? 25.361 -39.174 -6.451  1.000 53.725  0 171 LEU   A CD1 1 ? 1 
ATOM   1300 C CD2 . LEU   A 1 171 ? 26.952 -39.370 -8.344  1.000 55.800  0 171 LEU   A CD2 1 ? 1 
ATOM   1301 N N   . ASN   A 1 172 ? 23.240 -42.001 -11.333 1.000 59.097  0 172 ASN   A N   1 ? 1 
ATOM   1302 C CA  . ASN   A 1 172 ? 22.781 -43.198 -12.022 1.000 64.223  0 172 ASN   A CA  1 ? 1 
ATOM   1303 C C   . ASN   A 1 172 ? 23.341 -43.270 -13.434 1.000 61.945  0 172 ASN   A C   1 ? 1 
ATOM   1304 O O   . ASN   A 1 172 ? 23.181 -44.311 -14.066 1.000 61.580  0 172 ASN   A O   1 ? 1 
ATOM   1305 C CB  . ASN   A 1 172 ? 21.259 -43.299 -12.012 1.000 69.059  0 172 ASN   A CB  1 ? 1 
ATOM   1306 C CG  . ASN   A 1 172 ? 20.645 -42.310 -12.963 1.000 73.790  0 172 ASN   A CG  1 ? 1 
ATOM   1307 O OD1 . ASN   A 1 172 ? 20.725 -41.093 -12.792 1.000 82.449  0 172 ASN   A OD1 1 ? 1 
ATOM   1308 N ND2 . ASN   A 1 172 ? 20.103 -42.810 -14.044 1.000 91.262  0 172 ASN   A ND2 1 ? 1 
ATOM   1309 N N   . LYS   A 1 173 ? 24.053 -42.230 -13.923 1.000 58.392  0 173 LYS   A N   1 ? 1 
ATOM   1310 C CA  . LYS   A 1 173 ? 24.758 -42.393 -15.195 1.000 58.668  0 173 LYS   A CA  1 ? 1 
ATOM   1311 C C   . LYS   A 1 173 ? 26.112 -41.702 -15.133 1.000 56.412  0 173 LYS   A C   1 ? 1 
ATOM   1312 O O   . LYS   A 1 173 ? 26.288 -40.737 -14.393 1.000 49.752  0 173 LYS   A O   1 ? 1 
ATOM   1313 C CB  . LYS   A 1 173 ? 23.989 -41.921 -16.454 1.000 62.235  0 173 LYS   A CB  1 ? 1 
ATOM   1314 C CG  . LYS   A 1 173 ? 23.255 -40.563 -16.284 1.000 63.857  0 173 LYS   A CG  1 ? 1 
ATOM   1315 C CD  . LYS   A 1 173 ? 22.343 -39.997 -17.382 1.000 73.286  0 173 LYS   A CD  1 ? 1 
ATOM   1316 C CE  . LYS   A 1 173 ? 20.850 -40.191 -17.192 1.000 87.030  0 173 LYS   A CE  1 ? 1 
ATOM   1317 N NZ  . LYS   A 1 173 ? 20.361 -40.043 -15.789 1.000 83.272  0 173 LYS   A NZ  1 ? 1 
ATOM   1318 N N   . LYS   A 1 174 ? 27.031 -42.141 -16.009 1.000 54.836  0 174 LYS   A N   1 ? 1 
ATOM   1319 C CA  . LYS   A 1 174 ? 28.255 -41.388 -16.218 1.000 49.354  0 174 LYS   A CA  1 ? 1 
ATOM   1320 C C   . LYS   A 1 174 ? 27.895 -39.950 -16.558 1.000 46.219  0 174 LYS   A C   1 ? 1 
ATOM   1321 O O   . LYS   A 1 174 ? 26.798 -39.710 -17.052 1.000 46.761  0 174 LYS   A O   1 ? 1 
ATOM   1322 C CB  . LYS   A 1 174 ? 29.202 -41.915 -17.282 1.000 49.302  0 174 LYS   A CB  1 ? 1 
ATOM   1323 C CG  . LYS   A 1 174 ? 29.749 -43.288 -16.982 1.000 61.581  0 174 LYS   A CG  1 ? 1 
ATOM   1324 C CD  . LYS   A 1 174 ? 30.541 -43.904 -18.132 1.000 66.154  0 174 LYS   A CD  1 ? 1 
ATOM   1325 C CE  . LYS   A 1 174 ? 31.377 -42.852 -18.756 1.000 74.931  0 174 LYS   A CE  1 ? 1 
ATOM   1326 N NZ  . LYS   A 1 174 ? 32.461 -43.478 -19.506 1.000 80.196  0 174 LYS   A NZ  1 ? 1 
ATOM   1327 N N   . LEU   A 1 175 ? 28.783 -39.013 -16.177 1.000 40.992  0 175 LEU   A N   1 ? 1 
ATOM   1328 C CA  . LEU   A 1 175 ? 28.719 -37.656 -16.664 1.000 40.518  0 175 LEU   A CA  1 ? 1 
ATOM   1329 C C   . LEU   A 1 175 ? 28.667 -37.656 -18.201 1.000 44.654  0 175 LEU   A C   1 ? 1 
ATOM   1330 O O   . LEU   A 1 175 ? 29.440 -38.357 -18.852 1.000 48.226  0 175 LEU   A O   1 ? 1 
ATOM   1331 C CB  . LEU   A 1 175 ? 29.960 -36.900 -16.224 1.000 38.587  0 175 LEU   A CB  1 ? 1 
ATOM   1332 C CG  . LEU   A 1 175 ? 29.909 -35.423 -16.591 1.000 36.791  0 175 LEU   A CG  1 ? 1 
ATOM   1333 C CD1 . LEU   A 1 175 ? 28.657 -34.774 -16.068 1.000 37.795  0 175 LEU   A CD1 1 ? 1 
ATOM   1334 C CD2 . LEU   A 1 175 ? 31.069 -34.707 -16.113 1.000 37.517  0 175 LEU   A CD2 1 ? 1 
ATOM   1335 N N   . GLN   A 1 176 ? 27.796 -36.818 -18.793 1.000 44.127  0 176 GLN   A N   1 ? 1 
ATOM   1336 C CA  . GLN   A 1 176 ? 27.657 -36.767 -20.229 1.000 41.892  0 176 GLN   A CA  1 ? 1 
ATOM   1337 C C   . GLN   A 1 176 ? 28.941 -36.242 -20.811 1.000 41.614  0 176 GLN   A C   1 ? 1 
ATOM   1338 O O   . GLN   A 1 176 ? 29.450 -35.226 -20.343 1.000 40.106  0 176 GLN   A O   1 ? 1 
ATOM   1339 C CB  . GLN   A 1 176 ? 26.499 -35.871 -20.617 1.000 42.894  0 176 GLN   A CB  1 ? 1 
ATOM   1340 C CG  . GLN   A 1 176 ? 25.152 -36.404 -20.125 1.000 44.727  0 176 GLN   A CG  1 ? 1 
ATOM   1341 C CD  . GLN   A 1 176 ? 24.737 -35.878 -18.777 1.000 46.114  0 176 GLN   A CD  1 ? 1 
ATOM   1342 O OE1 . GLN   A 1 176 ? 25.572 -35.523 -17.937 1.000 47.186  0 176 GLN   A OE1 1 ? 1 
ATOM   1343 N NE2 . GLN   A 1 176 ? 23.437 -35.751 -18.603 1.000 48.383  0 176 GLN   A NE2 1 ? 1 
ATOM   1344 N N   . THR   A 1 177 ? 29.423 -36.952 -21.836 1.000 42.268  0 177 THR   A N   1 ? 1 
ATOM   1345 C CA  . THR   A 1 177 ? 30.686 -36.621 -22.462 1.000 45.359  0 177 THR   A CA  1 ? 1 
ATOM   1346 C C   . THR   A 1 177 ? 30.788 -35.152 -22.907 1.000 42.544  0 177 THR   A C   1 ? 1 
ATOM   1347 O O   . THR   A 1 177 ? 31.915 -34.589 -22.858 1.000 34.231  0 177 THR   A O   1 ? 1 
ATOM   1348 C CB  . THR   A 1 177 ? 30.999 -37.574 -23.627 1.000 48.062  0 177 THR   A CB  1 ? 1 
ATOM   1349 O OG1 . THR   A 1 177 ? 30.229 -37.402 -24.821 1.000 56.563  0 177 THR   A OG1 1 ? 1 
ATOM   1350 C CG2 . THR   A 1 177 ? 31.090 -38.993 -23.115 1.000 42.890  0 177 THR   A CG2 1 ? 1 
ATOM   1351 N N   . HIS   A 1 178 ? 29.664 -34.571 -23.407 1.000 40.086  0 178 HIS   A N   1 ? 1 
ATOM   1352 C CA  . HIS   A 1 178 ? 29.716 -33.183 -23.875 1.000 42.850  0 178 HIS   A CA  1 ? 1 
ATOM   1353 C C   . HIS   A 1 178 ? 29.936 -32.173 -22.732 1.000 45.233  0 178 HIS   A C   1 ? 1 
ATOM   1354 O O   . HIS   A 1 178 ? 30.347 -31.022 -23.008 1.000 42.347  0 178 HIS   A O   1 ? 1 
ATOM   1355 C CB  . HIS   A 1 178 ? 28.526 -32.768 -24.746 1.000 40.126  0 178 HIS   A CB  1 ? 1 
ATOM   1356 C CG  . HIS   A 1 178 ? 27.295 -32.686 -23.975 1.000 39.318  0 178 HIS   A CG  1 ? 1 
ATOM   1357 N ND1 . HIS   A 1 178 ? 26.648 -33.860 -23.673 1.000 40.966  0 178 HIS   A ND1 1 ? 1 
ATOM   1358 C CD2 . HIS   A 1 178 ? 26.643 -31.671 -23.397 1.000 38.680  0 178 HIS   A CD2 1 ? 1 
ATOM   1359 C CE1 . HIS   A 1 178 ? 25.575 -33.571 -22.919 1.000 43.900  0 178 HIS   A CE1 1 ? 1 
ATOM   1360 N NE2 . HIS   A 1 178 ? 25.582 -32.242 -22.704 1.000 42.163  0 178 HIS   A NE2 1 ? 1 
ATOM   1361 N N   . ARG   A 1 179 ? 29.708 -32.625 -21.464 1.000 46.624  0 179 ARG   A N   1 ? 1 
ATOM   1362 C CA  . ARG   A 1 179 ? 29.930 -31.804 -20.266 1.000 44.249  0 179 ARG   A CA  1 ? 1 
ATOM   1363 C C   . ARG   A 1 179 ? 31.343 -31.919 -19.649 1.000 40.793  0 179 ARG   A C   1 ? 1 
ATOM   1364 O O   . ARG   A 1 179 ? 31.762 -31.003 -18.896 1.000 39.614  0 179 ARG   A O   1 ? 1 
ATOM   1365 C CB  . ARG   A 1 179 ? 28.869 -32.165 -19.240 1.000 45.659  0 179 ARG   A CB  1 ? 1 
ATOM   1366 C CG  . ARG   A 1 179 ? 27.465 -31.915 -19.755 1.000 43.814  0 179 ARG   A CG  1 ? 1 
ATOM   1367 C CD  . ARG   A 1 179 ? 26.426 -32.290 -18.800 1.000 41.427  0 179 ARG   A CD  1 ? 1 
ATOM   1368 N NE  . ARG   A 1 179 ? 26.403 -31.435 -17.607 1.000 40.574  0 179 ARG   A NE  1 ? 1 
ATOM   1369 C CZ  . ARG   A 1 179 ? 26.099 -31.943 -16.414 1.000 42.395  0 179 ARG   A CZ  1 ? 1 
ATOM   1370 N NH1 . ARG   A 1 179 ? 25.693 -33.212 -16.300 1.000 42.923  0 179 ARG   A NH1 1 ? 1 
ATOM   1371 N NH2 . ARG   A 1 179 ? 26.175 -31.201 -15.322 1.000 42.747  0 179 ARG   A NH2 1 ? 1 
ATOM   1372 N N   . MET   A 1 180 ? 32.110 -32.954 -20.033 1.000 34.609  0 180 MET   A N   1 ? 1 
ATOM   1373 C CA  . MET   A 1 180 ? 33.408 -33.202 -19.437 1.000 34.349  0 180 MET   A CA  1 ? 1 
ATOM   1374 C C   . MET   A 1 180 ? 34.390 -32.047 -19.661 1.000 35.876  0 180 MET   A C   1 ? 1 
ATOM   1375 O O   . MET   A 1 180 ? 35.374 -31.840 -18.889 1.000 33.491  0 180 MET   A O   1 ? 1 
ATOM   1376 C CB  . MET   A 1 180 ? 34.008 -34.541 -19.859 1.000 33.361  0 180 MET   A CB  1 ? 1 
ATOM   1377 C CG  . MET   A 1 180 ? 33.136 -35.691 -19.364 1.000 36.514  0 180 MET   A CG  1 ? 1 
ATOM   1378 S SD  . MET   A 1 180 ? 33.843 -37.217 -20.014 1.000 41.586  0 180 MET   A SD  1 ? 1 
ATOM   1379 C CE  . MET   A 1 180 ? 32.974 -38.481 -19.061 1.000 42.947  0 180 MET   A CE  1 ? 1 
ATOM   1380 N N   . GLY   A 1 181 ? 34.143 -31.258 -20.701 1.000 34.512  0 181 GLY   A N   1 ? 1 
ATOM   1381 C CA  . GLY   A 1 181 ? 35.088 -30.189 -21.035 1.000 31.771  0 181 GLY   A CA  1 ? 1 
ATOM   1382 C C   . GLY   A 1 181 ? 34.562 -28.825 -20.608 1.000 31.846  0 181 GLY   A C   1 ? 1 
ATOM   1383 O O   . GLY   A 1 181 ? 35.202 -27.833 -20.908 1.000 33.705  0 181 GLY   A O   1 ? 1 
ATOM   1384 N N   . ASP   A 1 182 ? 33.401 -28.780 -19.938 1.000 33.230  0 182 ASP   A N   1 ? 1 
ATOM   1385 C CA  . ASP   A 1 182 ? 32.847 -27.549 -19.396 1.000 36.555  0 182 ASP   A CA  1 ? 1 
ATOM   1386 C C   . ASP   A 1 182 ? 33.614 -27.210 -18.136 1.000 38.690  0 182 ASP   A C   1 ? 1 
ATOM   1387 O O   . ASP   A 1 182 ? 33.996 -28.114 -17.403 1.000 35.240  0 182 ASP   A O   1 ? 1 
ATOM   1388 C CB  . ASP   A 1 182 ? 31.367 -27.686 -19.082 1.000 41.502  0 182 ASP   A CB  1 ? 1 
ATOM   1389 C CG  . ASP   A 1 182 ? 30.399 -27.701 -20.286 1.000 44.676  0 182 ASP   A CG  1 ? 1 
ATOM   1390 O OD1 . ASP   A 1 182 ? 30.804 -27.273 -21.452 1.000 46.763  0 182 ASP   A OD1 1 ? 1 
ATOM   1391 O OD2 . ASP   A 1 182 ? 29.275 -28.233 -20.073 1.000 40.455  0 182 ASP   A OD2 1 ? 1 
ATOM   1392 N N   . VAL   A 1 183 ? 33.973 -25.934 -17.992 1.000 42.237  0 183 VAL   A N   1 ? 1 
ATOM   1393 C CA  . VAL   A 1 183 ? 34.800 -25.494 -16.884 1.000 39.585  0 183 VAL   A CA  1 ? 1 
ATOM   1394 C C   . VAL   A 1 183 ? 34.101 -24.364 -16.138 1.000 40.722  0 183 VAL   A C   1 ? 1 
ATOM   1395 O O   . VAL   A 1 183 ? 33.246 -23.690 -16.685 1.000 35.569  0 183 VAL   A O   1 ? 1 
ATOM   1396 C CB  . VAL   A 1 183 ? 36.165 -25.092 -17.412 1.000 38.953  0 183 VAL   A CB  1 ? 1 
ATOM   1397 C CG1 . VAL   A 1 183 ? 36.744 -26.213 -18.278 1.000 41.714  0 183 VAL   A CG1 1 ? 1 
ATOM   1398 C CG2 . VAL   A 1 183 ? 36.038 -23.842 -18.251 1.000 40.964  0 183 VAL   A CG2 1 ? 1 
ATOM   1399 N N   . ILE   A 1 184 ? 34.418 -24.283 -14.834 1.000 44.383  0 184 ILE   A N   1 ? 1 
ATOM   1400 C CA  . ILE   A 1 184 ? 33.915 -23.235 -13.984 1.000 42.598  0 184 ILE   A CA  1 ? 1 
ATOM   1401 C C   . ILE   A 1 184 ? 35.041 -22.603 -13.178 1.000 40.589  0 184 ILE   A C   1 ? 1 
ATOM   1402 O O   . ILE   A 1 184 ? 36.205 -23.046 -13.120 1.000 34.573  0 184 ILE   A O   1 ? 1 
ATOM   1403 C CB  . ILE   A 1 184 ? 32.809 -23.813 -13.105 1.000 45.370  0 184 ILE   A CB  1 ? 1 
ATOM   1404 C CG1 . ILE   A 1 184 ? 33.375 -24.853 -12.168 1.000 44.202  0 184 ILE   A CG1 1 ? 1 
ATOM   1405 C CG2 . ILE   A 1 184 ? 31.685 -24.372 -13.993 1.000 43.480  0 184 ILE   A CG2 1 ? 1 
ATOM   1406 C CD1 . ILE   A 1 184 ? 32.343 -25.413 -11.218 1.000 43.554  0 184 ILE   A CD1 1 ? 1 
ATOM   1407 N N   . ASP   A 1 185 ? 34.662 -21.458 -12.632 1.000 43.298  0 185 ASP   A N   1 ? 1 
ATOM   1408 C CA  . ASP   A 1 185 ? 35.571 -20.728 -11.776 1.000 50.292  0 185 ASP   A CA  1 ? 1 
ATOM   1409 C C   . ASP   A 1 185 ? 35.528 -21.324 -10.369 1.000 43.885  0 185 ASP   A C   1 ? 1 
ATOM   1410 O O   . ASP   A 1 185 ? 34.498 -21.228 -9.696  1.000 44.041  0 185 ASP   A O   1 ? 1 
ATOM   1411 C CB  . ASP   A 1 185 ? 35.253 -19.246 -11.735 1.000 55.329  0 185 ASP   A CB  1 ? 1 
ATOM   1412 C CG  . ASP   A 1 185 ? 36.344 -18.403 -11.097 1.000 62.922  0 185 ASP   A CG  1 ? 1 
ATOM   1413 O OD1 . ASP   A 1 185 ? 37.261 -18.963 -10.405 1.000 66.150  0 185 ASP   A OD1 1 ? 1 
ATOM   1414 O OD2 . ASP   A 1 185 ? 36.337 -17.211 -11.388 1.000 68.027  0 185 ASP   A OD2 1 ? 1 
ATOM   1415 N N   . GLY   A 1 186 ? 36.671 -21.900 -9.944  1.000 40.018  0 186 GLY   A N   1 ? 1 
ATOM   1416 C CA  . GLY   A 1 186 ? 36.781 -22.578 -8.655  1.000 44.520  0 186 GLY   A CA  1 ? 1 
ATOM   1417 C C   . GLY   A 1 186 ? 36.643 -21.650 -7.438  1.000 42.845  0 186 GLY   A C   1 ? 1 
ATOM   1418 O O   . GLY   A 1 186 ? 36.062 -22.035 -6.452  1.000 42.704  0 186 GLY   A O   1 ? 1 
ATOM   1419 N N   . ARG   A 1 187 ? 37.094 -20.411 -7.566  1.000 45.980  0 187 ARG   A N   1 ? 1 
ATOM   1420 C CA  . ARG   A 1 187 ? 36.858 -19.344 -6.617  1.000 51.177  0 187 ARG   A CA  1 ? 1 
ATOM   1421 C C   . ARG   A 1 187 ? 35.368 -19.126 -6.390  1.000 55.466  0 187 ARG   A C   1 ? 1 
ATOM   1422 O O   . ARG   A 1 187 ? 35.022 -18.782 -5.286  1.000 53.469  0 187 ARG   A O   1 ? 1 
ATOM   1423 C CB  . ARG   A 1 187 ? 37.497 -18.018 -7.055  1.000 58.709  0 187 ARG   A CB  1 ? 1 
ATOM   1424 C CG  . ARG   A 1 187 ? 39.001 -18.116 -7.318  1.000 65.685  0 187 ARG   A CG  1 ? 1 
ATOM   1425 C CD  . ARG   A 1 187 ? 39.312 -17.216 -8.482  1.000 86.699  0 187 ARG   A CD  1 ? 1 
ATOM   1426 N NE  . ARG   A 1 187 ? 40.664 -17.281 -9.024  1.000 93.619  0 187 ARG   A NE  1 ? 1 
ATOM   1427 C CZ  . ARG   A 1 187 ? 41.028 -16.346 -9.867  1.000 105.616 0 187 ARG   A CZ  1 ? 1 
ATOM   1428 N NH1 . ARG   A 1 187 ? 40.073 -15.661 -10.473 1.000 94.229  0 187 ARG   A NH1 1 ? 1 
ATOM   1429 N NH2 . ARG   A 1 187 ? 42.328 -16.111 -10.052 1.000 124.219 0 187 ARG   A NH2 1 ? 1 
ATOM   1430 N N   . ASN   A 1 188 ? 34.474 -19.367 -7.364  1.000 54.730  0 188 ASN   A N   1 ? 1 
ATOM   1431 C CA  . ASN   A 1 188 ? 33.072 -19.026 -7.144  1.000 52.777  0 188 ASN   A CA  1 ? 1 
ATOM   1432 C C   . ASN   A 1 188 ? 32.200 -20.220 -6.797  1.000 51.607  0 188 ASN   A C   1 ? 1 
ATOM   1433 O O   . ASN   A 1 188 ? 30.988 -20.068 -6.690  1.000 50.434  0 188 ASN   A O   1 ? 1 
ATOM   1434 C CB  . ASN   A 1 188 ? 32.467 -18.286 -8.319  1.000 54.366  0 188 ASN   A CB  1 ? 1 
ATOM   1435 C CG  . ASN   A 1 188 ? 33.323 -17.081 -8.603  1.000 60.368  0 188 ASN   A CG  1 ? 1 
ATOM   1436 O OD1 . ASN   A 1 188 ? 34.006 -16.600 -7.701  1.000 67.353  0 188 ASN   A OD1 1 ? 1 
ATOM   1437 N ND2 . ASN   A 1 188 ? 33.376 -16.640 -9.848  1.000 63.654  0 188 ASN   A ND2 1 ? 1 
ATOM   1438 N N   . ILE   A 1 189 ? 32.788 -21.394 -6.588  1.000 48.167  0 189 ILE   A N   1 ? 1 
ATOM   1439 C CA  . ILE   A 1 189 ? 31.986 -22.478 -6.049  1.000 50.418  0 189 ILE   A CA  1 ? 1 
ATOM   1440 C C   . ILE   A 1 189 ? 31.588 -22.094 -4.610  1.000 61.657  0 189 ILE   A C   1 ? 1 
ATOM   1441 O O   . ILE   A 1 189 ? 32.433 -21.597 -3.851  1.000 64.699  0 189 ILE   A O   1 ? 1 
ATOM   1442 C CB  . ILE   A 1 189 ? 32.731 -23.827 -6.131  1.000 44.167  0 189 ILE   A CB  1 ? 1 
ATOM   1443 C CG1 . ILE   A 1 189 ? 33.084 -24.256 -7.544  1.000 48.536  0 189 ILE   A CG1 1 ? 1 
ATOM   1444 C CG2 . ILE   A 1 189 ? 31.955 -24.930 -5.423  1.000 44.076  0 189 ILE   A CG2 1 ? 1 
ATOM   1445 C CD1 . ILE   A 1 189 ? 34.190 -25.317 -7.605  1.000 49.111  0 189 ILE   A CD1 1 ? 1 
ATOM   1446 N N   . GLU   A 1 190 ? 30.312 -22.347 -4.242  1.000 66.300  0 190 GLU   A N   1 ? 1 
ATOM   1447 C CA  . GLU   A 1 190 ? 29.776 -21.950 -2.942  1.000 74.245  0 190 GLU   A CA  1 ? 1 
ATOM   1448 C C   . GLU   A 1 190 ? 29.660 -23.175 -2.050  1.000 60.967  0 190 GLU   A C   1 ? 1 
ATOM   1449 O O   . GLU   A 1 190 ? 30.228 -23.216 -0.983  1.000 68.556  0 190 GLU   A O   1 ? 1 
ATOM   1450 C CB  . GLU   A 1 190 ? 28.442 -21.202 -3.038  1.000 87.403  0 190 GLU   A CB  1 ? 1 
ATOM   1451 C CG  . GLU   A 1 190 ? 27.870 -20.720 -1.699  1.000 94.118  0 190 GLU   A CG  1 ? 1 
ATOM   1452 C CD  . GLU   A 1 190 ? 28.741 -19.903 -0.725  1.000 101.705 0 190 GLU   A CD  1 ? 1 
ATOM   1453 O OE1 . GLU   A 1 190 ? 29.845 -19.342 -1.047  1.000 88.660  0 190 GLU   A OE1 1 ? 1 
ATOM   1454 O OE2 . GLU   A 1 190 ? 28.266 -19.868 0.449   1.000 100.015 0 190 GLU   A OE2 1 ? 1 
ATOM   1455 N N   . LYS   A 1 191 ? 28.998 -24.202 -2.541  1.000 61.620  0 191 LYS   A N   1 ? 1 
ATOM   1456 C CA  . LYS   A 1 191 ? 28.920 -25.457 -1.823  1.000 63.466  0 191 LYS   A CA  1 ? 1 
ATOM   1457 C C   . LYS   A 1 191 ? 28.606 -26.605 -2.772  1.000 56.643  0 191 LYS   A C   1 ? 1 
ATOM   1458 O O   . LYS   A 1 191 ? 28.204 -26.418 -3.900  1.000 61.945  0 191 LYS   A O   1 ? 1 
ATOM   1459 C CB  . LYS   A 1 191 ? 27.717 -25.384 -0.891  1.000 73.363  0 191 LYS   A CB  1 ? 1 
ATOM   1460 C CG  . LYS   A 1 191 ? 26.490 -24.791 -1.609  1.000 78.328  0 191 LYS   A CG  1 ? 1 
ATOM   1461 C CD  . LYS   A 1 191 ? 25.123 -24.979 -0.941  1.000 83.789  0 191 LYS   A CD  1 ? 1 
ATOM   1462 C CE  . LYS   A 1 191 ? 24.048 -24.377 -1.807  1.000 88.634  0 191 LYS   A CE  1 ? 1 
ATOM   1463 N NZ  . LYS   A 1 191 ? 22.706 -24.592 -1.263  1.000 82.156  0 191 LYS   A NZ  1 ? 1 
ATOM   1464 N N   . ILE   A 1 192 ? 28.721 -27.800 -2.249  1.000 54.650  0 192 ILE   A N   1 ? 1 
ATOM   1465 C CA  . ILE   A 1 192 ? 28.433 -29.039 -2.940  1.000 58.085  0 192 ILE   A CA  1 ? 1 
ATOM   1466 C C   . ILE   A 1 192 ? 27.483 -29.839 -2.036  1.000 56.410  0 192 ILE   A C   1 ? 1 
ATOM   1467 O O   . ILE   A 1 192 ? 27.780 -29.964 -0.847  1.000 53.967  0 192 ILE   A O   1 ? 1 
ATOM   1468 C CB  . ILE   A 1 192 ? 29.735 -29.826 -3.242  1.000 51.484  0 192 ILE   A CB  1 ? 1 
ATOM   1469 C CG1 . ILE   A 1 192 ? 30.714 -28.992 -4.044  1.000 51.863  0 192 ILE   A CG1 1 ? 1 
ATOM   1470 C CG2 . ILE   A 1 192 ? 29.420 -31.145 -3.951  1.000 50.575  0 192 ILE   A CG2 1 ? 1 
ATOM   1471 C CD1 . ILE   A 1 192 ? 32.112 -29.586 -4.187  1.000 50.062  0 192 ILE   A CD1 1 ? 1 
ATOM   1472 N N   . GLU   A 1 193 ? 26.404 -30.402 -2.623  1.000 54.466  0 193 GLU   A N   1 ? 1 
ATOM   1473 C CA  . GLU   A 1 193 ? 25.430 -31.169 -1.872  1.000 56.641  0 193 GLU   A CA  1 ? 1 
ATOM   1474 C C   . GLU   A 1 193 ? 25.160 -32.443 -2.628  1.000 58.177  0 193 GLU   A C   1 ? 1 
ATOM   1475 O O   . GLU   A 1 193 ? 25.023 -32.428 -3.845  1.000 61.853  0 193 GLU   A O   1 ? 1 
ATOM   1476 C CB  . GLU   A 1 193 ? 24.083 -30.480 -1.654  1.000 58.955  0 193 GLU   A CB  1 ? 1 
ATOM   1477 C CG  . GLU   A 1 193 ? 24.229 -29.139 -0.948  1.000 67.669  0 193 GLU   A CG  1 ? 1 
ATOM   1478 C CD  . GLU   A 1 193 ? 23.024 -28.196 -0.892  1.000 79.654  0 193 GLU   A CD  1 ? 1 
ATOM   1479 O OE1 . GLU   A 1 193 ? 22.487 -27.754 -1.951  1.000 73.593  0 193 GLU   A OE1 1 ? 1 
ATOM   1480 O OE2 . GLU   A 1 193 ? 22.640 -27.882 0.273   1.000 87.892  0 193 GLU   A OE2 1 ? 1 
ATOM   1481 N N   . VAL   A 1 194 ? 25.092 -33.528 -1.866  1.000 57.560  0 194 VAL   A N   1 ? 1 
ATOM   1482 C CA  . VAL   A 1 194 ? 24.802 -34.847 -2.385  1.000 59.032  0 194 VAL   A CA  1 ? 1 
ATOM   1483 C C   . VAL   A 1 194 ? 23.669 -35.442 -1.555  1.000 57.384  0 194 VAL   A C   1 ? 1 
ATOM   1484 O O   . VAL   A 1 194 ? 23.700 -35.349 -0.355  1.000 53.737  0 194 VAL   A O   1 ? 1 
ATOM   1485 C CB  . VAL   A 1 194 ? 26.089 -35.710 -2.326  1.000 58.932  0 194 VAL   A CB  1 ? 1 
ATOM   1486 C CG1 . VAL   A 1 194 ? 25.920 -37.064 -3.010  1.000 59.393  0 194 VAL   A CG1 1 ? 1 
ATOM   1487 C CG2 . VAL   A 1 194 ? 27.294 -34.968 -2.900  1.000 54.650  0 194 VAL   A CG2 1 ? 1 
ATOM   1488 N N   . ASN   A 1 195 ? 22.735 -36.127 -2.202  1.000 69.904  0 195 ASN   A N   1 ? 1 
ATOM   1489 C CA  . ASN   A 1 195 ? 21.681 -36.861 -1.520  1.000 70.235  0 195 ASN   A CA  1 ? 1 
ATOM   1490 C C   . ASN   A 1 195 ? 21.715 -38.317 -1.931  1.000 66.367  0 195 ASN   A C   1 ? 1 
ATOM   1491 O O   . ASN   A 1 195 ? 21.204 -38.644 -2.982  1.000 75.684  0 195 ASN   A O   1 ? 1 
ATOM   1492 C CB  . ASN   A 1 195 ? 20.294 -36.469 -1.983  1.000 74.995  0 195 ASN   A CB  1 ? 1 
ATOM   1493 C CG  . ASN   A 1 195 ? 20.281 -35.021 -2.335  1.000 89.138  0 195 ASN   A CG  1 ? 1 
ATOM   1494 O OD1 . ASN   A 1 195 ? 20.378 -34.199 -1.419  1.000 89.484  0 195 ASN   A OD1 1 ? 1 
ATOM   1495 N ND2 . ASN   A 1 195 ? 20.235 -34.729 -3.632  1.000 103.702 0 195 ASN   A ND2 1 ? 1 
ATOM   1496 N N   . LEU   A 1 196 ? 22.359 -39.166 -1.141  1.000 63.608  0 196 LEU   A N   1 ? 1 
ATOM   1497 C CA  . LEU   A 1 196 ? 22.295 -40.598 -1.395  1.000 73.343  0 196 LEU   A CA  1 ? 1 
ATOM   1498 C C   . LEU   A 1 196 ? 20.961 -41.234 -0.870  1.000 81.830  0 196 LEU   A C   1 ? 1 
ATOM   1499 O O   . LEU   A 1 196 ? 20.298 -40.687 0.089   1.000 76.036  0 196 LEU   A O   1 ? 1 
ATOM   1500 C CB  . LEU   A 1 196 ? 23.545 -41.233 -0.779  1.000 70.135  0 196 LEU   A CB  1 ? 1 
ATOM   1501 C CG  . LEU   A 1 196 ? 24.892 -40.609 -1.150  1.000 65.563  0 196 LEU   A CG  1 ? 1 
ATOM   1502 C CD1 . LEU   A 1 196 ? 25.978 -41.355 -0.383  1.000 64.996  0 196 LEU   A CD1 1 ? 1 
ATOM   1503 C CD2 . LEU   A 1 196 ? 25.094 -40.696 -2.659  1.000 67.277  0 196 LEU   A CD2 1 ? 1 
ATOM   1504 O OXT . LEU   A 1 196 ? 20.614 -42.287 -1.435  1.000 80.642  0 196 LEU   A OXT 1 ? 1 
HETATM 1505 C C1  . GOL   B 2 .   ? 38.492 -35.896 -35.330 1.000 64.090  0 201 GOL   A C1  1 ? 1 
HETATM 1506 O O1  . GOL   B 2 .   ? 37.621 -36.864 -34.736 1.000 70.560  0 201 GOL   A O1  1 ? 1 
HETATM 1507 C C2  . GOL   B 2 .   ? 39.797 -35.906 -34.598 1.000 60.199  0 201 GOL   A C2  1 ? 1 
HETATM 1508 O O2  . GOL   B 2 .   ? 39.428 -36.019 -33.226 1.000 57.782  0 201 GOL   A O2  1 ? 1 
HETATM 1509 C C3  . GOL   B 2 .   ? 40.719 -37.049 -35.004 1.000 68.813  0 201 GOL   A C3  1 ? 1 
HETATM 1510 O O3  . GOL   B 2 .   ? 41.952 -36.599 -35.595 1.000 72.605  0 201 GOL   A O3  1 ? 1 
HETATM 1511 C C1  . MPD   C 3 .   ? 43.215 -21.277 -23.081 1.000 91.851  0 202 MPD   A C1  1 ? 1 
HETATM 1512 C C2  . MPD   C 3 .   ? 41.840 -21.950 -23.137 1.000 93.642  0 202 MPD   A C2  1 ? 1 
HETATM 1513 O O2  . MPD   C 3 .   ? 41.967 -23.342 -23.411 1.000 86.024  0 202 MPD   A O2  1 ? 1 
HETATM 1514 C CM  . MPD   C 3 .   ? 40.979 -21.324 -24.230 1.000 94.836  0 202 MPD   A CM  1 ? 1 
HETATM 1515 C C3  . MPD   C 3 .   ? 41.141 -22.049 -21.773 1.000 88.918  0 202 MPD   A C3  1 ? 1 
HETATM 1516 C C4  . MPD   C 3 .   ? 39.950 -23.034 -21.728 1.000 81.913  0 202 MPD   A C4  1 ? 1 
HETATM 1517 O O4  . MPD   C 3 .   ? 40.449 -24.349 -21.526 1.000 61.663  0 202 MPD   A O4  1 ? 1 
HETATM 1518 C C5  . MPD   C 3 .   ? 38.800 -22.725 -20.767 1.000 69.934  0 202 MPD   A C5  1 ? 1 
HETATM 1519 C C1  . GOL   D 2 .   ? 49.108 -46.226 -11.872 1.000 85.307  0 203 GOL   A C1  1 ? 1 
HETATM 1520 O O1  . GOL   D 2 .   ? 48.436 -46.372 -10.620 1.000 73.370  0 203 GOL   A O1  1 ? 1 
HETATM 1521 C C2  . GOL   D 2 .   ? 50.445 -45.502 -11.741 1.000 99.391  0 203 GOL   A C2  1 ? 1 
HETATM 1522 O O2  . GOL   D 2 .   ? 51.443 -46.389 -11.206 1.000 87.407  0 203 GOL   A O2  1 ? 1 
HETATM 1523 C C3  . GOL   D 2 .   ? 50.919 -44.856 -13.052 1.000 97.994  0 203 GOL   A C3  1 ? 1 
HETATM 1524 O O3  . GOL   D 2 .   ? 51.822 -43.732 -12.934 1.000 65.600  0 203 GOL   A O3  1 ? 1 
HETATM 1525 C C1  . SIA   E 4 .   ? 22.417 -28.748 -14.627 1.000 61.533  0 204 SIA   A C1  1 ? ? 
HETATM 1526 C C2  . SIA   E 4 .   ? 21.827 -28.053 -15.871 1.000 55.002  0 204 SIA   A C2  1 ? ? 
HETATM 1527 C C3  . SIA   E 4 .   ? 20.941 -26.900 -15.437 1.000 39.744  0 204 SIA   A C3  1 ? ? 
HETATM 1528 C C4  . SIA   E 4 .   ? 21.766 -25.813 -14.817 1.000 44.247  0 204 SIA   A C4  1 ? ? 
HETATM 1529 C C5  . SIA   E 4 .   ? 22.901 -25.478 -15.791 1.000 46.026  0 204 SIA   A C5  1 ? ? 
HETATM 1530 C C6  . SIA   E 4 .   ? 23.726 -26.736 -16.050 1.000 51.169  0 204 SIA   A C6  1 ? ? 
HETATM 1531 C C7  . SIA   E 4 .   ? 24.968 -26.519 -16.885 1.000 45.763  0 204 SIA   A C7  1 ? ? 
HETATM 1532 C C8  . SIA   E 4 .   ? 25.539 -27.834 -17.423 1.000 40.923  0 204 SIA   A C8  1 ? ? 
HETATM 1533 C C9  . SIA   E 4 .   ? 26.869 -27.728 -18.151 1.000 34.296  0 204 SIA   A C9  1 ? ? 
HETATM 1534 C C10 . SIA   E 4 .   ? 24.205 -23.336 -15.818 1.000 54.520  0 204 SIA   A C10 1 ? ? 
HETATM 1535 C C11 . SIA   E 4 .   ? 24.095 -23.219 -17.306 1.000 55.359  0 204 SIA   A C11 1 ? ? 
HETATM 1536 N N5  . SIA   E 4 .   ? 23.758 -24.445 -15.231 1.000 50.747  0 204 SIA   A N5  1 ? ? 
HETATM 1537 O O1A . SIA   E 4 .   ? 23.455 -29.405 -14.652 1.000 50.626  0 204 SIA   A O1A 1 ? ? 
HETATM 1538 O O1B . SIA   E 4 .   ? 21.803 -28.655 -13.640 1.000 56.665  0 204 SIA   A O1B 1 ? ? 
HETATM 1539 O O4  . SIA   E 4 .   ? 20.959 -24.671 -14.467 1.000 39.000  0 204 SIA   A O4  1 ? ? 
HETATM 1540 O O6  . SIA   E 4 .   ? 22.884 -27.669 -16.772 1.000 46.538  0 204 SIA   A O6  1 ? ? 
HETATM 1541 O O7  . SIA   E 4 .   ? 24.557 -25.708 -17.975 1.000 54.620  0 204 SIA   A O7  1 ? ? 
HETATM 1542 O O8  . SIA   E 4 .   ? 25.709 -28.687 -16.317 1.000 46.521  0 204 SIA   A O8  1 ? ? 
HETATM 1543 O O9  . SIA   E 4 .   ? 27.401 -29.024 -18.510 1.000 31.189  0 204 SIA   A O9  1 ? ? 
HETATM 1544 O O10 . SIA   E 4 .   ? 24.747 -22.457 -15.139 1.000 57.159  0 204 SIA   A O10 1 ? ? 
HETATM 1545 C C10 . A1AUS F 5 .   ? 21.769 -30.481 -16.946 1.000 41.219  0 205 A1AUS A C10 1 ? ? 
HETATM 1546 C C11 . A1AUS F 5 .   ? 21.251 -31.567 -16.079 1.000 35.956  0 205 A1AUS A C11 1 ? ? 
HETATM 1547 C C15 . A1AUS F 5 .   ? 21.368 -33.944 -15.628 1.000 36.111  0 205 A1AUS A C15 1 ? ? 
HETATM 1548 C C02 . A1AUS F 5 .   ? 20.969 -32.276 -20.867 1.000 64.233  0 205 A1AUS A C02 1 ? ? 
HETATM 1549 C C03 . A1AUS F 5 .   ? 21.230 -33.094 -21.887 1.000 63.688  0 205 A1AUS A C03 1 ? ? 
HETATM 1550 C C06 . A1AUS F 5 .   ? 20.300 -33.411 -23.112 1.000 60.414  0 205 A1AUS A C06 1 ? ? 
HETATM 1551 C C08 . A1AUS F 5 .   ? 22.340 -31.785 -18.801 1.000 51.582  0 205 A1AUS A C08 1 ? ? 
HETATM 1552 N N01 . A1AUS F 5 .   ? 22.041 -32.270 -20.079 1.000 61.237  0 205 A1AUS A N01 1 ? ? 
HETATM 1553 N N04 . A1AUS F 5 .   ? 22.430 -33.626 -21.722 1.000 53.345  0 205 A1AUS A N04 1 ? ? 
HETATM 1554 O O18 . A1AUS F 5 .   ? 22.206 -29.479 -19.056 1.000 55.030  0 205 A1AUS A O18 1 ? ? 
HETATM 1555 C C09 . A1AUS F 5 .   ? 21.594 -30.640 -18.438 1.000 50.773  0 205 A1AUS A C09 1 ? ? 
HETATM 1556 O O17 . A1AUS F 5 .   ? 21.199 -29.164 -16.559 1.000 34.022  0 205 A1AUS A O17 1 ? ? 
HETATM 1557 O O12 . A1AUS F 5 .   ? 19.914 -31.464 -16.131 1.000 43.581  0 205 A1AUS A O12 1 ? ? 
HETATM 1558 C C13 . A1AUS F 5 .   ? 21.823 -32.797 -16.512 1.000 37.251  0 205 A1AUS A C13 1 ? ? 
HETATM 1559 O O16 . A1AUS F 5 .   ? 22.083 -35.254 -16.012 1.000 39.630  0 205 A1AUS A O16 1 ? ? 
HETATM 1560 O O14 . A1AUS F 5 .   ? 21.658 -32.988 -18.003 1.000 49.526  0 205 A1AUS A O14 1 ? ? 
HETATM 1561 N N05 . A1AUS F 5 .   ? 22.898 -33.106 -20.598 1.000 72.590  0 205 A1AUS A N05 1 ? ? 
HETATM 1562 O O07 . A1AUS F 5 .   ? 19.335 -32.392 -23.311 1.000 53.412  0 205 A1AUS A O07 1 ? ? 
HETATM 1563 O O   . HOH   G 6 .   ? 46.258 -29.012 -36.204 1.000 34.377  0 301 HOH   A O   1 ? ? 
HETATM 1564 O O   . HOH   G 6 .   ? 24.917 -27.319 -4.142  1.000 61.849  0 302 HOH   A O   1 ? ? 
HETATM 1565 O O   . HOH   G 6 .   ? 54.052 -42.984 -13.409 1.000 54.004  0 303 HOH   A O   1 ? ? 
HETATM 1566 O O   . HOH   G 6 .   ? 35.323 -33.121 -24.370 1.000 25.018  0 304 HOH   A O   1 ? ? 
HETATM 1567 O O   . HOH   G 6 .   ? 53.518 -33.876 -16.427 1.000 33.953  0 305 HOH   A O   1 ? ? 
HETATM 1568 O O   . HOH   G 6 .   ? 22.534 -35.825 -22.721 1.000 66.710  0 306 HOH   A O   1 ? ? 
HETATM 1569 O O   . HOH   G 6 .   ? 38.018 -49.742 -11.956 1.000 53.949  0 307 HOH   A O   1 ? ? 
HETATM 1570 O O   . HOH   G 6 .   ? 37.946 -39.825 -20.115 1.000 35.120  0 308 HOH   A O   1 ? ? 
HETATM 1571 O O   . HOH   G 6 .   ? 41.110 -35.695 -20.248 1.000 20.907  0 309 HOH   A O   1 ? ? 
HETATM 1572 O O   . HOH   G 6 .   ? 41.990 -29.611 -15.794 1.000 25.183  0 310 HOH   A O   1 ? ? 
HETATM 1573 O O   . HOH   G 6 .   ? 33.727 -37.346 -14.579 1.000 29.470  0 311 HOH   A O   1 ? ? 
HETATM 1574 O O   . HOH   G 6 .   ? 42.938 -29.373 -36.348 1.000 48.658  0 312 HOH   A O   1 ? ? 
HETATM 1575 O O   . HOH   G 6 .   ? 43.806 -38.102 -34.709 1.000 65.375  0 313 HOH   A O   1 ? ? 
HETATM 1576 O O   . HOH   G 6 .   ? 50.512 -37.803 -21.082 1.000 75.232  0 314 HOH   A O   1 ? ? 
HETATM 1577 O O   . HOH   G 6 .   ? 54.278 -29.501 -16.019 1.000 47.518  0 315 HOH   A O   1 ? ? 
HETATM 1578 O O   . HOH   G 6 .   ? 49.623 -21.279 -28.654 1.000 38.357  0 316 HOH   A O   1 ? ? 
HETATM 1579 O O   . HOH   G 6 .   ? 46.392 -22.066 -23.532 1.000 40.796  0 317 HOH   A O   1 ? ? 
HETATM 1580 O O   . HOH   G 6 .   ? 20.714 -40.591 -10.273 1.000 58.102  0 318 HOH   A O   1 ? ? 
HETATM 1581 O O   . HOH   G 6 .   ? 58.490 -33.671 -16.744 1.000 85.048  0 319 HOH   A O   1 ? ? 
HETATM 1582 O O   . HOH   G 6 .   ? 42.290 -47.132 -16.391 1.000 50.147  0 320 HOH   A O   1 ? ? 
HETATM 1583 O O   . HOH   G 6 .   ? 45.897 -21.738 -26.378 1.000 36.442  0 321 HOH   A O   1 ? ? 
HETATM 1584 O O   . HOH   G 6 .   ? 52.689 -24.967 -21.869 1.000 35.588  0 322 HOH   A O   1 ? ? 
HETATM 1585 O O   . HOH   G 6 .   ? 52.399 -32.253 -24.233 1.000 51.108  0 323 HOH   A O   1 ? ? 
HETATM 1586 O O   . HOH   G 6 .   ? 21.907 -22.818 -12.860 1.000 48.610  0 324 HOH   A O   1 ? ? 
HETATM 1587 O O   . HOH   G 6 .   ? 29.639 -28.354 -23.565 1.000 50.156  0 325 HOH   A O   1 ? ? 
HETATM 1588 O O   . HOH   G 6 .   ? 49.874 -19.773 -1.689  1.000 72.776  0 326 HOH   A O   1 ? ? 
HETATM 1589 O O   . HOH   G 6 .   ? 42.636 -33.370 -9.298  1.000 41.194  0 327 HOH   A O   1 ? ? 
HETATM 1590 O O   . HOH   G 6 .   ? 31.192 -34.269 3.564   1.000 33.814  0 328 HOH   A O   1 ? ? 
HETATM 1591 O O   . HOH   G 6 .   ? 37.763 -27.720 -21.641 1.000 31.760  0 329 HOH   A O   1 ? ? 
HETATM 1592 O O   . HOH   G 6 .   ? 47.091 -25.161 -11.934 1.000 31.133  0 330 HOH   A O   1 ? ? 
HETATM 1593 O O   . HOH   G 6 .   ? 57.909 -39.865 -22.467 1.000 62.894  0 331 HOH   A O   1 ? ? 
HETATM 1594 O O   . HOH   G 6 .   ? 42.437 -44.111 -16.033 1.000 37.859  0 332 HOH   A O   1 ? ? 
HETATM 1595 O O   . HOH   G 6 .   ? 15.746 -46.481 9.753   1.000 50.977  0 333 HOH   A O   1 ? ? 
HETATM 1596 O O   . HOH   G 6 .   ? 43.718 -19.950 -14.412 1.000 40.960  0 334 HOH   A O   1 ? ? 
HETATM 1597 O O   . HOH   G 6 .   ? 31.255 -48.000 -2.387  1.000 47.503  0 335 HOH   A O   1 ? ? 
HETATM 1598 O O   . HOH   G 6 .   ? 35.519 -38.683 -16.548 1.000 40.083  0 336 HOH   A O   1 ? ? 
HETATM 1599 O O   . HOH   G 6 .   ? 39.079 -43.444 -8.884  1.000 32.481  0 337 HOH   A O   1 ? ? 
HETATM 1600 O O   . HOH   G 6 .   ? 27.040 -27.941 -21.665 1.000 47.596  0 338 HOH   A O   1 ? ? 
HETATM 1601 O O   . HOH   G 6 .   ? 18.094 -41.428 -16.580 1.000 48.545  0 339 HOH   A O   1 ? ? 
HETATM 1602 O O   . HOH   G 6 .   ? 34.010 -20.052 1.747   1.000 65.391  0 340 HOH   A O   1 ? ? 
HETATM 1603 O O   . HOH   G 6 .   ? 45.269 -34.143 -7.945  1.000 34.517  0 341 HOH   A O   1 ? ? 
HETATM 1604 O O   . HOH   G 6 .   ? 48.542 -21.309 -26.135 1.000 39.248  0 342 HOH   A O   1 ? ? 
HETATM 1605 O O   . HOH   G 6 .   ? 21.639 -26.754 -19.167 1.000 56.901  0 343 HOH   A O   1 ? ? 
HETATM 1606 O O   . HOH   G 6 .   ? 46.371 -21.194 -20.191 1.000 43.422  0 344 HOH   A O   1 ? ? 
HETATM 1607 O O   . HOH   G 6 .   ? 39.661 -29.911 -14.327 1.000 24.824  0 345 HOH   A O   1 ? ? 
HETATM 1608 O O   . HOH   G 6 .   ? 41.257 -39.087 -5.416  1.000 55.011  0 346 HOH   A O   1 ? ? 
HETATM 1609 O O   . HOH   G 6 .   ? 24.552 -35.669 -14.769 1.000 33.430  0 347 HOH   A O   1 ? ? 
HETATM 1610 O O   . HOH   G 6 .   ? 47.917 -37.620 -11.152 1.000 32.651  0 348 HOH   A O   1 ? ? 
HETATM 1611 O O   . HOH   G 6 .   ? 29.160 -17.312 -8.826  1.000 57.868  0 349 HOH   A O   1 ? ? 
HETATM 1612 O O   . HOH   G 6 .   ? 43.339 -23.604 -12.945 1.000 37.496  0 350 HOH   A O   1 ? ? 
HETATM 1613 O O   . HOH   G 6 .   ? 41.993 -27.513 -34.945 1.000 47.295  0 351 HOH   A O   1 ? ? 
HETATM 1614 O O   . HOH   G 6 .   ? 32.267 -20.040 -13.317 1.000 41.492  0 352 HOH   A O   1 ? ? 
HETATM 1615 O O   . HOH   G 6 .   ? 25.760 -37.946 -14.900 1.000 36.267  0 353 HOH   A O   1 ? ? 
HETATM 1616 O O   . HOH   G 6 .   ? 38.936 -40.731 -2.634  1.000 54.999  0 354 HOH   A O   1 ? ? 
HETATM 1617 O O   . HOH   G 6 .   ? 31.716 -36.502 3.183   1.000 32.034  0 355 HOH   A O   1 ? ? 
HETATM 1618 O O   . HOH   G 6 .   ? 33.172 -32.026 -23.375 1.000 28.710  0 356 HOH   A O   1 ? ? 
HETATM 1619 O O   . HOH   G 6 .   ? 34.537 -25.345 -22.244 1.000 58.481  0 357 HOH   A O   1 ? ? 
HETATM 1620 O O   . HOH   G 6 .   ? 38.463 -38.420 -4.559  1.000 48.510  0 358 HOH   A O   1 ? ? 
HETATM 1621 O O   . HOH   G 6 .   ? 45.806 -15.707 -9.985  1.000 60.135  0 359 HOH   A O   1 ? ? 
HETATM 1622 O O   . HOH   G 6 .   ? 28.667 -22.273 -17.323 1.000 52.531  0 360 HOH   A O   1 ? ? 
HETATM 1623 O O   . HOH   G 6 .   ? 32.988 -29.204 -23.316 1.000 42.602  0 361 HOH   A O   1 ? ? 
HETATM 1624 O O   . HOH   G 6 .   ? 34.954 -35.836 -33.890 1.000 51.666  0 362 HOH   A O   1 ? ? 
HETATM 1625 O O   . HOH   G 6 .   ? 38.276 -30.126 -22.354 1.000 26.035  0 363 HOH   A O   1 ? ? 
HETATM 1626 O O   . HOH   G 6 .   ? 12.061 -47.892 3.053   1.000 69.692  0 364 HOH   A O   1 ? ? 
HETATM 1627 O O   . HOH   G 6 .   ? 53.999 -19.320 -3.999  1.000 74.196  0 365 HOH   A O   1 ? ? 
HETATM 1628 O O   . HOH   G 6 .   ? 46.057 -34.148 -31.542 1.000 47.487  0 366 HOH   A O   1 ? ? 
HETATM 1629 O O   . HOH   G 6 .   ? 32.859 -24.148 -20.155 1.000 40.219  0 367 HOH   A O   1 ? ? 
HETATM 1630 O O   . HOH   G 6 .   ? 46.164 -16.748 -29.575 1.000 38.790  0 368 HOH   A O   1 ? ? 
HETATM 1631 O O   . HOH   G 6 .   ? 20.091 -51.255 -4.027  1.000 59.925  0 369 HOH   A O   1 ? ? 
HETATM 1632 O O   . HOH   G 6 .   ? 49.329 -26.318 -11.047 1.000 37.513  0 370 HOH   A O   1 ? ? 
HETATM 1633 O O   . HOH   G 6 .   ? 17.986 -25.128 -14.017 1.000 65.637  0 371 HOH   A O   1 ? ? 
HETATM 1634 O O   . HOH   G 6 .   ? 30.771 -27.247 -29.791 1.000 64.710  0 372 HOH   A O   1 ? ? 
HETATM 1635 O O   . HOH   G 6 .   ? 49.402 -23.297 -8.526  1.000 52.616  0 373 HOH   A O   1 ? ? 
HETATM 1636 O O   . HOH   G 6 .   ? 50.654 -24.090 -12.532 1.000 47.861  0 374 HOH   A O   1 ? ? 
HETATM 1637 O O   . HOH   G 6 .   ? 55.270 -22.227 -17.437 1.000 53.198  0 375 HOH   A O   1 ? ? 
HETATM 1638 O O   . HOH   G 6 .   ? 56.537 -35.521 -16.891 1.000 57.740  0 376 HOH   A O   1 ? ? 
HETATM 1639 O O   . HOH   G 6 .   ? 43.388 -30.865 -14.079 1.000 48.347  0 377 HOH   A O   1 ? ? 
HETATM 1640 O O   . HOH   G 6 .   ? 21.482 -37.207 -20.712 0.500 44.845  0 378 HOH   A O   1 ? ? 
HETATM 1641 O O   . HOH   G 6 .   ? 27.556 -39.085 -23.434 1.000 39.944  0 379 HOH   A O   1 ? ? 
HETATM 1642 O O   . HOH   G 6 .   ? 37.617 -25.174 -22.950 1.000 64.303  0 380 HOH   A O   1 ? ? 
HETATM 1643 O O   . HOH   G 6 .   ? 23.076 -47.536 -14.985 1.000 51.050  0 381 HOH   A O   1 ? ? 
HETATM 1644 O O   . HOH   G 6 .   ? 13.719 -44.825 -6.913  1.000 63.117  0 382 HOH   A O   1 ? ? 
HETATM 1645 O O   . HOH   G 6 .   ? 32.802 -31.234 -35.405 1.000 59.817  0 383 HOH   A O   1 ? ? 
HETATM 1646 O O   . HOH   G 6 .   ? 55.476 -40.853 -23.519 1.000 54.508  0 384 HOH   A O   1 ? ? 
HETATM 1647 O O   . HOH   G 6 .   ? 26.799 -41.339 -20.102 1.000 40.860  0 385 HOH   A O   1 ? ? 
HETATM 1648 O O   . HOH   G 6 .   ? 42.904 -47.405 -9.114  1.000 67.035  0 386 HOH   A O   1 ? ? 
HETATM 1649 O O   . HOH   G 6 .   ? 61.176 -39.283 -21.652 1.000 61.065  0 387 HOH   A O   1 ? ? 
HETATM 1650 O O   . HOH   G 6 .   ? 54.217 -29.708 -27.864 1.000 45.452  0 388 HOH   A O   1 ? ? 
HETATM 1651 O O   . HOH   G 6 .   ? 46.085 -37.910 -32.582 1.000 64.023  0 389 HOH   A O   1 ? ? 
HETATM 1652 O O   . HOH   G 6 .   ? 12.079 -41.174 -4.783  1.000 53.912  0 390 HOH   A O   1 ? ? 
HETATM 1653 O O   . HOH   G 6 .   ? 18.991 -30.393 -5.086  1.000 70.089  0 391 HOH   A O   1 ? ? 
HETATM 1654 O O   . HOH   G 6 .   ? 28.484 -28.049 -28.306 1.000 66.600  0 392 HOH   A O   1 ? ? 
HETATM 1655 O O   . HOH   G 6 .   ? 27.008 -27.897 -24.851 1.000 63.391  0 393 HOH   A O   1 ? ? 
HETATM 1656 O O   . HOH   G 6 .   ? 57.285 -42.120 -23.417 1.000 59.932  0 394 HOH   A O   1 ? ? 
HETATM 1657 O O   . HOH   G 6 .   ? 20.799 -22.839 -17.999 1.000 67.729  0 395 HOH   A O   1 ? ? 
HETATM 1658 O O   . HOH   G 6 .   ? 38.732 -45.790 -26.437 1.000 70.975  0 396 HOH   A O   1 ? ? 
HETATM 1659 O O   . HOH   G 6 .   ? 51.975 -19.585 -15.733 1.000 55.060  0 397 HOH   A O   1 ? ? 
HETATM 1660 O O   . HOH   G 6 .   ? 22.729 -39.367 -20.712 0.500 45.015  0 398 HOH   A O   1 ? ? 
HETATM 1661 O O   . HOH   G 6 .   ? 25.785 -54.307 -6.952  1.000 58.985  0 399 HOH   A O   1 ? ? 
HETATM 1662 O O   . HOH   G 6 .   ? 52.821 -32.769 -31.928 1.000 51.717  0 400 HOH   A O   1 ? ? 
HETATM 1663 O O   . HOH   G 6 .   ? 12.945 -50.374 3.195   1.000 73.846  0 401 HOH   A O   1 ? ? 
HETATM 1664 O O   . HOH   G 6 .   ? 6.960  -41.003 -4.947  1.000 61.372  0 402 HOH   A O   1 ? ? 
HETATM 1665 O O   . HOH   G 6 .   ? 6.842  -40.915 -2.287  1.000 61.372  0 403 HOH   A O   1 ? ? 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.pdbx_PDB_ins_code 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1    N N   . ALA A 9   ? 0.99644506 1.11524880 0.62839413 -0.39202568 -0.05349552 0.11566804  9   ALA A N   
2    C CA  . ALA A 9   ? 0.96302092 1.11353028 0.62446415 -0.37171498 -0.05056489 0.11524831  9   ALA A CA  
3    C C   . ALA A 9   ? 0.91972470 1.08237767 0.60988742 -0.34967911 -0.04873931 0.11453280  9   ALA A C   
4    O O   . ALA A 9   ? 0.95446765 1.10795677 0.65946692 -0.33088645 -0.04225912 0.10833971  9   ALA A O   
5    C CB  . ALA A 9   ? 0.79086089 0.98998803 0.45832145 -0.38051644 -0.05644401 0.12480198  9   ALA A CB  
6    N N   . THR A 10  ? 0.87550473 1.05744457 0.57104051 -0.35386923 -0.05439136 0.12081293  10  THR A N   
7    C CA  . THR A 10  ? 0.88324475 1.07170773 0.60050160 -0.33698803 -0.05310914 0.12010399  10  THR A CA  
8    C C   . THR A 10  ? 0.93468273 1.07899630 0.64938474 -0.32691297 -0.04762026 0.11268121  10  THR A C   
9    O O   . THR A 10  ? 0.90656626 1.05127263 0.64149332 -0.30768311 -0.04314492 0.10901738  10  THR A O   
10   C CB  . THR A 10  ? 0.85544038 1.06640589 0.57303721 -0.34705713 -0.06011969 0.12793572  10  THR A CB  
11   O OG1 . THR A 10  ? 0.85977960 1.11773276 0.59030116 -0.34691885 -0.06207544 0.13468027  10  THR A OG1 
12   C CG2 . THR A 10  ? 0.84724265 1.05876637 0.58183396 -0.33341143 -0.05934399 0.12712659  10  THR A CG2 
13   N N   . GLN A 11  ? 0.96813214 1.07440138 0.65725750 -0.34002045 -0.04728616 0.11102142  11  GLN A N   
14   C CA  . GLN A 11  ? 1.05657244 1.11910892 0.74196446 -0.33013600 -0.04068167 0.10549429  11  GLN A CA  
15   C C   . GLN A 11  ? 0.91964591 0.97300917 0.61569118 -0.31385374 -0.03235617 0.09831996  11  GLN A C   
16   O O   . GLN A 11  ? 0.89582860 0.93382573 0.60563624 -0.29696909 -0.02700350 0.09533209  11  GLN A O   
17   C CB  . GLN A 11  ? 1.21921444 1.23618543 0.87085027 -0.34628266 -0.03844399 0.10363013  11  GLN A CB  
18   C CG  . GLN A 11  ? 1.33797693 1.34881699 0.97221774 -0.36391395 -0.04535265 0.10990445  11  GLN A CG  
19   C CD  . GLN A 11  ? 1.51117218 1.50311971 1.10862517 -0.39061147 -0.04753298 0.11044373  11  GLN A CD  
20   O OE1 . GLN A 11  ? 1.92587602 1.90479767 1.50740719 -0.39752221 -0.04354049 0.10586485  11  GLN A OE1 
21   N NE2 . GLN A 11  ? 1.52921510 1.52575946 1.11288679 -0.40814814 -0.05508357 0.11690424  11  GLN A NE2 
22   N N   . ASP A 12  ? 0.86413836 0.92736274 0.55195493 -0.32118857 -0.03186383 0.09671060  12  ASP A N   
23   C CA  . ASP A 12  ? 0.88440681 0.93631411 0.57640791 -0.31002498 -0.02416792 0.08984669  12  ASP A CA  
24   C C   . ASP A 12  ? 0.78894305 0.86968303 0.51251143 -0.28949216 -0.02288293 0.08943955  12  ASP A C   
25   O O   . ASP A 12  ? 0.81462657 0.88031846 0.54917628 -0.27384463 -0.01612917 0.08417249  12  ASP A O   
26   C CB  . ASP A 12  ? 0.99577820 1.05725968 0.67272156 -0.32382235 -0.02533977 0.08986019  12  ASP A CB  
27   C CG  . ASP A 12  ? 1.14069581 1.16840172 0.78085911 -0.34624609 -0.02480611 0.08827755  12  ASP A CG  
28   O OD1 . ASP A 12  ? 1.08206618 1.06754684 0.70769376 -0.34638995 -0.01972709 0.08454499  12  ASP A OD1 
29   O OD2 . ASP A 12  ? 1.01734471 1.06219363 0.64350009 -0.36362445 -0.02937450 0.09168674  12  ASP A OD2 
30   N N   . LEU A 13  ? 0.67486125 0.79605776 0.41061497 -0.29102203 -0.02890582 0.09545162  13  LEU A N   
31   C CA  . LEU A 13  ? 0.66661739 0.81627351 0.42852616 -0.27420920 -0.02773091 0.09585715  13  LEU A CA  
32   C C   . LEU A 13  ? 0.65962130 0.79711163 0.43489987 -0.26137173 -0.02584285 0.09403536  13  LEU A C   
33   O O   . LEU A 13  ? 0.67496037 0.81127012 0.46529227 -0.24598776 -0.02086825 0.08994626  13  LEU A O   
34   C CB  . LEU A 13  ? 0.69230175 0.88367087 0.46141118 -0.27932030 -0.03331473 0.10358251  13  LEU A CB  
35   C CG  . LEU A 13  ? 0.67956126 0.89729917 0.44770581 -0.28409547 -0.03409589 0.10745895  13  LEU A CG  
36   C CD1 . LEU A 13  ? 0.68543947 0.94676518 0.46326530 -0.28713632 -0.03850066 0.11698660  13  LEU A CD1 
37   C CD2 . LEU A 13  ? 0.79558957 1.01452601 0.57687938 -0.26770955 -0.02751971 0.10255439  13  LEU A CD2 
38   N N   . SER A 14  ? 0.63972896 0.76686311 0.40860140 -0.26839727 -0.02983226 0.09752947  14  SER A N   
39   C CA  . SER A 14  ? 0.69889498 0.81755340 0.48113662 -0.25706759 -0.02886265 0.09764519  14  SER A CA  
40   C C   . SER A 14  ? 0.67333221 0.75758302 0.45482948 -0.24754494 -0.02178181 0.09292367  14  SER A C   
41   O O   . SER A 14  ? 0.60399592 0.68788052 0.40246457 -0.23366149 -0.01899552 0.09219661  14  SER A O   
42   C CB  . SER A 14  ? 0.77223289 0.89116424 0.54963350 -0.26624137 -0.03529957 0.10385965  14  SER A CB  
43   O OG  . SER A 14  ? 0.78136796 0.86332095 0.54259241 -0.27193546 -0.03419578 0.10423629  14  SER A OG  
44   N N   . GLU A 15  ? 0.70975196 0.76508909 0.47111624 -0.25512803 -0.01815842 0.08997332  15  GLU A N   
45   C CA  . GLU A 15  ? 0.78022611 0.80306256 0.54161489 -0.24428840 -0.00949366 0.08564709  15  GLU A CA  
46   C C   . GLU A 15  ? 0.68114626 0.71672148 0.45959604 -0.23021083 -0.00450644 0.08074667  15  GLU A C   
47   O O   . GLU A 15  ? 0.62871444 0.65583587 0.42104310 -0.21623868 0.00050906  0.07961436  15  GLU A O   
48   C CB  . GLU A 15  ? 0.82337189 0.80885088 0.55642617 -0.25546053 -0.00459140 0.08232180  15  GLU A CB  
49   C CG  . GLU A 15  ? 0.86289787 0.81114328 0.59516573 -0.24311121 0.00606722  0.07901498  15  GLU A CG  
50   C CD  . GLU A 15  ? 0.97742927 0.92524958 0.71928704 -0.23098905 0.01387532  0.07263508  15  GLU A CD  
51   O OE1 . GLU A 15  ? 0.82999539 0.78657228 0.56319129 -0.23821454 0.01378404  0.06838615  15  GLU A OE1 
52   O OE2 . GLU A 15  ? 1.08006358 1.02056146 0.83890986 -0.21442193 0.01981172  0.07289612  15  GLU A OE2 
53   N N   . TYR A 16  ? 0.65603346 0.71476048 0.43402740 -0.23441692 -0.00644088 0.07918675  16  TYR A N   
54   C CA  . TYR A 16  ? 0.66857040 0.73784840 0.45871764 -0.22333401 -0.00183458 0.07465225  16  TYR A CA  
55   C C   . TYR A 16  ? 0.61102355 0.70148528 0.42466646 -0.21026097 -0.00280414 0.07611475  16  TYR A C   
56   O O   . TYR A 16  ? 0.54980749 0.63232780 0.37485418 -0.19832203 0.00211274  0.07349596  16  TYR A O   
57   C CB  . TYR A 16  ? 0.67799330 0.76780581 0.46142322 -0.23144236 -0.00401903 0.07465003  16  TYR A CB  
58   C CG  . TYR A 16  ? 0.64841449 0.74675971 0.44317389 -0.21988231 0.00103218  0.07031466  16  TYR A CG  
59   C CD1 . TYR A 16  ? 0.63169730 0.70557177 0.42005044 -0.21645483 0.00815867  0.06426761  16  TYR A CD1 
60   C CD2 . TYR A 16  ? 0.57167047 0.70016634 0.38273144 -0.21193905 -0.00042020 0.07223970  16  TYR A CD2 
61   C CE1 . TYR A 16  ? 0.64996427 0.73189139 0.44810683 -0.20674680 0.01236393  0.06065794  16  TYR A CE1 
62   C CE2 . TYR A 16  ? 0.57561630 0.70975029 0.39558357 -0.20170406 0.00428192  0.06864300  16  TYR A CE2 
63   C CZ  . TYR A 16  ? 0.62312150 0.73490822 0.43713409 -0.19936605 0.01013830  0.06296588  16  TYR A CZ  
64   O OH  . TYR A 16  ? 0.54102457 0.65885931 0.36330190 -0.18997611 0.01448972  0.05967378  16  TYR A OH  
65   N N   . TYR A 17  ? 0.64174688 0.75785339 0.46080768 -0.21391380 -0.00895325 0.08074185  17  TYR A N   
66   C CA  . TYR A 17  ? 0.60934198 0.74509603 0.44655338 -0.20396653 -0.00944208 0.08162323  17  TYR A CA  
67   C C   . TYR A 17  ? 0.56442916 0.68905091 0.40967029 -0.19936515 -0.01034566 0.08422582  17  TYR A C   
68   O O   . TYR A 17  ? 0.58552712 0.72052979 0.44470608 -0.19115542 -0.00973266 0.08431727  17  TYR A O   
69   C CB  . TYR A 17  ? 0.55126798 0.71662509 0.38911995 -0.20938770 -0.01369762 0.08529490  17  TYR A CB  
70   C CG  . TYR A 17  ? 0.57674330 0.75681406 0.41431379 -0.20745511 -0.01082803 0.08360571  17  TYR A CG  
71   C CD1 . TYR A 17  ? 0.52811873 0.71493858 0.37690210 -0.19506694 -0.00563788 0.07994579  17  TYR A CD1 
72   C CD2 . TYR A 17  ? 0.64993036 0.83809185 0.47559488 -0.21872589 -0.01355012 0.08669568  17  TYR A CD2 
73   C CE1 . TYR A 17  ? 0.52737689 0.72860026 0.37673298 -0.19227484 -0.00292926 0.07981031  17  TYR A CE1 
74   C CE2 . TYR A 17  ? 0.65471172 0.86016876 0.48204142 -0.21654594 -0.01144902 0.08733529  17  TYR A CE2 
75   C CZ  . TYR A 17  ? 0.57928622 0.79060894 0.41885674 -0.20246804 -0.00588172 0.08396453  17  TYR A CZ  
76   O OH  . TYR A 17  ? 0.53154188 0.75946414 0.37305847 -0.19945462 -0.00361531 0.08578724  17  TYR A OH  
77   N N   . ASN A 18  ? 0.59915292 0.69975734 0.43521664 -0.20373535 -0.01059146 0.08634780  18  ASN A N   
78   C CA  . ASN A 18  ? 0.62530392 0.71472323 0.47124809 -0.19681720 -0.01024844 0.09021272  18  ASN A CA  
79   C C   . ASN A 18  ? 0.63919371 0.71043789 0.49205208 -0.18505740 -0.00245253 0.08742929  18  ASN A C   
80   O O   . ASN A 18  ? 0.78510118 0.85079032 0.64917946 -0.17777024 -0.00165933 0.09210116  18  ASN A O   
81   C CB  . ASN A 18  ? 0.66451812 0.73642993 0.49948943 -0.20488170 -0.01363961 0.09579870  18  ASN A CB  
82   C CG  . ASN A 18  ? 0.64937174 0.74388659 0.48726562 -0.21210492 -0.02189177 0.10116038  18  ASN A CG  
83   O OD1 . ASN A 18  ? 0.66437387 0.77579445 0.51717800 -0.20658283 -0.02401591 0.10364637  18  ASN A OD1 
84   N ND2 . ASN A 18  ? 0.68932748 0.78750873 0.51252180 -0.22550894 -0.02645452 0.10266621  18  ASN A ND2 
85   N N   . ARG A 19  ? 0.61553836 0.67975974 0.46291047 -0.18309979 0.00322326  0.08092835  19  ARG A N   
86   C CA  . ARG A 19  ? 0.62317961 0.66964805 0.47658640 -0.17211190 0.01143330  0.07848682  19  ARG A CA  
87   C C   . ARG A 19  ? 0.55159688 0.61679399 0.42635190 -0.16137300 0.01174717  0.07958539  19  ARG A C   
88   O O   . ARG A 19  ? 0.51201379 0.60078657 0.39247864 -0.16261294 0.00777800  0.07873085  19  ARG A O   
89   C CB  . ARG A 19  ? 0.68455553 0.72263467 0.52786064 -0.17281230 0.01734176  0.07079564  19  ARG A CB  
90   C CG  . ARG A 19  ? 0.72421092 0.74269027 0.54304683 -0.18581651 0.01754526  0.06908474  19  ARG A CG  
91   C CD  . ARG A 19  ? 0.71343398 0.72380471 0.52008915 -0.18895020 0.02265139  0.06232985  19  ARG A CD  
92   N NE  . ARG A 19  ? 0.78158104 0.77225423 0.56221515 -0.20429397 0.02203836  0.06171727  19  ARG A NE  
93   C CZ  . ARG A 19  ? 0.81848902 0.79658455 0.58096910 -0.21248764 0.02563621  0.05683824  19  ARG A CZ  
94   N NH1 . ARG A 19  ? 0.84902751 0.83024186 0.61676127 -0.20578949 0.03066710  0.05196988  19  ARG A NH1 
95   N NH2 . ARG A 19  ? 0.79991162 0.76065481 0.53725314 -0.22858025 0.02426177  0.05702444  19  ARG A NH2 
96   N N   . PRO A 20  ? 0.54291737 0.59758592 0.42845708 -0.15069951 0.01778433  0.08091956  20  PRO A N   
97   C CA  . PRO A 20  ? 0.52017301 0.59345508 0.42451888 -0.14257990 0.01785977  0.08235583  20  PRO A CA  
98   C C   . PRO A 20  ? 0.51449227 0.59745741 0.41610181 -0.14265338 0.01996081  0.07439685  20  PRO A C   
99   O O   . PRO A 20  ? 0.51163077 0.58194947 0.40075421 -0.14500973 0.02392453  0.06886358  20  PRO A O   
100  C CB  . PRO A 20  ? 0.54944432 0.60806084 0.46345347 -0.13142511 0.02581557  0.08479811  20  PRO A CB  
101  C CG  . PRO A 20  ? 0.57767701 0.60667598 0.47730458 -0.13294742 0.03024044  0.08538574  20  PRO A CG  
102  C CD  . PRO A 20  ? 0.55596995 0.58021927 0.43476856 -0.14635494 0.02575248  0.08116835  20  PRO A CD  
103  N N   . TYR A 21  ? 0.49249229 0.59438378 0.40572688 -0.13924748 0.01864077  0.07434038  21  TYR A N   
104  C CA  . TYR A 21  ? 0.44387960 0.55127519 0.35663971 -0.13651425 0.02241583  0.06771540  21  TYR A CA  
105  C C   . TYR A 21  ? 0.44142216 0.55531538 0.36867470 -0.12940367 0.02503834  0.06922881  21  TYR A C   
106  O O   . TYR A 21  ? 0.44650930 0.56464720 0.38517106 -0.12721772 0.02297446  0.07642739  21  TYR A O   
107  C CB  . TYR A 21  ? 0.47088346 0.59452969 0.37785137 -0.14171180 0.01865592  0.06526548  21  TYR A CB  
108  C CG  . TYR A 21  ? 0.50216770 0.64233923 0.41620156 -0.14347957 0.01389690  0.06914634  21  TYR A CG  
109  C CD1 . TYR A 21  ? 0.48740816 0.63600421 0.40739697 -0.14034179 0.01573866  0.06739959  21  TYR A CD1 
110  C CD2 . TYR A 21  ? 0.48383844 0.63019526 0.39566407 -0.14988366 0.00784272  0.07402118  21  TYR A CD2 
111  C CE1 . TYR A 21  ? 0.49292344 0.65444601 0.41557220 -0.14407019 0.01194763  0.07029596  21  TYR A CE1 
112  C CE2 . TYR A 21  ? 0.49275237 0.65361553 0.40830839 -0.15293820 0.00401811  0.07686289  21  TYR A CE2 
113  C CZ  . TYR A 21  ? 0.51589066 0.68345678 0.43648335 -0.15026347 0.00620507  0.07500847  21  TYR A CZ  
114  O OH  . TYR A 21  ? 0.49550369 0.67492282 0.41667989 -0.15492868 0.00325286  0.07713763  21  TYR A OH  
115  N N   . PHE A 22  ? 0.44606540 0.55921119 0.37240312 -0.12592152 0.03010491  0.06319360  22  PHE A N   
116  C CA  . PHE A 22  ? 0.45055163 0.56937170 0.38912356 -0.12021733 0.03320012  0.06426978  22  PHE A CA  
117  C C   . PHE A 22  ? 0.45220679 0.58068627 0.38709947 -0.12166183 0.03357036  0.05890435  22  PHE A C   
118  O O   . PHE A 22  ? 0.49833369 0.62167370 0.42327771 -0.12203021 0.03622870  0.05295045  22  PHE A O   
119  C CB  . PHE A 22  ? 0.46731964 0.57271016 0.41062519 -0.11272600 0.04114177  0.06348863  22  PHE A CB  
120  C CG  . PHE A 22  ? 0.52261281 0.61348987 0.46668488 -0.11034206 0.04263041  0.06870009  22  PHE A CG  
121  C CD1 . PHE A 22  ? 0.56140149 0.63411874 0.48945630 -0.11446155 0.04392013  0.06507121  22  PHE A CD1 
122  C CD2 . PHE A 22  ? 0.57753932 0.67379868 0.53727865 -0.10509256 0.04219282  0.07824685  22  PHE A CD2 
123  C CE1 . PHE A 22  ? 0.62527537 0.68089116 0.55076212 -0.11312473 0.04584605  0.06962097  22  PHE A CE1 
124  C CE2 . PHE A 22  ? 0.64997387 0.73125648 0.60971588 -0.10204464 0.04404285  0.08394034  22  PHE A CE2 
125  C CZ  . PHE A 22  ? 0.68146777 0.74049091 0.62294465 -0.10609175 0.04622874  0.07900490  22  PHE A CZ  
126  N N   . ASP A 23  ? 0.42716670 0.56870317 0.36969543 -0.12279817 0.03121714  0.06194346  23  ASP A N   
127  C CA  . ASP A 23  ? 0.39575458 0.54379332 0.33176991 -0.12541197 0.03160802  0.05738780  23  ASP A CA  
128  C C   . ASP A 23  ? 0.37535059 0.52435511 0.31800777 -0.12237348 0.03558827  0.05666695  23  ASP A C   
129  O O   . ASP A 23  ? 0.39254031 0.55182278 0.34449419 -0.12450232 0.03300305  0.06246090  23  ASP A O   
130  C CB  . ASP A 23  ? 0.42220223 0.58082366 0.35436338 -0.13202129 0.02633802  0.05974240  23  ASP A CB  
131  C CG  . ASP A 23  ? 0.46886641 0.62994361 0.39185733 -0.13425528 0.02885869  0.05477968  23  ASP A CG  
132  O OD1 . ASP A 23  ? 0.55139303 0.70626599 0.47188449 -0.13031839 0.03407763  0.04992771  23  ASP A OD1 
133  O OD2 . ASP A 23  ? 0.48095822 0.64825761 0.39779440 -0.14014666 0.02634007  0.05566442  23  ASP A OD2 
134  N N   . LEU A 24  ? 0.36248529 0.50230622 0.30042112 -0.11838556 0.04140585  0.05053652  24  LEU A N   
135  C CA  . LEU A 24  ? 0.36803901 0.50858289 0.31260514 -0.11549432 0.04576337  0.04998948  24  LEU A CA  
136  C C   . LEU A 24  ? 0.33743346 0.48069927 0.27361089 -0.11895027 0.04667838  0.04567694  24  LEU A C   
137  O O   . LEU A 24  ? 0.34295347 0.48223048 0.26736084 -0.11988391 0.04708537  0.04129799  24  LEU A O   
138  C CB  . LEU A 24  ? 0.39727834 0.52512956 0.34177917 -0.10964607 0.05225916  0.04651655  24  LEU A CB  
139  C CG  . LEU A 24  ? 0.45478088 0.57367396 0.40261433 -0.10659820 0.05308454  0.04976071  24  LEU A CG  
140  C CD1 . LEU A 24  ? 0.55457771 0.65831524 0.49926183 -0.10178232 0.06139532  0.04520949  24  LEU A CD1 
141  C CD2 . LEU A 24  ? 0.44757798 0.57560176 0.41069967 -0.10472716 0.05050828  0.05921800  24  LEU A CD2 
142  N N   . ARG A 25  ? 0.33652112 0.48664653 0.27819937 -0.12104978 0.04729722  0.04772994  25  ARG A N   
143  C CA  . ARG A 25  ? 0.36406323 0.51400840 0.29428208 -0.12646879 0.04800632  0.04395260  25  ARG A CA  
144  C C   . ARG A 25  ? 0.35269350 0.50169069 0.28410935 -0.12629986 0.05232967  0.04207718  25  ARG A C   
145  O O   . ARG A 25  ? 0.34763664 0.50513220 0.29257014 -0.12528895 0.05276036  0.04702212  25  ARG A O   
146  C CB  . ARG A 25  ? 0.37828243 0.53883028 0.30745116 -0.13557790 0.04265978  0.04874029  25  ARG A CB  
147  C CG  . ARG A 25  ? 0.38135964 0.54410183 0.30727991 -0.13787696 0.03813444  0.05067790  25  ARG A CG  
148  C CD  . ARG A 25  ? 0.40406862 0.55734575 0.31485420 -0.13652146 0.04097805  0.04426137  25  ARG A CD  
149  N NE  . ARG A 25  ? 0.46597332 0.62333047 0.37455618 -0.13882343 0.03700109  0.04659585  25  ARG A NE  
150  C CZ  . ARG A 25  ? 0.45527411 0.61630023 0.35553390 -0.14689068 0.03487149  0.04766598  25  ARG A CZ  
151  N NH1 . ARG A 25  ? 0.38911754 0.55476397 0.28798592 -0.14944263 0.03135144  0.05010599  25  ARG A NH1 
152  N NH2 . ARG A 25  ? 0.46405602 0.62227261 0.35457689 -0.15331523 0.03690695  0.04568585  25  ARG A NH2 
153  N N   . ASN A 26  ? 0.35751593 0.49664497 0.27469736 -0.12695889 0.05590325  0.03565395  26  ASN A N   
154  C CA  . ASN A 26  ? 0.40722299 0.54374003 0.32121181 -0.12883666 0.05973207  0.03326617  26  ASN A CA  
155  C C   . ASN A 26  ? 0.39477101 0.53372294 0.32171550 -0.12343525 0.06302962  0.03447756  26  ASN A C   
156  O O   . ASN A 26  ? 0.43284190 0.58114266 0.36833259 -0.12600864 0.06354809  0.03819540  26  ASN A O   
157  C CB  . ASN A 26  ? 0.42843118 0.57258129 0.33910722 -0.13919927 0.05687452  0.03647262  26  ASN A CB  
158  C CG  . ASN A 26  ? 0.44907188 0.58918917 0.35347831 -0.14274049 0.06077725  0.03375025  26  ASN A CG  
159  O OD1 . ASN A 26  ? 0.52563310 0.65269822 0.42099679 -0.13835104 0.06569760  0.02778920  26  ASN A OD1 
160  N ND2 . ASN A 26  ? 0.47096312 0.62330967 0.38030285 -0.15108430 0.05844713  0.03885860  26  ASN A ND2 
161  N N   . LEU A 27  ? 0.40357435 0.53378963 0.33030272 -0.11660875 0.06592241  0.03131698  27  LEU A N   
162  C CA  . LEU A 27  ? 0.45103595 0.57862854 0.38527906 -0.11160524 0.07114632  0.03064312  27  LEU A CA  
163  C C   . LEU A 27  ? 0.45259702 0.56660175 0.37481910 -0.10918979 0.07558933  0.02371310  27  LEU A C   
164  O O   . LEU A 27  ? 0.44923055 0.55771369 0.35939455 -0.11023504 0.07433045  0.02074436  27  LEU A O   
165  C CB  . LEU A 27  ? 0.44436017 0.57449412 0.39166498 -0.10666107 0.07115384  0.03551833  27  LEU A CB  
166  C CG  . LEU A 27  ? 0.50238168 0.62213403 0.44389829 -0.10417470 0.07040861  0.03355111  27  LEU A CG  
167  C CD1 . LEU A 27  ? 0.50776792 0.62950802 0.46218333 -0.10010661 0.07043415  0.03995046  27  LEU A CD1 
168  C CD2 . LEU A 27  ? 0.55970061 0.68056691 0.49188319 -0.10815947 0.06471508  0.03280245  27  LEU A CD2 
169  N N   . SER A 28  ? 0.47021833 0.58011544 0.39620110 -0.10596810 0.08126405  0.02206453  28  SER A N   
170  C CA  . SER A 28  ? 0.42758948 0.52545702 0.34223491 -0.10499072 0.08550914  0.01618938  28  SER A CA  
171  C C   . SER A 28  ? 0.45403033 0.54263687 0.36422986 -0.10297492 0.08621176  0.01462950  28  SER A C   
172  O O   . SER A 28  ? 0.48604980 0.57372719 0.40413606 -0.10039576 0.08730529  0.01715172  28  SER A O   
173  C CB  . SER A 28  ? 0.39844701 0.49580809 0.31681120 -0.10414296 0.09155233  0.01482606  28  SER A CB  
174  O OG  . SER A 28  ? 0.41109681 0.51501173 0.32828903 -0.10851479 0.09047128  0.01549918  28  SER A OG  
175  N N   . GLY A 29  ? 0.44500721 0.52712327 0.34209663 -0.10467408 0.08556973  0.01146330  29  GLY A N   
176  C CA  . GLY A 29  ? 0.46942115 0.54276156 0.35822856 -0.10588442 0.08620524  0.00982396  29  GLY A CA  
177  C C   . GLY A 29  ? 0.52024698 0.58536065 0.39851046 -0.10772605 0.09065127  0.00569122  29  GLY A C   
178  O O   . GLY A 29  ? 0.48841807 0.55565137 0.36247912 -0.10802171 0.09068625  0.00490199  29  GLY A O   
179  N N   . TYR A 30  ? 0.51533282 0.56908262 0.38849187 -0.10920814 0.09535412  0.00303822  30  TYR A N   
180  C CA  . TYR A 30  ? 0.52373576 0.56825477 0.38625863 -0.11215232 0.10053163  -0.00114226 30  TYR A CA  
181  C C   . TYR A 30  ? 0.47541049 0.51414549 0.32286197 -0.11881585 0.09789748  -0.00141242 30  TYR A C   
182  O O   . TYR A 30  ? 0.43562487 0.46690655 0.27913633 -0.12138169 0.09802790  -0.00143456 30  TYR A O   
183  C CB  . TYR A 30  ? 0.52260286 0.55723935 0.38835058 -0.10980090 0.10956559  -0.00415594 30  TYR A CB  
184  C CG  . TYR A 30  ? 0.56878543 0.59486866 0.42291164 -0.11355166 0.11509448  -0.00875934 30  TYR A CG  
185  C CD1 . TYR A 30  ? 0.56032312 0.59288263 0.41830927 -0.11233911 0.11656903  -0.00932029 30  TYR A CD1 
186  C CD2 . TYR A 30  ? 0.57029748 0.58163410 0.40787959 -0.11982533 0.11852044  -0.01234045 30  TYR A CD2 
187  C CE1 . TYR A 30  ? 0.56421697 0.58967412 0.41150469 -0.11620985 0.12121727  -0.01311101 30  TYR A CE1 
188  C CE2 . TYR A 30  ? 0.57466626 0.57876086 0.40051746 -0.12449672 0.12329179  -0.01630989 30  TYR A CE2 
189  C CZ  . TYR A 30  ? 0.55239367 0.56424272 0.38387135 -0.12219813 0.12436987  -0.01650244 30  TYR A CZ  
190  O OH  . TYR A 30  ? 0.53716397 0.54353321 0.35878024 -0.12639523 0.12880337  -0.01984601 30  TYR A OH  
191  N N   . ARG A 31  ? 0.45424795 0.49881059 0.29419833 -0.12163556 0.09433451  0.00008207  31  ARG A N   
192  C CA  . ARG A 31  ? 0.50349879 0.54786974 0.33053306 -0.12905073 0.09058244  0.00209946  31  ARG A CA  
193  C C   . ARG A 31  ? 0.53095710 0.56221652 0.34320962 -0.13631511 0.09578738  -0.00208613 31  ARG A C   
194  O O   . ARG A 31  ? 0.47581625 0.50529784 0.28668404 -0.13540594 0.09936212  -0.00422922 31  ARG A O   
195  C CB  . ARG A 31  ? 0.46771437 0.52678478 0.29443446 -0.12804115 0.08468483  0.00784786  31  ARG A CB  
196  C CG  . ARG A 31  ? 0.43877155 0.50243026 0.25412738 -0.13657875 0.08003540  0.01205640  31  ARG A CG  
197  C CD  . ARG A 31  ? 0.43630540 0.51677716 0.25341743 -0.13349815 0.07548789  0.01964352  31  ARG A CD  
198  N NE  . ARG A 31  ? 0.46453226 0.55400425 0.27264193 -0.14265949 0.07020073  0.02553796  31  ARG A NE  
199  C CZ  . ARG A 31  ? 0.50464016 0.61258650 0.31453076 -0.14127408 0.06559722  0.03472000  31  ARG A CZ  
200  N NH1 . ARG A 31  ? 0.51698780 0.63108969 0.33591464 -0.13015641 0.06704693  0.03736849  31  ARG A NH1 
201  N NH2 . ARG A 31  ? 0.56882691 0.68964583 0.37240893 -0.15021762 0.05993623  0.04186743  31  ARG A NH2 
202  N N   . GLU A 32  ? 0.57513189 0.59514141 0.37543157 -0.14402999 0.09687444  -0.00368629 32  GLU A N   
203  C CA  . GLU A 32  ? 0.64313489 0.64873737 0.42369956 -0.15475290 0.10087389  -0.00726444 32  GLU A CA  
204  C C   . GLU A 32  ? 0.62678576 0.63630885 0.39406866 -0.16609567 0.09380609  -0.00280885 32  GLU A C   
205  O O   . GLU A 32  ? 0.60852337 0.61322224 0.37391111 -0.16853587 0.09223851  -0.00224977 32  GLU A O   
206  C CB  . GLU A 32  ? 0.72221959 0.70444888 0.49593252 -0.15568386 0.11052629  -0.01378727 32  GLU A CB  
207  C CG  . GLU A 32  ? 0.99521410 0.97090906 0.77790976 -0.14716417 0.12010013  -0.01842589 32  GLU A CG  
208  C CD  . GLU A 32  ? 1.14442754 1.10024869 0.92763799 -0.14235152 0.13168745  -0.02307177 32  GLU A CD  
209  O OE1 . GLU A 32  ? 1.05299163 1.00990605 0.84895605 -0.13494582 0.13149209  -0.02050401 32  GLU A OE1 
210  O OE2 . GLU A 32  ? 1.18319046 1.12342548 0.95538157 -0.14484788 0.14160900  -0.02861530 32  GLU A OE2 
211  N N   . GLY A 33  ? 0.61778337 0.63869941 0.37695765 -0.17305721 0.08879715  0.00182932  33  GLY A N   
212  C CA  . GLY A 33  ? 0.60640514 0.63623202 0.35374540 -0.18516378 0.08127671  0.00809084  33  GLY A CA  
213  C C   . GLY A 33  ? 0.57805556 0.62901521 0.34090525 -0.17818512 0.07381070  0.01553852  33  GLY A C   
214  O O   . GLY A 33  ? 0.59677804 0.66234457 0.37361944 -0.16783990 0.07204724  0.01934668  33  GLY A O   
215  N N   . ASN A 34  ? 0.62195730 0.67139262 0.38079429 -0.18385012 0.07070935  0.01681691  34  ASN A N   
216  C CA  . ASN A 34  ? 0.64701730 0.71588558 0.41916838 -0.17850098 0.06406002  0.02361594  34  ASN A CA  
217  C C   . ASN A 34  ? 0.61910474 0.67621982 0.39975688 -0.17182600 0.06692310  0.01892106  34  ASN A C   
218  O O   . ASN A 34  ? 0.56966341 0.63347512 0.35327008 -0.17321612 0.06231605  0.02246113  34  ASN A O   
219  C CB  . ASN A 34  ? 0.64132917 0.72520846 0.40239221 -0.19214596 0.05615414  0.03200386  34  ASN A CB  
220  C CG  . ASN A 34  ? 0.62815267 0.73291093 0.39007622 -0.19302614 0.05234020  0.04031269  34  ASN A CG  
221  O OD1 . ASN A 34  ? 0.62588131 0.73385143 0.39798069 -0.18171456 0.05527002  0.03999968  34  ASN A OD1 
222  N ND2 . ASN A 34  ? 0.66460109 0.78486830 0.41627157 -0.20636261 0.04562090  0.04895822  34  ASN A ND2 
223  N N   . THR A 35  ? 0.62236279 0.66183549 0.40620995 -0.16539928 0.07488614  0.01149682  35  THR A N   
224  C CA  . THR A 35  ? 0.60459220 0.63393211 0.39785862 -0.15829757 0.07826008  0.00844306  35  THR A CA  
225  C C   . THR A 35  ? 0.54932815 0.58314806 0.35995281 -0.14541559 0.08180390  0.00664705  35  THR A C   
226  O O   . THR A 35  ? 0.61461723 0.64425886 0.42341876 -0.14402650 0.08645076  0.00342583  35  THR A O   
227  C CB  . THR A 35  ? 0.64345765 0.64523745 0.42342365 -0.16313539 0.08610210  0.00233287  35  THR A CB  
228  O OG1 . THR A 35  ? 0.69017082 0.68772101 0.45226997 -0.17696239 0.08171725  0.00451741  35  THR A OG1 
229  C CG2 . THR A 35  ? 0.68852878 0.68299675 0.48198557 -0.15324949 0.08967500  0.00147513  35  THR A CG2 
230  N N   . VAL A 36  ? 0.49913859 0.54116178 0.32474911 -0.13789144 0.07929818  0.00902950  36  VAL A N   
231  C CA  . VAL A 36  ? 0.47512949 0.52078301 0.31631333 -0.12790087 0.08216415  0.00797141  36  VAL A CA  
232  C C   . VAL A 36  ? 0.46506768 0.50059211 0.31330639 -0.12415415 0.08596660  0.00708274  36  VAL A C   
233  O O   . VAL A 36  ? 0.45088184 0.48674077 0.30009809 -0.12562656 0.08220240  0.01000923  36  VAL A O   
234  C CB  . VAL A 36  ? 0.46418074 0.52775455 0.31614220 -0.12293597 0.07659852  0.01219749  36  VAL A CB  
235  C CG1 . VAL A 36  ? 0.49166441 0.55758345 0.35499734 -0.11596148 0.07975110  0.01073614  36  VAL A CG1 
236  C CG2 . VAL A 36  ? 0.50279129 0.57693297 0.34799305 -0.12534472 0.07305293  0.01528350  36  VAL A CG2 
237  N N   . THR A 37  ? 0.45745271 0.48569763 0.31092966 -0.11914457 0.09342666  0.00397450  37  THR A N   
238  C CA  . THR A 37  ? 0.52915931 0.54949689 0.39224923 -0.11310974 0.09886549  0.00460504  37  THR A CA  
239  C C   . THR A 37  ? 0.53407806 0.57092673 0.41729614 -0.10565182 0.09676763  0.00874809  37  THR A C   
240  O O   . THR A 37  ? 0.48465925 0.53000259 0.37279600 -0.10385653 0.09762156  0.00784062  37  THR A O   
241  C CB  . THR A 37  ? 0.50729316 0.50999188 0.36338216 -0.11223855 0.10986669  -0.00045231 37  THR A CB  
242  O OG1 . THR A 37  ? 0.53100282 0.51460469 0.36717844 -0.12034157 0.11193514  -0.00337829 37  THR A OG1 
243  C CG2 . THR A 37  ? 0.51883513 0.51582128 0.38816008 -0.10299902 0.11763481  0.00153992  37  THR A CG2 
244  N N   . PHE A 38  ? 0.53700542 0.57696724 0.43059099 -0.10229489 0.09458736  0.01360826  38  PHE A N   
245  C CA  . PHE A 38  ? 0.52223068 0.57843137 0.43450329 -0.09695255 0.09243370  0.01889130  38  PHE A CA  
246  C C   . PHE A 38  ? 0.51739097 0.56861240 0.44169623 -0.08966391 0.09908710  0.02294422  38  PHE A C   
247  O O   . PHE A 38  ? 0.51900089 0.55409455 0.43702766 -0.08895513 0.10247263  0.02292687  38  PHE A O   
248  C CB  . PHE A 38  ? 0.46755287 0.53617728 0.38264862 -0.09977774 0.08290859  0.02300597  38  PHE A CB  
249  C CG  . PHE A 38  ? 0.41840214 0.49356657 0.32394645 -0.10455946 0.07770456  0.02063996  38  PHE A CG  
250  C CD1 . PHE A 38  ? 0.43146363 0.50161928 0.32387128 -0.10943824 0.07517404  0.01910985  38  PHE A CD1 
251  C CD2 . PHE A 38  ? 0.40408200 0.49068850 0.31344622 -0.10433168 0.07565653  0.02098117  38  PHE A CD2 
252  C CE1 . PHE A 38  ? 0.39980882 0.47896606 0.28592223 -0.11199874 0.07091391  0.01911986  38  PHE A CE1 
253  C CE2 . PHE A 38  ? 0.39488643 0.48507482 0.29497299 -0.10676965 0.07271148  0.01945368  38  PHE A CE2 
254  C CZ  . PHE A 38  ? 0.38641602 0.47393274 0.27633628 -0.10953988 0.07066984  0.01900889  38  PHE A CZ  
255  N N   . ILE A 39  ? 0.51075363 0.57482183 0.45080885 -0.08459429 0.10169370  0.02672324  39  ILE A N   
256  C CA  . ILE A 39  ? 0.59231889 0.65628129 0.54728109 -0.07599036 0.10829903  0.03301577  39  ILE A CA  
257  C C   . ILE A 39  ? 0.69716716 0.78555238 0.67115700 -0.07490559 0.10110916  0.04264533  39  ILE A C   
258  O O   . ILE A 39  ? 0.69596028 0.80097997 0.67436320 -0.07885955 0.09663992  0.04346164  39  ILE A O   
259  C CB  . ILE A 39  ? 0.63196039 0.68983364 0.58912253 -0.07063648 0.11997236  0.03040795  39  ILE A CB  
260  C CG1 . ILE A 39  ? 0.76705420 0.79803705 0.70513231 -0.07178999 0.12814666  0.02251747  39  ILE A CG1 
261  C CG2 . ILE A 39  ? 0.70506799 0.77114284 0.68329006 -0.05992372 0.12694249  0.03961473  39  ILE A CG2 
262  C CD1 . ILE A 39  ? 0.93098330 0.95756245 0.85500151 -0.07794835 0.12983227  0.01417566  39  ILE A CD1 
263  N N   . ASN A 40  ? 0.80476743 0.89393234 0.78860670 -0.07031273 0.10029089  0.05046004  40  ASN A N   
264  C CA  . ASN A 40  ? 0.85017604 0.96210086 0.85312086 -0.06895913 0.09426655  0.06178942  40  ASN A CA  
265  C C   . ASN A 40  ? 0.95890450 1.07640672 0.98164082 -0.05753602 0.10280583  0.07146333  40  ASN A C   
266  O O   . ASN A 40  ? 1.09820175 1.19520068 1.11718512 -0.04960809 0.11402543  0.06899483  40  ASN A O   
267  C CB  . ASN A 40  ? 0.88496292 0.99285793 0.88477957 -0.07129633 0.08729820  0.06528763  40  ASN A CB  
268  C CG  . ASN A 40  ? 0.68891746 0.81203258 0.68513107 -0.08109654 0.07590321  0.06503969  40  ASN A CG  
269  O OD1 . ASN A 40  ? 0.77986091 0.91790676 0.77969313 -0.08486713 0.07366215  0.06508610  40  ASN A OD1 
270  N ND2 . ASN A 40  ? 0.71807390 0.83643961 0.70589495 -0.08560519 0.06963497  0.06465825  40  ASN A ND2 
271  N N   A HIS A 41  ? 0.95348990 1.09846759 0.99627984 -0.05710468 0.09784468  0.08312263  41  HIS A N   
272  N N   B HIS A 41  ? 0.98511255 1.12970376 1.02825034 -0.05668534 0.09807168  0.08341295  41  HIS A N   
273  C CA  A HIS A 41  ? 0.91937065 1.07529616 0.98498195 -0.04546354 0.10404787  0.09657471  41  HIS A CA  
274  C CA  B HIS A 41  ? 0.96742499 1.12137914 1.03278387 -0.04442769 0.10553020  0.09607282  41  HIS A CA  
275  C C   A HIS A 41  ? 0.96554577 1.10428810 1.02992845 -0.03930166 0.10532864  0.10081951  41  HIS A C   
276  C C   B HIS A 41  ? 1.00356114 1.13605857 1.06608772 -0.03695746 0.10928567  0.09886856  41  HIS A C   
277  O O   A HIS A 41  ? 0.97519612 1.12541640 1.05870068 -0.03106677 0.10639273  0.11474403  41  HIS A O   
278  O O   B HIS A 41  ? 1.11899948 1.25062442 1.19651818 -0.02430451 0.11805588  0.10858995  41  HIS A O   
279  C CB  A HIS A 41  ? 0.71780145 0.91055357 0.80483973 -0.04881625 0.09630825  0.11025073  41  HIS A CB  
280  C CB  B HIS A 41  ? 0.76429069 0.95539594 0.85222793 -0.04686079 0.09862639  0.11007072  41  HIS A CB  
281  C CG  A HIS A 41  ? 0.64889610 0.86246979 0.74437380 -0.05175881 0.09796656  0.11178041  41  HIS A CG  
282  C CG  B HIS A 41  ? 0.73270601 0.94097900 0.84781611 -0.03394498 0.10473341  0.12703907  41  HIS A CG  
283  N ND1 A HIS A 41  ? 0.63405114 0.86723089 0.72656918 -0.06572859 0.08732531  0.11220255  41  HIS A ND1 
284  N ND1 B HIS A 41  ? 0.74132812 0.98075175 0.87712896 -0.03279086 0.10561891  0.13785921  41  HIS A ND1 
285  C CD2 A HIS A 41  ? 0.67995822 0.90061665 0.78752983 -0.04367570 0.10845201  0.11484928  41  HIS A CD2 
286  C CD2 B HIS A 41  ? 0.78002214 0.98088706 0.90615737 -0.02145311 0.11025199  0.13684165  41  HIS A CD2 
287  C CE1 A HIS A 41  ? 0.65956593 0.90930837 0.75992239 -0.06732671 0.09067236  0.11447830  41  HIS A CE1 
288  C CE1 B HIS A 41  ? 0.74999022 1.00248420 0.90996349 -0.01925774 0.11159988  0.15409596  41  HIS A CE1 
289  N NE2 A HIS A 41  ? 0.65008950 0.89459312 0.76114571 -0.05372993 0.10331676  0.11653907  41  HIS A NE2 
290  N NE2 B HIS A 41  ? 0.74972308 0.97773588 0.90411800 -0.01149105 0.11486887  0.15377204  41  HIS A NE2 
291  N N   . TYR A 42  ? 0.93660569 1.04922843 0.97828066 -0.04422630 0.10440139  0.08996361  42  TYR A N   
292  C CA  . TYR A 42  ? 1.09027994 1.18235111 1.12650740 -0.04004749 0.10636638  0.09267798  42  TYR A CA  
293  C C   . TYR A 42  ? 1.23782969 1.29487205 1.24742937 -0.04297313 0.11257568  0.07949658  42  TYR A C   
294  O O   . TYR A 42  ? 1.43969178 1.47196114 1.44339681 -0.03621124 0.12145046  0.08059085  42  TYR A O   
295  C CB  . TYR A 42  ? 1.14684153 1.25204873 1.18468153 -0.04795450 0.09255567  0.09839004  42  TYR A CB  
296  C CG  . TYR A 42  ? 1.24481368 1.32708645 1.26987875 -0.04876755 0.09150324  0.09810947  42  TYR A CG  
297  C CD1 . TYR A 42  ? 1.19400525 1.26656139 1.22863567 -0.03815091 0.09731126  0.10875596  42  TYR A CD1 
298  C CD2 . TYR A 42  ? 1.14341307 1.21543121 1.14742136 -0.06037055 0.08435048  0.08866701  42  TYR A CD2 
299  C CE1 . TYR A 42  ? 1.04373240 1.09399629 1.06494212 -0.04017546 0.09602685  0.10885064  42  TYR A CE1 
300  C CE2 . TYR A 42  ? 1.12305510 1.17615616 1.11480427 -0.06300921 0.08260900  0.08903784  42  TYR A CE2 
301  C CZ  . TYR A 42  ? 1.07074380 1.11170685 1.06998754 -0.05358141 0.08822529  0.09869043  42  TYR A CZ  
302  O OH  . TYR A 42  ? 0.91949832 0.93973863 0.90363365 -0.05795093 0.08619255  0.09843050  42  TYR A OH  
303  N N   . GLN A 43  ? 1.23945868 1.29319692 1.23167014 -0.05348916 0.10819583  0.06789805  43  GLN A N   
304  C CA  . GLN A 43  ? 1.18451118 1.20899904 1.15092349 -0.05913907 0.11161443  0.05735325  43  GLN A CA  
305  C C   . GLN A 43  ? 1.07429481 1.09743237 1.02826023 -0.06520200 0.11306984  0.04658835  43  GLN A C   
306  O O   . GLN A 43  ? 0.98521662 1.02984262 0.94578850 -0.06875847 0.10673493  0.04608381  43  GLN A O   
307  C CB  . GLN A 43  ? 1.22056496 1.24275374 1.17702031 -0.06772632 0.10107614  0.05805503  43  GLN A CB  
308  C CG  . GLN A 43  ? 1.21739566 1.26536882 1.17738581 -0.07624710 0.08772743  0.05836640  43  GLN A CG  
309  C CD  . GLN A 43  ? 1.12242484 1.16834641 1.07039917 -0.08535125 0.07848541  0.05772161  43  GLN A CD  
310  O OE1 . GLN A 43  ? 1.18621159 1.21188390 1.12179959 -0.08736726 0.08023719  0.05717234  43  GLN A OE1 
311  N NE2 . GLN A 43  ? 0.96933132 1.03538501 0.91884589 -0.09178367 0.06905852  0.05741642  43  GLN A NE2 
312  N N   . GLN A 44  ? 0.89029884 0.88661456 0.82462561 -0.06701741 0.12186468  0.03825643  44  GLN A N   
313  C CA  . GLN A 44  ? 0.78416789 0.77709973 0.70115429 -0.07648012 0.12001798  0.02848297  44  GLN A CA  
314  C C   . GLN A 44  ? 0.71923935 0.70423502 0.61688834 -0.08806902 0.11183703  0.02497200  44  GLN A C   
315  O O   . GLN A 44  ? 0.78124166 0.74278772 0.66352797 -0.09115142 0.11560351  0.02339587  44  GLN A O   
316  C CB  . GLN A 44  ? 0.74637222 0.71712148 0.65009439 -0.07524621 0.13303903  0.02118099  44  GLN A CB  
317  C CG  . GLN A 44  ? 0.82257116 0.78856528 0.70583004 -0.08680145 0.13013169  0.01224501  44  GLN A CG  
318  C CD  . GLN A 44  ? 0.92122579 0.86357594 0.78787029 -0.08798073 0.14280984  0.00465867  44  GLN A CD  
319  O OE1 . GLN A 44  ? 0.83067894 0.76960665 0.70694160 -0.07836691 0.15394099  0.00533224  44  GLN A OE1 
320  N NE2 . GLN A 44  ? 0.91734427 0.84494269 0.75887924 -0.10039631 0.14134911  -0.00198429 44  GLN A NE2 
321  N N   . THR A 45  ? 0.66064179 0.66337776 0.55636513 -0.09517841 0.10195465  0.02326023  45  THR A N   
322  C CA  . THR A 45  ? 0.64888012 0.65078163 0.52949220 -0.10560973 0.09381428  0.02169358  45  THR A CA  
323  C C   . THR A 45  ? 0.56738508 0.57042539 0.43373084 -0.11321886 0.09257366  0.01568453  45  THR A C   
324  O O   . THR A 45  ? 0.52368867 0.53988242 0.39618671 -0.11124562 0.09186444  0.01431386  45  THR A O   
325  C CB  . THR A 45  ? 0.68628830 0.71173483 0.58008814 -0.10556372 0.08330823  0.02754554  45  THR A CB  
326  O OG1 . THR A 45  ? 0.73521376 0.75933027 0.64267349 -0.09832258 0.08547343  0.03391474  45  THR A OG1 
327  C CG2 . THR A 45  ? 0.61814606 0.64791918 0.50005275 -0.11498705 0.07485514  0.02758678  45  THR A CG2 
328  N N   . ASP A 46  ? 0.57864380 0.56901103 0.42501646 -0.12314547 0.09138411  0.01313549  46  ASP A N   
329  C CA  . ASP A 46  ? 0.60895205 0.60096633 0.44121298 -0.13130535 0.09001906  0.00925370  46  ASP A CA  
330  C C   . ASP A 46  ? 0.55206215 0.56090987 0.38066041 -0.13875993 0.07937460  0.01303825  46  ASP A C   
331  O O   . ASP A 46  ? 0.55227637 0.55589265 0.37269896 -0.14519869 0.07587116  0.01528662  46  ASP A O   
332  C CB  . ASP A 46  ? 0.68925893 0.65450644 0.49865842 -0.13936223 0.09747090  0.00397151  46  ASP A CB  
333  C CG  . ASP A 46  ? 0.78868127 0.73647547 0.59732652 -0.13314031 0.11005321  -0.00103406 46  ASP A CG  
334  O OD1 . ASP A 46  ? 0.76017582 0.72041678 0.58482981 -0.12442198 0.11217467  -0.00089477 46  ASP A OD1 
335  O OD2 . ASP A 46  ? 1.06191540 0.98255372 0.85152936 -0.13826306 0.11823929  -0.00525871 46  ASP A OD2 
336  N N   . VAL A 47  ? 0.50088918 0.52899188 0.33454359 -0.13787979 0.07505877  0.01411355  47  VAL A N   
337  C CA  . VAL A 47  ? 0.48208794 0.52943820 0.31640339 -0.14174993 0.06619101  0.01913667  47  VAL A CA  
338  C C   . VAL A 47  ? 0.50619525 0.56014812 0.32836047 -0.14926939 0.06403869  0.01975656  47  VAL A C   
339  O O   . VAL A 47  ? 0.52277422 0.57812017 0.34518489 -0.14654228 0.06711181  0.01760177  47  VAL A O   
340  C CB  . VAL A 47  ? 0.45395654 0.51960504 0.30546385 -0.13280219 0.06345008  0.02166218  47  VAL A CB  
341  C CG1 . VAL A 47  ? 0.42011338 0.50555646 0.27284127 -0.13462955 0.05643947  0.02678685  47  VAL A CG1 
342  C CG2 . VAL A 47  ? 0.46953523 0.53165960 0.33390614 -0.12636603 0.06508440  0.02231186  47  VAL A CG2 
343  N N   . LYS A 48  ? 0.47359407 0.53410530 0.28648365 -0.15871111 0.05818009  0.02393622  48  LYS A N   
344  C CA  . LYS A 48  ? 0.55292428 0.62280834 0.35388350 -0.16813760 0.05479421  0.02707752  48  LYS A CA  
345  C C   . LYS A 48  ? 0.50137091 0.59864688 0.31421843 -0.16205817 0.05007070  0.03360155  48  LYS A C   
346  O O   . LYS A 48  ? 0.47686851 0.58864594 0.29886013 -0.15878579 0.04589006  0.03809256  48  LYS A O   
347  C CB  . LYS A 48  ? 0.66001713 0.72531378 0.44390857 -0.18325149 0.05058002  0.02970256  48  LYS A CB  
348  C CG  . LYS A 48  ? 0.85134512 0.88602835 0.61570859 -0.19220455 0.05665784  0.02328981  48  LYS A CG  
349  C CD  . LYS A 48  ? 1.25277722 1.28060484 1.00173354 -0.20034017 0.05977490  0.02061523  48  LYS A CD  
350  C CE  . LYS A 48  ? 1.29431605 1.34189093 1.03191602 -0.21427497 0.05204543  0.02788868  48  LYS A CE  
351  N NZ  . LYS A 48  ? 1.31842923 1.35606563 1.03991675 -0.22284839 0.05560936  0.02485548  48  LYS A NZ  
352  N N   . LEU A 49  ? 0.48525923 0.58868253 0.29453143 -0.16262616 0.05090158  0.03493062  49  LEU A N   
353  C CA  . LEU A 49  ? 0.47444999 0.60237461 0.29114893 -0.15790956 0.04750237  0.04273530  49  LEU A CA  
354  C C   . LEU A 49  ? 0.53995663 0.68314356 0.34625900 -0.17061481 0.04136003  0.05088326  49  LEU A C   
355  O O   . LEU A 49  ? 0.65795416 0.79471505 0.44995543 -0.18148924 0.04118455  0.05047818  49  LEU A O   
356  C CB  . LEU A 49  ? 0.44984645 0.57578415 0.27013808 -0.14986621 0.05206689  0.04072900  49  LEU A CB  
357  C CG  . LEU A 49  ? 0.47844118 0.58798909 0.30582559 -0.14123073 0.05804538  0.03248901  49  LEU A CG  
358  C CD1 . LEU A 49  ? 0.47387719 0.58120567 0.30144092 -0.13618584 0.06206502  0.03096620  49  LEU A CD1 
359  C CD2 . LEU A 49  ? 0.49693528 0.61290622 0.33720896 -0.13306469 0.05698916  0.03329210  49  LEU A CD2 
360  N N   . GLU A 50  ? 0.51302469 0.67661047 0.32577533 -0.17044547 0.03634282  0.05842748  50  GLU A N   
361  C CA  . GLU A 50  ? 0.53753519 0.72053170 0.34273669 -0.18298835 0.02962681  0.06792149  50  GLU A CA  
362  C C   . GLU A 50  ? 0.53569722 0.75051552 0.35407627 -0.17449224 0.02750006  0.07951527  50  GLU A C   
363  O O   . GLU A 50  ? 0.62497807 0.86261266 0.44113904 -0.18305391 0.02179458  0.08982508  50  GLU A O   
364  C CB  . GLU A 50  ? 0.61517107 0.79874784 0.41657689 -0.19145681 0.02525052  0.06902299  50  GLU A CB  
365  C CG  . GLU A 50  ? 0.74621356 0.89888823 0.53173184 -0.20196140 0.02700251  0.06014927  50  GLU A CG  
366  C CD  . GLU A 50  ? 0.97815740 1.12252474 0.74078250 -0.22109158 0.02485500  0.06086136  50  GLU A CD  
367  O OE1 . GLU A 50  ? 1.18241835 1.35183978 0.94110340 -0.23069274 0.01866834  0.07103728  50  GLU A OE1 
368  O OE2 . GLU A 50  ? 1.01873851 1.13121605 0.76762122 -0.22571290 0.03025288  0.05145798  50  GLU A OE2 
369  N N   . GLY A 51  ? 0.51349747 0.73111677 0.34518895 -0.15796432 0.03236545  0.07900415  51  GLY A N   
370  C CA  . GLY A 51  ? 0.48182631 0.72778893 0.32459539 -0.14905281 0.03203956  0.09082926  51  GLY A CA  
371  C C   . GLY A 51  ? 0.52448779 0.76690418 0.37265939 -0.13549376 0.03824117  0.09076651  51  GLY A C   
372  O O   . GLY A 51  ? 0.58774585 0.81605387 0.42840302 -0.13892750 0.03957826  0.08627186  51  GLY A O   
373  N N   . LYS A 52  ? 0.48482135 0.73750794 0.34410852 -0.12074553 0.04271835  0.09520159  52  LYS A N   
374  C CA  . LYS A 52  ? 0.52342522 0.76957572 0.38626057 -0.10688008 0.04982097  0.09517321  52  LYS A CA  
375  C C   . LYS A 52  ? 0.52361226 0.73989642 0.38257608 -0.10441637 0.05426546  0.08121321  52  LYS A C   
376  O O   . LYS A 52  ? 0.54080367 0.74689758 0.39859042 -0.09689395 0.05941877  0.07956797  52  LYS A O   
377  C CB  . LYS A 52  ? 0.61618078 0.87690425 0.48864105 -0.09198877 0.05523964  0.10324001  52  LYS A CB  
378  C CG  . LYS A 52  ? 0.79283381 1.08731985 0.67169774 -0.09132117 0.05233656  0.12039231  52  LYS A CG  
379  C CD  . LYS A 52  ? 1.11343145 1.41707730 1.00161135 -0.07409100 0.06053729  0.12639707  52  LYS A CD  
380  C CE  . LYS A 52  ? 1.27328300 1.61321592 1.17163086 -0.07145670 0.05894645  0.14275683  52  LYS A CE  
381  N NZ  . LYS A 52  ? 1.31630230 1.67848647 1.22009218 -0.06681506 0.05885448  0.15823627  52  LYS A NZ  
382  N N   . ASP A 53  ? 0.51515281 0.71836460 0.37185752 -0.11150632 0.05205288  0.07232988  53  ASP A N   
383  C CA  . ASP A 53  ? 0.50139761 0.67980039 0.35552031 -0.11083161 0.05554358  0.06073260  53  ASP A CA  
384  C C   . ASP A 53  ? 0.46783811 0.63768351 0.31473994 -0.11494584 0.05644913  0.05891787  53  ASP A C   
385  O O   . ASP A 53  ? 0.45617640 0.61096525 0.30240074 -0.11034276 0.06110187  0.05269015  53  ASP A O   
386  C CB  . ASP A 53  ? 0.47775030 0.64504337 0.33236629 -0.11623158 0.05359272  0.05354940  53  ASP A CB  
387  C CG  . ASP A 53  ? 0.58541089 0.75675935 0.43437147 -0.12859981 0.04773852  0.05556174  53  ASP A CG  
388  O OD1 . ASP A 53  ? 0.62189609 0.80606318 0.46571487 -0.13457341 0.04470068  0.06252465  53  ASP A OD1 
389  O OD2 . ASP A 53  ? 0.49480304 0.65586734 0.34334302 -0.13294663 0.04631720  0.05079299  53  ASP A OD2 
390  N N   . LYS A 54  ? 0.52595770 0.70582467 0.36644730 -0.12454571 0.05205016  0.06467763  54  LYS A N   
391  C CA  . LYS A 54  ? 0.56037211 0.73050773 0.39144841 -0.13090177 0.05282725  0.06222738  54  LYS A CA  
392  C C   . LYS A 54  ? 0.51569182 0.68474352 0.34929907 -0.12059877 0.05746217  0.06432160  54  LYS A C   
393  O O   . LYS A 54  ? 0.45875853 0.61156750 0.28768122 -0.12100505 0.06095922  0.05755693  54  LYS A O   
394  C CB  . LYS A 54  ? 0.60051262 0.78453267 0.42266434 -0.14425398 0.04684183  0.07002780  54  LYS A CB  
395  C CG  . LYS A 54  ? 0.65206629 0.82795936 0.46396175 -0.15863356 0.04335173  0.06585203  54  LYS A CG  
396  C CD  . LYS A 54  ? 0.80167627 1.00140119 0.60840064 -0.17036138 0.03594946  0.07768525  54  LYS A CD  
397  C CE  . LYS A 54  ? 0.96401191 1.15091395 0.75081718 -0.18948536 0.03354099  0.07419883  54  LYS A CE  
398  N NZ  . LYS A 54  ? 1.07963753 1.27338696 0.85953355 -0.20220116 0.02777817  0.07761674  54  LYS A NZ  
399  N N   . ASP A 55  ? 0.56067580 0.74427217 0.40215707 -0.10980944 0.05883728  0.07269800  55  ASP A N   
400  C CA  . ASP A 55  ? 0.56109011 0.74381346 0.40404475 -0.09875637 0.06390451  0.07695770  55  ASP A CA  
401  C C   . ASP A 55  ? 0.60398364 0.76595879 0.44737190 -0.08982199 0.07073780  0.06792820  55  ASP A C   
402  O O   . ASP A 55  ? 0.59242564 0.74794286 0.43344691 -0.08247710 0.07545313  0.06988940  55  ASP A O   
403  C CB  . ASP A 55  ? 0.61701775 0.82393754 0.46773514 -0.08982183 0.06403844  0.09125491  55  ASP A CB  
404  C CG  . ASP A 55  ? 0.68158484 0.91443717 0.53256208 -0.10044415 0.05612924  0.10244270  55  ASP A CG  
405  O OD1 . ASP A 55  ? 0.71775019 0.94912016 0.56005287 -0.11217389 0.05218489  0.10246119  55  ASP A OD1 
406  O OD2 . ASP A 55  ? 0.74283892 0.99603260 0.60078704 -0.09947856 0.05363619  0.11004510  55  ASP A OD2 
407  N N   . LYS A 56  ? 0.70188200 0.85426110 0.54760015 -0.09042443 0.07135579  0.05956281  56  LYS A N   
408  C CA  . LYS A 56  ? 0.76307249 0.89762461 0.60750961 -0.08406246 0.07732308  0.05238849  56  LYS A CA  
409  C C   . LYS A 56  ? 0.69903851 0.81714904 0.54106879 -0.09059113 0.07763062  0.04189400  56  LYS A C   
410  O O   . LYS A 56  ? 0.75674719 0.86157954 0.59524685 -0.08800055 0.08201219  0.03755190  56  LYS A O   
411  C CB  . LYS A 56  ? 1.04279804 1.17721796 0.89055896 -0.07784268 0.07995528  0.05175157  56  LYS A CB  
412  C CG  . LYS A 56  ? 1.18306196 1.32706690 1.03181839 -0.06687827 0.08434337  0.06101221  56  LYS A CG  
413  C CD  . LYS A 56  ? 1.18548632 1.35447979 1.04127896 -0.06848627 0.07922140  0.07032236  56  LYS A CD  
414  C CE  . LYS A 56  ? 1.17282748 1.35072899 1.03214264 -0.05808171 0.08419685  0.07650820  56  LYS A CE  
415  N NZ  . LYS A 56  ? 1.25031793 1.45259488 1.11675429 -0.06311100 0.07779031  0.08362982  56  LYS A NZ  
416  N N   . ILE A 57  ? 0.60764557 0.72579944 0.45083112 -0.09896654 0.07379480  0.03827028  57  ILE A N   
417  C CA  . ILE A 57  ? 0.54827100 0.65193838 0.39097589 -0.10272500 0.07580750  0.02963229  57  ILE A CA  
418  C C   . ILE A 57  ? 0.52339089 0.61998999 0.35888743 -0.10594779 0.07801771  0.02809728  57  ILE A C   
419  O O   . ILE A 57  ? 0.52148217 0.62262690 0.35166007 -0.11174680 0.07563291  0.03109262  57  ILE A O   
420  C CB  . ILE A 57  ? 0.49729696 0.60056823 0.34274402 -0.10910065 0.07267941  0.02687394  57  ILE A CB  
421  C CG1 . ILE A 57  ? 0.52228081 0.63594484 0.37305591 -0.10800061 0.06895857  0.03051383  57  ILE A CG1 
422  C CG2 . ILE A 57  ? 0.45924681 0.54970801 0.30742663 -0.11042513 0.07589570  0.01954977  57  ILE A CG2 
423  C CD1 . ILE A 57  ? 0.56968987 0.67982066 0.42677712 -0.10423831 0.07018295  0.02743195  57  ILE A CD1 
424  N N   . LYS A 58  ? 0.48652422 0.57181382 0.32055658 -0.10409278 0.08239114  0.02326121  58  LYS A N   
425  C CA  . LYS A 58  ? 0.49115467 0.56872106 0.31835321 -0.10794171 0.08493670  0.02075638  58  LYS A CA  
426  C C   . LYS A 58  ? 0.53857583 0.61035055 0.36380270 -0.11570108 0.08546813  0.01552385  58  LYS A C   
427  O O   . LYS A 58  ? 0.55865139 0.62687504 0.38961771 -0.11631174 0.08627243  0.01142235  58  LYS A O   
428  C CB  . LYS A 58  ? 0.46797061 0.53452337 0.29472068 -0.10583357 0.08967479  0.01570510  58  LYS A CB  
429  C CG  . LYS A 58  ? 0.44099268 0.50523269 0.26624700 -0.09931568 0.09149064  0.01809022  58  LYS A CG  
430  C CD  . LYS A 58  ? 0.45080134 0.50306737 0.27154529 -0.09977076 0.09584287  0.01383675  58  LYS A CD  
431  C CE  . LYS A 58  ? 0.45896626 0.50914258 0.28559512 -0.10306234 0.09660700  0.00847052  58  LYS A CE  
432  N NZ  . LYS A 58  ? 0.49381596 0.53401864 0.31372330 -0.10530502 0.10049349  0.00571715  58  LYS A NZ  
433  N N   . ASP A 59  ? 0.60638618 0.67479563 0.42237851 -0.12145749 0.08636908  0.01541474  59  ASP A N   
434  C CA  . ASP A 59  ? 0.56309062 0.62143093 0.37397963 -0.12865204 0.08931404  0.00940162  59  ASP A CA  
435  C C   . ASP A 59  ? 0.50074571 0.55046344 0.31835938 -0.12495370 0.09505820  0.00297644  59  ASP A C   
436  O O   . ASP A 59  ? 0.46598163 0.51616943 0.28629562 -0.12066609 0.09635626  0.00318343  59  ASP A O   
437  C CB  . ASP A 59  ? 0.63068748 0.68733096 0.42807314 -0.13678786 0.08916278  0.01097761  59  ASP A CB  
438  C CG  . ASP A 59  ? 0.75646186 0.79780984 0.54559374 -0.14329259 0.09552343  0.00311308  59  ASP A CG  
439  O OD1 . ASP A 59  ? 0.70895195 0.74211717 0.49334514 -0.14854725 0.09729991  -0.00047724 59  ASP A OD1 
440  O OD2 . ASP A 59  ? 0.88550049 0.92156482 0.67265874 -0.14256704 0.09973456  0.00033183  59  ASP A OD2 
441  N N   . GLY A 60  ? 0.46206415 0.50393128 0.28189805 -0.12666652 0.09896041  -0.00191467 60  GLY A N   
442  C CA  . GLY A 60  ? 0.45628816 0.49485439 0.28559917 -0.12244429 0.10430290  -0.00576167 60  GLY A CA  
443  C C   . GLY A 60  ? 0.41766283 0.46445447 0.26068640 -0.11656348 0.10145831  -0.00345586 60  GLY A C   
444  O O   . GLY A 60  ? 0.39236817 0.44409204 0.23834997 -0.11557912 0.09688157  -0.00056185 60  GLY A O   
445  N N   . ASN A 61  ? 0.45420650 0.50323266 0.30451229 -0.11402345 0.10396010  -0.00436675 61  ASN A N   
446  C CA  . ASN A 61  ? 0.49220729 0.54902446 0.35483298 -0.11072792 0.10193393  -0.00219663 61  ASN A CA  
447  C C   . ASN A 61  ? 0.46177262 0.52343774 0.32213780 -0.10966810 0.09690846  0.00074822  61  ASN A C   
448  O O   . ASN A 61  ? 0.47180346 0.53052139 0.32437682 -0.11008481 0.09749265  0.00067496  61  ASN A O   
449  C CB  . ASN A 61  ? 0.52660686 0.58653820 0.39728415 -0.11037399 0.10613680  -0.00303223 61  ASN A CB  
450  C CG  . ASN A 61  ? 0.52019274 0.58967501 0.40566880 -0.10796840 0.10470891  0.00037623  61  ASN A CG  
451  O OD1 . ASN A 61  ? 0.54291153 0.61282176 0.43452430 -0.10548496 0.10401762  0.00197148  61  ASN A OD1 
452  N ND2 . ASN A 61  ? 0.55007422 0.62727451 0.44014290 -0.10974140 0.10380710  0.00223154  61  ASN A ND2 
453  N N   . ASN A 62  ? 0.47394919 0.54143625 0.34026912 -0.10814374 0.09284528  0.00338750  62  ASN A N   
454  C CA  . ASN A 62  ? 0.47802275 0.54966241 0.34291255 -0.10693169 0.08933237  0.00594177  62  ASN A CA  
455  C C   . ASN A 62  ? 0.45041472 0.52846074 0.32486272 -0.10783559 0.08768988  0.00732718  62  ASN A C   
456  O O   . ASN A 62  ? 0.42826450 0.51124960 0.31240743 -0.10734961 0.08612978  0.00896814  62  ASN A O   
457  C CB  . ASN A 62  ? 0.45798397 0.53315687 0.32067123 -0.10569306 0.08555391  0.00871635  62  ASN A CB  
458  C CG  . ASN A 62  ? 0.49113595 0.56410503 0.34452966 -0.10600685 0.08594513  0.00963365  62  ASN A CG  
459  O OD1 . ASN A 62  ? 0.46072155 0.53443515 0.30810350 -0.10334833 0.08598186  0.01227945  62  ASN A OD1 
460  N ND2 . ASN A 62  ? 0.53254795 0.60303050 0.38401383 -0.10941618 0.08621070  0.00849232  62  ASN A ND2 
461  N N   . GLU A 63  ? 0.46676961 0.54412985 0.33762121 -0.11011635 0.08827528  0.00715530  63  GLU A N   
462  C CA  . GLU A 63  ? 0.48286775 0.56784016 0.36080685 -0.11361275 0.08608171  0.00937315  63  GLU A CA  
463  C C   . GLU A 63  ? 0.44923884 0.53590637 0.32339638 -0.11447348 0.08246045  0.01124917  63  GLU A C   
464  O O   . GLU A 63  ? 0.42330861 0.50401461 0.28772876 -0.11160537 0.08302101  0.01063170  63  GLU A O   
465  C CB  . GLU A 63  ? 0.58232355 0.66413105 0.45386913 -0.11867291 0.08852945  0.00810175  63  GLU A CB  
466  C CG  . GLU A 63  ? 0.65923500 0.74075711 0.53442055 -0.11868233 0.09266027  0.00640547  63  GLU A CG  
467  C CD  . GLU A 63  ? 0.84016681 0.92225331 0.71092832 -0.12567982 0.09416252  0.00636095  63  GLU A CD  
468  O OE1 . GLU A 63  ? 0.79297829 0.86483705 0.65230805 -0.12687749 0.09740468  0.00340507  63  GLU A OE1 
469  O OE2 . GLU A 63  ? 1.21274781 1.30633688 1.09112144 -0.13088946 0.09176230  0.01004129  63  GLU A OE2 
470  N N   . ASN A 64  ? 0.42474377 0.52120095 0.30778688 -0.11804067 0.07893469  0.01454280  64  ASN A N   
471  C CA  . ASN A 64  ? 0.37800625 0.47597346 0.25579858 -0.12134634 0.07584408  0.01610849  64  ASN A CA  
472  C C   . ASN A 64  ? 0.38120264 0.47816151 0.25689858 -0.11638071 0.07447415  0.01638279  64  ASN A C   
473  O O   . ASN A 64  ? 0.37993866 0.47171500 0.24448478 -0.11602442 0.07552510  0.01570822  64  ASN A O   
474  C CB  . ASN A 64  ? 0.38070476 0.46759665 0.24105604 -0.12576051 0.07876193  0.01348186  64  ASN A CB  
475  C CG  . ASN A 64  ? 0.40214592 0.48884746 0.26105607 -0.13232818 0.08028255  0.01300893  64  ASN A CG  
476  O OD1 . ASN A 64  ? 0.45744675 0.53272116 0.30504870 -0.13294463 0.08450712  0.00984772  64  ASN A OD1 
477  N ND2 . ASN A 64  ? 0.43072176 0.53188002 0.30238232 -0.13729297 0.07676800  0.01723481  64  ASN A ND2 
478  N N   . LEU A 65  ? 0.37449509 0.47674972 0.26079735 -0.11328666 0.07246040  0.01802241  65  LEU A N   
479  C CA  . LEU A 65  ? 0.39327338 0.49816182 0.27926543 -0.11099809 0.06961748  0.01966279  65  LEU A CA  
480  C C   . LEU A 65  ? 0.39763290 0.51136959 0.29233742 -0.11372516 0.06464972  0.02363727  65  LEU A C   
481  O O   . LEU A 65  ? 0.37780529 0.49691808 0.28287238 -0.11557152 0.06329186  0.02626271  65  LEU A O   
482  C CB  . LEU A 65  ? 0.40432671 0.50644487 0.29199469 -0.10797332 0.07055731  0.01885163  65  LEU A CB  
483  C CG  . LEU A 65  ? 0.41921800 0.51388383 0.29867092 -0.10608526 0.07481429  0.01587024  65  LEU A CG  
484  C CD1 . LEU A 65  ? 0.44063932 0.53263235 0.32063973 -0.10597145 0.07513794  0.01531310  65  LEU A CD1 
485  C CD2 . LEU A 65  ? 0.41821170 0.51143664 0.28740039 -0.10361871 0.07591246  0.01655411  65  LEU A CD2 
486  N N   . ASP A 66  ? 0.35540760 0.47208482 0.24709859 -0.11343664 0.06200046  0.02515332  66  ASP A N   
487  C CA  . ASP A 66  ? 0.35763240 0.48156804 0.25720567 -0.11553196 0.05705960  0.02914427  66  ASP A CA  
488  C C   . ASP A 66  ? 0.35274583 0.47520792 0.25201815 -0.11318075 0.05614702  0.02949714  66  ASP A C   
489  O O   . ASP A 66  ? 0.39555824 0.51585603 0.28718245 -0.11112853 0.05814248  0.02784669  66  ASP A O   
490  C CB  . ASP A 66  ? 0.43328634 0.56200838 0.32734513 -0.11914021 0.05459444  0.03070072  66  ASP A CB  
491  C CG  . ASP A 66  ? 0.43295625 0.56169021 0.32199508 -0.12487084 0.05501793  0.03042683  66  ASP A CG  
492  O OD1 . ASP A 66  ? 0.42970783 0.55917013 0.32366168 -0.12711631 0.05541904  0.03083255  66  ASP A OD1 
493  O OD2 . ASP A 66  ? 0.47360796 0.60120308 0.35224277 -0.12769562 0.05558305  0.02984944  66  ASP A OD2 
494  N N   . VAL A 67  ? 0.31674373 0.44097754 0.22290906 -0.11436129 0.05281578  0.03264989  67  VAL A N   
495  C CA  . VAL A 67  ? 0.34484211 0.46629769 0.24726957 -0.11484858 0.05155309  0.03308515  67  VAL A CA  
496  C C   . VAL A 67  ? 0.33532277 0.46029747 0.24201100 -0.11776035 0.04659047  0.03752058  67  VAL A C   
497  O O   . VAL A 67  ? 0.35923579 0.48401189 0.27472335 -0.11746752 0.04555785  0.04048631  67  VAL A O   
498  C CB  . VAL A 67  ? 0.37980172 0.49001861 0.28058684 -0.11335394 0.05578382  0.03018586  67  VAL A CB  
499  C CG1 . VAL A 67  ? 0.38654667 0.49085742 0.29652303 -0.11130484 0.05803717  0.03136336  67  VAL A CG1 
500  C CG2 . VAL A 67  ? 0.39100128 0.49730593 0.28364933 -0.11682454 0.05417370  0.03058384  67  VAL A CG2 
501  N N   . PHE A 68  ? 0.33369654 0.46265930 0.23406982 -0.12054782 0.04364152  0.03884956  68  PHE A N   
502  C CA  . PHE A 68  ? 0.34284255 0.47449577 0.24393430 -0.12464254 0.03867732  0.04292963  68  PHE A CA  
503  C C   . PHE A 68  ? 0.37636518 0.49707809 0.27177677 -0.12734008 0.03894000  0.04272345  68  PHE A C   
504  O O   . PHE A 68  ? 0.38155341 0.50314265 0.26797798 -0.13028415 0.03887573  0.04182735  68  PHE A O   
505  C CB  . PHE A 68  ? 0.32520115 0.46904999 0.22133078 -0.12711139 0.03582868  0.04480901  68  PHE A CB  
506  C CG  . PHE A 68  ? 0.34747827 0.49639159 0.24474345 -0.13217874 0.03024719  0.04933067  68  PHE A CG  
507  C CD1 . PHE A 68  ? 0.36657426 0.51520741 0.25803548 -0.13727416 0.02713694  0.05163368  68  PHE A CD1 
508  C CD2 . PHE A 68  ? 0.32733130 0.48296088 0.22908548 -0.13361165 0.02772626  0.05166666  68  PHE A CD2 
509  C CE1 . PHE A 68  ? 0.37279946 0.52593488 0.26431945 -0.14260550 0.02188598  0.05599730  68  PHE A CE1 
510  C CE2 . PHE A 68  ? 0.31639838 0.47678709 0.21880072 -0.13875812 0.02236829  0.05620567  68  PHE A CE2 
511  C CZ  . PHE A 68  ? 0.33833236 0.49692085 0.23614833 -0.14269409 0.01960240  0.05827155  68  PHE A CZ  
512  N N   . VAL A 69  ? 0.40054917 0.51104832 0.30070484 -0.12667033 0.03948764  0.04444308  69  VAL A N   
513  C CA  . VAL A 69  ? 0.42125091 0.51455837 0.31416449 -0.12866084 0.04211971  0.04348755  69  VAL A CA  
514  C C   . VAL A 69  ? 0.45381653 0.54321921 0.34247059 -0.13422528 0.03762379  0.04774540  69  VAL A C   
515  O O   . VAL A 69  ? 0.48617956 0.57985502 0.38391924 -0.13274992 0.03464936  0.05250225  69  VAL A O   
516  C CB  . VAL A 69  ? 0.42532995 0.50834721 0.32725307 -0.12180943 0.04792513  0.04331122  69  VAL A CB  
517  C CG1 . VAL A 69  ? 0.43846315 0.49922925 0.33108956 -0.12282895 0.05293716  0.04185129  69  VAL A CG1 
518  C CG2 . VAL A 69  ? 0.44090900 0.52726018 0.34663719 -0.11732516 0.05236966  0.03937547  69  VAL A CG2 
519  N N   . VAL A 70  ? 0.46588987 0.54688603 0.33980647 -0.14162579 0.03708110  0.04648565  70  VAL A N   
520  C CA  . VAL A 70  ? 0.49515611 0.56557244 0.35934842 -0.14912400 0.03415966  0.04946416  70  VAL A CA  
521  C C   . VAL A 70  ? 0.53855920 0.58495706 0.38607582 -0.15393260 0.03970309  0.04535956  70  VAL A C   
522  O O   . VAL A 70  ? 0.52507913 0.57364768 0.36297515 -0.15865861 0.04044933  0.04214688  70  VAL A O   
523  C CB  . VAL A 70  ? 0.47946477 0.56768751 0.33860672 -0.15741941 0.02666313  0.05278779  70  VAL A CB  
524  C CG1 . VAL A 70  ? 0.51183653 0.58936369 0.36008283 -0.16658676 0.02307570  0.05622824  70  VAL A CG1 
525  C CG2 . VAL A 70  ? 0.48161766 0.59181613 0.35420510 -0.15290625 0.02301889  0.05551459  70  VAL A CG2 
526  N N   . ARG A 71  ? 0.61299038 0.63603646 0.45747709 -0.15188417 0.04446459  0.04589492  71  ARG A N   
527  C CA  . ARG A 71  ? 0.66620940 0.65976423 0.49264571 -0.15580851 0.05205211  0.04158047  71  ARG A CA  
528  C C   . ARG A 71  ? 0.68578446 0.67426050 0.49058706 -0.17152242 0.04718325  0.04181025  71  ARG A C   
529  O O   . ARG A 71  ? 0.63525796 0.62875867 0.44041449 -0.17575119 0.04101290  0.04685728  71  ARG A O   
530  C CB  . ARG A 71  ? 0.76067185 0.72809362 0.58722997 -0.14948800 0.05918302  0.04347323  71  ARG A CB  
531  C CG  . ARG A 71  ? 1.02036858 0.99370617 0.86867368 -0.13426244 0.06492752  0.04452400  71  ARG A CG  
532  C CD  . ARG A 71  ? 1.29865086 1.24966395 1.15217817 -0.12392880 0.07416610  0.04808087  71  ARG A CD  
533  N NE  . ARG A 71  ? 1.50083160 1.44944739 1.35606217 -0.12535645 0.06901195  0.05558519  71  ARG A NE  
534  C CZ  . ARG A 71  ? 1.44067538 1.40579093 1.31657362 -0.11816211 0.06451663  0.06432508  71  ARG A CZ  
535  N NH1 . ARG A 71  ? 1.54826093 1.53118491 1.44668317 -0.10729273 0.06612377  0.06785193  71  ARG A NH1 
536  N NH2 . ARG A 71  ? 1.20103419 1.16426206 1.07342279 -0.12335388 0.05820799  0.07013117  71  ARG A NH2 
537  N N   . GLU A 72  ? 0.64714813 0.62712342 0.43392658 -0.18046008 0.04977320  0.03705751  72  GLU A N   
538  C CA  . GLU A 72  ? 0.70593846 0.68980670 0.47315308 -0.19749430 0.04358625  0.03845003  72  GLU A CA  
539  C C   . GLU A 72  ? 0.78556573 0.73466474 0.52654684 -0.20931214 0.04738617  0.03681686  72  GLU A C   
540  O O   . GLU A 72  ? 0.72573131 0.64398587 0.46001840 -0.20402895 0.05749030  0.03266303  72  GLU A O   
541  C CB  . GLU A 72  ? 0.72458094 0.72305202 0.48652998 -0.20288850 0.04237537  0.03657766  72  GLU A CB  
542  C CG  . GLU A 72  ? 0.77724767 0.81247520 0.56010306 -0.19536915 0.03634471  0.04053523  72  GLU A CG  
543  C CD  . GLU A 72  ? 0.80656570 0.86685371 0.59096742 -0.20277710 0.02686928  0.04770326  72  GLU A CD  
544  O OE1 . GLU A 72  ? 0.75780034 0.81011796 0.52357429 -0.21770479 0.02366402  0.04970800  72  GLU A OE1 
545  O OE2 . GLU A 72  ? 0.78226030 0.86803633 0.58455473 -0.19450867 0.02337298  0.05119707  72  GLU A OE2 
546  N N   . GLY A 73  ? 0.95209849 0.90693450 0.67903191 -0.22474277 0.03950623  0.04092028  73  GLY A N   
547  C CA  . GLY A 73  ? 1.26159847 1.18394303 0.95727122 -0.24111283 0.04194829  0.03929421  73  GLY A CA  
548  C C   . GLY A 73  ? 1.30472732 1.20950389 0.99752462 -0.24100624 0.04147331  0.04282898  73  GLY A C   
549  O O   . GLY A 73  ? 1.54720831 1.41128397 1.22312319 -0.24085629 0.05114274  0.03928436  73  GLY A O   
550  N N   . ASN A 80  ? 1.30546904 1.18750608 1.10005140 -0.13373187 0.10759622  0.01866572  80  ASN A N   
551  C CA  . ASN A 80  ? 1.27338564 1.19376326 1.09401035 -0.12747990 0.09849100  0.02246804  80  ASN A CA  
552  C C   . ASN A 80  ? 1.08138335 1.01869297 0.89482158 -0.13681282 0.09219342  0.01829100  80  ASN A C   
553  O O   . ASN A 80  ? 1.05664909 1.00491977 0.87871933 -0.13183334 0.09451731  0.01570596  80  ASN A O   
554  C CB  . ASN A 80  ? 1.27493274 1.20217848 1.11921954 -0.11134617 0.10545319  0.02533662  80  ASN A CB  
555  C CG  . ASN A 80  ? 1.30012059 1.25527704 1.16889048 -0.10521978 0.09645710  0.03369441  80  ASN A CG  
556  O OD1 . ASN A 80  ? 1.10074019 1.07429183 0.96997488 -0.11235497 0.08523784  0.03530467  80  ASN A OD1 
557  N ND2 . ASN A 80  ? 1.39592719 1.35522878 1.28465390 -0.09252406 0.10155848  0.03973833  80  ASN A ND2 
558  N N   . ASN A 81  ? 0.86560881 0.80725640 0.66465163 -0.15007216 0.08374162  0.01912657  81  ASN A N   
559  C CA  . ASN A 81  ? 0.86373127 0.82648647 0.65879613 -0.15817243 0.07633238  0.01845181  81  ASN A CA  
560  C C   . ASN A 81  ? 0.73479497 0.72585869 0.54180598 -0.15909281 0.06493309  0.02466695  81  ASN A C   
561  O O   . ASN A 81  ? 0.82437122 0.81359816 0.62710685 -0.16441382 0.06032079  0.02837905  81  ASN A O   
562  C CB  . ASN A 81  ? 0.90246940 0.84867632 0.66898847 -0.17416249 0.07739458  0.01483659  81  ASN A CB  
563  C CG  . ASN A 81  ? 0.98174232 0.90550995 0.73665124 -0.17359503 0.08861344  0.00777783  81  ASN A CG  
564  O OD1 . ASN A 81  ? 0.92709112 0.86320162 0.68919218 -0.16968909 0.08959591  0.00577503  81  ASN A OD1 
565  N ND2 . ASN A 81  ? 1.00045753 0.88945311 0.73670363 -0.17690708 0.09827960  0.00378355  81  ASN A ND2 
566  N N   . SER A 82  ? 0.57264900 0.58856070 0.39141726 -0.15531763 0.06082734  0.02564665  82  SER A N   
567  C CA  . SER A 82  ? 0.56262892 0.60387743 0.39041555 -0.15596981 0.05192319  0.03100412  82  SER A CA  
568  C C   . SER A 82  ? 0.50579768 0.56459939 0.32956991 -0.16002169 0.04874433  0.03167144  82  SER A C   
569  O O   . SER A 82  ? 0.48938313 0.54191005 0.30818266 -0.15982154 0.05312103  0.02802606  82  SER A O   
570  C CB  . SER A 82  ? 0.52521640 0.57827413 0.37428802 -0.14428881 0.05142697  0.03303679  82  SER A CB  
571  O OG  . SER A 82  ? 0.50636685 0.58304614 0.36225870 -0.14435507 0.04479399  0.03677323  82  SER A OG  
572  N N   . ILE A 83  ? 0.50880033 0.59052712 0.33656520 -0.16202793 0.04196052  0.03693806  83  ILE A N   
573  C CA  . ILE A 83  ? 0.53310829 0.63314569 0.35924158 -0.16374983 0.03974189  0.03960629  83  ILE A CA  
574  C C   . ILE A 83  ? 0.48391879 0.60414487 0.32553798 -0.15343899 0.03862524  0.04227611  83  ILE A C   
575  O O   . ILE A 83  ? 0.51710880 0.64835584 0.36429513 -0.15293990 0.03490689  0.04589265  83  ILE A O   
576  C CB  . ILE A 83  ? 0.55880767 0.66894519 0.37291324 -0.17696580 0.03349468  0.04527638  83  ILE A CB  
577  C CG1 . ILE A 83  ? 0.58433926 0.67063236 0.37786153 -0.18985716 0.03512410  0.04210167  83  ILE A CG1 
578  C CG2 . ILE A 83  ? 0.55691218 0.69274712 0.37271643 -0.17778148 0.03037914  0.05144041  83  ILE A CG2 
579  C CD1 . ILE A 83  ? 0.55220175 0.64608788 0.33260125 -0.20508397 0.02824016  0.04789409  83  ILE A CD1 
580  N N   . GLY A 84  ? 0.46024430 0.58461618 0.30592152 -0.14667344 0.04203178  0.04081601  84  GLY A N   
581  C CA  . GLY A 84  ? 0.41662425 0.55735707 0.27214512 -0.13790414 0.04228142  0.04349586  84  GLY A CA  
582  C C   . GLY A 84  ? 0.40860605 0.54411870 0.27400416 -0.13089409 0.04421031  0.04034556  84  GLY A C   
583  O O   . GLY A 84  ? 0.35559455 0.47642308 0.22329724 -0.12983543 0.04674128  0.03613046  84  GLY A O   
584  N N   . GLY A 85  ? 0.41073477 0.55987680 0.28139231 -0.12692316 0.04302845  0.04352424  85  GLY A N   
585  C CA  . GLY A 85  ? 0.40792280 0.55523479 0.28563130 -0.12322574 0.04352896  0.04190021  85  GLY A CA  
586  C C   . GLY A 85  ? 0.38741606 0.52604580 0.26800969 -0.11762167 0.04843254  0.03736164  85  GLY A C   
587  O O   . GLY A 85  ? 0.40121144 0.53670317 0.28713614 -0.11680877 0.04849117  0.03606476  85  GLY A O   
588  N N   . ILE A 86  ? 0.36065501 0.49631912 0.23750567 -0.11474601 0.05216450  0.03566550  86  ILE A N   
589  C CA  . ILE A 86  ? 0.37383813 0.50140631 0.25213572 -0.11066686 0.05662456  0.03161354  86  ILE A CA  
590  C C   . ILE A 86  ? 0.35890555 0.49010432 0.23448852 -0.10587658 0.05964119  0.03222780  86  ILE A C   
591  O O   . ILE A 86  ? 0.38320252 0.52181387 0.25521648 -0.10295022 0.06063617  0.03572877  86  ILE A O   
592  C CB  . ILE A 86  ? 0.38915035 0.50888294 0.26340050 -0.11046649 0.05979400  0.02898696  86  ILE A CB  
593  C CG1 . ILE A 86  ? 0.47526813 0.58644593 0.34944463 -0.11497644 0.05915457  0.02724142  86  ILE A CG1 
594  C CG2 . ILE A 86  ? 0.35017115 0.46309519 0.22474529 -0.10676976 0.06438773  0.02541974  86  ILE A CG2 
595  C CD1 . ILE A 86  ? 0.48270988 0.58557653 0.34933597 -0.11715065 0.06228606  0.02468270  86  ILE A CD1 
596  N N   . THR A 87  ? 0.32771939 0.45319372 0.20390257 -0.10530312 0.06178126  0.02941787  87  THR A N   
597  C CA  . THR A 87  ? 0.33977860 0.46314475 0.20903203 -0.10189743 0.06612079  0.02902863  87  THR A CA  
598  C C   . THR A 87  ? 0.35317981 0.46530691 0.21891648 -0.10258097 0.06976633  0.02486455  87  THR A C   
599  O O   . THR A 87  ? 0.38049293 0.49059400 0.25221121 -0.10578105 0.06815408  0.02316096  87  THR A O   
600  C CB  . THR A 87  ? 0.36490709 0.49347180 0.23377715 -0.10428719 0.06435773  0.03053460  87  THR A CB  
601  O OG1 . THR A 87  ? 0.34094957 0.47007346 0.21649088 -0.11021890 0.05984058  0.03006822  87  THR A OG1 
602  C CG2 . THR A 87  ? 0.34303850 0.48393005 0.21354282 -0.10333329 0.06185651  0.03519608  87  THR A CG2 
603  N N   . LYS A 88  ? 0.39152980 0.49583143 0.24702068 -0.09943762 0.07539982  0.02369415  88  LYS A N   
604  C CA  . LYS A 88  ? 0.47934657 0.57208133 0.32845211 -0.10287752 0.07846829  0.01981156  88  LYS A CA  
605  C C   . LYS A 88  ? 0.46578133 0.56178397 0.31681824 -0.11049336 0.07487740  0.01971184  88  LYS A C   
606  O O   . LYS A 88  ? 0.46038127 0.56093895 0.30989715 -0.11120562 0.07368757  0.02143364  88  LYS A O   
607  C CB  . LYS A 88  ? 0.56325507 0.64181936 0.39662752 -0.09972119 0.08613014  0.01811529  88  LYS A CB  
608  C CG  . LYS A 88  ? 0.81603718 0.88861287 0.64364290 -0.09099683 0.09171548  0.01964159  88  LYS A CG  
609  C CD  . LYS A 88  ? 0.93763727 0.99454385 0.74893022 -0.08565737 0.10083057  0.01937352  88  LYS A CD  
610  C CE  . LYS A 88  ? 1.11581171 1.17660737 0.92426908 -0.08354732 0.10285190  0.02126608  88  LYS A CE  
611  N NZ  . LYS A 88  ? 1.07097197 1.11532021 0.86229753 -0.08627795 0.10961285  0.01794090  88  LYS A NZ  
612  N N   . THR A 89  ? 0.48795360 0.58400857 0.34311336 -0.11666083 0.07283770  0.01878165  89  THR A N   
613  C CA  . THR A 89  ? 0.48318845 0.58404696 0.33913159 -0.12518267 0.06919780  0.02028973  89  THR A CA  
614  C C   . THR A 89  ? 0.50731218 0.59648252 0.34427845 -0.12966551 0.07368869  0.01779045  89  THR A C   
615  O O   . THR A 89  ? 0.49447125 0.57001537 0.31825212 -0.12545404 0.08045254  0.01486024  89  THR A O   
616  C CB  . THR A 89  ? 0.49462095 0.60097945 0.36009869 -0.13022374 0.06664681  0.02161948  89  THR A CB  
617  O OG1 . THR A 89  ? 0.56792188 0.68503481 0.43923646 -0.13711952 0.06111189  0.02591259  89  THR A OG1 
618  C CG2 . THR A 89  ? 0.49932659 0.59543025 0.35242730 -0.13534592 0.07077268  0.01856573  89  THR A CG2 
619  N N   . ASN A 90  ? 0.51769018 0.61060858 0.35131454 -0.13844542 0.07058917  0.01925890  90  ASN A N   
620  C CA  . ASN A 90  ? 0.53199327 0.61027765 0.34379736 -0.14484583 0.07582270  0.01608495  90  ASN A CA  
621  C C   . ASN A 90  ? 0.57294083 0.63844895 0.37243104 -0.15142962 0.07930740  0.01305933  90  ASN A C   
622  O O   . ASN A 90  ? 0.51273572 0.58828676 0.32229859 -0.15758237 0.07436068  0.01544066  90  ASN A O   
623  C CB  . ASN A 90  ? 0.49365285 0.57957011 0.30330911 -0.15654719 0.07064952  0.01868383  90  ASN A CB  
624  C CG  . ASN A 90  ? 0.51764262 0.61185384 0.33205208 -0.15289451 0.06857292  0.02089353  90  ASN A CG  
625  O OD1 . ASN A 90  ? 0.55659783 0.64818072 0.37043014 -0.14250147 0.07287829  0.01991138  90  ASN A OD1 
626  N ND2 . ASN A 90  ? 0.65579724 0.76011300 0.47224534 -0.16288096 0.06236658  0.02446045  90  ASN A ND2 
627  N N   . ARG A 91  ? 0.73643106 0.77974486 0.51333410 -0.15083252 0.08818842  0.00849251  91  ARG A N   
628  C CA  . ARG A 91  ? 0.96079361 0.98869359 0.72213560 -0.15863660 0.09190065  0.00537003  91  ARG A CA  
629  C C   . ARG A 91  ? 0.92528248 0.95515943 0.67691725 -0.17717536 0.08768007  0.00624200  91  ARG A C   
630  O O   . ARG A 91  ? 0.96499217 0.99404359 0.71291691 -0.18657264 0.08626935  0.00637192  91  ARG A O   
631  C CB  . ARG A 91  ? 1.09584212 1.09482265 0.83156931 -0.15432753 0.10357853  0.00050106  91  ARG A CB  
632  C CG  . ARG A 91  ? 1.26610053 1.26120985 1.00708294 -0.13653849 0.10923000  0.00099813  91  ARG A CG  
633  C CD  . ARG A 91  ? 1.78667736 1.76055431 1.50558126 -0.13174431 0.12016900  -0.00116687 91  ARG A CD  
634  N NE  . ARG A 91  ? 2.02878714 1.99450088 1.74639463 -0.11463016 0.12876990  0.00054133  91  ARG A NE  
635  C CZ  . ARG A 91  ? 1.94967628 1.92594528 1.67623639 -0.10281382 0.13087422  0.00438454  91  ARG A CZ  
636  N NH1 . ARG A 91  ? 1.97624636 1.97418344 1.71777737 -0.10547832 0.12313564  0.00667808  91  ARG A NH1 
637  N NH2 . ARG A 91  ? 1.72766316 1.69531500 1.44996750 -0.08807918 0.14024800  0.00720101  91  ARG A NH2 
638  N N   . THR A 92  ? 1.01382399 1.04709280 0.76036716 -0.18344986 0.08563041  0.00737350  92  THR A N   
639  C CA  . THR A 92  ? 1.10018373 1.13667047 0.83579499 -0.20291872 0.08097701  0.00923508  92  THR A CA  
640  C C   . THR A 92  ? 1.14285553 1.20556819 0.89925146 -0.20500256 0.07114272  0.01597168  92  THR A C   
641  O O   . THR A 92  ? 1.00664055 1.07342100 0.77168268 -0.19409747 0.07155822  0.01619352  92  THR A O   
642  C CB  . THR A 92  ? 1.09614134 1.10469174 0.79702169 -0.21125561 0.08992486  0.00336267  92  THR A CB  
643  O OG1 . THR A 92  ? 0.97712153 0.98101193 0.67749107 -0.19881211 0.09518732  0.00171746  92  THR A OG1 
644  C CG2 . THR A 92  ? 1.08028460 1.05850291 0.75655401 -0.21068156 0.10053653  -0.00288267 92  THR A CG2 
645  N N   . GLN A 93  ? 1.30432653 1.38428664 1.06671679 -0.21982603 0.06267777  0.02213245  93  GLN A N   
646  C CA  . GLN A 93  ? 1.50700128 1.60825539 1.28241158 -0.22541715 0.05386073  0.02926831  93  GLN A CA  
647  C C   . GLN A 93  ? 1.41569209 1.50318718 1.16873765 -0.23144037 0.05751682  0.02548680  93  GLN A C   
648  O O   . GLN A 93  ? 1.44282115 1.51049840 1.16643059 -0.24433564 0.06285764  0.02077522  93  GLN A O   
649  C CB  . GLN A 93  ? 1.54900157 1.67076468 1.32919288 -0.24353409 0.04445561  0.03805560  93  GLN A CB  
650  C CG  . GLN A 93  ? 1.61126995 1.76192963 1.42502952 -0.23810737 0.03657757  0.04792100  93  GLN A CG  
651  C CD  . GLN A 93  ? 1.78283525 1.95084929 1.59644139 -0.25683656 0.02997685  0.05630360  93  GLN A CD  
652  O OE1 . GLN A 93  ? 1.73772311 1.90840864 1.53590953 -0.27471873 0.02579537  0.05937657  93  GLN A OE1 
653  N NE2 . GLN A 93  ? 1.55972791 1.73868108 1.38733983 -0.25455958 0.02960109  0.05980998  93  GLN A NE2 
654  N N   . HIS A 94  ? 1.24180877 1.33852553 1.00745928 -0.22235446 0.05534725  0.02737837  94  HIS A N   
655  C CA  . HIS A 94  ? 1.25715828 1.34497762 1.00503159 -0.22741224 0.05843027  0.02481918  94  HIS A CA  
656  C C   . HIS A 94  ? 1.41060948 1.52363372 1.17397738 -0.23637260 0.04665283  0.03391378  94  HIS A C   
657  O O   . HIS A 94  ? 1.27842009 1.40542150 1.06239331 -0.22583158 0.04245135  0.03772084  94  HIS A O   
658  C CB  . HIS A 94  ? 1.21423161 1.29499829 0.96513188 -0.20931205 0.06540036  0.02087187  94  HIS A CB  
659  C CG  . HIS A 94  ? 1.22727704 1.28367257 0.96270758 -0.19837366 0.07804726  0.01344586  94  HIS A CG  
660  N ND1 . HIS A 94  ? 1.30275297 1.33905303 1.01620114 -0.19464384 0.08935045  0.00815580  94  HIS A ND1 
661  C CD2 . HIS A 94  ? 1.09701490 1.14674842 0.83712769 -0.18882510 0.08164214  0.01141871  94  HIS A CD2 
662  C CE1 . HIS A 94  ? 1.09608328 1.11448193 0.80196363 -0.18268865 0.09934831  0.00399699  94  HIS A CE1 
663  N NE2 . HIS A 94  ? 1.09530389 1.12136960 0.81632912 -0.18010207 0.09428339  0.00573167  94  HIS A NE2 
664  N N   . ILE A 95  ? 1.76187122 1.88077962 1.51480854 -0.25645310 0.04113527  0.03815383  95  ILE A N   
665  C CA  . ILE A 95  ? 1.77788782 1.91973758 1.54147232 -0.26710621 0.03023048  0.04775833  95  ILE A CA  
666  C C   . ILE A 95  ? 1.73825705 1.87065530 1.48672175 -0.26806027 0.03383857  0.04378313  95  ILE A C   
667  O O   . ILE A 95  ? 1.33751357 1.48662829 1.10259891 -0.26460925 0.02720874  0.04974869  95  ILE A O   
668  C CB  . ILE A 95  ? 1.64599526 1.79980397 1.40201330 -0.29010832 0.02267235  0.05503023  95  ILE A CB  
669  C CG1 . ILE A 95  ? 1.56172609 1.71911955 1.32484174 -0.29038265 0.02260685  0.05654500  95  ILE A CG1 
670  C CG2 . ILE A 95  ? 1.53502893 1.71962416 1.31195116 -0.29713228 0.00966760  0.06860775  95  ILE A CG2 
671  C CD1 . ILE A 95  ? 1.37899971 1.54323614 1.12670135 -0.31538332 0.01750994  0.06188109  95  ILE A CD1 
672  N N   . ASP A 96  ? 2.03238106 2.13675427 1.74920654 -0.27150038 0.04542952  0.03375969  96  ASP A N   
673  C CA  . ASP A 96  ? 1.93003178 2.02327442 1.63369894 -0.26715311 0.05239859  0.02882491  96  ASP A CA  
674  C C   . ASP A 96  ? 1.81765759 1.91003454 1.53820300 -0.24269237 0.05800469  0.02602467  96  ASP A C   
675  O O   . ASP A 96  ? 1.47427130 1.56523371 1.20685768 -0.23088934 0.05969705  0.02494181  96  ASP A O   
676  C CB  . ASP A 96  ? 1.83006155 1.89346945 1.49294853 -0.28063601 0.06353121  0.02033316  96  ASP A CB  
677  C CG  . ASP A 96  ? 2.08351803 2.12929296 1.73070538 -0.27095178 0.07601050  0.01340432  96  ASP A CG  
678  O OD1 . ASP A 96  ? 1.93660390 1.99834037 1.59519386 -0.26871350 0.07151024  0.01726382  96  ASP A OD1 
679  O OD2 . ASP A 96  ? 2.36274695 2.37980509 1.98789501 -0.26442134 0.09050140  0.00499554  96  ASP A OD2 
680  N N   . THR A 97  ? 1.39586329 1.49068928 1.11730480 -0.23585664 0.06060692  0.02548929  97  THR A N   
681  C CA  . THR A 97  ? 1.14940310 1.24747610 0.88703263 -0.21511306 0.06456987  0.02462044  97  THR A CA  
682  C C   . THR A 97  ? 1.02467442 1.09840083 0.74564105 -0.20387791 0.07939941  0.01683023  97  THR A C   
683  O O   . THR A 97  ? 1.09107041 1.14156747 0.78409290 -0.21120526 0.08884982  0.01096392  97  THR A O   
684  C CB  . THR A 97  ? 1.13933015 1.24956024 0.88301432 -0.21206795 0.06276336  0.02742711  97  THR A CB  
685  O OG1 . THR A 97  ? 0.99670601 1.08759665 0.71259129 -0.21518022 0.07493436  0.02113138  97  THR A OG1 
686  C CG2 . THR A 97  ? 1.01588917 1.14809775 0.77435148 -0.22298406 0.04861205  0.03583516  97  THR A CG2 
687  N N   . VAL A 98  ? 0.88452828 0.96324575 0.62229675 -0.18608741 0.08153902  0.01747568  98  VAL A N   
688  C CA  . VAL A 98  ? 0.85028124 0.91113591 0.57840985 -0.17209727 0.09455848  0.01282245  98  VAL A CA  
689  C C   . VAL A 98  ? 0.86047143 0.91638458 0.57806408 -0.16423133 0.10508496  0.01158636  98  VAL A C   
690  O O   . VAL A 98  ? 0.88146907 0.91554338 0.58055568 -0.15694989 0.11911701  0.00721785  98  VAL A O   
691  C CB  . VAL A 98  ? 0.82453978 0.89884067 0.57793975 -0.15828107 0.09001804  0.01618744  98  VAL A CB  
692  C CG1 . VAL A 98  ? 0.78789181 0.85324168 0.53901958 -0.14127856 0.10107977  0.01485151  98  VAL A CG1 
693  C CG2 . VAL A 98  ? 0.79001224 0.86658859 0.55236942 -0.16365197 0.08281894  0.01683840  98  VAL A CG2 
694  N N   . GLN A 99  ? 0.82990128 0.90631998 0.56044978 -0.16389801 0.09914860  0.01615350  99  GLN A N   
695  C CA  . GLN A 99  ? 0.83589852 0.91302532 0.56023419 -0.15570191 0.10864328  0.01638760  99  GLN A CA  
696  C C   . GLN A 99  ? 0.78674555 0.88476014 0.52046490 -0.16440588 0.09871642  0.02086651  99  GLN A C   
697  O O   . GLN A 99  ? 0.82486105 0.93979657 0.57701778 -0.16998170 0.08476977  0.02539047  99  GLN A O   
698  C CB  . GLN A 99  ? 0.82752162 0.91155833 0.56538892 -0.13584536 0.11449777  0.01942895  99  GLN A CB  
699  C CG  . GLN A 99  ? 0.83273619 0.92301357 0.56858963 -0.12500556 0.12465011  0.02201873  99  GLN A CG  
700  C CD  . GLN A 99  ? 0.94507021 1.00886881 0.65192741 -0.12415992 0.14192510  0.01639865  99  GLN A CD  
701  O OE1 . GLN A 99  ? 0.87456667 0.91421711 0.56658959 -0.11818571 0.15291959  0.01243362  99  GLN A OE1 
702  N NE2 . GLN A 99  ? 1.19679415 1.26174617 0.89251727 -0.13036637 0.14584731  0.01564700  99  GLN A NE2 
703  N N   . ASN A 100 ? 0.86320537 0.95647264 0.58086669 -0.16703400 0.10688822  0.01922351  100 ASN A N   
704  C CA  . ASN A 100 ? 0.88637531 0.99990511 0.61212641 -0.17254543 0.09989713  0.02383629  100 ASN A CA  
705  C C   . ASN A 100 ? 0.81345570 0.93781263 0.54615873 -0.15708748 0.10823669  0.02677654  100 ASN A C   
706  O O   . ASN A 100 ? 0.77068186 0.88026649 0.48920554 -0.14687632 0.12416642  0.02369498  100 ASN A O   
707  C CB  . ASN A 100 ? 0.90773404 1.01283181 0.61147815 -0.18994014 0.10088701  0.02110462  100 ASN A CB  
708  C CG  . ASN A 100 ? 1.02369857 1.12645388 0.72556043 -0.20654342 0.08955710  0.02140665  100 ASN A CG  
709  O OD1 . ASN A 100 ? 0.93497074 1.05610752 0.65936333 -0.20891002 0.07519434  0.02741736  100 ASN A OD1 
710  N ND2 . ASN A 100 ? 1.11030614 1.18926787 0.78477126 -0.21741900 0.09697169  0.01530881  100 ASN A ND2 
711  N N   . VAL A 101 ? 0.81364077 0.96374464 0.56775045 -0.15613472 0.09736471  0.03350450  101 VAL A N   
712  C CA  . VAL A 101 ? 0.82891202 0.99682754 0.59607631 -0.14255776 0.10104096  0.03883692  101 VAL A CA  
713  C C   . VAL A 101 ? 0.77381122 0.96103263 0.54491764 -0.14990801 0.09547158  0.04332263  101 VAL A C   
714  O O   . VAL A 101 ? 0.79511768 0.99150163 0.57400656 -0.16175212 0.08160230  0.04586162  101 VAL A O   
715  C CB  . VAL A 101 ? 0.79780293 0.97646582 0.58610642 -0.13511844 0.09269550  0.04271439  101 VAL A CB  
716  C CG1 . VAL A 101 ? 0.85045755 1.05318439 0.65461898 -0.12633198 0.09125526  0.05019581  101 VAL A CG1 
717  C CG2 . VAL A 101 ? 0.84452307 1.00499022 0.62752837 -0.12539050 0.10121201  0.03884937  101 VAL A CG2 
718  N N   . ASN A 102 ? 0.70772088 0.90170109 0.47420436 -0.14202479 0.10675447  0.04515978  102 ASN A N   
719  C CA  . ASN A 102 ? 0.73861456 0.95185721 0.50851989 -0.14968206 0.10146400  0.04959764  102 ASN A CA  
720  C C   . ASN A 102 ? 0.69434476 0.93330610 0.48790532 -0.14592728 0.09035000  0.05772077  102 ASN A C   
721  O O   . ASN A 102 ? 0.72589368 0.97626948 0.52825063 -0.13264419 0.09648976  0.06205234  102 ASN A O   
722  C CB  . ASN A 102 ? 0.82066548 1.03031254 0.57377255 -0.14618552 0.11763388  0.04796593  102 ASN A CB  
723  C CG  . ASN A 102 ? 0.90048426 1.13339186 0.65836036 -0.15344690 0.11260706  0.05340036  102 ASN A CG  
724  O OD1 . ASN A 102 ? 0.90015435 1.14869010 0.66198272 -0.14315580 0.12205794  0.05809341  102 ASN A OD1 
725  N ND2 . ASN A 102 ? 0.81748945 1.05571723 0.57736737 -0.17017558 0.09743913  0.05440709  102 ASN A ND2 
726  N N   . LEU A 103 ? 0.68765932 0.93574882 0.48958650 -0.15847802 0.07475653  0.06056481  103 LEU A N   
727  C CA  . LEU A 103 ? 0.61845177 0.88918304 0.43701085 -0.15960485 0.06424385  0.06818864  103 LEU A CA  
728  C C   . LEU A 103 ? 0.66888076 0.95722175 0.48539627 -0.16684176 0.06290080  0.07274476  103 LEU A C   
729  O O   . LEU A 103 ? 0.67490530 0.95917809 0.48252103 -0.17929970 0.05879543  0.07131805  103 LEU A O   
730  C CB  . LEU A 103 ? 0.58053702 0.84646785 0.40726498 -0.16861469 0.04942742  0.06866401  103 LEU A CB  
731  C CG  . LEU A 103 ? 0.56287736 0.84478974 0.40206194 -0.17347519 0.03758721  0.07550304  103 LEU A CG  
732  C CD1 . LEU A 103 ? 0.59824109 0.89208013 0.44689372 -0.16370012 0.03965975  0.07926042  103 LEU A CD1 
733  C CD2 . LEU A 103 ? 0.56669223 0.83774918 0.41159549 -0.18029234 0.02615827  0.07528824  103 LEU A CD2 
734  N N   . LEU A 104 ? 0.68594718 0.99612814 0.51216048 -0.16018045 0.06462974  0.07944367  104 LEU A N   
735  C CA  . LEU A 104 ? 0.69842482 1.03032839 0.52450472 -0.16306625 0.06674073  0.08513810  104 LEU A CA  
736  C C   . LEU A 104 ? 0.69037640 1.04371476 0.52992940 -0.16850699 0.05422731  0.09330905  104 LEU A C   
737  O O   . LEU A 104 ? 0.85956609 1.22641802 0.70892298 -0.16023828 0.05565346  0.09833138  104 LEU A O   
738  C CB  . LEU A 104 ? 0.77731407 1.11727738 0.60185957 -0.14751269 0.08408612  0.08697553  104 LEU A CB  
739  C CG  . LEU A 104 ? 0.98540616 1.30606818 0.79114741 -0.14357017 0.10021988  0.07987420  104 LEU A CG  
740  C CD1 . LEU A 104 ? 1.03170943 1.36060214 0.83765411 -0.12510040 0.11914349  0.08346502  104 LEU A CD1 
741  C CD2 . LEU A 104 ? 0.96691680 1.28774309 0.76027405 -0.15844293 0.09800962  0.07801524  104 LEU A CD2 
742  N N   . VAL A 105 ? 0.64504498 1.00050128 0.48379767 -0.18314929 0.04195404  0.09512828  105 VAL A N   
743  C CA  . VAL A 105 ? 0.62437755 0.99632126 0.47162184 -0.19062114 0.03046676  0.10253753  105 VAL A CA  
744  C C   . VAL A 105 ? 0.65472251 1.05050671 0.50009298 -0.19658560 0.03171587  0.10876084  105 VAL A C   
745  O O   . VAL A 105 ? 0.74191254 1.13472247 0.57825434 -0.20310281 0.03345127  0.10663202  105 VAL A O   
746  C CB  . VAL A 105 ? 0.59862381 0.95497036 0.44550234 -0.20247976 0.01656985  0.10138088  105 VAL A CB  
747  C CG1 . VAL A 105 ? 0.58661228 0.95090395 0.43876541 -0.21027508 0.00537986  0.10758650  105 VAL A CG1 
748  C CG2 . VAL A 105 ? 0.61199498 0.94499874 0.45962280 -0.19712101 0.01692090  0.09488322  105 VAL A CG2 
749  N N   . SER A 106 ? 0.68830144 1.10886741 0.54157132 -0.19633229 0.02989359  0.11708447  106 SER A N   
750  C CA  . SER A 106 ? 0.68049520 1.12704396 0.53317720 -0.20267567 0.03061559  0.12416628  106 SER A CA  
751  C C   . SER A 106 ? 0.77641690 1.23500323 0.63207453 -0.21693219 0.01597241  0.13134399  106 SER A C   
752  O O   . SER A 106 ? 0.89883029 1.36173177 0.76032323 -0.21610652 0.01153267  0.13475269  106 SER A O   
753  C CB  . SER A 106 ? 0.59723359 1.06573927 0.45526883 -0.18784428 0.04584392  0.12873746  106 SER A CB  
754  O OG  . SER A 106 ? 0.64378434 1.13774228 0.51342654 -0.18567818 0.04278012  0.13846630  106 SER A OG  
755  N N   . LYS A 107 ? 0.88135612 1.34197378 0.73064667 -0.23158152 0.00801060  0.13330638  107 LYS A N   
756  C CA  . LYS A 107 ? 0.88296229 1.35001719 0.73115826 -0.24676527 -0.00547687 0.13964072  107 LYS A CA  
757  C C   . LYS A 107 ? 0.95266008 1.44844770 0.79870176 -0.25605571 -0.00546509 0.14734516  107 LYS A C   
758  O O   . LYS A 107 ? 0.91454351 1.41261792 0.75549400 -0.25711170 -0.00021637 0.14544168  107 LYS A O   
759  C CB  . LYS A 107 ? 0.91059881 1.34694624 0.75254053 -0.25564015 -0.01596320 0.13482931  107 LYS A CB  
760  C CG  . LYS A 107 ? 1.04272366 1.48019469 0.87807703 -0.27387604 -0.02880901 0.14083411  107 LYS A CG  
761  C CD  . LYS A 107 ? 1.15085304 1.57816648 0.98409140 -0.28122020 -0.03802387 0.14358838  107 LYS A CD  
762  C CE  . LYS A 107 ? 1.13640833 1.58526778 0.96498132 -0.29532608 -0.04427028 0.15263212  107 LYS A CE  
763  N NZ  . LYS A 107 ? 1.05909359 1.53041053 0.89450979 -0.28926158 -0.03955774 0.15654951  107 LYS A NZ  
764  N N   . SER A 108 ? 0.88778937 1.40685737 0.73684150 -0.26369166 -0.01099037 0.15646011  108 SER A N   
765  C CA  . SER A 108 ? 0.86490977 1.41280103 0.71200228 -0.27534348 -0.01334973 0.16515373  108 SER A CA  
766  C C   . SER A 108 ? 0.97006589 1.50570965 0.80690235 -0.29571348 -0.02881842 0.16736577  108 SER A C   
767  O O   . SER A 108 ? 0.91152251 1.45191407 0.74690557 -0.30445346 -0.03652379 0.17262292  108 SER A O   
768  C CB  . SER A 108 ? 0.92929673 1.51493812 0.78656000 -0.27105093 -0.00879760 0.17559701  108 SER A CB  
769  O OG  . SER A 108 ? 0.94349593 1.53806376 0.81053293 -0.25015491 0.00652078  0.17450148  108 SER A OG  
770  N N   . THR A 109 ? 1.21140850 1.73132586 1.03972030 -0.30403170 -0.03297962 0.16407003  109 THR A N   
771  C CA  . THR A 109 ? 1.09595466 1.60140395 0.91362566 -0.32246703 -0.04679428 0.16679671  109 THR A CA  
772  C C   . THR A 109 ? 1.06960404 1.60572982 0.88323092 -0.33760837 -0.05106852 0.17685169  109 THR A C   
773  O O   . THR A 109 ? 1.02505195 1.55380321 0.82805377 -0.35402426 -0.06075355 0.17992097  109 THR A O   
774  C CB  . THR A 109 ? 1.17892551 1.66025853 0.99022919 -0.32589412 -0.04999087 0.16185726  109 THR A CB  
775  O OG1 . THR A 109 ? 1.34820914 1.82188404 1.16506636 -0.30997813 -0.03945898 0.15414074  109 THR A OG1 
776  C CG2 . THR A 109 ? 1.17412376 1.62258232 0.97923660 -0.33329451 -0.06113892 0.16084719  109 THR A CG2 
777  N N   . GLY A 110 ? 1.09583378 1.66735137 0.91830927 -0.33195212 -0.04365795 0.18293473  110 GLY A N   
778  C CA  . GLY A 110 ? 1.24986839 1.85468459 1.07028735 -0.34682927 -0.04852273 0.19432336  110 GLY A CA  
779  C C   . GLY A 110 ? 1.44804609 2.09536552 1.28221190 -0.33483273 -0.03595266 0.20105231  110 GLY A C   
780  O O   . GLY A 110 ? 0.94792587 1.59329426 0.79137278 -0.31466845 -0.02341625 0.19601679  110 GLY A O   
781  N N   . GLN A 111 ? 1.55128419 2.23615122 1.38608861 -0.34732231 -0.03884130 0.21291602  111 GLN A N   
782  C CA  . GLN A 111 ? 1.38667846 2.11574173 1.23522389 -0.33637482 -0.02612961 0.22135131  111 GLN A CA  
783  C C   . GLN A 111 ? 1.41677642 2.14455223 1.26325250 -0.32990056 -0.01558346 0.21617916  111 GLN A C   
784  O O   . GLN A 111 ? 1.18857503 1.94340312 1.04543626 -0.31538936 -0.00064073 0.21996206  111 GLN A O   
785  C CB  . GLN A 111 ? 1.35910749 2.13263655 1.20972753 -0.35239026 -0.03204379 0.23680168  111 GLN A CB  
786  C CG  . GLN A 111 ? 1.43504059 2.24365330 1.30088568 -0.34439301 -0.02850916 0.24795425  111 GLN A CG  
787  C CD  . GLN A 111 ? 1.48473322 2.31870508 1.34485161 -0.36862269 -0.04242121 0.26066864  111 GLN A CD  
788  O OE1 . GLN A 111 ? 1.51498830 2.36372805 1.36657321 -0.38717261 -0.04881784 0.26626796  111 GLN A OE1 
789  N NE2 . GLN A 111 ? 1.43351567 2.26875854 1.29553211 -0.37033802 -0.04766423 0.26445562  111 GLN A NE2 
790  N N   . HIS A 112 ? 1.25639951 1.95158386 1.08884192 -0.34037259 -0.02278537 0.20794722  112 HIS A N   
791  C CA  . HIS A 112 ? 1.11110342 1.80305123 0.93808597 -0.33823714 -0.01449874 0.20300770  112 HIS A CA  
792  C C   . HIS A 112 ? 1.00422430 1.66191149 0.82926178 -0.32264945 -0.00579116 0.19001248  112 HIS A C   
793  O O   . HIS A 112 ? 1.09184110 1.75419819 0.91542715 -0.31388086 0.00779051  0.18663993  112 HIS A O   
794  C CB  . HIS A 112 ? 1.18251920 1.87047172 0.99552500 -0.36132964 -0.02682940 0.20532480  112 HIS A CB  
795  C CG  . HIS A 112 ? 1.22058344 1.94173467 1.03256476 -0.37934750 -0.03552505 0.21820027  112 HIS A CG  
796  N ND1 . HIS A 112 ? 1.19053698 1.95621610 1.01421070 -0.37746447 -0.03098425 0.22989434  112 HIS A ND1 
797  C CD2 . HIS A 112 ? 1.17328405 1.88656127 0.97157598 -0.40213373 -0.04987885 0.22151123  112 HIS A CD2 
798  C CE1 . HIS A 112 ? 1.14134288 1.92611456 0.95781255 -0.39986730 -0.04267696 0.23960438  112 HIS A CE1 
799  N NE2 . HIS A 112 ? 1.17478204 1.92630887 0.97483718 -0.41510263 -0.05404155 0.23420449  112 HIS A NE2 
800  N N   . THR A 113 ? 0.99455035 1.61824596 0.81827921 -0.31958702 -0.01236221 0.18283527  113 THR A N   
801  C CA  A THR A 113 ? 1.08852482 1.67947614 0.90808839 -0.30931848 -0.00646513 0.17114981  113 THR A CA  
802  C CA  B THR A 113 ? 0.93357718 1.52431250 0.75310194 -0.30940145 -0.00658599 0.17112999  113 THR A CA  
803  C C   . THR A 113 ? 0.95546234 1.53353739 0.78399569 -0.29171312 -0.00077765 0.16650178  113 THR A C   
804  O O   . THR A 113 ? 1.04698789 1.62023473 0.87987369 -0.29336751 -0.00923306 0.16867326  113 THR A O   
805  C CB  A THR A 113 ? 1.19039416 1.75062990 0.99896228 -0.32361916 -0.02016776 0.16712025  113 THR A CB  
806  C CB  B THR A 113 ? 0.84243137 1.40241575 0.65104306 -0.32378417 -0.02048641 0.16718939  113 THR A CB  
807  O OG1 A THR A 113 ? 1.42698789 1.98025298 1.23661768 -0.33176669 -0.03310663 0.17114508  113 THR A OG1 
808  O OG1 B THR A 113 ? 0.80667436 1.38016438 0.60681623 -0.34095788 -0.02646526 0.17279273  113 THR A OG1 
809  C CG2 A THR A 113 ? 1.16212595 1.73138487 0.96053296 -0.34196553 -0.02700864 0.17177677  113 THR A CG2 
810  C CG2 B THR A 113 ? 0.71022570 1.24009013 0.51429528 -0.31621727 -0.01599814 0.15686688  113 THR A CG2 
811  N N   . THR A 114 ? 0.78661412 1.35641289 0.61563230 -0.27560085 0.01410267  0.15961272  114 THR A N   
812  C CA  . THR A 114 ? 0.84132510 1.39245856 0.67587829 -0.25980845 0.01952770  0.15357003  114 THR A CA  
813  C C   . THR A 114 ? 0.84526449 1.36182499 0.66980135 -0.25711495 0.02281496  0.14203678  114 THR A C   
814  O O   . THR A 114 ? 0.86781609 1.38220763 0.68240976 -0.25979245 0.02979691  0.13878390  114 THR A O   
815  C CB  . THR A 114 ? 0.80224460 1.37696052 0.64701688 -0.24148589 0.03563629  0.15774766  114 THR A CB  
816  O OG1 . THR A 114 ? 0.87663651 1.44580221 0.71396011 -0.23242377 0.05184068  0.15219955  114 THR A OG1 
817  C CG2 . THR A 114 ? 0.71465719 1.33094370 0.56975269 -0.24527764 0.03346235  0.17137325  114 THR A CG2 
818  N N   . SER A 115 ? 0.84784603 1.33817816 0.67402762 -0.25265965 0.01826390  0.13613242  115 SER A N   
819  C CA  . SER A 115 ? 0.82239926 1.28324950 0.64017498 -0.24914293 0.02250290  0.12617944  115 SER A CA  
820  C C   . SER A 115 ? 0.78251213 1.22947574 0.60484922 -0.23219134 0.03162269  0.12059432  115 SER A C   
821  O O   . SER A 115 ? 0.78111374 1.23510396 0.61400157 -0.22384071 0.03135839  0.12362015  115 SER A O   
822  C CB  . SER A 115 ? 0.78138721 1.22041297 0.59497821 -0.26170215 0.00803004  0.12414260  115 SER A CB  
823  O OG  . SER A 115 ? 0.92246628 1.36972475 0.74096817 -0.27146041 -0.00512076 0.13128012  115 SER A OG  
824  N N   . VAL A 116 ? 0.81479812 1.24015260 0.62700939 -0.22885180 0.03934570  0.11225104  116 VAL A N   
825  C CA  . VAL A 116 ? 0.81819659 1.22423935 0.63102680 -0.21568695 0.04687553  0.10573170  116 VAL A CA  
826  C C   . VAL A 116 ? 0.84214723 1.22134376 0.64625430 -0.22444856 0.04002072  0.09911893  116 VAL A C   
827  O O   . VAL A 116 ? 0.79584718 1.16836965 0.58658338 -0.23404652 0.04153353  0.09627973  116 VAL A O   
828  C CB  . VAL A 116 ? 0.80495870 1.21231723 0.61094695 -0.20209776 0.06716601  0.10279055  116 VAL A CB  
829  C CG1 . VAL A 116 ? 0.82267797 1.20418787 0.62402356 -0.19059119 0.07593130  0.09480647  116 VAL A CG1 
830  C CG2 . VAL A 116 ? 0.75746799 1.19598997 0.57552975 -0.19206937 0.07387696  0.11187764  116 VAL A CG2 
831  N N   . THR A 117 ? 0.74596554 1.11176753 0.55772197 -0.22189976 0.03239110  0.09761024  117 THR A N   
832  C CA  . THR A 117 ? 0.69982147 1.04190838 0.50547248 -0.22611234 0.02900360  0.09181258  117 THR A CA  
833  C C   . THR A 117 ? 0.72154939 1.04846144 0.52344149 -0.21283577 0.04168435  0.08479252  117 THR A C   
834  O O   . THR A 117 ? 0.76006472 1.09028411 0.57112807 -0.20018575 0.04595059  0.08540668  117 THR A O   
835  C CB  . THR A 117 ? 0.71165454 1.04883575 0.52802658 -0.23138830 0.01366204  0.09535664  117 THR A CB  
836  O OG1 . THR A 117 ? 0.72788531 1.07926071 0.54485309 -0.24271479 0.00483590  0.10214547  117 THR A OG1 
837  C CG2 . THR A 117 ? 0.68693590 1.00428784 0.50098312 -0.23553206 0.00870824  0.09192899  117 THR A CG2 
838  N N   . SER A 118 ? 0.69935584 1.00876701 0.48586792 -0.21679106 0.04790952  0.07835847  118 SER A N   
839  C CA  . SER A 118 ? 0.67429477 0.96669954 0.45348307 -0.20546201 0.06108049  0.07153095  118 SER A CA  
840  C C   . SER A 118 ? 0.77590799 1.04803777 0.54887873 -0.21371257 0.05502959  0.06708388  118 SER A C   
841  O O   . SER A 118 ? 0.75330448 1.02099180 0.51498723 -0.22775504 0.05104155  0.06644349  118 SER A O   
842  C CB  . SER A 118 ? 0.66895825 0.95788783 0.43229645 -0.20032656 0.07867017  0.06781407  118 SER A CB  
843  O OG  . SER A 118 ? 0.73407996 0.99672902 0.48182258 -0.19667685 0.08957578  0.05956984  118 SER A OG  
844  N N   . THR A 119 ? 0.86028624 1.12325001 0.64205319 -0.20581402 0.05322366  0.06535976  119 THR A N   
845  C CA  . THR A 119 ? 0.86070448 1.10795546 0.63906628 -0.21330670 0.04712468  0.06251448  119 THR A CA  
846  C C   . THR A 119 ? 0.85947633 1.09020281 0.63488853 -0.20212243 0.05643384  0.05656987  119 THR A C   
847  O O   . THR A 119 ? 0.80113447 1.03114223 0.57536203 -0.18866566 0.06842309  0.05472052  119 THR A O   
848  C CB  . THR A 119 ? 0.80641651 1.06161189 0.60171741 -0.21914783 0.03035124  0.06893861  119 THR A CB  
849  O OG1 . THR A 119 ? 0.72874844 0.98749304 0.53958559 -0.20737603 0.02877370  0.07044427  119 THR A OG1 
850  C CG2 . THR A 119 ? 0.87730646 1.14769411 0.67462957 -0.22928265 0.02191056  0.07535604  119 THR A CG2 
851  N N   . ASN A 120 ? 0.85573244 1.07418704 0.62902290 -0.20896147 0.05090653  0.05456396  120 ASN A N   
852  C CA  . ASN A 120 ? 0.96857989 1.16982245 0.73746163 -0.20227951 0.05749984  0.04905828  120 ASN A CA  
853  C C   . ASN A 120 ? 0.82123113 1.02662373 0.61048102 -0.19718076 0.04773586  0.05217960  120 ASN A C   
854  O O   . ASN A 120 ? 0.80654919 1.01741111 0.60503757 -0.20557316 0.03566815  0.05662335  120 ASN A O   
855  C CB  . ASN A 120 ? 0.89778531 1.08181190 0.64621419 -0.21543518 0.05976515  0.04438932  120 ASN A CB  
856  C CG  . ASN A 120 ? 1.03557134 1.19922662 0.77365828 -0.20715714 0.07116297  0.03761139  120 ASN A CG  
857  O OD1 . ASN A 120 ? 1.33467555 1.48893380 1.06179142 -0.19679245 0.08576932  0.03352955  120 ASN A OD1 
858  N ND2 . ASN A 120 ? 0.98081934 1.13892460 0.72422785 -0.20987310 0.06507057  0.03739667  120 ASN A ND2 
859  N N   . TYR A 121 ? 0.79863781 1.00214243 0.59508997 -0.18290140 0.05349346  0.05067807  121 TYR A N   
860  C CA  . TYR A 121 ? 0.78412050 0.98764747 0.59633505 -0.17760968 0.04690126  0.05207437  121 TYR A CA  
861  C C   . TYR A 121 ? 0.70958304 0.89450222 0.51220715 -0.17585360 0.05346928  0.04609272  121 TYR A C   
862  O O   . TYR A 121 ? 0.79697609 0.97060061 0.58760214 -0.16837211 0.06580429  0.04149111  121 TYR A O   
863  C CB  . TYR A 121 ? 0.73036039 0.94605637 0.55520183 -0.16636315 0.04742064  0.05537652  121 TYR A CB  
864  C CG  . TYR A 121 ? 0.78747523 1.00468957 0.62767845 -0.16243143 0.04005299  0.05747038  121 TYR A CG  
865  C CD1 . TYR A 121 ? 0.71911156 0.92675138 0.56040770 -0.15361871 0.04532493  0.05400405  121 TYR A CD1 
866  C CD2 . TYR A 121 ? 0.82766813 1.05330837 0.67923123 -0.16752239 0.02896860  0.06265074  121 TYR A CD2 
867  C CE1 . TYR A 121 ? 0.80225646 1.00953364 0.65530801 -0.15037720 0.04003852  0.05514855  121 TYR A CE1 
868  C CE2 . TYR A 121 ? 0.78620178 1.00920141 0.64851010 -0.16360906 0.02459739  0.06363344  121 TYR A CE2 
869  C CZ  . TYR A 121 ? 0.76296246 0.97724277 0.62601686 -0.15525381 0.03018847  0.05966422  121 TYR A CZ  
870  O OH  . TYR A 121 ? 0.91720617 1.12671912 0.78862309 -0.15150963 0.02752554  0.05955335  121 TYR A OH  
871  N N   . SER A 122 ? 0.66477561 0.84608793 0.47064176 -0.18390986 0.04590855  0.04674057  122 SER A N   
872  C CA  . SER A 122 ? 0.76655179 0.93240535 0.56488329 -0.18361531 0.05051406  0.04199066  122 SER A CA  
873  C C   . SER A 122 ? 0.75326407 0.91761374 0.56421506 -0.17071134 0.05187940  0.04126109  122 SER A C   
874  O O   . SER A 122 ? 0.68919146 0.86386502 0.51767826 -0.16689742 0.04452038  0.04534139  122 SER A O   
875  C CB  . SER A 122 ? 0.85621822 1.02402806 0.65692437 -0.19644815 0.04124231  0.04495943  122 SER A CB  
876  O OG  . SER A 122 ? 0.78073609 0.95163065 0.56991005 -0.21014088 0.03852573  0.04672087  122 SER A OG  
877  N N   . ILE A 123 ? 0.76133686 0.91009527 0.56113923 -0.16525079 0.06158178  0.03584456  123 ILE A N   
878  C CA  . ILE A 123 ? 0.61449915 0.76050937 0.42418030 -0.15497096 0.06270308  0.03504557  123 ILE A CA  
879  C C   . ILE A 123 ? 0.58754200 0.72221935 0.39224762 -0.16149086 0.06179948  0.03228478  123 ILE A C   
880  O O   . ILE A 123 ? 0.64241374 0.76274365 0.42783731 -0.16839473 0.06771977  0.02818367  123 ILE A O   
881  C CB  . ILE A 123 ? 0.57258701 0.71202976 0.37511125 -0.14207038 0.07463524  0.03279334  123 ILE A CB  
882  C CG1 . ILE A 123 ? 0.56308782 0.71964741 0.37351844 -0.13668887 0.07415816  0.03756422  123 ILE A CG1 
883  C CG2 . ILE A 123 ? 0.60607558 0.73919499 0.41430497 -0.13323705 0.07679019  0.03144035  123 ILE A CG2 
884  C CD1 . ILE A 123 ? 0.59230727 0.76530188 0.42253619 -0.13394894 0.06457302  0.04270768  123 ILE A CD1 
885  N N   . TYR A 124 ? 0.64458150 0.78579843 0.46550414 -0.16081128 0.05441882  0.03492318  124 TYR A N   
886  C CA  . TYR A 124 ? 0.66770297 0.80213082 0.48687512 -0.16650043 0.05327822  0.03358114  124 TYR A CA  
887  C C   . TYR A 124 ? 0.61616158 0.74237454 0.43855354 -0.15614042 0.05827638  0.03041078  124 TYR A C   
888  O O   . TYR A 124 ? 0.64915764 0.76789969 0.46783000 -0.15974200 0.05929897  0.02847154  124 TYR A O   
889  C CB  . TYR A 124 ? 0.79992914 0.94958431 0.63457400 -0.17464873 0.04181639  0.04040303  124 TYR A CB  
890  C CG  . TYR A 124 ? 0.93744326 1.09759033 0.77144712 -0.18403968 0.03558350  0.04515024  124 TYR A CG  
891  C CD1 . TYR A 124 ? 1.01211429 1.17059112 0.83158952 -0.19865058 0.03435323  0.04565192  124 TYR A CD1 
892  C CD2 . TYR A 124 ? 1.22326374 1.39471936 1.06993616 -0.17985132 0.03046151  0.04954185  124 TYR A CD2 
893  C CE1 . TYR A 124 ? 1.06191921 1.23079896 0.88079083 -0.20809291 0.02807895  0.05061293  124 TYR A CE1 
894  C CE2 . TYR A 124 ? 1.26329565 1.44428873 1.10955310 -0.18865691 0.02437477  0.05438811  124 TYR A CE2 
895  C CZ  . TYR A 124 ? 1.30623126 1.48643363 1.13901365 -0.20246989 0.02318273  0.05498873  124 TYR A CZ  
896  O OH  . TYR A 124 ? 1.42960644 1.61979997 1.26162958 -0.21156512 0.01692910  0.06016501  124 TYR A OH  
897  N N   . LYS A 125 ? 0.56131721 0.68836844 0.38811448 -0.14408022 0.06219653  0.02998612  125 LYS A N   
898  C CA  . LYS A 125 ? 0.50387555 0.62391257 0.33306408 -0.13565126 0.06623271  0.02775102  125 LYS A CA  
899  C C   . LYS A 125 ? 0.48969689 0.59610111 0.30364811 -0.12774187 0.07757613  0.02441175  125 LYS A C   
900  O O   . LYS A 125 ? 0.42815658 0.53855377 0.23990896 -0.12151514 0.08175109  0.02604333  125 LYS A O   
901  C CB  . LYS A 125 ? 0.50367963 0.63645947 0.35134012 -0.13022517 0.06010921  0.03143749  125 LYS A CB  
902  C CG  . LYS A 125 ? 0.49295825 0.63024759 0.35345638 -0.13499491 0.05307653  0.03339012  125 LYS A CG  
903  C CD  . LYS A 125 ? 0.49731523 0.64132309 0.37247342 -0.13050754 0.04871897  0.03608608  125 LYS A CD  
904  C CE  . LYS A 125 ? 0.46701682 0.60620952 0.34148028 -0.12218727 0.05323140  0.03374900  125 LYS A CE  
905  N NZ  . LYS A 125 ? 0.43797538 0.56641090 0.30483446 -0.12026180 0.05909899  0.02976088  125 LYS A NZ  
906  N N   . GLU A 126 ? 0.52112681 0.61210370 0.32566702 -0.12698239 0.08294634  0.02064582  126 GLU A N   
907  C CA  . GLU A 126 ? 0.57545638 0.65172827 0.36762416 -0.11683133 0.09418011  0.01856022  126 GLU A CA  
908  C C   . GLU A 126 ? 0.52698338 0.61598146 0.33274427 -0.10425680 0.09418412  0.02303821  126 GLU A C   
909  O O   . GLU A 126 ? 0.53851628 0.62706625 0.33999035 -0.09454515 0.10177871  0.02530332  126 GLU A O   
910  C CB  . GLU A 126 ? 0.60375178 0.66123015 0.38430488 -0.11908039 0.09864391  0.01432085  126 GLU A CB  
911  C CG  . GLU A 126 ? 0.70814389 0.75336730 0.47198302 -0.13406932 0.09872772  0.01061638  126 GLU A CG  
912  C CD  . GLU A 126 ? 0.73576361 0.76839876 0.49132830 -0.14134996 0.09917168  0.00755875  126 GLU A CD  
913  O OE1 . GLU A 126 ? 0.81438082 0.84600616 0.57704961 -0.13409181 0.09994161  0.00761415  126 GLU A OE1 
914  O OE2 . GLU A 126 ? 0.78370953 0.80931771 0.52613699 -0.15571430 0.09791140  0.00568788  126 GLU A OE2 
915  N N   . GLU A 127 ? 0.51416647 0.61574501 0.33635300 -0.10496831 0.08572049  0.02517696  127 GLU A N   
916  C CA  . GLU A 127 ? 0.50667429 0.61998999 0.33940539 -0.09643172 0.08467263  0.02951166  127 GLU A CA  
917  C C   . GLU A 127 ? 0.44829449 0.57832789 0.29468763 -0.10127043 0.07501821  0.03270713  127 GLU A C   
918  O O   . GLU A 127 ? 0.41046795 0.54066056 0.26353389 -0.10772435 0.06884391  0.03141124  127 GLU A O   
919  C CB  . GLU A 127 ? 0.49263537 0.59932005 0.32703888 -0.09310436 0.08564966  0.02823555  127 GLU A CB  
920  C CG  . GLU A 127 ? 0.58253503 0.70164990 0.42596948 -0.08646139 0.08399224  0.03328930  127 GLU A CG  
921  C CD  . GLU A 127 ? 0.61912793 0.73003805 0.46051872 -0.08221124 0.08703010  0.03256480  127 GLU A CD  
922  O OE1 . GLU A 127 ? 0.62683117 0.72557878 0.45786339 -0.07614458 0.09514160  0.03215013  127 GLU A OE1 
923  O OE2 . GLU A 127 ? 0.65673614 0.76983261 0.50461459 -0.08545190 0.08233001  0.03171464  127 GLU A OE2 
924  N N   . ILE A 128 ? 0.40719789 0.55100751 0.25745264 -0.09803645 0.07427385  0.03750967  128 ILE A N   
925  C CA  . ILE A 128 ? 0.40674168 0.56306827 0.26714963 -0.10402168 0.06524917  0.04026687  128 ILE A CA  
926  C C   . ILE A 128 ? 0.37674356 0.54618186 0.24336952 -0.10071941 0.06296109  0.04541224  128 ILE A C   
927  O O   . ILE A 128 ? 0.35198736 0.52965528 0.21721233 -0.09393028 0.06755534  0.04964952  128 ILE A O   
928  C CB  . ILE A 128 ? 0.46967047 0.63077116 0.32748473 -0.10954963 0.06349477  0.04107111  128 ILE A CB  
929  C CG1 . ILE A 128 ? 0.52932465 0.70083988 0.39612025 -0.11606663 0.05440701  0.04420285  128 ILE A CG1 
930  C CG2 . ILE A 128 ? 0.52847183 0.69574320 0.38042870 -0.10347492 0.07036094  0.04382945  128 ILE A CG2 
931  C CD1 . ILE A 128 ? 0.62286222 0.79776812 0.48718500 -0.12321199 0.05152126  0.04498163  128 ILE A CD1 
932  N N   . SER A 129 ? 0.36874628 0.54076141 0.24181753 -0.10632256 0.05584257  0.04593161  129 SER A N   
933  C CA  . SER A 129 ? 0.40162018 0.58531064 0.27761501 -0.10714366 0.05249705  0.05081419  129 SER A CA  
934  C C   . SER A 129 ? 0.40481699 0.60435390 0.28236446 -0.11067264 0.04887724  0.05621139  129 SER A C   
935  O O   . SER A 129 ? 0.47623003 0.67511618 0.35442477 -0.11564410 0.04567678  0.05535070  129 SER A O   
936  C CB  . SER A 129 ? 0.38714671 0.56376511 0.26536033 -0.11271512 0.04774291  0.04888862  129 SER A CB  
937  O OG  . SER A 129 ? 0.37815639 0.55246931 0.25915664 -0.11947371 0.04227786  0.04861021  129 SER A OG  
938  N N   . LEU A 130 ? 0.41787159 0.63266158 0.29647771 -0.11007667 0.04791487  0.06254849  130 LEU A N   
939  C CA  . LEU A 130 ? 0.47125489 0.70321083 0.35143510 -0.11599992 0.04293058  0.06860526  130 LEU A CA  
940  C C   . LEU A 130 ? 0.45074302 0.67536783 0.33009535 -0.12689127 0.03511382  0.06672341  130 LEU A C   
941  O O   . LEU A 130 ? 0.44692659 0.67851871 0.32623041 -0.13334219 0.03053809  0.06941509  130 LEU A O   
942  C CB  . LEU A 130 ? 0.48989171 0.74202627 0.37166649 -0.11459972 0.04283598  0.07718265  130 LEU A CB  
943  C CG  . LEU A 130 ? 0.52039564 0.78216994 0.40435398 -0.10167336 0.05167644  0.08173969  130 LEU A CG  
944  C CD1 . LEU A 130 ? 0.55141824 0.83974266 0.43970990 -0.10176234 0.04978924  0.09332912  130 LEU A CD1 
945  C CD2 . LEU A 130 ? 0.49635297 0.75919926 0.37957799 -0.09523707 0.05827641  0.08123429  130 LEU A CD2 
946  N N   . LYS A 131 ? 0.41374040 0.62283087 0.29168016 -0.12883861 0.03421438  0.06229562  131 LYS A N   
947  C CA  . LYS A 131 ? 0.40608150 0.60497314 0.28229979 -0.13742818 0.02880559  0.06085775  131 LYS A CA  
948  C C   . LYS A 131 ? 0.41593468 0.61134601 0.29576689 -0.13825333 0.02710640  0.05966152  131 LYS A C   
949  O O   . LYS A 131 ? 0.39840996 0.59546304 0.27712047 -0.14526065 0.02202335  0.06234302  131 LYS A O   
950  C CB  . LYS A 131 ? 0.37467146 0.55549145 0.24891780 -0.13723236 0.03060385  0.05580947  131 LYS A CB  
951  C CG  . LYS A 131 ? 0.39808509 0.56481540 0.26858348 -0.14491934 0.02713064  0.05470578  131 LYS A CG  
952  C CD  . LYS A 131 ? 0.43197924 0.57964361 0.30327725 -0.14148508 0.03131500  0.04907969  131 LYS A CD  
953  C CE  . LYS A 131 ? 0.46736971 0.59709263 0.33285958 -0.14726573 0.03072993  0.04785063  131 LYS A CE  
954  N NZ  . LYS A 131 ? 0.50063217 0.62977171 0.35288197 -0.15761083 0.02797931  0.04996691  131 LYS A NZ  
955  N N   . GLU A 132 ? 0.38614097 0.57604325 0.26890156 -0.13232732 0.03114675  0.05600775  132 GLU A N   
956  C CA  . GLU A 132 ? 0.44009840 0.62673473 0.32566959 -0.13418272 0.02946498  0.05518475  132 GLU A CA  
957  C C   . GLU A 132 ? 0.42044008 0.62046039 0.30413327 -0.13703842 0.02789905  0.05883950  132 GLU A C   
958  O O   . GLU A 132 ? 0.44235677 0.64413989 0.32706219 -0.14346312 0.02243981  0.06148233  132 GLU A O   
959  C CB  . GLU A 132 ? 0.46687168 0.64577806 0.35288548 -0.12922101 0.03446412  0.05081915  132 GLU A CB  
960  C CG  . GLU A 132 ? 0.44650906 0.62459230 0.33407670 -0.13316430 0.03226673  0.05101479  132 GLU A CG  
961  C CD  . GLU A 132 ? 0.51409352 0.68368983 0.40205413 -0.13187276 0.03526950  0.04753231  132 GLU A CD  
962  O OE1 . GLU A 132 ? 0.53555489 0.69747066 0.42387450 -0.12760434 0.03906860  0.04426452  132 GLU A OE1 
963  O OE2 . GLU A 132 ? 0.62340260 0.79539192 0.51136845 -0.13731748 0.03253786  0.04907429  132 GLU A OE2 
964  N N   . LEU A 133 ? 0.43481851 0.64504385 0.31560495 -0.13214295 0.03289439  0.06007640  133 LEU A N   
965  C CA  . LEU A 133 ? 0.48497248 0.70864820 0.36378527 -0.13415121 0.03292025  0.06368054  133 LEU A CA  
966  C C   . LEU A 133 ? 0.49615222 0.73062062 0.37597260 -0.14226711 0.02563667  0.06905280  133 LEU A C   
967  O O   . LEU A 133 ? 0.50184888 0.73950160 0.38114533 -0.14913686 0.02095672  0.07105861  133 LEU A O   
968  C CB  . LEU A 133 ? 0.52226734 0.75388753 0.39843941 -0.12511143 0.04157987  0.06485810  133 LEU A CB  
969  C CG  . LEU A 133 ? 0.57840765 0.79581344 0.44903940 -0.11885151 0.04970550  0.05926631  133 LEU A CG  
970  C CD1 . LEU A 133 ? 0.60267055 0.82347846 0.47043517 -0.10791659 0.05935941  0.06095277  133 LEU A CD1 
971  C CD2 . LEU A 133 ? 0.65233815 0.86748612 0.51718295 -0.12341859 0.05072361  0.05757082  133 LEU A CD2 
972  N N   . ASP A 134 ? 0.42849183 0.66712856 0.30824089 -0.14308107 0.02415784  0.07153492  134 ASP A N   
973  C CA  . ASP A 134 ? 0.41562012 0.66436678 0.29321373 -0.15241571 0.01772959  0.07692537  134 ASP A CA  
974  C C   . ASP A 134 ? 0.40136757 0.63555396 0.27739522 -0.16040768 0.01162980  0.07541739  134 ASP A C   
975  O O   . ASP A 134 ? 0.36702660 0.60708010 0.24108568 -0.16798151 0.00672878  0.07905626  134 ASP A O   
976  C CB  . ASP A 134 ? 0.46415460 0.71654570 0.33932924 -0.15422989 0.01689809  0.07936044  134 ASP A CB  
977  C CG  . ASP A 134 ? 0.46832699 0.72621930 0.33739853 -0.16724351 0.00961522  0.08421770  134 ASP A CG  
978  O OD1 . ASP A 134 ? 0.52546632 0.80456924 0.39525419 -0.17068858 0.00775748  0.09065925  134 ASP A OD1 
979  O OD2 . ASP A 134 ? 0.42880505 0.66832954 0.29143536 -0.17390577 0.00666704  0.08137776  134 ASP A OD2 
980  N N   . PHE A 135 ? 0.38324884 0.59826827 0.26035497 -0.15835558 0.01231044  0.07077865  135 PHE A N   
981  C CA  . PHE A 135 ? 0.42996764 0.63050133 0.30613920 -0.16431981 0.00764856  0.07095060  135 PHE A CA  
982  C C   . PHE A 135 ? 0.49199396 0.69427991 0.37235993 -0.16558990 0.00504609  0.07246321  135 PHE A C   
983  O O   . PHE A 135 ? 0.45970976 0.65823728 0.33845156 -0.17235997 -0.00018179 0.07589280  135 PHE A O   
984  C CB  . PHE A 135 ? 0.41862020 0.59996951 0.29677606 -0.15957445 0.01087189  0.06628901  135 PHE A CB  
985  C CG  . PHE A 135 ? 0.44211054 0.60597515 0.31712931 -0.16461441 0.00812628  0.06724969  135 PHE A CG  
986  C CD1 . PHE A 135 ? 0.45559758 0.61038333 0.31974500 -0.17166650 0.00714345  0.06760617  135 PHE A CD1 
987  C CD2 . PHE A 135 ? 0.45933565 0.61519152 0.34100688 -0.16285855 0.00686309  0.06862660  135 PHE A CD2 
988  C CE1 . PHE A 135 ? 0.48389718 0.61836660 0.34220180 -0.17612529 0.00615058  0.06833999  135 PHE A CE1 
989  C CE2 . PHE A 135 ? 0.48656276 0.62452054 0.36541554 -0.16556706 0.00580022  0.07052690  135 PHE A CE2 
990  C CZ  . PHE A 135 ? 0.47831282 0.60318714 0.34470749 -0.17156878 0.00628318  0.06971061  135 PHE A CZ  
991  N N   . LYS A 136 ? 0.45728284 0.66255879 0.34159955 -0.15977299 0.00887608  0.06987964  136 LYS A N   
992  C CA  . LYS A 136 ? 0.44899380 0.65534544 0.33587989 -0.16234776 0.00650463  0.07118990  136 LYS A CA  
993  C C   . LYS A 136 ? 0.47530717 0.69611466 0.35806507 -0.16826935 0.00397801  0.07488620  136 LYS A C   
994  O O   . LYS A 136 ? 0.48108646 0.70192510 0.36424899 -0.17490718 -0.00168247 0.07860148  136 LYS A O   
995  C CB  . LYS A 136 ? 0.41611895 0.61990750 0.30447239 -0.15710452 0.01153943  0.06711750  136 LYS A CB  
996  C CG  . LYS A 136 ? 0.45030424 0.64115679 0.34532207 -0.15437335 0.01117925  0.06597433  136 LYS A CG  
997  C CD  . LYS A 136 ? 0.53620166 0.72448909 0.43196529 -0.15094507 0.01551971  0.06235143  136 LYS A CD  
998  C CE  . LYS A 136 ? 0.58051372 0.77242899 0.47871810 -0.15704487 0.01113624  0.06598341  136 LYS A CE  
999  N NZ  . LYS A 136 ? 0.61680126 0.80541134 0.51406020 -0.15574849 0.01498880  0.06271005  136 LYS A NZ  
1000 N N   . LEU A 137 ? 0.46691972 0.70035678 0.34626761 -0.16543211 0.00842590  0.07477984  137 LEU A N   
1001 C CA  . LEU A 137 ? 0.44801208 0.69770968 0.32391846 -0.17007139 0.00743742  0.07879923  137 LEU A CA  
1002 C C   . LEU A 137 ? 0.46925375 0.72203577 0.34359828 -0.17926764 -0.00018400 0.08381052  137 LEU A C   
1003 O O   . LEU A 137 ? 0.47331467 0.73188853 0.34556353 -0.18663141 -0.00455939 0.08725084  137 LEU A O   
1004 C CB  . LEU A 137 ? 0.46136773 0.72507530 0.33599764 -0.16323307 0.01475352  0.07937872  137 LEU A CB  
1005 C CG  . LEU A 137 ? 0.51270676 0.77078390 0.38498557 -0.15477495 0.02379291  0.07450081  137 LEU A CG  
1006 C CD1 . LEU A 137 ? 0.52898759 0.79671597 0.40141699 -0.14481229 0.03219420  0.07576750  137 LEU A CD1 
1007 C CD2 . LEU A 137 ? 0.54937422 0.81080085 0.41634315 -0.15988567 0.02440000  0.07461025  137 LEU A CD2 
1008 N N   . ARG A 138 ? 0.51508880 0.76120961 0.38847440 -0.18029697 -0.00193552 0.08405107  138 ARG A N   
1009 C CA  . ARG A 138 ? 0.50686842 0.75267315 0.37487280 -0.19107312 -0.00880446 0.08862791  138 ARG A CA  
1010 C C   . ARG A 138 ? 0.49050808 0.72010553 0.35887462 -0.19530186 -0.01367236 0.08938961  138 ARG A C   
1011 O O   . ARG A 138 ? 0.48261666 0.71263659 0.34626520 -0.20443252 -0.01933241 0.09382606  138 ARG A O   
1012 C CB  . ARG A 138 ? 0.51884472 0.75910974 0.38146946 -0.19420259 -0.00953756 0.08887614  138 ARG A CB  
1013 C CG  . ARG A 138 ? 0.59289205 0.85657609 0.45532060 -0.19346662 -0.00726144 0.09232825  138 ARG A CG  
1014 C CD  . ARG A 138 ? 0.63936758 0.89929616 0.49403116 -0.20032610 -0.00947743 0.09380195  138 ARG A CD  
1015 N NE  . ARG A 138 ? 0.66382790 0.94121349 0.52152896 -0.19501981 -0.00557577 0.09604818  138 ARG A NE  
1016 C CZ  . ARG A 138 ? 0.66175711 0.95103812 0.51372266 -0.20280318 -0.00818442 0.10122949  138 ARG A CZ  
1017 N NH1 . ARG A 138 ? 0.60860348 0.89556098 0.44926763 -0.21814567 -0.01477713 0.10463632  138 ARG A NH1 
1018 N NH2 . ARG A 138 ? 0.66494232 0.96963298 0.52180970 -0.19593181 -0.00426320 0.10398495  138 ARG A NH2 
1019 N N   . LYS A 139 ? 0.49939126 0.71501082 0.37363333 -0.18881533 -0.01159681 0.08615816  139 LYS A N   
1020 C CA  . LYS A 139 ? 0.54803491 0.75126511 0.42472637 -0.19175756 -0.01606504 0.08923216  139 LYS A CA  
1021 C C   . LYS A 139 ? 0.58761501 0.80365860 0.46527007 -0.19672878 -0.01970906 0.09284864  139 LYS A C   
1022 O O   . LYS A 139 ? 0.54693329 0.76145381 0.42250866 -0.20412332 -0.02562794 0.09815525  139 LYS A O   
1023 C CB  . LYS A 139 ? 0.59680837 0.78692633 0.48124453 -0.18296349 -0.01221592 0.08600486  139 LYS A CB  
1024 C CG  . LYS A 139 ? 0.69072813 0.86828232 0.58078146 -0.18286781 -0.01527601 0.09046558  139 LYS A CG  
1025 C CD  . LYS A 139 ? 0.79205894 0.95815384 0.67506516 -0.18982959 -0.01959738 0.09527954  139 LYS A CD  
1026 C CE  . LYS A 139 ? 0.78700268 0.93933564 0.67831033 -0.18563710 -0.02037530 0.10042601  139 LYS A CE  
1027 N NZ  . LYS A 139 ? 0.84318757 0.98241770 0.72720563 -0.19190517 -0.02423117 0.10609052  139 LYS A NZ  
1028 N N   . HIS A 140 ? 0.54599291 0.77351511 0.42484900 -0.19306730 -0.01542758 0.08978299  140 HIS A N   
1029 C CA  . HIS A 140 ? 0.63707906 0.87618548 0.51369500 -0.19829562 -0.01701678 0.09186254  140 HIS A CA  
1030 C C   . HIS A 140 ? 0.61460048 0.86493766 0.48521879 -0.20704006 -0.02121673 0.09647167  140 HIS A C   
1031 O O   . HIS A 140 ? 0.61160040 0.86458498 0.48045927 -0.21485756 -0.02665244 0.10087752  140 HIS A O   
1032 C CB  . HIS A 140 ? 0.70696414 0.95282704 0.58159292 -0.19244544 -0.00907590 0.08666684  140 HIS A CB  
1033 C CG  . HIS A 140 ? 0.81567276 1.07201755 0.68444109 -0.19881174 -0.00914991 0.08808668  140 HIS A CG  
1034 N ND1 . HIS A 140 ? 0.78192663 1.03575683 0.65121233 -0.20632760 -0.01527616 0.09158288  140 HIS A ND1 
1035 C CD2 . HIS A 140 ? 0.75807852 1.02677095 0.62028497 -0.19900922 -0.00368843 0.08714543  140 HIS A CD2 
1036 C CE1 . HIS A 140 ? 0.79937083 1.06280637 0.66088384 -0.21224006 -0.01385201 0.09183631  140 HIS A CE1 
1037 N NE2 . HIS A 140 ? 0.77476859 1.04629767 0.63177979 -0.20732804 -0.00614947 0.08876036  140 HIS A NE2 
1038 N N   . LEU A 141 ? 0.56055272 0.81886327 0.42812699 -0.20643954 -0.01904004 0.09628071  141 LEU A N   
1039 C CA  . LEU A 141 ? 0.62738198 0.90168726 0.48954299 -0.21476009 -0.02196730 0.10103257  141 LEU A CA  
1040 C C   . LEU A 141 ? 0.70495921 0.96858788 0.56253594 -0.22491656 -0.03027737 0.10571682  141 LEU A C   
1041 O O   . LEU A 141 ? 0.62982357 0.90307701 0.48221046 -0.23480749 -0.03505770 0.11063814  141 LEU A O   
1042 C CB  . LEU A 141 ? 0.68550062 0.97435904 0.54703438 -0.21144550 -0.01757275 0.10134748  141 LEU A CB  
1043 C CG  . LEU A 141 ? 0.62575793 0.92662537 0.49058190 -0.20076685 -0.00806018 0.09843452  141 LEU A CG  
1044 C CD1 . LEU A 141 ? 0.58546424 0.89975852 0.45219758 -0.19561610 -0.00393863 0.10040503  141 LEU A CD1 
1045 C CD2 . LEU A 141 ? 0.57966602 0.89497608 0.44196928 -0.20297460 -0.00544017 0.10012391  141 LEU A CD2 
1046 N N   . ILE A 142 ? 0.67076576 0.91318738 0.52908373 -0.22236152 -0.03109232 0.10422310  142 ILE A N   
1047 C CA  . ILE A 142 ? 0.73047560 0.95634371 0.58257216 -0.23044947 -0.03705733 0.10835080  142 ILE A CA  
1048 C C   . ILE A 142 ? 0.74377698 0.96597087 0.59951913 -0.23286828 -0.04160518 0.11261050  142 ILE A C   
1049 O O   . ILE A 142 ? 0.80065596 1.01777864 0.65017956 -0.24193892 -0.04738547 0.11802810  142 ILE A O   
1050 C CB  . ILE A 142 ? 0.75419456 0.95581448 0.60531753 -0.22541724 -0.03435092 0.10528743  142 ILE A CB  
1051 C CG1 . ILE A 142 ? 0.81207013 1.01628423 0.65558720 -0.22754933 -0.03173959 0.10264830  142 ILE A CG1 
1052 C CG2 . ILE A 142 ? 0.70869589 0.88679779 0.55439210 -0.23019814 -0.03815910 0.10946945  142 ILE A CG2 
1053 C CD1 . ILE A 142 ? 0.73551869 0.91713905 0.57706040 -0.22207047 -0.02727847 0.09807067  142 ILE A CD1 
1054 N N   . ASP A 143 ? 0.75555825 0.97879374 0.62065971 -0.22524737 -0.03909088 0.11063175  143 ASP A N   
1055 C CA  . ASP A 143 ? 0.77147114 0.98994356 0.64216208 -0.22644717 -0.04345085 0.11569672  143 ASP A CA  
1056 C C   . ASP A 143 ? 0.81919742 1.05525744 0.68575048 -0.23570275 -0.04736104 0.11899757  143 ASP A C   
1057 O O   . ASP A 143 ? 0.76786870 1.00224900 0.63313270 -0.24297217 -0.05382461 0.12574650  143 ASP A O   
1058 C CB  . ASP A 143 ? 0.71796143 0.93255383 0.59921342 -0.21694666 -0.03981432 0.11328365  143 ASP A CB  
1059 C CG  . ASP A 143 ? 0.91741383 1.11217892 0.80420566 -0.20866470 -0.03715542 0.11293006  143 ASP A CG  
1060 O OD1 . ASP A 143 ? 0.99993199 1.17981493 0.88098049 -0.21121795 -0.03869625 0.11553591  143 ASP A OD1 
1061 O OD2 . ASP A 143 ? 0.85014594 1.04289591 0.74549991 -0.20018807 -0.03291998 0.11003060  143 ASP A OD2 
1062 N N   . LYS A 144 ? 0.77762949 1.03005290 0.64119530 -0.23523341 -0.04266137 0.11453106  144 LYS A N   
1063 C CA  . LYS A 144 ? 0.64853013 0.91633093 0.50785422 -0.24214998 -0.04358659 0.11603353  144 LYS A CA  
1064 C C   . LYS A 144 ? 0.67318511 0.95681643 0.52517432 -0.24806288 -0.04292899 0.11701433  144 LYS A C   
1065 O O   . LYS A 144 ? 0.68235809 0.97920030 0.52968019 -0.25414360 -0.04281850 0.11832781  144 LYS A O   
1066 C CB  . LYS A 144 ? 0.62216580 0.89480728 0.48227960 -0.23637642 -0.03640021 0.11013515  144 LYS A CB  
1067 C CG  . LYS A 144 ? 0.79407644 1.05595732 0.66106182 -0.23330648 -0.03790945 0.11051914  144 LYS A CG  
1068 C CD  . LYS A 144 ? 1.05643332 1.31010008 0.92925173 -0.23756458 -0.04685404 0.11904862  144 LYS A CD  
1069 C CE  . LYS A 144 ? 1.15916693 1.41348898 1.03757977 -0.24025626 -0.05075045 0.12381773  144 LYS A CE  
1070 N NZ  . LYS A 144 ? 1.25380731 1.50244260 1.13883805 -0.23098786 -0.04540808 0.11913138  144 LYS A NZ  
1071 N N   . HIS A 145 ? 0.62894487 0.91357481 0.47946322 -0.24670413 -0.04173983 0.11654232  145 HIS A N   
1072 C CA  . HIS A 145 ? 0.54733711 0.85237962 0.39253652 -0.25250006 -0.04097449 0.11899804  145 HIS A CA  
1073 C C   . HIS A 145 ? 0.58317822 0.88420308 0.42309311 -0.25968152 -0.04604720 0.12273566  145 HIS A C   
1074 O O   . HIS A 145 ? 0.60264391 0.92171001 0.43956438 -0.26330423 -0.04496564 0.12505871  145 HIS A O   
1075 C CB  . HIS A 145 ? 0.55975676 0.88214242 0.40730414 -0.24366969 -0.03111839 0.11526404  145 HIS A CB  
1076 C CG  . HIS A 145 ? 0.64760423 0.96952480 0.49589831 -0.23731284 -0.02428207 0.11044593  145 HIS A CG  
1077 N ND1 . HIS A 145 ? 0.64039731 0.97745240 0.48411292 -0.23836648 -0.01849669 0.11024639  145 HIS A ND1 
1078 C CD2 . HIS A 145 ? 0.79311854 1.10063052 0.64444971 -0.22991817 -0.02096317 0.10526067  145 HIS A CD2 
1079 C CE1 . HIS A 145 ? 0.73037285 1.05901432 0.57204098 -0.23303375 -0.01210449 0.10467114  145 HIS A CE1 
1080 N NE2 . HIS A 145 ? 0.72136390 1.03297079 0.56795669 -0.22827059 -0.01402632 0.10180861  145 HIS A NE2 
1081 N N   . ASP A 146 ? 0.60761601 0.88531548 0.44517910 -0.26280570 -0.05142593 0.12432464  146 ASP A N   
1082 C CA  . ASP A 146 ? 0.77196169 1.04215479 0.59905440 -0.27350205 -0.05654275 0.12825195  146 ASP A CA  
1083 C C   . ASP A 146 ? 0.70567435 0.97924244 0.52934331 -0.27279097 -0.05343228 0.12619801  146 ASP A C   
1084 O O   . ASP A 146 ? 0.79532987 1.07172441 0.60833454 -0.28464991 -0.05741564 0.13007952  146 ASP A O   
1085 C CB  . ASP A 146 ? 0.84623694 1.13441682 0.66632122 -0.28679597 -0.06169492 0.13432597  146 ASP A CB  
1086 C CG  . ASP A 146 ? 0.89674199 1.17937684 0.71700817 -0.29118735 -0.06668112 0.13796313  146 ASP A CG  
1087 O OD1 . ASP A 146 ? 0.85447425 1.11324549 0.67114627 -0.29404971 -0.07135460 0.14092857  146 ASP A OD1 
1088 O OD2 . ASP A 146 ? 1.00221121 1.30265188 0.82615292 -0.29063985 -0.06491049 0.13780147  146 ASP A OD2 
1089 N N   . LEU A 147 ? 0.79741025 1.07083344 0.62874985 -0.26049298 -0.04682077 0.12075086  147 LEU A N   
1090 C CA  . LEU A 147 ? 0.67820776 0.95909953 0.50718176 -0.25992888 -0.04400928 0.11988118  147 LEU A CA  
1091 C C   . LEU A 147 ? 0.66351438 0.91948617 0.47995952 -0.26847038 -0.04752261 0.12006211  147 LEU A C   
1092 O O   . LEU A 147 ? 0.58779466 0.81653857 0.40376121 -0.26458976 -0.04714792 0.11736086  147 LEU A O   
1093 C CB  . LEU A 147 ? 0.63358891 0.91402268 0.47256619 -0.24469273 -0.03633418 0.11390825  147 LEU A CB  
1094 C CG  . LEU A 147 ? 0.62174845 0.90889239 0.45941859 -0.24281189 -0.03329759 0.11337028  147 LEU A CG  
1095 C CD1 . LEU A 147 ? 0.55458486 0.87613297 0.39413053 -0.24530566 -0.03223363 0.11937124  147 LEU A CD1 
1096 C CD2 . LEU A 147 ? 0.59641707 0.87446678 0.44294402 -0.22782712 -0.02632615 0.10679983  147 LEU A CD2 
1097 N N   . TYR A 148 ? 0.64860213 0.91385996 0.45427802 -0.28033108 -0.05035632 0.12376487  148 TYR A N   
1098 C CA  . TYR A 148 ? 0.78382748 1.02245796 0.57289040 -0.29058081 -0.05266481 0.12319726  148 TYR A CA  
1099 C C   . TYR A 148 ? 0.81725824 1.03531516 0.59351313 -0.30243903 -0.05839023 0.12660137  148 TYR A C   
1100 O O   . TYR A 148 ? 0.85145521 1.04290736 0.60995167 -0.31255108 -0.05970727 0.12636024  148 TYR A O   
1101 C CB  . TYR A 148 ? 0.83802712 1.05072451 0.62842727 -0.27994171 -0.04677438 0.11609294  148 TYR A CB  
1102 C CG  . TYR A 148 ? 0.76825541 0.99820566 0.56903487 -0.26932171 -0.04133844 0.11301996  148 TYR A CG  
1103 C CD1 . TYR A 148 ? 0.79331553 1.05539966 0.59530151 -0.27373523 -0.04222984 0.11779939  148 TYR A CD1 
1104 C CD2 . TYR A 148 ? 0.66339546 0.87892002 0.47326738 -0.25476265 -0.03520788 0.10651138  148 TYR A CD2 
1105 C CE1 . TYR A 148 ? 0.75395882 1.03166485 0.56593609 -0.26299405 -0.03699471 0.11639347  148 TYR A CE1 
1106 C CE2 . TYR A 148 ? 0.67036080 0.90024507 0.48863038 -0.24539235 -0.03030243 0.10410098  148 TYR A CE2 
1107 C CZ  . TYR A 148 ? 0.65498561 0.91538960 0.47433120 -0.24901319 -0.03107533 0.10916521  148 TYR A CZ  
1108 O OH  . TYR A 148 ? 0.55248654 0.82885230 0.38039985 -0.23941842 -0.02621149 0.10868858  148 TYR A OH  
1109 N N   . LYS A 149 ? 0.82146478 1.05175090 0.60375905 -0.30326909 -0.06172221 0.13032937  149 LYS A N   
1110 C CA  . LYS A 149 ? 0.93285418 1.15416265 0.70113629 -0.31866148 -0.06854951 0.13598053  149 LYS A CA  
1111 C C   . LYS A 149 ? 0.93397856 1.17825282 0.69029021 -0.33605427 -0.07322185 0.14154407  149 LYS A C   
1112 O O   . LYS A 149 ? 0.86461651 1.09504235 0.60249668 -0.35259241 -0.07862959 0.14548156  149 LYS A O   
1113 C CB  . LYS A 149 ? 0.96858799 1.19850254 0.74620605 -0.31596377 -0.07126965 0.13905118  149 LYS A CB  
1114 C CG  . LYS A 149 ? 0.98989958 1.19150901 0.77379262 -0.30468929 -0.06914190 0.13668752  149 LYS A CG  
1115 C CD  . LYS A 149 ? 0.99189979 1.20135093 0.78467226 -0.30291495 -0.07246150 0.14055422  149 LYS A CD  
1116 C CE  . LYS A 149 ? 1.02932394 1.21369267 0.82999015 -0.29148933 -0.07042037 0.14000410  149 LYS A CE  
1117 N NZ  . LYS A 149 ? 1.04672956 1.24911380 0.86360919 -0.28229302 -0.06918491 0.13916707  149 LYS A NZ  
1118 N N   . THR A 150 ? 0.88630629 1.16668367 0.65333742 -0.33224052 -0.07089467 0.14284892  150 THR A N   
1119 C CA  . THR A 150 ? 0.86410081 1.17138159 0.62299609 -0.34692371 -0.07446274 0.14938757  150 THR A CA  
1120 C C   . THR A 150 ? 0.78104675 1.09791791 0.54316694 -0.34200320 -0.07041512 0.14783937  150 THR A C   
1121 O O   . THR A 150 ? 0.86188805 1.17110097 0.63570476 -0.32523543 -0.06412475 0.14164260  150 THR A O   
1122 C CB  . THR A 150 ? 0.87039876 1.21711993 0.64021569 -0.34719792 -0.07520781 0.15537727  150 THR A CB  
1123 O OG1 . THR A 150 ? 0.75373554 1.12367523 0.54301810 -0.32912982 -0.06751329 0.15326060  150 THR A OG1 
1124 C CG2 . THR A 150 ? 0.76841795 1.10332334 0.53591937 -0.35054848 -0.07884276 0.15605791  150 THR A CG2 
1125 N N   . GLU A 151 ? 0.83422768 1.16749561 0.58468330 -0.35826811 -0.07465465 0.15416561  151 GLU A N   
1126 C CA  . GLU A 151 ? 0.92493516 1.28075123 0.68064672 -0.35572961 -0.07215410 0.15650061  151 GLU A CA  
1127 C C   . GLU A 151 ? 0.83574402 1.22468066 0.61680716 -0.33555576 -0.06540130 0.15758279  151 GLU A C   
1128 O O   . GLU A 151 ? 0.76604563 1.18079281 0.55611610 -0.33390686 -0.06521961 0.16232882  151 GLU A O   
1129 C CB  . GLU A 151 ? 0.92133904 1.30181229 0.66317660 -0.37856567 -0.07925017 0.16675657  151 GLU A CB  
1130 C CG  . GLU A 151 ? 1.03427958 1.37796259 0.74619704 -0.39980817 -0.08434170 0.16482192  151 GLU A CG  
1131 C CD  . GLU A 151 ? 1.21552563 1.52472878 0.91864055 -0.39532906 -0.07985219 0.15637876  151 GLU A CD  
1132 O OE1 . GLU A 151 ? 1.55262876 1.87167501 1.27045178 -0.38007760 -0.07443055 0.15370138  151 GLU A OE1 
1133 O OE2 . GLU A 151 ? 1.16268969 1.43076873 0.84160650 -0.40792486 -0.08129126 0.15226172  151 GLU A OE2 
1134 N N   . PRO A 152 ? 0.74748433 1.13144338 0.53878248 -0.31945533 -0.05879214 0.15233243  152 PRO A N   
1135 C CA  . PRO A 152 ? 0.68258822 1.09043002 0.49505949 -0.29924423 -0.05079102 0.15229997  152 PRO A CA  
1136 C C   . PRO A 152 ? 0.70362937 1.15783834 0.52617717 -0.29857197 -0.04927756 0.16331394  152 PRO A C   
1137 O O   . PRO A 152 ? 0.57202923 1.04593527 0.41035944 -0.28260958 -0.04178296 0.16436464  152 PRO A O   
1138 C CB  . PRO A 152 ? 0.66255307 1.04726732 0.47910833 -0.28527492 -0.04505397 0.14384331  152 PRO A CB  
1139 C CG  . PRO A 152 ? 0.70374948 1.06410301 0.50160831 -0.30022612 -0.05005167 0.14232747  152 PRO A CG  
1140 C CD  . PRO A 152 ? 0.77143955 1.11909640 0.55294883 -0.31860995 -0.05744017 0.14457098  152 PRO A CD  
1141 N N   . LYS A 153 ? 0.90424323 1.37332463 0.71720928 -0.31481275 -0.05533551 0.17133749  153 LYS A N   
1142 C CA  . LYS A 153 ? 0.93334627 1.45129597 0.75681716 -0.31593215 -0.05502520 0.18477102  153 LYS A CA  
1143 C C   . LYS A 153 ? 0.89063275 1.42059326 0.73301971 -0.29236057 -0.04507348 0.18420628  153 LYS A C   
1144 O O   . LYS A 153 ? 0.95818126 1.46621418 0.79845458 -0.28664660 -0.04320086 0.17789114  153 LYS A O   
1145 C CB  . LYS A 153 ? 1.07368469 1.61774921 0.90069014 -0.32152280 -0.05660840 0.19169961  153 LYS A CB  
1146 C CG  . LYS A 153 ? 1.31146932 1.84548330 1.11697757 -0.34807631 -0.06753977 0.19434680  153 LYS A CG  
1147 C CD  . LYS A 153 ? 1.46438754 2.01196218 1.26746273 -0.35775191 -0.07101817 0.19874899  153 LYS A CD  
1148 C CE  . LYS A 153 ? 1.46668816 1.99620914 1.24420631 -0.38521200 -0.08187404 0.20057915  153 LYS A CE  
1149 N NZ  . LYS A 153 ? 1.27809727 1.82456112 1.05030465 -0.39946929 -0.08707476 0.20718575  153 LYS A NZ  
1150 N N   . ASP A 154 ? 0.89398056 1.45177042 0.75288129 -0.27794826 -0.03759236 0.18890738  154 ASP A N   
1151 C CA  . ASP A 154 ? 0.91392094 1.49388218 0.79047954 -0.25748020 -0.02765106 0.19342268  154 ASP A CA  
1152 C C   . ASP A 154 ? 0.82546437 1.37927294 0.70845920 -0.23633857 -0.01727509 0.18139836  154 ASP A C   
1153 O O   . ASP A 154 ? 0.81920129 1.38580418 0.71491379 -0.21800351 -0.00740553 0.18394908  154 ASP A O   
1154 C CB  . ASP A 154 ? 1.05778003 1.68650103 0.94773418 -0.25411007 -0.02372743 0.20773786  154 ASP A CB  
1155 C CG  . ASP A 154 ? 1.25470853 1.92047405 1.14364278 -0.27111113 -0.03220345 0.22344138  154 ASP A CG  
1156 O OD1 . ASP A 154 ? 1.04288435 1.70867443 0.93119234 -0.27191973 -0.03428616 0.22609025  154 ASP A OD1 
1157 O OD2 . ASP A 154 ? 1.20942438 1.90074730 1.09575593 -0.28580737 -0.03763048 0.23224816  154 ASP A OD2 
1158 N N   . SER A 155 ? 0.76288033 1.28260374 0.63697207 -0.23934233 -0.01921970 0.16982803  155 SER A N   
1159 C CA  . SER A 155 ? 0.73245478 1.23033762 0.61087978 -0.22294274 -0.01045358 0.15949136  155 SER A CA  
1160 C C   . SER A 155 ? 0.72532570 1.19978023 0.60557550 -0.21108158 -0.00617657 0.15197946  155 SER A C   
1161 O O   . SER A 155 ? 0.64072871 1.10010397 0.51449054 -0.21815865 -0.01173986 0.14987487  155 SER A O   
1162 C CB  . SER A 155 ? 0.77193540 1.24480605 0.64117926 -0.23138705 -0.01524392 0.15194705  155 SER A CB  
1163 O OG  . SER A 155 ? 0.90902799 1.36238956 0.76609004 -0.24728431 -0.02545235 0.15044253  155 SER A OG  
1164 N N   . LYS A 156 ? 0.66422838 1.13533187 0.55191755 -0.19325700 0.00475009  0.14792573  156 LYS A N   
1165 C CA  . LYS A 156 ? 0.62341076 1.07992923 0.51481366 -0.17933822 0.01132658  0.14295915  156 LYS A CA  
1166 C C   . LYS A 156 ? 0.63143933 1.06209624 0.52128661 -0.16867958 0.01884801  0.13194489  156 LYS A C   
1167 O O   . LYS A 156 ? 0.62969583 1.06727529 0.51975131 -0.16565557 0.02409440  0.13208678  156 LYS A O   
1168 C CB  . LYS A 156 ? 0.63707381 1.12964678 0.53972673 -0.16892469 0.01866433  0.15501538  156 LYS A CB  
1169 C CG  . LYS A 156 ? 0.79560703 1.30976033 0.70025784 -0.17730768 0.01174763  0.16537224  156 LYS A CG  
1170 C CD  . LYS A 156 ? 0.87124693 1.43220782 0.78794444 -0.17327152 0.01535996  0.18189771  156 LYS A CD  
1171 C CE  . LYS A 156 ? 0.87452579 1.46159363 0.79169810 -0.18663858 0.00595500  0.19430992  156 LYS A CE  
1172 N NZ  . LYS A 156 ? 0.86105168 1.43744266 0.76297057 -0.21130681 -0.00778596 0.19227910  156 LYS A NZ  
1173 N N   . ILE A 157 ? 0.55333036 0.95652783 0.44115704 -0.16312386 0.02024528  0.12321812  157 ILE A N   
1174 C CA  . ILE A 157 ? 0.52939999 0.91359305 0.41637772 -0.15119381 0.02937141  0.11497160  157 ILE A CA  
1175 C C   . ILE A 157 ? 0.59172618 0.98665285 0.48470908 -0.13529862 0.04026853  0.11884014  157 ILE A C   
1176 O O   . ILE A 157 ? 0.56489193 0.97155380 0.46268475 -0.13367644 0.03861775  0.12484545  157 ILE A O   
1177 C CB  . ILE A 157 ? 0.49536604 0.84761113 0.37796623 -0.15360704 0.02539598  0.10512957  157 ILE A CB  
1178 C CG1 . ILE A 157 ? 0.48241034 0.82443678 0.36022916 -0.16764946 0.01532257  0.10332192  157 ILE A CG1 
1179 C CG2 . ILE A 157 ? 0.47014192 0.80320811 0.35054135 -0.14313345 0.03425509  0.09710189  157 ILE A CG2 
1180 C CD1 . ILE A 157 ? 0.45063564 0.76560068 0.32630289 -0.16974960 0.01122448  0.09653530  157 ILE A CD1 
1181 N N   . ARG A 158 ? 0.63080490 1.02021933 0.52202404 -0.12391955 0.05190741  0.11570387  158 ARG A N   
1182 C CA  . ARG A 158 ? 0.62295961 1.01403666 0.51763320 -0.10706819 0.06398026  0.11801007  158 ARG A CA  
1183 C C   . ARG A 158 ? 0.62976539 0.98972827 0.51490498 -0.09961572 0.07320463  0.10691011  158 ARG A C   
1184 O O   . ARG A 158 ? 0.66582584 1.01705468 0.54305339 -0.10197404 0.07717846  0.10204958  158 ARG A O   
1185 C CB  . ARG A 158 ? 0.63730431 1.06063545 0.53992438 -0.09778033 0.07238989  0.13013716  158 ARG A CB  
1186 C CG  . ARG A 158 ? 0.77570707 1.19042110 0.67887425 -0.07837901 0.08730576  0.13031583  158 ARG A CG  
1187 C CD  . ARG A 158 ? 0.79683721 1.24218667 0.71019143 -0.06470601 0.09775551  0.14388895  158 ARG A CD  
1188 N NE  . ARG A 158 ? 0.88207889 1.36233306 0.80824971 -0.07013113 0.08821842  0.15753166  158 ARG A NE  
1189 C CZ  . ARG A 158 ? 0.92586040 1.44192386 0.86435241 -0.06018854 0.09501117  0.17284493  158 ARG A CZ  
1190 N NH1 . ARG A 158 ? 0.77604759 1.29269183 0.71531683 -0.04255769 0.11224385  0.17514716  158 ARG A NH1 
1191 N NH2 . ARG A 158 ? 0.96460426 1.51512063 0.91379654 -0.06780236 0.08533198  0.18629974  158 ARG A NH2 
1192 N N   . VAL A 159 ? 0.52983415 0.87431717 0.41467404 -0.09175574 0.07652650  0.10369259  159 VAL A N   
1193 C CA  . VAL A 159 ? 0.60764688 0.92211473 0.48235095 -0.08591080 0.08464278  0.09378649  159 VAL A CA  
1194 C C   . VAL A 159 ? 0.67315751 0.98741287 0.54680282 -0.06813866 0.10026906  0.09743620  159 VAL A C   
1195 O O   . VAL A 159 ? 0.73070878 1.05512989 0.61233115 -0.06016840 0.10128736  0.10411157  159 VAL A O   
1196 C CB  . VAL A 159 ? 0.51983893 0.81472772 0.39387417 -0.09047700 0.07735594  0.08726943  159 VAL A CB  
1197 C CG1 . VAL A 159 ? 0.50843543 0.77448821 0.37145916 -0.08539005 0.08579885  0.07808453  159 VAL A CG1 
1198 C CG2 . VAL A 159 ? 0.50554121 0.79800367 0.38075230 -0.10591483 0.06357468  0.08440682  159 VAL A CG2 
1199 N N   . THR A 160 ? 0.65464395 0.95478618 0.51683199 -0.06221789 0.11292511  0.09304632  160 THR A N   
1200 C CA  . THR A 160 ? 0.65320611 0.95155543 0.51308811 -0.04409217 0.12984885  0.09735496  160 THR A CA  
1201 C C   . THR A 160 ? 0.64549208 0.90547490 0.48819560 -0.04073992 0.13880457  0.08635876  160 THR A C   
1202 O O   . THR A 160 ? 0.64195460 0.88130414 0.47173154 -0.05200257 0.13633856  0.07634077  160 THR A O   
1203 C CB  . THR A 160 ? 0.75023854 1.06513643 0.60962230 -0.03796554 0.14052922  0.10318618  160 THR A CB  
1204 O OG1 . THR A 160 ? 0.60950637 0.96066320 0.48317799 -0.04485135 0.13067073  0.11293802  160 THR A OG1 
1205 C CG2 . THR A 160 ? 0.81424820 1.13182735 0.67503440 -0.01618643 0.15891454  0.11091632  160 THR A CG2 
1206 N N   . MET A 161 ? 0.65479654 0.90704423 0.49767700 -0.02627000 0.14825243  0.08945462  161 MET A N   
1207 C CA  . MET A 161 ? 0.75793046 0.97312307 0.58323783 -0.02248417 0.15772995  0.08012082  161 MET A CA  
1208 C C   . MET A 161 ? 0.85691929 1.05608690 0.66698444 -0.00947399 0.17859253  0.07971533  161 MET A C   
1209 O O   . MET A 161 ? 0.97774982 1.19823802 0.79551291 0.00146260  0.18699180  0.08915817  161 MET A O   
1210 C CB  . MET A 161 ? 0.74826485 0.96037555 0.58009595 -0.01384913 0.15721880  0.08372574  161 MET A CB  
1211 C CG  . MET A 161 ? 0.67900920 0.90966952 0.52627480 -0.02366987 0.13950139  0.08641759  161 MET A CG  
1212 S SD  . MET A 161 ? 0.65569508 0.87399685 0.49902913 -0.04524979 0.12352788  0.07476601  161 MET A SD  
1213 C CE  . MET A 161 ? 0.58110678 0.76274705 0.40971002 -0.04326279 0.12951297  0.06518232  161 MET A CE  
1214 N N   . LYS A 162 ? 0.92158222 1.08213103 0.70932579 -0.01017914 0.18780187  0.06932818  162 LYS A N   
1215 C CA  . LYS A 162 ? 0.94094890 1.07506990 0.70788753 0.00162583  0.20963210  0.06677523  162 LYS A CA  
1216 C C   . LYS A 162 ? 1.01396441 1.15688777 0.78978533 0.02566114  0.22415590  0.07875768  162 LYS A C   
1217 O O   . LYS A 162 ? 1.09790444 1.23233986 0.86388934 0.03893362  0.24301641  0.08129185  162 LYS A O   
1218 C CB  . LYS A 162 ? 0.92029965 1.01036489 0.66149533 -0.00499173 0.21470410  0.05435323  162 LYS A CB  
1219 C CG  . LYS A 162 ? 0.97352827 1.05330169 0.70104766 -0.02670230 0.20636198  0.04397731  162 LYS A CG  
1220 C CD  . LYS A 162 ? 0.94023561 0.98315948 0.64325869 -0.04066733 0.20612916  0.03190167  162 LYS A CD  
1221 C CE  . LYS A 162 ? 0.95267773 1.00578225 0.65581083 -0.06156658 0.19187352  0.02757060  162 LYS A CE  
1222 N NZ  . LYS A 162 ? 0.92884910 0.95958233 0.61505437 -0.08031982 0.18520921  0.01833276  162 LYS A NZ  
1223 N N   . ASN A 163 ? 0.96891624 1.12794566 0.76250672 0.03165213  0.21637055  0.08665721  163 ASN A N   
1224 C CA  . ASN A 163 ? 0.89567852 1.06647372 0.69970125 0.05430157  0.22894311  0.10025459  163 ASN A CA  
1225 C C   . ASN A 163 ? 0.88444453 1.10523963 0.71461993 0.05914488  0.22350121  0.11551544  163 ASN A C   
1226 O O   . ASN A 163 ? 0.91398966 1.15553260 0.75887573 0.07631156  0.23006013  0.13011137  163 ASN A O   
1227 C CB  . ASN A 163 ? 0.82944071 0.99319357 0.63822424 0.05844133  0.22424895  0.10266198  163 ASN A CB  
1228 C CG  . ASN A 163 ? 0.81759071 1.01529455 0.64914393 0.04787841  0.20280147  0.10834485  163 ASN A CG  
1229 O OD1 . ASN A 163 ? 0.81637698 1.03960562 0.65860438 0.03565757  0.19028832  0.10918993  163 ASN A OD1 
1230 N ND2 . ASN A 163 ? 0.86795163 1.06420422 0.70506793 0.05161295  0.19876465  0.11206396  163 ASN A ND2 
1231 N N   . GLY A 164 ? 0.88382971 1.12621152 0.72095549 0.04318214  0.21005262  0.11360618  164 GLY A N   
1232 C CA  . GLY A 164 ? 0.82021713 1.10986733 0.67995930 0.04583329  0.20493302  0.12826590  164 GLY A CA  
1233 C C   . GLY A 164 ? 0.83550274 1.15583205 0.71519631 0.03599548  0.18460390  0.13571754  164 GLY A C   
1234 O O   . GLY A 164 ? 0.69619644 1.05258501 0.59020609 0.02884650  0.17511678  0.14405714  164 GLY A O   
1235 N N   . ASP A 165 ? 0.74343777 1.04842103 0.62195098 0.03409198  0.17820507  0.13234253  165 ASP A N   
1236 C CA  . ASP A 165 ? 0.68112862 1.00630069 0.57250845 0.02108838  0.15899740  0.13555880  165 ASP A CA  
1237 C C   . ASP A 165 ? 0.67872095 1.01057196 0.56968218 0.00048434  0.14422238  0.12852775  165 ASP A C   
1238 O O   . ASP A 165 ? 0.75708854 1.06779730 0.63482606 -0.00612450 0.14656836  0.11729574  165 ASP A O   
1239 C CB  . ASP A 165 ? 0.76364005 1.06153011 0.64765942 0.01816645  0.15488592  0.12745820  165 ASP A CB  
1240 C CG  . ASP A 165 ? 0.84081399 1.13441300 0.72719038 0.03540561  0.16468322  0.13573974  165 ASP A CG  
1241 O OD1 . ASP A 165 ? 0.85245919 1.16958404 0.74978697 0.05109422  0.17402402  0.15059684  165 ASP A OD1 
1242 O OD2 . ASP A 165 ? 0.84889829 1.11713600 0.72699571 0.03317169  0.16277155  0.12833436  165 ASP A OD2 
1243 N N   . PHE A 166 ? 0.63897508 0.99923086 0.54288524 -0.01048166 0.12915210  0.13558480  166 PHE A N   
1244 C CA  . PHE A 166 ? 0.63740766 1.00266981 0.54028952 -0.02935838 0.11570664  0.13008226  166 PHE A CA  
1245 C C   . PHE A 166 ? 0.57751024 0.95269203 0.48628747 -0.04370487 0.09895936  0.13154130  166 PHE A C   
1246 O O   . PHE A 166 ? 0.59732544 0.98652911 0.51363695 -0.04082549 0.09620422  0.14002672  166 PHE A O   
1247 C CB  . PHE A 166 ? 0.64481670 1.03718555 0.55325425 -0.02809456 0.11949164  0.13821089  166 PHE A CB  
1248 C CG  . PHE A 166 ? 0.76678455 1.20351624 0.69241834 -0.02537547 0.11623484  0.15627441  166 PHE A CG  
1249 C CD1 . PHE A 166 ? 0.77971506 1.23787689 0.71148419 -0.04249264 0.09951021  0.16087785  166 PHE A CD1 
1250 C CD2 . PHE A 166 ? 0.86428374 1.32191014 0.79916751 -0.00628959 0.13038978  0.16956103  166 PHE A CD2 
1251 C CE1 . PHE A 166 ? 0.78142005 1.28238082 0.72742927 -0.04283383 0.09565002  0.17837137  166 PHE A CE1 
1252 C CE2 . PHE A 166 ? 0.85833311 1.36115146 0.81059724 -0.00475424 0.12650168  0.18810895  166 PHE A CE2 
1253 C CZ  . PHE A 166 ? 0.79947186 1.32469773 0.75689715 -0.02413541 0.10849340  0.19252047  166 PHE A CZ  
1254 N N   . TYR A 167 ? 0.51238096 0.87813473 0.41607451 -0.05989723 0.08811451  0.12305336  167 TYR A N   
1255 C CA  . TYR A 167 ? 0.51100922 0.88031459 0.41647390 -0.07474455 0.07360858  0.12267633  167 TYR A CA  
1256 C C   . TYR A 167 ? 0.50249916 0.88638341 0.40843979 -0.08928043 0.06416979  0.12442733  167 TYR A C   
1257 O O   . TYR A 167 ? 0.55960399 0.93165374 0.45988643 -0.09374397 0.06418392  0.11745054  167 TYR A O   
1258 C CB  . TYR A 167 ? 0.50472629 0.83928329 0.40158480 -0.07843775 0.07140046  0.10922263  167 TYR A CB  
1259 C CG  . TYR A 167 ? 0.48805004 0.80600792 0.38217956 -0.06481713 0.08143941  0.10691351  167 TYR A CG  
1260 C CD1 . TYR A 167 ? 0.49339294 0.81501168 0.39118126 -0.06259347 0.07928735  0.11123477  167 TYR A CD1 
1261 C CD2 . TYR A 167 ? 0.53363895 0.83179718 0.41964221 -0.05514493 0.09335867  0.10096593  167 TYR A CD2 
1262 C CE1 . TYR A 167 ? 0.50338197 0.80985421 0.39824978 -0.05033221 0.08830084  0.10999475  167 TYR A CE1 
1263 C CE2 . TYR A 167 ? 0.51315814 0.79430413 0.39452136 -0.04303647 0.10318510  0.09944646  167 TYR A CE2 
1264 C CZ  . TYR A 167 ? 0.50487036 0.79153180 0.39175946 -0.04005551 0.10047506  0.10458274  167 TYR A CZ  
1265 O OH  . TYR A 167 ? 0.53914893 0.80949152 0.42152619 -0.02911574 0.10903496  0.10382108  167 TYR A OH  
1266 N N   . THR A 168 ? 0.52178729 0.92961383 0.43273202 -0.09875194 0.05509029  0.13364282  168 THR A N   
1267 C CA  . THR A 168 ? 0.51189798 0.93472540 0.42194241 -0.11393527 0.04567441  0.13687807  168 THR A CA  
1268 C C   . THR A 168 ? 0.49866852 0.90450859 0.40102679 -0.13019076 0.03373976  0.13082390  168 THR A C   
1269 O O   . THR A 168 ? 0.55817115 0.96044636 0.45922285 -0.13280603 0.03041049  0.13166407  168 THR A O   
1270 C CB  . THR A 168 ? 0.50595778 0.97011054 0.42524344 -0.11506121 0.04414261  0.15326253  168 THR A CB  
1271 O OG1 . THR A 168 ? 0.54953641 1.02473831 0.47604305 -0.09666675 0.05778167  0.15827301  168 THR A OG1 
1272 C CG2 . THR A 168 ? 0.59959126 1.07956076 0.51651955 -0.13130601 0.03518498  0.15684208  168 THR A CG2 
1273 N N   . PHE A 169 ? 0.46870369 0.86561477 0.36545420 -0.14129797 0.02785216  0.12599352  169 PHE A N   
1274 C CA  . PHE A 169 ? 0.47826141 0.85968506 0.36668926 -0.15706147 0.01746388  0.12176722  169 PHE A CA  
1275 C C   . PHE A 169 ? 0.49596393 0.89705157 0.38175005 -0.17138690 0.00986134  0.12909527  169 PHE A C   
1276 O O   . PHE A 169 ? 0.57101738 0.97768009 0.45758715 -0.17221414 0.01060371  0.12929350  169 PHE A O   
1277 C CB  . PHE A 169 ? 0.46672443 0.81536961 0.35007888 -0.15774919 0.01694575  0.10967035  169 PHE A CB  
1278 C CG  . PHE A 169 ? 0.43191034 0.76055324 0.31682965 -0.14511669 0.02438959  0.10187629  169 PHE A CG  
1279 C CD1 . PHE A 169 ? 0.44549567 0.77321804 0.33204302 -0.13879141 0.02746351  0.10269637  169 PHE A CD1 
1280 C CD2 . PHE A 169 ? 0.42369062 0.73423362 0.30716902 -0.14157899 0.02746160  0.09412577  169 PHE A CD2 
1281 C CE1 . PHE A 169 ? 0.47112602 0.78034490 0.35792810 -0.12812838 0.03430944  0.09577367  169 PHE A CE1 
1282 C CE2 . PHE A 169 ? 0.44351581 0.73568022 0.32664582 -0.13228424 0.03377491  0.08720074  169 PHE A CE2 
1283 C CZ  . PHE A 169 ? 0.48217863 0.77292085 0.36679733 -0.12535253 0.03739530  0.08771361  169 PHE A CZ  
1284 N N   . GLU A 170 ? 0.51613003 0.92834377 0.39745677 -0.18365422 0.00273644  0.13555637  170 GLU A N   
1285 C CA  . GLU A 170 ? 0.52254379 0.95167434 0.39826757 -0.20048559 -0.00553449 0.14275345  170 GLU A CA  
1286 C C   . GLU A 170 ? 0.51469338 0.91224647 0.37705895 -0.21362664 -0.01222550 0.13424742  170 GLU A C   
1287 O O   . GLU A 170 ? 0.50459921 0.87912327 0.35799474 -0.21906483 -0.01462950 0.12906283  170 GLU A O   
1288 C CB  . GLU A 170 ? 0.52726763 0.98098475 0.40082040 -0.21102414 -0.01084091 0.15392196  170 GLU A CB  
1289 C CG  . GLU A 170 ? 0.57985747 1.07319427 0.46861017 -0.19922543 -0.00518547 0.16691661  170 GLU A CG  
1290 C CD  . GLU A 170 ? 0.66677952 1.18872499 0.55333126 -0.21282394 -0.01240704 0.18021899  170 GLU A CD  
1291 O OE1 . GLU A 170 ? 0.69329774 1.20238435 0.57176936 -0.21904905 -0.01568658 0.17835115  170 GLU A OE1 
1292 O OE2 . GLU A 170 ? 0.88681984 1.44640374 0.77966917 -0.21795458 -0.01461850 0.19329667  170 GLU A OE2 
1293 N N   . LEU A 171 ? 0.55002952 0.94975221 0.41031903 -0.21994746 -0.01522711 0.13478944  171 LEU A N   
1294 C CA  . LEU A 171 ? 0.57319021 0.94270915 0.42312700 -0.22899413 -0.02014143 0.12761715  171 LEU A CA  
1295 C C   . LEU A 171 ? 0.58492482 0.94854438 0.41899791 -0.24929824 -0.02875408 0.13097548  171 LEU A C   
1296 O O   . LEU A 171 ? 0.64944309 0.98248768 0.47236156 -0.25662774 -0.03188131 0.12520981  171 LEU A O   
1297 C CB  . LEU A 171 ? 0.54640406 0.92039692 0.40102169 -0.22585784 -0.01891189 0.12699471  171 LEU A CB  
1298 C CG  . LEU A 171 ? 0.58520067 0.95547378 0.45007229 -0.20798588 -0.00980955 0.12142751  171 LEU A CG  
1299 C CD1 . LEU A 171 ? 0.59858167 0.97673726 0.46599278 -0.20629777 -0.00768627 0.12165522  171 LEU A CD1 
1300 C CD2 . LEU A 171 ? 0.64050019 0.97648484 0.50316352 -0.20365705 -0.00913687 0.11158006  171 LEU A CD2 
1301 N N   . ASN A 172 ? 0.67430413 1.06480002 0.50630677 -0.25801855 -0.03178705 0.14040899  172 ASN A N   
1302 C CA  . ASN A 172 ? 0.74731863 1.13217938 0.56069267 -0.27990308 -0.03980390 0.14391127  172 ASN A CA  
1303 C C   . ASN A 172 ? 0.72973990 1.09115577 0.53274941 -0.28266636 -0.03904241 0.13874340  172 ASN A C   
1304 O O   . ASN A 172 ? 0.73679709 1.08321393 0.51973659 -0.30139726 -0.04432795 0.13904053  172 ASN A O   
1305 C CB  . ASN A 172 ? 0.79399180 1.22167218 0.60827208 -0.29187784 -0.04479529 0.15803638  172 ASN A CB  
1306 C CG  . ASN A 172 ? 0.84098041 1.29720211 0.66551208 -0.28516504 -0.04212586 0.16576239  172 ASN A CG  
1307 O OD1 . ASN A 172 ? 0.94037199 1.40966105 0.78264421 -0.26500034 -0.03435830 0.16620813  172 ASN A OD1 
1308 N ND2 . ASN A 172 ? 1.06443822 1.52707148 0.87602890 -0.30230686 -0.04815475 0.17165859  172 ASN A ND2 
1309 N N   . LYS A 173 ? 0.68355054 1.03779173 0.49727055 -0.26546586 -0.03211851 0.13325895  173 LYS A N   
1310 C CA  . LYS A 173 ? 0.69995505 1.02677715 0.50240070 -0.26829061 -0.03080425 0.12670895  173 LYS A CA  
1311 C C   . LYS A 173 ? 0.67646354 0.97854435 0.48838502 -0.24964193 -0.02330135 0.11602413  173 LYS A C   
1312 O O   . LYS A 173 ? 0.58279872 0.89652961 0.41100979 -0.23386164 -0.01869819 0.11553526  173 LYS A O   
1313 C CB  . LYS A 173 ? 0.73862159 1.08704817 0.53898156 -0.27373460 -0.03214154 0.13411449  173 LYS A CB  
1314 C CG  . LYS A 173 ? 0.73855919 1.12714887 0.56055081 -0.25855500 -0.02854251 0.14329080  173 LYS A CG  
1315 C CD  . LYS A 173 ? 0.84698462 1.26601863 0.67154413 -0.26207721 -0.03025562 0.15462844  173 LYS A CD  
1316 C CE  . LYS A 173 ? 1.00496101 1.46893048 0.83283967 -0.27344346 -0.03626651 0.17097676  173 LYS A CE  
1317 N NZ  . LYS A 173 ? 0.94580978 1.43107200 0.78705698 -0.26563624 -0.03440076 0.17527929  173 LYS A NZ  
1318 N N   . LYS A 174 ? 0.67145455 0.94016320 0.47188234 -0.25217167 -0.02140856 0.10794162  174 LYS A N   
1319 C CA  . LYS A 174 ? 0.60524690 0.85513711 0.41484720 -0.23562934 -0.01433548 0.09927952  174 LYS A CA  
1320 C C   . LYS A 174 ? 0.55252296 0.82735324 0.37623546 -0.22303088 -0.01049840 0.10279546  174 LYS A C   
1321 O O   . LYS A 174 ? 0.55067343 0.85209978 0.37392828 -0.22890459 -0.01326091 0.11172199  174 LYS A O   
1322 C CB  . LYS A 174 ? 0.62064797 0.83555031 0.41706738 -0.23894982 -0.01136873 0.09120197  174 LYS A CB  
1323 C CG  . LYS A 174 ? 0.79121578 0.97491962 0.57365906 -0.24779734 -0.01249043 0.08716250  174 LYS A CG  
1324 C CD  . LYS A 174 ? 0.86659950 1.01437581 0.63257229 -0.25226039 -0.00792900 0.07986721  174 LYS A CD  
1325 C CE  . LYS A 174 ? 0.97490430 1.11978626 0.75234568 -0.23743801 -0.00147080 0.07455166  174 LYS A CE  
1326 N NZ  . LYS A 174 ? 1.05789161 1.16523397 0.82395166 -0.23709722 0.00486803  0.06654482  174 LYS A NZ  
1327 N N   . LEU A 175 ? 0.48456925 0.75212574 0.32080311 -0.20612080 -0.00424909 0.09699409  175 LEU A N   
1328 C CA  . LEU A 175 ? 0.47099310 0.75129759 0.31722727 -0.19332068 0.00105841  0.09820117  175 LEU A CA  
1329 C C   . LEU A 175 ? 0.52802855 0.80328238 0.36533755 -0.19936234 0.00065354  0.09846240  175 LEU A C   
1330 O O   . LEU A 175 ? 0.58624321 0.83399981 0.41213721 -0.20573837 0.00073001  0.09149116  175 LEU A O   
1331 C CB  . LEU A 175 ? 0.44971278 0.71217644 0.30423623 -0.17870775 0.00741493  0.08964868  175 LEU A CB  
1332 C CG  . LEU A 175 ? 0.42062664 0.69332021 0.28392494 -0.16493323 0.01381153  0.09064014  175 LEU A CG  
1333 C CD1 . LEU A 175 ? 0.42032278 0.72446609 0.29123861 -0.16026624 0.01502506  0.10037857  175 LEU A CD1 
1334 C CD2 . LEU A 175 ? 0.43373877 0.68933308 0.30238721 -0.15356925 0.01946295  0.08271728  175 LEU A CD2 
1335 N N   . GLN A 176 ? 0.51090705 0.81218755 0.35352641 -0.19642958 0.00113565  0.10684964  176 GLN A N   
1336 C CA  . GLN A 176 ? 0.48585126 0.78604513 0.31981277 -0.20348248 -0.00003311 0.10866042  176 GLN A CA  
1337 C C   . GLN A 176 ? 0.49146175 0.76423603 0.32543343 -0.19390619 0.00610884  0.09818602  176 GLN A C   
1338 O O   . GLN A 176 ? 0.46863374 0.74054217 0.31467903 -0.17792742 0.01187198  0.09525876  176 GLN A O   
1339 C CB  . GLN A 176 ? 0.48325998 0.82012677 0.32639706 -0.19977833 -0.00051478 0.12173021  176 GLN A CB  
1340 C CG  . GLN A 176 ? 0.49531740 0.86473197 0.33938891 -0.21040444 -0.00682117 0.13414454  176 GLN A CG  
1341 C CD  . GLN A 176 ? 0.50140560 0.88984805 0.36087036 -0.19749399 -0.00324437 0.13808104  176 GLN A CD  
1342 O OE1 . GLN A 176 ? 0.51937252 0.88943112 0.38406265 -0.18542726 0.00226669  0.12904155  176 GLN A OE1 
1343 N NE2 . GLN A 176 ? 0.51488721 0.94181103 0.38164932 -0.19990462 -0.00577097 0.15239239  176 GLN A NE2 
1344 N N   . THR A 177 ? 0.51238096 0.76261711 0.33099738 -0.20494315 0.00523587  0.09284586  177 THR A N   
1345 C CA  . THR A 177 ? 0.56099451 0.78427202 0.37818310 -0.19767882 0.01126140  0.08279137  177 THR A CA  
1346 C C   . THR A 177 ? 0.51796263 0.75225818 0.34626743 -0.18388648 0.01582933  0.08448783  177 THR A C   
1347 O O   . THR A 177 ? 0.41690582 0.63329017 0.25044128 -0.17274612 0.02165136  0.07634720  177 THR A O   
1348 C CB  . THR A 177 ? 0.61004996 0.80934238 0.40672642 -0.21259826 0.01078696  0.07798372  177 THR A CB  
1349 O OG1 . THR A 177 ? 0.71673274 0.92890131 0.50351030 -0.22343481 0.00783991  0.08418418  177 THR A OG1 
1350 C CG2 . THR A 177 ? 0.55481410 0.73559719 0.33922994 -0.22390197 0.00836476  0.07501201  177 THR A CG2 
1351 N N   . HIS A 178 ? 0.47645557 0.73917967 0.30743113 -0.18540716 0.01327987  0.09559405  178 HIS A N   
1352 C CA  . HIS A 178 ? 0.50538951 0.77691174 0.34578845 -0.17193478 0.01808666  0.09837532  178 HIS A CA  
1353 C C   . HIS A 178 ? 0.52923220 0.80481684 0.38459840 -0.15361883 0.02402026  0.09747615  178 HIS A C   
1354 O O   . HIS A 178 ? 0.49226835 0.76379919 0.35290840 -0.14124086 0.02990935  0.09612656  178 HIS A O   
1355 C CB  . HIS A 178 ? 0.46090782 0.76203871 0.30164421 -0.17666319 0.01446978  0.11204838  178 HIS A CB  
1356 C CG  . HIS A 178 ? 0.43621385 0.77073044 0.28695083 -0.17503889 0.01170044  0.12451044  178 HIS A CG  
1357 N ND1 . HIS A 178 ? 0.45667550 0.80007911 0.29977289 -0.19110699 0.00464973  0.12809616  178 HIS A ND1 
1358 C CD2 . HIS A 178 ? 0.41496891 0.77348626 0.28121465 -0.15990222 0.01575083  0.13356182  178 HIS A CD2 
1359 C CE1 . HIS A 178 ? 0.47875723 0.85514480 0.33409435 -0.18634959 0.00365761  0.13993648  178 HIS A CE1 
1360 N NE2 . HIS A 178 ? 0.44906455 0.83401144 0.31894284 -0.16629818 0.01114521  0.14302272  178 HIS A NE2 
1361 N N   . ARG A 179 ? 0.54370636 0.82442689 0.40335780 -0.15324010 0.02276526  0.09766279  179 ARG A N   
1362 C CA  . ARG A 179 ? 0.50989294 0.79149288 0.37987664 -0.13878591 0.02855202  0.09582057  179 ARG A CA  
1363 C C   . ARG A 179 ? 0.47584897 0.72911561 0.34496844 -0.13537583 0.03142731  0.08346542  179 ARG A C   
1364 O O   . ARG A 179 ? 0.46052909 0.70947242 0.33515370 -0.12398722 0.03724644  0.08048944  179 ARG A O   
1365 C CB  . ARG A 179 ? 0.51832485 0.82343149 0.39308035 -0.14085360 0.02589355  0.10372757  179 ARG A CB  
1366 C CG  . ARG A 179 ? 0.48241273 0.82100737 0.36131951 -0.14237794 0.02374835  0.11818619  179 ARG A CG  
1367 C CD  . ARG A 179 ? 0.44201547 0.80591488 0.32611749 -0.14485696 0.02143815  0.12661141  179 ARG A CD  
1368 N NE  . ARG A 179 ? 0.42728469 0.79405367 0.32030421 -0.12950057 0.02953155  0.12594625  179 ARG A NE  
1369 C CZ  . ARG A 179 ? 0.44769979 0.82109797 0.34202632 -0.13229306 0.02841094  0.12616181  179 ARG A CZ  
1370 N NH1 . ARG A 179 ? 0.45378590 0.83448064 0.34262991 -0.14857584 0.01954407  0.12861706  179 ARG A NH1 
1371 N NH2 . ARG A 179 ? 0.45112729 0.82282805 0.35023904 -0.12002026 0.03634689  0.12401061  179 ARG A NH2 
1372 N N   . MET A 180 ? 0.40669900 0.64009994 0.26818961 -0.14485769 0.02830678  0.07685343  180 MET A N   
1373 C CA  . MET A 180 ? 0.41042969 0.62148809 0.27318817 -0.14208478 0.03034753  0.06776377  180 MET A CA  
1374 C C   . MET A 180 ? 0.43235114 0.63175786 0.29902631 -0.13121341 0.03682974  0.06216859  180 MET A C   
1375 O O   . MET A 180 ? 0.40465534 0.59260827 0.27524164 -0.12660995 0.03922473  0.05673458  180 MET A O   
1376 C CB  . MET A 180 ? 0.40724689 0.59886837 0.26145834 -0.15246093 0.02744000  0.06315245  180 MET A CB  
1377 C CG  . MET A 180 ? 0.44632849 0.64596492 0.29506332 -0.16379933 0.02119053  0.06807090  180 MET A CG  
1378 S SD  . MET A 180 ? 0.52511758 0.69531387 0.35963953 -0.17539398 0.02012461  0.06239369  180 MET A SD  
1379 C CE  . MET A 180 ? 0.54230607 0.71879023 0.37068775 -0.18749090 0.01312296  0.06775100  180 MET A CE  
1380 N N   . GLY A 181 ? 0.41438320 0.61739236 0.27950519 -0.12795255 0.03939828  0.06419747  181 GLY A N   
1381 C CA  . GLY A 181 ? 0.38348544 0.57356668 0.25009057 -0.11924290 0.04539895  0.05885438  181 GLY A CA  
1382 C C   . GLY A 181 ? 0.37973499 0.57997006 0.25031528 -0.10803621 0.05055686  0.06301955  181 GLY A C   
1383 O O   . GLY A 181 ? 0.40717199 0.59662569 0.27685708 -0.10127019 0.05582694  0.05952938  181 GLY A O   
1384 N N   . ASP A 182 ? 0.38956073 0.60946965 0.26357472 -0.10606731 0.04983713  0.07071193  182 ASP A N   
1385 C CA  . ASP A 182 ? 0.42799300 0.65585792 0.30508256 -0.09401613 0.05672156  0.07506825  182 ASP A CA  
1386 C C   . ASP A 182 ? 0.46003473 0.67400098 0.33600792 -0.09057725 0.06067811  0.06803402  182 ASP A C   
1387 O O   . ASP A 182 ? 0.41716322 0.62818390 0.29362813 -0.09767716 0.05618095  0.06461488  182 ASP A O   
1388 C CB  . ASP A 182 ? 0.47986138 0.73517150 0.36187154 -0.09286217 0.05547551  0.08639674  182 ASP A CB  
1389 C CG  . ASP A 182 ? 0.51273608 0.78821540 0.39654556 -0.09505060 0.05237750  0.09697378  182 ASP A CG  
1390 O OD1 . ASP A 182 ? 0.54303199 0.81010616 0.42363703 -0.09457573 0.05307846  0.09594294  182 ASP A OD1 
1391 O OD2 . ASP A 182 ? 0.44965726 0.75006795 0.33738667 -0.09934404 0.04834104  0.10649221  182 ASP A OD2 
1392 N N   . VAL A 183 ? 0.50985169 0.71243429 0.38252118 -0.08119930 0.06880325  0.06555562  183 VAL A N   
1393 C CA  . VAL A 183 ? 0.48300120 0.66996074 0.35106996 -0.08021881 0.07279610  0.05851791  183 VAL A CA  
1394 C C   . VAL A 183 ? 0.49856436 0.68624675 0.36242029 -0.06980481 0.08244179  0.06159088  183 VAL A C   
1395 O O   . VAL A 183 ? 0.43003136 0.62612033 0.29529095 -0.06069474 0.08745317  0.06857496  183 VAL A O   
1396 C CB  . VAL A 183 ? 0.48320007 0.64971435 0.34713876 -0.08187734 0.07389753  0.05077862  183 VAL A CB  
1397 C CG1 . VAL A 183 ? 0.51698732 0.68287301 0.38507184 -0.09019176 0.06648532  0.04867947  183 VAL A CG1 
1398 C CG2 . VAL A 183 ? 0.51247621 0.67212880 0.37182221 -0.07318517 0.08094157  0.05223759  183 VAL A CG2 
1399 N N   . ILE A 184 ? 0.54914564 0.72932935 0.40787867 -0.07187766 0.08484562  0.05725896  184 ILE A N   
1400 C CA  . ILE A 184 ? 0.53099942 0.70575655 0.38176775 -0.06327447 0.09567824  0.05809773  184 ILE A CA  
1401 C C   . ILE A 184 ? 0.51810247 0.66828799 0.35579601 -0.06738310 0.09992087  0.04892385  184 ILE A C   
1402 O O   . ILE A 184 ? 0.44486159 0.58659172 0.28215355 -0.07716532 0.09354059  0.04306554  184 ILE A O   
1403 C CB  . ILE A 184 ? 0.55771273 0.75280607 0.41334316 -0.06306468 0.09507921  0.06409323  184 ILE A CB  
1404 C CG1 . ILE A 184 ? 0.54278642 0.73801303 0.39866018 -0.07557306 0.08697233  0.05958870  184 ILE A CG1 
1405 C CG2 . ILE A 184 ? 0.52096832 0.74246562 0.38860315 -0.06067599 0.09046564  0.07453400  184 ILE A CG2 
1406 C CD1 . ILE A 184 ? 0.52725303 0.74127948 0.38630497 -0.07674049 0.08636315  0.06492659  184 ILE A CD1 
1407 N N   . ASP A 185 ? 0.56034172 0.69848627 0.38628733 -0.05912412 0.11204360  0.04862787  185 ASP A N   
1408 C CA  . ASP A 185 ? 0.66292197 0.77618098 0.47176847 -0.06429020 0.11765723  0.04037938  185 ASP A CA  
1409 C C   . ASP A 185 ? 0.58127666 0.69922185 0.38694501 -0.07284916 0.11528514  0.03858358  185 ASP A C   
1410 O O   . ASP A 185 ? 0.58120203 0.70691931 0.38525057 -0.06700842 0.12160487  0.04234910  185 ASP A O   
1411 C CB  . ASP A 185 ? 0.73905259 0.83128804 0.53190768 -0.05326350 0.13298039  0.03974579  185 ASP A CB  
1412 C CG  . ASP A 185 ? 0.85254776 0.91451257 0.62367094 -0.06131940 0.13846382  0.03049288  185 ASP A CG  
1413 O OD1 . ASP A 185 ? 0.89466202 0.95539862 0.66334975 -0.07593006 0.13064486  0.02544964  185 ASP A OD1 
1414 O OD2 . ASP A 185 ? 0.92926335 0.96934247 0.68611610 -0.05384131 0.14974526  0.02911388  185 ASP A OD2 
1415 N N   . GLY A 186 ? 0.53388083 0.64775532 0.33887303 -0.08639838 0.10662788  0.03362906  186 GLY A N   
1416 C CA  . GLY A 186 ? 0.58966517 0.70922822 0.39266771 -0.09661291 0.10210282  0.03271070  186 GLY A CA  
1417 C C   . GLY A 186 ? 0.58119994 0.68372691 0.36296937 -0.09826352 0.11314017  0.02873736  186 GLY A C   
1418 O O   . GLY A 186 ? 0.57728672 0.68807268 0.35720915 -0.10096363 0.11370014  0.03022585  186 GLY A O   
1419 N N   . ARG A 187 ? 0.63509548 0.71260810 0.39933974 -0.09637354 0.12289847  0.02380136  187 ARG A N   
1420 C CA  . ARG A 187 ? 0.71669292 0.77152646 0.45626825 -0.09597822 0.13683400  0.01953617  187 ARG A CA  
1421 C C   . ARG A 187 ? 0.76804882 0.83049524 0.50891042 -0.08126182 0.14772901  0.02459907  187 ARG A C   
1422 O O   . ARG A 187 ? 0.75136411 0.80394566 0.47625840 -0.08328395 0.15655574  0.02214561  187 ARG A O   
1423 C CB  . ARG A 187 ? 0.82883406 0.85309207 0.54873621 -0.09467580 0.14644049  0.01412911  187 ARG A CB  
1424 C CG  . ARG A 187 ? 0.91976273 0.93791574 0.63806832 -0.10937215 0.13660337  0.00996652  187 ARG A CG  
1425 C CD  . ARG A 187 ? 1.19263148 1.19490647 0.90663618 -0.10214639 0.14183962  0.00866706  187 ARG A CD  
1426 N NE  . ARG A 187 ? 1.28033602 1.28025842 0.99649894 -0.11324780 0.13311267  0.00604774  187 ARG A NE  
1427 C CZ  . ARG A 187 ? 1.44145286 1.42316163 1.14830267 -0.10969156 0.13881123  0.00385766  187 ARG A CZ  
1428 N NH1 . ARG A 187 ? 1.30092072 1.27417386 1.00519478 -0.09339454 0.14936198  0.00623076  187 ARG A NH1 
1429 N NH2 . ARG A 187 ? 1.68189061 1.65550101 1.38235056 -0.12264293 0.13396241  0.00035269  187 ARG A NH2 
1430 N N   . ASN A 188 ? 0.74604094 0.82787395 0.50556499 -0.06758386 0.14712325  0.03234465  188 ASN A N   
1431 C CA  . ASN A 188 ? 0.71782672 0.80859506 0.47887856 -0.05265795 0.15888369  0.03886014  188 ASN A CA  
1432 C C   . ASN A 188 ? 0.68588352 0.80996412 0.46498781 -0.05399686 0.15074328  0.04582186  188 ASN A C   
1433 O O   . ASN A 188 ? 0.66442710 0.80291045 0.44893906 -0.04181186 0.15900488  0.05319050  188 ASN A O   
1434 C CB  . ASN A 188 ? 0.73575741 0.82688105 0.50303745 -0.03535036 0.16653273  0.04522512  188 ASN A CB  
1435 C CG  . ASN A 188 ? 0.83043158 0.88596654 0.57731700 -0.03482424 0.17514822  0.03816309  188 ASN A CG  
1436 O OD1 . ASN A 188 ? 0.93496060 0.96478200 0.65938026 -0.04451309 0.18035439  0.02952799  188 ASN A OD1 
1437 N ND2 . ASN A 188 ? 0.87060148 0.92424488 0.62370014 -0.02633511 0.17539930  0.04157253  188 ASN A ND2 
1438 N N   . ILE A 189 ? 0.63520962 0.77168179 0.42324835 -0.06845460 0.13534793  0.04434148  189 ILE A N   
1439 C CA  . ILE A 189 ? 0.65071988 0.81409591 0.45083153 -0.07178695 0.12873422  0.05006173  189 ILE A CA  
1440 C C   . ILE A 189 ? 0.80103517 0.95660102 0.58504879 -0.07343674 0.13915572  0.04744435  189 ILE A C   
1441 O O   . ILE A 189 ? 0.85409391 0.98538852 0.61880112 -0.08245098 0.14267692  0.03925210  189 ILE A O   
1442 C CB  . ILE A 189 ? 0.56398773 0.73862350 0.37551600 -0.08634361 0.11095313  0.04936334  189 ILE A CB  
1443 C CG1 . ILE A 189 ? 0.61275834 0.79333210 0.43805546 -0.08498690 0.10223167  0.05145936  189 ILE A CG1 
1444 C CG2 . ILE A 189 ? 0.55209845 0.75046843 0.37213796 -0.09183191 0.10443220  0.05464360  189 ILE A CG2 
1445 C CD1 . ILE A 189 ? 0.61804736 0.79842818 0.44951323 -0.09829612 0.08833353  0.04854143  189 ILE A CD1 
1446 N N   . GLU A 190 ? 0.85024214 1.02734303 0.64150298 -0.06606336 0.14389771  0.05477127  190 GLU A N   
1447 C CA  . GLU A 190 ? 0.95789838 1.12892115 0.73414218 -0.06551101 0.15606901  0.05300997  190 GLU A CA  
1448 C C   . GLU A 190 ? 0.78144658 0.97181666 0.56319505 -0.07957418 0.14460504  0.05429798  190 GLU A C   
1449 O O   . GLU A 190 ? 0.88715279 1.06404018 0.65362096 -0.09199189 0.14429829  0.04792345  190 GLU A O   
1450 C CB  . GLU A 190 ? 1.12100673 1.30049288 0.89941144 -0.04574315 0.17288990  0.06064197  190 GLU A CB  
1451 C CG  . GLU A 190 ? 1.21492469 1.38527918 0.97583866 -0.04362448 0.18850736  0.05836155  190 GLU A CG  
1452 C CD  . GLU A 190 ? 1.33501172 1.46513414 1.06416404 -0.05270415 0.19833791  0.04585711  190 GLU A CD  
1453 O OE1 . GLU A 190 ? 1.18359268 1.28574026 0.89932740 -0.05869244 0.19717404  0.03808012  190 GLU A OE1 
1454 O OE2 . GLU A 190 ? 1.31855130 1.44664836 1.03491426 -0.05552295 0.20732406  0.04417513  190 GLU A OE2 
1455 N N   . LYS A 191 ? 0.77252793 0.99365479 0.57511127 -0.07938080 0.13403010  0.06277543  191 LYS A N   
1456 C CA  . LYS A 191 ? 0.78815234 1.02684772 0.59643161 -0.09330951 0.12170903  0.06464679  191 LYS A CA  
1457 C C   . LYS A 191 ? 0.68643475 0.95029140 0.51543587 -0.09578437 0.10720685  0.07213436  191 LYS A C   
1458 O O   . LYS A 191 ? 0.74711394 1.01995063 0.58655524 -0.08627564 0.10777096  0.07723669  191 LYS A O   
1459 C CB  . LYS A 191 ? 0.90925062 1.16331053 0.71489698 -0.08885273 0.13167344  0.06937319  191 LYS A CB  
1460 C CG  . LYS A 191 ? 0.96274084 1.23421693 0.77914023 -0.06961989 0.14296186  0.07874554  191 LYS A CG  
1461 C CD  . LYS A 191 ? 1.02100456 1.31964290 0.84294009 -0.06405355 0.15040135  0.08745673  191 LYS A CD  
1462 C CE  . LYS A 191 ? 1.07139957 1.38941205 0.90688229 -0.04447787 0.16035740  0.09869825  191 LYS A CE  
1463 N NZ  . LYS A 191 ? 0.97584975 1.32558632 0.82010287 -0.03843717 0.16713554  0.10927449  191 LYS A NZ  
1464 N N   . ILE A 192 ? 0.65617645 0.93105292 0.48920414 -0.10938539 0.09481744  0.07331604  192 ILE A N   
1465 C CA  . ILE A 192 ? 0.68803394 0.98301554 0.53590930 -0.11529621 0.08104365  0.07966372  192 ILE A CA  
1466 C C   . ILE A 192 ? 0.65856701 0.97617459 0.50857055 -0.12207677 0.07815751  0.08564256  192 ILE A C   
1467 O O   . ILE A 192 ? 0.63319272 0.94387639 0.47342536 -0.13029055 0.07840875  0.08186978  192 ILE A O   
1468 C CB  . ILE A 192 ? 0.60870963 0.88950491 0.45794177 -0.12649466 0.06795878  0.07487712  192 ILE A CB  
1469 C CG1 . ILE A 192 ? 0.62158293 0.88098252 0.46799374 -0.12068678 0.07140891  0.06888906  192 ILE A CG1 
1470 C CG2 . ILE A 192 ? 0.58810258 0.88465428 0.44887832 -0.13311814 0.05527606  0.08082080  192 ILE A CG2 
1471 C CD1 . ILE A 192 ? 0.60330176 0.84825301 0.45056438 -0.13031460 0.06120173  0.06427128  192 ILE A CD1 
1472 N N   . GLU A 193 ? 0.62095118 0.96566135 0.48285758 -0.12043486 0.07452624  0.09522143  193 GLU A N   
1473 C CA  . GLU A 193 ? 0.63946980 1.00859976 0.50404370 -0.12738006 0.07149164  0.10206738  193 GLU A CA  
1474 C C   . GLU A 193 ? 0.65075684 1.03540909 0.52431035 -0.13759896 0.05696549  0.10823234  193 GLU A C   
1475 O O   . GLU A 193 ? 0.69337976 1.08285832 0.57391274 -0.13367806 0.05453619  0.11161721  193 GLU A O   
1476 C CB  . GLU A 193 ? 0.65957540 1.05220914 0.52823871 -0.11517961 0.08448699  0.11016223  193 GLU A CB  
1477 C CG  . GLU A 193 ? 0.78011358 1.15405011 0.63694847 -0.10344942 0.10204022  0.10417612  193 GLU A CG  
1478 C CD  . GLU A 193 ? 0.92494464 1.31591511 0.78564006 -0.08592748 0.11913947  0.11198242  193 GLU A CD  
1479 O OE1 . GLU A 193 ? 0.83992469 1.24407578 0.71219230 -0.07333044 0.12275469  0.11977701  193 GLU A OE1 
1480 O OE2 . GLU A 193 ? 1.03262210 1.42298067 0.88388616 -0.08474598 0.12978441  0.11053007  193 GLU A OE2 
1481 N N   . VAL A 194 ? 0.64180040 1.03229892 0.51289994 -0.15161312 0.04782378  0.10955429  194 VAL A N   
1482 C CA  . VAL A 194 ? 0.65533161 1.05712390 0.53050512 -0.16399959 0.03443357  0.11511136  194 VAL A CA  
1483 C C   . VAL A 194 ? 0.62537378 1.05394804 0.50102329 -0.17169018 0.03279133  0.12305413  194 VAL A C   
1484 O O   . VAL A 194 ? 0.58168352 1.00861311 0.45144781 -0.17421354 0.03621394  0.12070709  194 VAL A O   
1485 C CB  . VAL A 194 ? 0.66430461 1.04033077 0.53452998 -0.17459375 0.02385427  0.10849716  194 VAL A CB  
1486 C CG1 . VAL A 194 ? 0.66876370 1.04807520 0.53983438 -0.18676637 0.01150101  0.11296444  194 VAL A CG1 
1487 C CG2 . VAL A 194 ? 0.61878008 0.96939003 0.48827896 -0.16653129 0.02733758  0.10031768  194 VAL A CG2 
1488 N N   . ASN A 195 ? 0.77415299 1.22654164 0.65532273 -0.17770666 0.02653641  0.13241351  195 ASN A N   
1489 C CA  . ASN A 195 ? 0.76928586 1.24861097 0.65070355 -0.18801847 0.02276616  0.14089578  195 ASN A CA  
1490 C C   . ASN A 195 ? 0.72244245 1.19980133 0.59940064 -0.20621379 0.00766169  0.14360847  195 ASN A C   
1491 O O   . ASN A 195 ? 0.83543456 1.32503045 0.71517378 -0.20996450 0.00305267  0.14974168  195 ASN A O   
1492 C CB  . ASN A 195 ? 0.81367195 1.33045053 0.70534194 -0.18167126 0.02813291  0.15315278  195 ASN A CB  
1493 C CG  . ASN A 195 ? 0.99113274 1.50672591 0.88896143 -0.16093227 0.04251529  0.15225653  195 ASN A CG  
1494 O OD1 . ASN A 195 ? 0.99898458 1.50744700 0.89354706 -0.15124173 0.05438517  0.14786926  195 ASN A OD1 
1495 N ND2 . ASN A 195 ? 1.17246711 1.69111061 1.07662416 -0.15527229 0.04156540  0.15567142  195 ASN A ND2 
1496 N N   . LEU A 196 ? 0.69611990 1.15589619 0.56479913 -0.21766067 0.00035170  0.13919696  196 LEU A N   
1497 C CA  . LEU A 196 ? 0.82289863 1.27893841 0.68484563 -0.23524381 -0.01267426 0.14249355  196 LEU A CA  
1498 C C   . LEU A 196 ? 0.91996193 1.40843916 0.78077835 -0.24734993 -0.01640838 0.15302800  196 LEU A C   
1499 O O   . LEU A 196 ? 0.83810776 1.34820700 0.70270771 -0.24281472 -0.00907479 0.15624104  196 LEU A O   
1500 C CB  . LEU A 196 ? 0.79529631 1.21952868 0.64997977 -0.24107212 -0.01842524 0.13512217  196 LEU A CB  
1501 C CG  . LEU A 196 ? 0.74617064 1.14208460 0.60282266 -0.23013946 -0.01481105 0.12587245  196 LEU A CG  
1502 C CD1 . LEU A 196 ? 0.74865413 1.12093616 0.59996438 -0.23738270 -0.02134861 0.12219737  196 LEU A CD1 
1503 C CD2 . LEU A 196 ? 0.77048028 1.15720010 0.62854904 -0.22756967 -0.01639186 0.12500161  196 LEU A CD2 
1504 O OXT . LEU A 196 ? 0.90626681 1.39682138 0.76092571 -0.26199141 -0.02619021 0.15783426  196 LEU A OXT 
1505 C C1  . GOL B .   ? 0.91083646 0.91801965 0.60625404 -0.22911704 0.07185077  0.01161275  201 GOL A C1  
1506 O O1  . GOL B .   ? 0.99499100 1.00376296 0.68218869 -0.23913869 0.06615727  0.01552406  201 GOL A O1  
1507 C C2  . GOL B .   ? 0.86023635 0.85439628 0.57265079 -0.21155274 0.07980236  0.00481657  201 GOL A C2  
1508 O O2  . GOL B .   ? 0.81925672 0.82818234 0.54800612 -0.20416507 0.07392880  0.00977264  201 GOL A O2  
1509 C C3  . GOL B .   ? 0.98649281 0.94458842 0.68350935 -0.21423928 0.09120037  -0.00482531 201 GOL A C3  
1510 O O3  . GOL B .   ? 1.03696668 0.98314059 0.73856628 -0.20516166 0.10116377  -0.01146936 201 GOL A O3  
1511 C C1  . MPD C .   ? 1.19219494 1.26755822 1.03018439 -0.08937463 0.08886774  0.01996144  202 MPD A C1  
1512 C C2  . MPD C .   ? 1.20864022 1.29782271 1.05148888 -0.08588919 0.08595331  0.02572373  202 MPD A C2  
1513 O O2  . MPD C .   ? 1.10672879 1.20405483 0.95775223 -0.09125014 0.08037817  0.02523771  202 MPD A O2  
1514 C CM  . MPD C .   ? 1.22444963 1.31548953 1.06338704 -0.08061306 0.08821779  0.03076753  202 MPD A CM  
1515 C C3  . MPD C .   ? 1.14652824 1.24173605 0.99021387 -0.08362104 0.08580116  0.02810537  202 MPD A C3  
1516 C C4  . MPD C .   ? 1.04969764 1.16222012 0.90040076 -0.08315090 0.08117476  0.03383894  202 MPD A C4  
1517 O O4  . MPD C .   ? 0.78964227 0.90609449 0.64716399 -0.09034712 0.07530703  0.03149757  202 MPD A O4  
1518 C C5  . MPD C .   ? 0.89537477 1.01640773 0.74539590 -0.07731440 0.08350700  0.03902635  202 MPD A C5  
1519 C C1  . GOL D .   ? 1.07143807 1.12299216 1.04686344 -0.08941591 0.04434318  0.11600980  203 GOL A C1  
1520 O O1  . GOL D .   ? 0.91676301 0.98059970 0.89036167 -0.09897117 0.03287411  0.12088973  203 GOL A O1  
1521 C C2  . GOL D .   ? 1.23380911 1.30930305 1.23328578 -0.08098333 0.04574270  0.12300278  203 GOL A C2  
1522 O O2  . GOL D .   ? 1.07543588 1.15290356 1.09271049 -0.07066242 0.04809486  0.13813758  203 GOL A O2  
1523 C C3  . GOL D .   ? 1.21801138 1.28812969 1.21717441 -0.07509826 0.05552397  0.11447635  203 GOL A C3  
1524 O O3  . GOL D .   ? 0.79291332 0.89046210 0.80911374 -0.07334030 0.05381798  0.11719270  203 GOL A O3  
# 
