data_8ZXH
# 
_entry.id   8ZXH 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.399 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   8ZXH         pdb_00008zxh 10.2210/pdb8zxh/pdb 
WWPDB D_1300048617 ?            ?                   
# 
_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       2025-02-19 
# 
_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                        8ZXH 
_pdbx_database_status.recvd_initial_deposition_date   2024-06-14 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBJ 
_pdbx_database_status.process_site                    PDBC 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
loop_
_pdbx_contact_author.id 
_pdbx_contact_author.email 
_pdbx_contact_author.name_first 
_pdbx_contact_author.name_last 
_pdbx_contact_author.name_mi 
_pdbx_contact_author.role 
_pdbx_contact_author.identifier_ORCID 
2 fuzhifei@fjmu.edu.cn Zhifei   Fu    ? 'principal investigator/group leader' 0000-0002-6307-1733 
3 abing0811@xmu.edu.cn Qingbing Zheng ? 'principal investigator/group leader' 0000-0002-7516-9965 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Li, Y.'    1 ? 
'Zheng, Q.' 2 ? 
'Li, S.'    3 ? 
'Fu, Z.'    4 ? 
# 
_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 the red fluorescent protein mScarlet3-H at pH 4.5' 
_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 'Li, Y.'    1 ? 
primary 'Zheng, Q.' 2 ? 
primary 'Li, S.'    3 ? 
primary 'Fu, Z.'    4 ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer man 'red fluorescent protein mYongHong' 24805.037 1   ? ? ? ? 
2 water   nat water                               18.015    178 ? ? ? ? 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   yes 
_entity_poly.pdbx_seq_one_letter_code       
;AVIKEFMRFKVHMEGSMNGHEFEIEGEGEGRPYEGTQTAKLRVTKGGPLPFSWDILSPQF(NRQ)SRAFTKHPADIPDYW
KQSFPEGFKWERVMNFEDGGAVSVAQDTSLEDGTLIYKVKLRGTNFPPDGPVMQKKTMGWEASTERLYPEDVVLKGDIKH
ALRLKDGGRYLADFKTTYRAKKPVQMPGAFNIDRKLDITSHNEDYTVVEQYERSVARHS
;
_entity_poly.pdbx_seq_one_letter_code_can   
;AVIKEFMRFKVHMEGSMNGHEFEIEGEGEGRPYEGTQTAKLRVTKGGPLPFSWDILSPQFMYGSRAFTKHPADIPDYWKQ
SFPEGFKWERVMNFEDGGAVSVAQDTSLEDGTLIYKVKLRGTNFPPDGPVMQKKTMGWEASTERLYPEDVVLKGDIKHAL
RLKDGGRYLADFKTTYRAKKPVQMPGAFNIDRKLDITSHNEDYTVVEQYERSVARHS
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
_pdbx_entity_nonpoly.entity_id   2 
_pdbx_entity_nonpoly.name        water 
_pdbx_entity_nonpoly.comp_id     HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   ALA n 
1 2   VAL n 
1 3   ILE n 
1 4   LYS n 
1 5   GLU n 
1 6   PHE n 
1 7   MET n 
1 8   ARG n 
1 9   PHE n 
1 10  LYS n 
1 11  VAL n 
1 12  HIS n 
1 13  MET n 
1 14  GLU n 
1 15  GLY n 
1 16  SER n 
1 17  MET n 
1 18  ASN n 
1 19  GLY n 
1 20  HIS n 
1 21  GLU n 
1 22  PHE n 
1 23  GLU n 
1 24  ILE n 
1 25  GLU n 
1 26  GLY n 
1 27  GLU n 
1 28  GLY n 
1 29  GLU n 
1 30  GLY n 
1 31  ARG n 
1 32  PRO n 
1 33  TYR n 
1 34  GLU n 
1 35  GLY n 
1 36  THR n 
1 37  GLN n 
1 38  THR n 
1 39  ALA n 
1 40  LYS n 
1 41  LEU n 
1 42  ARG n 
1 43  VAL n 
1 44  THR n 
1 45  LYS n 
1 46  GLY n 
1 47  GLY n 
1 48  PRO n 
1 49  LEU n 
1 50  PRO n 
1 51  PHE n 
1 52  SER n 
1 53  TRP n 
1 54  ASP n 
1 55  ILE n 
1 56  LEU n 
1 57  SER n 
1 58  PRO n 
1 59  GLN n 
1 60  PHE n 
1 61  NRQ n 
1 62  SER n 
1 63  ARG n 
1 64  ALA n 
1 65  PHE n 
1 66  THR n 
1 67  LYS n 
1 68  HIS n 
1 69  PRO n 
1 70  ALA n 
1 71  ASP n 
1 72  ILE n 
1 73  PRO n 
1 74  ASP n 
1 75  TYR n 
1 76  TRP n 
1 77  LYS n 
1 78  GLN n 
1 79  SER n 
1 80  PHE n 
1 81  PRO n 
1 82  GLU n 
1 83  GLY n 
1 84  PHE n 
1 85  LYS n 
1 86  TRP n 
1 87  GLU n 
1 88  ARG n 
1 89  VAL n 
1 90  MET n 
1 91  ASN n 
1 92  PHE n 
1 93  GLU n 
1 94  ASP n 
1 95  GLY n 
1 96  GLY n 
1 97  ALA n 
1 98  VAL n 
1 99  SER n 
1 100 VAL n 
1 101 ALA n 
1 102 GLN n 
1 103 ASP n 
1 104 THR n 
1 105 SER n 
1 106 LEU n 
1 107 GLU n 
1 108 ASP n 
1 109 GLY n 
1 110 THR n 
1 111 LEU n 
1 112 ILE n 
1 113 TYR n 
1 114 LYS n 
1 115 VAL n 
1 116 LYS n 
1 117 LEU n 
1 118 ARG n 
1 119 GLY n 
1 120 THR n 
1 121 ASN n 
1 122 PHE n 
1 123 PRO n 
1 124 PRO n 
1 125 ASP n 
1 126 GLY n 
1 127 PRO n 
1 128 VAL n 
1 129 MET n 
1 130 GLN n 
1 131 LYS n 
1 132 LYS n 
1 133 THR n 
1 134 MET n 
1 135 GLY n 
1 136 TRP n 
1 137 GLU n 
1 138 ALA n 
1 139 SER n 
1 140 THR n 
1 141 GLU n 
1 142 ARG n 
1 143 LEU n 
1 144 TYR n 
1 145 PRO n 
1 146 GLU n 
1 147 ASP n 
1 148 VAL n 
1 149 VAL n 
1 150 LEU n 
1 151 LYS n 
1 152 GLY n 
1 153 ASP n 
1 154 ILE n 
1 155 LYS n 
1 156 HIS n 
1 157 ALA n 
1 158 LEU n 
1 159 ARG n 
1 160 LEU n 
1 161 LYS n 
1 162 ASP n 
1 163 GLY n 
1 164 GLY n 
1 165 ARG n 
1 166 TYR n 
1 167 LEU n 
1 168 ALA n 
1 169 ASP n 
1 170 PHE n 
1 171 LYS n 
1 172 THR n 
1 173 THR n 
1 174 TYR n 
1 175 ARG n 
1 176 ALA n 
1 177 LYS n 
1 178 LYS n 
1 179 PRO n 
1 180 VAL n 
1 181 GLN n 
1 182 MET n 
1 183 PRO n 
1 184 GLY n 
1 185 ALA n 
1 186 PHE n 
1 187 ASN n 
1 188 ILE n 
1 189 ASP n 
1 190 ARG n 
1 191 LYS n 
1 192 LEU n 
1 193 ASP n 
1 194 ILE n 
1 195 THR n 
1 196 SER n 
1 197 HIS n 
1 198 ASN n 
1 199 GLU n 
1 200 ASP n 
1 201 TYR n 
1 202 THR n 
1 203 VAL n 
1 204 VAL n 
1 205 GLU n 
1 206 GLN n 
1 207 TYR n 
1 208 GLU n 
1 209 ARG n 
1 210 SER n 
1 211 VAL n 
1 212 ALA n 
1 213 ARG n 
1 214 HIS n 
1 215 SER 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                   215 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 ? 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Discosoma sp.' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     86600 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     562 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE ?                           'C3 H7 N O2'      89.093  
ARG 'L-peptide linking' y ARGININE ?                           'C6 H15 N4 O2 1'  175.209 
ASN 'L-peptide linking' y ASPARAGINE ?                           'C4 H8 N2 O3'     132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ?                           'C4 H7 N O4'      133.103 
GLN 'L-peptide linking' y GLUTAMINE ?                           'C5 H10 N2 O3'    146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ?                           'C5 H9 N O4'      147.129 
GLY 'peptide linking'   y GLYCINE ?                           'C2 H5 N O2'      75.067  
HIS 'L-peptide linking' y HISTIDINE ?                           'C6 H10 N3 O2 1'  156.162 
HOH non-polymer         . WATER ?                           'H2 O'            18.015  
ILE 'L-peptide linking' y ISOLEUCINE ?                           'C6 H13 N O2'     131.173 
LEU 'L-peptide linking' y LEUCINE ?                           'C6 H13 N O2'     131.173 
LYS 'L-peptide linking' y LYSINE ?                           'C6 H15 N2 O2 1'  147.195 
MET 'L-peptide linking' y METHIONINE ?                           'C5 H11 N O2 S'   149.211 
NRQ 'L-peptide linking' n 
'{(4Z)-4-(4-hydroxybenzylidene)-2-[3-(methylthio)propanimidoyl]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid' 
'CHROMOPHORE (MET-TYR-GLY)' 'C16 H17 N3 O4 S' 347.389 
PHE 'L-peptide linking' y PHENYLALANINE ?                           'C9 H11 N O2'     165.189 
PRO 'L-peptide linking' y PROLINE ?                           'C5 H9 N O2'      115.130 
SER 'L-peptide linking' y SERINE ?                           'C3 H7 N O3'      105.093 
THR 'L-peptide linking' y THREONINE ?                           'C4 H9 N O3'      119.119 
TRP 'L-peptide linking' y TRYPTOPHAN ?                           'C11 H12 N2 O2'   204.225 
TYR 'L-peptide linking' y TYROSINE ?                           'C9 H11 N O3'     181.189 
VAL 'L-peptide linking' y VALINE ?                           'C5 H11 N O2'     117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   ALA 1   7   7   ALA ALA A . n 
A 1 2   VAL 2   8   8   VAL VAL A . n 
A 1 3   ILE 3   9   9   ILE ILE A . n 
A 1 4   LYS 4   10  10  LYS LYS A . n 
A 1 5   GLU 5   11  11  GLU GLU A . n 
A 1 6   PHE 6   12  12  PHE PHE A . n 
A 1 7   MET 7   13  13  MET MET A . n 
A 1 8   ARG 8   14  14  ARG ARG A . n 
A 1 9   PHE 9   15  15  PHE PHE A . n 
A 1 10  LYS 10  16  16  LYS LYS A . n 
A 1 11  VAL 11  17  17  VAL VAL A . n 
A 1 12  HIS 12  18  18  HIS HIS A . n 
A 1 13  MET 13  19  19  MET MET A . n 
A 1 14  GLU 14  20  20  GLU GLU A . n 
A 1 15  GLY 15  21  21  GLY GLY A . n 
A 1 16  SER 16  22  22  SER SER A . n 
A 1 17  MET 17  23  23  MET MET A . n 
A 1 18  ASN 18  24  24  ASN ASN A . n 
A 1 19  GLY 19  25  25  GLY GLY A . n 
A 1 20  HIS 20  26  26  HIS HIS A . n 
A 1 21  GLU 21  27  27  GLU GLU A . n 
A 1 22  PHE 22  28  28  PHE PHE A . n 
A 1 23  GLU 23  29  29  GLU GLU A . n 
A 1 24  ILE 24  30  30  ILE ILE A . n 
A 1 25  GLU 25  31  31  GLU GLU A . n 
A 1 26  GLY 26  32  32  GLY GLY A . n 
A 1 27  GLU 27  33  33  GLU GLU A . n 
A 1 28  GLY 28  34  34  GLY GLY A . n 
A 1 29  GLU 29  35  35  GLU GLU A . n 
A 1 30  GLY 30  36  36  GLY GLY A . n 
A 1 31  ARG 31  37  37  ARG ARG A . n 
A 1 32  PRO 32  38  38  PRO PRO A . n 
A 1 33  TYR 33  39  39  TYR TYR A . n 
A 1 34  GLU 34  40  40  GLU GLU A . n 
A 1 35  GLY 35  41  41  GLY GLY A . n 
A 1 36  THR 36  42  42  THR THR A . n 
A 1 37  GLN 37  43  43  GLN GLN A . n 
A 1 38  THR 38  44  44  THR THR A . n 
A 1 39  ALA 39  45  45  ALA ALA A . n 
A 1 40  LYS 40  46  46  LYS LYS A . n 
A 1 41  LEU 41  47  47  LEU LEU A . n 
A 1 42  ARG 42  48  48  ARG ARG A . n 
A 1 43  VAL 43  49  49  VAL VAL A . n 
A 1 44  THR 44  50  50  THR THR A . n 
A 1 45  LYS 45  51  51  LYS LYS A . n 
A 1 46  GLY 46  52  52  GLY GLY A . n 
A 1 47  GLY 47  53  53  GLY GLY A . n 
A 1 48  PRO 48  54  54  PRO PRO A . n 
A 1 49  LEU 49  55  55  LEU LEU A . n 
A 1 50  PRO 50  56  56  PRO PRO A . n 
A 1 51  PHE 51  57  57  PHE PHE A . n 
A 1 52  SER 52  58  58  SER SER A . n 
A 1 53  TRP 53  59  59  TRP TRP A . n 
A 1 54  ASP 54  60  60  ASP ASP A . n 
A 1 55  ILE 55  61  61  ILE ILE A . n 
A 1 56  LEU 56  62  62  LEU LEU A . n 
A 1 57  SER 57  63  63  SER SER A . n 
A 1 58  PRO 58  64  64  PRO PRO A . n 
A 1 59  GLN 59  65  65  GLN GLN A . n 
A 1 60  PHE 60  66  66  PHE PHE A . n 
A 1 61  NRQ 61  67  67  NRQ NRQ A . n 
A 1 62  SER 62  70  70  SER SER A . n 
A 1 63  ARG 63  71  71  ARG ARG A . n 
A 1 64  ALA 64  72  72  ALA ALA A . n 
A 1 65  PHE 65  73  73  PHE PHE A . n 
A 1 66  THR 66  74  74  THR THR A . n 
A 1 67  LYS 67  75  75  LYS LYS A . n 
A 1 68  HIS 68  76  76  HIS HIS A . n 
A 1 69  PRO 69  77  77  PRO PRO A . n 
A 1 70  ALA 70  78  78  ALA ALA A . n 
A 1 71  ASP 71  79  79  ASP ASP A . n 
A 1 72  ILE 72  80  80  ILE ILE A . n 
A 1 73  PRO 73  81  81  PRO PRO A . n 
A 1 74  ASP 74  82  82  ASP ASP A . n 
A 1 75  TYR 75  83  83  TYR TYR A . n 
A 1 76  TRP 76  84  84  TRP TRP A . n 
A 1 77  LYS 77  85  85  LYS LYS A . n 
A 1 78  GLN 78  86  86  GLN GLN A . n 
A 1 79  SER 79  87  87  SER SER A . n 
A 1 80  PHE 80  88  88  PHE PHE A . n 
A 1 81  PRO 81  89  89  PRO PRO A . n 
A 1 82  GLU 82  90  90  GLU GLU A . n 
A 1 83  GLY 83  91  91  GLY GLY A . n 
A 1 84  PHE 84  92  92  PHE PHE A . n 
A 1 85  LYS 85  93  93  LYS LYS A . n 
A 1 86  TRP 86  94  94  TRP TRP A . n 
A 1 87  GLU 87  95  95  GLU GLU A . n 
A 1 88  ARG 88  96  96  ARG ARG A . n 
A 1 89  VAL 89  97  97  VAL VAL A . n 
A 1 90  MET 90  98  98  MET MET A . n 
A 1 91  ASN 91  99  99  ASN ASN A . n 
A 1 92  PHE 92  100 100 PHE PHE A . n 
A 1 93  GLU 93  101 101 GLU GLU A . n 
A 1 94  ASP 94  102 102 ASP ASP A . n 
A 1 95  GLY 95  103 103 GLY GLY A . n 
A 1 96  GLY 96  104 104 GLY GLY A . n 
A 1 97  ALA 97  105 105 ALA ALA A . n 
A 1 98  VAL 98  106 106 VAL VAL A . n 
A 1 99  SER 99  107 107 SER SER A . n 
A 1 100 VAL 100 108 108 VAL VAL A . n 
A 1 101 ALA 101 109 109 ALA ALA A . n 
A 1 102 GLN 102 110 110 GLN GLN A . n 
A 1 103 ASP 103 111 111 ASP ASP A . n 
A 1 104 THR 104 112 112 THR THR A . n 
A 1 105 SER 105 113 113 SER SER A . n 
A 1 106 LEU 106 114 114 LEU LEU A . n 
A 1 107 GLU 107 115 115 GLU GLU A . n 
A 1 108 ASP 108 116 116 ASP ASP A . n 
A 1 109 GLY 109 117 117 GLY GLY A . n 
A 1 110 THR 110 118 118 THR THR A . n 
A 1 111 LEU 111 119 119 LEU LEU A . n 
A 1 112 ILE 112 120 120 ILE ILE A . n 
A 1 113 TYR 113 121 121 TYR TYR A . n 
A 1 114 LYS 114 122 122 LYS LYS A . n 
A 1 115 VAL 115 123 123 VAL VAL A . n 
A 1 116 LYS 116 124 124 LYS LYS A . n 
A 1 117 LEU 117 125 125 LEU LEU A . n 
A 1 118 ARG 118 126 126 ARG ARG A . n 
A 1 119 GLY 119 127 127 GLY GLY A . n 
A 1 120 THR 120 128 128 THR THR A . n 
A 1 121 ASN 121 129 129 ASN ASN A . n 
A 1 122 PHE 122 130 130 PHE PHE A . n 
A 1 123 PRO 123 131 131 PRO PRO A . n 
A 1 124 PRO 124 132 132 PRO PRO A . n 
A 1 125 ASP 125 133 133 ASP ASP A . n 
A 1 126 GLY 126 134 134 GLY GLY A . n 
A 1 127 PRO 127 135 135 PRO PRO A . n 
A 1 128 VAL 128 136 136 VAL VAL A . n 
A 1 129 MET 129 137 137 MET MET A . n 
A 1 130 GLN 130 138 138 GLN GLN A . n 
A 1 131 LYS 131 139 139 LYS LYS A . n 
A 1 132 LYS 132 140 140 LYS LYS A . n 
A 1 133 THR 133 141 141 THR THR A . n 
A 1 134 MET 134 142 142 MET MET A . n 
A 1 135 GLY 135 143 143 GLY GLY A . n 
A 1 136 TRP 136 144 144 TRP TRP A . n 
A 1 137 GLU 137 145 145 GLU GLU A . n 
A 1 138 ALA 138 146 146 ALA ALA A . n 
A 1 139 SER 139 147 147 SER SER A . n 
A 1 140 THR 140 148 148 THR THR A . n 
A 1 141 GLU 141 149 149 GLU GLU A . n 
A 1 142 ARG 142 150 150 ARG ARG A . n 
A 1 143 LEU 143 151 151 LEU LEU A . n 
A 1 144 TYR 144 152 152 TYR TYR A . n 
A 1 145 PRO 145 153 153 PRO PRO A . n 
A 1 146 GLU 146 154 154 GLU GLU A . n 
A 1 147 ASP 147 155 155 ASP ASP A . n 
A 1 148 VAL 148 156 156 VAL VAL A . n 
A 1 149 VAL 149 157 157 VAL VAL A . n 
A 1 150 LEU 150 158 158 LEU LEU A . n 
A 1 151 LYS 151 159 159 LYS LYS A . n 
A 1 152 GLY 152 160 160 GLY GLY A . n 
A 1 153 ASP 153 161 161 ASP ASP A . n 
A 1 154 ILE 154 162 162 ILE ILE A . n 
A 1 155 LYS 155 163 163 LYS LYS A . n 
A 1 156 HIS 156 164 164 HIS HIS A . n 
A 1 157 ALA 157 165 165 ALA ALA A . n 
A 1 158 LEU 158 166 166 LEU LEU A . n 
A 1 159 ARG 159 167 167 ARG ARG A . n 
A 1 160 LEU 160 168 168 LEU LEU A . n 
A 1 161 LYS 161 169 169 LYS LYS A . n 
A 1 162 ASP 162 170 170 ASP ASP A . n 
A 1 163 GLY 163 171 171 GLY GLY A . n 
A 1 164 GLY 164 172 172 GLY GLY A . n 
A 1 165 ARG 165 173 173 ARG ARG A . n 
A 1 166 TYR 166 174 174 TYR TYR A . n 
A 1 167 LEU 167 175 175 LEU LEU A . n 
A 1 168 ALA 168 176 176 ALA ALA A . n 
A 1 169 ASP 169 177 177 ASP ASP A . n 
A 1 170 PHE 170 178 178 PHE PHE A . n 
A 1 171 LYS 171 179 179 LYS LYS A . n 
A 1 172 THR 172 180 180 THR THR A . n 
A 1 173 THR 173 181 181 THR THR A . n 
A 1 174 TYR 174 182 182 TYR TYR A . n 
A 1 175 ARG 175 183 183 ARG ARG A . n 
A 1 176 ALA 176 184 184 ALA ALA A . n 
A 1 177 LYS 177 185 185 LYS LYS A . n 
A 1 178 LYS 178 186 186 LYS LYS A . n 
A 1 179 PRO 179 187 187 PRO PRO A . n 
A 1 180 VAL 180 188 188 VAL VAL A . n 
A 1 181 GLN 181 189 189 GLN GLN A . n 
A 1 182 MET 182 190 190 MET MET A . n 
A 1 183 PRO 183 191 191 PRO PRO A . n 
A 1 184 GLY 184 192 192 GLY GLY A . n 
A 1 185 ALA 185 193 193 ALA ALA A . n 
A 1 186 PHE 186 194 194 PHE PHE A . n 
A 1 187 ASN 187 195 195 ASN ASN A . n 
A 1 188 ILE 188 196 196 ILE ILE A . n 
A 1 189 ASP 189 197 197 ASP ASP A . n 
A 1 190 ARG 190 198 198 ARG ARG A . n 
A 1 191 LYS 191 199 199 LYS LYS A . n 
A 1 192 LEU 192 200 200 LEU LEU A . n 
A 1 193 ASP 193 201 201 ASP ASP A . n 
A 1 194 ILE 194 202 202 ILE ILE A . n 
A 1 195 THR 195 203 203 THR THR A . n 
A 1 196 SER 196 204 204 SER SER A . n 
A 1 197 HIS 197 205 205 HIS HIS A . n 
A 1 198 ASN 198 206 206 ASN ASN A . n 
A 1 199 GLU 199 207 207 GLU GLU A . n 
A 1 200 ASP 200 208 208 ASP ASP A . n 
A 1 201 TYR 201 209 209 TYR TYR A . n 
A 1 202 THR 202 210 210 THR THR A . n 
A 1 203 VAL 203 211 211 VAL VAL A . n 
A 1 204 VAL 204 212 212 VAL VAL A . n 
A 1 205 GLU 205 213 213 GLU GLU A . n 
A 1 206 GLN 206 214 214 GLN GLN A . n 
A 1 207 TYR 207 215 215 TYR TYR A . n 
A 1 208 GLU 208 216 216 GLU GLU A . n 
A 1 209 ARG 209 217 217 ARG ARG A . n 
A 1 210 SER 210 218 218 SER SER A . n 
A 1 211 VAL 211 219 219 VAL VAL A . n 
A 1 212 ALA 212 220 220 ALA ALA A . n 
A 1 213 ARG 213 221 221 ARG ARG A . n 
A 1 214 HIS 214 222 222 HIS HIS A . n 
A 1 215 SER 215 223 223 SER SER A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        NRQ 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   NRQ 
_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 HOH 1   301 211 HOH HOH A . 
B 2 HOH 2   302 198 HOH HOH A . 
B 2 HOH 3   303 203 HOH HOH A . 
B 2 HOH 4   304 152 HOH HOH A . 
B 2 HOH 5   305 149 HOH HOH A . 
B 2 HOH 6   306 31  HOH HOH A . 
B 2 HOH 7   307 87  HOH HOH A . 
B 2 HOH 8   308 45  HOH HOH A . 
B 2 HOH 9   309 40  HOH HOH A . 
B 2 HOH 10  310 109 HOH HOH A . 
B 2 HOH 11  311 91  HOH HOH A . 
B 2 HOH 12  312 185 HOH HOH A . 
B 2 HOH 13  313 105 HOH HOH A . 
B 2 HOH 14  314 59  HOH HOH A . 
B 2 HOH 15  315 42  HOH HOH A . 
B 2 HOH 16  316 60  HOH HOH A . 
B 2 HOH 17  317 117 HOH HOH A . 
B 2 HOH 18  318 13  HOH HOH A . 
B 2 HOH 19  319 30  HOH HOH A . 
B 2 HOH 20  320 143 HOH HOH A . 
B 2 HOH 21  321 6   HOH HOH A . 
B 2 HOH 22  322 35  HOH HOH A . 
B 2 HOH 23  323 70  HOH HOH A . 
B 2 HOH 24  324 2   HOH HOH A . 
B 2 HOH 25  325 51  HOH HOH A . 
B 2 HOH 26  326 216 HOH HOH A . 
B 2 HOH 27  327 7   HOH HOH A . 
B 2 HOH 28  328 100 HOH HOH A . 
B 2 HOH 29  329 15  HOH HOH A . 
B 2 HOH 30  330 85  HOH HOH A . 
B 2 HOH 31  331 26  HOH HOH A . 
B 2 HOH 32  332 96  HOH HOH A . 
B 2 HOH 33  333 22  HOH HOH A . 
B 2 HOH 34  334 140 HOH HOH A . 
B 2 HOH 35  335 160 HOH HOH A . 
B 2 HOH 36  336 49  HOH HOH A . 
B 2 HOH 37  337 133 HOH HOH A . 
B 2 HOH 38  338 24  HOH HOH A . 
B 2 HOH 39  339 89  HOH HOH A . 
B 2 HOH 40  340 217 HOH HOH A . 
B 2 HOH 41  341 56  HOH HOH A . 
B 2 HOH 42  342 46  HOH HOH A . 
B 2 HOH 43  343 107 HOH HOH A . 
B 2 HOH 44  344 110 HOH HOH A . 
B 2 HOH 45  345 28  HOH HOH A . 
B 2 HOH 46  346 132 HOH HOH A . 
B 2 HOH 47  347 9   HOH HOH A . 
B 2 HOH 48  348 11  HOH HOH A . 
B 2 HOH 49  349 97  HOH HOH A . 
B 2 HOH 50  350 3   HOH HOH A . 
B 2 HOH 51  351 52  HOH HOH A . 
B 2 HOH 52  352 131 HOH HOH A . 
B 2 HOH 53  353 21  HOH HOH A . 
B 2 HOH 54  354 115 HOH HOH A . 
B 2 HOH 55  355 25  HOH HOH A . 
B 2 HOH 56  356 17  HOH HOH A . 
B 2 HOH 57  357 8   HOH HOH A . 
B 2 HOH 58  358 4   HOH HOH A . 
B 2 HOH 59  359 78  HOH HOH A . 
B 2 HOH 60  360 37  HOH HOH A . 
B 2 HOH 61  361 119 HOH HOH A . 
B 2 HOH 62  362 10  HOH HOH A . 
B 2 HOH 63  363 147 HOH HOH A . 
B 2 HOH 64  364 88  HOH HOH A . 
B 2 HOH 65  365 169 HOH HOH A . 
B 2 HOH 66  366 27  HOH HOH A . 
B 2 HOH 67  367 19  HOH HOH A . 
B 2 HOH 68  368 129 HOH HOH A . 
B 2 HOH 69  369 1   HOH HOH A . 
B 2 HOH 70  370 75  HOH HOH A . 
B 2 HOH 71  371 72  HOH HOH A . 
B 2 HOH 72  372 90  HOH HOH A . 
B 2 HOH 73  373 73  HOH HOH A . 
B 2 HOH 74  374 66  HOH HOH A . 
B 2 HOH 75  375 86  HOH HOH A . 
B 2 HOH 76  376 193 HOH HOH A . 
B 2 HOH 77  377 82  HOH HOH A . 
B 2 HOH 78  378 164 HOH HOH A . 
B 2 HOH 79  379 67  HOH HOH A . 
B 2 HOH 80  380 146 HOH HOH A . 
B 2 HOH 81  381 181 HOH HOH A . 
B 2 HOH 82  382 48  HOH HOH A . 
B 2 HOH 83  383 16  HOH HOH A . 
B 2 HOH 84  384 95  HOH HOH A . 
B 2 HOH 85  385 114 HOH HOH A . 
B 2 HOH 86  386 163 HOH HOH A . 
B 2 HOH 87  387 214 HOH HOH A . 
B 2 HOH 88  388 12  HOH HOH A . 
B 2 HOH 89  389 108 HOH HOH A . 
B 2 HOH 90  390 158 HOH HOH A . 
B 2 HOH 91  391 69  HOH HOH A . 
B 2 HOH 92  392 94  HOH HOH A . 
B 2 HOH 93  393 156 HOH HOH A . 
B 2 HOH 94  394 20  HOH HOH A . 
B 2 HOH 95  395 43  HOH HOH A . 
B 2 HOH 96  396 106 HOH HOH A . 
B 2 HOH 97  397 39  HOH HOH A . 
B 2 HOH 98  398 18  HOH HOH A . 
B 2 HOH 99  399 58  HOH HOH A . 
B 2 HOH 100 400 99  HOH HOH A . 
B 2 HOH 101 401 220 HOH HOH A . 
B 2 HOH 102 402 23  HOH HOH A . 
B 2 HOH 103 403 196 HOH HOH A . 
B 2 HOH 104 404 79  HOH HOH A . 
B 2 HOH 105 405 121 HOH HOH A . 
B 2 HOH 106 406 229 HOH HOH A . 
B 2 HOH 107 407 53  HOH HOH A . 
B 2 HOH 108 408 81  HOH HOH A . 
B 2 HOH 109 409 92  HOH HOH A . 
B 2 HOH 110 410 118 HOH HOH A . 
B 2 HOH 111 411 137 HOH HOH A . 
B 2 HOH 112 412 116 HOH HOH A . 
B 2 HOH 113 413 84  HOH HOH A . 
B 2 HOH 114 414 14  HOH HOH A . 
B 2 HOH 115 415 61  HOH HOH A . 
B 2 HOH 116 416 191 HOH HOH A . 
B 2 HOH 117 417 83  HOH HOH A . 
B 2 HOH 118 418 101 HOH HOH A . 
B 2 HOH 119 419 93  HOH HOH A . 
B 2 HOH 120 420 50  HOH HOH A . 
B 2 HOH 121 421 161 HOH HOH A . 
B 2 HOH 122 422 153 HOH HOH A . 
B 2 HOH 123 423 218 HOH HOH A . 
B 2 HOH 124 424 120 HOH HOH A . 
B 2 HOH 125 425 113 HOH HOH A . 
B 2 HOH 126 426 175 HOH HOH A . 
B 2 HOH 127 427 111 HOH HOH A . 
B 2 HOH 128 428 171 HOH HOH A . 
B 2 HOH 129 429 34  HOH HOH A . 
B 2 HOH 130 430 65  HOH HOH A . 
B 2 HOH 131 431 126 HOH HOH A . 
B 2 HOH 132 432 190 HOH HOH A . 
B 2 HOH 133 433 178 HOH HOH A . 
B 2 HOH 134 434 74  HOH HOH A . 
B 2 HOH 135 435 55  HOH HOH A . 
B 2 HOH 136 436 195 HOH HOH A . 
B 2 HOH 137 437 98  HOH HOH A . 
B 2 HOH 138 438 77  HOH HOH A . 
B 2 HOH 139 439 226 HOH HOH A . 
B 2 HOH 140 440 47  HOH HOH A . 
B 2 HOH 141 441 222 HOH HOH A . 
B 2 HOH 142 442 54  HOH HOH A . 
B 2 HOH 143 443 36  HOH HOH A . 
B 2 HOH 144 444 136 HOH HOH A . 
B 2 HOH 145 445 5   HOH HOH A . 
B 2 HOH 146 446 157 HOH HOH A . 
B 2 HOH 147 447 180 HOH HOH A . 
B 2 HOH 148 448 63  HOH HOH A . 
B 2 HOH 149 449 41  HOH HOH A . 
B 2 HOH 150 450 125 HOH HOH A . 
B 2 HOH 151 451 201 HOH HOH A . 
B 2 HOH 152 452 80  HOH HOH A . 
B 2 HOH 153 453 165 HOH HOH A . 
B 2 HOH 154 454 76  HOH HOH A . 
B 2 HOH 155 455 231 HOH HOH A . 
B 2 HOH 156 456 154 HOH HOH A . 
B 2 HOH 157 457 208 HOH HOH A . 
B 2 HOH 158 458 127 HOH HOH A . 
B 2 HOH 159 459 212 HOH HOH A . 
B 2 HOH 160 460 170 HOH HOH A . 
B 2 HOH 161 461 141 HOH HOH A . 
B 2 HOH 162 462 174 HOH HOH A . 
B 2 HOH 163 463 44  HOH HOH A . 
B 2 HOH 164 464 33  HOH HOH A . 
B 2 HOH 165 465 150 HOH HOH A . 
B 2 HOH 166 466 177 HOH HOH A . 
B 2 HOH 167 467 128 HOH HOH A . 
B 2 HOH 168 468 189 HOH HOH A . 
B 2 HOH 169 469 176 HOH HOH A . 
B 2 HOH 170 470 227 HOH HOH A . 
B 2 HOH 171 471 166 HOH HOH A . 
B 2 HOH 172 472 228 HOH HOH A . 
B 2 HOH 173 473 145 HOH HOH A . 
B 2 HOH 174 474 148 HOH HOH A . 
B 2 HOH 175 475 207 HOH HOH A . 
B 2 HOH 176 476 38  HOH HOH A . 
B 2 HOH 177 477 68  HOH HOH A . 
B 2 HOH 178 478 151 HOH HOH A . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? '(1.20.1_4487: ???)' 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .                    2 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? xia2   ? ? ? .                    3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.13-2998            4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   109.52 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8ZXH 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     84.520 
_cell.length_a_esd                 ? 
_cell.length_b                     35.490 
_cell.length_b_esd                 ? 
_cell.length_c                     85.660 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        4 
_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                         8ZXH 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                5 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'C 1 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                   8ZXH 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.34 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          47.39 
_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              4.5 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '6%propanol,0,1M NaAcet ph4.5,26%PEG550' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2024-06-04 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.9792 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'SSRF BEAMLINE BL17U1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.9792 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   BL17U1 
_diffrn_source.pdbx_synchrotron_site       SSRF 
# 
_reflns.B_iso_Wilson_estimate                          19.55 
_reflns.entry_id                                       8ZXH 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.46 
_reflns.d_resolution_low                               31.76 
_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                                     40680 
_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                           96.74 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                2 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          12.22 
_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                                0.09558 
_reflns.pdbx_Rpim_I_all                                0.03692 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.998 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.08797 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.46 
_reflns_shell.d_res_low                                     1.512 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             3998 
_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                                  0.744 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          95.01 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               ? 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 8ZXH 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.46 
_refine.ls_d_res_low                             31.76 
_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                     40662 
_refine.ls_number_reflns_R_free                  1999 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    96.75 
_refine.ls_percent_reflns_R_free                 4.92 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1864 
_refine.ls_R_factor_R_free                       0.2082 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1852 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.35 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ML 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.10 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.90 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 22.78 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.15 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.46 
_refine_hist.d_res_low                        31.76 
_refine_hist.number_atoms_solvent             178 
_refine_hist.number_atoms_total               1925 
_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        1747 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         0 
_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' ? 0.006 ? ?   ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 1.002 ? ?   ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 9.968 ? 244 ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.094 ? 244 ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.008 ? 318 ? f_plane_restr      ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.46 1.50  . . 138 2679 95.00 . . . . 0.2806 . . . . . . . . . . . 0.3132 
'X-RAY DIFFRACTION' 1.50 1.54  . . 141 2725 95.00 . . . . 0.2575 . . . . . . . . . . . 0.2834 
'X-RAY DIFFRACTION' 1.54 1.58  . . 139 2700 95.00 . . . . 0.2246 . . . . . . . . . . . 0.2362 
'X-RAY DIFFRACTION' 1.58 1.63  . . 140 2688 96.00 . . . . 0.2202 . . . . . . . . . . . 0.2525 
'X-RAY DIFFRACTION' 1.63 1.69  . . 141 2743 96.00 . . . . 0.2156 . . . . . . . . . . . 0.2343 
'X-RAY DIFFRACTION' 1.69 1.76  . . 141 2726 96.00 . . . . 0.2125 . . . . . . . . . . . 0.2164 
'X-RAY DIFFRACTION' 1.76 1.84  . . 143 2750 97.00 . . . . 0.1999 . . . . . . . . . . . 0.2416 
'X-RAY DIFFRACTION' 1.84 1.94  . . 141 2733 97.00 . . . . 0.1863 . . . . . . . . . . . 0.2212 
'X-RAY DIFFRACTION' 1.94 2.06  . . 144 2780 97.00 . . . . 0.1761 . . . . . . . . . . . 0.2149 
'X-RAY DIFFRACTION' 2.06 2.22  . . 143 2785 98.00 . . . . 0.1820 . . . . . . . . . . . 0.1922 
'X-RAY DIFFRACTION' 2.22 2.44  . . 145 2788 98.00 . . . . 0.1840 . . . . . . . . . . . 0.2038 
'X-RAY DIFFRACTION' 2.44 2.79  . . 146 2826 98.00 . . . . 0.1928 . . . . . . . . . . . 0.2283 
'X-RAY DIFFRACTION' 2.79 3.52  . . 146 2825 97.00 . . . . 0.1815 . . . . . . . . . . . 0.2251 
'X-RAY DIFFRACTION' 3.52 31.76 . . 151 2915 98.00 . . . . 0.1634 . . . . . . . . . . . 0.1654 
# 
_struct.entry_id                     8ZXH 
_struct.title                        'Structure of the red fluorescent protein mScarlet3-H at pH 4.5' 
_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        8ZXH 
_struct_keywords.text            'red fluorescent protein, mYongHong, FLUORESCENT PROTEIN' 
_struct_keywords.pdbx_keywords   'FLUORESCENT 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 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    PDB 
_struct_ref.db_code                    8ZXH 
_struct_ref.pdbx_db_accession          8ZXH 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   ? 
_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              8ZXH 
_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                 215 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             8ZXH 
_struct_ref_seq.db_align_beg                  7 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  223 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       7 
_struct_ref_seq.pdbx_auth_seq_align_end       223 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0 
_pdbx_struct_oper_list.matrix[1][2]         0.0 
_pdbx_struct_oper_list.matrix[1][3]         0.0 
_pdbx_struct_oper_list.vector[1]            0.0 
_pdbx_struct_oper_list.matrix[2][1]         0.0 
_pdbx_struct_oper_list.matrix[2][2]         1.0 
_pdbx_struct_oper_list.matrix[2][3]         0.0 
_pdbx_struct_oper_list.vector[2]            0.0 
_pdbx_struct_oper_list.matrix[3][1]         0.0 
_pdbx_struct_oper_list.matrix[3][2]         0.0 
_pdbx_struct_oper_list.matrix[3][3]         1.0 
_pdbx_struct_oper_list.vector[3]            0.0 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 SER A 52 ? PHE A 60 ? SER A 58 PHE A 66 5 ? 9 
HELX_P HELX_P2 AA2 SER A 62 ? THR A 66 ? SER A 70 THR A 74 5 ? 5 
HELX_P HELX_P3 AA3 ASP A 74 ? SER A 79 ? ASP A 82 SER A 87 1 ? 6 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
covale1 covale both ? A PHE 60 C  ? ? ? 1_555 A NRQ 61 N1 ? ? A PHE 66 A NRQ 67 1_555 ? ? ? ? ? ? ? 1.428 ? ? 
covale2 covale both ? A NRQ 61 C3 ? ? ? 1_555 A SER 62 N  ? ? A NRQ 67 A SER 70 1_555 ? ? ? ? ? ? ? 1.426 ? ? 
# 
_struct_conn_type.id          covale 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
_pdbx_modification_feature.ordinal                            1 
_pdbx_modification_feature.label_comp_id                      NRQ 
_pdbx_modification_feature.label_asym_id                      A 
_pdbx_modification_feature.label_seq_id                       61 
_pdbx_modification_feature.label_alt_id                       ? 
_pdbx_modification_feature.modified_residue_label_comp_id     . 
_pdbx_modification_feature.modified_residue_label_asym_id     . 
_pdbx_modification_feature.modified_residue_label_seq_id      . 
_pdbx_modification_feature.modified_residue_label_alt_id      . 
_pdbx_modification_feature.auth_comp_id                       NRQ 
_pdbx_modification_feature.auth_asym_id                       A 
_pdbx_modification_feature.auth_seq_id                        67 
_pdbx_modification_feature.PDB_ins_code                       ? 
_pdbx_modification_feature.symmetry                           1_555 
_pdbx_modification_feature.modified_residue_auth_comp_id      . 
_pdbx_modification_feature.modified_residue_auth_asym_id      . 
_pdbx_modification_feature.modified_residue_auth_seq_id       . 
_pdbx_modification_feature.modified_residue_PDB_ins_code      . 
_pdbx_modification_feature.modified_residue_symmetry          . 
_pdbx_modification_feature.comp_id_linking_atom               . 
_pdbx_modification_feature.modified_residue_id_linking_atom   . 
_pdbx_modification_feature.modified_residue_id                'MET, TYR, GLY' 
_pdbx_modification_feature.ref_pcm_id                         1 
_pdbx_modification_feature.ref_comp_id                        NRQ 
_pdbx_modification_feature.type                               None 
_pdbx_modification_feature.category                           Chromophore/chromophore-like 
# 
loop_
_struct_mon_prot_cis.pdbx_id 
_struct_mon_prot_cis.label_comp_id 
_struct_mon_prot_cis.label_seq_id 
_struct_mon_prot_cis.label_asym_id 
_struct_mon_prot_cis.label_alt_id 
_struct_mon_prot_cis.pdbx_PDB_ins_code 
_struct_mon_prot_cis.auth_comp_id 
_struct_mon_prot_cis.auth_seq_id 
_struct_mon_prot_cis.auth_asym_id 
_struct_mon_prot_cis.pdbx_label_comp_id_2 
_struct_mon_prot_cis.pdbx_label_seq_id_2 
_struct_mon_prot_cis.pdbx_label_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2 
_struct_mon_prot_cis.pdbx_auth_comp_id_2 
_struct_mon_prot_cis.pdbx_auth_seq_id_2 
_struct_mon_prot_cis.pdbx_auth_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_model_num 
_struct_mon_prot_cis.pdbx_omega_angle 
1 GLY 47 A . ? GLY 53 A PRO 48 A ? PRO 54 A 1 -10.26 
2 PHE 80 A . ? PHE 88 A PRO 81 A ? PRO 89 A 1 7.61   
# 
_struct_sheet.id               AA1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   13 
_struct_sheet.details          ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1  2  ? anti-parallel 
AA1 2  3  ? anti-parallel 
AA1 3  4  ? anti-parallel 
AA1 4  5  ? anti-parallel 
AA1 5  6  ? anti-parallel 
AA1 6  7  ? parallel      
AA1 7  8  ? anti-parallel 
AA1 8  9  ? anti-parallel 
AA1 9  10 ? anti-parallel 
AA1 10 11 ? anti-parallel 
AA1 11 12 ? anti-parallel 
AA1 12 13 ? 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  THR A 133 ? TRP A 136 ? THR A 141 TRP A 144 
AA1 2  VAL A 149 ? LEU A 160 ? VAL A 157 LEU A 168 
AA1 3  ARG A 165 ? ALA A 176 ? ARG A 173 ALA A 184 
AA1 4  PHE A 84  ? PHE A 92  ? PHE A 92  PHE A 100 
AA1 5  ALA A 97  ? GLU A 107 ? ALA A 105 GLU A 115 
AA1 6  THR A 110 ? THR A 120 ? THR A 118 THR A 128 
AA1 7  MET A 7   ? MET A 17  ? MET A 13  MET A 23  
AA1 8  HIS A 20  ? ARG A 31  ? HIS A 26  ARG A 37  
AA1 9  THR A 36  ? LYS A 45  ? THR A 42  LYS A 51  
AA1 10 VAL A 203 ? ARG A 213 ? VAL A 211 ARG A 221 
AA1 11 PHE A 186 ? HIS A 197 ? PHE A 194 HIS A 205 
AA1 12 SER A 139 ? GLU A 146 ? SER A 147 GLU A 154 
AA1 13 VAL A 149 ? LEU A 160 ? VAL A 157 LEU A 168 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1  2  N GLY A 135 ? N GLY A 143 O ARG A 159 ? O ARG A 167 
AA1 2  3  N LEU A 150 ? N LEU A 158 O TYR A 174 ? O TYR A 182 
AA1 3  4  O ARG A 175 ? O ARG A 183 N LYS A 85  ? N LYS A 93  
AA1 4  5  N TRP A 86  ? N TRP A 94  O GLN A 102 ? O GLN A 110 
AA1 5  6  N SER A 105 ? N SER A 113 O ILE A 112 ? O ILE A 120 
AA1 6  7  O TYR A 113 ? O TYR A 121 N LYS A 10  ? N LYS A 16  
AA1 7  8  N MET A 13  ? N MET A 19  O ILE A 24  ? O ILE A 30  
AA1 8  9  N GLU A 29  ? N GLU A 35  O THR A 38  ? O THR A 44  
AA1 9  10 N LEU A 41  ? N LEU A 47  O VAL A 204 ? O VAL A 212 
AA1 10 11 O ARG A 213 ? O ARG A 221 N ASN A 187 ? N ASN A 195 
AA1 11 12 O PHE A 186 ? O PHE A 194 N LEU A 143 ? N LEU A 151 
AA1 12 13 N ARG A 142 ? N ARG A 150 O ASP A 153 ? O ASP A 161 
# 
_pdbx_entry_details.entry_id                   8ZXH 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 PRO A 56  ? ? -89.29  34.98   
2 1 PHE A 73  ? ? -101.28 53.28   
3 1 ASP A 155 ? ? 54.66   -110.22 
# 
_pdbx_struct_special_symmetry.id              1 
_pdbx_struct_special_symmetry.PDB_model_num   1 
_pdbx_struct_special_symmetry.auth_asym_id    A 
_pdbx_struct_special_symmetry.auth_comp_id    HOH 
_pdbx_struct_special_symmetry.auth_seq_id     476 
_pdbx_struct_special_symmetry.PDB_ins_code    ? 
_pdbx_struct_special_symmetry.label_asym_id   B 
_pdbx_struct_special_symmetry.label_comp_id   HOH 
_pdbx_struct_special_symmetry.label_seq_id    . 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N N N 1   
ALA CA   C N S 2   
ALA C    C N N 3   
ALA O    O N N 4   
ALA CB   C N N 5   
ALA OXT  O N N 6   
ALA H    H N N 7   
ALA H2   H N N 8   
ALA HA   H N N 9   
ALA HB1  H N N 10  
ALA HB2  H N N 11  
ALA HB3  H N N 12  
ALA HXT  H N N 13  
ARG N    N N N 14  
ARG CA   C N S 15  
ARG C    C N N 16  
ARG O    O N N 17  
ARG CB   C N N 18  
ARG CG   C N N 19  
ARG CD   C N N 20  
ARG NE   N N N 21  
ARG CZ   C N N 22  
ARG NH1  N N N 23  
ARG NH2  N N N 24  
ARG OXT  O N N 25  
ARG H    H N N 26  
ARG H2   H N N 27  
ARG HA   H N N 28  
ARG HB2  H N N 29  
ARG HB3  H N N 30  
ARG HG2  H N N 31  
ARG HG3  H N N 32  
ARG HD2  H N N 33  
ARG HD3  H N N 34  
ARG HE   H N N 35  
ARG HH11 H N N 36  
ARG HH12 H N N 37  
ARG HH21 H N N 38  
ARG HH22 H N N 39  
ARG HXT  H N N 40  
ASN N    N N N 41  
ASN CA   C N S 42  
ASN C    C N N 43  
ASN O    O N N 44  
ASN CB   C N N 45  
ASN CG   C N N 46  
ASN OD1  O N N 47  
ASN ND2  N N N 48  
ASN OXT  O N N 49  
ASN H    H N N 50  
ASN H2   H N N 51  
ASN HA   H N N 52  
ASN HB2  H N N 53  
ASN HB3  H N N 54  
ASN HD21 H N N 55  
ASN HD22 H N N 56  
ASN HXT  H N N 57  
ASP N    N N N 58  
ASP CA   C N S 59  
ASP C    C N N 60  
ASP O    O N N 61  
ASP CB   C N N 62  
ASP CG   C N N 63  
ASP OD1  O N N 64  
ASP OD2  O N N 65  
ASP OXT  O N N 66  
ASP H    H N N 67  
ASP H2   H N N 68  
ASP HA   H N N 69  
ASP HB2  H N N 70  
ASP HB3  H N N 71  
ASP HD2  H N N 72  
ASP HXT  H N N 73  
GLN N    N N N 74  
GLN CA   C N S 75  
GLN C    C N N 76  
GLN O    O N N 77  
GLN CB   C N N 78  
GLN CG   C N N 79  
GLN CD   C N N 80  
GLN OE1  O N N 81  
GLN NE2  N N N 82  
GLN OXT  O N N 83  
GLN H    H N N 84  
GLN H2   H N N 85  
GLN HA   H N N 86  
GLN HB2  H N N 87  
GLN HB3  H N N 88  
GLN HG2  H N N 89  
GLN HG3  H N N 90  
GLN HE21 H N N 91  
GLN HE22 H N N 92  
GLN HXT  H N N 93  
GLU N    N N N 94  
GLU CA   C N S 95  
GLU C    C N N 96  
GLU O    O N N 97  
GLU CB   C N N 98  
GLU CG   C N N 99  
GLU CD   C N N 100 
GLU OE1  O N N 101 
GLU OE2  O N N 102 
GLU OXT  O N N 103 
GLU H    H N N 104 
GLU H2   H N N 105 
GLU HA   H N N 106 
GLU HB2  H N N 107 
GLU HB3  H N N 108 
GLU HG2  H N N 109 
GLU HG3  H N N 110 
GLU HE2  H N N 111 
GLU HXT  H N N 112 
GLY N    N N N 113 
GLY CA   C N N 114 
GLY C    C N N 115 
GLY O    O N N 116 
GLY OXT  O N N 117 
GLY H    H N N 118 
GLY H2   H N N 119 
GLY HA2  H N N 120 
GLY HA3  H N N 121 
GLY HXT  H N N 122 
HIS N    N N N 123 
HIS CA   C N S 124 
HIS C    C N N 125 
HIS O    O N N 126 
HIS CB   C N N 127 
HIS CG   C Y N 128 
HIS ND1  N Y N 129 
HIS CD2  C Y N 130 
HIS CE1  C Y N 131 
HIS NE2  N Y N 132 
HIS OXT  O N N 133 
HIS H    H N N 134 
HIS H2   H N N 135 
HIS HA   H N N 136 
HIS HB2  H N N 137 
HIS HB3  H N N 138 
HIS HD1  H N N 139 
HIS HD2  H N N 140 
HIS HE1  H N N 141 
HIS HE2  H N N 142 
HIS HXT  H N N 143 
HOH O    O N N 144 
HOH H1   H N N 145 
HOH H2   H N N 146 
ILE N    N N N 147 
ILE CA   C N S 148 
ILE C    C N N 149 
ILE O    O N N 150 
ILE CB   C N S 151 
ILE CG1  C N N 152 
ILE CG2  C N N 153 
ILE CD1  C N N 154 
ILE OXT  O N N 155 
ILE H    H N N 156 
ILE H2   H N N 157 
ILE HA   H N N 158 
ILE HB   H N N 159 
ILE HG12 H N N 160 
ILE HG13 H N N 161 
ILE HG21 H N N 162 
ILE HG22 H N N 163 
ILE HG23 H N N 164 
ILE HD11 H N N 165 
ILE HD12 H N N 166 
ILE HD13 H N N 167 
ILE HXT  H N N 168 
LEU N    N N N 169 
LEU CA   C N S 170 
LEU C    C N N 171 
LEU O    O N N 172 
LEU CB   C N N 173 
LEU CG   C N N 174 
LEU CD1  C N N 175 
LEU CD2  C N N 176 
LEU OXT  O N N 177 
LEU H    H N N 178 
LEU H2   H N N 179 
LEU HA   H N N 180 
LEU HB2  H N N 181 
LEU HB3  H N N 182 
LEU HG   H N N 183 
LEU HD11 H N N 184 
LEU HD12 H N N 185 
LEU HD13 H N N 186 
LEU HD21 H N N 187 
LEU HD22 H N N 188 
LEU HD23 H N N 189 
LEU HXT  H N N 190 
LYS N    N N N 191 
LYS CA   C N S 192 
LYS C    C N N 193 
LYS O    O N N 194 
LYS CB   C N N 195 
LYS CG   C N N 196 
LYS CD   C N N 197 
LYS CE   C N N 198 
LYS NZ   N N N 199 
LYS OXT  O N N 200 
LYS H    H N N 201 
LYS H2   H N N 202 
LYS HA   H N N 203 
LYS HB2  H N N 204 
LYS HB3  H N N 205 
LYS HG2  H N N 206 
LYS HG3  H N N 207 
LYS HD2  H N N 208 
LYS HD3  H N N 209 
LYS HE2  H N N 210 
LYS HE3  H N N 211 
LYS HZ1  H N N 212 
LYS HZ2  H N N 213 
LYS HZ3  H N N 214 
LYS HXT  H N N 215 
MET N    N N N 216 
MET CA   C N S 217 
MET C    C N N 218 
MET O    O N N 219 
MET CB   C N N 220 
MET CG   C N N 221 
MET SD   S N N 222 
MET CE   C N N 223 
MET OXT  O N N 224 
MET H    H N N 225 
MET H2   H N N 226 
MET HA   H N N 227 
MET HB2  H N N 228 
MET HB3  H N N 229 
MET HG2  H N N 230 
MET HG3  H N N 231 
MET HE1  H N N 232 
MET HE2  H N N 233 
MET HE3  H N N 234 
MET HXT  H N N 235 
NRQ N1   N N N 236 
NRQ CE   C N N 237 
NRQ SD   S N N 238 
NRQ CG1  C N N 239 
NRQ CB1  C N N 240 
NRQ CA1  C N N 241 
NRQ C1   C N N 242 
NRQ N2   N N N 243 
NRQ OH   O N N 244 
NRQ CD2  C Y N 245 
NRQ CE2  C Y N 246 
NRQ CZ   C Y N 247 
NRQ CE1  C Y N 248 
NRQ CD1  C Y N 249 
NRQ CG2  C Y N 250 
NRQ CB2  C N N 251 
NRQ CA2  C N N 252 
NRQ C2   C N N 253 
NRQ O2   O N N 254 
NRQ N3   N N N 255 
NRQ CA3  C N N 256 
NRQ C3   C N N 257 
NRQ O3   O N N 258 
NRQ OXT  O N N 259 
NRQ H    H N N 260 
NRQ HE1A H N N 261 
NRQ HE2A H N N 262 
NRQ HE3  H N N 263 
NRQ HG11 H N N 264 
NRQ HG12 H N N 265 
NRQ HB11 H N N 266 
NRQ HB12 H N N 267 
NRQ HOH  H N N 268 
NRQ HD2  H N N 269 
NRQ HE2  H N N 270 
NRQ HE1  H N N 271 
NRQ HD1  H N N 272 
NRQ HB2  H N N 273 
NRQ HA31 H N N 274 
NRQ HA32 H N N 275 
NRQ HXT  H N N 276 
PHE N    N N N 277 
PHE CA   C N S 278 
PHE C    C N N 279 
PHE O    O N N 280 
PHE CB   C N N 281 
PHE CG   C Y N 282 
PHE CD1  C Y N 283 
PHE CD2  C Y N 284 
PHE CE1  C Y N 285 
PHE CE2  C Y N 286 
PHE CZ   C Y N 287 
PHE OXT  O N N 288 
PHE H    H N N 289 
PHE H2   H N N 290 
PHE HA   H N N 291 
PHE HB2  H N N 292 
PHE HB3  H N N 293 
PHE HD1  H N N 294 
PHE HD2  H N N 295 
PHE HE1  H N N 296 
PHE HE2  H N N 297 
PHE HZ   H N N 298 
PHE HXT  H N N 299 
PRO N    N N N 300 
PRO CA   C N S 301 
PRO C    C N N 302 
PRO O    O N N 303 
PRO CB   C N N 304 
PRO CG   C N N 305 
PRO CD   C N N 306 
PRO OXT  O N N 307 
PRO H    H N N 308 
PRO HA   H N N 309 
PRO HB2  H N N 310 
PRO HB3  H N N 311 
PRO HG2  H N N 312 
PRO HG3  H N N 313 
PRO HD2  H N N 314 
PRO HD3  H N N 315 
PRO HXT  H N N 316 
SER N    N N N 317 
SER CA   C N S 318 
SER C    C N N 319 
SER O    O N N 320 
SER CB   C N N 321 
SER OG   O N N 322 
SER OXT  O N N 323 
SER H    H N N 324 
SER H2   H N N 325 
SER HA   H N N 326 
SER HB2  H N N 327 
SER HB3  H N N 328 
SER HG   H N N 329 
SER HXT  H N N 330 
THR N    N N N 331 
THR CA   C N S 332 
THR C    C N N 333 
THR O    O N N 334 
THR CB   C N R 335 
THR OG1  O N N 336 
THR CG2  C N N 337 
THR OXT  O N N 338 
THR H    H N N 339 
THR H2   H N N 340 
THR HA   H N N 341 
THR HB   H N N 342 
THR HG1  H N N 343 
THR HG21 H N N 344 
THR HG22 H N N 345 
THR HG23 H N N 346 
THR HXT  H N N 347 
TRP N    N N N 348 
TRP CA   C N S 349 
TRP C    C N N 350 
TRP O    O N N 351 
TRP CB   C N N 352 
TRP CG   C Y N 353 
TRP CD1  C Y N 354 
TRP CD2  C Y N 355 
TRP NE1  N Y N 356 
TRP CE2  C Y N 357 
TRP CE3  C Y N 358 
TRP CZ2  C Y N 359 
TRP CZ3  C Y N 360 
TRP CH2  C Y N 361 
TRP OXT  O N N 362 
TRP H    H N N 363 
TRP H2   H N N 364 
TRP HA   H N N 365 
TRP HB2  H N N 366 
TRP HB3  H N N 367 
TRP HD1  H N N 368 
TRP HE1  H N N 369 
TRP HE3  H N N 370 
TRP HZ2  H N N 371 
TRP HZ3  H N N 372 
TRP HH2  H N N 373 
TRP HXT  H N N 374 
TYR N    N N N 375 
TYR CA   C N S 376 
TYR C    C N N 377 
TYR O    O N N 378 
TYR CB   C N N 379 
TYR CG   C Y N 380 
TYR CD1  C Y N 381 
TYR CD2  C Y N 382 
TYR CE1  C Y N 383 
TYR CE2  C Y N 384 
TYR CZ   C Y N 385 
TYR OH   O N N 386 
TYR OXT  O N N 387 
TYR H    H N N 388 
TYR H2   H N N 389 
TYR HA   H N N 390 
TYR HB2  H N N 391 
TYR HB3  H N N 392 
TYR HD1  H N N 393 
TYR HD2  H N N 394 
TYR HE1  H N N 395 
TYR HE2  H N N 396 
TYR HH   H N N 397 
TYR HXT  H N N 398 
VAL N    N N N 399 
VAL CA   C N S 400 
VAL C    C N N 401 
VAL O    O N N 402 
VAL CB   C N N 403 
VAL CG1  C N N 404 
VAL CG2  C N N 405 
VAL OXT  O N N 406 
VAL H    H N N 407 
VAL H2   H N N 408 
VAL HA   H N N 409 
VAL HB   H N N 410 
VAL HG11 H N N 411 
VAL HG12 H N N 412 
VAL HG13 H N N 413 
VAL HG21 H N N 414 
VAL HG22 H N N 415 
VAL HG23 H N N 416 
VAL HXT  H N N 417 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
GLN N   CA   sing N N 70  
GLN N   H    sing N N 71  
GLN N   H2   sing N N 72  
GLN CA  C    sing N N 73  
GLN CA  CB   sing N N 74  
GLN CA  HA   sing N N 75  
GLN C   O    doub N N 76  
GLN C   OXT  sing N N 77  
GLN CB  CG   sing N N 78  
GLN CB  HB2  sing N N 79  
GLN CB  HB3  sing N N 80  
GLN CG  CD   sing N N 81  
GLN CG  HG2  sing N N 82  
GLN CG  HG3  sing N N 83  
GLN CD  OE1  doub N N 84  
GLN CD  NE2  sing N N 85  
GLN NE2 HE21 sing N N 86  
GLN NE2 HE22 sing N N 87  
GLN OXT HXT  sing N N 88  
GLU N   CA   sing N N 89  
GLU N   H    sing N N 90  
GLU N   H2   sing N N 91  
GLU CA  C    sing N N 92  
GLU CA  CB   sing N N 93  
GLU CA  HA   sing N N 94  
GLU C   O    doub N N 95  
GLU C   OXT  sing N N 96  
GLU CB  CG   sing N N 97  
GLU CB  HB2  sing N N 98  
GLU CB  HB3  sing N N 99  
GLU CG  CD   sing N N 100 
GLU CG  HG2  sing N N 101 
GLU CG  HG3  sing N N 102 
GLU CD  OE1  doub N N 103 
GLU CD  OE2  sing N N 104 
GLU OE2 HE2  sing N N 105 
GLU OXT HXT  sing N N 106 
GLY N   CA   sing N N 107 
GLY N   H    sing N N 108 
GLY N   H2   sing N N 109 
GLY CA  C    sing N N 110 
GLY CA  HA2  sing N N 111 
GLY CA  HA3  sing N N 112 
GLY C   O    doub N N 113 
GLY C   OXT  sing N N 114 
GLY OXT HXT  sing N N 115 
HIS N   CA   sing N N 116 
HIS N   H    sing N N 117 
HIS N   H2   sing N N 118 
HIS CA  C    sing N N 119 
HIS CA  CB   sing N N 120 
HIS CA  HA   sing N N 121 
HIS C   O    doub N N 122 
HIS C   OXT  sing N N 123 
HIS CB  CG   sing N N 124 
HIS CB  HB2  sing N N 125 
HIS CB  HB3  sing N N 126 
HIS CG  ND1  sing Y N 127 
HIS CG  CD2  doub Y N 128 
HIS ND1 CE1  doub Y N 129 
HIS ND1 HD1  sing N N 130 
HIS CD2 NE2  sing Y N 131 
HIS CD2 HD2  sing N N 132 
HIS CE1 NE2  sing Y N 133 
HIS CE1 HE1  sing N N 134 
HIS NE2 HE2  sing N N 135 
HIS OXT HXT  sing N N 136 
HOH O   H1   sing N N 137 
HOH O   H2   sing N N 138 
ILE N   CA   sing N N 139 
ILE N   H    sing N N 140 
ILE N   H2   sing N N 141 
ILE CA  C    sing N N 142 
ILE CA  CB   sing N N 143 
ILE CA  HA   sing N N 144 
ILE C   O    doub N N 145 
ILE C   OXT  sing N N 146 
ILE CB  CG1  sing N N 147 
ILE CB  CG2  sing N N 148 
ILE CB  HB   sing N N 149 
ILE CG1 CD1  sing N N 150 
ILE CG1 HG12 sing N N 151 
ILE CG1 HG13 sing N N 152 
ILE CG2 HG21 sing N N 153 
ILE CG2 HG22 sing N N 154 
ILE CG2 HG23 sing N N 155 
ILE CD1 HD11 sing N N 156 
ILE CD1 HD12 sing N N 157 
ILE CD1 HD13 sing N N 158 
ILE OXT HXT  sing N N 159 
LEU N   CA   sing N N 160 
LEU N   H    sing N N 161 
LEU N   H2   sing N N 162 
LEU CA  C    sing N N 163 
LEU CA  CB   sing N N 164 
LEU CA  HA   sing N N 165 
LEU C   O    doub N N 166 
LEU C   OXT  sing N N 167 
LEU CB  CG   sing N N 168 
LEU CB  HB2  sing N N 169 
LEU CB  HB3  sing N N 170 
LEU CG  CD1  sing N N 171 
LEU CG  CD2  sing N N 172 
LEU CG  HG   sing N N 173 
LEU CD1 HD11 sing N N 174 
LEU CD1 HD12 sing N N 175 
LEU CD1 HD13 sing N N 176 
LEU CD2 HD21 sing N N 177 
LEU CD2 HD22 sing N N 178 
LEU CD2 HD23 sing N N 179 
LEU OXT HXT  sing N N 180 
LYS N   CA   sing N N 181 
LYS N   H    sing N N 182 
LYS N   H2   sing N N 183 
LYS CA  C    sing N N 184 
LYS CA  CB   sing N N 185 
LYS CA  HA   sing N N 186 
LYS C   O    doub N N 187 
LYS C   OXT  sing N N 188 
LYS CB  CG   sing N N 189 
LYS CB  HB2  sing N N 190 
LYS CB  HB3  sing N N 191 
LYS CG  CD   sing N N 192 
LYS CG  HG2  sing N N 193 
LYS CG  HG3  sing N N 194 
LYS CD  CE   sing N N 195 
LYS CD  HD2  sing N N 196 
LYS CD  HD3  sing N N 197 
LYS CE  NZ   sing N N 198 
LYS CE  HE2  sing N N 199 
LYS CE  HE3  sing N N 200 
LYS NZ  HZ1  sing N N 201 
LYS NZ  HZ2  sing N N 202 
LYS NZ  HZ3  sing N N 203 
LYS OXT HXT  sing N N 204 
MET N   CA   sing N N 205 
MET N   H    sing N N 206 
MET N   H2   sing N N 207 
MET CA  C    sing N N 208 
MET CA  CB   sing N N 209 
MET CA  HA   sing N N 210 
MET C   O    doub N N 211 
MET C   OXT  sing N N 212 
MET CB  CG   sing N N 213 
MET CB  HB2  sing N N 214 
MET CB  HB3  sing N N 215 
MET CG  SD   sing N N 216 
MET CG  HG2  sing N N 217 
MET CG  HG3  sing N N 218 
MET SD  CE   sing N N 219 
MET CE  HE1  sing N N 220 
MET CE  HE2  sing N N 221 
MET CE  HE3  sing N N 222 
MET OXT HXT  sing N N 223 
NRQ OXT C3   sing N N 224 
NRQ CE  SD   sing N N 225 
NRQ SD  CG1  sing N N 226 
NRQ CG1 CB1  sing N N 227 
NRQ C3  O3   doub N N 228 
NRQ C3  CA3  sing N N 229 
NRQ O2  C2   doub N N 230 
NRQ C2  CA2  sing N N 231 
NRQ C2  N3   sing N N 232 
NRQ CA2 CB2  doub N N 233 
NRQ CA2 N2   sing N N 234 
NRQ CB2 CG2  sing N N 235 
NRQ CD2 CG2  doub Y N 236 
NRQ CD2 CE2  sing Y N 237 
NRQ N3  C1   sing N N 238 
NRQ N3  CA3  sing N N 239 
NRQ CG2 CD1  sing Y N 240 
NRQ CE2 CZ   doub Y N 241 
NRQ N2  C1   doub N N 242 
NRQ C1  CA1  sing N N 243 
NRQ CZ  OH   sing N N 244 
NRQ CZ  CE1  sing Y N 245 
NRQ CA1 CB1  sing N N 246 
NRQ CA1 N1   doub N N 247 
NRQ CD1 CE1  doub Y N 248 
NRQ N1  H    sing N N 249 
NRQ CE  HE1A sing N N 250 
NRQ CE  HE2A sing N N 251 
NRQ CE  HE3  sing N N 252 
NRQ CG1 HG11 sing N Z 253 
NRQ CG1 HG12 sing N N 254 
NRQ CB1 HB11 sing N N 255 
NRQ CB1 HB12 sing N N 256 
NRQ OH  HOH  sing N N 257 
NRQ CD2 HD2  sing N N 258 
NRQ CE2 HE2  sing N N 259 
NRQ CE1 HE1  sing N N 260 
NRQ CD1 HD1  sing N N 261 
NRQ CB2 HB2  sing N N 262 
NRQ CA3 HA31 sing N N 263 
NRQ CA3 HA32 sing N N 264 
NRQ OXT HXT  sing N N 265 
PHE N   CA   sing N N 266 
PHE N   H    sing N N 267 
PHE N   H2   sing N N 268 
PHE CA  C    sing N N 269 
PHE CA  CB   sing N N 270 
PHE CA  HA   sing N N 271 
PHE C   O    doub N N 272 
PHE C   OXT  sing N N 273 
PHE CB  CG   sing N N 274 
PHE CB  HB2  sing N N 275 
PHE CB  HB3  sing N N 276 
PHE CG  CD1  doub Y N 277 
PHE CG  CD2  sing Y N 278 
PHE CD1 CE1  sing Y N 279 
PHE CD1 HD1  sing N N 280 
PHE CD2 CE2  doub Y N 281 
PHE CD2 HD2  sing N N 282 
PHE CE1 CZ   doub Y N 283 
PHE CE1 HE1  sing N N 284 
PHE CE2 CZ   sing Y N 285 
PHE CE2 HE2  sing N N 286 
PHE CZ  HZ   sing N N 287 
PHE OXT HXT  sing N N 288 
PRO N   CA   sing N N 289 
PRO N   CD   sing N N 290 
PRO N   H    sing N N 291 
PRO CA  C    sing N N 292 
PRO CA  CB   sing N N 293 
PRO CA  HA   sing N N 294 
PRO C   O    doub N N 295 
PRO C   OXT  sing N N 296 
PRO CB  CG   sing N N 297 
PRO CB  HB2  sing N N 298 
PRO CB  HB3  sing N N 299 
PRO CG  CD   sing N N 300 
PRO CG  HG2  sing N N 301 
PRO CG  HG3  sing N N 302 
PRO CD  HD2  sing N N 303 
PRO CD  HD3  sing N N 304 
PRO OXT HXT  sing N N 305 
SER N   CA   sing N N 306 
SER N   H    sing N N 307 
SER N   H2   sing N N 308 
SER CA  C    sing N N 309 
SER CA  CB   sing N N 310 
SER CA  HA   sing N N 311 
SER C   O    doub N N 312 
SER C   OXT  sing N N 313 
SER CB  OG   sing N N 314 
SER CB  HB2  sing N N 315 
SER CB  HB3  sing N N 316 
SER OG  HG   sing N N 317 
SER OXT HXT  sing N N 318 
THR N   CA   sing N N 319 
THR N   H    sing N N 320 
THR N   H2   sing N N 321 
THR CA  C    sing N N 322 
THR CA  CB   sing N N 323 
THR CA  HA   sing N N 324 
THR C   O    doub N N 325 
THR C   OXT  sing N N 326 
THR CB  OG1  sing N N 327 
THR CB  CG2  sing N N 328 
THR CB  HB   sing N N 329 
THR OG1 HG1  sing N N 330 
THR CG2 HG21 sing N N 331 
THR CG2 HG22 sing N N 332 
THR CG2 HG23 sing N N 333 
THR OXT HXT  sing N N 334 
TRP N   CA   sing N N 335 
TRP N   H    sing N N 336 
TRP N   H2   sing N N 337 
TRP CA  C    sing N N 338 
TRP CA  CB   sing N N 339 
TRP CA  HA   sing N N 340 
TRP C   O    doub N N 341 
TRP C   OXT  sing N N 342 
TRP CB  CG   sing N N 343 
TRP CB  HB2  sing N N 344 
TRP CB  HB3  sing N N 345 
TRP CG  CD1  doub Y N 346 
TRP CG  CD2  sing Y N 347 
TRP CD1 NE1  sing Y N 348 
TRP CD1 HD1  sing N N 349 
TRP CD2 CE2  doub Y N 350 
TRP CD2 CE3  sing Y N 351 
TRP NE1 CE2  sing Y N 352 
TRP NE1 HE1  sing N N 353 
TRP CE2 CZ2  sing Y N 354 
TRP CE3 CZ3  doub Y N 355 
TRP CE3 HE3  sing N N 356 
TRP CZ2 CH2  doub Y N 357 
TRP CZ2 HZ2  sing N N 358 
TRP CZ3 CH2  sing Y N 359 
TRP CZ3 HZ3  sing N N 360 
TRP CH2 HH2  sing N N 361 
TRP OXT HXT  sing N N 362 
TYR N   CA   sing N N 363 
TYR N   H    sing N N 364 
TYR N   H2   sing N N 365 
TYR CA  C    sing N N 366 
TYR CA  CB   sing N N 367 
TYR CA  HA   sing N N 368 
TYR C   O    doub N N 369 
TYR C   OXT  sing N N 370 
TYR CB  CG   sing N N 371 
TYR CB  HB2  sing N N 372 
TYR CB  HB3  sing N N 373 
TYR CG  CD1  doub Y N 374 
TYR CG  CD2  sing Y N 375 
TYR CD1 CE1  sing Y N 376 
TYR CD1 HD1  sing N N 377 
TYR CD2 CE2  doub Y N 378 
TYR CD2 HD2  sing N N 379 
TYR CE1 CZ   doub Y N 380 
TYR CE1 HE1  sing N N 381 
TYR CE2 CZ   sing Y N 382 
TYR CE2 HE2  sing N N 383 
TYR CZ  OH   sing N N 384 
TYR OH  HH   sing N N 385 
TYR OXT HXT  sing N N 386 
VAL N   CA   sing N N 387 
VAL N   H    sing N N 388 
VAL N   H2   sing N N 389 
VAL CA  C    sing N N 390 
VAL CA  CB   sing N N 391 
VAL CA  HA   sing N N 392 
VAL C   O    doub N N 393 
VAL C   OXT  sing N N 394 
VAL CB  CG1  sing N N 395 
VAL CB  CG2  sing N N 396 
VAL CB  HB   sing N N 397 
VAL CG1 HG11 sing N N 398 
VAL CG1 HG12 sing N N 399 
VAL CG1 HG13 sing N N 400 
VAL CG2 HG21 sing N N 401 
VAL CG2 HG22 sing N N 402 
VAL CG2 HG23 sing N N 403 
VAL OXT HXT  sing N N 404 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'National Natural Science Foundation of China (NSFC)' China 32201235   1 
'Other government'                                    China 2022J01287 2 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   7ZCT 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    8ZXH 
_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]   0.011832 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.004194 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.028177 
_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]   0.012386 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C 
N 
O 
S 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N N   . ALA A 1 1   ? 19.707  3.870   44.003 1.00 40.03 ? 7   ALA A N   1 
ATOM   2    C CA  . ALA A 1 1   ? 19.284  3.838   42.607 1.00 38.35 ? 7   ALA A CA  1 
ATOM   3    C C   . ALA A 1 1   ? 17.779  3.627   42.500 1.00 35.67 ? 7   ALA A C   1 
ATOM   4    O O   . ALA A 1 1   ? 17.229  2.684   43.055 1.00 33.19 ? 7   ALA A O   1 
ATOM   5    C CB  . ALA A 1 1   ? 20.032  2.756   41.841 1.00 39.23 ? 7   ALA A CB  1 
ATOM   6    N N   . VAL A 1 2   ? 17.124  4.523   41.764 1.00 29.93 ? 8   VAL A N   1 
ATOM   7    C CA  . VAL A 1 2   ? 15.669  4.531   41.703 1.00 27.46 ? 8   VAL A CA  1 
ATOM   8    C C   . VAL A 1 2   ? 15.161  3.369   40.851 1.00 24.84 ? 8   VAL A C   1 
ATOM   9    O O   . VAL A 1 2   ? 14.207  2.670   41.219 1.00 25.88 ? 8   VAL A O   1 
ATOM   10   C CB  . VAL A 1 2   ? 15.197  5.898   41.178 1.00 29.57 ? 8   VAL A CB  1 
ATOM   11   C CG1 . VAL A 1 2   ? 13.732  5.892   40.921 1.00 28.92 ? 8   VAL A CG1 1 
ATOM   12   C CG2 . VAL A 1 2   ? 15.579  7.001   42.172 1.00 29.18 ? 8   VAL A CG2 1 
ATOM   13   N N   . ILE A 1 3   ? 15.782  3.156   39.696 1.00 22.39 ? 9   ILE A N   1 
ATOM   14   C CA  . ILE A 1 3   ? 15.457  2.023   38.832 1.00 20.69 ? 9   ILE A CA  1 
ATOM   15   C C   . ILE A 1 3   ? 16.189  0.806   39.388 1.00 21.75 ? 9   ILE A C   1 
ATOM   16   O O   . ILE A 1 3   ? 17.420  0.751   39.366 1.00 23.51 ? 9   ILE A O   1 
ATOM   17   C CB  . ILE A 1 3   ? 15.861  2.299   37.379 1.00 22.27 ? 9   ILE A CB  1 
ATOM   18   C CG1 . ILE A 1 3   ? 15.027  3.443   36.787 1.00 20.69 ? 9   ILE A CG1 1 
ATOM   19   C CG2 . ILE A 1 3   ? 15.695  1.054   36.529 1.00 19.76 ? 9   ILE A CG2 1 
ATOM   20   C CD1 . ILE A 1 3   ? 13.503  3.277   36.927 1.00 20.12 ? 9   ILE A CD1 1 
ATOM   21   N N   . LYS A 1 4   ? 15.435  -0.160  39.897 1.00 21.19 ? 10  LYS A N   1 
ATOM   22   C CA  . LYS A 1 4   ? 16.005  -1.347  40.514 1.00 20.27 ? 10  LYS A CA  1 
ATOM   23   C C   . LYS A 1 4   ? 16.286  -2.426  39.474 1.00 20.83 ? 10  LYS A C   1 
ATOM   24   O O   . LYS A 1 4   ? 15.916  -2.321  38.303 1.00 19.99 ? 10  LYS A O   1 
ATOM   25   C CB  . LYS A 1 4   ? 15.069  -1.909  41.583 1.00 22.08 ? 10  LYS A CB  1 
ATOM   26   C CG  . LYS A 1 4   ? 14.503  -0.882  42.542 1.00 24.39 ? 10  LYS A CG  1 
ATOM   27   C CD  . LYS A 1 4   ? 15.584  -0.194  43.344 1.00 29.19 ? 10  LYS A CD  1 
ATOM   28   C CE  . LYS A 1 4   ? 14.961  0.689   44.413 1.00 34.32 ? 10  LYS A CE  1 
ATOM   29   N NZ  . LYS A 1 4   ? 15.992  1.468   45.155 1.00 38.86 ? 10  LYS A NZ  1 
ATOM   30   N N   . GLU A 1 5   ? 16.956  -3.485  39.931 1.00 20.68 ? 11  GLU A N   1 
ATOM   31   C CA  . GLU A 1 5   ? 17.343  -4.570  39.036 1.00 20.12 ? 11  GLU A CA  1 
ATOM   32   C C   . GLU A 1 5   ? 16.134  -5.300  38.473 1.00 18.69 ? 11  GLU A C   1 
ATOM   33   O O   . GLU A 1 5   ? 16.222  -5.903  37.401 1.00 20.43 ? 11  GLU A O   1 
ATOM   34   C CB  . GLU A 1 5   ? 18.267  -5.544  39.763 1.00 24.03 ? 11  GLU A CB  1 
ATOM   35   C CG  . GLU A 1 5   ? 19.533  -4.883  40.289 1.00 33.56 ? 11  GLU A CG  1 
ATOM   36   C CD  . GLU A 1 5   ? 20.784  -5.559  39.787 1.00 42.45 ? 11  GLU A CD  1 
ATOM   37   O OE1 . GLU A 1 5   ? 21.078  -6.673  40.267 1.00 48.57 ? 11  GLU A OE1 1 
ATOM   38   O OE2 . GLU A 1 5   ? 21.471  -4.974  38.916 1.00 46.59 ? 11  GLU A OE2 1 
ATOM   39   N N   . PHE A 1 6   ? 15.014  -5.278  39.186 1.00 18.09 ? 12  PHE A N   1 
ATOM   40   C CA  . PHE A 1 6   ? 13.743  -5.775  38.687 1.00 18.43 ? 12  PHE A CA  1 
ATOM   41   C C   . PHE A 1 6   ? 12.746  -4.642  38.816 1.00 19.51 ? 12  PHE A C   1 
ATOM   42   O O   . PHE A 1 6   ? 12.689  -3.980  39.857 1.00 21.19 ? 12  PHE A O   1 
ATOM   43   C CB  . PHE A 1 6   ? 13.249  -6.973  39.498 1.00 19.11 ? 12  PHE A CB  1 
ATOM   44   C CG  . PHE A 1 6   ? 11.876  -7.442  39.090 1.00 19.33 ? 12  PHE A CG  1 
ATOM   45   C CD1 . PHE A 1 6   ? 11.706  -8.227  37.964 1.00 19.39 ? 12  PHE A CD1 1 
ATOM   46   C CD2 . PHE A 1 6   ? 10.756  -7.093  39.832 1.00 21.30 ? 12  PHE A CD2 1 
ATOM   47   C CE1 . PHE A 1 6   ? 10.430  -8.661  37.574 1.00 18.71 ? 12  PHE A CE1 1 
ATOM   48   C CE2 . PHE A 1 6   ? 9.488   -7.522  39.444 1.00 21.11 ? 12  PHE A CE2 1 
ATOM   49   C CZ  . PHE A 1 6   ? 9.339   -8.301  38.315 1.00 19.64 ? 12  PHE A CZ  1 
ATOM   50   N N   . MET A 1 7   ? 11.963  -4.412  37.767 1.00 17.53 ? 13  MET A N   1 
ATOM   51   C CA  . MET A 1 7   ? 10.962  -3.362  37.803 1.00 16.95 ? 13  MET A CA  1 
ATOM   52   C C   . MET A 1 7   ? 9.719   -3.842  37.079 1.00 17.30 ? 13  MET A C   1 
ATOM   53   O O   . MET A 1 7   ? 9.803   -4.626  36.132 1.00 17.10 ? 13  MET A O   1 
ATOM   54   C CB  . MET A 1 7   ? 11.426  -2.080  37.093 1.00 18.87 ? 13  MET A CB  1 
ATOM   55   C CG  . MET A 1 7   ? 12.557  -1.315  37.782 1.00 18.03 ? 13  MET A CG  1 
ATOM   56   S SD  . MET A 1 7   ? 12.079  -0.654  39.393 1.00 19.84 ? 13  MET A SD  1 
ATOM   57   C CE  . MET A 1 7   ? 10.914  0.621   38.903 1.00 21.42 ? 13  MET A CE  1 
ATOM   58   N N   . ARG A 1 8   ? 8.569   -3.355  37.537 1.00 18.29 ? 14  ARG A N   1 
ATOM   59   C CA  . ARG A 1 8   ? 7.295   -3.570  36.873 1.00 16.76 ? 14  ARG A CA  1 
ATOM   60   C C   . ARG A 1 8   ? 6.769   -2.256  36.317 1.00 16.28 ? 14  ARG A C   1 
ATOM   61   O O   . ARG A 1 8   ? 7.148   -1.166  36.762 1.00 15.79 ? 14  ARG A O   1 
ATOM   62   C CB  . ARG A 1 8   ? 6.254   -4.125  37.851 1.00 18.77 ? 14  ARG A CB  1 
ATOM   63   C CG  . ARG A 1 8   ? 6.583   -5.491  38.345 1.00 17.66 ? 14  ARG A CG  1 
ATOM   64   C CD  . ARG A 1 8   ? 5.433   -6.110  39.117 1.00 18.17 ? 14  ARG A CD  1 
ATOM   65   N NE  . ARG A 1 8   ? 5.602   -7.551  39.137 1.00 19.79 ? 14  ARG A NE  1 
ATOM   66   C CZ  . ARG A 1 8   ? 5.197   -8.359  38.174 1.00 20.67 ? 14  ARG A CZ  1 
ATOM   67   N NH1 . ARG A 1 8   ? 4.522   -7.904  37.133 1.00 21.22 ? 14  ARG A NH1 1 
ATOM   68   N NH2 . ARG A 1 8   ? 5.495   -9.653  38.246 1.00 26.26 ? 14  ARG A NH2 1 
ATOM   69   N N   . PHE A 1 9   ? 5.868   -2.371  35.343 1.00 15.15 ? 15  PHE A N   1 
ATOM   70   C CA  . PHE A 1 9   ? 5.162   -1.214  34.811 1.00 14.62 ? 15  PHE A CA  1 
ATOM   71   C C   . PHE A 1 9   ? 3.693   -1.540  34.587 1.00 15.38 ? 15  PHE A C   1 
ATOM   72   O O   . PHE A 1 9   ? 3.300   -2.704  34.465 1.00 17.09 ? 15  PHE A O   1 
ATOM   73   C CB  . PHE A 1 9   ? 5.804   -0.635  33.530 1.00 16.58 ? 15  PHE A CB  1 
ATOM   74   C CG  . PHE A 1 9   ? 5.799   -1.559  32.329 1.00 16.41 ? 15  PHE A CG  1 
ATOM   75   C CD1 . PHE A 1 9   ? 4.700   -1.619  31.475 1.00 19.38 ? 15  PHE A CD1 1 
ATOM   76   C CD2 . PHE A 1 9   ? 6.922   -2.312  32.022 1.00 17.72 ? 15  PHE A CD2 1 
ATOM   77   C CE1 . PHE A 1 9   ? 4.718   -2.434  30.354 1.00 20.91 ? 15  PHE A CE1 1 
ATOM   78   C CE2 . PHE A 1 9   ? 6.946   -3.123  30.893 1.00 20.27 ? 15  PHE A CE2 1 
ATOM   79   C CZ  . PHE A 1 9   ? 5.837   -3.187  30.067 1.00 21.33 ? 15  PHE A CZ  1 
ATOM   80   N N   . LYS A 1 10  ? 2.884   -0.477  34.546 1.00 16.91 ? 16  LYS A N   1 
ATOM   81   C CA  . LYS A 1 10  ? 1.492   -0.541  34.119 1.00 16.25 ? 16  LYS A CA  1 
ATOM   82   C C   . LYS A 1 10  ? 1.328   0.410   32.948 1.00 18.29 ? 16  LYS A C   1 
ATOM   83   O O   . LYS A 1 10  ? 1.923   1.492   32.938 1.00 19.99 ? 16  LYS A O   1 
ATOM   84   C CB  . LYS A 1 10  ? 0.552   -0.100  35.251 1.00 22.03 ? 16  LYS A CB  1 
ATOM   85   C CG  . LYS A 1 10  ? 0.521   -1.030  36.436 1.00 22.87 ? 16  LYS A CG  1 
ATOM   86   C CD  . LYS A 1 10  ? -0.094  -0.353  37.670 1.00 27.81 ? 16  LYS A CD  1 
ATOM   87   C CE  . LYS A 1 10  ? -1.436  0.279   37.373 1.00 35.42 ? 16  LYS A CE  1 
ATOM   88   N NZ  . LYS A 1 10  ? -2.375  -0.673  36.714 1.00 41.85 ? 16  LYS A NZ  1 
ATOM   89   N N   . VAL A 1 11  ? 0.533   0.024   31.951 1.00 16.38 ? 17  VAL A N   1 
ATOM   90   C CA  . VAL A 1 11  ? 0.349   0.866   30.779 1.00 17.12 ? 17  VAL A CA  1 
ATOM   91   C C   . VAL A 1 11  ? -1.130  1.003   30.448 1.00 17.89 ? 17  VAL A C   1 
ATOM   92   O O   . VAL A 1 11  ? -1.905  0.043   30.566 1.00 18.03 ? 17  VAL A O   1 
ATOM   93   C CB  . VAL A 1 11  ? 1.170   0.349   29.577 1.00 18.50 ? 17  VAL A CB  1 
ATOM   94   C CG1 . VAL A 1 11  ? 0.789   -1.100  29.243 1.00 18.81 ? 17  VAL A CG1 1 
ATOM   95   C CG2 . VAL A 1 11  ? 0.997   1.257   28.367 1.00 18.81 ? 17  VAL A CG2 1 
ATOM   96   N N   . HIS A 1 12  ? -1.517  2.207   30.039 1.00 17.30 ? 18  HIS A N   1 
ATOM   97   C CA  . HIS A 1 12  ? -2.842  2.484   29.517 1.00 18.02 ? 18  HIS A CA  1 
ATOM   98   C C   . HIS A 1 12  ? -2.661  3.205   28.195 1.00 16.81 ? 18  HIS A C   1 
ATOM   99   O O   . HIS A 1 12  ? -1.907  4.190   28.119 1.00 16.82 ? 18  HIS A O   1 
ATOM   100  C CB  . HIS A 1 12  ? -3.619  3.388   30.471 1.00 18.83 ? 18  HIS A CB  1 
ATOM   101  C CG  . HIS A 1 12  ? -4.914  3.880   29.910 1.00 24.52 ? 18  HIS A CG  1 
ATOM   102  N ND1 . HIS A 1 12  ? -6.066  3.122   29.936 1.00 31.34 ? 18  HIS A ND1 1 
ATOM   103  C CD2 . HIS A 1 12  ? -5.246  5.052   29.321 1.00 26.64 ? 18  HIS A CD2 1 
ATOM   104  C CE1 . HIS A 1 12  ? -7.053  3.806   29.383 1.00 30.25 ? 18  HIS A CE1 1 
ATOM   105  N NE2 . HIS A 1 12  ? -6.583  4.982   29.007 1.00 30.55 ? 18  HIS A NE2 1 
ATOM   106  N N   . MET A 1 13  ? -3.348  2.725   27.154 1.00 15.00 ? 19  MET A N   1 
ATOM   107  C CA  . MET A 1 13  ? -3.320  3.390   25.863 1.00 16.15 ? 19  MET A CA  1 
ATOM   108  C C   . MET A 1 13  ? -4.728  3.683   25.383 1.00 16.82 ? 19  MET A C   1 
ATOM   109  O O   . MET A 1 13  ? -5.622  2.837   25.497 1.00 17.81 ? 19  MET A O   1 
ATOM   110  C CB  . MET A 1 13  ? -2.460  2.635   24.817 1.00 20.40 ? 19  MET A CB  1 
ATOM   111  C CG  . MET A 1 13  ? -2.633  3.072   23.366 1.00 17.20 ? 19  MET A CG  1 
ATOM   112  S SD  . MET A 1 13  ? -2.093  1.850   22.132 1.00 19.17 ? 19  MET A SD  1 
ATOM   113  C CE  . MET A 1 13  ? -0.312  2.085   22.221 1.00 15.13 ? 19  MET A CE  1 
ATOM   114  N N   . GLU A 1 14  ? -4.923  4.895   24.891 1.00 17.27 ? 20  GLU A N   1 
ATOM   115  C CA  . GLU A 1 14  ? -6.119  5.263   24.146 1.00 17.21 ? 20  GLU A CA  1 
ATOM   116  C C   . GLU A 1 14  ? -5.701  5.642   22.741 1.00 18.15 ? 20  GLU A C   1 
ATOM   117  O O   . GLU A 1 14  ? -4.701  6.340   22.550 1.00 18.96 ? 20  GLU A O   1 
ATOM   118  C CB  . GLU A 1 14  ? -6.877  6.435   24.775 1.00 22.71 ? 20  GLU A CB  1 
ATOM   119  C CG  . GLU A 1 14  ? -7.200  6.236   26.229 1.00 29.68 ? 20  GLU A CG  1 
ATOM   120  C CD  . GLU A 1 14  ? -7.726  7.498   26.896 1.00 45.59 ? 20  GLU A CD  1 
ATOM   121  O OE1 . GLU A 1 14  ? -8.211  7.402   28.046 1.00 46.50 ? 20  GLU A OE1 1 
ATOM   122  O OE2 . GLU A 1 14  ? -7.662  8.578   26.266 1.00 48.36 ? 20  GLU A OE2 1 
ATOM   123  N N   . GLY A 1 15  ? -6.447  5.176   21.750 1.00 17.52 ? 21  GLY A N   1 
ATOM   124  C CA  . GLY A 1 15  ? -6.037  5.532   20.412 1.00 19.85 ? 21  GLY A CA  1 
ATOM   125  C C   . GLY A 1 15  ? -7.145  5.368   19.404 1.00 20.25 ? 21  GLY A C   1 
ATOM   126  O O   . GLY A 1 15  ? -8.270  4.987   19.732 1.00 18.63 ? 21  GLY A O   1 
ATOM   127  N N   . SER A 1 16  ? -6.801  5.682   18.163 1.00 17.79 ? 22  SER A N   1 
ATOM   128  C CA  A SER A 1 16  ? -7.696  5.477   17.038 0.83 19.78 ? 22  SER A CA  1 
ATOM   129  C CA  B SER A 1 16  ? -7.698  5.519   17.029 0.17 19.80 ? 22  SER A CA  1 
ATOM   130  C C   . SER A 1 16  ? -6.867  5.134   15.815 1.00 19.77 ? 22  SER A C   1 
ATOM   131  O O   . SER A 1 16  ? -5.728  5.589   15.663 1.00 18.52 ? 22  SER A O   1 
ATOM   132  C CB  A SER A 1 16  ? -8.597  6.688   16.773 0.83 20.53 ? 22  SER A CB  1 
ATOM   133  C CB  B SER A 1 16  ? -8.472  6.811   16.747 0.17 20.67 ? 22  SER A CB  1 
ATOM   134  O OG  A SER A 1 16  ? -7.863  7.801   16.310 0.83 22.11 ? 22  SER A OG  1 
ATOM   135  O OG  B SER A 1 16  ? -9.195  6.723   15.533 0.17 21.87 ? 22  SER A OG  1 
ATOM   136  N N   . MET A 1 17  ? -7.439  4.295   14.953 1.00 18.30 ? 23  MET A N   1 
ATOM   137  C CA  . MET A 1 17  ? -6.781  3.834   13.738 1.00 18.23 ? 23  MET A CA  1 
ATOM   138  C C   . MET A 1 17  ? -7.811  3.964   12.628 1.00 20.42 ? 23  MET A C   1 
ATOM   139  O O   . MET A 1 17  ? -8.846  3.289   12.666 1.00 18.29 ? 23  MET A O   1 
ATOM   140  C CB  . MET A 1 17  ? -6.330  2.386   13.908 1.00 20.20 ? 23  MET A CB  1 
ATOM   141  C CG  . MET A 1 17  ? -4.947  2.294   14.507 1.00 17.40 ? 23  MET A CG  1 
ATOM   142  S SD  . MET A 1 17  ? -3.531  2.833   13.522 1.00 20.34 ? 23  MET A SD  1 
ATOM   143  C CE  . MET A 1 17  ? -3.533  1.612   12.223 1.00 22.00 ? 23  MET A CE  1 
ATOM   144  N N   . ASN A 1 18  ? -7.557  4.858   11.670 1.00 18.32 ? 24  ASN A N   1 
ATOM   145  C CA  . ASN A 1 18  ? -8.524  5.126   10.602 1.00 19.12 ? 24  ASN A CA  1 
ATOM   146  C C   . ASN A 1 18  ? -9.900  5.454   11.181 1.00 21.73 ? 24  ASN A C   1 
ATOM   147  O O   . ASN A 1 18  ? -10.941 5.046   10.647 1.00 23.02 ? 24  ASN A O   1 
ATOM   148  C CB  . ASN A 1 18  ? -8.601  3.964   9.610  1.00 18.86 ? 24  ASN A CB  1 
ATOM   149  C CG  . ASN A 1 18  ? -7.522  4.021   8.539  1.00 17.68 ? 24  ASN A CG  1 
ATOM   150  O OD1 . ASN A 1 18  ? -6.517  4.727   8.674  1.00 19.24 ? 24  ASN A OD1 1 
ATOM   151  N ND2 . ASN A 1 18  ? -7.726  3.264   7.462  1.00 20.34 ? 24  ASN A ND2 1 
ATOM   152  N N   . GLY A 1 19  ? -9.907  6.168   12.309 1.00 19.68 ? 25  GLY A N   1 
ATOM   153  C CA  . GLY A 1 19  ? -11.144 6.561   12.956 1.00 20.90 ? 25  GLY A CA  1 
ATOM   154  C C   . GLY A 1 19  ? -11.713 5.565   13.943 1.00 21.20 ? 25  GLY A C   1 
ATOM   155  O O   . GLY A 1 19  ? -12.673 5.906   14.651 1.00 28.08 ? 25  GLY A O   1 
ATOM   156  N N   . HIS A 1 20  ? -11.183 4.342   14.002 1.00 19.30 ? 26  HIS A N   1 
ATOM   157  C CA  . HIS A 1 20  ? -11.678 3.308   14.914 1.00 21.57 ? 26  HIS A CA  1 
ATOM   158  C C   . HIS A 1 20  ? -11.020 3.489   16.279 1.00 20.66 ? 26  HIS A C   1 
ATOM   159  O O   . HIS A 1 20  ? -9.813  3.288   16.417 1.00 20.13 ? 26  HIS A O   1 
ATOM   160  C CB  . HIS A 1 20  ? -11.331 1.920   14.381 1.00 21.84 ? 26  HIS A CB  1 
ATOM   161  C CG  . HIS A 1 20  ? -11.884 1.620   13.021 1.00 25.58 ? 26  HIS A CG  1 
ATOM   162  N ND1 . HIS A 1 20  ? -13.230 1.418   12.794 1.00 34.54 ? 26  HIS A ND1 1 
ATOM   163  C CD2 . HIS A 1 20  ? -11.275 1.467   11.820 1.00 33.60 ? 26  HIS A CD2 1 
ATOM   164  C CE1 . HIS A 1 20  ? -13.426 1.163   11.512 1.00 36.18 ? 26  HIS A CE1 1 
ATOM   165  N NE2 . HIS A 1 20  ? -12.256 1.191   10.898 1.00 34.66 ? 26  HIS A NE2 1 
ATOM   166  N N   . GLU A 1 21  ? -11.802 3.831   17.296 1.00 20.08 ? 27  GLU A N   1 
ATOM   167  C CA  . GLU A 1 21  ? -11.263 4.083   18.626 1.00 20.29 ? 27  GLU A CA  1 
ATOM   168  C C   . GLU A 1 21  ? -11.082 2.785   19.403 1.00 19.53 ? 27  GLU A C   1 
ATOM   169  O O   . GLU A 1 21  ? -11.853 1.831   19.253 1.00 19.70 ? 27  GLU A O   1 
ATOM   170  C CB  . GLU A 1 21  ? -12.207 4.996   19.411 1.00 23.80 ? 27  GLU A CB  1 
ATOM   171  C CG  . GLU A 1 21  ? -12.393 6.354   18.766 1.00 28.53 ? 27  GLU A CG  1 
ATOM   172  C CD  . GLU A 1 21  ? -11.449 7.403   19.316 1.00 36.07 ? 27  GLU A CD  1 
ATOM   173  O OE1 . GLU A 1 21  ? -10.654 7.077   20.227 1.00 41.41 ? 27  GLU A OE1 1 
ATOM   174  O OE2 . GLU A 1 21  ? -11.507 8.559   18.840 1.00 45.28 ? 27  GLU A OE2 1 
ATOM   175  N N   . PHE A 1 22  ? -10.064 2.757   20.266 1.00 16.57 ? 28  PHE A N   1 
ATOM   176  C CA  . PHE A 1 22  ? -9.810  1.595   21.101 1.00 16.67 ? 28  PHE A CA  1 
ATOM   177  C C   . PHE A 1 22  ? -9.058  2.028   22.355 1.00 15.99 ? 28  PHE A C   1 
ATOM   178  O O   . PHE A 1 22  ? -8.538  3.142   22.443 1.00 17.50 ? 28  PHE A O   1 
ATOM   179  C CB  . PHE A 1 22  ? -8.978  0.549   20.338 1.00 17.64 ? 28  PHE A CB  1 
ATOM   180  C CG  . PHE A 1 22  ? -7.619  1.047   19.946 1.00 18.84 ? 28  PHE A CG  1 
ATOM   181  C CD1 . PHE A 1 22  ? -7.436  1.749   18.765 1.00 18.82 ? 28  PHE A CD1 1 
ATOM   182  C CD2 . PHE A 1 22  ? -6.536  0.828   20.770 1.00 16.89 ? 28  PHE A CD2 1 
ATOM   183  C CE1 . PHE A 1 22  ? -6.185  2.229   18.413 1.00 20.73 ? 28  PHE A CE1 1 
ATOM   184  C CE2 . PHE A 1 22  ? -5.271  1.315   20.428 1.00 18.19 ? 28  PHE A CE2 1 
ATOM   185  C CZ  . PHE A 1 22  ? -5.102  2.007   19.245 1.00 20.12 ? 28  PHE A CZ  1 
ATOM   186  N N   . GLU A 1 23  ? -9.000  1.118   23.320 1.00 15.18 ? 29  GLU A N   1 
ATOM   187  C CA  . GLU A 1 23  ? -8.245  1.299   24.549 1.00 17.37 ? 29  GLU A CA  1 
ATOM   188  C C   . GLU A 1 23  ? -7.583  -0.019  24.926 1.00 18.94 ? 29  GLU A C   1 
ATOM   189  O O   . GLU A 1 23  ? -8.141  -1.100  24.715 1.00 18.41 ? 29  GLU A O   1 
ATOM   190  C CB  . GLU A 1 23  ? -9.147  1.748   25.709 1.00 19.57 ? 29  GLU A CB  1 
ATOM   191  C CG  . GLU A 1 23  ? -9.649  3.165   25.566 1.00 24.18 ? 29  GLU A CG  1 
ATOM   192  C CD  . GLU A 1 23  ? -10.322 3.686   26.829 1.00 34.10 ? 29  GLU A CD  1 
ATOM   193  O OE1 . GLU A 1 23  ? -9.924  3.279   27.948 1.00 34.24 ? 29  GLU A OE1 1 
ATOM   194  O OE2 . GLU A 1 23  ? -11.256 4.503   26.694 1.00 43.00 ? 29  GLU A OE2 1 
ATOM   195  N N   . ILE A 1 24  ? -6.379  0.084   25.488 1.00 16.37 ? 30  ILE A N   1 
ATOM   196  C CA  . ILE A 1 24  ? -5.593  -1.056  25.939 1.00 16.67 ? 30  ILE A CA  1 
ATOM   197  C C   . ILE A 1 24  ? -5.161  -0.787  27.369 1.00 17.01 ? 30  ILE A C   1 
ATOM   198  O O   . ILE A 1 24  ? -4.779  0.339   27.704 1.00 18.00 ? 30  ILE A O   1 
ATOM   199  C CB  . ILE A 1 24  ? -4.313  -1.198  25.085 1.00 18.45 ? 30  ILE A CB  1 
ATOM   200  C CG1 . ILE A 1 24  ? -4.585  -1.004  23.592 1.00 25.98 ? 30  ILE A CG1 1 
ATOM   201  C CG2 . ILE A 1 24  ? -3.563  -2.502  25.409 1.00 19.64 ? 30  ILE A CG2 1 
ATOM   202  C CD1 . ILE A 1 24  ? -5.163  -2.209  22.914 1.00 22.60 ? 30  ILE A CD1 1 
ATOM   203  N N   . GLU A 1 25  ? -5.153  -1.830  28.191 1.00 18.01 ? 31  GLU A N   1 
ATOM   204  C CA  . GLU A 1 25  ? -4.597  -1.778  29.533 1.00 18.15 ? 31  GLU A CA  1 
ATOM   205  C C   . GLU A 1 25  ? -3.640  -2.951  29.681 1.00 19.49 ? 31  GLU A C   1 
ATOM   206  O O   . GLU A 1 25  ? -3.901  -4.045  29.176 1.00 21.19 ? 31  GLU A O   1 
ATOM   207  C CB  . GLU A 1 25  ? -5.723  -1.868  30.592 1.00 23.60 ? 31  GLU A CB  1 
ATOM   208  C CG  . GLU A 1 25  ? -6.406  -0.528  30.864 1.00 30.84 ? 31  GLU A CG  1 
ATOM   209  C CD  . GLU A 1 25  ? -5.644  0.351   31.849 1.00 33.54 ? 31  GLU A CD  1 
ATOM   210  O OE1 . GLU A 1 25  ? -4.509  0.001   32.230 1.00 38.88 ? 31  GLU A OE1 1 
ATOM   211  O OE2 . GLU A 1 25  ? -6.187  1.409   32.241 1.00 45.91 ? 31  GLU A OE2 1 
ATOM   212  N N   . GLY A 1 26  ? -2.527  -2.734  30.365 1.00 17.93 ? 32  GLY A N   1 
ATOM   213  C CA  . GLY A 1 26  ? -1.579  -3.828  30.452 1.00 17.13 ? 32  GLY A CA  1 
ATOM   214  C C   . GLY A 1 26  ? -0.631  -3.662  31.617 1.00 18.75 ? 32  GLY A C   1 
ATOM   215  O O   . GLY A 1 26  ? -0.621  -2.639  32.300 1.00 17.64 ? 32  GLY A O   1 
ATOM   216  N N   . GLU A 1 27  ? 0.177   -4.698  31.830 1.00 17.41 ? 33  GLU A N   1 
ATOM   217  C CA  . GLU A 1 27  ? 1.149   -4.712  32.914 1.00 20.62 ? 33  GLU A CA  1 
ATOM   218  C C   . GLU A 1 27  ? 2.381   -5.432  32.403 1.00 18.23 ? 33  GLU A C   1 
ATOM   219  O O   . GLU A 1 27  ? 2.270   -6.388  31.627 1.00 19.96 ? 33  GLU A O   1 
ATOM   220  C CB  . GLU A 1 27  ? 0.611   -5.468  34.144 1.00 25.11 ? 33  GLU A CB  1 
ATOM   221  C CG  . GLU A 1 27  ? -0.692  -4.922  34.709 1.00 32.47 ? 33  GLU A CG  1 
ATOM   222  C CD  . GLU A 1 27  ? -0.944  -5.325  36.158 1.00 42.18 ? 33  GLU A CD  1 
ATOM   223  O OE1 . GLU A 1 27  ? -1.621  -6.353  36.387 1.00 46.69 ? 33  GLU A OE1 1 
ATOM   224  O OE2 . GLU A 1 27  ? -0.504  -4.588  37.072 1.00 41.42 ? 33  GLU A OE2 1 
ATOM   225  N N   . GLY A 1 28  ? 3.558   -4.984  32.838 1.00 17.35 ? 34  GLY A N   1 
ATOM   226  C CA  . GLY A 1 28  ? 4.794   -5.602  32.408 1.00 17.84 ? 34  GLY A CA  1 
ATOM   227  C C   . GLY A 1 28  ? 5.824   -5.668  33.517 1.00 15.09 ? 34  GLY A C   1 
ATOM   228  O O   . GLY A 1 28  ? 5.620   -5.167  34.625 1.00 16.69 ? 34  GLY A O   1 
ATOM   229  N N   . GLU A 1 29  ? 6.947   -6.297  33.183 1.00 15.82 ? 35  GLU A N   1 
ATOM   230  C CA  . GLU A 1 29  ? 8.013   -6.527  34.145 1.00 16.19 ? 35  GLU A CA  1 
ATOM   231  C C   . GLU A 1 29  ? 9.287   -6.804  33.367 1.00 17.24 ? 35  GLU A C   1 
ATOM   232  O O   . GLU A 1 29  ? 9.253   -7.231  32.210 1.00 17.49 ? 35  GLU A O   1 
ATOM   233  C CB  . GLU A 1 29  ? 7.701   -7.729  35.049 1.00 16.86 ? 35  GLU A CB  1 
ATOM   234  C CG  . GLU A 1 29  ? 7.521   -9.031  34.262 1.00 21.16 ? 35  GLU A CG  1 
ATOM   235  C CD  . GLU A 1 29  ? 7.335   -10.249 35.145 1.00 24.84 ? 35  GLU A CD  1 
ATOM   236  O OE1 . GLU A 1 29  ? 8.313   -10.671 35.774 1.00 24.09 ? 35  GLU A OE1 1 
ATOM   237  O OE2 . GLU A 1 29  ? 6.212   -10.783 35.196 1.00 30.60 ? 35  GLU A OE2 1 
ATOM   238  N N   . GLY A 1 30  ? 10.416  -6.566  34.013 1.00 16.88 ? 36  GLY A N   1 
ATOM   239  C CA  . GLY A 1 30  ? 11.663  -6.911  33.354 1.00 17.86 ? 36  GLY A CA  1 
ATOM   240  C C   . GLY A 1 30  ? 12.856  -6.527  34.193 1.00 18.18 ? 36  GLY A C   1 
ATOM   241  O O   . GLY A 1 30  ? 12.728  -6.175  35.364 1.00 16.64 ? 36  GLY A O   1 
ATOM   242  N N   . ARG A 1 31  ? 14.022  -6.588  33.549 1.00 16.67 ? 37  ARG A N   1 
ATOM   243  C CA  . ARG A 1 31  ? 15.322  -6.393  34.190 1.00 17.01 ? 37  ARG A CA  1 
ATOM   244  C C   . ARG A 1 31  ? 15.973  -5.218  33.476 1.00 16.76 ? 37  ARG A C   1 
ATOM   245  O O   . ARG A 1 31  ? 16.607  -5.395  32.420 1.00 16.72 ? 37  ARG A O   1 
ATOM   246  C CB  . ARG A 1 31  ? 16.190  -7.639  34.049 1.00 18.84 ? 37  ARG A CB  1 
ATOM   247  C CG  . ARG A 1 31  ? 15.516  -8.926  34.381 1.00 25.70 ? 37  ARG A CG  1 
ATOM   248  C CD  . ARG A 1 31  ? 15.683  -9.249  35.817 1.00 28.39 ? 37  ARG A CD  1 
ATOM   249  N NE  . ARG A 1 31  ? 14.694  -10.240 36.217 1.00 31.82 ? 37  ARG A NE  1 
ATOM   250  C CZ  . ARG A 1 31  ? 14.576  -10.720 37.446 1.00 36.63 ? 37  ARG A CZ  1 
ATOM   251  N NH1 . ARG A 1 31  ? 15.375  -10.317 38.423 1.00 38.90 ? 37  ARG A NH1 1 
ATOM   252  N NH2 . ARG A 1 31  ? 13.639  -11.626 37.698 1.00 30.98 ? 37  ARG A NH2 1 
ATOM   253  N N   . PRO A 1 32  ? 15.820  -3.995  33.995 1.00 16.78 ? 38  PRO A N   1 
ATOM   254  C CA  . PRO A 1 32  ? 16.232  -2.810  33.225 1.00 17.43 ? 38  PRO A CA  1 
ATOM   255  C C   . PRO A 1 32  ? 17.699  -2.775  32.855 1.00 17.80 ? 38  PRO A C   1 
ATOM   256  O O   . PRO A 1 32  ? 18.032  -2.209  31.809 1.00 17.96 ? 38  PRO A O   1 
ATOM   257  C CB  . PRO A 1 32  ? 15.848  -1.639  34.142 1.00 18.33 ? 38  PRO A CB  1 
ATOM   258  C CG  . PRO A 1 32  ? 14.736  -2.199  34.994 1.00 17.00 ? 38  PRO A CG  1 
ATOM   259  C CD  . PRO A 1 32  ? 15.106  -3.632  35.231 1.00 17.18 ? 38  PRO A CD  1 
ATOM   260  N N   . TYR A 1 33  ? 18.584  -3.368  33.660 1.00 16.62 ? 39  TYR A N   1 
ATOM   261  C CA  . TYR A 1 33  ? 20.008  -3.341  33.350 1.00 17.96 ? 39  TYR A CA  1 
ATOM   262  C C   . TYR A 1 33  ? 20.433  -4.483  32.448 1.00 19.02 ? 39  TYR A C   1 
ATOM   263  O O   . TYR A 1 33  ? 21.549  -4.449  31.918 1.00 21.70 ? 39  TYR A O   1 
ATOM   264  C CB  . TYR A 1 33  ? 20.850  -3.304  34.640 1.00 17.55 ? 39  TYR A CB  1 
ATOM   265  C CG  . TYR A 1 33  ? 20.499  -2.094  35.477 1.00 17.44 ? 39  TYR A CG  1 
ATOM   266  C CD1 . TYR A 1 33  ? 19.485  -2.152  36.418 1.00 19.01 ? 39  TYR A CD1 1 
ATOM   267  C CD2 . TYR A 1 33  ? 21.176  -0.880  35.316 1.00 17.22 ? 39  TYR A CD2 1 
ATOM   268  C CE1 . TYR A 1 33  ? 19.140  -1.039  37.171 1.00 20.04 ? 39  TYR A CE1 1 
ATOM   269  C CE2 . TYR A 1 33  ? 20.847  0.230   36.068 1.00 20.07 ? 39  TYR A CE2 1 
ATOM   270  C CZ  . TYR A 1 33  ? 19.824  0.147   36.996 1.00 19.35 ? 39  TYR A CZ  1 
ATOM   271  O OH  . TYR A 1 33  ? 19.483  1.251   37.747 1.00 22.09 ? 39  TYR A OH  1 
ATOM   272  N N   . GLU A 1 34  ? 19.576  -5.483  32.248 1.00 18.16 ? 40  GLU A N   1 
ATOM   273  C CA  . GLU A 1 34  ? 19.823  -6.545  31.287 1.00 18.30 ? 40  GLU A CA  1 
ATOM   274  C C   . GLU A 1 34  ? 19.160  -6.265  29.946 1.00 18.39 ? 40  GLU A C   1 
ATOM   275  O O   . GLU A 1 34  ? 19.451  -6.960  28.963 1.00 19.08 ? 40  GLU A O   1 
ATOM   276  C CB  . GLU A 1 34  ? 19.338  -7.878  31.864 1.00 20.85 ? 40  GLU A CB  1 
ATOM   277  C CG  . GLU A 1 34  ? 19.949  -8.160  33.225 1.00 25.12 ? 40  GLU A CG  1 
ATOM   278  C CD  . GLU A 1 34  ? 19.476  -9.465  33.841 1.00 33.91 ? 40  GLU A CD  1 
ATOM   279  O OE1 . GLU A 1 34  ? 18.805  -10.260 33.150 1.00 34.68 ? 40  GLU A OE1 1 
ATOM   280  O OE2 . GLU A 1 34  ? 19.782  -9.694  35.031 1.00 44.49 ? 40  GLU A OE2 1 
ATOM   281  N N   . GLY A 1 35  ? 18.283  -5.264  29.888 1.00 16.12 ? 41  GLY A N   1 
ATOM   282  C CA  . GLY A 1 35  ? 17.647  -4.887  28.645 1.00 17.02 ? 41  GLY A CA  1 
ATOM   283  C C   . GLY A 1 35  ? 16.461  -5.724  28.238 1.00 17.96 ? 41  GLY A C   1 
ATOM   284  O O   . GLY A 1 35  ? 16.073  -5.678  27.072 1.00 18.41 ? 41  GLY A O   1 
ATOM   285  N N   . THR A 1 36  ? 15.854  -6.471  29.158 1.00 17.44 ? 42  THR A N   1 
ATOM   286  C CA  . THR A 1 36  ? 14.801  -7.410  28.800 1.00 17.06 ? 42  THR A CA  1 
ATOM   287  C C   . THR A 1 36  ? 13.514  -7.070  29.536 1.00 18.97 ? 42  THR A C   1 
ATOM   288  O O   . THR A 1 36  ? 13.533  -6.628  30.689 1.00 17.04 ? 42  THR A O   1 
ATOM   289  C CB  . THR A 1 36  ? 15.220  -8.844  29.138 1.00 18.63 ? 42  THR A CB  1 
ATOM   290  O OG1 . THR A 1 36  ? 15.548  -8.951  30.536 1.00 20.56 ? 42  THR A OG1 1 
ATOM   291  C CG2 . THR A 1 36  ? 16.431  -9.270  28.296 1.00 18.31 ? 42  THR A CG2 1 
ATOM   292  N N   . GLN A 1 37  ? 12.389  -7.319  28.872 1.00 15.75 ? 43  GLN A N   1 
ATOM   293  C CA  . GLN A 1 37  ? 11.103  -7.060  29.497 1.00 16.52 ? 43  GLN A CA  1 
ATOM   294  C C   . GLN A 1 37  ? 10.008  -7.827  28.772 1.00 15.59 ? 43  GLN A C   1 
ATOM   295  O O   . GLN A 1 37  ? 10.133  -8.166  27.592 1.00 16.94 ? 43  GLN A O   1 
ATOM   296  C CB  . GLN A 1 37  ? 10.779  -5.571  29.486 1.00 18.20 ? 43  GLN A CB  1 
ATOM   297  C CG  . GLN A 1 37  ? 10.732  -4.988  28.100 1.00 19.21 ? 43  GLN A CG  1 
ATOM   298  C CD  . GLN A 1 37  ? 10.499  -3.494  28.126 1.00 23.30 ? 43  GLN A CD  1 
ATOM   299  O OE1 . GLN A 1 37  ? 9.651   -3.007  28.872 1.00 23.50 ? 43  GLN A OE1 1 
ATOM   300  N NE2 . GLN A 1 37  ? 11.258  -2.753  27.323 1.00 19.40 ? 43  GLN A NE2 1 
ATOM   301  N N   . THR A 1 38  ? 8.918   -8.071  29.501 1.00 15.92 ? 44  THR A N   1 
ATOM   302  C CA  . THR A 1 38  ? 7.713   -8.671  28.947 1.00 17.22 ? 44  THR A CA  1 
ATOM   303  C C   . THR A 1 38  ? 6.509   -7.838  29.361 1.00 18.30 ? 44  THR A C   1 
ATOM   304  O O   . THR A 1 38  ? 6.545   -7.114  30.354 1.00 18.31 ? 44  THR A O   1 
ATOM   305  C CB  . THR A 1 38  ? 7.520   -10.104 29.463 1.00 22.76 ? 44  THR A CB  1 
ATOM   306  O OG1 . THR A 1 38  ? 7.420   -10.091 30.893 1.00 25.22 ? 44  THR A OG1 1 
ATOM   307  C CG2 . THR A 1 38  ? 8.679   -10.981 29.070 1.00 22.57 ? 44  THR A CG2 1 
ATOM   308  N N   . ALA A 1 39  ? 5.423   -7.956  28.598 1.00 16.70 ? 45  ALA A N   1 
ATOM   309  C CA  . ALA A 1 39  ? 4.183   -7.300  28.981 1.00 16.42 ? 45  ALA A CA  1 
ATOM   310  C C   . ALA A 1 39  ? 3.010   -8.151  28.533 1.00 18.00 ? 45  ALA A C   1 
ATOM   311  O O   . ALA A 1 39  ? 3.099   -8.908  27.563 1.00 18.31 ? 45  ALA A O   1 
ATOM   312  C CB  . ALA A 1 39  ? 4.032   -5.900  28.391 1.00 19.33 ? 45  ALA A CB  1 
ATOM   313  N N   . LYS A 1 40  ? 1.912   -8.011  29.264 1.00 17.03 ? 46  LYS A N   1 
ATOM   314  C CA  . LYS A 1 40  ? 0.633   -8.616  28.908 1.00 16.83 ? 46  LYS A CA  1 
ATOM   315  C C   . LYS A 1 40  ? -0.377  -7.491  28.760 1.00 17.01 ? 46  LYS A C   1 
ATOM   316  O O   . LYS A 1 40  ? -0.585  -6.719  29.702 1.00 18.73 ? 46  LYS A O   1 
ATOM   317  C CB  . LYS A 1 40  ? 0.197   -9.603  29.986 1.00 19.50 ? 46  LYS A CB  1 
ATOM   318  C CG  . LYS A 1 40  ? -1.016  -10.446 29.576 1.00 24.20 ? 46  LYS A CG  1 
ATOM   319  C CD  . LYS A 1 40  ? -1.451  -11.361 30.716 1.00 32.64 ? 46  LYS A CD  1 
ATOM   320  C CE  . LYS A 1 40  ? -2.325  -12.507 30.224 1.00 36.52 ? 46  LYS A CE  1 
ATOM   321  N NZ  . LYS A 1 40  ? -2.048  -13.770 30.967 1.00 44.59 ? 46  LYS A NZ  1 
ATOM   322  N N   . LEU A 1 41  ? -0.990  -7.400  27.580 1.00 15.12 ? 47  LEU A N   1 
ATOM   323  C CA  . LEU A 1 41  ? -1.888  -6.321  27.211 1.00 15.66 ? 47  LEU A CA  1 
ATOM   324  C C   . LEU A 1 41  ? -3.273  -6.894  26.967 1.00 16.43 ? 47  LEU A C   1 
ATOM   325  O O   . LEU A 1 41  ? -3.416  -7.998  26.435 1.00 16.81 ? 47  LEU A O   1 
ATOM   326  C CB  . LEU A 1 41  ? -1.437  -5.631  25.904 1.00 17.13 ? 47  LEU A CB  1 
ATOM   327  C CG  . LEU A 1 41  ? -0.052  -4.971  25.822 1.00 16.61 ? 47  LEU A CG  1 
ATOM   328  C CD1 . LEU A 1 41  ? 0.217   -4.141  27.066 1.00 17.22 ? 47  LEU A CD1 1 
ATOM   329  C CD2 . LEU A 1 41  ? 1.076   -5.977  25.563 1.00 16.32 ? 47  LEU A CD2 1 
ATOM   330  N N   . ARG A 1 42  ? -4.282  -6.100  27.316 1.00 16.29 ? 48  ARG A N   1 
ATOM   331  C CA  . ARG A 1 42  ? -5.681  -6.472  27.135 1.00 15.26 ? 48  ARG A CA  1 
ATOM   332  C C   . ARG A 1 42  ? -6.391  -5.350  26.400 1.00 15.72 ? 48  ARG A C   1 
ATOM   333  O O   . ARG A 1 42  ? -6.301  -4.182  26.798 1.00 17.72 ? 48  ARG A O   1 
ATOM   334  C CB  . ARG A 1 42  ? -6.355  -6.678  28.496 1.00 17.67 ? 48  ARG A CB  1 
ATOM   335  C CG  . ARG A 1 42  ? -5.781  -7.847  29.270 1.00 24.56 ? 48  ARG A CG  1 
ATOM   336  C CD  . ARG A 1 42  ? -6.262  -7.883  30.719 1.00 30.41 ? 48  ARG A CD  1 
ATOM   337  N NE  . ARG A 1 42  ? -5.854  -6.704  31.477 1.00 35.81 ? 48  ARG A NE  1 
ATOM   338  C CZ  . ARG A 1 42  ? -4.614  -6.456  31.885 1.00 39.22 ? 48  ARG A CZ  1 
ATOM   339  N NH1 . ARG A 1 42  ? -3.606  -7.265  31.583 1.00 37.41 ? 48  ARG A NH1 1 
ATOM   340  N NH2 . ARG A 1 42  ? -4.377  -5.368  32.615 1.00 36.96 ? 48  ARG A NH2 1 
ATOM   341  N N   . VAL A 1 43  ? -7.120  -5.697  25.346 1.00 15.33 ? 49  VAL A N   1 
ATOM   342  C CA  . VAL A 1 43  ? -7.965  -4.705  24.694 1.00 16.57 ? 49  VAL A CA  1 
ATOM   343  C C   . VAL A 1 43  ? -9.233  -4.556  25.530 1.00 18.33 ? 49  VAL A C   1 
ATOM   344  O O   . VAL A 1 43  ? -9.967  -5.531  25.735 1.00 20.39 ? 49  VAL A O   1 
ATOM   345  C CB  . VAL A 1 43  ? -8.308  -5.120  23.255 1.00 20.75 ? 49  VAL A CB  1 
ATOM   346  C CG1 . VAL A 1 43  ? -9.189  -4.072  22.604 1.00 18.29 ? 49  VAL A CG1 1 
ATOM   347  C CG2 . VAL A 1 43  ? -7.032  -5.315  22.431 1.00 17.57 ? 49  VAL A CG2 1 
ATOM   348  N N   . THR A 1 44  ? -9.496  -3.332  26.008 1.00 16.37 ? 50  THR A N   1 
ATOM   349  C CA  . THR A 1 44  ? -10.649 -3.062  26.858 1.00 18.54 ? 50  THR A CA  1 
ATOM   350  C C   . THR A 1 44  ? -11.737 -2.259  26.169 1.00 21.25 ? 50  THR A C   1 
ATOM   351  O O   . THR A 1 44  ? -12.841 -2.155  26.712 1.00 21.22 ? 50  THR A O   1 
ATOM   352  C CB  . THR A 1 44  ? -10.213 -2.320  28.122 1.00 19.68 ? 50  THR A CB  1 
ATOM   353  O OG1 . THR A 1 44  ? -9.551  -1.106  27.741 1.00 23.44 ? 50  THR A OG1 1 
ATOM   354  C CG2 . THR A 1 44  ? -9.266  -3.181  28.942 1.00 21.89 ? 50  THR A CG2 1 
ATOM   355  N N   . LYS A 1 45  ? -11.466 -1.687  25.005 1.00 19.08 ? 51  LYS A N   1 
ATOM   356  C CA  . LYS A 1 45  ? -12.490 -1.047  24.198 1.00 17.56 ? 51  LYS A CA  1 
ATOM   357  C C   . LYS A 1 45  ? -12.046 -1.124  22.749 1.00 17.92 ? 51  LYS A C   1 
ATOM   358  O O   . LYS A 1 45  ? -10.847 -1.056  22.455 1.00 18.74 ? 51  LYS A O   1 
ATOM   359  C CB  . LYS A 1 45  ? -12.721 0.402   24.641 1.00 19.66 ? 51  LYS A CB  1 
ATOM   360  C CG  . LYS A 1 45  ? -13.840 1.124   23.895 1.00 27.24 ? 51  LYS A CG  1 
ATOM   361  C CD  . LYS A 1 45  ? -13.985 2.575   24.341 1.00 33.60 ? 51  LYS A CD  1 
ATOM   362  C CE  . LYS A 1 45  ? -15.460 2.976   24.367 1.00 47.50 ? 51  LYS A CE  1 
ATOM   363  N NZ  . LYS A 1 45  ? -15.794 3.884   25.501 1.00 51.50 ? 51  LYS A NZ  1 
ATOM   364  N N   . GLY A 1 46  ? -13.003 -1.282  21.843 1.00 17.80 ? 52  GLY A N   1 
ATOM   365  C CA  . GLY A 1 46  ? -12.682 -1.340  20.436 1.00 16.67 ? 52  GLY A CA  1 
ATOM   366  C C   . GLY A 1 46  ? -12.197 -2.679  19.935 1.00 16.70 ? 52  GLY A C   1 
ATOM   367  O O   . GLY A 1 46  ? -11.715 -2.755  18.795 1.00 20.13 ? 52  GLY A O   1 
ATOM   368  N N   . GLY A 1 47  ? -12.312 -3.743  20.732 1.00 15.48 ? 53  GLY A N   1 
ATOM   369  C CA  . GLY A 1 47  ? -11.819 -5.046  20.341 1.00 16.24 ? 53  GLY A CA  1 
ATOM   370  C C   . GLY A 1 47  ? -12.876 -5.882  19.639 1.00 19.42 ? 53  GLY A C   1 
ATOM   371  O O   . GLY A 1 47  ? -14.080 -5.633  19.783 1.00 18.50 ? 53  GLY A O   1 
ATOM   372  N N   . PRO A 1 48  ? -12.457 -6.865  18.837 1.00 19.01 ? 54  PRO A N   1 
ATOM   373  C CA  . PRO A 1 48  ? -11.079 -7.106  18.387 1.00 18.13 ? 54  PRO A CA  1 
ATOM   374  C C   . PRO A 1 48  ? -10.654 -5.980  17.469 1.00 18.42 ? 54  PRO A C   1 
ATOM   375  O O   . PRO A 1 48  ? -11.456 -5.435  16.718 1.00 18.47 ? 54  PRO A O   1 
ATOM   376  C CB  . PRO A 1 48  ? -11.159 -8.443  17.642 1.00 18.92 ? 54  PRO A CB  1 
ATOM   377  C CG  . PRO A 1 48  ? -12.620 -8.642  17.305 1.00 23.50 ? 54  PRO A CG  1 
ATOM   378  C CD  . PRO A 1 48  ? -13.400 -7.896  18.353 1.00 19.48 ? 54  PRO A CD  1 
ATOM   379  N N   . LEU A 1 49  ? -9.390  -5.581  17.558 1.00 17.16 ? 55  LEU A N   1 
ATOM   380  C CA  . LEU A 1 49  ? -8.929  -4.447  16.780 1.00 17.32 ? 55  LEU A CA  1 
ATOM   381  C C   . LEU A 1 49  ? -9.034  -4.768  15.294 1.00 17.88 ? 55  LEU A C   1 
ATOM   382  O O   . LEU A 1 49  ? -8.660  -5.865  14.869 1.00 19.46 ? 55  LEU A O   1 
ATOM   383  C CB  . LEU A 1 49  ? -7.469  -4.149  17.123 1.00 16.45 ? 55  LEU A CB  1 
ATOM   384  C CG  . LEU A 1 49  ? -7.220  -3.883  18.600 1.00 18.61 ? 55  LEU A CG  1 
ATOM   385  C CD1 . LEU A 1 49  ? -5.708  -3.841  18.822 1.00 17.39 ? 55  LEU A CD1 1 
ATOM   386  C CD2 . LEU A 1 49  ? -7.876  -2.589  19.022 1.00 19.35 ? 55  LEU A CD2 1 
ATOM   387  N N   . PRO A 1 50  ? -9.501  -3.831  14.484 1.00 17.88 ? 56  PRO A N   1 
ATOM   388  C CA  . PRO A 1 50  ? -9.637  -4.084  13.045 1.00 18.96 ? 56  PRO A CA  1 
ATOM   389  C C   . PRO A 1 50  ? -8.372  -3.723  12.289 1.00 23.50 ? 56  PRO A C   1 
ATOM   390  O O   . PRO A 1 50  ? -8.432  -3.259  11.145 1.00 24.06 ? 56  PRO A O   1 
ATOM   391  C CB  . PRO A 1 50  ? -10.802 -3.167  12.650 1.00 20.86 ? 56  PRO A CB  1 
ATOM   392  C CG  . PRO A 1 50  ? -10.695 -2.013  13.614 1.00 23.67 ? 56  PRO A CG  1 
ATOM   393  C CD  . PRO A 1 50  ? -10.140 -2.571  14.905 1.00 18.89 ? 56  PRO A CD  1 
ATOM   394  N N   . PHE A 1 51  ? -7.222  -3.946  12.926 1.00 18.58 ? 57  PHE A N   1 
ATOM   395  C CA  . PHE A 1 51  ? -5.928  -3.619  12.338 1.00 18.88 ? 57  PHE A CA  1 
ATOM   396  C C   . PHE A 1 51  ? -4.859  -4.440  13.051 1.00 18.18 ? 57  PHE A C   1 
ATOM   397  O O   . PHE A 1 51  ? -5.079  -4.976  14.139 1.00 18.83 ? 57  PHE A O   1 
ATOM   398  C CB  . PHE A 1 51  ? -5.626  -2.121  12.447 1.00 18.72 ? 57  PHE A CB  1 
ATOM   399  C CG  . PHE A 1 51  ? -5.609  -1.612  13.853 1.00 18.48 ? 57  PHE A CG  1 
ATOM   400  C CD1 . PHE A 1 51  ? -4.447  -1.663  14.608 1.00 17.74 ? 57  PHE A CD1 1 
ATOM   401  C CD2 . PHE A 1 51  ? -6.752  -1.087  14.430 1.00 17.84 ? 57  PHE A CD2 1 
ATOM   402  C CE1 . PHE A 1 51  ? -4.423  -1.209  15.902 1.00 17.91 ? 57  PHE A CE1 1 
ATOM   403  C CE2 . PHE A 1 51  ? -6.736  -0.631  15.730 1.00 17.28 ? 57  PHE A CE2 1 
ATOM   404  C CZ  . PHE A 1 51  ? -5.566  -0.684  16.470 1.00 17.83 ? 57  PHE A CZ  1 
ATOM   405  N N   . SER A 1 52  ? -3.674  -4.502  12.439 1.00 17.32 ? 58  SER A N   1 
ATOM   406  C CA  . SER A 1 52  ? -2.605  -5.340  12.968 1.00 16.86 ? 58  SER A CA  1 
ATOM   407  C C   . SER A 1 52  ? -2.121  -4.862  14.337 1.00 17.16 ? 58  SER A C   1 
ATOM   408  O O   . SER A 1 52  ? -1.833  -3.673  14.533 1.00 17.06 ? 58  SER A O   1 
ATOM   409  C CB  . SER A 1 52  ? -1.424  -5.339  12.001 1.00 17.52 ? 58  SER A CB  1 
ATOM   410  O OG  . SER A 1 52  ? -0.321  -6.041  12.575 1.00 20.84 ? 58  SER A OG  1 
ATOM   411  N N   . TRP A 1 53  ? -1.978  -5.818  15.265 1.00 17.44 ? 59  TRP A N   1 
ATOM   412  C CA  . TRP A 1 53  ? -1.366  -5.550  16.561 1.00 15.41 ? 59  TRP A CA  1 
ATOM   413  C C   . TRP A 1 53  ? 0.017   -4.929  16.418 1.00 16.74 ? 59  TRP A C   1 
ATOM   414  O O   . TRP A 1 53  ? 0.463   -4.183  17.304 1.00 17.83 ? 59  TRP A O   1 
ATOM   415  C CB  . TRP A 1 53  ? -1.242  -6.853  17.365 1.00 18.33 ? 59  TRP A CB  1 
ATOM   416  C CG  . TRP A 1 53  ? -0.752  -6.600  18.743 1.00 17.90 ? 59  TRP A CG  1 
ATOM   417  C CD1 . TRP A 1 53  ? 0.549   -6.660  19.188 1.00 20.27 ? 59  TRP A CD1 1 
ATOM   418  C CD2 . TRP A 1 53  ? -1.539  -6.172  19.857 1.00 17.57 ? 59  TRP A CD2 1 
ATOM   419  N NE1 . TRP A 1 53  ? 0.605   -6.316  20.518 1.00 19.03 ? 59  TRP A NE1 1 
ATOM   420  C CE2 . TRP A 1 53  ? -0.660  -6.010  20.951 1.00 17.06 ? 59  TRP A CE2 1 
ATOM   421  C CE3 . TRP A 1 53  ? -2.907  -5.924  20.043 1.00 17.49 ? 59  TRP A CE3 1 
ATOM   422  C CZ2 . TRP A 1 53  ? -1.104  -5.614  22.216 1.00 21.71 ? 59  TRP A CZ2 1 
ATOM   423  C CZ3 . TRP A 1 53  ? -3.350  -5.531  21.301 1.00 19.30 ? 59  TRP A CZ3 1 
ATOM   424  C CH2 . TRP A 1 53  ? -2.446  -5.380  22.371 1.00 23.29 ? 59  TRP A CH2 1 
ATOM   425  N N   . ASP A 1 54  ? 0.722   -5.244  15.326 1.00 17.16 ? 60  ASP A N   1 
ATOM   426  C CA  . ASP A 1 54  ? 2.103   -4.790  15.177 1.00 18.54 ? 60  ASP A CA  1 
ATOM   427  C C   . ASP A 1 54  ? 2.229   -3.269  15.193 1.00 17.02 ? 60  ASP A C   1 
ATOM   428  O O   . ASP A 1 54  ? 3.305   -2.751  15.509 1.00 16.71 ? 60  ASP A O   1 
ATOM   429  C CB  . ASP A 1 54  ? 2.710   -5.353  13.893 1.00 17.30 ? 60  ASP A CB  1 
ATOM   430  C CG  . ASP A 1 54  ? 2.836   -6.876  13.912 1.00 19.04 ? 60  ASP A CG  1 
ATOM   431  O OD1 . ASP A 1 54  ? 3.044   -7.463  14.998 1.00 20.73 ? 60  ASP A OD1 1 
ATOM   432  O OD2 . ASP A 1 54  ? 2.762   -7.492  12.824 1.00 20.49 ? 60  ASP A OD2 1 
ATOM   433  N N   . ILE A 1 55  ? 1.166   -2.535  14.862 1.00 17.47 ? 61  ILE A N   1 
ATOM   434  C CA  . ILE A 1 55  ? 1.222   -1.081  14.963 1.00 17.83 ? 61  ILE A CA  1 
ATOM   435  C C   . ILE A 1 55  ? 1.380   -0.639  16.409 1.00 17.88 ? 61  ILE A C   1 
ATOM   436  O O   . ILE A 1 55  ? 2.032   0.378   16.692 1.00 18.11 ? 61  ILE A O   1 
ATOM   437  C CB  . ILE A 1 55  ? -0.047  -0.474  14.345 1.00 18.67 ? 61  ILE A CB  1 
ATOM   438  C CG1 . ILE A 1 55  ? -0.151  -0.853  12.874 1.00 21.26 ? 61  ILE A CG1 1 
ATOM   439  C CG2 . ILE A 1 55  ? -0.053  1.050   14.531 1.00 22.30 ? 61  ILE A CG2 1 
ATOM   440  C CD1 . ILE A 1 55  ? 0.938   -0.267  12.037 1.00 23.01 ? 61  ILE A CD1 1 
ATOM   441  N N   . LEU A 1 56  ? 0.798   -1.388  17.348 1.00 15.31 ? 62  LEU A N   1 
ATOM   442  C CA  . LEU A 1 56  ? 0.781   -0.998  18.749 1.00 17.90 ? 62  LEU A CA  1 
ATOM   443  C C   . LEU A 1 56  ? 1.975   -1.515  19.521 1.00 15.10 ? 62  LEU A C   1 
ATOM   444  O O   . LEU A 1 56  ? 2.393   -0.866  20.483 1.00 16.13 ? 62  LEU A O   1 
ATOM   445  C CB  . LEU A 1 56  ? -0.472  -1.549  19.438 1.00 16.92 ? 62  LEU A CB  1 
ATOM   446  C CG  . LEU A 1 56  ? -1.802  -1.195  18.784 1.00 18.16 ? 62  LEU A CG  1 
ATOM   447  C CD1 . LEU A 1 56  ? -2.918  -1.733  19.662 1.00 17.40 ? 62  LEU A CD1 1 
ATOM   448  C CD2 . LEU A 1 56  ? -1.933  0.304   18.583 1.00 18.17 ? 62  LEU A CD2 1 
ATOM   449  N N   . SER A 1 57  ? 2.522   -2.672  19.143 1.00 15.20 ? 63  SER A N   1 
ATOM   450  C CA  . SER A 1 57  ? 3.542   -3.309  19.974 1.00 16.37 ? 63  SER A CA  1 
ATOM   451  C C   . SER A 1 57  ? 4.735   -2.419  20.318 1.00 14.60 ? 63  SER A C   1 
ATOM   452  O O   . SER A 1 57  ? 5.183   -2.473  21.480 1.00 16.35 ? 63  SER A O   1 
ATOM   453  C CB  . SER A 1 57  ? 3.980   -4.656  19.381 1.00 18.01 ? 63  SER A CB  1 
ATOM   454  O OG  . SER A 1 57  ? 4.581   -4.485  18.117 1.00 17.80 ? 63  SER A OG  1 
ATOM   455  N N   . PRO A 1 58  ? 5.298   -1.610  19.408 1.00 16.58 ? 64  PRO A N   1 
ATOM   456  C CA  . PRO A 1 58  ? 6.445   -0.774  19.798 1.00 16.65 ? 64  PRO A CA  1 
ATOM   457  C C   . PRO A 1 58  ? 6.079   0.388   20.686 1.00 18.04 ? 64  PRO A C   1 
ATOM   458  O O   . PRO A 1 58  ? 6.963   1.175   21.031 1.00 18.20 ? 64  PRO A O   1 
ATOM   459  C CB  . PRO A 1 58  ? 6.980   -0.241  18.453 1.00 18.71 ? 64  PRO A CB  1 
ATOM   460  C CG  . PRO A 1 58  ? 6.340   -1.079  17.401 1.00 19.41 ? 64  PRO A CG  1 
ATOM   461  C CD  . PRO A 1 58  ? 5.008   -1.460  17.973 1.00 16.65 ? 64  PRO A CD  1 
ATOM   462  N N   . GLN A 1 59  ? 4.812   0.567   21.049 1.00 16.70 ? 65  GLN A N   1 
ATOM   463  C CA  . GLN A 1 59  ? 4.447   1.686   21.901 1.00 16.75 ? 65  GLN A CA  1 
ATOM   464  C C   . GLN A 1 59  ? 4.341   1.309   23.371 1.00 18.29 ? 65  GLN A C   1 
ATOM   465  O O   . GLN A 1 59  ? 4.123   2.198   24.203 1.00 20.07 ? 65  GLN A O   1 
ATOM   466  C CB  . GLN A 1 59  ? 3.115   2.325   21.452 1.00 15.44 ? 65  GLN A CB  1 
ATOM   467  C CG  . GLN A 1 59  ? 2.827   2.288   19.946 1.00 17.25 ? 65  GLN A CG  1 
ATOM   468  C CD  . GLN A 1 59  ? 3.972   2.824   19.089 1.00 18.14 ? 65  GLN A CD  1 
ATOM   469  O OE1 . GLN A 1 59  ? 4.795   3.631   19.535 1.00 18.98 ? 65  GLN A OE1 1 
ATOM   470  N NE2 . GLN A 1 59  ? 4.035   2.359   17.846 1.00 18.71 ? 65  GLN A NE2 1 
ATOM   471  N N   . PHE A 1 60  ? 4.473   0.027   23.713 1.00 18.85 ? 66  PHE A N   1 
ATOM   472  C CA  . PHE A 1 60  ? 4.244   -0.415  25.089 1.00 21.47 ? 66  PHE A CA  1 
ATOM   473  C C   . PHE A 1 60  ? 5.503   -0.474  25.930 1.00 22.84 ? 66  PHE A C   1 
ATOM   474  O O   . PHE A 1 60  ? 5.436   -0.339  27.152 1.00 26.27 ? 66  PHE A O   1 
ATOM   475  C CB  . PHE A 1 60  ? 3.550   -1.770  25.112 1.00 18.91 ? 66  PHE A CB  1 
ATOM   476  C CG  . PHE A 1 60  ? 2.193   -1.748  24.506 1.00 17.30 ? 66  PHE A CG  1 
ATOM   477  C CD1 . PHE A 1 60  ? 1.219   -0.897  24.998 1.00 21.26 ? 66  PHE A CD1 1 
ATOM   478  C CD2 . PHE A 1 60  ? 1.888   -2.573  23.440 1.00 19.26 ? 66  PHE A CD2 1 
ATOM   479  C CE1 . PHE A 1 60  ? -0.050  -0.884  24.428 1.00 21.20 ? 66  PHE A CE1 1 
ATOM   480  C CE2 . PHE A 1 60  ? 0.628   -2.565  22.874 1.00 19.08 ? 66  PHE A CE2 1 
ATOM   481  C CZ  . PHE A 1 60  ? -0.337  -1.724  23.359 1.00 18.97 ? 66  PHE A CZ  1 
HETATM 482  N N1  . NRQ A 1 61  ? 6.826   -0.513  25.394 1.00 22.79 ? 67  NRQ A N1  1 
HETATM 483  C CE  . NRQ A 1 61  ? 6.976   -5.413  26.694 1.00 26.59 ? 67  NRQ A CE  1 
HETATM 484  S SD  . NRQ A 1 61  ? 7.730   -5.046  25.088 1.00 23.38 ? 67  NRQ A SD  1 
HETATM 485  C CG1 . NRQ A 1 61  ? 8.101   -3.264  25.071 1.00 25.28 ? 67  NRQ A CG1 1 
HETATM 486  C CB1 . NRQ A 1 61  ? 7.168   -2.514  24.113 1.00 24.26 ? 67  NRQ A CB1 1 
HETATM 487  C CA1 . NRQ A 1 61  ? 7.375   -1.025  24.395 1.00 23.92 ? 67  NRQ A CA1 1 
HETATM 488  C C1  . NRQ A 1 61  ? 8.277   -0.168  23.488 1.00 20.76 ? 67  NRQ A C1  1 
HETATM 489  N N2  . NRQ A 1 61  ? 9.120   -0.715  22.462 1.00 23.66 ? 67  NRQ A N2  1 
HETATM 490  O OH  . NRQ A 1 61  ? 9.985   -3.000  16.402 1.00 35.10 ? 67  NRQ A OH  1 
HETATM 491  C CD2 . NRQ A 1 61  ? 10.390  -1.784  19.775 1.00 36.21 ? 67  NRQ A CD2 1 
HETATM 492  C CE2 . NRQ A 1 61  ? 10.242  -2.610  18.696 1.00 38.91 ? 67  NRQ A CE2 1 
HETATM 493  C CZ  . NRQ A 1 61  ? 10.170  -2.075  17.432 1.00 35.33 ? 67  NRQ A CZ  1 
HETATM 494  C CE1 . NRQ A 1 61  ? 10.291  -0.698  17.218 1.00 38.95 ? 67  NRQ A CE1 1 
HETATM 495  C CD1 . NRQ A 1 61  ? 10.473  0.166   18.300 1.00 37.60 ? 67  NRQ A CD1 1 
HETATM 496  C CG2 . NRQ A 1 61  ? 10.500  -0.440  19.544 1.00 37.15 ? 67  NRQ A CG2 1 
HETATM 497  C CB2 . NRQ A 1 61  ? 10.690  0.354   20.831 1.00 22.47 ? 67  NRQ A CB2 1 
HETATM 498  C CA2 . NRQ A 1 61  ? 9.811   0.375   21.825 1.00 27.27 ? 67  NRQ A CA2 1 
HETATM 499  C C2  . NRQ A 1 61  ? 9.365   1.669   22.523 1.00 22.61 ? 67  NRQ A C2  1 
HETATM 500  O O2  . NRQ A 1 61  ? 9.699   2.775   22.280 1.00 25.21 ? 67  NRQ A O2  1 
HETATM 501  N N3  . NRQ A 1 61  ? 8.408   1.287   23.577 1.00 23.78 ? 67  NRQ A N3  1 
HETATM 502  C CA3 . NRQ A 1 61  ? 7.732   2.270   24.428 1.00 20.39 ? 67  NRQ A CA3 1 
HETATM 503  C C3  . NRQ A 1 61  ? 8.095   2.173   25.903 1.00 19.69 ? 67  NRQ A C3  1 
HETATM 504  O O3  . NRQ A 1 61  ? 7.580   2.964   26.729 1.00 24.51 ? 67  NRQ A O3  1 
ATOM   505  N N   . SER A 1 62  ? 9.353   1.552   26.160 1.00 18.69 ? 70  SER A N   1 
ATOM   506  C CA  . SER A 1 62  ? 9.732   1.229   27.525 1.00 19.08 ? 70  SER A CA  1 
ATOM   507  C C   . SER A 1 62  ? 11.263  1.260   27.595 1.00 20.75 ? 70  SER A C   1 
ATOM   508  O O   . SER A 1 62  ? 11.913  0.259   27.901 1.00 20.08 ? 70  SER A O   1 
ATOM   509  C CB  . SER A 1 62  ? 9.129   -0.132  27.909 1.00 19.52 ? 70  SER A CB  1 
ATOM   510  O OG  . SER A 1 62  ? 9.303   -0.430  29.281 1.00 21.50 ? 70  SER A OG  1 
ATOM   511  N N   . ARG A 1 63  ? 11.828  2.431   27.270 1.00 21.17 ? 71  ARG A N   1 
ATOM   512  C CA  . ARG A 1 63  ? 13.276  2.602   27.119 1.00 19.53 ? 71  ARG A CA  1 
ATOM   513  C C   . ARG A 1 63  ? 14.038  2.580   28.439 1.00 20.10 ? 71  ARG A C   1 
ATOM   514  O O   . ARG A 1 63  ? 15.270  2.528   28.408 1.00 19.74 ? 71  ARG A O   1 
ATOM   515  C CB  . ARG A 1 63  ? 13.600  3.887   26.349 1.00 23.16 ? 71  ARG A CB  1 
ATOM   516  C CG  . ARG A 1 63  ? 13.257  3.846   24.864 1.00 19.95 ? 71  ARG A CG  1 
ATOM   517  C CD  . ARG A 1 63  ? 14.364  3.217   24.036 1.00 26.78 ? 71  ARG A CD  1 
ATOM   518  N NE  . ARG A 1 63  ? 13.984  3.291   22.635 1.00 27.49 ? 71  ARG A NE  1 
ATOM   519  C CZ  . ARG A 1 63  ? 13.103  2.473   22.085 1.00 32.30 ? 71  ARG A CZ  1 
ATOM   520  N NH1 . ARG A 1 63  ? 12.622  1.436   22.754 1.00 28.59 ? 71  ARG A NH1 1 
ATOM   521  N NH2 . ARG A 1 63  ? 12.704  2.694   20.835 1.00 31.37 ? 71  ARG A NH2 1 
ATOM   522  N N   . ALA A 1 64  ? 13.364  2.602   29.590 1.00 17.50 ? 72  ALA A N   1 
ATOM   523  C CA  . ALA A 1 64  ? 14.090  2.371   30.833 1.00 18.03 ? 72  ALA A CA  1 
ATOM   524  C C   . ALA A 1 64  ? 14.699  0.978   30.886 1.00 18.65 ? 72  ALA A C   1 
ATOM   525  O O   . ALA A 1 64  ? 15.603  0.743   31.693 1.00 17.78 ? 72  ALA A O   1 
ATOM   526  C CB  . ALA A 1 64  ? 13.189  2.586   32.047 1.00 21.73 ? 72  ALA A CB  1 
ATOM   527  N N   . PHE A 1 65  ? 14.222  0.052   30.061 1.00 17.30 ? 73  PHE A N   1 
ATOM   528  C CA  . PHE A 1 65  ? 14.723  -1.323  30.027 1.00 16.62 ? 73  PHE A CA  1 
ATOM   529  C C   . PHE A 1 65  ? 15.670  -1.522  28.854 1.00 20.20 ? 73  PHE A C   1 
ATOM   530  O O   . PHE A 1 65  ? 15.471  -2.395  28.012 1.00 24.13 ? 73  PHE A O   1 
ATOM   531  C CB  . PHE A 1 65  ? 13.567  -2.317  29.934 1.00 18.15 ? 73  PHE A CB  1 
ATOM   532  C CG  . PHE A 1 65  ? 12.628  -2.301  31.109 1.00 16.40 ? 73  PHE A CG  1 
ATOM   533  C CD1 . PHE A 1 65  ? 11.639  -1.335  31.215 1.00 16.35 ? 73  PHE A CD1 1 
ATOM   534  C CD2 . PHE A 1 65  ? 12.702  -3.284  32.073 1.00 16.54 ? 73  PHE A CD2 1 
ATOM   535  C CE1 . PHE A 1 65  ? 10.772  -1.333  32.300 1.00 18.96 ? 73  PHE A CE1 1 
ATOM   536  C CE2 . PHE A 1 65  ? 11.817  -3.297  33.147 1.00 17.02 ? 73  PHE A CE2 1 
ATOM   537  C CZ  . PHE A 1 65  ? 10.867  -2.318  33.262 1.00 18.78 ? 73  PHE A CZ  1 
ATOM   538  N N   . THR A 1 66  ? 16.682  -0.676  28.747 1.00 19.75 ? 74  THR A N   1 
ATOM   539  C CA  . THR A 1 66  ? 17.695  -0.798  27.710 1.00 17.78 ? 74  THR A CA  1 
ATOM   540  C C   . THR A 1 66  ? 19.029  -0.994  28.405 1.00 15.94 ? 74  THR A C   1 
ATOM   541  O O   . THR A 1 66  ? 19.423  -0.158  29.229 1.00 18.86 ? 74  THR A O   1 
ATOM   542  C CB  . THR A 1 66  ? 17.750  0.478   26.870 1.00 19.09 ? 74  THR A CB  1 
ATOM   543  O OG1 . THR A 1 66  ? 16.454  0.755   26.313 1.00 20.17 ? 74  THR A OG1 1 
ATOM   544  C CG2 . THR A 1 66  ? 18.800  0.367   25.750 1.00 17.85 ? 74  THR A CG2 1 
ATOM   545  N N   . LYS A 1 67  ? 19.717  -2.086  28.071 1.00 16.23 ? 75  LYS A N   1 
ATOM   546  C CA  . LYS A 1 67  ? 21.052  -2.320  28.612 1.00 18.24 ? 75  LYS A CA  1 
ATOM   547  C C   . LYS A 1 67  ? 22.034  -1.332  27.991 1.00 19.56 ? 75  LYS A C   1 
ATOM   548  O O   . LYS A 1 67  ? 22.131  -1.225  26.766 1.00 18.77 ? 75  LYS A O   1 
ATOM   549  C CB  . LYS A 1 67  ? 21.469  -3.755  28.300 1.00 17.83 ? 75  LYS A CB  1 
ATOM   550  C CG  . LYS A 1 67  ? 22.860  -4.160  28.807 1.00 19.84 ? 75  LYS A CG  1 
ATOM   551  C CD  . LYS A 1 67  ? 23.119  -5.627  28.504 1.00 26.27 ? 75  LYS A CD  1 
ATOM   552  C CE  . LYS A 1 67  ? 24.488  -6.052  29.003 1.00 30.14 ? 75  LYS A CE  1 
ATOM   553  N NZ  . LYS A 1 67  ? 25.555  -5.464  28.156 1.00 39.12 ? 75  LYS A NZ  1 
ATOM   554  N N   . HIS A 1 68  ? 22.751  -0.598  28.840 1.00 19.97 ? 76  HIS A N   1 
ATOM   555  C CA  . HIS A 1 68  ? 23.757  0.356   28.394 1.00 18.19 ? 76  HIS A CA  1 
ATOM   556  C C   . HIS A 1 68  ? 25.137  -0.087  28.844 1.00 22.51 ? 76  HIS A C   1 
ATOM   557  O O   . HIS A 1 68  ? 25.297  -0.554  29.978 1.00 24.27 ? 76  HIS A O   1 
ATOM   558  C CB  . HIS A 1 68  ? 23.497  1.740   28.996 1.00 18.19 ? 76  HIS A CB  1 
ATOM   559  C CG  . HIS A 1 68  ? 22.416  2.519   28.308 1.00 16.70 ? 76  HIS A CG  1 
ATOM   560  N ND1 . HIS A 1 68  ? 21.099  2.104   28.265 1.00 17.60 ? 76  HIS A ND1 1 
ATOM   561  C CD2 . HIS A 1 68  ? 22.459  3.698   27.643 1.00 18.75 ? 76  HIS A CD2 1 
ATOM   562  C CE1 . HIS A 1 68  ? 20.385  2.993   27.599 1.00 18.85 ? 76  HIS A CE1 1 
ATOM   563  N NE2 . HIS A 1 68  ? 21.185  3.968   27.206 1.00 19.51 ? 76  HIS A NE2 1 
ATOM   564  N N   . PRO A 1 69  ? 26.146  0.058   27.997 1.00 21.68 ? 77  PRO A N   1 
ATOM   565  C CA  . PRO A 1 69  ? 27.518  -0.108  28.480 1.00 23.56 ? 77  PRO A CA  1 
ATOM   566  C C   . PRO A 1 69  ? 27.844  0.998   29.467 1.00 23.11 ? 77  PRO A C   1 
ATOM   567  O O   . PRO A 1 69  ? 27.207  2.053   29.503 1.00 21.58 ? 77  PRO A O   1 
ATOM   568  C CB  . PRO A 1 69  ? 28.366  0.009   27.212 1.00 24.07 ? 77  PRO A CB  1 
ATOM   569  C CG  . PRO A 1 69  ? 27.555  0.791   26.278 1.00 25.18 ? 77  PRO A CG  1 
ATOM   570  C CD  . PRO A 1 69  ? 26.094  0.519   26.602 1.00 21.65 ? 77  PRO A CD  1 
ATOM   571  N N   . ALA A 1 70  ? 28.868  0.734   30.284 1.00 25.96 ? 78  ALA A N   1 
ATOM   572  C CA  . ALA A 1 70  ? 29.237  1.674   31.332 1.00 28.42 ? 78  ALA A CA  1 
ATOM   573  C C   . ALA A 1 70  ? 29.608  3.041   30.770 1.00 24.61 ? 78  ALA A C   1 
ATOM   574  O O   . ALA A 1 70  ? 29.394  4.061   31.435 1.00 27.93 ? 78  ALA A O   1 
ATOM   575  C CB  . ALA A 1 70  ? 30.392  1.094   32.154 1.00 29.38 ? 78  ALA A CB  1 
ATOM   576  N N   . ASP A 1 71  ? 30.129  3.092   29.546 1.00 23.35 ? 79  ASP A N   1 
ATOM   577  C CA  . ASP A 1 71  ? 30.612  4.346   28.987 1.00 25.00 ? 79  ASP A CA  1 
ATOM   578  C C   . ASP A 1 71  ? 29.568  5.124   28.187 1.00 25.81 ? 79  ASP A C   1 
ATOM   579  O O   . ASP A 1 71  ? 29.905  6.164   27.613 1.00 24.43 ? 79  ASP A O   1 
ATOM   580  C CB  . ASP A 1 71  ? 31.952  4.155   28.242 1.00 22.64 ? 79  ASP A CB  1 
ATOM   581  C CG  . ASP A 1 71  ? 31.827  3.341   26.956 1.00 28.58 ? 79  ASP A CG  1 
ATOM   582  O OD1 . ASP A 1 71  ? 30.722  2.862   26.645 1.00 26.68 ? 79  ASP A OD1 1 
ATOM   583  O OD2 . ASP A 1 71  ? 32.857  3.152   26.257 1.00 25.85 ? 79  ASP A OD2 1 
ATOM   584  N N   . ILE A 1 72  ? 28.313  4.681   28.160 1.00 20.18 ? 80  ILE A N   1 
ATOM   585  C CA  . ILE A 1 72  ? 27.250  5.472   27.548 1.00 22.11 ? 80  ILE A CA  1 
ATOM   586  C C   . ILE A 1 72  ? 26.290  5.905   28.656 1.00 20.67 ? 80  ILE A C   1 
ATOM   587  O O   . ILE A 1 72  ? 25.619  5.048   29.259 1.00 20.85 ? 80  ILE A O   1 
ATOM   588  C CB  . ILE A 1 72  ? 26.520  4.701   26.440 1.00 20.18 ? 80  ILE A CB  1 
ATOM   589  C CG1 . ILE A 1 72  ? 27.510  4.290   25.340 1.00 17.50 ? 80  ILE A CG1 1 
ATOM   590  C CG2 . ILE A 1 72  ? 25.400  5.556   25.859 1.00 18.85 ? 80  ILE A CG2 1 
ATOM   591  C CD1 . ILE A 1 72  ? 26.891  3.527   24.198 1.00 23.48 ? 80  ILE A CD1 1 
ATOM   592  N N   . PRO A 1 73  ? 26.180  7.203   28.951 1.00 20.72 ? 81  PRO A N   1 
ATOM   593  C CA  . PRO A 1 73  ? 25.208  7.655   29.955 1.00 19.01 ? 81  PRO A CA  1 
ATOM   594  C C   . PRO A 1 73  ? 23.816  7.218   29.548 1.00 16.12 ? 81  PRO A C   1 
ATOM   595  O O   . PRO A 1 73  ? 23.452  7.297   28.377 1.00 18.37 ? 81  PRO A O   1 
ATOM   596  C CB  . PRO A 1 73  ? 25.328  9.180   29.905 1.00 20.04 ? 81  PRO A CB  1 
ATOM   597  C CG  . PRO A 1 73  ? 26.760  9.408   29.469 1.00 22.21 ? 81  PRO A CG  1 
ATOM   598  C CD  . PRO A 1 73  ? 27.021  8.311   28.463 1.00 21.96 ? 81  PRO A CD  1 
ATOM   599  N N   . ASP A 1 74  ? 23.036  6.794   30.542 1.00 18.70 ? 82  ASP A N   1 
ATOM   600  C CA  . ASP A 1 74  ? 21.704  6.222   30.323 1.00 17.89 ? 82  ASP A CA  1 
ATOM   601  C C   . ASP A 1 74  ? 20.681  7.340   30.477 1.00 17.65 ? 82  ASP A C   1 
ATOM   602  O O   . ASP A 1 74  ? 20.309  7.705   31.596 1.00 18.18 ? 82  ASP A O   1 
ATOM   603  C CB  . ASP A 1 74  ? 21.460  5.116   31.340 1.00 19.25 ? 82  ASP A CB  1 
ATOM   604  C CG  . ASP A 1 74  ? 20.220  4.280   31.022 1.00 18.92 ? 82  ASP A CG  1 
ATOM   605  O OD1 . ASP A 1 74  ? 19.197  4.844   30.577 1.00 18.92 ? 82  ASP A OD1 1 
ATOM   606  O OD2 . ASP A 1 74  ? 20.301  3.052   31.228 1.00 20.18 ? 82  ASP A OD2 1 
ATOM   607  N N   . TYR A 1 75  ? 20.223  7.887   29.344 1.00 17.37 ? 83  TYR A N   1 
ATOM   608  C CA  . TYR A 1 75  ? 19.336  9.048   29.369 1.00 17.10 ? 83  TYR A CA  1 
ATOM   609  C C   . TYR A 1 75  ? 18.074  8.756   30.164 1.00 17.02 ? 83  TYR A C   1 
ATOM   610  O O   . TYR A 1 75  ? 17.608  9.592   30.954 1.00 17.57 ? 83  TYR A O   1 
ATOM   611  C CB  . TYR A 1 75  ? 18.969  9.429   27.931 1.00 17.36 ? 83  TYR A CB  1 
ATOM   612  C CG  . TYR A 1 75  ? 18.148  10.680  27.782 1.00 16.11 ? 83  TYR A CG  1 
ATOM   613  C CD1 . TYR A 1 75  ? 18.736  11.942  27.846 1.00 18.83 ? 83  TYR A CD1 1 
ATOM   614  C CD2 . TYR A 1 75  ? 16.781  10.606  27.569 1.00 17.88 ? 83  TYR A CD2 1 
ATOM   615  C CE1 . TYR A 1 75  ? 17.990  13.084  27.703 1.00 17.99 ? 83  TYR A CE1 1 
ATOM   616  C CE2 . TYR A 1 75  ? 16.025  11.743  27.432 1.00 19.74 ? 83  TYR A CE2 1 
ATOM   617  C CZ  . TYR A 1 75  ? 16.637  12.990  27.504 1.00 17.17 ? 83  TYR A CZ  1 
ATOM   618  O OH  . TYR A 1 75  ? 15.886  14.128  27.360 1.00 18.15 ? 83  TYR A OH  1 
ATOM   619  N N   . TRP A 1 76  ? 17.510  7.570   29.967 1.00 15.91 ? 84  TRP A N   1 
ATOM   620  C CA  . TRP A 1 76  ? 16.212  7.280   30.555 1.00 17.96 ? 84  TRP A CA  1 
ATOM   621  C C   . TRP A 1 76  ? 16.320  6.939   32.033 1.00 16.60 ? 84  TRP A C   1 
ATOM   622  O O   . TRP A 1 76  ? 15.524  7.438   32.835 1.00 18.04 ? 84  TRP A O   1 
ATOM   623  C CB  . TRP A 1 76  ? 15.528  6.171   29.764 1.00 16.24 ? 84  TRP A CB  1 
ATOM   624  C CG  . TRP A 1 76  ? 15.355  6.515   28.331 1.00 15.58 ? 84  TRP A CG  1 
ATOM   625  C CD1 . TRP A 1 76  ? 14.323  7.224   27.785 1.00 16.33 ? 84  TRP A CD1 1 
ATOM   626  C CD2 . TRP A 1 76  ? 16.244  6.193   27.248 1.00 17.85 ? 84  TRP A CD2 1 
ATOM   627  N NE1 . TRP A 1 76  ? 14.509  7.356   26.428 1.00 18.02 ? 84  TRP A NE1 1 
ATOM   628  C CE2 . TRP A 1 76  ? 15.671  6.723   26.072 1.00 17.06 ? 84  TRP A CE2 1 
ATOM   629  C CE3 . TRP A 1 76  ? 17.457  5.491   27.157 1.00 16.16 ? 84  TRP A CE3 1 
ATOM   630  C CZ2 . TRP A 1 76  ? 16.264  6.587   24.824 1.00 16.61 ? 84  TRP A CZ2 1 
ATOM   631  C CZ3 . TRP A 1 76  ? 18.047  5.352   25.910 1.00 17.19 ? 84  TRP A CZ3 1 
ATOM   632  C CH2 . TRP A 1 76  ? 17.450  5.900   24.762 1.00 19.02 ? 84  TRP A CH2 1 
ATOM   633  N N   . LYS A 1 77  ? 17.295  6.104   32.429 1.00 16.50 ? 85  LYS A N   1 
ATOM   634  C CA  . LYS A 1 77  ? 17.372  5.721   33.840 1.00 16.19 ? 85  LYS A CA  1 
ATOM   635  C C   . LYS A 1 77  ? 17.688  6.923   34.718 1.00 17.75 ? 85  LYS A C   1 
ATOM   636  O O   . LYS A 1 77  ? 17.168  7.040   35.833 1.00 19.06 ? 85  LYS A O   1 
ATOM   637  C CB  . LYS A 1 77  ? 18.372  4.589   34.050 1.00 17.01 ? 85  LYS A CB  1 
ATOM   638  C CG  . LYS A 1 77  ? 17.894  3.247   33.498 1.00 17.23 ? 85  LYS A CG  1 
ATOM   639  C CD  . LYS A 1 77  ? 18.808  2.124   33.970 1.00 19.59 ? 85  LYS A CD  1 
ATOM   640  C CE  . LYS A 1 77  ? 18.456  0.779   33.330 1.00 19.28 ? 85  LYS A CE  1 
ATOM   641  N NZ  . LYS A 1 77  ? 18.639  0.725   31.844 1.00 18.81 ? 85  LYS A NZ  1 
ATOM   642  N N   . GLN A 1 78  ? 18.512  7.843   34.216 1.00 18.29 ? 86  GLN A N   1 
ATOM   643  C CA  . GLN A 1 78  ? 18.864  9.030   34.987 1.00 20.66 ? 86  GLN A CA  1 
ATOM   644  C C   . GLN A 1 78  ? 17.678  9.953   35.217 1.00 20.49 ? 86  GLN A C   1 
ATOM   645  O O   . GLN A 1 78  ? 17.731  10.794  36.121 1.00 20.70 ? 86  GLN A O   1 
ATOM   646  C CB  . GLN A 1 78  ? 19.892  9.852   34.227 1.00 17.94 ? 86  GLN A CB  1 
ATOM   647  C CG  . GLN A 1 78  ? 21.292  9.319   34.223 1.00 19.12 ? 86  GLN A CG  1 
ATOM   648  C CD  . GLN A 1 78  ? 22.176  10.263  33.462 1.00 21.18 ? 86  GLN A CD  1 
ATOM   649  O OE1 . GLN A 1 78  ? 22.674  11.237  34.026 1.00 21.59 ? 86  GLN A OE1 1 
ATOM   650  N NE2 . GLN A 1 78  ? 22.300  10.041  32.158 1.00 18.13 ? 86  GLN A NE2 1 
ATOM   651  N N   . SER A 1 79  ? 16.621  9.836   34.411 1.00 16.77 ? 87  SER A N   1 
ATOM   652  C CA  . SER A 1 79  ? 15.526  10.792  34.483 1.00 16.67 ? 87  SER A CA  1 
ATOM   653  C C   . SER A 1 79  ? 14.601  10.552  35.667 1.00 18.49 ? 87  SER A C   1 
ATOM   654  O O   . SER A 1 79  ? 13.750  11.407  35.950 1.00 20.38 ? 87  SER A O   1 
ATOM   655  C CB  . SER A 1 79  ? 14.706  10.762  33.185 1.00 18.91 ? 87  SER A CB  1 
ATOM   656  O OG  . SER A 1 79  ? 13.881  9.602   33.124 1.00 20.31 ? 87  SER A OG  1 
ATOM   657  N N   . PHE A 1 80  ? 14.747  9.449   36.347 1.00 17.99 ? 88  PHE A N   1 
ATOM   658  C CA  . PHE A 1 80  ? 13.842  9.083   37.423 1.00 19.99 ? 88  PHE A CA  1 
ATOM   659  C C   . PHE A 1 80  ? 14.320  9.666   38.744 1.00 23.17 ? 88  PHE A C   1 
ATOM   660  O O   . PHE A 1 80  ? 15.497  10.004  38.895 1.00 21.67 ? 88  PHE A O   1 
ATOM   661  C CB  . PHE A 1 80  ? 13.721  7.562   37.477 1.00 20.38 ? 88  PHE A CB  1 
ATOM   662  C CG  . PHE A 1 80  ? 12.938  7.013   36.319 1.00 16.05 ? 88  PHE A CG  1 
ATOM   663  C CD1 . PHE A 1 80  ? 11.549  7.059   36.321 1.00 19.48 ? 88  PHE A CD1 1 
ATOM   664  C CD2 . PHE A 1 80  ? 13.582  6.514   35.203 1.00 20.47 ? 88  PHE A CD2 1 
ATOM   665  C CE1 . PHE A 1 80  ? 10.820  6.593   35.241 1.00 19.39 ? 88  PHE A CE1 1 
ATOM   666  C CE2 . PHE A 1 80  ? 12.855  6.040   34.121 1.00 18.57 ? 88  PHE A CE2 1 
ATOM   667  C CZ  . PHE A 1 80  ? 11.471  6.072   34.145 1.00 18.95 ? 88  PHE A CZ  1 
ATOM   668  N N   . PRO A 1 81  ? 13.420  9.816   39.730 1.00 23.25 ? 89  PRO A N   1 
ATOM   669  C CA  . PRO A 1 81  ? 12.024  9.342   39.759 1.00 19.83 ? 89  PRO A CA  1 
ATOM   670  C C   . PRO A 1 81  ? 11.048  10.139  38.899 1.00 20.70 ? 89  PRO A C   1 
ATOM   671  O O   . PRO A 1 81  ? 9.974   9.629   38.599 1.00 20.99 ? 89  PRO A O   1 
ATOM   672  C CB  . PRO A 1 81  ? 11.653  9.446   41.244 1.00 21.39 ? 89  PRO A CB  1 
ATOM   673  C CG  . PRO A 1 81  ? 12.500  10.556  41.758 1.00 23.05 ? 89  PRO A CG  1 
ATOM   674  C CD  . PRO A 1 81  ? 13.799  10.471  40.993 1.00 25.19 ? 89  PRO A CD  1 
ATOM   675  N N   . GLU A 1 82  ? 11.384  11.355  38.464 1.00 21.76 ? 90  GLU A N   1 
ATOM   676  C CA  . GLU A 1 82  ? 10.425  12.175  37.729 1.00 23.31 ? 90  GLU A CA  1 
ATOM   677  C C   . GLU A 1 82  ? 9.981   11.499  36.433 1.00 21.98 ? 90  GLU A C   1 
ATOM   678  O O   . GLU A 1 82  ? 8.784   11.442  36.128 1.00 22.52 ? 90  GLU A O   1 
ATOM   679  C CB  . GLU A 1 82  ? 11.015  13.560  37.461 1.00 26.64 ? 90  GLU A CB  1 
ATOM   680  C CG  . GLU A 1 82  ? 11.164  14.421  38.712 1.00 31.67 ? 90  GLU A CG  1 
ATOM   681  C CD  . GLU A 1 82  ? 12.476  14.185  39.450 1.00 30.58 ? 90  GLU A CD  1 
ATOM   682  O OE1 . GLU A 1 82  ? 13.148  13.166  39.197 1.00 30.24 ? 90  GLU A OE1 1 
ATOM   683  O OE2 . GLU A 1 82  ? 12.851  15.036  40.288 1.00 34.89 ? 90  GLU A OE2 1 
ATOM   684  N N   . GLY A 1 83  ? 10.923  10.971  35.665 1.00 19.67 ? 91  GLY A N   1 
ATOM   685  C CA  . GLY A 1 83  ? 10.598  10.265  34.438 1.00 18.96 ? 91  GLY A CA  1 
ATOM   686  C C   . GLY A 1 83  ? 10.826  11.075  33.176 1.00 19.96 ? 91  GLY A C   1 
ATOM   687  O O   . GLY A 1 83  ? 11.625  12.016  33.124 1.00 17.75 ? 91  GLY A O   1 
ATOM   688  N N   . PHE A 1 84  ? 10.128  10.671  32.118 1.00 17.61 ? 92  PHE A N   1 
ATOM   689  C CA  . PHE A 1 84  ? 10.366  11.256  30.806 1.00 16.52 ? 92  PHE A CA  1 
ATOM   690  C C   . PHE A 1 84  ? 9.104   11.119  29.970 1.00 16.81 ? 92  PHE A C   1 
ATOM   691  O O   . PHE A 1 84  ? 8.171   10.385  30.321 1.00 18.79 ? 92  PHE A O   1 
ATOM   692  C CB  . PHE A 1 84  ? 11.577  10.619  30.095 1.00 17.07 ? 92  PHE A CB  1 
ATOM   693  C CG  . PHE A 1 84  ? 11.425  9.146   29.813 1.00 16.28 ? 92  PHE A CG  1 
ATOM   694  C CD1 . PHE A 1 84  ? 11.757  8.205   30.771 1.00 17.01 ? 92  PHE A CD1 1 
ATOM   695  C CD2 . PHE A 1 84  ? 10.959  8.709   28.584 1.00 19.58 ? 92  PHE A CD2 1 
ATOM   696  C CE1 . PHE A 1 84  ? 11.622  6.844   30.518 1.00 17.79 ? 92  PHE A CE1 1 
ATOM   697  C CE2 . PHE A 1 84  ? 10.826  7.358   28.322 1.00 19.80 ? 92  PHE A CE2 1 
ATOM   698  C CZ  . PHE A 1 84  ? 11.155  6.424   29.291 1.00 19.89 ? 92  PHE A CZ  1 
ATOM   699  N N   . LYS A 1 85  ? 9.081   11.850  28.869 1.00 17.54 ? 93  LYS A N   1 
ATOM   700  C CA  . LYS A 1 85  ? 8.021   11.783  27.883 1.00 17.72 ? 93  LYS A CA  1 
ATOM   701  C C   . LYS A 1 85  ? 8.635   11.400  26.547 1.00 20.07 ? 93  LYS A C   1 
ATOM   702  O O   . LYS A 1 85  ? 9.827   11.595  26.308 1.00 18.91 ? 93  LYS A O   1 
ATOM   703  C CB  . LYS A 1 85  ? 7.325   13.137  27.714 1.00 21.19 ? 93  LYS A CB  1 
ATOM   704  C CG  . LYS A 1 85  ? 6.450   13.542  28.886 1.00 25.54 ? 93  LYS A CG  1 
ATOM   705  C CD  . LYS A 1 85  ? 5.757   14.866  28.594 1.00 27.55 ? 93  LYS A CD  1 
ATOM   706  C CE  . LYS A 1 85  ? 6.692   16.042  28.826 1.00 32.06 ? 93  LYS A CE  1 
ATOM   707  N NZ  . LYS A 1 85  ? 6.009   17.165  29.539 1.00 45.11 ? 93  LYS A NZ  1 
ATOM   708  N N   . TRP A 1 86  ? 7.828   10.847  25.656 1.00 16.52 ? 94  TRP A N   1 
ATOM   709  C CA  . TRP A 1 86  ? 8.293   10.643  24.297 1.00 16.44 ? 94  TRP A CA  1 
ATOM   710  C C   . TRP A 1 86  ? 7.154   10.867  23.312 1.00 19.43 ? 94  TRP A C   1 
ATOM   711  O O   . TRP A 1 86  ? 5.978   10.678  23.641 1.00 18.62 ? 94  TRP A O   1 
ATOM   712  C CB  . TRP A 1 86  ? 9.037   9.304   24.078 1.00 17.72 ? 94  TRP A CB  1 
ATOM   713  C CG  . TRP A 1 86  ? 8.289   8.029   24.381 1.00 17.74 ? 94  TRP A CG  1 
ATOM   714  C CD1 . TRP A 1 86  ? 8.298   7.332   25.558 1.00 18.99 ? 94  TRP A CD1 1 
ATOM   715  C CD2 . TRP A 1 86  ? 7.463   7.274   23.478 1.00 16.50 ? 94  TRP A CD2 1 
ATOM   716  N NE1 . TRP A 1 86  ? 7.514   6.206   25.454 1.00 20.51 ? 94  TRP A NE1 1 
ATOM   717  C CE2 . TRP A 1 86  ? 7.003   6.138   24.182 1.00 17.90 ? 94  TRP A CE2 1 
ATOM   718  C CE3 . TRP A 1 86  ? 7.077   7.447   22.146 1.00 17.64 ? 94  TRP A CE3 1 
ATOM   719  C CZ2 . TRP A 1 86  ? 6.145   5.194   23.605 1.00 20.25 ? 94  TRP A CZ2 1 
ATOM   720  C CZ3 . TRP A 1 86  ? 6.226   6.503   21.572 1.00 18.08 ? 94  TRP A CZ3 1 
ATOM   721  C CH2 . TRP A 1 86  ? 5.783   5.387   22.301 1.00 18.70 ? 94  TRP A CH2 1 
ATOM   722  N N   . GLU A 1 87  ? 7.512   11.333  22.119 1.00 17.77 ? 95  GLU A N   1 
ATOM   723  C CA  . GLU A 1 87  ? 6.577   11.501  21.017 1.00 18.47 ? 95  GLU A CA  1 
ATOM   724  C C   . GLU A 1 87  ? 7.182   10.916  19.761 1.00 20.22 ? 95  GLU A C   1 
ATOM   725  O O   . GLU A 1 87  ? 8.390   11.038  19.527 1.00 20.48 ? 95  GLU A O   1 
ATOM   726  C CB  . GLU A 1 87  ? 6.190   12.959  20.769 1.00 20.92 ? 95  GLU A CB  1 
ATOM   727  C CG  . GLU A 1 87  ? 5.691   13.655  22.006 1.00 25.66 ? 95  GLU A CG  1 
ATOM   728  C CD  . GLU A 1 87  ? 6.819   14.164  22.872 1.00 28.88 ? 95  GLU A CD  1 
ATOM   729  O OE1 . GLU A 1 87  ? 6.652   14.199  24.111 1.00 33.80 ? 95  GLU A OE1 1 
ATOM   730  O OE2 . GLU A 1 87  ? 7.864   14.550  22.304 1.00 29.83 ? 95  GLU A OE2 1 
ATOM   731  N N   . ARG A 1 88  ? 6.318   10.281  18.979 1.00 17.60 ? 96  ARG A N   1 
ATOM   732  C CA  . ARG A 1 88  ? 6.808   9.514   17.824 1.00 17.70 ? 96  ARG A CA  1 
ATOM   733  C C   . ARG A 1 88  ? 5.897   9.671   16.618 1.00 16.62 ? 96  ARG A C   1 
ATOM   734  O O   . ARG A 1 88  ? 4.702   9.909   16.802 1.00 17.36 ? 96  ARG A O   1 
ATOM   735  C CB  . ARG A 1 88  ? 6.845   8.032   18.213 1.00 17.59 ? 96  ARG A CB  1 
ATOM   736  C CG  . ARG A 1 88  ? 7.133   7.055   17.083 1.00 16.78 ? 96  ARG A CG  1 
ATOM   737  C CD  . ARG A 1 88  ? 7.282   5.644   17.617 1.00 18.81 ? 96  ARG A CD  1 
ATOM   738  N NE  . ARG A 1 88  ? 8.392   5.529   18.551 1.00 18.15 ? 96  ARG A NE  1 
ATOM   739  C CZ  . ARG A 1 88  ? 8.606   4.503   19.365 1.00 20.11 ? 96  ARG A CZ  1 
ATOM   740  N NH1 . ARG A 1 88  ? 7.677   3.582   19.540 1.00 19.97 ? 96  ARG A NH1 1 
ATOM   741  N NH2 . ARG A 1 88  ? 9.752   4.407   20.015 1.00 20.97 ? 96  ARG A NH2 1 
ATOM   742  N N   . VAL A 1 89  ? 6.505   9.633   15.456 1.00 17.51 ? 97  VAL A N   1 
ATOM   743  C CA  . VAL A 1 89  ? 5.722   9.597   14.207 1.00 17.93 ? 97  VAL A CA  1 
ATOM   744  C C   . VAL A 1 89  ? 6.225   8.388   13.423 1.00 19.37 ? 97  VAL A C   1 
ATOM   745  O O   . VAL A 1 89  ? 7.429   8.200   13.322 1.00 19.10 ? 97  VAL A O   1 
ATOM   746  C CB  . VAL A 1 89  ? 5.820   10.889  13.384 1.00 21.54 ? 97  VAL A CB  1 
ATOM   747  C CG1 . VAL A 1 89  ? 5.179   10.716  12.017 1.00 27.02 ? 97  VAL A CG1 1 
ATOM   748  C CG2 . VAL A 1 89  ? 5.201   12.062  14.122 1.00 23.32 ? 97  VAL A CG2 1 
ATOM   749  N N   . MET A 1 90  ? 5.291   7.581   12.950 1.00 18.15 ? 98  MET A N   1 
ATOM   750  C CA  . MET A 1 90  ? 5.648   6.419   12.119 1.00 17.81 ? 98  MET A CA  1 
ATOM   751  C C   . MET A 1 90  ? 5.012   6.609   10.747 1.00 19.04 ? 98  MET A C   1 
ATOM   752  O O   . MET A 1 90  ? 3.799   6.789   10.676 1.00 19.92 ? 98  MET A O   1 
ATOM   753  C CB  . MET A 1 90  ? 5.172   5.145   12.803 1.00 21.03 ? 98  MET A CB  1 
ATOM   754  C CG  . MET A 1 90  ? 5.535   5.165   14.265 1.00 21.79 ? 98  MET A CG  1 
ATOM   755  S SD  . MET A 1 90  ? 4.363   4.242   15.252 1.00 37.70 ? 98  MET A SD  1 
ATOM   756  C CE  . MET A 1 90  ? 4.859   2.603   14.736 1.00 11.23 ? 98  MET A CE  1 
ATOM   757  N N   . ASN A 1 91  ? 5.846   6.638   9.724  1.00 18.16 ? 99  ASN A N   1 
ATOM   758  C CA  . ASN A 1 91  ? 5.366   6.855   8.344  1.00 16.82 ? 99  ASN A CA  1 
ATOM   759  C C   . ASN A 1 91  ? 5.589   5.570   7.558  1.00 17.96 ? 99  ASN A C   1 
ATOM   760  O O   . ASN A 1 91  ? 6.723   5.116   7.478  1.00 19.55 ? 99  ASN A O   1 
ATOM   761  C CB  . ASN A 1 91  ? 6.034   8.071   7.706  1.00 20.27 ? 99  ASN A CB  1 
ATOM   762  C CG  . ASN A 1 91  ? 5.607   9.367   8.355  1.00 24.90 ? 99  ASN A CG  1 
ATOM   763  O OD1 . ASN A 1 91  ? 6.404   10.025  9.013  1.00 29.87 ? 99  ASN A OD1 1 
ATOM   764  N ND2 . ASN A 1 91  ? 4.350   9.731   8.180  1.00 25.72 ? 99  ASN A ND2 1 
ATOM   765  N N   . PHE A 1 92  ? 4.509   5.018   7.038  1.00 16.45 ? 100 PHE A N   1 
ATOM   766  C CA  . PHE A 1 92  ? 4.572   3.729   6.323  1.00 17.23 ? 100 PHE A CA  1 
ATOM   767  C C   . PHE A 1 92  ? 4.626   3.953   4.818  1.00 17.76 ? 100 PHE A C   1 
ATOM   768  O O   . PHE A 1 92  ? 4.139   4.966   4.329  1.00 17.55 ? 100 PHE A O   1 
ATOM   769  C CB  . PHE A 1 92  ? 3.403   2.851   6.768  1.00 16.36 ? 100 PHE A CB  1 
ATOM   770  C CG  . PHE A 1 92  ? 3.460   2.433   8.213  1.00 18.31 ? 100 PHE A CG  1 
ATOM   771  C CD1 . PHE A 1 92  ? 2.994   3.268   9.213  1.00 17.65 ? 100 PHE A CD1 1 
ATOM   772  C CD2 . PHE A 1 92  ? 4.000   1.213   8.572  1.00 17.53 ? 100 PHE A CD2 1 
ATOM   773  C CE1 . PHE A 1 92  ? 3.057   2.884   10.540 1.00 16.84 ? 100 PHE A CE1 1 
ATOM   774  C CE2 . PHE A 1 92  ? 4.058   0.828   9.900  1.00 18.98 ? 100 PHE A CE2 1 
ATOM   775  C CZ  . PHE A 1 92  ? 3.592   1.667   10.881 1.00 18.95 ? 100 PHE A CZ  1 
ATOM   776  N N   . GLU A 1 93  ? 5.175   2.972   4.116  1.00 17.95 ? 101 GLU A N   1 
ATOM   777  C CA  . GLU A 1 93  ? 5.445   3.158   2.700  1.00 16.76 ? 101 GLU A CA  1 
ATOM   778  C C   . GLU A 1 93  ? 4.184   3.277   1.854  1.00 18.98 ? 101 GLU A C   1 
ATOM   779  O O   . GLU A 1 93  ? 4.264   3.795   0.736  1.00 20.25 ? 101 GLU A O   1 
ATOM   780  C CB  . GLU A 1 93  ? 6.333   2.028   2.188  1.00 17.82 ? 101 GLU A CB  1 
ATOM   781  C CG  . GLU A 1 93  ? 5.682   0.676   2.270  1.00 17.20 ? 101 GLU A CG  1 
ATOM   782  C CD  . GLU A 1 93  ? 6.437   -0.331  1.452  1.00 19.16 ? 101 GLU A CD  1 
ATOM   783  O OE1 . GLU A 1 93  ? 6.191   -0.413  0.233  1.00 18.83 ? 101 GLU A OE1 1 
ATOM   784  O OE2 . GLU A 1 93  ? 7.299   -1.032  2.022  1.00 19.63 ? 101 GLU A OE2 1 
ATOM   785  N N   . ASP A 1 94  ? 3.035   2.805   2.345  1.00 18.89 ? 102 ASP A N   1 
ATOM   786  C CA  . ASP A 1 94  ? 1.769   2.939   1.624  1.00 18.87 ? 102 ASP A CA  1 
ATOM   787  C C   . ASP A 1 94  ? 0.951   4.140   2.076  1.00 20.52 ? 102 ASP A C   1 
ATOM   788  O O   . ASP A 1 94  ? -0.243  4.225   1.758  1.00 20.72 ? 102 ASP A O   1 
ATOM   789  C CB  . ASP A 1 94  ? 0.948   1.639   1.673  1.00 19.59 ? 102 ASP A CB  1 
ATOM   790  C CG  . ASP A 1 94  ? 0.467   1.279   3.065  1.00 21.42 ? 102 ASP A CG  1 
ATOM   791  O OD1 . ASP A 1 94  ? 0.874   1.934   4.051  1.00 19.25 ? 102 ASP A OD1 1 
ATOM   792  O OD2 . ASP A 1 94  ? -0.349  0.330   3.167  1.00 19.79 ? 102 ASP A OD2 1 
ATOM   793  N N   . GLY A 1 95  ? 1.555   5.076   2.803  1.00 18.95 ? 103 GLY A N   1 
ATOM   794  C CA  . GLY A 1 95  ? 0.878   6.300   3.169  1.00 19.34 ? 103 GLY A CA  1 
ATOM   795  C C   . GLY A 1 95  ? 0.268   6.312   4.553  1.00 18.96 ? 103 GLY A C   1 
ATOM   796  O O   . GLY A 1 95  ? -0.141  7.384   5.019  1.00 20.39 ? 103 GLY A O   1 
ATOM   797  N N   . GLY A 1 96  ? 0.191   5.169   5.230  1.00 18.38 ? 104 GLY A N   1 
ATOM   798  C CA  . GLY A 1 96  ? -0.278  5.187   6.602  1.00 19.48 ? 104 GLY A CA  1 
ATOM   799  C C   . GLY A 1 96  ? 0.643   6.008   7.487  1.00 17.59 ? 104 GLY A C   1 
ATOM   800  O O   . GLY A 1 96  ? 1.860   6.059   7.285  1.00 18.61 ? 104 GLY A O   1 
ATOM   801  N N   . ALA A 1 97  ? 0.054   6.679   8.469  1.00 17.94 ? 105 ALA A N   1 
ATOM   802  C CA  . ALA A 1 97  ? 0.816   7.512   9.385  1.00 18.72 ? 105 ALA A CA  1 
ATOM   803  C C   . ALA A 1 97  ? 0.246   7.393   10.786 1.00 19.13 ? 105 ALA A C   1 
ATOM   804  O O   . ALA A 1 97  ? -0.971  7.336   10.966 1.00 18.63 ? 105 ALA A O   1 
ATOM   805  C CB  . ALA A 1 97  ? 0.806   8.980   8.958  1.00 23.65 ? 105 ALA A CB  1 
ATOM   806  N N   . VAL A 1 98  ? 1.126   7.362   11.780 1.00 17.33 ? 106 VAL A N   1 
ATOM   807  C CA  . VAL A 1 98  ? 0.728   7.199   13.173 1.00 16.60 ? 106 VAL A CA  1 
ATOM   808  C C   . VAL A 1 98  ? 1.505   8.196   14.012 1.00 17.95 ? 106 VAL A C   1 
ATOM   809  O O   . VAL A 1 98  ? 2.740   8.249   13.938 1.00 19.66 ? 106 VAL A O   1 
ATOM   810  C CB  . VAL A 1 98  ? 1.009   5.779   13.701 1.00 17.70 ? 106 VAL A CB  1 
ATOM   811  C CG1 . VAL A 1 98  ? 0.558   5.646   15.147 1.00 19.03 ? 106 VAL A CG1 1 
ATOM   812  C CG2 . VAL A 1 98  ? 0.321   4.744   12.843 1.00 18.20 ? 106 VAL A CG2 1 
ATOM   813  N N   . SER A 1 99  ? 0.797   8.953   14.834 1.00 17.69 ? 107 SER A N   1 
ATOM   814  C CA  . SER A 1 99  ? 1.415   9.812   15.832 1.00 16.72 ? 107 SER A CA  1 
ATOM   815  C C   . SER A 1 99  ? 1.178   9.210   17.207 1.00 16.99 ? 107 SER A C   1 
ATOM   816  O O   . SER A 1 99  ? 0.082   8.714   17.498 1.00 17.21 ? 107 SER A O   1 
ATOM   817  C CB  . SER A 1 99  ? 0.823   11.216  15.772 1.00 23.32 ? 107 SER A CB  1 
ATOM   818  O OG  . SER A 1 99  ? 1.178   11.835  14.545 1.00 30.86 ? 107 SER A OG  1 
ATOM   819  N N   . VAL A 1 100 ? 2.208   9.215   18.046 1.00 17.49 ? 108 VAL A N   1 
ATOM   820  C CA  . VAL A 1 100 ? 2.135   8.641   19.382 1.00 15.18 ? 108 VAL A CA  1 
ATOM   821  C C   . VAL A 1 100 ? 2.703   9.637   20.380 1.00 16.97 ? 108 VAL A C   1 
ATOM   822  O O   . VAL A 1 100 ? 3.746   10.247  20.130 1.00 17.29 ? 108 VAL A O   1 
ATOM   823  C CB  . VAL A 1 100 ? 2.935   7.324   19.466 1.00 15.93 ? 108 VAL A CB  1 
ATOM   824  C CG1 . VAL A 1 100 ? 2.657   6.615   20.783 1.00 17.45 ? 108 VAL A CG1 1 
ATOM   825  C CG2 . VAL A 1 100 ? 2.615   6.421   18.279 1.00 19.17 ? 108 VAL A CG2 1 
ATOM   826  N N   . ALA A 1 101 ? 2.050   9.776   21.522 1.00 17.21 ? 109 ALA A N   1 
ATOM   827  C CA  . ALA A 1 101 ? 2.565   10.582  22.621 1.00 16.05 ? 109 ALA A CA  1 
ATOM   828  C C   . ALA A 1 101 ? 2.498   9.754   23.891 1.00 17.23 ? 109 ALA A C   1 
ATOM   829  O O   . ALA A 1 101 ? 1.507   9.057   24.130 1.00 17.33 ? 109 ALA A O   1 
ATOM   830  C CB  . ALA A 1 101 ? 1.759   11.873  22.801 1.00 17.94 ? 109 ALA A CB  1 
ATOM   831  N N   . GLN A 1 102 ? 3.542   9.817   24.710 1.00 15.12 ? 110 GLN A N   1 
ATOM   832  C CA  . GLN A 1 102 ? 3.627   8.963   25.874 1.00 15.33 ? 110 GLN A CA  1 
ATOM   833  C C   . GLN A 1 102 ? 4.206   9.738   27.046 1.00 16.42 ? 110 GLN A C   1 
ATOM   834  O O   . GLN A 1 102 ? 5.095   10.580  26.870 1.00 17.53 ? 110 GLN A O   1 
ATOM   835  C CB  . GLN A 1 102 ? 4.509   7.750   25.570 1.00 15.93 ? 110 GLN A CB  1 
ATOM   836  C CG  . GLN A 1 102 ? 4.309   6.581   26.495 1.00 19.07 ? 110 GLN A CG  1 
ATOM   837  C CD  . GLN A 1 102 ? 5.293   6.531   27.632 1.00 19.82 ? 110 GLN A CD  1 
ATOM   838  O OE1 . GLN A 1 102 ? 5.990   7.514   27.915 1.00 20.09 ? 110 GLN A OE1 1 
ATOM   839  N NE2 . GLN A 1 102 ? 5.362   5.387   28.299 1.00 18.12 ? 110 GLN A NE2 1 
ATOM   840  N N   . ASP A 1 103 ? 3.697   9.454   28.236 1.00 17.32 ? 111 ASP A N   1 
ATOM   841  C CA  . ASP A 1 103 ? 4.236   9.954   29.493 1.00 17.60 ? 111 ASP A CA  1 
ATOM   842  C C   . ASP A 1 103 ? 4.657   8.784   30.365 1.00 17.46 ? 111 ASP A C   1 
ATOM   843  O O   . ASP A 1 103 ? 3.887   7.834   30.560 1.00 17.12 ? 111 ASP A O   1 
ATOM   844  C CB  . ASP A 1 103 ? 3.194   10.789  30.251 1.00 17.84 ? 111 ASP A CB  1 
ATOM   845  C CG  . ASP A 1 103 ? 3.785   11.417  31.491 1.00 26.21 ? 111 ASP A CG  1 
ATOM   846  O OD1 . ASP A 1 103 ? 4.568   12.370  31.339 1.00 28.48 ? 111 ASP A OD1 1 
ATOM   847  O OD2 . ASP A 1 103 ? 3.518   10.916  32.607 1.00 29.82 ? 111 ASP A OD2 1 
ATOM   848  N N   . THR A 1 104 ? 5.869   8.856   30.908 1.00 18.68 ? 112 THR A N   1 
ATOM   849  C CA  . THR A 1 104 ? 6.393   7.838   31.802 1.00 17.11 ? 112 THR A CA  1 
ATOM   850  C C   . THR A 1 104 ? 6.674   8.456   33.162 1.00 19.04 ? 112 THR A C   1 
ATOM   851  O O   . THR A 1 104 ? 7.418   9.442   33.259 1.00 18.75 ? 112 THR A O   1 
ATOM   852  C CB  . THR A 1 104 ? 7.686   7.236   31.239 1.00 17.95 ? 112 THR A CB  1 
ATOM   853  O OG1 . THR A 1 104 ? 7.379   6.540   30.022 1.00 18.00 ? 112 THR A OG1 1 
ATOM   854  C CG2 . THR A 1 104 ? 8.270   6.253   32.230 1.00 17.76 ? 112 THR A CG2 1 
ATOM   855  N N   A SER A 1 105 ? 6.093   7.867   34.205 0.72 17.47 ? 113 SER A N   1 
ATOM   856  N N   B SER A 1 105 ? 6.098   7.863   34.206 0.28 17.53 ? 113 SER A N   1 
ATOM   857  C CA  A SER A 1 105 ? 6.282   8.305   35.580 0.72 18.01 ? 113 SER A CA  1 
ATOM   858  C CA  B SER A 1 105 ? 6.296   8.303   35.578 0.28 18.07 ? 113 SER A CA  1 
ATOM   859  C C   A SER A 1 105 ? 6.528   7.081   36.456 0.72 18.93 ? 113 SER A C   1 
ATOM   860  C C   B SER A 1 105 ? 6.528   7.079   36.457 0.28 18.93 ? 113 SER A C   1 
ATOM   861  O O   A SER A 1 105 ? 6.548   5.941   35.981 0.72 18.74 ? 113 SER A O   1 
ATOM   862  O O   B SER A 1 105 ? 6.536   5.939   35.983 0.28 18.74 ? 113 SER A O   1 
ATOM   863  C CB  A SER A 1 105 ? 5.076   9.116   36.068 0.72 19.47 ? 113 SER A CB  1 
ATOM   864  C CB  B SER A 1 105 ? 5.106   9.139   36.064 0.28 19.53 ? 113 SER A CB  1 
ATOM   865  O OG  A SER A 1 105 ? 3.892   8.337   36.013 0.72 19.02 ? 113 SER A OG  1 
ATOM   866  O OG  B SER A 1 105 ? 4.898   10.254  35.217 0.28 23.42 ? 113 SER A OG  1 
ATOM   867  N N   . LEU A 1 106 ? 6.719   7.321   37.753 1.00 19.44 ? 114 LEU A N   1 
ATOM   868  C CA  . LEU A 1 106 ? 6.999   6.261   38.711 1.00 19.10 ? 114 LEU A CA  1 
ATOM   869  C C   . LEU A 1 106 ? 6.136   6.522   39.936 1.00 22.87 ? 114 LEU A C   1 
ATOM   870  O O   . LEU A 1 106 ? 6.245   7.586   40.549 1.00 26.52 ? 114 LEU A O   1 
ATOM   871  C CB  . LEU A 1 106 ? 8.486   6.277   39.085 1.00 19.83 ? 114 LEU A CB  1 
ATOM   872  C CG  . LEU A 1 106 ? 8.959   5.235   40.093 1.00 22.47 ? 114 LEU A CG  1 
ATOM   873  C CD1 . LEU A 1 106 ? 8.953   3.825   39.508 1.00 21.34 ? 114 LEU A CD1 1 
ATOM   874  C CD2 . LEU A 1 106 ? 10.342  5.606   40.577 1.00 22.27 ? 114 LEU A CD2 1 
ATOM   875  N N   . GLU A 1 107 ? 5.265   5.576   40.282 1.00 20.93 ? 115 GLU A N   1 
ATOM   876  C CA  . GLU A 1 107 ? 4.346   5.756   41.402 1.00 21.82 ? 115 GLU A CA  1 
ATOM   877  C C   . GLU A 1 107 ? 4.423   4.523   42.284 1.00 23.52 ? 115 GLU A C   1 
ATOM   878  O O   . GLU A 1 107 ? 4.169   3.409   41.811 1.00 23.89 ? 115 GLU A O   1 
ATOM   879  C CB  . GLU A 1 107 ? 2.906   5.957   40.904 1.00 23.29 ? 115 GLU A CB  1 
ATOM   880  C CG  . GLU A 1 107 ? 2.724   7.124   39.917 1.00 25.41 ? 115 GLU A CG  1 
ATOM   881  C CD  . GLU A 1 107 ? 1.271   7.369   39.495 1.00 29.10 ? 115 GLU A CD  1 
ATOM   882  O OE1 . GLU A 1 107 ? 0.358   6.708   40.028 1.00 30.08 ? 115 GLU A OE1 1 
ATOM   883  O OE2 . GLU A 1 107 ? 1.047   8.249   38.635 1.00 36.51 ? 115 GLU A OE2 1 
ATOM   884  N N   . ASP A 1 108 ? 4.767   4.714   43.563 1.00 25.58 ? 116 ASP A N   1 
ATOM   885  C CA  . ASP A 1 108 ? 4.808   3.613   44.529 1.00 27.42 ? 116 ASP A CA  1 
ATOM   886  C C   . ASP A 1 108 ? 5.736   2.489   44.073 1.00 28.57 ? 116 ASP A C   1 
ATOM   887  O O   . ASP A 1 108 ? 5.465   1.311   44.320 1.00 29.90 ? 116 ASP A O   1 
ATOM   888  C CB  . ASP A 1 108 ? 3.410   3.054   44.817 1.00 30.72 ? 116 ASP A CB  1 
ATOM   889  C CG  . ASP A 1 108 ? 2.497   4.059   45.509 1.00 36.66 ? 116 ASP A CG  1 
ATOM   890  O OD1 . ASP A 1 108 ? 3.009   5.027   46.109 1.00 42.63 ? 116 ASP A OD1 1 
ATOM   891  O OD2 . ASP A 1 108 ? 1.262   3.892   45.421 1.00 42.02 ? 116 ASP A OD2 1 
ATOM   892  N N   . GLY A 1 109 ? 6.820   2.838   43.381 1.00 26.38 ? 117 GLY A N   1 
ATOM   893  C CA  . GLY A 1 109 ? 7.786   1.870   42.911 1.00 24.88 ? 117 GLY A CA  1 
ATOM   894  C C   . GLY A 1 109 ? 7.460   1.203   41.590 1.00 19.73 ? 117 GLY A C   1 
ATOM   895  O O   . GLY A 1 109 ? 8.267   0.390   41.118 1.00 20.62 ? 117 GLY A O   1 
ATOM   896  N N   . THR A 1 110 ? 6.316   1.509   40.982 1.00 20.84 ? 118 THR A N   1 
ATOM   897  C CA  . THR A 1 110 ? 5.893   0.911   39.719 1.00 17.49 ? 118 THR A CA  1 
ATOM   898  C C   . THR A 1 110 ? 5.924   1.974   38.631 1.00 18.31 ? 118 THR A C   1 
ATOM   899  O O   . THR A 1 110 ? 5.441   3.092   38.834 1.00 19.35 ? 118 THR A O   1 
ATOM   900  C CB  . THR A 1 110 ? 4.478   0.342   39.849 1.00 21.08 ? 118 THR A CB  1 
ATOM   901  O OG1 . THR A 1 110 ? 4.491   -0.732  40.790 1.00 24.46 ? 118 THR A OG1 1 
ATOM   902  C CG2 . THR A 1 110 ? 3.981   -0.199  38.513 1.00 21.43 ? 118 THR A CG2 1 
ATOM   903  N N   . LEU A 1 111 ? 6.514   1.634   37.485 1.00 16.52 ? 119 LEU A N   1 
ATOM   904  C CA  . LEU A 1 111 ? 6.513   2.552   36.357 1.00 17.13 ? 119 LEU A CA  1 
ATOM   905  C C   . LEU A 1 111 ? 5.109   2.666   35.772 1.00 16.63 ? 119 LEU A C   1 
ATOM   906  O O   . LEU A 1 111 ? 4.372   1.679   35.685 1.00 19.44 ? 119 LEU A O   1 
ATOM   907  C CB  . LEU A 1 111 ? 7.491   2.045   35.296 1.00 17.39 ? 119 LEU A CB  1 
ATOM   908  C CG  . LEU A 1 111 ? 8.957   2.098   35.732 1.00 17.63 ? 119 LEU A CG  1 
ATOM   909  C CD1 . LEU A 1 111 ? 9.812   1.142   34.900 1.00 20.47 ? 119 LEU A CD1 1 
ATOM   910  C CD2 . LEU A 1 111 ? 9.468   3.515   35.636 1.00 19.40 ? 119 LEU A CD2 1 
ATOM   911  N N   . ILE A 1 112 ? 4.732   3.881   35.386 1.00 17.27 ? 120 ILE A N   1 
ATOM   912  C CA  . ILE A 1 112 ? 3.392   4.179   34.894 1.00 17.56 ? 120 ILE A CA  1 
ATOM   913  C C   . ILE A 1 112 ? 3.523   4.765   33.499 1.00 18.00 ? 120 ILE A C   1 
ATOM   914  O O   . ILE A 1 112 ? 4.153   5.814   33.322 1.00 17.48 ? 120 ILE A O   1 
ATOM   915  C CB  . ILE A 1 112 ? 2.665   5.161   35.823 1.00 18.07 ? 120 ILE A CB  1 
ATOM   916  C CG1 . ILE A 1 112 ? 2.572   4.585   37.243 1.00 19.57 ? 120 ILE A CG1 1 
ATOM   917  C CG2 . ILE A 1 112 ? 1.289   5.520   35.252 1.00 18.54 ? 120 ILE A CG2 1 
ATOM   918  C CD1 . ILE A 1 112 ? 1.777   3.286   37.335 1.00 20.44 ? 120 ILE A CD1 1 
ATOM   919  N N   . TYR A 1 113 ? 2.932   4.093   32.509 1.00 15.47 ? 121 TYR A N   1 
ATOM   920  C CA  . TYR A 1 113 ? 2.995   4.507   31.113 1.00 15.90 ? 121 TYR A CA  1 
ATOM   921  C C   . TYR A 1 113 ? 1.608   4.928   30.653 1.00 15.58 ? 121 TYR A C   1 
ATOM   922  O O   . TYR A 1 113 ? 0.650   4.163   30.800 1.00 17.11 ? 121 TYR A O   1 
ATOM   923  C CB  . TYR A 1 113 ? 3.444   3.348   30.219 1.00 15.51 ? 121 TYR A CB  1 
ATOM   924  C CG  . TYR A 1 113 ? 4.834   2.785   30.488 1.00 17.28 ? 121 TYR A CG  1 
ATOM   925  C CD1 . TYR A 1 113 ? 5.782   3.481   31.241 1.00 16.34 ? 121 TYR A CD1 1 
ATOM   926  C CD2 . TYR A 1 113 ? 5.191   1.552   29.969 1.00 17.27 ? 121 TYR A CD2 1 
ATOM   927  C CE1 . TYR A 1 113 ? 7.049   2.930   31.471 1.00 18.33 ? 121 TYR A CE1 1 
ATOM   928  C CE2 . TYR A 1 113 ? 6.440   1.002   30.184 1.00 17.07 ? 121 TYR A CE2 1 
ATOM   929  C CZ  . TYR A 1 113 ? 7.365   1.698   30.939 1.00 15.39 ? 121 TYR A CZ  1 
ATOM   930  O OH  . TYR A 1 113 ? 8.614   1.120   31.150 1.00 17.38 ? 121 TYR A OH  1 
ATOM   931  N N   . LYS A 1 114 ? 1.500   6.113   30.066 1.00 16.78 ? 122 LYS A N   1 
ATOM   932  C CA  . LYS A 1 114 ? 0.245   6.605   29.504 1.00 16.65 ? 122 LYS A CA  1 
ATOM   933  C C   . LYS A 1 114 ? 0.495   6.942   28.044 1.00 16.88 ? 122 LYS A C   1 
ATOM   934  O O   . LYS A 1 114 ? 1.418   7.703   27.735 1.00 17.24 ? 122 LYS A O   1 
ATOM   935  C CB  . LYS A 1 114 ? -0.233  7.851   30.262 1.00 19.63 ? 122 LYS A CB  1 
ATOM   936  C CG  . LYS A 1 114 ? -0.428  7.610   31.745 1.00 20.97 ? 122 LYS A CG  1 
ATOM   937  C CD  . LYS A 1 114 ? -0.693  8.899   32.505 1.00 30.97 ? 122 LYS A CD  1 
ATOM   938  C CE  . LYS A 1 114 ? -0.986  8.623   33.975 1.00 39.27 ? 122 LYS A CE  1 
ATOM   939  N NZ  . LYS A 1 114 ? -1.265  9.881   34.737 1.00 39.96 ? 122 LYS A NZ  1 
ATOM   940  N N   . VAL A 1 115 ? -0.305  6.374   27.140 1.00 15.71 ? 123 VAL A N   1 
ATOM   941  C CA  . VAL A 1 115 ? -0.033  6.463   25.713 1.00 17.59 ? 123 VAL A CA  1 
ATOM   942  C C   . VAL A 1 115 ? -1.278  6.937   24.991 1.00 16.55 ? 123 VAL A C   1 
ATOM   943  O O   . VAL A 1 115 ? -2.386  6.445   25.254 1.00 15.97 ? 123 VAL A O   1 
ATOM   944  C CB  . VAL A 1 115 ? 0.412   5.116   25.113 1.00 17.70 ? 123 VAL A CB  1 
ATOM   945  C CG1 . VAL A 1 115 ? 1.017   5.341   23.746 1.00 19.15 ? 123 VAL A CG1 1 
ATOM   946  C CG2 . VAL A 1 115 ? 1.405   4.403   26.014 1.00 20.64 ? 123 VAL A CG2 1 
ATOM   947  N N   . LYS A 1 116 ? -1.095  7.868   24.065 1.00 16.26 ? 124 LYS A N   1 
ATOM   948  C CA  . LYS A 1 116 ? -2.123  8.286   23.124 1.00 16.22 ? 124 LYS A CA  1 
ATOM   949  C C   . LYS A 1 116 ? -1.619  8.028   21.709 1.00 17.83 ? 124 LYS A C   1 
ATOM   950  O O   . LYS A 1 116 ? -0.471  8.357   21.383 1.00 18.37 ? 124 LYS A O   1 
ATOM   951  C CB  . LYS A 1 116 ? -2.433  9.779   23.285 1.00 20.17 ? 124 LYS A CB  1 
ATOM   952  C CG  . LYS A 1 116 ? -3.052  10.181  24.618 1.00 29.85 ? 124 LYS A CG  1 
ATOM   953  C CD  . LYS A 1 116 ? -3.191  11.708  24.688 1.00 37.26 ? 124 LYS A CD  1 
ATOM   954  C CE  . LYS A 1 116 ? -4.049  12.161  25.863 1.00 40.20 ? 124 LYS A CE  1 
ATOM   955  N NZ  . LYS A 1 116 ? -4.156  13.646  25.945 1.00 42.29 ? 124 LYS A NZ  1 
ATOM   956  N N   . LEU A 1 117 ? -2.464  7.458   20.861 1.00 16.14 ? 125 LEU A N   1 
ATOM   957  C CA  . LEU A 1 117 ? -2.040  7.065   19.527 1.00 16.17 ? 125 LEU A CA  1 
ATOM   958  C C   . LEU A 1 117 ? -3.105  7.463   18.522 1.00 18.10 ? 125 LEU A C   1 
ATOM   959  O O   . LEU A 1 117 ? -4.295  7.271   18.773 1.00 19.13 ? 125 LEU A O   1 
ATOM   960  C CB  . LEU A 1 117 ? -1.832  5.545   19.462 1.00 16.27 ? 125 LEU A CB  1 
ATOM   961  C CG  . LEU A 1 117 ? -1.347  4.942   18.137 1.00 16.93 ? 125 LEU A CG  1 
ATOM   962  C CD1 . LEU A 1 117 ? -0.446  3.752   18.395 1.00 18.77 ? 125 LEU A CD1 1 
ATOM   963  C CD2 . LEU A 1 117 ? -2.517  4.500   17.257 1.00 17.76 ? 125 LEU A CD2 1 
ATOM   964  N N   . ARG A 1 118 ? -2.693  8.002   17.382 1.00 17.14 ? 126 ARG A N   1 
ATOM   965  C CA  . ARG A 1 118 ? -3.645  8.330   16.326 1.00 17.67 ? 126 ARG A CA  1 
ATOM   966  C C   . ARG A 1 118 ? -3.054  7.925   14.988 1.00 16.17 ? 126 ARG A C   1 
ATOM   967  O O   . ARG A 1 118 ? -2.019  8.458   14.573 1.00 17.69 ? 126 ARG A O   1 
ATOM   968  C CB  . ARG A 1 118 ? -4.029  9.810   16.323 1.00 22.20 ? 126 ARG A CB  1 
ATOM   969  C CG  . ARG A 1 118 ? -5.004  10.142  15.201 1.00 24.50 ? 126 ARG A CG  1 
ATOM   970  C CD  . ARG A 1 118 ? -5.887  11.334  15.521 1.00 40.37 ? 126 ARG A CD  1 
ATOM   971  N NE  . ARG A 1 118 ? -5.311  12.590  15.054 1.00 47.86 ? 126 ARG A NE  1 
ATOM   972  C CZ  . ARG A 1 118 ? -5.503  13.763  15.642 1.00 57.29 ? 126 ARG A CZ  1 
ATOM   973  N NH1 . ARG A 1 118 ? -6.278  13.883  16.710 1.00 54.62 ? 126 ARG A NH1 1 
ATOM   974  N NH2 . ARG A 1 118 ? -4.914  14.844  15.140 1.00 59.81 ? 126 ARG A NH2 1 
ATOM   975  N N   . GLY A 1 119 ? -3.701  6.980   14.319 1.00 15.98 ? 127 GLY A N   1 
ATOM   976  C CA  . GLY A 1 119 ? -3.258  6.487   13.021 1.00 17.21 ? 127 GLY A CA  1 
ATOM   977  C C   . GLY A 1 119 ? -4.283  6.851   11.962 1.00 17.25 ? 127 GLY A C   1 
ATOM   978  O O   . GLY A 1 119 ? -5.490  6.743   12.196 1.00 19.61 ? 127 GLY A O   1 
ATOM   979  N N   . THR A 1 120 ? -3.800  7.267   10.798 1.00 17.79 ? 128 THR A N   1 
ATOM   980  C CA  . THR A 1 120 ? -4.671  7.705   9.718  1.00 18.21 ? 128 THR A CA  1 
ATOM   981  C C   . THR A 1 120 ? -4.096  7.265   8.383  1.00 20.75 ? 128 THR A C   1 
ATOM   982  O O   . THR A 1 120 ? -2.908  6.946   8.256  1.00 19.16 ? 128 THR A O   1 
ATOM   983  C CB  . THR A 1 120 ? -4.824  9.233   9.699  1.00 22.69 ? 128 THR A CB  1 
ATOM   984  O OG1 . THR A 1 120 ? -3.528  9.840   9.645  1.00 25.15 ? 128 THR A OG1 1 
ATOM   985  C CG2 . THR A 1 120 ? -5.554  9.718   10.941 1.00 27.64 ? 128 THR A CG2 1 
ATOM   986  N N   . ASN A 1 121 ? -4.967  7.253   7.379  1.00 20.27 ? 129 ASN A N   1 
ATOM   987  C CA  . ASN A 1 121 ? -4.601  7.122   5.975  1.00 20.51 ? 129 ASN A CA  1 
ATOM   988  C C   . ASN A 1 121 ? -4.061  5.730   5.642  1.00 21.45 ? 129 ASN A C   1 
ATOM   989  O O   . ASN A 1 121 ? -3.311  5.557   4.672  1.00 20.61 ? 129 ASN A O   1 
ATOM   990  C CB  . ASN A 1 121 ? -3.644  8.244   5.536  1.00 21.23 ? 129 ASN A CB  1 
ATOM   991  C CG  . ASN A 1 121 ? -3.454  8.307   4.029  1.00 31.26 ? 129 ASN A CG  1 
ATOM   992  O OD1 . ASN A 1 121 ? -2.340  8.501   3.533  1.00 34.75 ? 129 ASN A OD1 1 
ATOM   993  N ND2 . ASN A 1 121 ? -4.556  8.174   3.291  1.00 34.74 ? 129 ASN A ND2 1 
ATOM   994  N N   . PHE A 1 122 ? -4.433  4.717   6.417  1.00 16.57 ? 130 PHE A N   1 
ATOM   995  C CA  . PHE A 1 122 ? -4.018  3.369   6.055  1.00 17.57 ? 130 PHE A CA  1 
ATOM   996  C C   . PHE A 1 122 ? -4.927  2.836   4.955  1.00 19.81 ? 130 PHE A C   1 
ATOM   997  O O   . PHE A 1 122 ? -6.155  2.877   5.103  1.00 20.55 ? 130 PHE A O   1 
ATOM   998  C CB  . PHE A 1 122 ? -4.066  2.449   7.266  1.00 18.24 ? 130 PHE A CB  1 
ATOM   999  C CG  . PHE A 1 122 ? -2.902  2.656   8.176  1.00 18.29 ? 130 PHE A CG  1 
ATOM   1000 C CD1 . PHE A 1 122 ? -1.707  1.992   7.953  1.00 18.13 ? 130 PHE A CD1 1 
ATOM   1001 C CD2 . PHE A 1 122 ? -2.973  3.597   9.188  1.00 18.61 ? 130 PHE A CD2 1 
ATOM   1002 C CE1 . PHE A 1 122 ? -0.589  2.228   8.777  1.00 17.30 ? 130 PHE A CE1 1 
ATOM   1003 C CE2 . PHE A 1 122 ? -1.864  3.850   10.005 1.00 18.58 ? 130 PHE A CE2 1 
ATOM   1004 C CZ  . PHE A 1 122 ? -0.676  3.146   9.803  1.00 19.20 ? 130 PHE A CZ  1 
ATOM   1005 N N   . PRO A 1 123 ? -4.373  2.356   3.843  1.00 18.10 ? 131 PRO A N   1 
ATOM   1006 C CA  . PRO A 1 123 ? -5.220  1.847   2.747  1.00 18.81 ? 131 PRO A CA  1 
ATOM   1007 C C   . PRO A 1 123 ? -6.122  0.729   3.236  1.00 18.92 ? 131 PRO A C   1 
ATOM   1008 O O   . PRO A 1 123 ? -5.699  -0.128  4.020  1.00 17.98 ? 131 PRO A O   1 
ATOM   1009 C CB  . PRO A 1 123 ? -4.201  1.325   1.726  1.00 20.25 ? 131 PRO A CB  1 
ATOM   1010 C CG  . PRO A 1 123 ? -2.946  2.139   1.995  1.00 19.15 ? 131 PRO A CG  1 
ATOM   1011 C CD  . PRO A 1 123 ? -2.937  2.373   3.486  1.00 19.16 ? 131 PRO A CD  1 
ATOM   1012 N N   . PRO A 1 124 ? -7.384  0.712   2.797  1.00 19.62 ? 132 PRO A N   1 
ATOM   1013 C CA  . PRO A 1 124 ? -8.336  -0.272  3.339  1.00 18.94 ? 132 PRO A CA  1 
ATOM   1014 C C   . PRO A 1 124 ? -7.934  -1.706  3.092  1.00 18.35 ? 132 PRO A C   1 
ATOM   1015 O O   . PRO A 1 124 ? -8.261  -2.585  3.900  1.00 19.70 ? 132 PRO A O   1 
ATOM   1016 C CB  . PRO A 1 124 ? -9.646  0.054   2.602  1.00 21.00 ? 132 PRO A CB  1 
ATOM   1017 C CG  . PRO A 1 124 ? -9.453  1.391   1.999  1.00 28.16 ? 132 PRO A CG  1 
ATOM   1018 C CD  . PRO A 1 124 ? -7.992  1.641   1.835  1.00 19.73 ? 132 PRO A CD  1 
ATOM   1019 N N   . ASP A 1 125 ? -7.228  -1.973  1.994  1.00 17.26 ? 133 ASP A N   1 
ATOM   1020 C CA  . ASP A 1 125 ? -6.776  -3.313  1.658  1.00 17.96 ? 133 ASP A CA  1 
ATOM   1021 C C   . ASP A 1 125 ? -5.300  -3.526  1.943  1.00 18.54 ? 133 ASP A C   1 
ATOM   1022 O O   . ASP A 1 125 ? -4.743  -4.553  1.539  1.00 19.67 ? 133 ASP A O   1 
ATOM   1023 C CB  . ASP A 1 125 ? -7.061  -3.590  0.186  1.00 20.67 ? 133 ASP A CB  1 
ATOM   1024 C CG  . ASP A 1 125 ? -8.538  -3.538  -0.126 1.00 21.46 ? 133 ASP A CG  1 
ATOM   1025 O OD1 . ASP A 1 125 ? -9.285  -4.436  0.341  1.00 22.61 ? 133 ASP A OD1 1 
ATOM   1026 O OD2 . ASP A 1 125 ? -8.958  -2.582  -0.807 1.00 20.28 ? 133 ASP A OD2 1 
ATOM   1027 N N   . GLY A 1 126 ? -4.665  -2.587  2.633  1.00 18.29 ? 134 GLY A N   1 
ATOM   1028 C CA  . GLY A 1 126 ? -3.260  -2.685  2.948  1.00 16.73 ? 134 GLY A CA  1 
ATOM   1029 C C   . GLY A 1 126 ? -2.999  -3.705  4.039  1.00 19.07 ? 134 GLY A C   1 
ATOM   1030 O O   . GLY A 1 126 ? -3.921  -4.236  4.666  1.00 18.06 ? 134 GLY A O   1 
ATOM   1031 N N   . PRO A 1 127 ? -1.721  -3.998  4.291  1.00 17.72 ? 135 PRO A N   1 
ATOM   1032 C CA  . PRO A 1 127 ? -1.386  -5.055  5.259  1.00 17.72 ? 135 PRO A CA  1 
ATOM   1033 C C   . PRO A 1 127 ? -1.760  -4.719  6.694  1.00 18.56 ? 135 PRO A C   1 
ATOM   1034 O O   . PRO A 1 127 ? -1.964  -5.651  7.487  1.00 18.91 ? 135 PRO A O   1 
ATOM   1035 C CB  . PRO A 1 127 ? 0.129   -5.226  5.095  1.00 16.78 ? 135 PRO A CB  1 
ATOM   1036 C CG  . PRO A 1 127 ? 0.592   -3.945  4.451  1.00 18.15 ? 135 PRO A CG  1 
ATOM   1037 C CD  . PRO A 1 127 ? -0.541  -3.489  3.573  1.00 18.21 ? 135 PRO A CD  1 
ATOM   1038 N N   . VAL A 1 128 ? -1.882  -3.436  7.044  1.00 16.09 ? 136 VAL A N   1 
ATOM   1039 C CA  . VAL A 1 128 ? -2.264  -3.065  8.407  1.00 18.19 ? 136 VAL A CA  1 
ATOM   1040 C C   . VAL A 1 128 ? -3.753  -3.306  8.647  1.00 18.38 ? 136 VAL A C   1 
ATOM   1041 O O   . VAL A 1 128 ? -4.130  -4.015  9.584  1.00 18.37 ? 136 VAL A O   1 
ATOM   1042 C CB  . VAL A 1 128 ? -1.845  -1.618  8.718  1.00 16.73 ? 136 VAL A CB  1 
ATOM   1043 C CG1 . VAL A 1 128 ? -2.483  -1.138  9.997  1.00 18.76 ? 136 VAL A CG1 1 
ATOM   1044 C CG2 . VAL A 1 128 ? -0.320  -1.546  8.807  1.00 16.30 ? 136 VAL A CG2 1 
ATOM   1045 N N   . MET A 1 129 ? -4.621  -2.705  7.823  1.00 17.85 ? 137 MET A N   1 
ATOM   1046 C CA  . MET A 1 129 ? -6.058  -2.932  7.980  1.00 18.46 ? 137 MET A CA  1 
ATOM   1047 C C   . MET A 1 129 ? -6.497  -4.361  7.671  1.00 19.93 ? 137 MET A C   1 
ATOM   1048 O O   . MET A 1 129 ? -7.556  -4.781  8.163  1.00 23.00 ? 137 MET A O   1 
ATOM   1049 C CB  . MET A 1 129 ? -6.883  -1.890  7.213  1.00 19.53 ? 137 MET A CB  1 
ATOM   1050 C CG  . MET A 1 129 ? -6.603  -0.422  7.538  1.00 19.78 ? 137 MET A CG  1 
ATOM   1051 S SD  . MET A 1 129 ? -6.568  -0.059  9.314  1.00 22.22 ? 137 MET A SD  1 
ATOM   1052 C CE  . MET A 1 129 ? -8.282  -0.372  9.724  1.00 24.69 ? 137 MET A CE  1 
ATOM   1053 N N   . GLN A 1 130 ? -5.740  -5.112  6.872  1.00 18.80 ? 138 GLN A N   1 
ATOM   1054 C CA  . GLN A 1 130 ? -6.090  -6.496  6.570  1.00 19.08 ? 138 GLN A CA  1 
ATOM   1055 C C   . GLN A 1 130 ? -5.364  -7.511  7.448  1.00 21.51 ? 138 GLN A C   1 
ATOM   1056 O O   . GLN A 1 130 ? -5.522  -8.721  7.239  1.00 21.18 ? 138 GLN A O   1 
ATOM   1057 C CB  . GLN A 1 130 ? -5.864  -6.805  5.083  1.00 20.73 ? 138 GLN A CB  1 
ATOM   1058 C CG  . GLN A 1 130 ? -6.771  -6.014  4.144  1.00 21.31 ? 138 GLN A CG  1 
ATOM   1059 C CD  . GLN A 1 130 ? -8.243  -6.327  4.347  1.00 22.61 ? 138 GLN A CD  1 
ATOM   1060 O OE1 . GLN A 1 130 ? -8.618  -7.478  4.570  1.00 26.64 ? 138 GLN A OE1 1 
ATOM   1061 N NE2 . GLN A 1 130 ? -9.080  -5.301  4.275  1.00 24.22 ? 138 GLN A NE2 1 
ATOM   1062 N N   . LYS A 1 131 ? -4.571  -7.050  8.423  1.00 18.08 ? 139 LYS A N   1 
ATOM   1063 C CA  . LYS A 1 131 ? -3.889  -7.928  9.377  1.00 19.67 ? 139 LYS A CA  1 
ATOM   1064 C C   . LYS A 1 131 ? -3.013  -8.962  8.675  1.00 21.81 ? 139 LYS A C   1 
ATOM   1065 O O   . LYS A 1 131 ? -3.078  -10.159 8.959  1.00 25.06 ? 139 LYS A O   1 
ATOM   1066 C CB  . LYS A 1 131 ? -4.874  -8.577  10.351 1.00 22.41 ? 139 LYS A CB  1 
ATOM   1067 C CG  . LYS A 1 131 ? -5.707  -7.573  11.098 1.00 21.17 ? 139 LYS A CG  1 
ATOM   1068 C CD  . LYS A 1 131 ? -6.736  -8.297  11.947 1.00 27.75 ? 139 LYS A CD  1 
ATOM   1069 C CE  . LYS A 1 131 ? -7.913  -7.407  12.240 1.00 30.34 ? 139 LYS A CE  1 
ATOM   1070 N NZ  . LYS A 1 131 ? -8.968  -8.148  12.988 1.00 32.24 ? 139 LYS A NZ  1 
ATOM   1071 N N   . LYS A 1 132 ? -2.177  -8.478  7.753  1.00 18.22 ? 140 LYS A N   1 
ATOM   1072 C CA  . LYS A 1 132 ? -1.257  -9.310  6.992  1.00 19.49 ? 140 LYS A CA  1 
ATOM   1073 C C   . LYS A 1 132 ? 0.191   -9.171  7.438  1.00 21.07 ? 140 LYS A C   1 
ATOM   1074 O O   . LYS A 1 132 ? 1.079   -9.741  6.796  1.00 22.72 ? 140 LYS A O   1 
ATOM   1075 C CB  . LYS A 1 132 ? -1.377  -9.018  5.500  1.00 19.77 ? 140 LYS A CB  1 
ATOM   1076 C CG  . LYS A 1 132 ? -2.723  -9.465  4.938  1.00 23.87 ? 140 LYS A CG  1 
ATOM   1077 C CD  . LYS A 1 132 ? -2.904  -9.047  3.485  1.00 28.73 ? 140 LYS A CD  1 
ATOM   1078 C CE  . LYS A 1 132 ? -4.205  -9.606  2.937  1.00 33.23 ? 140 LYS A CE  1 
ATOM   1079 N NZ  . LYS A 1 132 ? -4.336  -9.391  1.468  1.00 34.13 ? 140 LYS A NZ  1 
ATOM   1080 N N   . THR A 1 133 ? 0.454   -8.434  8.508  1.00 19.21 ? 141 THR A N   1 
ATOM   1081 C CA  . THR A 1 133 ? 1.816   -8.343  9.010  1.00 19.20 ? 141 THR A CA  1 
ATOM   1082 C C   . THR A 1 133 ? 2.077   -9.450  10.022 1.00 19.11 ? 141 THR A C   1 
ATOM   1083 O O   . THR A 1 133 ? 1.156   -9.982  10.652 1.00 22.31 ? 141 THR A O   1 
ATOM   1084 C CB  . THR A 1 133 ? 2.091   -6.970  9.635  1.00 22.29 ? 141 THR A CB  1 
ATOM   1085 O OG1 . THR A 1 133 ? 1.241   -6.769  10.768 1.00 22.67 ? 141 THR A OG1 1 
ATOM   1086 C CG2 . THR A 1 133 ? 1.832   -5.868  8.617  1.00 21.49 ? 141 THR A CG2 1 
ATOM   1087 N N   . MET A 1 134 ? 3.353   -9.792  10.182 1.00 18.54 ? 142 MET A N   1 
ATOM   1088 C CA  . MET A 1 134 ? 3.748   -10.869 11.085 1.00 22.19 ? 142 MET A CA  1 
ATOM   1089 C C   . MET A 1 134 ? 4.985   -10.484 11.894 1.00 22.08 ? 142 MET A C   1 
ATOM   1090 O O   . MET A 1 134 ? 5.926   -11.262 12.060 1.00 23.47 ? 142 MET A O   1 
ATOM   1091 C CB  . MET A 1 134 ? 3.843   -12.224 10.380 1.00 27.20 ? 142 MET A CB  1 
ATOM   1092 C CG  . MET A 1 134 ? 4.933   -12.377 9.357  1.00 34.44 ? 142 MET A CG  1 
ATOM   1093 S SD  . MET A 1 134 ? 4.986   -14.092 8.762  1.00 54.54 ? 142 MET A SD  1 
ATOM   1094 C CE  . MET A 1 134 ? 3.305   -14.627 9.084  1.00 35.38 ? 142 MET A CE  1 
ATOM   1095 N N   . GLY A 1 135 ? 4.975   -9.273  12.427 1.00 18.07 ? 143 GLY A N   1 
ATOM   1096 C CA  . GLY A 1 135 ? 5.981   -8.875  13.388 1.00 16.79 ? 143 GLY A CA  1 
ATOM   1097 C C   . GLY A 1 135 ? 7.089   -8.036  12.773 1.00 18.38 ? 143 GLY A C   1 
ATOM   1098 O O   . GLY A 1 135 ? 7.306   -8.013  11.560 1.00 17.76 ? 143 GLY A O   1 
ATOM   1099 N N   . TRP A 1 136 ? 7.824   -7.359  13.645 1.00 18.51 ? 144 TRP A N   1 
ATOM   1100 C CA  . TRP A 1 136 ? 8.898   -6.466  13.234 1.00 19.48 ? 144 TRP A CA  1 
ATOM   1101 C C   . TRP A 1 136 ? 10.219  -7.199  13.067 1.00 21.29 ? 144 TRP A C   1 
ATOM   1102 O O   . TRP A 1 136 ? 10.611  -7.999  13.919 1.00 19.61 ? 144 TRP A O   1 
ATOM   1103 C CB  . TRP A 1 136 ? 9.089   -5.393  14.296 1.00 17.53 ? 144 TRP A CB  1 
ATOM   1104 C CG  . TRP A 1 136 ? 7.912   -4.502  14.414 1.00 16.93 ? 144 TRP A CG  1 
ATOM   1105 C CD1 . TRP A 1 136 ? 6.883   -4.619  15.293 1.00 18.09 ? 144 TRP A CD1 1 
ATOM   1106 C CD2 . TRP A 1 136 ? 7.643   -3.347  13.619 1.00 17.73 ? 144 TRP A CD2 1 
ATOM   1107 N NE1 . TRP A 1 136 ? 5.985   -3.604  15.098 1.00 17.38 ? 144 TRP A NE1 1 
ATOM   1108 C CE2 . TRP A 1 136 ? 6.426   -2.804  14.076 1.00 18.55 ? 144 TRP A CE2 1 
ATOM   1109 C CE3 . TRP A 1 136 ? 8.314   -2.716  12.564 1.00 18.34 ? 144 TRP A CE3 1 
ATOM   1110 C CZ2 . TRP A 1 136 ? 5.855   -1.659  13.516 1.00 19.38 ? 144 TRP A CZ2 1 
ATOM   1111 C CZ3 . TRP A 1 136 ? 7.744   -1.572  12.009 1.00 19.57 ? 144 TRP A CZ3 1 
ATOM   1112 C CH2 . TRP A 1 136 ? 6.526   -1.063  12.482 1.00 18.08 ? 144 TRP A CH2 1 
ATOM   1113 N N   . GLU A 1 137 ? 10.915  -6.898  11.976 1.00 19.61 ? 145 GLU A N   1 
ATOM   1114 C CA  . GLU A 1 137 ? 12.301  -7.328  11.860 1.00 17.91 ? 145 GLU A CA  1 
ATOM   1115 C C   . GLU A 1 137 ? 13.121  -6.709  12.991 1.00 22.39 ? 145 GLU A C   1 
ATOM   1116 O O   . GLU A 1 137 ? 12.792  -5.641  13.512 1.00 22.82 ? 145 GLU A O   1 
ATOM   1117 C CB  . GLU A 1 137 ? 12.869  -6.863  10.515 1.00 20.97 ? 145 GLU A CB  1 
ATOM   1118 C CG  . GLU A 1 137 ? 12.252  -7.553  9.313  1.00 24.49 ? 145 GLU A CG  1 
ATOM   1119 C CD  . GLU A 1 137 ? 12.776  -7.032  7.981  1.00 31.80 ? 145 GLU A CD  1 
ATOM   1120 O OE1 . GLU A 1 137 ? 13.640  -6.123  7.976  1.00 32.68 ? 145 GLU A OE1 1 
ATOM   1121 O OE2 . GLU A 1 137 ? 12.312  -7.531  6.934  1.00 29.56 ? 145 GLU A OE2 1 
ATOM   1122 N N   . ALA A 1 138 ? 14.185  -7.400  13.395 1.00 21.29 ? 146 ALA A N   1 
ATOM   1123 C CA  . ALA A 1 138 ? 15.134  -6.801  14.327 1.00 17.86 ? 146 ALA A CA  1 
ATOM   1124 C C   . ALA A 1 138 ? 15.598  -5.460  13.777 1.00 20.06 ? 146 ALA A C   1 
ATOM   1125 O O   . ALA A 1 138 ? 15.740  -5.286  12.563 1.00 22.62 ? 146 ALA A O   1 
ATOM   1126 C CB  . ALA A 1 138 ? 16.345  -7.723  14.488 1.00 21.24 ? 146 ALA A CB  1 
ATOM   1127 N N   . SER A 1 139 ? 15.834  -4.500  14.668 1.00 20.01 ? 147 SER A N   1 
ATOM   1128 C CA  . SER A 1 139 ? 16.032  -3.132  14.212 1.00 20.96 ? 147 SER A CA  1 
ATOM   1129 C C   . SER A 1 139 ? 17.152  -2.458  14.983 1.00 21.97 ? 147 SER A C   1 
ATOM   1130 O O   . SER A 1 139 ? 17.543  -2.889  16.068 1.00 21.30 ? 147 SER A O   1 
ATOM   1131 C CB  . SER A 1 139 ? 14.754  -2.308  14.367 1.00 23.52 ? 147 SER A CB  1 
ATOM   1132 O OG  . SER A 1 139 ? 14.429  -2.164  15.735 1.00 22.95 ? 147 SER A OG  1 
ATOM   1133 N N   . THR A 1 140 ? 17.664  -1.376  14.398 1.00 20.96 ? 148 THR A N   1 
ATOM   1134 C CA  . THR A 1 140 ? 18.624  -0.514  15.072 1.00 19.99 ? 148 THR A CA  1 
ATOM   1135 C C   . THR A 1 140 ? 18.090  0.904   15.045 1.00 19.96 ? 148 THR A C   1 
ATOM   1136 O O   . THR A 1 140 ? 17.750  1.428   13.977 1.00 22.36 ? 148 THR A O   1 
ATOM   1137 C CB  . THR A 1 140 ? 19.997  -0.569  14.413 1.00 21.19 ? 148 THR A CB  1 
ATOM   1138 O OG1 . THR A 1 140 ? 20.475  -1.917  14.431 1.00 24.52 ? 148 THR A OG1 1 
ATOM   1139 C CG2 . THR A 1 140 ? 20.955  0.281   15.207 1.00 23.35 ? 148 THR A CG2 1 
ATOM   1140 N N   . GLU A 1 141 ? 17.968  1.501   16.220 1.00 18.05 ? 149 GLU A N   1 
ATOM   1141 C CA  . GLU A 1 141 ? 17.569  2.888   16.346 1.00 17.51 ? 149 GLU A CA  1 
ATOM   1142 C C   . GLU A 1 141 ? 18.839  3.714   16.478 1.00 18.98 ? 149 GLU A C   1 
ATOM   1143 O O   . GLU A 1 141 ? 19.721  3.388   17.286 1.00 18.67 ? 149 GLU A O   1 
ATOM   1144 C CB  . GLU A 1 141 ? 16.664  3.080   17.566 1.00 19.14 ? 149 GLU A CB  1 
ATOM   1145 C CG  . GLU A 1 141 ? 16.173  4.517   17.713 1.00 17.27 ? 149 GLU A CG  1 
ATOM   1146 C CD  . GLU A 1 141 ? 15.142  4.709   18.815 1.00 24.18 ? 149 GLU A CD  1 
ATOM   1147 O OE1 . GLU A 1 141 ? 15.068  3.868   19.733 1.00 23.47 ? 149 GLU A OE1 1 
ATOM   1148 O OE2 . GLU A 1 141 ? 14.404  5.717   18.767 1.00 23.33 ? 149 GLU A OE2 1 
ATOM   1149 N N   . ARG A 1 142 ? 18.951  4.745   15.653 1.00 19.15 ? 150 ARG A N   1 
ATOM   1150 C CA  . ARG A 1 142 ? 20.097  5.649   15.688 1.00 18.56 ? 150 ARG A CA  1 
ATOM   1151 C C   . ARG A 1 142 ? 19.678  6.896   16.452 1.00 16.06 ? 150 ARG A C   1 
ATOM   1152 O O   . ARG A 1 142 ? 18.790  7.642   16.013 1.00 18.27 ? 150 ARG A O   1 
ATOM   1153 C CB  . ARG A 1 142 ? 20.577  5.975   14.278 1.00 20.81 ? 150 ARG A CB  1 
ATOM   1154 C CG  . ARG A 1 142 ? 20.755  4.761   13.383 1.00 28.20 ? 150 ARG A CG  1 
ATOM   1155 C CD  . ARG A 1 142 ? 21.164  5.180   11.966 1.00 34.67 ? 150 ARG A CD  1 
ATOM   1156 N NE  . ARG A 1 142 ? 20.109  5.844   11.194 1.00 40.65 ? 150 ARG A NE  1 
ATOM   1157 C CZ  . ARG A 1 142 ? 18.861  5.415   11.026 1.00 39.06 ? 150 ARG A CZ  1 
ATOM   1158 N NH1 . ARG A 1 142 ? 18.450  4.248   11.502 1.00 38.85 ? 150 ARG A NH1 1 
ATOM   1159 N NH2 . ARG A 1 142 ? 18.006  6.165   10.336 1.00 40.17 ? 150 ARG A NH2 1 
ATOM   1160 N N   . LEU A 1 143 ? 20.277  7.099   17.619 1.00 17.80 ? 151 LEU A N   1 
ATOM   1161 C CA  . LEU A 1 143 ? 19.896  8.179   18.512 1.00 18.17 ? 151 LEU A CA  1 
ATOM   1162 C C   . LEU A 1 143 ? 20.974  9.251   18.533 1.00 18.98 ? 151 LEU A C   1 
ATOM   1163 O O   . LEU A 1 143 ? 22.165  8.954   18.400 1.00 19.47 ? 151 LEU A O   1 
ATOM   1164 C CB  . LEU A 1 143 ? 19.686  7.658   19.931 1.00 18.25 ? 151 LEU A CB  1 
ATOM   1165 C CG  . LEU A 1 143 ? 18.482  6.712   20.005 1.00 20.71 ? 151 LEU A CG  1 
ATOM   1166 C CD1 . LEU A 1 143 ? 18.944  5.306   20.260 1.00 21.87 ? 151 LEU A CD1 1 
ATOM   1167 C CD2 . LEU A 1 143 ? 17.486  7.188   21.057 1.00 23.49 ? 151 LEU A CD2 1 
ATOM   1168 N N   . TYR A 1 144 ? 20.547  10.502  18.696 1.00 20.54 ? 152 TYR A N   1 
ATOM   1169 C CA  . TYR A 1 144 ? 21.506  11.595  18.824 1.00 20.82 ? 152 TYR A CA  1 
ATOM   1170 C C   . TYR A 1 144 ? 20.945  12.646  19.765 1.00 20.69 ? 152 TYR A C   1 
ATOM   1171 O O   . TYR A 1 144 ? 19.728  12.867  19.795 1.00 19.07 ? 152 TYR A O   1 
ATOM   1172 C CB  . TYR A 1 144 ? 21.839  12.224  17.463 1.00 23.00 ? 152 TYR A CB  1 
ATOM   1173 C CG  . TYR A 1 144 ? 20.662  12.813  16.723 1.00 23.45 ? 152 TYR A CG  1 
ATOM   1174 C CD1 . TYR A 1 144 ? 19.880  12.021  15.892 1.00 25.45 ? 152 TYR A CD1 1 
ATOM   1175 C CD2 . TYR A 1 144 ? 20.336  14.162  16.839 1.00 27.19 ? 152 TYR A CD2 1 
ATOM   1176 C CE1 . TYR A 1 144 ? 18.802  12.552  15.207 1.00 27.72 ? 152 TYR A CE1 1 
ATOM   1177 C CE2 . TYR A 1 144 ? 19.260  14.702  16.155 1.00 28.42 ? 152 TYR A CE2 1 
ATOM   1178 C CZ  . TYR A 1 144 ? 18.498  13.889  15.341 1.00 28.71 ? 152 TYR A CZ  1 
ATOM   1179 O OH  . TYR A 1 144 ? 17.422  14.420  14.657 1.00 32.71 ? 152 TYR A OH  1 
ATOM   1180 N N   . PRO A 1 145 ? 21.796  13.306  20.542 1.00 17.61 ? 153 PRO A N   1 
ATOM   1181 C CA  . PRO A 1 145 ? 21.318  14.360  21.434 1.00 19.16 ? 153 PRO A CA  1 
ATOM   1182 C C   . PRO A 1 145 ? 21.110  15.667  20.687 1.00 22.23 ? 153 PRO A C   1 
ATOM   1183 O O   . PRO A 1 145 ? 21.806  15.982  19.715 1.00 22.99 ? 153 PRO A O   1 
ATOM   1184 C CB  . PRO A 1 145 ? 22.463  14.503  22.440 1.00 21.42 ? 153 PRO A CB  1 
ATOM   1185 C CG  . PRO A 1 145 ? 23.676  14.137  21.639 1.00 20.25 ? 153 PRO A CG  1 
ATOM   1186 C CD  . PRO A 1 145 ? 23.250  13.067  20.676 1.00 17.55 ? 153 PRO A CD  1 
ATOM   1187 N N   . GLU A 1 146 ? 20.128  16.430  21.159 1.00 22.96 ? 154 GLU A N   1 
ATOM   1188 C CA  . GLU A 1 146 ? 19.840  17.762  20.629 1.00 24.82 ? 154 GLU A CA  1 
ATOM   1189 C C   . GLU A 1 146 ? 19.486  18.633  21.828 1.00 26.89 ? 154 GLU A C   1 
ATOM   1190 O O   . GLU A 1 146 ? 18.358  18.585  22.328 1.00 24.75 ? 154 GLU A O   1 
ATOM   1191 C CB  . GLU A 1 146 ? 18.708  17.716  19.615 1.00 27.18 ? 154 GLU A CB  1 
ATOM   1192 C CG  . GLU A 1 146 ? 18.553  18.975  18.808 1.00 30.89 ? 154 GLU A CG  1 
ATOM   1193 C CD  . GLU A 1 146 ? 17.580  18.781  17.667 1.00 37.32 ? 154 GLU A CD  1 
ATOM   1194 O OE1 . GLU A 1 146 ? 17.958  18.116  16.677 1.00 40.90 ? 154 GLU A OE1 1 
ATOM   1195 O OE2 . GLU A 1 146 ? 16.435  19.267  17.775 1.00 41.17 ? 154 GLU A OE2 1 
ATOM   1196 N N   . ASP A 1 147 ? 20.455  19.421  22.286 1.00 25.84 ? 155 ASP A N   1 
ATOM   1197 C CA  . ASP A 1 147 ? 20.323  20.130  23.553 1.00 28.95 ? 155 ASP A CA  1 
ATOM   1198 C C   . ASP A 1 147 ? 19.997  19.172  24.697 1.00 26.19 ? 155 ASP A C   1 
ATOM   1199 O O   . ASP A 1 147 ? 20.849  18.363  25.081 1.00 28.74 ? 155 ASP A O   1 
ATOM   1200 C CB  . ASP A 1 147 ? 19.329  21.287  23.450 1.00 33.59 ? 155 ASP A CB  1 
ATOM   1201 C CG  . ASP A 1 147 ? 19.455  22.256  24.605 1.00 38.94 ? 155 ASP A CG  1 
ATOM   1202 O OD1 . ASP A 1 147 ? 20.590  22.694  24.891 1.00 48.39 ? 155 ASP A OD1 1 
ATOM   1203 O OD2 . ASP A 1 147 ? 18.430  22.541  25.255 1.00 42.10 ? 155 ASP A OD2 1 
ATOM   1204 N N   . VAL A 1 148 ? 18.775  19.233  25.236 1.00 28.89 ? 156 VAL A N   1 
ATOM   1205 C CA  . VAL A 1 148 ? 18.410  18.431  26.402 1.00 25.72 ? 156 VAL A CA  1 
ATOM   1206 C C   . VAL A 1 148 ? 17.582  17.199  26.051 1.00 25.88 ? 156 VAL A C   1 
ATOM   1207 O O   . VAL A 1 148 ? 17.260  16.413  26.956 1.00 22.94 ? 156 VAL A O   1 
ATOM   1208 C CB  . VAL A 1 148 ? 17.708  19.271  27.488 1.00 28.99 ? 156 VAL A CB  1 
ATOM   1209 C CG1 . VAL A 1 148 ? 18.656  20.361  27.998 1.00 31.37 ? 156 VAL A CG1 1 
ATOM   1210 C CG2 . VAL A 1 148 ? 16.432  19.873  26.948 1.00 32.80 ? 156 VAL A CG2 1 
ATOM   1211 N N   . VAL A 1 149 ? 17.243  16.998  24.778 1.00 23.87 ? 157 VAL A N   1 
ATOM   1212 C CA  . VAL A 1 149 ? 16.448  15.848  24.357 1.00 21.13 ? 157 VAL A CA  1 
ATOM   1213 C C   . VAL A 1 149 ? 17.291  14.869  23.549 1.00 22.98 ? 157 VAL A C   1 
ATOM   1214 O O   . VAL A 1 149 ? 18.386  15.172  23.068 1.00 21.83 ? 157 VAL A O   1 
ATOM   1215 C CB  . VAL A 1 149 ? 15.174  16.237  23.583 1.00 24.15 ? 157 VAL A CB  1 
ATOM   1216 C CG1 . VAL A 1 149 ? 14.430  17.342  24.308 1.00 23.44 ? 157 VAL A CG1 1 
ATOM   1217 C CG2 . VAL A 1 149 ? 15.529  16.646  22.162 1.00 24.17 ? 157 VAL A CG2 1 
ATOM   1218 N N   . LEU A 1 150 ? 16.762  13.661  23.410 1.00 18.81 ? 158 LEU A N   1 
ATOM   1219 C CA  . LEU A 1 150 ? 17.350  12.625  22.584 1.00 20.29 ? 158 LEU A CA  1 
ATOM   1220 C C   . LEU A 1 150 ? 16.382  12.365  21.445 1.00 19.57 ? 158 LEU A C   1 
ATOM   1221 O O   . LEU A 1 150 ? 15.172  12.255  21.671 1.00 21.65 ? 158 LEU A O   1 
ATOM   1222 C CB  . LEU A 1 150 ? 17.534  11.352  23.405 1.00 23.38 ? 158 LEU A CB  1 
ATOM   1223 C CG  . LEU A 1 150 ? 18.737  10.441  23.239 1.00 26.23 ? 158 LEU A CG  1 
ATOM   1224 C CD1 . LEU A 1 150 ? 20.026  11.251  23.250 1.00 20.64 ? 158 LEU A CD1 1 
ATOM   1225 C CD2 . LEU A 1 150 ? 18.743  9.374   24.324 1.00 20.63 ? 158 LEU A CD2 1 
ATOM   1226 N N   . LYS A 1 151 ? 16.895  12.288  20.233 1.00 17.53 ? 159 LYS A N   1 
ATOM   1227 C CA  . LYS A 1 151 ? 16.085  11.982  19.067 1.00 18.87 ? 159 LYS A CA  1 
ATOM   1228 C C   . LYS A 1 151 ? 16.565  10.676  18.466 1.00 20.64 ? 159 LYS A C   1 
ATOM   1229 O O   . LYS A 1 151 ? 17.769  10.402  18.438 1.00 21.52 ? 159 LYS A O   1 
ATOM   1230 C CB  . LYS A 1 151 ? 16.154  13.104  18.032 1.00 25.73 ? 159 LYS A CB  1 
ATOM   1231 C CG  . LYS A 1 151 ? 15.491  14.376  18.515 1.00 28.36 ? 159 LYS A CG  1 
ATOM   1232 C CD  . LYS A 1 151 ? 15.313  15.390  17.402 1.00 33.27 ? 159 LYS A CD  1 
ATOM   1233 C CE  . LYS A 1 151 ? 14.399  16.518  17.860 1.00 35.20 ? 159 LYS A CE  1 
ATOM   1234 N NZ  . LYS A 1 151 ? 14.300  17.604  16.850 1.00 41.76 ? 159 LYS A NZ  1 
ATOM   1235 N N   . GLY A 1 152 ? 15.621  9.862   18.016 1.00 19.39 ? 160 GLY A N   1 
ATOM   1236 C CA  . GLY A 1 152 ? 15.944  8.586   17.417 1.00 18.64 ? 160 GLY A CA  1 
ATOM   1237 C C   . GLY A 1 152 ? 15.245  8.416   16.087 1.00 18.85 ? 160 GLY A C   1 
ATOM   1238 O O   . GLY A 1 152 ? 14.118  8.876   15.884 1.00 19.69 ? 160 GLY A O   1 
ATOM   1239 N N   . ASP A 1 153 ? 15.941  7.745   15.175 1.00 18.92 ? 161 ASP A N   1 
ATOM   1240 C CA  . ASP A 1 153 ? 15.412  7.369   13.874 1.00 20.32 ? 161 ASP A CA  1 
ATOM   1241 C C   . ASP A 1 153 ? 15.578  5.870   13.683 1.00 19.11 ? 161 ASP A C   1 
ATOM   1242 O O   . ASP A 1 153 ? 16.626  5.299   14.022 1.00 19.90 ? 161 ASP A O   1 
ATOM   1243 C CB  . ASP A 1 153 ? 16.154  8.080   12.746 1.00 22.86 ? 161 ASP A CB  1 
ATOM   1244 C CG  . ASP A 1 153 ? 16.008  9.586   12.819 1.00 28.38 ? 161 ASP A CG  1 
ATOM   1245 O OD1 . ASP A 1 153 ? 14.879  10.089  12.635 1.00 35.83 ? 161 ASP A OD1 1 
ATOM   1246 O OD2 . ASP A 1 153 ? 17.018  10.271  13.075 1.00 33.91 ? 161 ASP A OD2 1 
ATOM   1247 N N   . ILE A 1 154 ? 14.534  5.230   13.154 1.00 18.78 ? 162 ILE A N   1 
ATOM   1248 C CA  . ILE A 1 154 ? 14.578  3.827   12.764 1.00 19.56 ? 162 ILE A CA  1 
ATOM   1249 C C   . ILE A 1 154 ? 14.057  3.707   11.340 1.00 22.78 ? 162 ILE A C   1 
ATOM   1250 O O   . ILE A 1 154 ? 12.983  4.234   11.019 1.00 19.81 ? 162 ILE A O   1 
ATOM   1251 C CB  . ILE A 1 154 ? 13.753  2.917   13.694 1.00 19.96 ? 162 ILE A CB  1 
ATOM   1252 C CG1 . ILE A 1 154 ? 13.978  3.286   15.159 1.00 20.78 ? 162 ILE A CG1 1 
ATOM   1253 C CG2 . ILE A 1 154 ? 14.115  1.462   13.440 1.00 21.62 ? 162 ILE A CG2 1 
ATOM   1254 C CD1 . ILE A 1 154 ? 13.141  2.482   16.136 1.00 23.26 ? 162 ILE A CD1 1 
ATOM   1255 N N   . LYS A 1 155 ? 14.822  2.999   10.510 1.00 22.76 ? 163 LYS A N   1 
ATOM   1256 C CA  . LYS A 1 155 ? 14.354  2.614   9.165  1.00 21.34 ? 163 LYS A CA  1 
ATOM   1257 C C   . LYS A 1 155 ? 13.903  1.180   9.400  1.00 24.04 ? 163 LYS A C   1 
ATOM   1258 O O   . LYS A 1 155 ? 14.753  0.293   9.425  1.00 28.24 ? 163 LYS A O   1 
ATOM   1259 C CB  . LYS A 1 155 ? 15.475  2.762   8.143  1.00 25.38 ? 163 LYS A CB  1 
ATOM   1260 C CG  . LYS A 1 155 ? 16.052  4.164   8.033  1.00 35.45 ? 163 LYS A CG  1 
ATOM   1261 C CD  . LYS A 1 155 ? 15.052  5.171   7.521  1.00 37.51 ? 163 LYS A CD  1 
ATOM   1262 C CE  . LYS A 1 155 ? 15.212  5.457   6.044  1.00 41.08 ? 163 LYS A CE  1 
ATOM   1263 N NZ  . LYS A 1 155 ? 13.982  5.144   5.279  1.00 42.25 ? 163 LYS A NZ  1 
ATOM   1264 N N   . HIS A 1 156 ? 12.615  0.992   9.609  1.00 25.24 ? 164 HIS A N   1 
ATOM   1265 C CA  . HIS A 1 156 ? 12.115  -0.311  10.081 1.00 25.93 ? 164 HIS A CA  1 
ATOM   1266 C C   . HIS A 1 156 ? 11.315  -1.068  9.022  1.00 21.91 ? 164 HIS A C   1 
ATOM   1267 O O   . HIS A 1 156 ? 10.971  -0.530  7.973  1.00 23.82 ? 164 HIS A O   1 
ATOM   1268 C CB  . HIS A 1 156 ? 11.252  -0.010  11.309 1.00 26.20 ? 164 HIS A CB  1 
ATOM   1269 C CG  . HIS A 1 156 ? 11.362  -0.947  12.449 1.00 23.88 ? 164 HIS A CG  1 
ATOM   1270 N ND1 . HIS A 1 156 ? 11.730  -2.266  12.329 1.00 28.05 ? 164 HIS A ND1 1 
ATOM   1271 C CD2 . HIS A 1 156 ? 11.112  -0.741  13.736 1.00 22.81 ? 164 HIS A CD2 1 
ATOM   1272 C CE1 . HIS A 1 156 ? 11.701  -2.827  13.523 1.00 28.67 ? 164 HIS A CE1 1 
ATOM   1273 N NE2 . HIS A 1 156 ? 11.339  -1.915  14.391 1.00 31.97 ? 164 HIS A NE2 1 
ATOM   1274 N N   . ALA A 1 157 ? 11.049  -2.323  9.352  1.00 20.32 ? 165 ALA A N   1 
ATOM   1275 C CA  . ALA A 1 157 ? 10.264  -3.140  8.419  1.00 20.01 ? 165 ALA A CA  1 
ATOM   1276 C C   . ALA A 1 157 ? 9.433   -4.191  9.141  1.00 18.48 ? 165 ALA A C   1 
ATOM   1277 O O   . ALA A 1 157 ? 9.926   -4.810  10.074 1.00 19.48 ? 165 ALA A O   1 
ATOM   1278 C CB  . ALA A 1 157 ? 11.153  -3.789  7.397  1.00 25.16 ? 165 ALA A CB  1 
ATOM   1279 N N   . LEU A 1 158 ? 8.186   -4.318  8.700  1.00 16.98 ? 166 LEU A N   1 
ATOM   1280 C CA  . LEU A 1 158 ? 7.317   -5.390  9.157  1.00 17.86 ? 166 LEU A CA  1 
ATOM   1281 C C   . LEU A 1 158 ? 7.373   -6.533  8.157  1.00 18.94 ? 166 LEU A C   1 
ATOM   1282 O O   . LEU A 1 158 ? 7.412   -6.306  6.942  1.00 19.82 ? 166 LEU A O   1 
ATOM   1283 C CB  . LEU A 1 158 ? 5.877   -4.894  9.229  1.00 18.53 ? 166 LEU A CB  1 
ATOM   1284 C CG  . LEU A 1 158 ? 5.570   -4.141  10.511 1.00 19.82 ? 166 LEU A CG  1 
ATOM   1285 C CD1 . LEU A 1 158 ? 4.301   -3.312  10.330 1.00 19.60 ? 166 LEU A CD1 1 
ATOM   1286 C CD2 . LEU A 1 158 ? 5.388   -5.152  11.631 1.00 19.02 ? 166 LEU A CD2 1 
ATOM   1287 N N   . ARG A 1 159 ? 7.382   -7.759  8.668  1.00 18.62 ? 167 ARG A N   1 
ATOM   1288 C CA  . ARG A 1 159 ? 7.238   -8.928  7.812  1.00 20.91 ? 167 ARG A CA  1 
ATOM   1289 C C   . ARG A 1 159 ? 5.783   -9.080  7.379  1.00 18.59 ? 167 ARG A C   1 
ATOM   1290 O O   . ARG A 1 159 ? 4.861   -8.721  8.112  1.00 19.63 ? 167 ARG A O   1 
ATOM   1291 C CB  . ARG A 1 159 ? 7.651   -10.185 8.575  1.00 20.61 ? 167 ARG A CB  1 
ATOM   1292 C CG  . ARG A 1 159 ? 9.123   -10.206 8.978  1.00 23.11 ? 167 ARG A CG  1 
ATOM   1293 C CD  . ARG A 1 159 ? 9.460   -11.455 9.779  1.00 28.03 ? 167 ARG A CD  1 
ATOM   1294 N NE  . ARG A 1 159 ? 8.791   -11.454 11.072 1.00 31.81 ? 167 ARG A NE  1 
ATOM   1295 C CZ  . ARG A 1 159 ? 9.368   -11.079 12.206 1.00 29.13 ? 167 ARG A CZ  1 
ATOM   1296 N NH1 . ARG A 1 159 ? 10.644  -10.728 12.249 1.00 30.42 ? 167 ARG A NH1 1 
ATOM   1297 N NH2 . ARG A 1 159 ? 8.650   -11.063 13.323 1.00 30.24 ? 167 ARG A NH2 1 
ATOM   1298 N N   . LEU A 1 160 ? 5.583   -9.626  6.181  1.00 19.11 ? 168 LEU A N   1 
ATOM   1299 C CA  . LEU A 1 160 ? 4.257   -9.892  5.644  1.00 21.10 ? 168 LEU A CA  1 
ATOM   1300 C C   . LEU A 1 160 ? 3.986   -11.392 5.605  1.00 21.73 ? 168 LEU A C   1 
ATOM   1301 O O   . LEU A 1 160 ? 4.904   -12.205 5.441  1.00 22.86 ? 168 LEU A O   1 
ATOM   1302 C CB  . LEU A 1 160 ? 4.119   -9.330  4.226  1.00 19.41 ? 168 LEU A CB  1 
ATOM   1303 C CG  . LEU A 1 160 ? 4.229   -7.814  4.075  1.00 20.24 ? 168 LEU A CG  1 
ATOM   1304 C CD1 . LEU A 1 160 ? 4.098   -7.413  2.612  1.00 21.03 ? 168 LEU A CD1 1 
ATOM   1305 C CD2 . LEU A 1 160 ? 3.185   -7.110  4.945  1.00 22.84 ? 168 LEU A CD2 1 
ATOM   1306 N N   . LYS A 1 161 ? 2.703   -11.748 5.736  1.00 22.60 ? 169 LYS A N   1 
ATOM   1307 C CA  . LYS A 1 161 ? 2.319   -13.156 5.675  1.00 25.40 ? 169 LYS A CA  1 
ATOM   1308 C C   . LYS A 1 161 ? 2.747   -13.817 4.370  1.00 26.13 ? 169 LYS A C   1 
ATOM   1309 O O   . LYS A 1 161 ? 3.086   -15.008 4.364  1.00 26.83 ? 169 LYS A O   1 
ATOM   1310 C CB  . LYS A 1 161 ? 0.820   -13.323 5.930  1.00 26.91 ? 169 LYS A CB  1 
ATOM   1311 C CG  . LYS A 1 161 ? 0.458   -13.184 7.402  1.00 29.79 ? 169 LYS A CG  1 
ATOM   1312 C CD  . LYS A 1 161 ? -1.034  -13.221 7.657  1.00 32.49 ? 169 LYS A CD  1 
ATOM   1313 C CE  . LYS A 1 161 ? -1.340  -12.606 9.022  1.00 34.85 ? 169 LYS A CE  1 
ATOM   1314 N NZ  . LYS A 1 161 ? -2.721  -12.952 9.487  1.00 35.55 ? 169 LYS A NZ  1 
ATOM   1315 N N   . ASP A 1 162 ? 2.757   -13.069 3.262  1.00 23.14 ? 170 ASP A N   1 
ATOM   1316 C CA  . ASP A 1 162 ? 3.158   -13.631 1.975  1.00 25.18 ? 170 ASP A CA  1 
ATOM   1317 C C   . ASP A 1 162 ? 4.672   -13.665 1.770  1.00 26.54 ? 170 ASP A C   1 
ATOM   1318 O O   . ASP A 1 162 ? 5.126   -14.014 0.670  1.00 26.13 ? 170 ASP A O   1 
ATOM   1319 C CB  . ASP A 1 162 ? 2.440   -12.924 0.812  1.00 25.89 ? 170 ASP A CB  1 
ATOM   1320 C CG  . ASP A 1 162 ? 2.949   -11.500 0.560  1.00 25.08 ? 170 ASP A CG  1 
ATOM   1321 O OD1 . ASP A 1 162 ? 3.903   -11.043 1.220  1.00 25.73 ? 170 ASP A OD1 1 
ATOM   1322 O OD2 . ASP A 1 162 ? 2.379   -10.827 -0.329 1.00 25.43 ? 170 ASP A OD2 1 
ATOM   1323 N N   . GLY A 1 163 ? 5.456   -13.302 2.791  1.00 23.87 ? 171 GLY A N   1 
ATOM   1324 C CA  . GLY A 1 163 ? 6.896   -13.327 2.708  1.00 24.71 ? 171 GLY A CA  1 
ATOM   1325 C C   . GLY A 1 163 ? 7.536   -12.012 2.326  1.00 24.66 ? 171 GLY A C   1 
ATOM   1326 O O   . GLY A 1 163 ? 8.765   -11.896 2.399  1.00 27.29 ? 171 GLY A O   1 
ATOM   1327 N N   . GLY A 1 164 ? 6.750   -11.018 1.924  1.00 21.78 ? 172 GLY A N   1 
ATOM   1328 C CA  . GLY A 1 164 ? 7.282   -9.716  1.600  1.00 22.16 ? 172 GLY A CA  1 
ATOM   1329 C C   . GLY A 1 164 ? 7.576   -8.889  2.842  1.00 23.16 ? 172 GLY A C   1 
ATOM   1330 O O   . GLY A 1 164 ? 7.604   -9.378  3.973  1.00 21.61 ? 172 GLY A O   1 
ATOM   1331 N N   . ARG A 1 165 ? 7.806   -7.598  2.607  1.00 24.30 ? 173 ARG A N   1 
ATOM   1332 C CA  . ARG A 1 165 ? 8.168   -6.654  3.656  1.00 22.62 ? 173 ARG A CA  1 
ATOM   1333 C C   . ARG A 1 165 ? 7.356   -5.381  3.483  1.00 22.00 ? 173 ARG A C   1 
ATOM   1334 O O   . ARG A 1 165 ? 6.832   -5.098  2.405  1.00 23.81 ? 173 ARG A O   1 
ATOM   1335 C CB  . ARG A 1 165 ? 9.657   -6.288  3.609  1.00 25.37 ? 173 ARG A CB  1 
ATOM   1336 C CG  . ARG A 1 165 ? 10.598  -7.453  3.778  1.00 32.06 ? 173 ARG A CG  1 
ATOM   1337 C CD  . ARG A 1 165 ? 12.028  -7.060  3.455  1.00 31.20 ? 173 ARG A CD  1 
ATOM   1338 N NE  . ARG A 1 165 ? 12.658  -6.310  4.537  1.00 30.37 ? 173 ARG A NE  1 
ATOM   1339 C CZ  . ARG A 1 165 ? 13.233  -5.123  4.396  1.00 31.73 ? 173 ARG A CZ  1 
ATOM   1340 N NH1 . ARG A 1 165 ? 13.277  -4.508  3.223  1.00 28.77 ? 173 ARG A NH1 1 
ATOM   1341 N NH2 . ARG A 1 165 ? 13.794  -4.545  5.455  1.00 28.55 ? 173 ARG A NH2 1 
ATOM   1342 N N   . TYR A 1 166 ? 7.255   -4.617  4.567  1.00 16.30 ? 174 TYR A N   1 
ATOM   1343 C CA  . TYR A 1 166 ? 6.435   -3.407  4.610  1.00 17.22 ? 174 TYR A CA  1 
ATOM   1344 C C   . TYR A 1 166 ? 7.212   -2.386  5.425  1.00 17.28 ? 174 TYR A C   1 
ATOM   1345 O O   . TYR A 1 166 ? 7.373   -2.564  6.634  1.00 18.23 ? 174 TYR A O   1 
ATOM   1346 C CB  . TYR A 1 166 ? 5.106   -3.747  5.276  1.00 18.95 ? 174 TYR A CB  1 
ATOM   1347 C CG  . TYR A 1 166 ? 4.135   -2.612  5.483  1.00 17.77 ? 174 TYR A CG  1 
ATOM   1348 C CD1 . TYR A 1 166 ? 3.742   -1.781  4.427  1.00 17.83 ? 174 TYR A CD1 1 
ATOM   1349 C CD2 . TYR A 1 166 ? 3.577   -2.393  6.734  1.00 18.08 ? 174 TYR A CD2 1 
ATOM   1350 C CE1 . TYR A 1 166 ? 2.818   -0.753  4.637  1.00 16.98 ? 174 TYR A CE1 1 
ATOM   1351 C CE2 . TYR A 1 166 ? 2.660   -1.392  6.942  1.00 17.43 ? 174 TYR A CE2 1 
ATOM   1352 C CZ  . TYR A 1 166 ? 2.283   -0.574  5.904  1.00 17.16 ? 174 TYR A CZ  1 
ATOM   1353 O OH  . TYR A 1 166 ? 1.371   0.420   6.168  1.00 18.06 ? 174 TYR A OH  1 
ATOM   1354 N N   . LEU A 1 167 ? 7.696   -1.331  4.772  1.00 17.67 ? 175 LEU A N   1 
ATOM   1355 C CA  . LEU A 1 167 ? 8.667   -0.430  5.386  1.00 18.08 ? 175 LEU A CA  1 
ATOM   1356 C C   . LEU A 1 167 ? 7.986   0.704   6.147  1.00 18.63 ? 175 LEU A C   1 
ATOM   1357 O O   . LEU A 1 167 ? 6.910   1.190   5.766  1.00 17.53 ? 175 LEU A O   1 
ATOM   1358 C CB  . LEU A 1 167 ? 9.589   0.164   4.322  1.00 18.68 ? 175 LEU A CB  1 
ATOM   1359 C CG  . LEU A 1 167 ? 10.282  -0.839  3.412  1.00 25.53 ? 175 LEU A CG  1 
ATOM   1360 C CD1 . LEU A 1 167 ? 11.164  -0.115  2.414  1.00 27.35 ? 175 LEU A CD1 1 
ATOM   1361 C CD2 . LEU A 1 167 ? 11.077  -1.820  4.242  1.00 26.88 ? 175 LEU A CD2 1 
ATOM   1362 N N   . ALA A 1 168 ? 8.644   1.144   7.222  1.00 18.28 ? 176 ALA A N   1 
ATOM   1363 C CA  . ALA A 1 168 ? 8.181   2.277   8.009  1.00 19.99 ? 176 ALA A CA  1 
ATOM   1364 C C   . ALA A 1 168 ? 9.392   3.038   8.515  1.00 20.84 ? 176 ALA A C   1 
ATOM   1365 O O   . ALA A 1 168 ? 10.415  2.433   8.846  1.00 24.77 ? 176 ALA A O   1 
ATOM   1366 C CB  . ALA A 1 168 ? 7.369   1.831   9.228  1.00 22.04 ? 176 ALA A CB  1 
ATOM   1367 N N   . ASP A 1 169 ? 9.270   4.356   8.571  1.00 19.07 ? 177 ASP A N   1 
ATOM   1368 C CA  . ASP A 1 169 ? 10.262  5.200   9.223  1.00 19.46 ? 177 ASP A CA  1 
ATOM   1369 C C   . ASP A 1 169 ? 9.690   5.677   10.547 1.00 20.05 ? 177 ASP A C   1 
ATOM   1370 O O   . ASP A 1 169 ? 8.576   6.211   10.584 1.00 18.44 ? 177 ASP A O   1 
ATOM   1371 C CB  . ASP A 1 169 ? 10.631  6.416   8.370  1.00 24.07 ? 177 ASP A CB  1 
ATOM   1372 C CG  . ASP A 1 169 ? 11.328  6.042   7.074  1.00 35.05 ? 177 ASP A CG  1 
ATOM   1373 O OD1 . ASP A 1 169 ? 11.964  4.969   7.015  1.00 40.28 ? 177 ASP A OD1 1 
ATOM   1374 O OD2 . ASP A 1 169 ? 11.221  6.819   6.103  1.00 44.60 ? 177 ASP A OD2 1 
ATOM   1375 N N   . PHE A 1 170 ? 10.446  5.481   11.627 1.00 19.37 ? 178 PHE A N   1 
ATOM   1376 C CA  . PHE A 1 170 ? 10.103  6.003   12.946 1.00 18.04 ? 178 PHE A CA  1 
ATOM   1377 C C   . PHE A 1 170 ? 10.980  7.215   13.233 1.00 17.63 ? 178 PHE A C   1 
ATOM   1378 O O   . PHE A 1 170 ? 12.197  7.175   13.019 1.00 20.03 ? 178 PHE A O   1 
ATOM   1379 C CB  . PHE A 1 170 ? 10.442  5.005   14.053 1.00 17.80 ? 178 PHE A CB  1 
ATOM   1380 C CG  . PHE A 1 170 ? 9.532   3.804   14.161 1.00 21.52 ? 178 PHE A CG  1 
ATOM   1381 C CD1 . PHE A 1 170 ? 9.005   3.181   13.042 1.00 25.38 ? 178 PHE A CD1 1 
ATOM   1382 C CD2 . PHE A 1 170 ? 9.307   3.229   15.406 1.00 22.47 ? 178 PHE A CD2 1 
ATOM   1383 C CE1 . PHE A 1 170 ? 8.211   2.048   13.170 1.00 26.94 ? 178 PHE A CE1 1 
ATOM   1384 C CE2 . PHE A 1 170 ? 8.526   2.099   15.542 1.00 22.43 ? 178 PHE A CE2 1 
ATOM   1385 C CZ  . PHE A 1 170 ? 7.980   1.505   14.427 1.00 25.64 ? 178 PHE A CZ  1 
ATOM   1386 N N   . LYS A 1 171 ? 10.378  8.266   13.768 1.00 17.78 ? 179 LYS A N   1 
ATOM   1387 C CA  . LYS A 1 171 ? 11.103  9.393   14.342 1.00 17.57 ? 179 LYS A CA  1 
ATOM   1388 C C   . LYS A 1 171 ? 10.550  9.601   15.739 1.00 18.07 ? 179 LYS A C   1 
ATOM   1389 O O   . LYS A 1 171 ? 9.336   9.783   15.909 1.00 18.28 ? 179 LYS A O   1 
ATOM   1390 C CB  . LYS A 1 171 ? 10.927  10.666  13.508 1.00 20.33 ? 179 LYS A CB  1 
ATOM   1391 C CG  . LYS A 1 171 ? 11.664  10.614  12.194 1.00 27.92 ? 179 LYS A CG  1 
ATOM   1392 C CD  . LYS A 1 171 ? 11.536  11.909  11.420 1.00 34.44 ? 179 LYS A CD  1 
ATOM   1393 C CE  . LYS A 1 171 ? 12.343  11.841  10.133 1.00 40.27 ? 179 LYS A CE  1 
ATOM   1394 N NZ  . LYS A 1 171 ? 13.778  11.552  10.399 1.00 42.98 ? 179 LYS A NZ  1 
ATOM   1395 N N   . THR A 1 172 ? 11.417  9.520   16.739 1.00 18.86 ? 180 THR A N   1 
ATOM   1396 C CA  . THR A 1 172 ? 11.008  9.676   18.124 1.00 17.60 ? 180 THR A CA  1 
ATOM   1397 C C   . THR A 1 172 ? 11.854  10.744  18.795 1.00 20.44 ? 180 THR A C   1 
ATOM   1398 O O   . THR A 1 172 ? 13.058  10.841  18.545 1.00 18.23 ? 180 THR A O   1 
ATOM   1399 C CB  . THR A 1 172 ? 11.168  8.365   18.891 1.00 19.22 ? 180 THR A CB  1 
ATOM   1400 O OG1 . THR A 1 172 ? 10.605  7.285   18.129 1.00 19.98 ? 180 THR A OG1 1 
ATOM   1401 C CG2 . THR A 1 172 ? 10.471  8.452   20.236 1.00 18.81 ? 180 THR A CG2 1 
ATOM   1402 N N   . THR A 1 173 ? 11.221  11.541  19.641 1.00 18.43 ? 181 THR A N   1 
ATOM   1403 C CA  . THR A 1 173 ? 11.904  12.457  20.545 1.00 17.57 ? 181 THR A CA  1 
ATOM   1404 C C   . THR A 1 173 ? 11.629  12.024  21.976 1.00 18.43 ? 181 THR A C   1 
ATOM   1405 O O   . THR A 1 173 ? 10.471  11.786  22.341 1.00 20.09 ? 181 THR A O   1 
ATOM   1406 C CB  . THR A 1 173 ? 11.410  13.884  20.332 1.00 22.17 ? 181 THR A CB  1 
ATOM   1407 O OG1 . THR A 1 173 ? 11.652  14.264  18.974 1.00 23.29 ? 181 THR A OG1 1 
ATOM   1408 C CG2 . THR A 1 173 ? 12.143  14.849  21.273 1.00 22.37 ? 181 THR A CG2 1 
ATOM   1409 N N   . TYR A 1 174 ? 12.688  11.897  22.775 1.00 17.69 ? 182 TYR A N   1 
ATOM   1410 C CA  . TYR A 1 174 ? 12.596  11.526  24.180 1.00 15.64 ? 182 TYR A CA  1 
ATOM   1411 C C   . TYR A 1 174 ? 13.000  12.734  25.012 1.00 20.01 ? 182 TYR A C   1 
ATOM   1412 O O   . TYR A 1 174 ? 14.043  13.350  24.744 1.00 19.46 ? 182 TYR A O   1 
ATOM   1413 C CB  . TYR A 1 174 ? 13.551  10.365  24.487 1.00 16.83 ? 182 TYR A CB  1 
ATOM   1414 C CG  . TYR A 1 174 ? 13.367  9.176   23.567 1.00 15.02 ? 182 TYR A CG  1 
ATOM   1415 C CD1 . TYR A 1 174 ? 12.421  8.179   23.854 1.00 17.35 ? 182 TYR A CD1 1 
ATOM   1416 C CD2 . TYR A 1 174 ? 14.105  9.057   22.391 1.00 18.72 ? 182 TYR A CD2 1 
ATOM   1417 C CE1 . TYR A 1 174 ? 12.258  7.095   23.008 1.00 18.73 ? 182 TYR A CE1 1 
ATOM   1418 C CE2 . TYR A 1 174 ? 13.925  7.980   21.533 1.00 20.03 ? 182 TYR A CE2 1 
ATOM   1419 C CZ  . TYR A 1 174 ? 13.001  7.001   21.851 1.00 22.26 ? 182 TYR A CZ  1 
ATOM   1420 O OH  . TYR A 1 174 ? 12.816  5.936   21.002 1.00 24.21 ? 182 TYR A OH  1 
ATOM   1421 N N   . ARG A 1 175 ? 12.207  13.059  26.031 1.00 19.89 ? 183 ARG A N   1 
ATOM   1422 C CA  . ARG A 1 175 ? 12.407  14.294  26.793 1.00 20.40 ? 183 ARG A CA  1 
ATOM   1423 C C   . ARG A 1 175 ? 12.366  13.982  28.285 1.00 17.95 ? 183 ARG A C   1 
ATOM   1424 O O   . ARG A 1 175 ? 11.292  13.749  28.850 1.00 20.14 ? 183 ARG A O   1 
ATOM   1425 C CB  . ARG A 1 175 ? 11.357  15.349  26.420 1.00 22.87 ? 183 ARG A CB  1 
ATOM   1426 C CG  . ARG A 1 175 ? 11.509  16.657  27.205 1.00 34.88 ? 183 ARG A CG  1 
ATOM   1427 C CD  . ARG A 1 175 ? 10.426  17.694  26.868 1.00 39.58 ? 183 ARG A CD  1 
ATOM   1428 N NE  . ARG A 1 175 ? 10.883  18.811  26.037 1.00 46.40 ? 183 ARG A NE  1 
ATOM   1429 C CZ  . ARG A 1 175 ? 11.904  19.623  26.298 1.00 43.72 ? 183 ARG A CZ  1 
ATOM   1430 N NH1 . ARG A 1 175 ? 12.641  19.495  27.393 1.00 46.39 ? 183 ARG A NH1 1 
ATOM   1431 N NH2 . ARG A 1 175 ? 12.190  20.599  25.438 1.00 42.32 ? 183 ARG A NH2 1 
ATOM   1432 N N   . ALA A 1 176 ? 13.533  13.975  28.926 1.00 18.64 ? 184 ALA A N   1 
ATOM   1433 C CA  . ALA A 1 176 ? 13.599  13.784  30.363 1.00 17.79 ? 184 ALA A CA  1 
ATOM   1434 C C   . ALA A 1 176 ? 12.956  14.968  31.085 1.00 20.23 ? 184 ALA A C   1 
ATOM   1435 O O   . ALA A 1 176 ? 12.996  16.110  30.612 1.00 22.09 ? 184 ALA A O   1 
ATOM   1436 C CB  . ALA A 1 176 ? 15.060  13.653  30.803 1.00 19.00 ? 184 ALA A CB  1 
ATOM   1437 N N   . LYS A 1 177 ? 12.359  14.687  32.242 1.00 20.16 ? 185 LYS A N   1 
ATOM   1438 C CA  . LYS A 1 177 ? 11.679  15.716  33.024 1.00 22.87 ? 185 LYS A CA  1 
ATOM   1439 C C   . LYS A 1 177 ? 12.617  16.469  33.961 1.00 24.25 ? 185 LYS A C   1 
ATOM   1440 O O   . LYS A 1 177 ? 12.158  17.335  34.709 1.00 29.18 ? 185 LYS A O   1 
ATOM   1441 C CB  . LYS A 1 177 ? 10.507  15.115  33.803 1.00 22.19 ? 185 LYS A CB  1 
ATOM   1442 C CG  . LYS A 1 177 ? 9.393   14.618  32.899 1.00 21.90 ? 185 LYS A CG  1 
ATOM   1443 C CD  . LYS A 1 177 ? 8.385   13.794  33.679 1.00 24.24 ? 185 LYS A CD  1 
ATOM   1444 C CE  . LYS A 1 177 ? 7.284   13.297  32.768 1.00 23.44 ? 185 LYS A CE  1 
ATOM   1445 N NZ  . LYS A 1 177 ? 6.464   12.246  33.452 1.00 23.04 ? 185 LYS A NZ  1 
ATOM   1446 N N   . LYS A 1 178 ? 13.905  16.154  33.944 1.00 22.02 ? 186 LYS A N   1 
ATOM   1447 C CA  . LYS A 1 178 ? 14.917  16.891  34.686 1.00 23.78 ? 186 LYS A CA  1 
ATOM   1448 C C   . LYS A 1 178 ? 16.232  16.758  33.940 1.00 24.51 ? 186 LYS A C   1 
ATOM   1449 O O   . LYS A 1 178 ? 16.367  15.891  33.069 1.00 23.89 ? 186 LYS A O   1 
ATOM   1450 C CB  . LYS A 1 178 ? 15.045  16.355  36.115 1.00 26.32 ? 186 LYS A CB  1 
ATOM   1451 C CG  . LYS A 1 178 ? 15.575  14.953  36.198 1.00 25.67 ? 186 LYS A CG  1 
ATOM   1452 C CD  . LYS A 1 178 ? 15.712  14.532  37.646 1.00 29.35 ? 186 LYS A CD  1 
ATOM   1453 C CE  . LYS A 1 178 ? 16.132  13.091  37.748 1.00 27.78 ? 186 LYS A CE  1 
ATOM   1454 N NZ  . LYS A 1 178 ? 16.516  12.717  39.139 1.00 30.10 ? 186 LYS A NZ  1 
ATOM   1455 N N   . PRO A 1 179 ? 17.217  17.615  34.235 1.00 23.98 ? 187 PRO A N   1 
ATOM   1456 C CA  . PRO A 1 179 ? 18.511  17.499  33.554 1.00 22.96 ? 187 PRO A CA  1 
ATOM   1457 C C   . PRO A 1 179 ? 19.169  16.171  33.877 1.00 21.10 ? 187 PRO A C   1 
ATOM   1458 O O   . PRO A 1 179 ? 19.090  15.679  35.005 1.00 23.65 ? 187 PRO A O   1 
ATOM   1459 C CB  . PRO A 1 179 ? 19.328  18.659  34.137 1.00 25.07 ? 187 PRO A CB  1 
ATOM   1460 C CG  . PRO A 1 179 ? 18.330  19.603  34.692 1.00 26.48 ? 187 PRO A CG  1 
ATOM   1461 C CD  . PRO A 1 179 ? 17.190  18.755  35.169 1.00 30.83 ? 187 PRO A CD  1 
ATOM   1462 N N   . VAL A 1 180 ? 19.827  15.596  32.868 1.00 20.95 ? 188 VAL A N   1 
ATOM   1463 C CA  . VAL A 1 180 ? 20.603  14.373  33.017 1.00 21.67 ? 188 VAL A CA  1 
ATOM   1464 C C   . VAL A 1 180 ? 21.917  14.554  32.269 1.00 21.84 ? 188 VAL A C   1 
ATOM   1465 O O   . VAL A 1 180 ? 22.066  15.461  31.448 1.00 24.13 ? 188 VAL A O   1 
ATOM   1466 C CB  . VAL A 1 180 ? 19.845  13.126  32.496 1.00 22.83 ? 188 VAL A CB  1 
ATOM   1467 C CG1 . VAL A 1 180 ? 18.503  12.981  33.212 1.00 21.84 ? 188 VAL A CG1 1 
ATOM   1468 C CG2 . VAL A 1 180 ? 19.636  13.220  31.000 1.00 21.65 ? 188 VAL A CG2 1 
ATOM   1469 N N   . GLN A 1 181 ? 22.874  13.681  32.568 1.00 21.11 ? 189 GLN A N   1 
ATOM   1470 C CA  . GLN A 1 181 ? 24.110  13.630  31.796 1.00 20.78 ? 189 GLN A CA  1 
ATOM   1471 C C   . GLN A 1 181 ? 23.793  13.101  30.407 1.00 24.34 ? 189 GLN A C   1 
ATOM   1472 O O   . GLN A 1 181 ? 23.265  11.993  30.268 1.00 22.39 ? 189 GLN A O   1 
ATOM   1473 C CB  . GLN A 1 181 ? 25.116  12.717  32.486 1.00 24.67 ? 189 GLN A CB  1 
ATOM   1474 C CG  . GLN A 1 181 ? 26.517  12.757  31.879 1.00 27.20 ? 189 GLN A CG  1 
ATOM   1475 C CD  . GLN A 1 181 ? 27.441  11.698  32.465 1.00 35.68 ? 189 GLN A CD  1 
ATOM   1476 O OE1 . GLN A 1 181 ? 27.032  10.888  33.297 1.00 36.86 ? 189 GLN A OE1 1 
ATOM   1477 N NE2 . GLN A 1 181 ? 28.685  11.681  32.004 1.00 36.02 ? 189 GLN A NE2 1 
ATOM   1478 N N   . MET A 1 182 ? 24.111  13.881  29.384 1.00 23.16 ? 190 MET A N   1 
ATOM   1479 C CA  . MET A 1 182 ? 23.718  13.514  28.026 1.00 21.74 ? 190 MET A CA  1 
ATOM   1480 C C   . MET A 1 182 ? 24.717  12.539  27.412 1.00 21.86 ? 190 MET A C   1 
ATOM   1481 O O   . MET A 1 182 ? 25.932  12.758  27.504 1.00 22.29 ? 190 MET A O   1 
ATOM   1482 C CB  . MET A 1 182 ? 23.609  14.739  27.131 1.00 23.45 ? 190 MET A CB  1 
ATOM   1483 C CG  . MET A 1 182 ? 22.586  15.757  27.572 1.00 19.22 ? 190 MET A CG  1 
ATOM   1484 S SD  . MET A 1 182 ? 20.925  15.055  27.547 1.00 22.87 ? 190 MET A SD  1 
ATOM   1485 C CE  . MET A 1 182 ? 20.520  15.299  25.820 1.00 24.95 ? 190 MET A CE  1 
ATOM   1486 N N   . PRO A 1 183 ? 24.253  11.472  26.774 1.00 17.76 ? 191 PRO A N   1 
ATOM   1487 C CA  . PRO A 1 183 ? 25.148  10.648  25.960 1.00 20.85 ? 191 PRO A CA  1 
ATOM   1488 C C   . PRO A 1 183 ? 25.458  11.349  24.645 1.00 17.77 ? 191 PRO A C   1 
ATOM   1489 O O   . PRO A 1 183 ? 24.779  12.290  24.230 1.00 20.61 ? 191 PRO A O   1 
ATOM   1490 C CB  . PRO A 1 183 ? 24.308  9.387   25.708 1.00 19.74 ? 191 PRO A CB  1 
ATOM   1491 C CG  . PRO A 1 183 ? 22.890  9.936   25.633 1.00 19.30 ? 191 PRO A CG  1 
ATOM   1492 C CD  . PRO A 1 183 ? 22.839  11.042  26.671 1.00 17.62 ? 191 PRO A CD  1 
ATOM   1493 N N   . GLY A 1 184 ? 26.511  10.869  23.991 1.00 17.79 ? 192 GLY A N   1 
ATOM   1494 C CA  . GLY A 1 184 ? 26.702  11.170  22.594 1.00 18.28 ? 192 GLY A CA  1 
ATOM   1495 C C   . GLY A 1 184 ? 25.742  10.341  21.766 1.00 19.33 ? 192 GLY A C   1 
ATOM   1496 O O   . GLY A 1 184 ? 24.865  9.646   22.281 1.00 22.84 ? 192 GLY A O   1 
ATOM   1497 N N   . ALA A 1 185 ? 25.896  10.436  20.454 1.00 17.71 ? 193 ALA A N   1 
ATOM   1498 C CA  . ALA A 1 185 ? 25.055  9.620   19.587 1.00 16.66 ? 193 ALA A CA  1 
ATOM   1499 C C   . ALA A 1 185 ? 25.433  8.153   19.746 1.00 19.04 ? 193 ALA A C   1 
ATOM   1500 O O   . ALA A 1 185 ? 26.593  7.803   19.953 1.00 19.54 ? 193 ALA A O   1 
ATOM   1501 C CB  . ALA A 1 185 ? 25.216  10.049  18.132 1.00 18.53 ? 193 ALA A CB  1 
ATOM   1502 N N   . PHE A 1 186 ? 24.441  7.280   19.643 1.00 17.98 ? 194 PHE A N   1 
ATOM   1503 C CA  . PHE A 1 186 ? 24.659  5.856   19.823 1.00 17.28 ? 194 PHE A CA  1 
ATOM   1504 C C   . PHE A 1 186 ? 23.483  5.134   19.177 1.00 15.13 ? 194 PHE A C   1 
ATOM   1505 O O   . PHE A 1 186 ? 22.553  5.764   18.663 1.00 17.42 ? 194 PHE A O   1 
ATOM   1506 C CB  . PHE A 1 186 ? 24.826  5.497   21.306 1.00 18.74 ? 194 PHE A CB  1 
ATOM   1507 C CG  . PHE A 1 186 ? 23.581  5.713   22.125 1.00 16.88 ? 194 PHE A CG  1 
ATOM   1508 C CD1 . PHE A 1 186 ? 23.199  6.987   22.520 1.00 17.74 ? 194 PHE A CD1 1 
ATOM   1509 C CD2 . PHE A 1 186 ? 22.797  4.639   22.501 1.00 16.58 ? 194 PHE A CD2 1 
ATOM   1510 C CE1 . PHE A 1 186 ? 22.038  7.202   23.268 1.00 18.69 ? 194 PHE A CE1 1 
ATOM   1511 C CE2 . PHE A 1 186 ? 21.634  4.838   23.265 1.00 17.34 ? 194 PHE A CE2 1 
ATOM   1512 C CZ  . PHE A 1 186 ? 21.254  6.116   23.638 1.00 17.72 ? 194 PHE A CZ  1 
ATOM   1513 N N   . ASN A 1 187 ? 23.550  3.810   19.195 1.00 15.47 ? 195 ASN A N   1 
ATOM   1514 C CA  . ASN A 1 187 ? 22.533  2.965   18.585 1.00 15.65 ? 195 ASN A CA  1 
ATOM   1515 C C   . ASN A 1 187 ? 21.893  2.078   19.640 1.00 17.41 ? 195 ASN A C   1 
ATOM   1516 O O   . ASN A 1 187 ? 22.517  1.719   20.640 1.00 16.03 ? 195 ASN A O   1 
ATOM   1517 C CB  . ASN A 1 187 ? 23.149  2.091   17.486 1.00 18.49 ? 195 ASN A CB  1 
ATOM   1518 C CG  . ASN A 1 187 ? 23.659  2.910   16.316 1.00 24.78 ? 195 ASN A CG  1 
ATOM   1519 O OD1 . ASN A 1 187 ? 23.297  4.076   16.160 1.00 25.24 ? 195 ASN A OD1 1 
ATOM   1520 N ND2 . ASN A 1 187 ? 24.511  2.311   15.500 1.00 32.77 ? 195 ASN A ND2 1 
ATOM   1521 N N   . ILE A 1 188 ? 20.632  1.720   19.415 1.00 18.36 ? 196 ILE A N   1 
ATOM   1522 C CA  . ILE A 1 188 ? 19.986  0.680   20.205 1.00 18.76 ? 196 ILE A CA  1 
ATOM   1523 C C   . ILE A 1 188 ? 19.533  -0.422  19.266 1.00 17.30 ? 196 ILE A C   1 
ATOM   1524 O O   . ILE A 1 188 ? 18.754  -0.172  18.339 1.00 18.24 ? 196 ILE A O   1 
ATOM   1525 C CB  . ILE A 1 188 ? 18.811  1.211   21.032 1.00 17.05 ? 196 ILE A CB  1 
ATOM   1526 C CG1 . ILE A 1 188 ? 19.320  2.144   22.127 1.00 17.06 ? 196 ILE A CG1 1 
ATOM   1527 C CG2 . ILE A 1 188 ? 18.060  0.043   21.650 1.00 18.27 ? 196 ILE A CG2 1 
ATOM   1528 C CD1 . ILE A 1 188 ? 18.199  2.833   22.908 1.00 18.59 ? 196 ILE A CD1 1 
ATOM   1529 N N   . ASP A 1 189 ? 20.018  -1.630  19.505 1.00 17.81 ? 197 ASP A N   1 
ATOM   1530 C CA  . ASP A 1 189 ? 19.560  -2.807  18.780 1.00 17.52 ? 197 ASP A CA  1 
ATOM   1531 C C   . ASP A 1 189 ? 18.429  -3.447  19.575 1.00 19.42 ? 197 ASP A C   1 
ATOM   1532 O O   . ASP A 1 189 ? 18.545  -3.632  20.789 1.00 17.72 ? 197 ASP A O   1 
ATOM   1533 C CB  . ASP A 1 189 ? 20.704  -3.811  18.626 1.00 20.70 ? 197 ASP A CB  1 
ATOM   1534 C CG  . ASP A 1 189 ? 21.833  -3.288  17.751 1.00 23.32 ? 197 ASP A CG  1 
ATOM   1535 O OD1 . ASP A 1 189 ? 21.564  -2.622  16.730 1.00 27.31 ? 197 ASP A OD1 1 
ATOM   1536 O OD2 . ASP A 1 189 ? 22.993  -3.567  18.093 1.00 27.05 ? 197 ASP A OD2 1 
ATOM   1537 N N   . ARG A 1 190 ? 17.344  -3.795  18.892 1.00 17.50 ? 198 ARG A N   1 
ATOM   1538 C CA  . ARG A 1 190 ? 16.155  -4.258  19.584 1.00 18.50 ? 198 ARG A CA  1 
ATOM   1539 C C   . ARG A 1 190 ? 15.557  -5.431  18.836 1.00 18.36 ? 198 ARG A C   1 
ATOM   1540 O O   . ARG A 1 190 ? 15.601  -5.479  17.605 1.00 19.35 ? 198 ARG A O   1 
ATOM   1541 C CB  . ARG A 1 190 ? 15.127  -3.127  19.676 1.00 22.49 ? 198 ARG A CB  1 
ATOM   1542 C CG  . ARG A 1 190 ? 14.000  -3.390  20.624 1.00 30.14 ? 198 ARG A CG  1 
ATOM   1543 C CD  . ARG A 1 190 ? 13.324  -2.091  21.007 1.00 31.39 ? 198 ARG A CD  1 
ATOM   1544 N NE  . ARG A 1 190 ? 13.758  -0.962  20.196 1.00 36.12 ? 198 ARG A NE  1 
ATOM   1545 C CZ  . ARG A 1 190 ? 14.516  0.023   20.661 1.00 39.09 ? 198 ARG A CZ  1 
ATOM   1546 N NH1 . ARG A 1 190 ? 14.897  0.055   21.928 1.00 38.85 ? 198 ARG A NH1 1 
ATOM   1547 N NH2 . ARG A 1 190 ? 14.902  0.998   19.836 1.00 29.87 ? 198 ARG A NH2 1 
ATOM   1548 N N   . LYS A 1 191 ? 14.985  -6.366  19.593 1.00 17.03 ? 199 LYS A N   1 
ATOM   1549 C CA  . LYS A 1 191 ? 14.163  -7.430  19.035 1.00 19.00 ? 199 LYS A CA  1 
ATOM   1550 C C   . LYS A 1 191 ? 12.870  -7.471  19.835 1.00 17.75 ? 199 LYS A C   1 
ATOM   1551 O O   . LYS A 1 191 ? 12.903  -7.632  21.058 1.00 18.35 ? 199 LYS A O   1 
ATOM   1552 C CB  . LYS A 1 191 ? 14.896  -8.771  19.108 1.00 22.91 ? 199 LYS A CB  1 
ATOM   1553 C CG  . LYS A 1 191 ? 14.234  -9.900  18.323 1.00 28.86 ? 199 LYS A CG  1 
ATOM   1554 C CD  . LYS A 1 191 ? 15.019  -11.203 18.503 1.00 36.56 ? 199 LYS A CD  1 
ATOM   1555 C CE  . LYS A 1 191 ? 14.107  -12.400 18.745 1.00 42.25 ? 199 LYS A CE  1 
ATOM   1556 N NZ  . LYS A 1 191 ? 14.493  -13.153 19.974 1.00 45.80 ? 199 LYS A NZ  1 
ATOM   1557 N N   . LEU A 1 192 ? 11.740  -7.319  19.142 1.00 17.97 ? 200 LEU A N   1 
ATOM   1558 C CA  . LEU A 1 192 ? 10.419  -7.271  19.758 1.00 16.98 ? 200 LEU A CA  1 
ATOM   1559 C C   . LEU A 1 192 ? 9.594   -8.402  19.168 1.00 20.20 ? 200 LEU A C   1 
ATOM   1560 O O   . LEU A 1 192 ? 9.440   -8.481  17.942 1.00 18.56 ? 200 LEU A O   1 
ATOM   1561 C CB  . LEU A 1 192 ? 9.765   -5.934  19.429 1.00 18.48 ? 200 LEU A CB  1 
ATOM   1562 C CG  . LEU A 1 192 ? 8.313   -5.806  19.873 1.00 22.02 ? 200 LEU A CG  1 
ATOM   1563 C CD1 . LEU A 1 192 ? 8.213   -6.006  21.354 1.00 23.26 ? 200 LEU A CD1 1 
ATOM   1564 C CD2 . LEU A 1 192 ? 7.732   -4.473  19.460 1.00 26.25 ? 200 LEU A CD2 1 
ATOM   1565 N N   . ASP A 1 193 ? 9.074   -9.280  20.035 1.00 19.23 ? 201 ASP A N   1 
ATOM   1566 C CA  . ASP A 1 193 ? 8.320   -10.451 19.599 1.00 21.44 ? 201 ASP A CA  1 
ATOM   1567 C C   . ASP A 1 193 ? 6.970   -10.488 20.298 1.00 19.57 ? 201 ASP A C   1 
ATOM   1568 O O   . ASP A 1 193 ? 6.882   -10.248 21.502 1.00 18.14 ? 201 ASP A O   1 
ATOM   1569 C CB  . ASP A 1 193 ? 9.039   -11.752 19.987 1.00 22.54 ? 201 ASP A CB  1 
ATOM   1570 C CG  . ASP A 1 193 ? 10.449  -11.852 19.416 1.00 28.89 ? 201 ASP A CG  1 
ATOM   1571 O OD1 . ASP A 1 193 ? 10.613  -11.711 18.191 1.00 33.17 ? 201 ASP A OD1 1 
ATOM   1572 O OD2 . ASP A 1 193 ? 11.383  -12.132 20.201 1.00 33.01 ? 201 ASP A OD2 1 
ATOM   1573 N N   . ILE A 1 194 ? 5.924   -10.815 19.546 1.00 18.57 ? 202 ILE A N   1 
ATOM   1574 C CA  . ILE A 1 194 ? 4.669   -11.264 20.143 1.00 17.65 ? 202 ILE A CA  1 
ATOM   1575 C C   . ILE A 1 194 ? 4.827   -12.721 20.547 1.00 19.34 ? 202 ILE A C   1 
ATOM   1576 O O   . ILE A 1 194 ? 5.010   -13.595 19.691 1.00 22.10 ? 202 ILE A O   1 
ATOM   1577 C CB  . ILE A 1 194 ? 3.499   -11.095 19.169 1.00 18.20 ? 202 ILE A CB  1 
ATOM   1578 C CG1 . ILE A 1 194 ? 3.465   -9.697  18.556 1.00 21.55 ? 202 ILE A CG1 1 
ATOM   1579 C CG2 . ILE A 1 194 ? 2.192   -11.487 19.854 1.00 20.48 ? 202 ILE A CG2 1 
ATOM   1580 C CD1 . ILE A 1 194 ? 3.588   -8.584  19.560 1.00 26.31 ? 202 ILE A CD1 1 
ATOM   1581 N N   . THR A 1 195 ? 4.766   -12.989 21.849 1.00 19.43 ? 203 THR A N   1 
ATOM   1582 C CA  . THR A 1 195 ? 5.028   -14.332 22.340 1.00 19.00 ? 203 THR A CA  1 
ATOM   1583 C C   . THR A 1 195 ? 3.768   -15.166 22.523 1.00 18.54 ? 203 THR A C   1 
ATOM   1584 O O   . THR A 1 195 ? 3.829   -16.390 22.387 1.00 24.09 ? 203 THR A O   1 
ATOM   1585 C CB  . THR A 1 195 ? 5.857   -14.304 23.633 1.00 21.92 ? 203 THR A CB  1 
ATOM   1586 O OG1 . THR A 1 195 ? 5.175   -13.539 24.631 1.00 22.00 ? 203 THR A OG1 1 
ATOM   1587 C CG2 . THR A 1 195 ? 7.236   -13.676 23.376 1.00 23.09 ? 203 THR A CG2 1 
ATOM   1588 N N   . SER A 1 196 ? 2.633   -14.546 22.830 1.00 19.80 ? 204 SER A N   1 
ATOM   1589 C CA  . SER A 1 196 ? 1.387   -15.292 22.884 1.00 20.82 ? 204 SER A CA  1 
ATOM   1590 C C   . SER A 1 196 ? 0.238   -14.339 22.620 1.00 19.92 ? 204 SER A C   1 
ATOM   1591 O O   . SER A 1 196 ? 0.379   -13.119 22.711 1.00 17.49 ? 204 SER A O   1 
ATOM   1592 C CB  . SER A 1 196 ? 1.199   -15.999 24.228 1.00 25.86 ? 204 SER A CB  1 
ATOM   1593 O OG  . SER A 1 196 ? 0.852   -15.076 25.234 1.00 32.38 ? 204 SER A OG  1 
ATOM   1594 N N   . HIS A 1 197 ? -0.911  -14.919 22.283 1.00 18.59 ? 205 HIS A N   1 
ATOM   1595 C CA  . HIS A 1 197 ? -2.096  -14.119 22.035 1.00 17.98 ? 205 HIS A CA  1 
ATOM   1596 C C   . HIS A 1 197 ? -3.285  -15.056 22.039 1.00 22.19 ? 205 HIS A C   1 
ATOM   1597 O O   . HIS A 1 197 ? -3.152  -16.240 21.719 1.00 23.50 ? 205 HIS A O   1 
ATOM   1598 C CB  . HIS A 1 197 ? -2.037  -13.413 20.681 1.00 21.51 ? 205 HIS A CB  1 
ATOM   1599 C CG  . HIS A 1 197 ? -1.852  -14.336 19.517 1.00 23.17 ? 205 HIS A CG  1 
ATOM   1600 N ND1 . HIS A 1 197 ? -2.907  -14.884 18.817 1.00 22.47 ? 205 HIS A ND1 1 
ATOM   1601 C CD2 . HIS A 1 197 ? -0.725  -14.797 18.918 1.00 22.14 ? 205 HIS A CD2 1 
ATOM   1602 C CE1 . HIS A 1 197 ? -2.440  -15.634 17.835 1.00 24.29 ? 205 HIS A CE1 1 
ATOM   1603 N NE2 . HIS A 1 197 ? -1.119  -15.602 17.875 1.00 24.88 ? 205 HIS A NE2 1 
ATOM   1604 N N   . ASN A 1 198 ? -4.434  -14.521 22.427 1.00 17.93 ? 206 ASN A N   1 
ATOM   1605 C CA  . ASN A 1 198 ? -5.665  -15.287 22.261 1.00 15.88 ? 206 ASN A CA  1 
ATOM   1606 C C   . ASN A 1 198 ? -6.152  -15.148 20.820 1.00 19.40 ? 206 ASN A C   1 
ATOM   1607 O O   . ASN A 1 198 ? -5.518  -14.503 19.986 1.00 20.33 ? 206 ASN A O   1 
ATOM   1608 C CB  . ASN A 1 198 ? -6.707  -14.906 23.319 1.00 19.05 ? 206 ASN A CB  1 
ATOM   1609 C CG  . ASN A 1 198 ? -7.245  -13.493 23.149 1.00 18.77 ? 206 ASN A CG  1 
ATOM   1610 O OD1 . ASN A 1 198 ? -6.783  -12.731 22.301 1.00 18.92 ? 206 ASN A OD1 1 
ATOM   1611 N ND2 . ASN A 1 198 ? -8.251  -13.140 23.958 1.00 19.19 ? 206 ASN A ND2 1 
ATOM   1612 N N   . GLU A 1 199 ? -7.313  -15.738 20.514 1.00 21.06 ? 207 GLU A N   1 
ATOM   1613 C CA  . GLU A 1 199 ? -7.680  -15.940 19.114 1.00 20.28 ? 207 GLU A CA  1 
ATOM   1614 C C   . GLU A 1 199 ? -7.856  -14.633 18.349 1.00 18.91 ? 207 GLU A C   1 
ATOM   1615 O O   . GLU A 1 199 ? -7.545  -14.567 17.151 1.00 22.87 ? 207 GLU A O   1 
ATOM   1616 C CB  . GLU A 1 199 ? -8.931  -16.812 19.019 1.00 21.06 ? 207 GLU A CB  1 
ATOM   1617 C CG  . GLU A 1 199 ? -8.801  -18.118 19.790 1.00 33.54 ? 207 GLU A CG  1 
ATOM   1618 C CD  . GLU A 1 199 ? -9.431  -18.078 21.174 1.00 39.95 ? 207 GLU A CD  1 
ATOM   1619 O OE1 . GLU A 1 199 ? -8.896  -17.388 22.082 1.00 28.28 ? 207 GLU A OE1 1 
ATOM   1620 O OE2 . GLU A 1 199 ? -10.481 -18.742 21.341 1.00 38.98 ? 207 GLU A OE2 1 
ATOM   1621 N N   . ASP A 1 200 ? -8.377  -13.592 19.003 1.00 20.49 ? 208 ASP A N   1 
ATOM   1622 C CA  . ASP A 1 200 ? -8.674  -12.329 18.337 1.00 16.61 ? 208 ASP A CA  1 
ATOM   1623 C C   . ASP A 1 200 ? -7.738  -11.199 18.760 1.00 17.73 ? 208 ASP A C   1 
ATOM   1624 O O   . ASP A 1 200 ? -8.047  -10.025 18.537 1.00 19.29 ? 208 ASP A O   1 
ATOM   1625 C CB  . ASP A 1 200 ? -10.132 -11.937 18.575 1.00 17.85 ? 208 ASP A CB  1 
ATOM   1626 C CG  . ASP A 1 200 ? -10.472 -11.821 20.054 1.00 22.22 ? 208 ASP A CG  1 
ATOM   1627 O OD1 . ASP A 1 200 ? -9.566  -11.977 20.907 1.00 20.25 ? 208 ASP A OD1 1 
ATOM   1628 O OD2 . ASP A 1 200 ? -11.667 -11.570 20.367 1.00 22.83 ? 208 ASP A OD2 1 
ATOM   1629 N N   . TYR A 1 201 ? -6.606  -11.543 19.364 1.00 17.16 ? 209 TYR A N   1 
ATOM   1630 C CA  . TYR A 1 201 ? -5.606  -10.562 19.807 1.00 18.00 ? 209 TYR A CA  1 
ATOM   1631 C C   . TYR A 1 201 ? -6.196  -9.536  20.768 1.00 19.77 ? 209 TYR A C   1 
ATOM   1632 O O   . TYR A 1 201 ? -5.823  -8.363  20.761 1.00 18.27 ? 209 TYR A O   1 
ATOM   1633 C CB  . TYR A 1 201 ? -4.874  -9.874  18.647 1.00 18.39 ? 209 TYR A CB  1 
ATOM   1634 C CG  . TYR A 1 201 ? -3.861  -10.726 17.928 1.00 19.88 ? 209 TYR A CG  1 
ATOM   1635 C CD1 . TYR A 1 201 ? -4.258  -11.660 16.976 1.00 24.06 ? 209 TYR A CD1 1 
ATOM   1636 C CD2 . TYR A 1 201 ? -2.502  -10.579 18.183 1.00 20.98 ? 209 TYR A CD2 1 
ATOM   1637 C CE1 . TYR A 1 201 ? -3.320  -12.442 16.304 1.00 21.83 ? 209 TYR A CE1 1 
ATOM   1638 C CE2 . TYR A 1 201 ? -1.565  -11.350 17.520 1.00 22.16 ? 209 TYR A CE2 1 
ATOM   1639 C CZ  . TYR A 1 201 ? -1.984  -12.277 16.580 1.00 24.88 ? 209 TYR A CZ  1 
ATOM   1640 O OH  . TYR A 1 201 ? -1.060  -13.057 15.910 1.00 28.03 ? 209 TYR A OH  1 
ATOM   1641 N N   . THR A 1 202 ? -7.138  -9.966  21.597 1.00 16.88 ? 210 THR A N   1 
ATOM   1642 C CA  . THR A 1 202 ? -7.612  -9.100  22.667 1.00 16.94 ? 210 THR A CA  1 
ATOM   1643 C C   . THR A 1 202 ? -6.846  -9.295  23.967 1.00 16.74 ? 210 THR A C   1 
ATOM   1644 O O   . THR A 1 202 ? -7.018  -8.499  24.901 1.00 16.97 ? 210 THR A O   1 
ATOM   1645 C CB  . THR A 1 202 ? -9.125  -9.243  22.898 1.00 18.97 ? 210 THR A CB  1 
ATOM   1646 O OG1 . THR A 1 202 ? -9.474  -10.613 23.146 1.00 19.57 ? 210 THR A OG1 1 
ATOM   1647 C CG2 . THR A 1 202 ? -9.880  -8.748  21.684 1.00 20.15 ? 210 THR A CG2 1 
ATOM   1648 N N   . VAL A 1 203 ? -6.021  -10.340 24.048 1.00 15.29 ? 211 VAL A N   1 
ATOM   1649 C CA  . VAL A 1 203 ? -5.071  -10.527 25.135 1.00 17.05 ? 211 VAL A CA  1 
ATOM   1650 C C   . VAL A 1 203 ? -3.778  -10.937 24.456 1.00 16.16 ? 211 VAL A C   1 
ATOM   1651 O O   . VAL A 1 203 ? -3.762  -11.908 23.695 1.00 18.09 ? 211 VAL A O   1 
ATOM   1652 C CB  . VAL A 1 203 ? -5.528  -11.608 26.132 1.00 18.22 ? 211 VAL A CB  1 
ATOM   1653 C CG1 . VAL A 1 203 ? -4.474  -11.842 27.221 1.00 20.30 ? 211 VAL A CG1 1 
ATOM   1654 C CG2 . VAL A 1 203 ? -6.873  -11.209 26.746 1.00 18.40 ? 211 VAL A CG2 1 
ATOM   1655 N N   . VAL A 1 204 ? -2.710  -10.165 24.670 1.00 14.94 ? 212 VAL A N   1 
ATOM   1656 C CA  . VAL A 1 204 ? -1.462  -10.357 23.935 1.00 15.90 ? 212 VAL A CA  1 
ATOM   1657 C C   . VAL A 1 204 ? -0.294  -10.251 24.909 1.00 16.30 ? 212 VAL A C   1 
ATOM   1658 O O   . VAL A 1 204 ? -0.303  -9.410  25.814 1.00 17.80 ? 212 VAL A O   1 
ATOM   1659 C CB  . VAL A 1 204 ? -1.321  -9.309  22.804 1.00 16.36 ? 212 VAL A CB  1 
ATOM   1660 C CG1 . VAL A 1 204 ? -0.033  -9.534  22.006 1.00 17.92 ? 212 VAL A CG1 1 
ATOM   1661 C CG2 . VAL A 1 204 ? -2.533  -9.331  21.867 1.00 16.39 ? 212 VAL A CG2 1 
ATOM   1662 N N   . GLU A 1 205 ? 0.712   -11.096 24.723 1.00 15.92 ? 213 GLU A N   1 
ATOM   1663 C CA  . GLU A 1 205 ? 1.960   -10.979 25.470 1.00 17.04 ? 213 GLU A CA  1 
ATOM   1664 C C   . GLU A 1 205 ? 3.102   -10.685 24.513 1.00 16.92 ? 213 GLU A C   1 
ATOM   1665 O O   . GLU A 1 205 ? 3.163   -11.237 23.413 1.00 18.42 ? 213 GLU A O   1 
ATOM   1666 C CB  . GLU A 1 205 ? 2.264   -12.254 26.243 1.00 19.34 ? 213 GLU A CB  1 
ATOM   1667 C CG  . GLU A 1 205 ? 1.233   -12.562 27.323 1.00 24.35 ? 213 GLU A CG  1 
ATOM   1668 C CD  . GLU A 1 205 ? 1.676   -13.689 28.245 1.00 35.97 ? 213 GLU A CD  1 
ATOM   1669 O OE1 . GLU A 1 205 ? 1.009   -14.749 28.244 1.00 45.03 ? 213 GLU A OE1 1 
ATOM   1670 O OE2 . GLU A 1 205 ? 2.702   -13.531 28.941 1.00 36.46 ? 213 GLU A OE2 1 
ATOM   1671 N N   . GLN A 1 206 ? 4.018   -9.820  24.935 1.00 15.92 ? 214 GLN A N   1 
ATOM   1672 C CA  . GLN A 1 206 ? 5.146   -9.495  24.086 1.00 16.17 ? 214 GLN A CA  1 
ATOM   1673 C C   . GLN A 1 206 ? 6.413   -9.444  24.923 1.00 16.99 ? 214 GLN A C   1 
ATOM   1674 O O   . GLN A 1 206 ? 6.375   -9.297  26.148 1.00 18.64 ? 214 GLN A O   1 
ATOM   1675 C CB  . GLN A 1 206 ? 4.957   -8.215  23.260 1.00 22.34 ? 214 GLN A CB  1 
ATOM   1676 C CG  . GLN A 1 206 ? 4.147   -7.126  23.879 1.00 24.98 ? 214 GLN A CG  1 
ATOM   1677 C CD  . GLN A 1 206 ? 3.942   -5.942  22.937 1.00 17.98 ? 214 GLN A CD  1 
ATOM   1678 O OE1 . GLN A 1 206 ? 2.959   -5.850  22.193 1.00 20.24 ? 214 GLN A OE1 1 
ATOM   1679 N NE2 . GLN A 1 206 ? 4.896   -5.022  22.974 1.00 17.82 ? 214 GLN A NE2 1 
ATOM   1680 N N   . TYR A 1 207 ? 7.539   -9.595  24.233 1.00 15.62 ? 215 TYR A N   1 
ATOM   1681 C CA  . TYR A 1 207 ? 8.857   -9.647  24.849 1.00 16.02 ? 215 TYR A CA  1 
ATOM   1682 C C   . TYR A 1 207 ? 9.780   -8.758  24.032 1.00 16.60 ? 215 TYR A C   1 
ATOM   1683 O O   . TYR A 1 207 ? 9.694   -8.735  22.799 1.00 16.88 ? 215 TYR A O   1 
ATOM   1684 C CB  . TYR A 1 207 ? 9.412   -11.073 24.810 1.00 19.37 ? 215 TYR A CB  1 
ATOM   1685 C CG  . TYR A 1 207 ? 10.821  -11.210 25.316 1.00 23.44 ? 215 TYR A CG  1 
ATOM   1686 C CD1 . TYR A 1 207 ? 11.082  -11.348 26.668 1.00 24.46 ? 215 TYR A CD1 1 
ATOM   1687 C CD2 . TYR A 1 207 ? 11.890  -11.208 24.435 1.00 22.61 ? 215 TYR A CD2 1 
ATOM   1688 C CE1 . TYR A 1 207 ? 12.388  -11.478 27.135 1.00 25.38 ? 215 TYR A CE1 1 
ATOM   1689 C CE2 . TYR A 1 207 ? 13.193  -11.329 24.889 1.00 20.28 ? 215 TYR A CE2 1 
ATOM   1690 C CZ  . TYR A 1 207 ? 13.429  -11.465 26.233 1.00 22.13 ? 215 TYR A CZ  1 
ATOM   1691 O OH  . TYR A 1 207 ? 14.742  -11.593 26.664 1.00 30.41 ? 215 TYR A OH  1 
ATOM   1692 N N   . GLU A 1 208 ? 10.671  -8.039  24.712 1.00 17.12 ? 216 GLU A N   1 
ATOM   1693 C CA  . GLU A 1 208 ? 11.592  -7.163  24.007 1.00 17.04 ? 216 GLU A CA  1 
ATOM   1694 C C   . GLU A 1 208 ? 12.945  -7.202  24.689 1.00 18.31 ? 216 GLU A C   1 
ATOM   1695 O O   . GLU A 1 208 ? 13.035  -7.159  25.919 1.00 17.28 ? 216 GLU A O   1 
ATOM   1696 C CB  . GLU A 1 208 ? 11.077  -5.729  24.016 1.00 17.02 ? 216 GLU A CB  1 
ATOM   1697 C CG  . GLU A 1 208 ? 11.872  -4.753  23.184 1.00 20.75 ? 216 GLU A CG  1 
ATOM   1698 C CD  . GLU A 1 208 ? 11.170  -3.413  23.158 1.00 26.26 ? 216 GLU A CD  1 
ATOM   1699 O OE1 . GLU A 1 208 ? 11.439  -2.593  24.059 1.00 30.77 ? 216 GLU A OE1 1 
ATOM   1700 O OE2 . GLU A 1 208 ? 10.311  -3.199  22.281 1.00 27.82 ? 216 GLU A OE2 1 
ATOM   1701 N N   . ARG A 1 209 ? 13.994  -7.308  23.873 1.00 15.43 ? 217 ARG A N   1 
ATOM   1702 C CA  . ARG A 1 209 ? 15.372  -7.162  24.318 1.00 16.34 ? 217 ARG A CA  1 
ATOM   1703 C C   . ARG A 1 209 ? 15.966  -5.960  23.602 1.00 15.96 ? 217 ARG A C   1 
ATOM   1704 O O   . ARG A 1 209 ? 15.870  -5.869  22.376 1.00 17.27 ? 217 ARG A O   1 
ATOM   1705 C CB  . ARG A 1 209 ? 16.169  -8.416  23.976 1.00 18.90 ? 217 ARG A CB  1 
ATOM   1706 C CG  . ARG A 1 209 ? 17.614  -8.324  24.384 1.00 22.59 ? 217 ARG A CG  1 
ATOM   1707 C CD  . ARG A 1 209 ? 18.253  -9.701  24.424 1.00 29.35 ? 217 ARG A CD  1 
ATOM   1708 N NE  . ARG A 1 209 ? 19.533  -9.672  25.125 1.00 35.77 ? 217 ARG A NE  1 
ATOM   1709 C CZ  . ARG A 1 209 ? 20.689  -9.391  24.540 1.00 40.48 ? 217 ARG A CZ  1 
ATOM   1710 N NH1 . ARG A 1 209 ? 20.766  -9.166  23.239 1.00 40.23 ? 217 ARG A NH1 1 
ATOM   1711 N NH2 . ARG A 1 209 ? 21.797  -9.339  25.279 1.00 35.61 ? 217 ARG A NH2 1 
ATOM   1712 N N   . SER A 1 210 ? 16.548  -5.032  24.368 1.00 15.38 ? 218 SER A N   1 
ATOM   1713 C CA  . SER A 1 210 ? 17.124  -3.792  23.843 1.00 16.13 ? 218 SER A CA  1 
ATOM   1714 C C   . SER A 1 210 ? 18.504  -3.566  24.431 1.00 17.99 ? 218 SER A C   1 
ATOM   1715 O O   . SER A 1 210 ? 18.664  -3.596  25.653 1.00 18.45 ? 218 SER A O   1 
ATOM   1716 C CB  . SER A 1 210 ? 16.269  -2.553  24.150 1.00 16.56 ? 218 SER A CB  1 
ATOM   1717 O OG  . SER A 1 210 ? 14.884  -2.837  24.082 1.00 22.91 ? 218 SER A OG  1 
ATOM   1718 N N   . VAL A 1 211 ? 19.492  -3.323  23.565 1.00 16.45 ? 219 VAL A N   1 
ATOM   1719 C CA  . VAL A 1 211 ? 20.878  -3.138  23.995 1.00 17.56 ? 219 VAL A CA  1 
ATOM   1720 C C   . VAL A 1 211 ? 21.454  -1.925  23.276 1.00 17.44 ? 219 VAL A C   1 
ATOM   1721 O O   . VAL A 1 211 ? 21.455  -1.875  22.036 1.00 19.19 ? 219 VAL A O   1 
ATOM   1722 C CB  . VAL A 1 211 ? 21.737  -4.379  23.717 1.00 18.23 ? 219 VAL A CB  1 
ATOM   1723 C CG1 . VAL A 1 211 ? 23.169  -4.137  24.196 1.00 19.50 ? 219 VAL A CG1 1 
ATOM   1724 C CG2 . VAL A 1 211 ? 21.131  -5.622  24.370 1.00 21.41 ? 219 VAL A CG2 1 
ATOM   1725 N N   . ALA A 1 212 ? 21.951  -0.958  24.048 1.00 18.02 ? 220 ALA A N   1 
ATOM   1726 C CA  . ALA A 1 212 ? 22.634  0.196   23.478 1.00 16.64 ? 220 ALA A CA  1 
ATOM   1727 C C   . ALA A 1 212 ? 24.064  -0.168  23.122 1.00 19.77 ? 220 ALA A C   1 
ATOM   1728 O O   . ALA A 1 212 ? 24.710  -0.963  23.811 1.00 21.01 ? 220 ALA A O   1 
ATOM   1729 C CB  . ALA A 1 212 ? 22.645  1.356   24.472 1.00 18.30 ? 220 ALA A CB  1 
ATOM   1730 N N   . ARG A 1 213 ? 24.548  0.408   22.026 1.00 15.13 ? 221 ARG A N   1 
ATOM   1731 C CA  . ARG A 1 213 ? 25.934  0.191   21.649 1.00 18.21 ? 221 ARG A CA  1 
ATOM   1732 C C   . ARG A 1 213 ? 26.474  1.418   20.931 1.00 17.59 ? 221 ARG A C   1 
ATOM   1733 O O   . ARG A 1 213 ? 25.727  2.283   20.472 1.00 18.82 ? 221 ARG A O   1 
ATOM   1734 C CB  . ARG A 1 213 ? 26.073  -1.048  20.771 1.00 23.44 ? 221 ARG A CB  1 
ATOM   1735 C CG  . ARG A 1 213 ? 25.508  -0.877  19.392 1.00 25.40 ? 221 ARG A CG  1 
ATOM   1736 C CD  . ARG A 1 213 ? 25.918  -2.028  18.481 1.00 29.97 ? 221 ARG A CD  1 
ATOM   1737 N NE  . ARG A 1 213 ? 25.066  -2.054  17.299 1.00 27.79 ? 221 ARG A NE  1 
ATOM   1738 C CZ  . ARG A 1 213 ? 25.231  -1.267  16.246 1.00 34.29 ? 221 ARG A CZ  1 
ATOM   1739 N NH1 . ARG A 1 213 ? 26.253  -0.428  16.166 1.00 34.47 ? 221 ARG A NH1 1 
ATOM   1740 N NH2 . ARG A 1 213 ? 24.342  -1.310  15.257 1.00 33.37 ? 221 ARG A NH2 1 
ATOM   1741 N N   . HIS A 1 214 ? 27.803  1.485   20.851 1.00 20.16 ? 222 HIS A N   1 
ATOM   1742 C CA  . HIS A 1 214 ? 28.432  2.549   20.097 1.00 19.41 ? 222 HIS A CA  1 
ATOM   1743 C C   . HIS A 1 214 ? 28.304  2.274   18.604 1.00 22.48 ? 222 HIS A C   1 
ATOM   1744 O O   . HIS A 1 214 ? 28.350  1.123   18.159 1.00 26.53 ? 222 HIS A O   1 
ATOM   1745 C CB  . HIS A 1 214 ? 29.923  2.611   20.454 1.00 17.69 ? 222 HIS A CB  1 
ATOM   1746 C CG  . HIS A 1 214 ? 30.180  2.981   21.881 1.00 19.81 ? 222 HIS A CG  1 
ATOM   1747 N ND1 . HIS A 1 214 ? 30.232  4.289   22.309 1.00 19.68 ? 222 HIS A ND1 1 
ATOM   1748 C CD2 . HIS A 1 214 ? 30.359  2.217   22.984 1.00 24.46 ? 222 HIS A CD2 1 
ATOM   1749 C CE1 . HIS A 1 214 ? 30.438  4.315   23.614 1.00 18.75 ? 222 HIS A CE1 1 
ATOM   1750 N NE2 . HIS A 1 214 ? 30.526  3.070   24.045 1.00 22.38 ? 222 HIS A NE2 1 
ATOM   1751 N N   . SER A 1 215 ? 28.138  3.345   17.831 1.00 22.29 ? 223 SER A N   1 
ATOM   1752 C CA  . SER A 1 215 ? 28.245  3.265   16.376 1.00 28.37 ? 223 SER A CA  1 
ATOM   1753 C C   . SER A 1 215 ? 29.618  2.721   16.005 1.00 30.69 ? 223 SER A C   1 
ATOM   1754 O O   . SER A 1 215 ? 30.630  3.155   16.563 1.00 28.52 ? 223 SER A O   1 
ATOM   1755 C CB  . SER A 1 215 ? 28.075  4.649   15.746 1.00 34.69 ? 223 SER A CB  1 
ATOM   1756 O OG  . SER A 1 215 ? 27.142  5.428   16.470 1.00 40.41 ? 223 SER A OG  1 
HETATM 1757 O O   . HOH B 2 .   ? -5.599  9.579   26.727 1.00 43.18 ? 301 HOH A O   1 
HETATM 1758 O O   . HOH B 2 .   ? -1.486  -14.597 14.127 1.00 39.23 ? 302 HOH A O   1 
HETATM 1759 O O   . HOH B 2 .   ? -12.252 0.775   8.504  1.00 38.96 ? 303 HOH A O   1 
HETATM 1760 O O   . HOH B 2 .   ? -7.464  -5.021  32.235 1.00 38.16 ? 304 HOH A O   1 
HETATM 1761 O O   . HOH B 2 .   ? 14.811  -4.124  8.783  1.00 36.66 ? 305 HOH A O   1 
HETATM 1762 O O   . HOH B 2 .   ? 11.163  -0.315  24.967 1.00 25.67 ? 306 HOH A O   1 
HETATM 1763 O O   . HOH B 2 .   ? -12.886 -18.536 22.016 1.00 30.57 ? 307 HOH A O   1 
HETATM 1764 O O   . HOH B 2 .   ? 30.496  7.028   25.313 1.00 29.10 ? 308 HOH A O   1 
HETATM 1765 O O   . HOH B 2 .   ? 17.366  1.969   11.371 1.00 24.50 ? 309 HOH A O   1 
HETATM 1766 O O   . HOH B 2 .   ? 15.029  14.156  41.236 1.00 38.33 ? 310 HOH A O   1 
HETATM 1767 O O   . HOH B 2 .   ? -9.292  0.690   29.543 1.00 35.37 ? 311 HOH A O   1 
HETATM 1768 O O   . HOH B 2 .   ? 2.984   12.298  34.723 1.00 36.18 ? 312 HOH A O   1 
HETATM 1769 O O   . HOH B 2 .   ? 19.369  9.424   13.731 1.00 31.86 ? 313 HOH A O   1 
HETATM 1770 O O   . HOH B 2 .   ? 9.785   4.959   23.671 1.00 24.31 ? 314 HOH A O   1 
HETATM 1771 O O   . HOH B 2 .   ? 4.069   -15.222 26.268 1.00 28.53 ? 315 HOH A O   1 
HETATM 1772 O O   . HOH B 2 .   ? 6.416   -12.452 26.636 1.00 29.05 ? 316 HOH A O   1 
HETATM 1773 O O   . HOH B 2 .   ? -7.668  -9.704  3.581  1.00 36.96 ? 317 HOH A O   1 
HETATM 1774 O O   . HOH B 2 .   ? 8.665   4.559   28.497 1.00 20.01 ? 318 HOH A O   1 
HETATM 1775 O O   . HOH B 2 .   ? 5.499   -12.397 37.156 1.00 24.18 ? 319 HOH A O   1 
HETATM 1776 O O   . HOH B 2 .   ? 23.438  -3.888  20.680 1.00 29.48 ? 320 HOH A O   1 
HETATM 1777 O O   . HOH B 2 .   ? -1.089  -0.824  5.440  1.00 19.47 ? 321 HOH A O   1 
HETATM 1778 O O   . HOH B 2 .   ? 12.639  6.290   16.737 1.00 21.18 ? 322 HOH A O   1 
HETATM 1779 O O   . HOH B 2 .   ? -2.374  5.821   1.728  1.00 31.28 ? 323 HOH A O   1 
HETATM 1780 O O   . HOH B 2 .   ? 4.764   -6.877  16.958 1.00 19.48 ? 324 HOH A O   1 
HETATM 1781 O O   . HOH B 2 .   ? 28.770  8.293   21.409 1.00 25.31 ? 325 HOH A O   1 
HETATM 1782 O O   . HOH B 2 .   ? -10.084 5.650   22.407 1.00 32.55 ? 326 HOH A O   1 
HETATM 1783 O O   . HOH B 2 .   ? 8.484   -2.106  40.195 1.00 22.33 ? 327 HOH A O   1 
HETATM 1784 O O   . HOH B 2 .   ? 26.641  -2.812  23.626 1.00 35.19 ? 328 HOH A O   1 
HETATM 1785 O O   . HOH B 2 .   ? 17.528  2.651   29.850 1.00 18.92 ? 329 HOH A O   1 
HETATM 1786 O O   . HOH B 2 .   ? 11.683  -10.026 6.176  1.00 31.21 ? 330 HOH A O   1 
HETATM 1787 O O   . HOH B 2 .   ? 4.548   13.000  25.274 1.00 23.54 ? 331 HOH A O   1 
HETATM 1788 O O   . HOH B 2 .   ? 3.972   -9.405  34.594 1.00 30.44 ? 332 HOH A O   1 
HETATM 1789 O O   . HOH B 2 .   ? 28.279  5.947   18.941 1.00 25.23 ? 333 HOH A O   1 
HETATM 1790 O O   . HOH B 2 .   ? 20.537  -9.350  28.311 1.00 40.77 ? 334 HOH A O   1 
HETATM 1791 O O   . HOH B 2 .   ? 18.794  14.181  39.086 1.00 43.01 ? 335 HOH A O   1 
HETATM 1792 O O   . HOH B 2 .   ? -5.631  -7.083  0.891  1.00 31.72 ? 336 HOH A O   1 
HETATM 1793 O O   . HOH B 2 .   ? 23.046  17.973  31.710 1.00 38.70 ? 337 HOH A O   1 
HETATM 1794 O O   . HOH B 2 .   ? -7.715  7.714   13.489 1.00 21.39 ? 338 HOH A O   1 
HETATM 1795 O O   . HOH B 2 .   ? 22.153  11.999  36.576 1.00 34.07 ? 339 HOH A O   1 
HETATM 1796 O O   . HOH B 2 .   ? 11.873  13.379  16.419 1.00 34.05 ? 340 HOH A O   1 
HETATM 1797 O O   . HOH B 2 .   ? 13.349  -9.777  31.894 1.00 29.65 ? 341 HOH A O   1 
HETATM 1798 O O   . HOH B 2 .   ? 6.387   4.586   -0.758 1.00 28.45 ? 342 HOH A O   1 
HETATM 1799 O O   . HOH B 2 .   ? 29.817  13.537  30.366 1.00 35.50 ? 343 HOH A O   1 
HETATM 1800 O O   . HOH B 2 .   ? 15.649  12.709  13.500 1.00 37.99 ? 344 HOH A O   1 
HETATM 1801 O O   . HOH B 2 .   ? 26.401  14.479  24.348 1.00 24.55 ? 345 HOH A O   1 
HETATM 1802 O O   . HOH B 2 .   ? 28.087  14.008  28.615 1.00 35.04 ? 346 HOH A O   1 
HETATM 1803 O O   . HOH B 2 .   ? 2.814   8.400   33.415 1.00 20.24 ? 347 HOH A O   1 
HETATM 1804 O O   . HOH B 2 .   ? 7.160   -8.245  16.450 1.00 19.65 ? 348 HOH A O   1 
HETATM 1805 O O   . HOH B 2 .   ? 10.778  -3.063  41.589 1.00 29.46 ? 349 HOH A O   1 
HETATM 1806 O O   . HOH B 2 .   ? 18.299  -5.452  35.674 1.00 19.43 ? 350 HOH A O   1 
HETATM 1807 O O   . HOH B 2 .   ? 25.150  3.657   31.580 1.00 31.75 ? 351 HOH A O   1 
HETATM 1808 O O   . HOH B 2 .   ? 14.490  17.139  28.545 1.00 27.66 ? 352 HOH A O   1 
HETATM 1809 O O   . HOH B 2 .   ? -1.222  -0.908  0.869  1.00 22.22 ? 353 HOH A O   1 
HETATM 1810 O O   . HOH B 2 .   ? 9.370   -10.823 5.513  1.00 30.41 ? 354 HOH A O   1 
HETATM 1811 O O   . HOH B 2 .   ? -8.475  -7.074  0.301  1.00 27.57 ? 355 HOH A O   1 
HETATM 1812 O O   . HOH B 2 .   ? 4.617   2.936   26.819 1.00 20.35 ? 356 HOH A O   1 
HETATM 1813 O O   . HOH B 2 .   ? 7.251   10.086  38.697 1.00 20.25 ? 357 HOH A O   1 
HETATM 1814 O O   . HOH B 2 .   ? 21.168  6.819   26.897 1.00 18.35 ? 358 HOH A O   1 
HETATM 1815 O O   . HOH B 2 .   ? 22.434  2.036   32.674 1.00 28.96 ? 359 HOH A O   1 
HETATM 1816 O O   . HOH B 2 .   ? -15.656 -3.353  19.835 1.00 23.71 ? 360 HOH A O   1 
HETATM 1817 O O   . HOH B 2 .   ? 5.993   12.744  9.368  1.00 39.14 ? 361 HOH A O   1 
HETATM 1818 O O   . HOH B 2 .   ? -3.755  -0.912  5.835  1.00 18.85 ? 362 HOH A O   1 
HETATM 1819 O O   . HOH B 2 .   ? 19.012  16.618  37.615 1.00 36.05 ? 363 HOH A O   1 
HETATM 1820 O O   . HOH B 2 .   ? 30.254  -1.649  29.953 1.00 37.30 ? 364 HOH A O   1 
HETATM 1821 O O   . HOH B 2 .   ? -2.582  -1.703  34.034 1.00 32.38 ? 365 HOH A O   1 
HETATM 1822 O O   . HOH B 2 .   ? 1.248   -12.262 -2.431 1.00 27.95 ? 366 HOH A O   1 
HETATM 1823 O O   . HOH B 2 .   ? -7.698  -7.287  18.967 1.00 22.70 ? 367 HOH A O   1 
HETATM 1824 O O   . HOH B 2 .   ? 12.979  17.668  39.369 1.00 41.25 ? 368 HOH A O   1 
HETATM 1825 O O   . HOH B 2 .   ? 13.828  -4.026  26.376 1.00 20.36 ? 369 HOH A O   1 
HETATM 1826 O O   . HOH B 2 .   ? 12.692  -4.252  16.403 1.00 29.86 ? 370 HOH A O   1 
HETATM 1827 O O   . HOH B 2 .   ? 9.955   -10.191 15.639 1.00 32.46 ? 371 HOH A O   1 
HETATM 1828 O O   . HOH B 2 .   ? -11.903 -4.606  -0.637 1.00 33.90 ? 372 HOH A O   1 
HETATM 1829 O O   . HOH B 2 .   ? 25.895  -3.156  30.835 1.00 32.83 ? 373 HOH A O   1 
HETATM 1830 O O   . HOH B 2 .   ? 12.057  -7.139  16.361 1.00 28.22 ? 374 HOH A O   1 
HETATM 1831 O O   . HOH B 2 .   ? 14.073  -0.190  25.165 1.00 29.74 ? 375 HOH A O   1 
HETATM 1832 O O   . HOH B 2 .   ? -2.484  -6.225  1.500  1.00 28.70 ? 376 HOH A O   1 
HETATM 1833 O O   . HOH B 2 .   ? 15.792  -0.475  17.524 1.00 28.68 ? 377 HOH A O   1 
HETATM 1834 O O   . HOH B 2 .   ? -8.301  8.258   21.226 1.00 37.60 ? 378 HOH A O   1 
HETATM 1835 O O   . HOH B 2 .   ? 8.645   9.077   10.443 1.00 29.34 ? 379 HOH A O   1 
HETATM 1836 O O   . HOH B 2 .   ? -9.398  -17.123 24.852 1.00 31.83 ? 380 HOH A O   1 
HETATM 1837 O O   . HOH B 2 .   ? 13.014  18.939  36.876 1.00 38.66 ? 381 HOH A O   1 
HETATM 1838 O O   . HOH B 2 .   ? -12.064 -6.429  24.053 1.00 28.36 ? 382 HOH A O   1 
HETATM 1839 O O   . HOH B 2 .   ? -15.785 -1.737  22.170 1.00 20.18 ? 383 HOH A O   1 
HETATM 1840 O O   . HOH B 2 .   ? 11.721  2.281   42.536 1.00 30.75 ? 384 HOH A O   1 
HETATM 1841 O O   . HOH B 2 .   ? 17.529  8.014   38.484 1.00 32.30 ? 385 HOH A O   1 
HETATM 1842 O O   . HOH B 2 .   ? 35.460  2.632   27.295 1.00 30.27 ? 386 HOH A O   1 
HETATM 1843 O O   . HOH B 2 .   ? 3.081   -10.314 14.969 1.00 30.64 ? 387 HOH A O   1 
HETATM 1844 O O   . HOH B 2 .   ? -13.223 -4.058  23.417 1.00 18.80 ? 388 HOH A O   1 
HETATM 1845 O O   . HOH B 2 .   ? -15.587 -1.396  26.505 1.00 33.84 ? 389 HOH A O   1 
HETATM 1846 O O   . HOH B 2 .   ? -7.762  5.158   4.490  1.00 32.60 ? 390 HOH A O   1 
HETATM 1847 O O   . HOH B 2 .   ? 14.903  -9.841  12.092 1.00 29.22 ? 391 HOH A O   1 
HETATM 1848 O O   . HOH B 2 .   ? 11.382  -14.010 22.370 1.00 39.98 ? 392 HOH A O   1 
HETATM 1849 O O   . HOH B 2 .   ? -11.589 -7.018  13.296 1.00 37.23 ? 393 HOH A O   1 
HETATM 1850 O O   . HOH B 2 .   ? -11.633 -0.430  17.112 1.00 26.41 ? 394 HOH A O   1 
HETATM 1851 O O   . HOH B 2 .   ? 16.743  -1.082  11.693 1.00 27.96 ? 395 HOH A O   1 
HETATM 1852 O O   . HOH B 2 .   ? 25.722  16.247  29.721 1.00 30.16 ? 396 HOH A O   1 
HETATM 1853 O O   . HOH B 2 .   ? 10.464  4.787   26.306 1.00 23.03 ? 397 HOH A O   1 
HETATM 1854 O O   . HOH B 2 .   ? 3.548   -1.575  0.392  1.00 22.52 ? 398 HOH A O   1 
HETATM 1855 O O   . HOH B 2 .   ? 16.608  17.150  30.477 1.00 29.79 ? 399 HOH A O   1 
HETATM 1856 O O   . HOH B 2 .   ? -5.092  -7.326  15.824 1.00 29.31 ? 400 HOH A O   1 
HETATM 1857 O O   . HOH B 2 .   ? 23.093  19.220  21.110 1.00 35.96 ? 401 HOH A O   1 
HETATM 1858 O O   . HOH B 2 .   ? -1.266  -8.450  11.275 1.00 23.15 ? 402 HOH A O   1 
HETATM 1859 O O   . HOH B 2 .   ? 3.195   -0.258  43.433 1.00 35.72 ? 403 HOH A O   1 
HETATM 1860 O O   . HOH B 2 .   ? -9.499  -8.455  26.404 1.00 27.97 ? 404 HOH A O   1 
HETATM 1861 O O   . HOH B 2 .   ? -14.676 3.715   16.894 1.00 27.71 ? 405 HOH A O   1 
HETATM 1862 O O   . HOH B 2 .   ? -4.273  -12.359 11.875 1.00 45.29 ? 406 HOH A O   1 
HETATM 1863 O O   . HOH B 2 .   ? 10.639  -0.328  42.642 1.00 28.94 ? 407 HOH A O   1 
HETATM 1864 O O   . HOH B 2 .   ? 12.928  -11.025 10.470 1.00 33.00 ? 408 HOH A O   1 
HETATM 1865 O O   . HOH B 2 .   ? -1.875  -14.481 26.073 1.00 36.35 ? 409 HOH A O   1 
HETATM 1866 O O   . HOH B 2 .   ? 20.383  4.001   37.363 1.00 36.20 ? 410 HOH A O   1 
HETATM 1867 O O   . HOH B 2 .   ? -1.166  3.895   33.072 1.00 31.10 ? 411 HOH A O   1 
HETATM 1868 O O   . HOH B 2 .   ? 4.655   -9.511  31.640 1.00 31.53 ? 412 HOH A O   1 
HETATM 1869 O O   . HOH B 2 .   ? 3.029   8.365   5.911  1.00 29.30 ? 413 HOH A O   1 
HETATM 1870 O O   . HOH B 2 .   ? 10.550  3.151   30.310 1.00 19.21 ? 414 HOH A O   1 
HETATM 1871 O O   . HOH B 2 .   ? -10.106 -3.194  8.732  1.00 30.87 ? 415 HOH A O   1 
HETATM 1872 O O   . HOH B 2 .   ? -7.461  -8.352  15.874 1.00 30.07 ? 416 HOH A O   1 
HETATM 1873 O O   . HOH B 2 .   ? -7.727  8.038   8.013  1.00 26.63 ? 417 HOH A O   1 
HETATM 1874 O O   . HOH B 2 .   ? 25.172  1.394   32.176 1.00 33.59 ? 418 HOH A O   1 
HETATM 1875 O O   . HOH B 2 .   ? 14.484  -3.027  11.143 1.00 27.13 ? 419 HOH A O   1 
HETATM 1876 O O   . HOH B 2 .   ? 24.049  6.633   33.318 1.00 27.06 ? 420 HOH A O   1 
HETATM 1877 O O   . HOH B 2 .   ? 18.788  -5.577  16.275 1.00 29.83 ? 421 HOH A O   1 
HETATM 1878 O O   . HOH B 2 .   ? -10.167 -1.561  5.944  1.00 33.17 ? 422 HOH A O   1 
HETATM 1879 O O   . HOH B 2 .   ? 13.898  11.823  15.513 1.00 30.39 ? 423 HOH A O   1 
HETATM 1880 O O   . HOH B 2 .   ? 17.720  5.169   38.661 1.00 32.52 ? 424 HOH A O   1 
HETATM 1881 O O   . HOH B 2 .   ? 13.621  8.090   10.563 1.00 32.95 ? 425 HOH A O   1 
HETATM 1882 O O   . HOH B 2 .   ? 13.444  -10.534 21.656 1.00 33.45 ? 426 HOH A O   1 
HETATM 1883 O O   . HOH B 2 .   ? 23.099  8.035   15.716 1.00 30.47 ? 427 HOH A O   1 
HETATM 1884 O O   . HOH B 2 .   ? 15.918  -11.685 22.155 1.00 41.21 ? 428 HOH A O   1 
HETATM 1885 O O   . HOH B 2 .   ? 0.956   -10.687 3.079  1.00 23.33 ? 429 HOH A O   1 
HETATM 1886 O O   . HOH B 2 .   ? 22.212  -0.905  31.777 1.00 26.65 ? 430 HOH A O   1 
HETATM 1887 O O   . HOH B 2 .   ? 26.904  1.506   13.836 1.00 41.08 ? 431 HOH A O   1 
HETATM 1888 O O   . HOH B 2 .   ? -3.822  7.337   27.778 1.00 29.40 ? 432 HOH A O   1 
HETATM 1889 O O   . HOH B 2 .   ? 2.382   -14.988 19.029 1.00 34.39 ? 433 HOH A O   1 
HETATM 1890 O O   . HOH B 2 .   ? 28.886  8.935   24.121 1.00 26.50 ? 434 HOH A O   1 
HETATM 1891 O O   . HOH B 2 .   ? 20.665  -6.578  36.424 1.00 28.86 ? 435 HOH A O   1 
HETATM 1892 O O   . HOH B 2 .   ? 6.335   -12.094 -1.405 1.00 40.05 ? 436 HOH A O   1 
HETATM 1893 O O   . HOH B 2 .   ? -0.222  -17.880 21.797 1.00 33.31 ? 437 HOH A O   1 
HETATM 1894 O O   . HOH B 2 .   ? 17.856  -3.612  42.883 1.00 40.03 ? 438 HOH A O   1 
HETATM 1895 O O   . HOH B 2 .   ? 28.639  11.342  27.037 1.00 32.46 ? 439 HOH A O   1 
HETATM 1896 O O   . HOH B 2 .   ? 12.363  1.673   6.293  1.00 29.35 ? 440 HOH A O   1 
HETATM 1897 O O   . HOH B 2 .   ? -13.924 4.046   11.300 1.00 40.48 ? 441 HOH A O   1 
HETATM 1898 O O   . HOH B 2 .   ? 19.447  16.877  30.067 1.00 26.17 ? 442 HOH A O   1 
HETATM 1899 O O   . HOH B 2 .   ? 4.064   -3.820  1.726  1.00 23.71 ? 443 HOH A O   1 
HETATM 1900 O O   . HOH B 2 .   ? 0.610   -16.986 15.664 1.00 41.58 ? 444 HOH A O   1 
HETATM 1901 O O   . HOH B 2 .   ? 6.281   -11.022 16.443 1.00 18.13 ? 445 HOH A O   1 
HETATM 1902 O O   . HOH B 2 .   ? 19.851  13.082  36.755 1.00 36.78 ? 446 HOH A O   1 
HETATM 1903 O O   . HOH B 2 .   ? 6.422   12.540  37.977 1.00 37.93 ? 447 HOH A O   1 
HETATM 1904 O O   . HOH B 2 .   ? -10.104 1.302   6.586  1.00 27.17 ? 448 HOH A O   1 
HETATM 1905 O O   . HOH B 2 .   ? 6.522   -3.027  41.748 1.00 31.84 ? 449 HOH A O   1 
HETATM 1906 O O   . HOH B 2 .   ? 6.458   -1.752  44.144 1.00 37.62 ? 450 HOH A O   1 
HETATM 1907 O O   . HOH B 2 .   ? -9.197  -7.473  8.934  1.00 37.58 ? 451 HOH A O   1 
HETATM 1908 O O   . HOH B 2 .   ? 15.010  -5.395  42.444 1.00 30.73 ? 452 HOH A O   1 
HETATM 1909 O O   . HOH B 2 .   ? 3.714   12.249  37.518 1.00 39.12 ? 453 HOH A O   1 
HETATM 1910 O O   . HOH B 2 .   ? 10.683  -10.342 31.566 1.00 32.55 ? 454 HOH A O   1 
HETATM 1911 O O   . HOH B 2 .   ? -13.581 -0.174  15.751 1.00 35.65 ? 455 HOH A O   1 
HETATM 1912 O O   . HOH B 2 .   ? -2.643  -16.647 25.073 1.00 36.50 ? 456 HOH A O   1 
HETATM 1913 O O   . HOH B 2 .   ? 8.055   -13.174 16.315 1.00 37.01 ? 457 HOH A O   1 
HETATM 1914 O O   . HOH B 2 .   ? 21.241  18.729  30.474 1.00 35.92 ? 458 HOH A O   1 
HETATM 1915 O O   . HOH B 2 .   ? 18.179  -10.882 21.304 1.00 46.01 ? 459 HOH A O   1 
HETATM 1916 O O   . HOH B 2 .   ? 19.107  0.966   9.523  1.00 39.79 ? 460 HOH A O   1 
HETATM 1917 O O   . HOH B 2 .   ? -0.418  -14.765 1.791  1.00 36.14 ? 461 HOH A O   1 
HETATM 1918 O O   . HOH B 2 .   ? 9.708   2.725   46.016 1.00 41.26 ? 462 HOH A O   1 
HETATM 1919 O O   . HOH B 2 .   ? -1.763  -5.282  -1.062 1.00 24.10 ? 463 HOH A O   1 
HETATM 1920 O O   . HOH B 2 .   ? 10.605  4.360   43.941 1.00 29.97 ? 464 HOH A O   1 
HETATM 1921 O O   . HOH B 2 .   ? 12.876  -11.524 8.009  1.00 41.69 ? 465 HOH A O   1 
HETATM 1922 O O   . HOH B 2 .   ? -10.809 -8.363  0.489  1.00 40.84 ? 466 HOH A O   1 
HETATM 1923 O O   . HOH B 2 .   ? -8.604  10.181  12.828 1.00 36.90 ? 467 HOH A O   1 
HETATM 1924 O O   . HOH B 2 .   ? 0.052   -7.333  2.080  1.00 26.41 ? 468 HOH A O   1 
HETATM 1925 O O   . HOH B 2 .   ? 8.636   4.325   0.659  1.00 39.49 ? 469 HOH A O   1 
HETATM 1926 O O   . HOH B 2 .   ? 25.930  -4.471  21.438 1.00 36.74 ? 470 HOH A O   1 
HETATM 1927 O O   . HOH B 2 .   ? 22.120  9.658   13.936 1.00 39.33 ? 471 HOH A O   1 
HETATM 1928 O O   . HOH B 2 .   ? -15.518 -0.413  18.143 1.00 39.35 ? 472 HOH A O   1 
HETATM 1929 O O   . HOH B 2 .   ? 22.517  3.486   35.181 1.00 34.77 ? 473 HOH A O   1 
HETATM 1930 O O   . HOH B 2 .   ? 35.457  4.034   30.000 1.00 38.23 ? 474 HOH A O   1 
HETATM 1931 O O   . HOH B 2 .   ? 17.008  18.268  38.828 1.00 42.08 ? 475 HOH A O   1 
HETATM 1932 O O   . HOH B 2 .   ? -0.000  -3.398  0.000  0.50 25.23 ? 476 HOH A O   1 
HETATM 1933 O O   . HOH B 2 .   ? 2.139   14.393  25.313 1.00 30.78 ? 477 HOH A O   1 
HETATM 1934 O O   . HOH B 2 .   ? -7.860  -10.792 30.408 1.00 40.47 ? 478 HOH A O   1 
# 
