data_8S8R
# 
_entry.id   8S8R 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.402 
_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   8S8R         pdb_00008s8r 10.2210/pdb8s8r/pdb 
WWPDB D_1292137037 ?            ?                   
# 
_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                        8S8R 
_pdbx_database_status.recvd_initial_deposition_date   2024-03-07 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              Reinhard.Sterner@biologie.uni-regensburg.de 
_pdbx_contact_author.name_first         Reinhard 
_pdbx_contact_author.name_last          Sterner 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0001-8177-8460 
# 
_audit_author.name               'Rajendran, C.' 
_audit_author.pdbx_ordinal       1 
_audit_author.identifier_ORCID   ? 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Jacs Au' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2691-3704 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            4 
_citation.language                  ? 
_citation.page_first                3258 
_citation.page_last                 3276 
_citation.title                     
;Conformational Modulation of a Mobile Loop Controls Catalysis in the ( beta alpha ) 8 -Barrel Enzyme of Histidine Biosynthesis HisF.
;
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1021/jacsau.4c00558 
_citation.pdbx_database_id_PubMed   39211614 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Hupfeld, E.'       1  ?                   
primary 'Schlee, S.'        2  ?                   
primary 'Wurm, J.P.'        3  ?                   
primary 'Rajendran, C.'     4  ?                   
primary 'Yehorova, D.'      5  ?                   
primary 'Vos, E.'           6  ?                   
primary 'Ravindra Raju, D.' 7  0000-0003-0657-1560 
primary 'Kamerlin, S.C.L.'  8  0000-0002-3190-1173 
primary 'Sprangers, R.'     9  ?                   
primary 'Sterner, R.'       10 0000-0001-8177-8460 
# 
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 'Imidazole glycerol phosphate synthase subunit HisF' 27663.748 1   4.3.2.10 ? ? ? 
2 non-polymer syn 'PHOSPHATE ION'                                      94.971    2   ?        ? ? ? 
3 water       nat water                                                18.015    281 ?        ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'IGP synthase cyclase subunit,IGP synthase subunit HisF,ImGP synthase subunit HisF,IGPS subunit HisF' 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;MLAKRIIACLDVKDGRVVKGSNAENLRDSGDPVELGKFYSEIGIDELVFLDITASVEKRKTMLELVEKVAEQIDIPFTVG
GGIHDFETASELILRGADKVSINTAAVENPSLITQIAQTFGSQAVVVAIDAKRVDGEFMVFTYSGKKNTGILLRDWVVEV
EKRGAGEILLTSIDRDGTKSGYDTEMIRFVRPLTTLPIIASGGAGKMEHFLEAFLAGADAALAASVFHFREIDVRELKEY
LKKHGVNVRLEGL
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MLAKRIIACLDVKDGRVVKGSNAENLRDSGDPVELGKFYSEIGIDELVFLDITASVEKRKTMLELVEKVAEQIDIPFTVG
GGIHDFETASELILRGADKVSINTAAVENPSLITQIAQTFGSQAVVVAIDAKRVDGEFMVFTYSGKKNTGILLRDWVVEV
EKRGAGEILLTSIDRDGTKSGYDTEMIRFVRPLTTLPIIASGGAGKMEHFLEAFLAGADAALAASVFHFREIDVRELKEY
LKKHGVNVRLEGL
;
_entity_poly.pdbx_strand_id                 D 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'PHOSPHATE ION' PO4 
3 water           HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   LEU n 
1 3   ALA n 
1 4   LYS n 
1 5   ARG n 
1 6   ILE n 
1 7   ILE n 
1 8   ALA n 
1 9   CYS n 
1 10  LEU n 
1 11  ASP n 
1 12  VAL n 
1 13  LYS n 
1 14  ASP n 
1 15  GLY n 
1 16  ARG n 
1 17  VAL n 
1 18  VAL n 
1 19  LYS n 
1 20  GLY n 
1 21  SER n 
1 22  ASN n 
1 23  ALA n 
1 24  GLU n 
1 25  ASN n 
1 26  LEU n 
1 27  ARG n 
1 28  ASP n 
1 29  SER n 
1 30  GLY n 
1 31  ASP n 
1 32  PRO n 
1 33  VAL n 
1 34  GLU n 
1 35  LEU n 
1 36  GLY n 
1 37  LYS n 
1 38  PHE n 
1 39  TYR n 
1 40  SER n 
1 41  GLU n 
1 42  ILE n 
1 43  GLY n 
1 44  ILE n 
1 45  ASP n 
1 46  GLU n 
1 47  LEU n 
1 48  VAL n 
1 49  PHE n 
1 50  LEU n 
1 51  ASP n 
1 52  ILE n 
1 53  THR n 
1 54  ALA n 
1 55  SER n 
1 56  VAL n 
1 57  GLU n 
1 58  LYS n 
1 59  ARG n 
1 60  LYS n 
1 61  THR n 
1 62  MET n 
1 63  LEU n 
1 64  GLU n 
1 65  LEU n 
1 66  VAL n 
1 67  GLU n 
1 68  LYS n 
1 69  VAL n 
1 70  ALA n 
1 71  GLU n 
1 72  GLN n 
1 73  ILE n 
1 74  ASP n 
1 75  ILE n 
1 76  PRO n 
1 77  PHE n 
1 78  THR n 
1 79  VAL n 
1 80  GLY n 
1 81  GLY n 
1 82  GLY n 
1 83  ILE n 
1 84  HIS n 
1 85  ASP n 
1 86  PHE n 
1 87  GLU n 
1 88  THR n 
1 89  ALA n 
1 90  SER n 
1 91  GLU n 
1 92  LEU n 
1 93  ILE n 
1 94  LEU n 
1 95  ARG n 
1 96  GLY n 
1 97  ALA n 
1 98  ASP n 
1 99  LYS n 
1 100 VAL n 
1 101 SER n 
1 102 ILE n 
1 103 ASN n 
1 104 THR n 
1 105 ALA n 
1 106 ALA n 
1 107 VAL n 
1 108 GLU n 
1 109 ASN n 
1 110 PRO n 
1 111 SER n 
1 112 LEU n 
1 113 ILE n 
1 114 THR n 
1 115 GLN n 
1 116 ILE n 
1 117 ALA n 
1 118 GLN n 
1 119 THR n 
1 120 PHE n 
1 121 GLY n 
1 122 SER n 
1 123 GLN n 
1 124 ALA n 
1 125 VAL n 
1 126 VAL n 
1 127 VAL n 
1 128 ALA n 
1 129 ILE n 
1 130 ASP n 
1 131 ALA n 
1 132 LYS n 
1 133 ARG n 
1 134 VAL n 
1 135 ASP n 
1 136 GLY n 
1 137 GLU n 
1 138 PHE n 
1 139 MET n 
1 140 VAL n 
1 141 PHE n 
1 142 THR n 
1 143 TYR n 
1 144 SER n 
1 145 GLY n 
1 146 LYS n 
1 147 LYS n 
1 148 ASN n 
1 149 THR n 
1 150 GLY n 
1 151 ILE n 
1 152 LEU n 
1 153 LEU n 
1 154 ARG n 
1 155 ASP n 
1 156 TRP n 
1 157 VAL n 
1 158 VAL n 
1 159 GLU n 
1 160 VAL n 
1 161 GLU n 
1 162 LYS n 
1 163 ARG n 
1 164 GLY n 
1 165 ALA n 
1 166 GLY n 
1 167 GLU n 
1 168 ILE n 
1 169 LEU n 
1 170 LEU n 
1 171 THR n 
1 172 SER n 
1 173 ILE n 
1 174 ASP n 
1 175 ARG n 
1 176 ASP n 
1 177 GLY n 
1 178 THR n 
1 179 LYS n 
1 180 SER n 
1 181 GLY n 
1 182 TYR n 
1 183 ASP n 
1 184 THR n 
1 185 GLU n 
1 186 MET n 
1 187 ILE n 
1 188 ARG n 
1 189 PHE n 
1 190 VAL n 
1 191 ARG n 
1 192 PRO n 
1 193 LEU n 
1 194 THR n 
1 195 THR n 
1 196 LEU n 
1 197 PRO n 
1 198 ILE n 
1 199 ILE n 
1 200 ALA n 
1 201 SER n 
1 202 GLY n 
1 203 GLY n 
1 204 ALA n 
1 205 GLY n 
1 206 LYS n 
1 207 MET n 
1 208 GLU n 
1 209 HIS n 
1 210 PHE n 
1 211 LEU n 
1 212 GLU n 
1 213 ALA n 
1 214 PHE n 
1 215 LEU n 
1 216 ALA n 
1 217 GLY n 
1 218 ALA n 
1 219 ASP n 
1 220 ALA n 
1 221 ALA n 
1 222 LEU n 
1 223 ALA n 
1 224 ALA n 
1 225 SER n 
1 226 VAL n 
1 227 PHE n 
1 228 HIS n 
1 229 PHE n 
1 230 ARG n 
1 231 GLU n 
1 232 ILE n 
1 233 ASP n 
1 234 VAL n 
1 235 ARG n 
1 236 GLU n 
1 237 LEU n 
1 238 LYS n 
1 239 GLU n 
1 240 TYR n 
1 241 LEU n 
1 242 LYS n 
1 243 LYS n 
1 244 HIS n 
1 245 GLY n 
1 246 VAL n 
1 247 ASN n 
1 248 VAL n 
1 249 ARG n 
1 250 LEU n 
1 251 GLU n 
1 252 GLY n 
1 253 LEU n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   253 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'hisF, TM_1036' 
_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      'Thermotoga maritima' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     2336 
_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 
CYS 'L-peptide linking' y CYSTEINE        ? 'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE       ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE         ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE       ? 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER           ? 'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE      ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE         ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE          ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE      ? 'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE   ? 'C9 H11 N O2'    165.189 
PO4 non-polymer         . 'PHOSPHATE ION' ? 'O4 P -3'        94.971  
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   MET 1   1   1   MET MET D . n 
A 1 2   LEU 2   2   2   LEU LEU D . n 
A 1 3   ALA 3   3   3   ALA ALA D . n 
A 1 4   LYS 4   4   4   LYS LYS D . n 
A 1 5   ARG 5   5   5   ARG ARG D . n 
A 1 6   ILE 6   6   6   ILE ILE D . n 
A 1 7   ILE 7   7   7   ILE ILE D . n 
A 1 8   ALA 8   8   8   ALA ALA D . n 
A 1 9   CYS 9   9   9   CYS CYS D . n 
A 1 10  LEU 10  10  10  LEU LEU D . n 
A 1 11  ASP 11  11  11  ASP ASP D . n 
A 1 12  VAL 12  12  12  VAL VAL D . n 
A 1 13  LYS 13  13  13  LYS LYS D . n 
A 1 14  ASP 14  14  14  ASP ASP D . n 
A 1 15  GLY 15  15  15  GLY GLY D . n 
A 1 16  ARG 16  16  16  ARG ARG D . n 
A 1 17  VAL 17  17  17  VAL VAL D . n 
A 1 18  VAL 18  18  18  VAL VAL D . n 
A 1 19  LYS 19  19  19  LYS LYS D . n 
A 1 20  GLY 20  20  20  GLY GLY D . n 
A 1 21  SER 21  21  21  SER SER D . n 
A 1 22  ASN 22  22  22  ASN ASN D . n 
A 1 23  ALA 23  23  23  ALA ALA D . n 
A 1 24  GLU 24  24  24  GLU GLU D . n 
A 1 25  ASN 25  25  25  ASN ASN D . n 
A 1 26  LEU 26  26  26  LEU LEU D . n 
A 1 27  ARG 27  27  27  ARG ARG D . n 
A 1 28  ASP 28  28  28  ASP ASP D . n 
A 1 29  SER 29  29  29  SER SER D . n 
A 1 30  GLY 30  30  30  GLY GLY D . n 
A 1 31  ASP 31  31  31  ASP ASP D . n 
A 1 32  PRO 32  32  32  PRO PRO D . n 
A 1 33  VAL 33  33  33  VAL VAL D . n 
A 1 34  GLU 34  34  34  GLU GLU D . n 
A 1 35  LEU 35  35  35  LEU LEU D . n 
A 1 36  GLY 36  36  36  GLY GLY D . n 
A 1 37  LYS 37  37  37  LYS LYS D . n 
A 1 38  PHE 38  38  38  PHE PHE D . n 
A 1 39  TYR 39  39  39  TYR TYR D . n 
A 1 40  SER 40  40  40  SER SER D . n 
A 1 41  GLU 41  41  41  GLU GLU D . n 
A 1 42  ILE 42  42  42  ILE ILE D . n 
A 1 43  GLY 43  43  43  GLY GLY D . n 
A 1 44  ILE 44  44  44  ILE ILE D . n 
A 1 45  ASP 45  45  45  ASP ASP D . n 
A 1 46  GLU 46  46  46  GLU GLU D . n 
A 1 47  LEU 47  47  47  LEU LEU D . n 
A 1 48  VAL 48  48  48  VAL VAL D . n 
A 1 49  PHE 49  49  49  PHE PHE D . n 
A 1 50  LEU 50  50  50  LEU LEU D . n 
A 1 51  ASP 51  51  51  ASP ASP D . n 
A 1 52  ILE 52  52  52  ILE ILE D . n 
A 1 53  THR 53  53  53  THR THR D . n 
A 1 54  ALA 54  54  54  ALA ALA D . n 
A 1 55  SER 55  55  55  SER SER D . n 
A 1 56  VAL 56  56  56  VAL VAL D . n 
A 1 57  GLU 57  57  57  GLU GLU D . n 
A 1 58  LYS 58  58  58  LYS LYS D . n 
A 1 59  ARG 59  59  59  ARG ARG D . n 
A 1 60  LYS 60  60  60  LYS LYS D . n 
A 1 61  THR 61  61  61  THR THR D . n 
A 1 62  MET 62  62  62  MET MET D . n 
A 1 63  LEU 63  63  63  LEU LEU D . n 
A 1 64  GLU 64  64  64  GLU GLU D . n 
A 1 65  LEU 65  65  65  LEU LEU D . n 
A 1 66  VAL 66  66  66  VAL VAL D . n 
A 1 67  GLU 67  67  67  GLU GLU D . n 
A 1 68  LYS 68  68  68  LYS LYS D . n 
A 1 69  VAL 69  69  69  VAL VAL D . n 
A 1 70  ALA 70  70  70  ALA ALA D . n 
A 1 71  GLU 71  71  71  GLU GLU D . n 
A 1 72  GLN 72  72  72  GLN GLN D . n 
A 1 73  ILE 73  73  73  ILE ILE D . n 
A 1 74  ASP 74  74  74  ASP ASP D . n 
A 1 75  ILE 75  75  75  ILE ILE D . n 
A 1 76  PRO 76  76  76  PRO PRO D . n 
A 1 77  PHE 77  77  77  PHE PHE D . n 
A 1 78  THR 78  78  78  THR THR D . n 
A 1 79  VAL 79  79  79  VAL VAL D . n 
A 1 80  GLY 80  80  80  GLY GLY D . n 
A 1 81  GLY 81  81  81  GLY GLY D . n 
A 1 82  GLY 82  82  82  GLY GLY D . n 
A 1 83  ILE 83  83  83  ILE ILE D . n 
A 1 84  HIS 84  84  84  HIS HIS D . n 
A 1 85  ASP 85  85  85  ASP ASP D . n 
A 1 86  PHE 86  86  86  PHE PHE D . n 
A 1 87  GLU 87  87  87  GLU GLU D . n 
A 1 88  THR 88  88  88  THR THR D . n 
A 1 89  ALA 89  89  89  ALA ALA D . n 
A 1 90  SER 90  90  90  SER SER D . n 
A 1 91  GLU 91  91  91  GLU GLU D . n 
A 1 92  LEU 92  92  92  LEU LEU D . n 
A 1 93  ILE 93  93  93  ILE ILE D . n 
A 1 94  LEU 94  94  94  LEU LEU D . n 
A 1 95  ARG 95  95  95  ARG ARG D . n 
A 1 96  GLY 96  96  96  GLY GLY D . n 
A 1 97  ALA 97  97  97  ALA ALA D . n 
A 1 98  ASP 98  98  98  ASP ASP D . n 
A 1 99  LYS 99  99  99  LYS LYS D . n 
A 1 100 VAL 100 100 100 VAL VAL D . n 
A 1 101 SER 101 101 101 SER SER D . n 
A 1 102 ILE 102 102 102 ILE ILE D . n 
A 1 103 ASN 103 103 103 ASN ASN D . n 
A 1 104 THR 104 104 104 THR THR D . n 
A 1 105 ALA 105 105 105 ALA ALA D . n 
A 1 106 ALA 106 106 106 ALA ALA D . n 
A 1 107 VAL 107 107 107 VAL VAL D . n 
A 1 108 GLU 108 108 108 GLU GLU D . n 
A 1 109 ASN 109 109 109 ASN ASN D . n 
A 1 110 PRO 110 110 110 PRO PRO D . n 
A 1 111 SER 111 111 111 SER SER D . n 
A 1 112 LEU 112 112 112 LEU LEU D . n 
A 1 113 ILE 113 113 113 ILE ILE D . n 
A 1 114 THR 114 114 114 THR THR D . n 
A 1 115 GLN 115 115 115 GLN GLN D . n 
A 1 116 ILE 116 116 116 ILE ILE D . n 
A 1 117 ALA 117 117 117 ALA ALA D . n 
A 1 118 GLN 118 118 118 GLN GLN D . n 
A 1 119 THR 119 119 119 THR THR D . n 
A 1 120 PHE 120 120 120 PHE PHE D . n 
A 1 121 GLY 121 121 121 GLY GLY D . n 
A 1 122 SER 122 122 122 SER SER D . n 
A 1 123 GLN 123 123 123 GLN GLN D . n 
A 1 124 ALA 124 124 124 ALA ALA D . n 
A 1 125 VAL 125 125 125 VAL VAL D . n 
A 1 126 VAL 126 126 126 VAL VAL D . n 
A 1 127 VAL 127 127 127 VAL VAL D . n 
A 1 128 ALA 128 128 128 ALA ALA D . n 
A 1 129 ILE 129 129 129 ILE ILE D . n 
A 1 130 ASP 130 130 130 ASP ASP D . n 
A 1 131 ALA 131 131 131 ALA ALA D . n 
A 1 132 LYS 132 132 132 LYS LYS D . n 
A 1 133 ARG 133 133 133 ARG ARG D . n 
A 1 134 VAL 134 134 134 VAL VAL D . n 
A 1 135 ASP 135 135 135 ASP ASP D . n 
A 1 136 GLY 136 136 136 GLY GLY D . n 
A 1 137 GLU 137 137 137 GLU GLU D . n 
A 1 138 PHE 138 138 138 PHE PHE D . n 
A 1 139 MET 139 139 139 MET MET D . n 
A 1 140 VAL 140 140 140 VAL VAL D . n 
A 1 141 PHE 141 141 141 PHE PHE D . n 
A 1 142 THR 142 142 142 THR THR D . n 
A 1 143 TYR 143 143 143 TYR TYR D . n 
A 1 144 SER 144 144 144 SER SER D . n 
A 1 145 GLY 145 145 145 GLY GLY D . n 
A 1 146 LYS 146 146 146 LYS LYS D . n 
A 1 147 LYS 147 147 147 LYS LYS D . n 
A 1 148 ASN 148 148 148 ASN ASN D . n 
A 1 149 THR 149 149 149 THR THR D . n 
A 1 150 GLY 150 150 150 GLY GLY D . n 
A 1 151 ILE 151 151 151 ILE ILE D . n 
A 1 152 LEU 152 152 152 LEU LEU D . n 
A 1 153 LEU 153 153 153 LEU LEU D . n 
A 1 154 ARG 154 154 154 ARG ARG D . n 
A 1 155 ASP 155 155 155 ASP ASP D . n 
A 1 156 TRP 156 156 156 TRP TRP D . n 
A 1 157 VAL 157 157 157 VAL VAL D . n 
A 1 158 VAL 158 158 158 VAL VAL D . n 
A 1 159 GLU 159 159 159 GLU GLU D . n 
A 1 160 VAL 160 160 160 VAL VAL D . n 
A 1 161 GLU 161 161 161 GLU GLU D . n 
A 1 162 LYS 162 162 162 LYS LYS D . n 
A 1 163 ARG 163 163 163 ARG ARG D . n 
A 1 164 GLY 164 164 164 GLY GLY D . n 
A 1 165 ALA 165 165 165 ALA ALA D . n 
A 1 166 GLY 166 166 166 GLY GLY D . n 
A 1 167 GLU 167 167 167 GLU GLU D . n 
A 1 168 ILE 168 168 168 ILE ILE D . n 
A 1 169 LEU 169 169 169 LEU LEU D . n 
A 1 170 LEU 170 170 170 LEU LEU D . n 
A 1 171 THR 171 171 171 THR THR D . n 
A 1 172 SER 172 172 172 SER SER D . n 
A 1 173 ILE 173 173 173 ILE ILE D . n 
A 1 174 ASP 174 174 174 ASP ASP D . n 
A 1 175 ARG 175 175 175 ARG ARG D . n 
A 1 176 ASP 176 176 176 ASP ASP D . n 
A 1 177 GLY 177 177 177 GLY GLY D . n 
A 1 178 THR 178 178 178 THR THR D . n 
A 1 179 LYS 179 179 179 LYS LYS D . n 
A 1 180 SER 180 180 180 SER SER D . n 
A 1 181 GLY 181 181 181 GLY GLY D . n 
A 1 182 TYR 182 182 182 TYR TYR D . n 
A 1 183 ASP 183 183 183 ASP ASP D . n 
A 1 184 THR 184 184 184 THR THR D . n 
A 1 185 GLU 185 185 185 GLU GLU D . n 
A 1 186 MET 186 186 186 MET MET D . n 
A 1 187 ILE 187 187 187 ILE ILE D . n 
A 1 188 ARG 188 188 188 ARG ARG D . n 
A 1 189 PHE 189 189 189 PHE PHE D . n 
A 1 190 VAL 190 190 190 VAL VAL D . n 
A 1 191 ARG 191 191 191 ARG ARG D . n 
A 1 192 PRO 192 192 192 PRO PRO D . n 
A 1 193 LEU 193 193 193 LEU LEU D . n 
A 1 194 THR 194 194 194 THR THR D . n 
A 1 195 THR 195 195 195 THR THR D . n 
A 1 196 LEU 196 196 196 LEU LEU D . n 
A 1 197 PRO 197 197 197 PRO PRO D . n 
A 1 198 ILE 198 198 198 ILE ILE D . n 
A 1 199 ILE 199 199 199 ILE ILE D . n 
A 1 200 ALA 200 200 200 ALA ALA D . n 
A 1 201 SER 201 201 201 SER SER D . n 
A 1 202 GLY 202 202 202 GLY GLY D . n 
A 1 203 GLY 203 203 203 GLY GLY D . n 
A 1 204 ALA 204 204 204 ALA ALA D . n 
A 1 205 GLY 205 205 205 GLY GLY D . n 
A 1 206 LYS 206 206 206 LYS LYS D . n 
A 1 207 MET 207 207 207 MET MET D . n 
A 1 208 GLU 208 208 208 GLU GLU D . n 
A 1 209 HIS 209 209 209 HIS HIS D . n 
A 1 210 PHE 210 210 210 PHE PHE D . n 
A 1 211 LEU 211 211 211 LEU LEU D . n 
A 1 212 GLU 212 212 212 GLU GLU D . n 
A 1 213 ALA 213 213 213 ALA ALA D . n 
A 1 214 PHE 214 214 214 PHE PHE D . n 
A 1 215 LEU 215 215 215 LEU LEU D . n 
A 1 216 ALA 216 216 216 ALA ALA D . n 
A 1 217 GLY 217 217 217 GLY GLY D . n 
A 1 218 ALA 218 218 218 ALA ALA D . n 
A 1 219 ASP 219 219 219 ASP ASP D . n 
A 1 220 ALA 220 220 220 ALA ALA D . n 
A 1 221 ALA 221 221 221 ALA ALA D . n 
A 1 222 LEU 222 222 222 LEU LEU D . n 
A 1 223 ALA 223 223 223 ALA ALA D . n 
A 1 224 ALA 224 224 224 ALA ALA D . n 
A 1 225 SER 225 225 225 SER SER D . n 
A 1 226 VAL 226 226 226 VAL VAL D . n 
A 1 227 PHE 227 227 227 PHE PHE D . n 
A 1 228 HIS 228 228 228 HIS HIS D . n 
A 1 229 PHE 229 229 229 PHE PHE D . n 
A 1 230 ARG 230 230 230 ARG ARG D . n 
A 1 231 GLU 231 231 231 GLU GLU D . n 
A 1 232 ILE 232 232 232 ILE ILE D . n 
A 1 233 ASP 233 233 233 ASP ASP D . n 
A 1 234 VAL 234 234 234 VAL VAL D . n 
A 1 235 ARG 235 235 235 ARG ARG D . n 
A 1 236 GLU 236 236 236 GLU GLU D . n 
A 1 237 LEU 237 237 237 LEU LEU D . n 
A 1 238 LYS 238 238 238 LYS LYS D . n 
A 1 239 GLU 239 239 239 GLU GLU D . n 
A 1 240 TYR 240 240 240 TYR TYR D . n 
A 1 241 LEU 241 241 241 LEU LEU D . n 
A 1 242 LYS 242 242 242 LYS LYS D . n 
A 1 243 LYS 243 243 243 LYS LYS D . n 
A 1 244 HIS 244 244 244 HIS HIS D . n 
A 1 245 GLY 245 245 245 GLY GLY D . n 
A 1 246 VAL 246 246 246 VAL VAL D . n 
A 1 247 ASN 247 247 247 ASN ASN D . n 
A 1 248 VAL 248 248 248 VAL VAL D . n 
A 1 249 ARG 249 249 249 ARG ARG D . n 
A 1 250 LEU 250 250 250 LEU LEU D . n 
A 1 251 GLU 251 251 251 GLU GLU D . n 
A 1 252 GLY 252 252 252 GLY GLY D . n 
A 1 253 LEU 253 253 253 LEU LEU D . n 
# 
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 PO4 1   301 305 PO4 PO4 D . 
C 2 PO4 1   302 306 PO4 PO4 D . 
D 3 HOH 1   401 209 HOH HOH D . 
D 3 HOH 2   402 213 HOH HOH D . 
D 3 HOH 3   403 83  HOH HOH D . 
D 3 HOH 4   404 171 HOH HOH D . 
D 3 HOH 5   405 157 HOH HOH D . 
D 3 HOH 6   406 136 HOH HOH D . 
D 3 HOH 7   407 165 HOH HOH D . 
D 3 HOH 8   408 238 HOH HOH D . 
D 3 HOH 9   409 154 HOH HOH D . 
D 3 HOH 10  410 86  HOH HOH D . 
D 3 HOH 11  411 131 HOH HOH D . 
D 3 HOH 12  412 149 HOH HOH D . 
D 3 HOH 13  413 10  HOH HOH D . 
D 3 HOH 14  414 17  HOH HOH D . 
D 3 HOH 15  415 96  HOH HOH D . 
D 3 HOH 16  416 228 HOH HOH D . 
D 3 HOH 17  417 187 HOH HOH D . 
D 3 HOH 18  418 203 HOH HOH D . 
D 3 HOH 19  419 132 HOH HOH D . 
D 3 HOH 20  420 276 HOH HOH D . 
D 3 HOH 21  421 150 HOH HOH D . 
D 3 HOH 22  422 12  HOH HOH D . 
D 3 HOH 23  423 76  HOH HOH D . 
D 3 HOH 24  424 166 HOH HOH D . 
D 3 HOH 25  425 27  HOH HOH D . 
D 3 HOH 26  426 94  HOH HOH D . 
D 3 HOH 27  427 222 HOH HOH D . 
D 3 HOH 28  428 49  HOH HOH D . 
D 3 HOH 29  429 221 HOH HOH D . 
D 3 HOH 30  430 201 HOH HOH D . 
D 3 HOH 31  431 21  HOH HOH D . 
D 3 HOH 32  432 182 HOH HOH D . 
D 3 HOH 33  433 22  HOH HOH D . 
D 3 HOH 34  434 87  HOH HOH D . 
D 3 HOH 35  435 84  HOH HOH D . 
D 3 HOH 36  436 236 HOH HOH D . 
D 3 HOH 37  437 250 HOH HOH D . 
D 3 HOH 38  438 158 HOH HOH D . 
D 3 HOH 39  439 251 HOH HOH D . 
D 3 HOH 40  440 1   HOH HOH D . 
D 3 HOH 41  441 20  HOH HOH D . 
D 3 HOH 42  442 55  HOH HOH D . 
D 3 HOH 43  443 24  HOH HOH D . 
D 3 HOH 44  444 40  HOH HOH D . 
D 3 HOH 45  445 245 HOH HOH D . 
D 3 HOH 46  446 128 HOH HOH D . 
D 3 HOH 47  447 192 HOH HOH D . 
D 3 HOH 48  448 279 HOH HOH D . 
D 3 HOH 49  449 90  HOH HOH D . 
D 3 HOH 50  450 82  HOH HOH D . 
D 3 HOH 51  451 113 HOH HOH D . 
D 3 HOH 52  452 18  HOH HOH D . 
D 3 HOH 53  453 107 HOH HOH D . 
D 3 HOH 54  454 97  HOH HOH D . 
D 3 HOH 55  455 41  HOH HOH D . 
D 3 HOH 56  456 143 HOH HOH D . 
D 3 HOH 57  457 88  HOH HOH D . 
D 3 HOH 58  458 261 HOH HOH D . 
D 3 HOH 59  459 114 HOH HOH D . 
D 3 HOH 60  460 14  HOH HOH D . 
D 3 HOH 61  461 67  HOH HOH D . 
D 3 HOH 62  462 29  HOH HOH D . 
D 3 HOH 63  463 73  HOH HOH D . 
D 3 HOH 64  464 44  HOH HOH D . 
D 3 HOH 65  465 139 HOH HOH D . 
D 3 HOH 66  466 239 HOH HOH D . 
D 3 HOH 67  467 120 HOH HOH D . 
D 3 HOH 68  468 100 HOH HOH D . 
D 3 HOH 69  469 47  HOH HOH D . 
D 3 HOH 70  470 145 HOH HOH D . 
D 3 HOH 71  471 186 HOH HOH D . 
D 3 HOH 72  472 52  HOH HOH D . 
D 3 HOH 73  473 16  HOH HOH D . 
D 3 HOH 74  474 118 HOH HOH D . 
D 3 HOH 75  475 25  HOH HOH D . 
D 3 HOH 76  476 60  HOH HOH D . 
D 3 HOH 77  477 62  HOH HOH D . 
D 3 HOH 78  478 95  HOH HOH D . 
D 3 HOH 79  479 30  HOH HOH D . 
D 3 HOH 80  480 9   HOH HOH D . 
D 3 HOH 81  481 220 HOH HOH D . 
D 3 HOH 82  482 4   HOH HOH D . 
D 3 HOH 83  483 159 HOH HOH D . 
D 3 HOH 84  484 241 HOH HOH D . 
D 3 HOH 85  485 28  HOH HOH D . 
D 3 HOH 86  486 266 HOH HOH D . 
D 3 HOH 87  487 235 HOH HOH D . 
D 3 HOH 88  488 181 HOH HOH D . 
D 3 HOH 89  489 37  HOH HOH D . 
D 3 HOH 90  490 35  HOH HOH D . 
D 3 HOH 91  491 59  HOH HOH D . 
D 3 HOH 92  492 156 HOH HOH D . 
D 3 HOH 93  493 208 HOH HOH D . 
D 3 HOH 94  494 152 HOH HOH D . 
D 3 HOH 95  495 102 HOH HOH D . 
D 3 HOH 96  496 13  HOH HOH D . 
D 3 HOH 97  497 103 HOH HOH D . 
D 3 HOH 98  498 5   HOH HOH D . 
D 3 HOH 99  499 48  HOH HOH D . 
D 3 HOH 100 500 56  HOH HOH D . 
D 3 HOH 101 501 32  HOH HOH D . 
D 3 HOH 102 502 109 HOH HOH D . 
D 3 HOH 103 503 58  HOH HOH D . 
D 3 HOH 104 504 26  HOH HOH D . 
D 3 HOH 105 505 134 HOH HOH D . 
D 3 HOH 106 506 161 HOH HOH D . 
D 3 HOH 107 507 172 HOH HOH D . 
D 3 HOH 108 508 146 HOH HOH D . 
D 3 HOH 109 509 116 HOH HOH D . 
D 3 HOH 110 510 229 HOH HOH D . 
D 3 HOH 111 511 43  HOH HOH D . 
D 3 HOH 112 512 111 HOH HOH D . 
D 3 HOH 113 513 66  HOH HOH D . 
D 3 HOH 114 514 133 HOH HOH D . 
D 3 HOH 115 515 46  HOH HOH D . 
D 3 HOH 116 516 64  HOH HOH D . 
D 3 HOH 117 517 85  HOH HOH D . 
D 3 HOH 118 518 183 HOH HOH D . 
D 3 HOH 119 519 214 HOH HOH D . 
D 3 HOH 120 520 121 HOH HOH D . 
D 3 HOH 121 521 6   HOH HOH D . 
D 3 HOH 122 522 207 HOH HOH D . 
D 3 HOH 123 523 80  HOH HOH D . 
D 3 HOH 124 524 142 HOH HOH D . 
D 3 HOH 125 525 162 HOH HOH D . 
D 3 HOH 126 526 77  HOH HOH D . 
D 3 HOH 127 527 34  HOH HOH D . 
D 3 HOH 128 528 174 HOH HOH D . 
D 3 HOH 129 529 42  HOH HOH D . 
D 3 HOH 130 530 110 HOH HOH D . 
D 3 HOH 131 531 11  HOH HOH D . 
D 3 HOH 132 532 23  HOH HOH D . 
D 3 HOH 133 533 74  HOH HOH D . 
D 3 HOH 134 534 8   HOH HOH D . 
D 3 HOH 135 535 141 HOH HOH D . 
D 3 HOH 136 536 193 HOH HOH D . 
D 3 HOH 137 537 105 HOH HOH D . 
D 3 HOH 138 538 53  HOH HOH D . 
D 3 HOH 139 539 89  HOH HOH D . 
D 3 HOH 140 540 260 HOH HOH D . 
D 3 HOH 141 541 175 HOH HOH D . 
D 3 HOH 142 542 176 HOH HOH D . 
D 3 HOH 143 543 3   HOH HOH D . 
D 3 HOH 144 544 151 HOH HOH D . 
D 3 HOH 145 545 147 HOH HOH D . 
D 3 HOH 146 546 185 HOH HOH D . 
D 3 HOH 147 547 248 HOH HOH D . 
D 3 HOH 148 548 115 HOH HOH D . 
D 3 HOH 149 549 206 HOH HOH D . 
D 3 HOH 150 550 224 HOH HOH D . 
D 3 HOH 151 551 188 HOH HOH D . 
D 3 HOH 152 552 69  HOH HOH D . 
D 3 HOH 153 553 167 HOH HOH D . 
D 3 HOH 154 554 168 HOH HOH D . 
D 3 HOH 155 555 153 HOH HOH D . 
D 3 HOH 156 556 216 HOH HOH D . 
D 3 HOH 157 557 140 HOH HOH D . 
D 3 HOH 158 558 144 HOH HOH D . 
D 3 HOH 159 559 108 HOH HOH D . 
D 3 HOH 160 560 215 HOH HOH D . 
D 3 HOH 161 561 15  HOH HOH D . 
D 3 HOH 162 562 98  HOH HOH D . 
D 3 HOH 163 563 36  HOH HOH D . 
D 3 HOH 164 564 2   HOH HOH D . 
D 3 HOH 165 565 68  HOH HOH D . 
D 3 HOH 166 566 257 HOH HOH D . 
D 3 HOH 167 567 198 HOH HOH D . 
D 3 HOH 168 568 231 HOH HOH D . 
D 3 HOH 169 569 262 HOH HOH D . 
D 3 HOH 170 570 61  HOH HOH D . 
D 3 HOH 171 571 202 HOH HOH D . 
D 3 HOH 172 572 106 HOH HOH D . 
D 3 HOH 173 573 180 HOH HOH D . 
D 3 HOH 174 574 252 HOH HOH D . 
D 3 HOH 175 575 225 HOH HOH D . 
D 3 HOH 176 576 54  HOH HOH D . 
D 3 HOH 177 577 78  HOH HOH D . 
D 3 HOH 178 578 33  HOH HOH D . 
D 3 HOH 179 579 104 HOH HOH D . 
D 3 HOH 180 580 173 HOH HOH D . 
D 3 HOH 181 581 254 HOH HOH D . 
D 3 HOH 182 582 57  HOH HOH D . 
D 3 HOH 183 583 117 HOH HOH D . 
D 3 HOH 184 584 130 HOH HOH D . 
D 3 HOH 185 585 45  HOH HOH D . 
D 3 HOH 186 586 124 HOH HOH D . 
D 3 HOH 187 587 39  HOH HOH D . 
D 3 HOH 188 588 38  HOH HOH D . 
D 3 HOH 189 589 155 HOH HOH D . 
D 3 HOH 190 590 184 HOH HOH D . 
D 3 HOH 191 591 232 HOH HOH D . 
D 3 HOH 192 592 263 HOH HOH D . 
D 3 HOH 193 593 237 HOH HOH D . 
D 3 HOH 194 594 256 HOH HOH D . 
D 3 HOH 195 595 71  HOH HOH D . 
D 3 HOH 196 596 81  HOH HOH D . 
D 3 HOH 197 597 122 HOH HOH D . 
D 3 HOH 198 598 125 HOH HOH D . 
D 3 HOH 199 599 272 HOH HOH D . 
D 3 HOH 200 600 148 HOH HOH D . 
D 3 HOH 201 601 169 HOH HOH D . 
D 3 HOH 202 602 177 HOH HOH D . 
D 3 HOH 203 603 135 HOH HOH D . 
D 3 HOH 204 604 163 HOH HOH D . 
D 3 HOH 205 605 191 HOH HOH D . 
D 3 HOH 206 606 212 HOH HOH D . 
D 3 HOH 207 607 197 HOH HOH D . 
D 3 HOH 208 608 199 HOH HOH D . 
D 3 HOH 209 609 51  HOH HOH D . 
D 3 HOH 210 610 264 HOH HOH D . 
D 3 HOH 211 611 211 HOH HOH D . 
D 3 HOH 212 612 259 HOH HOH D . 
D 3 HOH 213 613 189 HOH HOH D . 
D 3 HOH 214 614 246 HOH HOH D . 
D 3 HOH 215 615 92  HOH HOH D . 
D 3 HOH 216 616 278 HOH HOH D . 
D 3 HOH 217 617 223 HOH HOH D . 
D 3 HOH 218 618 277 HOH HOH D . 
D 3 HOH 219 619 230 HOH HOH D . 
D 3 HOH 220 620 196 HOH HOH D . 
D 3 HOH 221 621 280 HOH HOH D . 
D 3 HOH 222 622 164 HOH HOH D . 
D 3 HOH 223 623 255 HOH HOH D . 
D 3 HOH 224 624 275 HOH HOH D . 
D 3 HOH 225 625 218 HOH HOH D . 
D 3 HOH 226 626 170 HOH HOH D . 
D 3 HOH 227 627 205 HOH HOH D . 
D 3 HOH 228 628 178 HOH HOH D . 
D 3 HOH 229 629 101 HOH HOH D . 
D 3 HOH 230 630 91  HOH HOH D . 
D 3 HOH 231 631 179 HOH HOH D . 
D 3 HOH 232 632 63  HOH HOH D . 
D 3 HOH 233 633 19  HOH HOH D . 
D 3 HOH 234 634 204 HOH HOH D . 
D 3 HOH 235 635 269 HOH HOH D . 
D 3 HOH 236 636 267 HOH HOH D . 
D 3 HOH 237 637 271 HOH HOH D . 
D 3 HOH 238 638 247 HOH HOH D . 
D 3 HOH 239 639 242 HOH HOH D . 
D 3 HOH 240 640 265 HOH HOH D . 
D 3 HOH 241 641 190 HOH HOH D . 
D 3 HOH 242 642 112 HOH HOH D . 
D 3 HOH 243 643 227 HOH HOH D . 
D 3 HOH 244 644 210 HOH HOH D . 
D 3 HOH 245 645 126 HOH HOH D . 
D 3 HOH 246 646 79  HOH HOH D . 
D 3 HOH 247 647 72  HOH HOH D . 
D 3 HOH 248 648 129 HOH HOH D . 
D 3 HOH 249 649 273 HOH HOH D . 
D 3 HOH 250 650 217 HOH HOH D . 
D 3 HOH 251 651 240 HOH HOH D . 
D 3 HOH 252 652 31  HOH HOH D . 
D 3 HOH 253 653 244 HOH HOH D . 
D 3 HOH 254 654 7   HOH HOH D . 
D 3 HOH 255 655 234 HOH HOH D . 
D 3 HOH 256 656 137 HOH HOH D . 
D 3 HOH 257 657 194 HOH HOH D . 
D 3 HOH 258 658 274 HOH HOH D . 
D 3 HOH 259 659 70  HOH HOH D . 
D 3 HOH 260 660 243 HOH HOH D . 
D 3 HOH 261 661 268 HOH HOH D . 
D 3 HOH 262 662 138 HOH HOH D . 
D 3 HOH 263 663 160 HOH HOH D . 
D 3 HOH 264 664 65  HOH HOH D . 
D 3 HOH 265 665 200 HOH HOH D . 
D 3 HOH 266 666 258 HOH HOH D . 
D 3 HOH 267 667 99  HOH HOH D . 
D 3 HOH 268 668 281 HOH HOH D . 
D 3 HOH 269 669 123 HOH HOH D . 
D 3 HOH 270 670 195 HOH HOH D . 
D 3 HOH 271 671 226 HOH HOH D . 
D 3 HOH 272 672 119 HOH HOH D . 
D 3 HOH 273 673 75  HOH HOH D . 
D 3 HOH 274 674 127 HOH HOH D . 
D 3 HOH 275 675 219 HOH HOH D . 
D 3 HOH 276 676 270 HOH HOH D . 
D 3 HOH 277 677 50  HOH HOH D . 
D 3 HOH 278 678 233 HOH HOH D . 
D 3 HOH 279 679 253 HOH HOH D . 
D 3 HOH 280 680 93  HOH HOH D . 
D 3 HOH 281 681 249 HOH HOH D . 
# 
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 ? ? ? '(1.12_2829: ???)' 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .                  2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XSCALE ? ? ? .                  3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .                  4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   111.82 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8S8R 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     79.321 
_cell.length_a_esd                 ? 
_cell.length_b                     44.206 
_cell.length_b_esd                 ? 
_cell.length_c                     63.460 
_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                         8S8R 
_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                   8S8R 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             1.87 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          34.11 
_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' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    'ammonium phosphate' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            277 
# 
_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 PILATUS 200K' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2019-10-12 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1 
_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                        'SLS BEAMLINE X06DA' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   X06DA 
_diffrn_source.pdbx_synchrotron_site       SLS 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       8S8R 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.19 
_reflns.d_resolution_low                               36.81 
_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                                     62429 
_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                           96.59 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                6.5 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          37.69 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                ? 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.99 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.02606 
_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                                    1.196 
_reflns_shell.d_res_low                                     35.07 
_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                             62429 
_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                                  0.99 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               ? 
_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                                 8S8R 
_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                            1.196 
_refine.ls_d_res_low                             36 
_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                     62308 
_refine.ls_number_reflns_R_free                  2012 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    96.60 
_refine.ls_percent_reflns_R_free                 3.23 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1960 
_refine.ls_R_factor_R_free                       0.2084 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1956 
_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                          1.37 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ML 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.11 
_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                 21.45 
_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                            0.11 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.pdbx_number_atoms_protein        1943 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         10 
_refine_hist.number_atoms_solvent             281 
_refine_hist.number_atoms_total               2234 
_refine_hist.d_res_high                       1.196 
_refine_hist.d_res_low                        36 
# 
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' ? 0.005 ? 1988 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.784 ? 2680 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 2.588 ? 1646 ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.076 ? 314  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.005 ? 342  ? 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' 1.1960 1.2259 . . 134 3977 89.00  . . . . 0.2187 . . . . . . . . . . . 0.2036 
'X-RAY DIFFRACTION' 1.2259 1.2591 . . 131 4042 92.00  . . . . 0.2154 . . . . . . . . . . . 0.2403 
'X-RAY DIFFRACTION' 1.2591 1.2961 . . 140 4126 93.00  . . . . 0.2115 . . . . . . . . . . . 0.2322 
'X-RAY DIFFRACTION' 1.2961 1.3379 . . 140 4116 93.00  . . . . 0.213  . . . . . . . . . . . 0.2091 
'X-RAY DIFFRACTION' 1.3379 1.3858 . . 134 4238 95.00  . . . . 0.2158 . . . . . . . . . . . 0.2638 
'X-RAY DIFFRACTION' 1.3858 1.4413 . . 146 4246 96.00  . . . . 0.2104 . . . . . . . . . . . 0.2470 
'X-RAY DIFFRACTION' 1.4413 1.5069 . . 143 4370 98.00  . . . . 0.1992 . . . . . . . . . . . 0.2301 
'X-RAY DIFFRACTION' 1.5069 1.5863 . . 144 4399 99.00  . . . . 0.1896 . . . . . . . . . . . 0.2133 
'X-RAY DIFFRACTION' 1.5863 1.6857 . . 150 4395 99.00  . . . . 0.1902 . . . . . . . . . . . 0.2131 
'X-RAY DIFFRACTION' 1.6857 1.8158 . . 148 4437 99.00  . . . . 0.1941 . . . . . . . . . . . 0.2208 
'X-RAY DIFFRACTION' 1.8158 1.99   . . 146 4426 99.00  . . . . 0.1896 . . . . . . . . . . . 0.1975 
'X-RAY DIFFRACTION' 1.9986 2.2877 . . 150 4467 100.00 . . . . 0.1805 . . . . . . . . . . . 0.1839 
'X-RAY DIFFRACTION' 2.2877 2.8821 . . 155 4488 100.00 . . . . 0.2056 . . . . . . . . . . . 0.2006 
'X-RAY DIFFRACTION' 2.8821 36     . . 151 4569 100.00 . . . . 0.1911 . . . . . . . . . . . 0.2072 
# 
_struct.entry_id                     8S8R 
_struct.title                        'An induced-fit motion of a mobile loop' 
_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        8S8R 
_struct_keywords.text            'imidazole glycerol phosphate synthase, STRUCTURAL PROTEIN' 
_struct_keywords.pdbx_keywords   'STRUCTURAL PROTEIN' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 2 ? 
D N N 3 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    HIS6_THEMA 
_struct_ref.pdbx_db_accession          Q9X0C6 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;MLAKRIIACLDVKDGRVVKGTNFENLRDSGDPVELGKFYSEIGIDELVFLDITASVEKRKTMLELVEKVAEQIDIPFTVG
GGIHDFETASELILRGADKVSINTAAVENPSLITQIAQTFGSQAVVVAIDAKRVDGEFMVFTYSGKKNTGILLRDWVVEV
EKRGAGEILLTSIDRDGTKSGYDTEMIRFVRPLTTLPIIASGGAGKMEHFLEAFLAGADAALAASVFHFREIDVRELKEY
LKKHGVNVRLEGL
;
_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              8S8R 
_struct_ref_seq.pdbx_strand_id                D 
_struct_ref_seq.seq_align_beg                 1 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 253 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             Q9X0C6 
_struct_ref_seq.db_align_beg                  1 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  253 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       1 
_struct_ref_seq.pdbx_auth_seq_align_end       253 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 8S8R SER D 21 ? UNP Q9X0C6 THR 21 conflict 21 1 
1 8S8R ALA D 23 ? UNP Q9X0C6 PHE 23 conflict 23 2 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 500   ? 
1 MORE         -16   ? 
1 'SSA (A^2)'  11060 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 ASP A 31  ? GLY A 43  ? ASP D 31  GLY D 43  1 ? 13 
HELX_P HELX_P2  AA2 GLU A 57  ? GLU A 71  ? GLU D 57  GLU D 71  1 ? 15 
HELX_P HELX_P3  AA3 ASP A 85  ? ARG A 95  ? ASP D 85  ARG D 95  1 ? 11 
HELX_P HELX_P4  AA4 ASN A 103 ? ASN A 109 ? ASN D 103 ASN D 109 1 ? 7  
HELX_P HELX_P5  AA5 PRO A 110 ? GLY A 121 ? PRO D 110 GLY D 121 1 ? 12 
HELX_P HELX_P6  AA6 LEU A 153 ? ARG A 163 ? LEU D 153 ARG D 163 1 ? 11 
HELX_P HELX_P7  AA7 ASP A 183 ? ARG A 191 ? ASP D 183 ARG D 191 1 ? 9  
HELX_P HELX_P8  AA8 PRO A 192 ? THR A 194 ? PRO D 192 THR D 194 5 ? 3  
HELX_P HELX_P9  AA9 LYS A 206 ? ALA A 216 ? LYS D 206 ALA D 216 1 ? 11 
HELX_P HELX_P10 AB1 ALA A 224 ? PHE A 229 ? ALA D 224 PHE D 229 1 ? 6  
HELX_P HELX_P11 AB2 ASP A 233 ? HIS A 244 ? ASP D 233 HIS D 244 1 ? 12 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 8 ? 
AA2 ? 8 ? 
# 
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 ? parallel      
AA1 3 4 ? parallel      
AA1 4 5 ? parallel      
AA1 5 6 ? parallel      
AA1 6 7 ? anti-parallel 
AA1 7 8 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA2 2 3 ? parallel      
AA2 3 4 ? parallel      
AA2 4 5 ? parallel      
AA2 5 6 ? parallel      
AA2 6 7 ? anti-parallel 
AA2 7 8 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 ARG A 16  ? VAL A 17  ? ARG D 16  VAL D 17  
AA1 2 ARG A 5   ? LYS A 13  ? ARG D 5   LYS D 13  
AA1 3 GLU A 46  ? ASP A 51  ? GLU D 46  ASP D 51  
AA1 4 PHE A 77  ? GLY A 80  ? PHE D 77  GLY D 80  
AA1 5 LYS A 99  ? ILE A 102 ? LYS D 99  ILE D 102 
AA1 6 VAL A 125 ? VAL A 134 ? VAL D 125 VAL D 134 
AA1 7 GLU A 137 ? THR A 142 ? GLU D 137 THR D 142 
AA1 8 LYS A 147 ? LEU A 152 ? LYS D 147 LEU D 152 
AA2 1 ARG A 16  ? VAL A 17  ? ARG D 16  VAL D 17  
AA2 2 ARG A 5   ? LYS A 13  ? ARG D 5   LYS D 13  
AA2 3 ALA A 220 ? ALA A 223 ? ALA D 220 ALA D 223 
AA2 4 ILE A 198 ? SER A 201 ? ILE D 198 SER D 201 
AA2 5 GLU A 167 ? SER A 172 ? GLU D 167 SER D 172 
AA2 6 VAL A 125 ? VAL A 134 ? VAL D 125 VAL D 134 
AA2 7 GLU A 137 ? THR A 142 ? GLU D 137 THR D 142 
AA2 8 LYS A 147 ? LEU A 152 ? LYS D 147 LEU D 152 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 O ARG A 16  ? O ARG D 16  N LYS A 13  ? N LYS D 13  
AA1 2 3 N LEU A 10  ? N LEU D 10  O VAL A 48  ? O VAL D 48  
AA1 3 4 N PHE A 49  ? N PHE D 49  O THR A 78  ? O THR D 78  
AA1 4 5 N VAL A 79  ? N VAL D 79  O SER A 101 ? O SER D 101 
AA1 5 6 N VAL A 100 ? N VAL D 100 O VAL A 126 ? O VAL D 126 
AA1 6 7 N VAL A 134 ? N VAL D 134 O GLU A 137 ? O GLU D 137 
AA1 7 8 N VAL A 140 ? N VAL D 140 O ILE A 151 ? O ILE D 151 
AA2 1 2 O ARG A 16  ? O ARG D 16  N LYS A 13  ? N LYS D 13  
AA2 2 3 N ILE A 7   ? N ILE D 7   O ALA A 221 ? O ALA D 221 
AA2 3 4 O LEU A 222 ? O LEU D 222 N ALA A 200 ? N ALA D 200 
AA2 4 5 O ILE A 199 ? O ILE D 199 N ILE A 168 ? N ILE D 168 
AA2 5 6 O LEU A 169 ? O LEU D 169 N ILE A 129 ? N ILE D 129 
AA2 6 7 N VAL A 134 ? N VAL D 134 O GLU A 137 ? O GLU D 137 
AA2 7 8 N VAL A 140 ? N VAL D 140 O ILE A 151 ? O ILE D 151 
# 
_pdbx_entry_details.entry_id                   8S8R 
_pdbx_entry_details.has_ligand_of_interest     N 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   N 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1  1 O   D HOH 591 ? ? O D HOH 597 ? ? 1.82 
2  1 NH1 D ARG 188 ? ? O D HOH 401 ? ? 1.91 
3  1 O   D HOH 401 ? ? O D HOH 632 ? ? 1.94 
4  1 O   D HOH 553 ? ? O D HOH 621 ? ? 1.98 
5  1 NH1 D ARG 235 ? ? O D HOH 402 ? ? 2.01 
6  1 O   D HOH 612 ? ? O D HOH 637 ? ? 2.02 
7  1 O   D HOH 494 ? ? O D HOH 648 ? ? 2.04 
8  1 O   D HOH 535 ? ? O D HOH 641 ? ? 2.05 
9  1 OG  D SER 122 ? A O D HOH 403 ? ? 2.08 
10 1 ND1 D HIS 84  ? ? O D HOH 404 ? ? 2.10 
11 1 O   D HOH 415 ? ? O D HOH 623 ? ? 2.11 
# 
loop_
_pdbx_validate_symm_contact.id 
_pdbx_validate_symm_contact.PDB_model_num 
_pdbx_validate_symm_contact.auth_atom_id_1 
_pdbx_validate_symm_contact.auth_asym_id_1 
_pdbx_validate_symm_contact.auth_comp_id_1 
_pdbx_validate_symm_contact.auth_seq_id_1 
_pdbx_validate_symm_contact.PDB_ins_code_1 
_pdbx_validate_symm_contact.label_alt_id_1 
_pdbx_validate_symm_contact.site_symmetry_1 
_pdbx_validate_symm_contact.auth_atom_id_2 
_pdbx_validate_symm_contact.auth_asym_id_2 
_pdbx_validate_symm_contact.auth_comp_id_2 
_pdbx_validate_symm_contact.auth_seq_id_2 
_pdbx_validate_symm_contact.PDB_ins_code_2 
_pdbx_validate_symm_contact.label_alt_id_2 
_pdbx_validate_symm_contact.site_symmetry_2 
_pdbx_validate_symm_contact.dist 
1 1 O   D HOH 518 ? ? 1_555 O D HOH 571 ? ? 4_555 1.84 
2 1 O   D HOH 520 ? ? 1_555 O D HOH 607 ? ? 2_656 2.00 
3 1 OE1 D GLU 236 ? ? 1_555 O D HOH 402 ? ? 2_655 2.06 
4 1 O   D HOH 457 ? ? 1_555 O D HOH 457 ? ? 2_656 2.12 
# 
_pdbx_validate_rmsd_bond.id                        1 
_pdbx_validate_rmsd_bond.PDB_model_num             1 
_pdbx_validate_rmsd_bond.auth_atom_id_1            C 
_pdbx_validate_rmsd_bond.auth_asym_id_1            D 
_pdbx_validate_rmsd_bond.auth_comp_id_1            VAL 
_pdbx_validate_rmsd_bond.auth_seq_id_1             79 
_pdbx_validate_rmsd_bond.PDB_ins_code_1            ? 
_pdbx_validate_rmsd_bond.label_alt_id_1            ? 
_pdbx_validate_rmsd_bond.auth_atom_id_2            N 
_pdbx_validate_rmsd_bond.auth_asym_id_2            D 
_pdbx_validate_rmsd_bond.auth_comp_id_2            GLY 
_pdbx_validate_rmsd_bond.auth_seq_id_2             80 
_pdbx_validate_rmsd_bond.PDB_ins_code_2            ? 
_pdbx_validate_rmsd_bond.label_alt_id_2            ? 
_pdbx_validate_rmsd_bond.bond_value                1.112 
_pdbx_validate_rmsd_bond.bond_target_value         1.336 
_pdbx_validate_rmsd_bond.bond_deviation            -0.224 
_pdbx_validate_rmsd_bond.bond_standard_deviation   0.023 
_pdbx_validate_rmsd_bond.linker_flag               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 LYS D 19  ? ? -96.04  -144.33 
2 1 ASN D 22  ? ? 62.64   84.61   
3 1 SER D 55  ? ? -130.69 -98.12  
4 1 GLU D 57  ? ? 58.28   6.17    
5 1 ASN D 103 ? ? -140.74 -85.88  
6 1 ASN D 109 ? ? -154.10 79.44   
7 1 LYS D 179 ? ? 59.91   19.14   
8 1 ALA D 224 ? ? -107.68 -64.23  
# 
_pdbx_validate_polymer_linkage.id               1 
_pdbx_validate_polymer_linkage.PDB_model_num    1 
_pdbx_validate_polymer_linkage.auth_atom_id_1   C 
_pdbx_validate_polymer_linkage.auth_asym_id_1   D 
_pdbx_validate_polymer_linkage.auth_comp_id_1   VAL 
_pdbx_validate_polymer_linkage.auth_seq_id_1    79 
_pdbx_validate_polymer_linkage.PDB_ins_code_1   ? 
_pdbx_validate_polymer_linkage.label_alt_id_1   ? 
_pdbx_validate_polymer_linkage.auth_atom_id_2   N 
_pdbx_validate_polymer_linkage.auth_asym_id_2   D 
_pdbx_validate_polymer_linkage.auth_comp_id_2   GLY 
_pdbx_validate_polymer_linkage.auth_seq_id_2    80 
_pdbx_validate_polymer_linkage.PDB_ins_code_2   ? 
_pdbx_validate_polymer_linkage.label_alt_id_2   ? 
_pdbx_validate_polymer_linkage.dist             1.11 
# 
loop_
_pdbx_struct_special_symmetry.id 
_pdbx_struct_special_symmetry.PDB_model_num 
_pdbx_struct_special_symmetry.auth_asym_id 
_pdbx_struct_special_symmetry.auth_comp_id 
_pdbx_struct_special_symmetry.auth_seq_id 
_pdbx_struct_special_symmetry.PDB_ins_code 
_pdbx_struct_special_symmetry.label_asym_id 
_pdbx_struct_special_symmetry.label_comp_id 
_pdbx_struct_special_symmetry.label_seq_id 
1 1 D HOH 596 ? D HOH . 
2 1 D HOH 615 ? D HOH . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1 1 N 0 D PO4 301 ? B PO4 ? 
2 1 N 0 D PO4 302 ? C PO4 ? 
# 
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  
CYS N    N N N 74  
CYS CA   C N R 75  
CYS C    C N N 76  
CYS O    O N N 77  
CYS CB   C N N 78  
CYS SG   S N N 79  
CYS OXT  O N N 80  
CYS H    H N N 81  
CYS H2   H N N 82  
CYS HA   H N N 83  
CYS HB2  H N N 84  
CYS HB3  H N N 85  
CYS HG   H N N 86  
CYS HXT  H N N 87  
GLN N    N N N 88  
GLN CA   C N S 89  
GLN C    C N N 90  
GLN O    O N N 91  
GLN CB   C N N 92  
GLN CG   C N N 93  
GLN CD   C N N 94  
GLN OE1  O N N 95  
GLN NE2  N N N 96  
GLN OXT  O N N 97  
GLN H    H N N 98  
GLN H2   H N N 99  
GLN HA   H N N 100 
GLN HB2  H N N 101 
GLN HB3  H N N 102 
GLN HG2  H N N 103 
GLN HG3  H N N 104 
GLN HE21 H N N 105 
GLN HE22 H N N 106 
GLN HXT  H N N 107 
GLU N    N N N 108 
GLU CA   C N S 109 
GLU C    C N N 110 
GLU O    O N N 111 
GLU CB   C N N 112 
GLU CG   C N N 113 
GLU CD   C N N 114 
GLU OE1  O N N 115 
GLU OE2  O N N 116 
GLU OXT  O N N 117 
GLU H    H N N 118 
GLU H2   H N N 119 
GLU HA   H N N 120 
GLU HB2  H N N 121 
GLU HB3  H N N 122 
GLU HG2  H N N 123 
GLU HG3  H N N 124 
GLU HE2  H N N 125 
GLU HXT  H N N 126 
GLY N    N N N 127 
GLY CA   C N N 128 
GLY C    C N N 129 
GLY O    O N N 130 
GLY OXT  O N N 131 
GLY H    H N N 132 
GLY H2   H N N 133 
GLY HA2  H N N 134 
GLY HA3  H N N 135 
GLY HXT  H N N 136 
HIS N    N N N 137 
HIS CA   C N S 138 
HIS C    C N N 139 
HIS O    O N N 140 
HIS CB   C N N 141 
HIS CG   C Y N 142 
HIS ND1  N Y N 143 
HIS CD2  C Y N 144 
HIS CE1  C Y N 145 
HIS NE2  N Y N 146 
HIS OXT  O N N 147 
HIS H    H N N 148 
HIS H2   H N N 149 
HIS HA   H N N 150 
HIS HB2  H N N 151 
HIS HB3  H N N 152 
HIS HD1  H N N 153 
HIS HD2  H N N 154 
HIS HE1  H N N 155 
HIS HE2  H N N 156 
HIS HXT  H N N 157 
HOH O    O N N 158 
HOH H1   H N N 159 
HOH H2   H N N 160 
ILE N    N N N 161 
ILE CA   C N S 162 
ILE C    C N N 163 
ILE O    O N N 164 
ILE CB   C N S 165 
ILE CG1  C N N 166 
ILE CG2  C N N 167 
ILE CD1  C N N 168 
ILE OXT  O N N 169 
ILE H    H N N 170 
ILE H2   H N N 171 
ILE HA   H N N 172 
ILE HB   H N N 173 
ILE HG12 H N N 174 
ILE HG13 H N N 175 
ILE HG21 H N N 176 
ILE HG22 H N N 177 
ILE HG23 H N N 178 
ILE HD11 H N N 179 
ILE HD12 H N N 180 
ILE HD13 H N N 181 
ILE HXT  H N N 182 
LEU N    N N N 183 
LEU CA   C N S 184 
LEU C    C N N 185 
LEU O    O N N 186 
LEU CB   C N N 187 
LEU CG   C N N 188 
LEU CD1  C N N 189 
LEU CD2  C N N 190 
LEU OXT  O N N 191 
LEU H    H N N 192 
LEU H2   H N N 193 
LEU HA   H N N 194 
LEU HB2  H N N 195 
LEU HB3  H N N 196 
LEU HG   H N N 197 
LEU HD11 H N N 198 
LEU HD12 H N N 199 
LEU HD13 H N N 200 
LEU HD21 H N N 201 
LEU HD22 H N N 202 
LEU HD23 H N N 203 
LEU HXT  H N N 204 
LYS N    N N N 205 
LYS CA   C N S 206 
LYS C    C N N 207 
LYS O    O N N 208 
LYS CB   C N N 209 
LYS CG   C N N 210 
LYS CD   C N N 211 
LYS CE   C N N 212 
LYS NZ   N N N 213 
LYS OXT  O N N 214 
LYS H    H N N 215 
LYS H2   H N N 216 
LYS HA   H N N 217 
LYS HB2  H N N 218 
LYS HB3  H N N 219 
LYS HG2  H N N 220 
LYS HG3  H N N 221 
LYS HD2  H N N 222 
LYS HD3  H N N 223 
LYS HE2  H N N 224 
LYS HE3  H N N 225 
LYS HZ1  H N N 226 
LYS HZ2  H N N 227 
LYS HZ3  H N N 228 
LYS HXT  H N N 229 
MET N    N N N 230 
MET CA   C N S 231 
MET C    C N N 232 
MET O    O N N 233 
MET CB   C N N 234 
MET CG   C N N 235 
MET SD   S N N 236 
MET CE   C N N 237 
MET OXT  O N N 238 
MET H    H N N 239 
MET H2   H N N 240 
MET HA   H N N 241 
MET HB2  H N N 242 
MET HB3  H N N 243 
MET HG2  H N N 244 
MET HG3  H N N 245 
MET HE1  H N N 246 
MET HE2  H N N 247 
MET HE3  H N N 248 
MET HXT  H N N 249 
PHE N    N N N 250 
PHE CA   C N S 251 
PHE C    C N N 252 
PHE O    O N N 253 
PHE CB   C N N 254 
PHE CG   C Y N 255 
PHE CD1  C Y N 256 
PHE CD2  C Y N 257 
PHE CE1  C Y N 258 
PHE CE2  C Y N 259 
PHE CZ   C Y N 260 
PHE OXT  O N N 261 
PHE H    H N N 262 
PHE H2   H N N 263 
PHE HA   H N N 264 
PHE HB2  H N N 265 
PHE HB3  H N N 266 
PHE HD1  H N N 267 
PHE HD2  H N N 268 
PHE HE1  H N N 269 
PHE HE2  H N N 270 
PHE HZ   H N N 271 
PHE HXT  H N N 272 
PO4 P    P N N 273 
PO4 O1   O N N 274 
PO4 O2   O N N 275 
PO4 O3   O N N 276 
PO4 O4   O N N 277 
PRO N    N N N 278 
PRO CA   C N S 279 
PRO C    C N N 280 
PRO O    O N N 281 
PRO CB   C N N 282 
PRO CG   C N N 283 
PRO CD   C N N 284 
PRO OXT  O N N 285 
PRO H    H N N 286 
PRO HA   H N N 287 
PRO HB2  H N N 288 
PRO HB3  H N N 289 
PRO HG2  H N N 290 
PRO HG3  H N N 291 
PRO HD2  H N N 292 
PRO HD3  H N N 293 
PRO HXT  H N N 294 
SER N    N N N 295 
SER CA   C N S 296 
SER C    C N N 297 
SER O    O N N 298 
SER CB   C N N 299 
SER OG   O N N 300 
SER OXT  O N N 301 
SER H    H N N 302 
SER H2   H N N 303 
SER HA   H N N 304 
SER HB2  H N N 305 
SER HB3  H N N 306 
SER HG   H N N 307 
SER HXT  H N N 308 
THR N    N N N 309 
THR CA   C N S 310 
THR C    C N N 311 
THR O    O N N 312 
THR CB   C N R 313 
THR OG1  O N N 314 
THR CG2  C N N 315 
THR OXT  O N N 316 
THR H    H N N 317 
THR H2   H N N 318 
THR HA   H N N 319 
THR HB   H N N 320 
THR HG1  H N N 321 
THR HG21 H N N 322 
THR HG22 H N N 323 
THR HG23 H N N 324 
THR HXT  H N N 325 
TRP N    N N N 326 
TRP CA   C N S 327 
TRP C    C N N 328 
TRP O    O N N 329 
TRP CB   C N N 330 
TRP CG   C Y N 331 
TRP CD1  C Y N 332 
TRP CD2  C Y N 333 
TRP NE1  N Y N 334 
TRP CE2  C Y N 335 
TRP CE3  C Y N 336 
TRP CZ2  C Y N 337 
TRP CZ3  C Y N 338 
TRP CH2  C Y N 339 
TRP OXT  O N N 340 
TRP H    H N N 341 
TRP H2   H N N 342 
TRP HA   H N N 343 
TRP HB2  H N N 344 
TRP HB3  H N N 345 
TRP HD1  H N N 346 
TRP HE1  H N N 347 
TRP HE3  H N N 348 
TRP HZ2  H N N 349 
TRP HZ3  H N N 350 
TRP HH2  H N N 351 
TRP HXT  H N N 352 
TYR N    N N N 353 
TYR CA   C N S 354 
TYR C    C N N 355 
TYR O    O N N 356 
TYR CB   C N N 357 
TYR CG   C Y N 358 
TYR CD1  C Y N 359 
TYR CD2  C Y N 360 
TYR CE1  C Y N 361 
TYR CE2  C Y N 362 
TYR CZ   C Y N 363 
TYR OH   O N N 364 
TYR OXT  O N N 365 
TYR H    H N N 366 
TYR H2   H N N 367 
TYR HA   H N N 368 
TYR HB2  H N N 369 
TYR HB3  H N N 370 
TYR HD1  H N N 371 
TYR HD2  H N N 372 
TYR HE1  H N N 373 
TYR HE2  H N N 374 
TYR HH   H N N 375 
TYR HXT  H N N 376 
VAL N    N N N 377 
VAL CA   C N S 378 
VAL C    C N N 379 
VAL O    O N N 380 
VAL CB   C N N 381 
VAL CG1  C N N 382 
VAL CG2  C N N 383 
VAL OXT  O N N 384 
VAL H    H N N 385 
VAL H2   H N N 386 
VAL HA   H N N 387 
VAL HB   H N N 388 
VAL HG11 H N N 389 
VAL HG12 H N N 390 
VAL HG13 H N N 391 
VAL HG21 H N N 392 
VAL HG22 H N N 393 
VAL HG23 H N N 394 
VAL HXT  H N N 395 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
HIS N   CA   sing N N 129 
HIS N   H    sing N N 130 
HIS N   H2   sing N N 131 
HIS CA  C    sing N N 132 
HIS CA  CB   sing N N 133 
HIS CA  HA   sing N N 134 
HIS C   O    doub N N 135 
HIS C   OXT  sing N N 136 
HIS CB  CG   sing N N 137 
HIS CB  HB2  sing N N 138 
HIS CB  HB3  sing N N 139 
HIS CG  ND1  sing Y N 140 
HIS CG  CD2  doub Y N 141 
HIS ND1 CE1  doub Y N 142 
HIS ND1 HD1  sing N N 143 
HIS CD2 NE2  sing Y N 144 
HIS CD2 HD2  sing N N 145 
HIS CE1 NE2  sing Y N 146 
HIS CE1 HE1  sing N N 147 
HIS NE2 HE2  sing N N 148 
HIS OXT HXT  sing N N 149 
HOH O   H1   sing N N 150 
HOH O   H2   sing N N 151 
ILE N   CA   sing N N 152 
ILE N   H    sing N N 153 
ILE N   H2   sing N N 154 
ILE CA  C    sing N N 155 
ILE CA  CB   sing N N 156 
ILE CA  HA   sing N N 157 
ILE C   O    doub N N 158 
ILE C   OXT  sing N N 159 
ILE CB  CG1  sing N N 160 
ILE CB  CG2  sing N N 161 
ILE CB  HB   sing N N 162 
ILE CG1 CD1  sing N N 163 
ILE CG1 HG12 sing N N 164 
ILE CG1 HG13 sing N N 165 
ILE CG2 HG21 sing N N 166 
ILE CG2 HG22 sing N N 167 
ILE CG2 HG23 sing N N 168 
ILE CD1 HD11 sing N N 169 
ILE CD1 HD12 sing N N 170 
ILE CD1 HD13 sing N N 171 
ILE OXT HXT  sing N N 172 
LEU N   CA   sing N N 173 
LEU N   H    sing N N 174 
LEU N   H2   sing N N 175 
LEU CA  C    sing N N 176 
LEU CA  CB   sing N N 177 
LEU CA  HA   sing N N 178 
LEU C   O    doub N N 179 
LEU C   OXT  sing N N 180 
LEU CB  CG   sing N N 181 
LEU CB  HB2  sing N N 182 
LEU CB  HB3  sing N N 183 
LEU CG  CD1  sing N N 184 
LEU CG  CD2  sing N N 185 
LEU CG  HG   sing N N 186 
LEU CD1 HD11 sing N N 187 
LEU CD1 HD12 sing N N 188 
LEU CD1 HD13 sing N N 189 
LEU CD2 HD21 sing N N 190 
LEU CD2 HD22 sing N N 191 
LEU CD2 HD23 sing N N 192 
LEU OXT HXT  sing N N 193 
LYS N   CA   sing N N 194 
LYS N   H    sing N N 195 
LYS N   H2   sing N N 196 
LYS CA  C    sing N N 197 
LYS CA  CB   sing N N 198 
LYS CA  HA   sing N N 199 
LYS C   O    doub N N 200 
LYS C   OXT  sing N N 201 
LYS CB  CG   sing N N 202 
LYS CB  HB2  sing N N 203 
LYS CB  HB3  sing N N 204 
LYS CG  CD   sing N N 205 
LYS CG  HG2  sing N N 206 
LYS CG  HG3  sing N N 207 
LYS CD  CE   sing N N 208 
LYS CD  HD2  sing N N 209 
LYS CD  HD3  sing N N 210 
LYS CE  NZ   sing N N 211 
LYS CE  HE2  sing N N 212 
LYS CE  HE3  sing N N 213 
LYS NZ  HZ1  sing N N 214 
LYS NZ  HZ2  sing N N 215 
LYS NZ  HZ3  sing N N 216 
LYS OXT HXT  sing N N 217 
MET N   CA   sing N N 218 
MET N   H    sing N N 219 
MET N   H2   sing N N 220 
MET CA  C    sing N N 221 
MET CA  CB   sing N N 222 
MET CA  HA   sing N N 223 
MET C   O    doub N N 224 
MET C   OXT  sing N N 225 
MET CB  CG   sing N N 226 
MET CB  HB2  sing N N 227 
MET CB  HB3  sing N N 228 
MET CG  SD   sing N N 229 
MET CG  HG2  sing N N 230 
MET CG  HG3  sing N N 231 
MET SD  CE   sing N N 232 
MET CE  HE1  sing N N 233 
MET CE  HE2  sing N N 234 
MET CE  HE3  sing N N 235 
MET OXT HXT  sing N N 236 
PHE N   CA   sing N N 237 
PHE N   H    sing N N 238 
PHE N   H2   sing N N 239 
PHE CA  C    sing N N 240 
PHE CA  CB   sing N N 241 
PHE CA  HA   sing N N 242 
PHE C   O    doub N N 243 
PHE C   OXT  sing N N 244 
PHE CB  CG   sing N N 245 
PHE CB  HB2  sing N N 246 
PHE CB  HB3  sing N N 247 
PHE CG  CD1  doub Y N 248 
PHE CG  CD2  sing Y N 249 
PHE CD1 CE1  sing Y N 250 
PHE CD1 HD1  sing N N 251 
PHE CD2 CE2  doub Y N 252 
PHE CD2 HD2  sing N N 253 
PHE CE1 CZ   doub Y N 254 
PHE CE1 HE1  sing N N 255 
PHE CE2 CZ   sing Y N 256 
PHE CE2 HE2  sing N N 257 
PHE CZ  HZ   sing N N 258 
PHE OXT HXT  sing N N 259 
PO4 P   O1   doub N N 260 
PO4 P   O2   sing N N 261 
PO4 P   O3   sing N N 262 
PO4 P   O4   sing N N 263 
PRO N   CA   sing N N 264 
PRO N   CD   sing N N 265 
PRO N   H    sing N N 266 
PRO CA  C    sing N N 267 
PRO CA  CB   sing N N 268 
PRO CA  HA   sing N N 269 
PRO C   O    doub N N 270 
PRO C   OXT  sing N N 271 
PRO CB  CG   sing N N 272 
PRO CB  HB2  sing N N 273 
PRO CB  HB3  sing N N 274 
PRO CG  CD   sing N N 275 
PRO CG  HG2  sing N N 276 
PRO CG  HG3  sing N N 277 
PRO CD  HD2  sing N N 278 
PRO CD  HD3  sing N N 279 
PRO OXT HXT  sing N N 280 
SER N   CA   sing N N 281 
SER N   H    sing N N 282 
SER N   H2   sing N N 283 
SER CA  C    sing N N 284 
SER CA  CB   sing N N 285 
SER CA  HA   sing N N 286 
SER C   O    doub N N 287 
SER C   OXT  sing N N 288 
SER CB  OG   sing N N 289 
SER CB  HB2  sing N N 290 
SER CB  HB3  sing N N 291 
SER OG  HG   sing N N 292 
SER OXT HXT  sing N N 293 
THR N   CA   sing N N 294 
THR N   H    sing N N 295 
THR N   H2   sing N N 296 
THR CA  C    sing N N 297 
THR CA  CB   sing N N 298 
THR CA  HA   sing N N 299 
THR C   O    doub N N 300 
THR C   OXT  sing N N 301 
THR CB  OG1  sing N N 302 
THR CB  CG2  sing N N 303 
THR CB  HB   sing N N 304 
THR OG1 HG1  sing N N 305 
THR CG2 HG21 sing N N 306 
THR CG2 HG22 sing N N 307 
THR CG2 HG23 sing N N 308 
THR OXT HXT  sing N N 309 
TRP N   CA   sing N N 310 
TRP N   H    sing N N 311 
TRP N   H2   sing N N 312 
TRP CA  C    sing N N 313 
TRP CA  CB   sing N N 314 
TRP CA  HA   sing N N 315 
TRP C   O    doub N N 316 
TRP C   OXT  sing N N 317 
TRP CB  CG   sing N N 318 
TRP CB  HB2  sing N N 319 
TRP CB  HB3  sing N N 320 
TRP CG  CD1  doub Y N 321 
TRP CG  CD2  sing Y N 322 
TRP CD1 NE1  sing Y N 323 
TRP CD1 HD1  sing N N 324 
TRP CD2 CE2  doub Y N 325 
TRP CD2 CE3  sing Y N 326 
TRP NE1 CE2  sing Y N 327 
TRP NE1 HE1  sing N N 328 
TRP CE2 CZ2  sing Y N 329 
TRP CE3 CZ3  doub Y N 330 
TRP CE3 HE3  sing N N 331 
TRP CZ2 CH2  doub Y N 332 
TRP CZ2 HZ2  sing N N 333 
TRP CZ3 CH2  sing Y N 334 
TRP CZ3 HZ3  sing N N 335 
TRP CH2 HH2  sing N N 336 
TRP OXT HXT  sing N N 337 
TYR N   CA   sing N N 338 
TYR N   H    sing N N 339 
TYR N   H2   sing N N 340 
TYR CA  C    sing N N 341 
TYR CA  CB   sing N N 342 
TYR CA  HA   sing N N 343 
TYR C   O    doub N N 344 
TYR C   OXT  sing N N 345 
TYR CB  CG   sing N N 346 
TYR CB  HB2  sing N N 347 
TYR CB  HB3  sing N N 348 
TYR CG  CD1  doub Y N 349 
TYR CG  CD2  sing Y N 350 
TYR CD1 CE1  sing Y N 351 
TYR CD1 HD1  sing N N 352 
TYR CD2 CE2  doub Y N 353 
TYR CD2 HD2  sing N N 354 
TYR CE1 CZ   doub Y N 355 
TYR CE1 HE1  sing N N 356 
TYR CE2 CZ   sing Y N 357 
TYR CE2 HE2  sing N N 358 
TYR CZ  OH   sing N N 359 
TYR OH  HH   sing N N 360 
TYR OXT HXT  sing N N 361 
VAL N   CA   sing N N 362 
VAL N   H    sing N N 363 
VAL N   H2   sing N N 364 
VAL CA  C    sing N N 365 
VAL CA  CB   sing N N 366 
VAL CA  HA   sing N N 367 
VAL C   O    doub N N 368 
VAL C   OXT  sing N N 369 
VAL CB  CG1  sing N N 370 
VAL CB  CG2  sing N N 371 
VAL CB  HB   sing N N 372 
VAL CG1 HG11 sing N N 373 
VAL CG1 HG12 sing N N 374 
VAL CG1 HG13 sing N N 375 
VAL CG2 HG21 sing N N 376 
VAL CG2 HG22 sing N N 377 
VAL CG2 HG23 sing N N 378 
VAL OXT HXT  sing N N 379 
# 
_pdbx_audit_support.funding_organization   'German Research Foundation (DFG)' 
_pdbx_audit_support.country                Germany 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      Other 
_pdbx_initial_refinement_model.accession_code   ? 
_pdbx_initial_refinement_model.details          'wild type' 
# 
_atom_sites.entry_id                    8S8R 
_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]   0.012607 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.005048 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.022621 
_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]   0.016974 
_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 
P 
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   . MET A 1 1   ? 14.253 20.470 -2.318 1.00 14.82 ? 1   MET D N   1 
ATOM   2    C CA  . MET A 1 1   ? 14.328 20.325 -0.871 1.00 16.48 ? 1   MET D CA  1 
ATOM   3    C C   . MET A 1 1   ? 15.055 21.516 -0.261 1.00 14.93 ? 1   MET D C   1 
ATOM   4    O O   . MET A 1 1   ? 15.749 22.253 -0.950 1.00 15.80 ? 1   MET D O   1 
ATOM   5    C CB  . MET A 1 1   ? 15.026 19.025 -0.476 1.00 18.63 ? 1   MET D CB  1 
ATOM   6    C CG  . MET A 1 1   ? 16.491 18.977 -0.828 1.00 20.26 ? 1   MET D CG  1 
ATOM   7    S SD  . MET A 1 1   ? 17.253 17.440 -0.281 1.00 25.46 ? 1   MET D SD  1 
ATOM   8    C CE  . MET A 1 1   ? 16.234 16.276 -1.164 1.00 9.81  ? 1   MET D CE  1 
ATOM   9    N N   . LEU A 1 2   ? 14.891 21.703 1.046  1.00 15.78 ? 2   LEU D N   1 
ATOM   10   C CA  . LEU A 1 2   ? 15.444 22.883 1.696  1.00 16.27 ? 2   LEU D CA  1 
ATOM   11   C C   . LEU A 1 2   ? 16.964 22.831 1.688  1.00 13.74 ? 2   LEU D C   1 
ATOM   12   O O   . LEU A 1 2   ? 17.570 21.760 1.800  1.00 16.22 ? 2   LEU D O   1 
ATOM   13   C CB  . LEU A 1 2   ? 14.945 22.998 3.135  1.00 20.21 ? 2   LEU D CB  1 
ATOM   14   C CG  . LEU A 1 2   ? 15.357 24.291 3.852  1.00 21.67 ? 2   LEU D CG  1 
ATOM   15   C CD1 . LEU A 1 2   ? 14.890 25.528 3.088  1.00 26.20 ? 2   LEU D CD1 1 
ATOM   16   C CD2 . LEU A 1 2   ? 14.849 24.313 5.289  1.00 24.40 ? 2   LEU D CD2 1 
ATOM   17   N N   . ALA A 1 3   ? 17.573 23.995 1.518  1.00 18.16 ? 3   ALA D N   1 
ATOM   18   C CA  . ALA A 1 3   ? 19.015 24.096 1.624  1.00 18.67 ? 3   ALA D CA  1 
ATOM   19   C C   . ALA A 1 3   ? 19.463 23.726 3.031  1.00 15.07 ? 3   ALA D C   1 
ATOM   20   O O   . ALA A 1 3   ? 18.738 23.904 4.020  1.00 16.51 ? 3   ALA D O   1 
ATOM   21   C CB  . ALA A 1 3   ? 19.464 25.521 1.298  1.00 22.63 ? 3   ALA D CB  1 
ATOM   22   N N   . LYS A 1 4   ? 20.668 23.190 3.114  1.00 13.84 ? 4   LYS D N   1 
ATOM   23   C CA  . LYS A 1 4   ? 21.328 22.943 4.385  1.00 11.55 ? 4   LYS D CA  1 
ATOM   24   C C   . LYS A 1 4   ? 22.596 23.780 4.385  1.00 12.20 ? 4   LYS D C   1 
ATOM   25   O O   . LYS A 1 4   ? 23.411 23.676 3.461  1.00 16.72 ? 4   LYS D O   1 
ATOM   26   C CB  . LYS A 1 4   ? 21.632 21.457 4.526  1.00 13.37 ? 4   LYS D CB  1 
ATOM   27   C CG  . LYS A 1 4   ? 20.375 20.596 4.478  1.00 12.70 ? 4   LYS D CG  1 
ATOM   28   C CD  . LYS A 1 4   ? 19.446 20.917 5.636  1.00 12.10 ? 4   LYS D CD  1 
ATOM   29   C CE  . LYS A 1 4   ? 18.154 20.120 5.534  1.00 15.72 ? 4   LYS D CE  1 
ATOM   30   N NZ  . LYS A 1 4   ? 17.373 20.174 6.794  1.00 19.11 ? 4   LYS D NZ  1 
ATOM   31   N N   . ARG A 1 5   ? 22.744 24.637 5.386  1.00 9.71  ? 5   ARG D N   1 
ATOM   32   C CA  . ARG A 1 5   ? 23.742 25.697 5.375  1.00 9.93  ? 5   ARG D CA  1 
ATOM   33   C C   . ARG A 1 5   ? 24.834 25.444 6.403  1.00 8.50  ? 5   ARG D C   1 
ATOM   34   O O   . ARG A 1 5   ? 24.578 24.898 7.478  1.00 9.06  ? 5   ARG D O   1 
ATOM   35   C CB  . ARG A 1 5   ? 23.089 27.038 5.685  1.00 9.49  ? 5   ARG D CB  1 
ATOM   36   C CG  . ARG A 1 5   ? 22.126 27.500 4.595  1.00 11.93 ? 5   ARG D CG  1 
ATOM   37   C CD  . ARG A 1 5   ? 21.252 28.636 5.095  1.00 13.50 ? 5   ARG D CD  1 
ATOM   38   N NE  . ARG A 1 5   ? 20.199 28.104 5.954  1.00 13.42 ? 5   ARG D NE  1 
ATOM   39   C CZ  . ARG A 1 5   ? 19.752 28.675 7.070  1.00 12.70 ? 5   ARG D CZ  1 
ATOM   40   N NH1 . ARG A 1 5   ? 20.244 29.832 7.499  1.00 13.71 ? 5   ARG D NH1 1 
ATOM   41   N NH2 . ARG A 1 5   ? 18.793 28.080 7.762  1.00 12.86 ? 5   ARG D NH2 1 
ATOM   42   N N   . ILE A 1 6   ? 26.053 25.850 6.053  1.00 8.81  ? 6   ILE D N   1 
ATOM   43   C CA  . ILE A 1 6   ? 27.201 25.870 6.953  1.00 9.47  ? 6   ILE D CA  1 
ATOM   44   C C   . ILE A 1 6   ? 27.455 27.325 7.306  1.00 8.66  ? 6   ILE D C   1 
ATOM   45   O O   . ILE A 1 6   ? 27.652 28.156 6.411  1.00 9.49  ? 6   ILE D O   1 
ATOM   46   C CB  . ILE A 1 6   ? 28.449 25.271 6.288  1.00 10.36 ? 6   ILE D CB  1 
ATOM   47   C CG1 . ILE A 1 6   ? 28.151 23.877 5.722  1.00 10.87 ? 6   ILE D CG1 1 
ATOM   48   C CG2 . ILE A 1 6   ? 29.625 25.293 7.258  1.00 11.85 ? 6   ILE D CG2 1 
ATOM   49   C CD1 . ILE A 1 6   ? 27.649 22.882 6.747  1.00 12.88 ? 6   ILE D CD1 1 
ATOM   50   N N   . ILE A 1 7   ? 27.460 27.640 8.601  1.00 8.83  ? 7   ILE D N   1 
ATOM   51   C CA  . ILE A 1 7   ? 27.552 29.018 9.072  1.00 9.34  ? 7   ILE D CA  1 
ATOM   52   C C   . ILE A 1 7   ? 28.716 29.122 10.043 1.00 8.72  ? 7   ILE D C   1 
ATOM   53   O O   . ILE A 1 7   ? 28.881 28.264 10.916 1.00 9.26  ? 7   ILE D O   1 
ATOM   54   C CB  . ILE A 1 7   ? 26.239 29.451 9.749  1.00 8.92  ? 7   ILE D CB  1 
ATOM   55   C CG1 . ILE A 1 7   ? 25.057 29.176 8.816  1.00 8.67  ? 7   ILE D CG1 1 
ATOM   56   C CG2 . ILE A 1 7   ? 26.274 30.912 10.158 1.00 9.72  ? 7   ILE D CG2 1 
ATOM   57   C CD1 . ILE A 1 7   ? 23.723 29.598 9.372  1.00 10.99 ? 7   ILE D CD1 1 
ATOM   58   N N   . ALA A 1 8   ? 29.543 30.146 9.873  1.00 9.37  ? 8   ALA D N   1 
ATOM   59   C CA  . ALA A 1 8   ? 30.664 30.399 10.768 1.00 9.71  ? 8   ALA D CA  1 
ATOM   60   C C   . ALA A 1 8   ? 30.277 31.460 11.783 1.00 9.44  ? 8   ALA D C   1 
ATOM   61   O O   . ALA A 1 8   ? 29.723 32.501 11.413 1.00 10.25 ? 8   ALA D O   1 
ATOM   62   C CB  . ALA A 1 8   ? 31.890 30.864 9.981  1.00 11.45 ? 8   ALA D CB  1 
ATOM   63   N N   . CYS A 1 9   ? 30.591 31.207 13.052 1.00 9.48  ? 9   CYS D N   1 
ATOM   64   C CA  . CYS A 1 9   ? 30.357 32.166 14.118 1.00 10.72 ? 9   CYS D CA  1 
ATOM   65   C C   . CYS A 1 9   ? 31.676 32.857 14.437 1.00 10.74 ? 9   CYS D C   1 
ATOM   66   O O   . CYS A 1 9   ? 32.654 32.195 14.813 1.00 12.71 ? 9   CYS D O   1 
ATOM   67   C CB  . CYS A 1 9   ? 29.795 31.469 15.352 1.00 11.16 ? 9   CYS D CB  1 
ATOM   68   S SG  . CYS A 1 9   ? 29.277 32.645 16.603 1.00 12.79 ? 9   CYS D SG  1 
ATOM   69   N N   . LEU A 1 10  ? 31.699 34.178 14.259 1.00 11.34 ? 10  LEU D N   1 
ATOM   70   C CA  . LEU A 1 10  ? 32.864 35.014 14.507 1.00 11.97 ? 10  LEU D CA  1 
ATOM   71   C C   . LEU A 1 10  ? 32.595 35.785 15.784 1.00 11.81 ? 10  LEU D C   1 
ATOM   72   O O   . LEU A 1 10  ? 31.688 36.621 15.839 1.00 12.26 ? 10  LEU D O   1 
ATOM   73   C CB  . LEU A 1 10  ? 33.105 35.964 13.339 1.00 13.40 ? 10  LEU D CB  1 
ATOM   74   C CG  . LEU A 1 10  ? 33.323 35.300 11.985 1.00 15.57 ? 10  LEU D CG  1 
ATOM   75   C CD1 . LEU A 1 10  ? 33.699 36.338 10.938 1.00 19.82 ? 10  LEU D CD1 1 
ATOM   76   C CD2 . LEU A 1 10  ? 34.369 34.217 12.090 1.00 22.42 ? 10  LEU D CD2 1 
ATOM   77   N N   . ASP A 1 11  ? 33.356 35.478 16.818 1.00 12.53 ? 11  ASP D N   1 
ATOM   78   C CA  . ASP A 1 11  ? 33.179 36.152 18.085 1.00 12.98 ? 11  ASP D CA  1 
ATOM   79   C C   . ASP A 1 11  ? 33.895 37.488 18.025 1.00 13.10 ? 11  ASP D C   1 
ATOM   80   O O   . ASP A 1 11  ? 35.040 37.565 17.568 1.00 15.42 ? 11  ASP D O   1 
ATOM   81   C CB  . ASP A 1 11  ? 33.715 35.281 19.216 1.00 15.56 ? 11  ASP D CB  1 
ATOM   82   C CG  . ASP A 1 11  ? 32.888 34.024 19.419 1.00 16.90 ? 11  ASP D CG  1 
ATOM   83   O OD1 . ASP A 1 11  ? 31.810 33.897 18.798 1.00 18.56 ? 11  ASP D OD1 1 
ATOM   84   O OD2 . ASP A 1 11  ? 33.320 33.157 20.206 1.00 23.20 ? 11  ASP D OD2 1 
ATOM   85   N N   . VAL A 1 12  ? 33.220 38.532 18.489 1.00 13.17 ? 12  VAL D N   1 
ATOM   86   C CA  . VAL A 1 12  ? 33.668 39.904 18.307 1.00 15.42 ? 12  VAL D CA  1 
ATOM   87   C C   . VAL A 1 12  ? 33.866 40.556 19.665 1.00 14.28 ? 12  VAL D C   1 
ATOM   88   O O   . VAL A 1 12  ? 33.060 40.375 20.583 1.00 17.45 ? 12  VAL D O   1 
ATOM   89   C CB  . VAL A 1 12  ? 32.659 40.707 17.460 1.00 14.72 ? 12  VAL D CB  1 
ATOM   90   C CG1 . VAL A 1 12  ? 32.935 42.210 17.542 1.00 18.62 ? 12  VAL D CG1 1 
ATOM   91   C CG2 . VAL A 1 12  ? 32.684 40.220 16.024 1.00 16.42 ? 12  VAL D CG2 1 
ATOM   92   N N   . LYS A 1 13  ? 34.940 41.331 19.772 1.00 15.18 ? 13  LYS D N   1 
ATOM   93   C CA  . LYS A 1 13  ? 35.201 42.187 20.916 1.00 15.85 ? 13  LYS D CA  1 
ATOM   94   C C   . LYS A 1 13  ? 35.723 43.505 20.377 1.00 17.38 ? 13  LYS D C   1 
ATOM   95   O O   . LYS A 1 13  ? 36.690 43.521 19.611 1.00 16.52 ? 13  LYS D O   1 
ATOM   96   C CB  . LYS A 1 13  ? 36.246 41.561 21.838 1.00 17.34 ? 13  LYS D CB  1 
ATOM   97   C CG  . LYS A 1 13  ? 36.689 42.496 22.950 1.00 20.28 ? 13  LYS D CG  1 
ATOM   98   C CD  . LYS A 1 13  ? 37.660 41.817 23.904 1.00 20.78 ? 13  LYS D CD  1 
ATOM   99   C CE  . LYS A 1 13  ? 38.238 42.811 24.900 1.00 25.41 ? 13  LYS D CE  1 
ATOM   100  N NZ  . LYS A 1 13  ? 39.321 43.647 24.305 1.00 28.09 ? 13  LYS D NZ  1 
ATOM   101  N N   . ASP A 1 14  ? 35.075 44.600 20.773 1.00 18.22 ? 14  ASP D N   1 
ATOM   102  C CA  . ASP A 1 14  ? 35.450 45.945 20.331 1.00 19.67 ? 14  ASP D CA  1 
ATOM   103  C C   . ASP A 1 14  ? 35.507 46.044 18.807 1.00 20.15 ? 14  ASP D C   1 
ATOM   104  O O   . ASP A 1 14  ? 36.416 46.650 18.236 1.00 23.33 ? 14  ASP D O   1 
ATOM   105  C CB  . ASP A 1 14  ? 36.756 46.421 20.975 1.00 21.35 ? 14  ASP D CB  1 
ATOM   106  C CG  . ASP A 1 14  ? 36.758 46.270 22.481 1.00 23.40 ? 14  ASP D CG  1 
ATOM   107  O OD1 . ASP A 1 14  ? 35.701 46.488 23.105 1.00 25.11 ? 14  ASP D OD1 1 
ATOM   108  O OD2 . ASP A 1 14  ? 37.828 45.950 23.044 1.00 28.49 ? 14  ASP D OD2 1 
ATOM   109  N N   . GLY A 1 15  ? 34.536 45.424 18.139 1.00 17.73 ? 15  GLY D N   1 
ATOM   110  C CA  . GLY A 1 15  ? 34.438 45.531 16.699 1.00 20.98 ? 15  GLY D CA  1 
ATOM   111  C C   . GLY A 1 15  ? 35.445 44.722 15.922 1.00 21.34 ? 15  GLY D C   1 
ATOM   112  O O   . GLY A 1 15  ? 35.519 44.869 14.698 1.00 22.56 ? 15  GLY D O   1 
ATOM   113  N N   . ARG A 1 16  ? 36.220 43.868 16.585 1.00 18.72 ? 16  ARG D N   1 
ATOM   114  C CA  . ARG A 1 16  ? 37.196 43.030 15.907 1.00 20.00 ? 16  ARG D CA  1 
ATOM   115  C C   . ARG A 1 16  ? 36.987 41.574 16.297 1.00 19.46 ? 16  ARG D C   1 
ATOM   116  O O   . ARG A 1 16  ? 36.521 41.266 17.399 1.00 19.52 ? 16  ARG D O   1 
ATOM   117  C CB  . ARG A 1 16  ? 38.626 43.477 16.215 1.00 22.77 ? 16  ARG D CB  1 
ATOM   118  C CG  . ARG A 1 16  ? 38.926 44.879 15.701 1.00 27.79 ? 16  ARG D CG  1 
ATOM   119  C CD  . ARG A 1 16  ? 40.391 45.246 15.854 1.00 30.42 ? 16  ARG D CD  1 
ATOM   120  N NE  . ARG A 1 16  ? 41.265 44.355 15.099 1.00 33.62 ? 16  ARG D NE  1 
ATOM   121  C CZ  . ARG A 1 16  ? 41.402 44.376 13.776 1.00 30.47 ? 16  ARG D CZ  1 
ATOM   122  N NH1 . ARG A 1 16  ? 40.723 45.247 13.038 1.00 31.80 ? 16  ARG D NH1 1 
ATOM   123  N NH2 . ARG A 1 16  ? 42.227 43.526 13.191 1.00 29.84 ? 16  ARG D NH2 1 
ATOM   124  N N   . VAL A 1 17  ? 37.324 40.681 15.378 1.00 18.10 ? 17  VAL D N   1 
ATOM   125  C CA  . VAL A 1 17  ? 37.141 39.258 15.627 1.00 18.88 ? 17  VAL D CA  1 
ATOM   126  C C   . VAL A 1 17  ? 38.250 38.771 16.546 1.00 19.08 ? 17  VAL D C   1 
ATOM   127  O O   . VAL A 1 17  ? 39.432 39.060 16.326 1.00 21.47 ? 17  VAL D O   1 
ATOM   128  C CB  . VAL A 1 17  ? 37.113 38.469 14.310 1.00 18.62 ? 17  VAL D CB  1 
ATOM   129  C CG1 . VAL A 1 17  ? 36.818 37.005 14.592 1.00 17.87 ? 17  VAL D CG1 1 
ATOM   130  C CG2 . VAL A 1 17  ? 36.071 39.049 13.366 1.00 18.12 ? 17  VAL D CG2 1 
ATOM   131  N N   . VAL A 1 18  ? 37.864 38.051 17.595 1.00 16.92 ? 18  VAL D N   1 
ATOM   132  C CA  . VAL A 1 18  ? 38.802 37.495 18.561 1.00 19.64 ? 18  VAL D CA  1 
ATOM   133  C C   . VAL A 1 18  ? 39.871 36.709 17.816 1.00 19.21 ? 18  VAL D C   1 
ATOM   134  O O   . VAL A 1 18  ? 39.560 35.791 17.049 1.00 23.16 ? 18  VAL D O   1 
ATOM   135  C CB  . VAL A 1 18  ? 38.061 36.627 19.593 1.00 22.95 ? 18  VAL D CB  1 
ATOM   136  C CG1 . VAL A 1 18  ? 39.041 35.767 20.371 1.00 25.67 ? 18  VAL D CG1 1 
ATOM   137  C CG2 . VAL A 1 18  ? 37.237 37.509 20.529 1.00 23.43 ? 18  VAL D CG2 1 
ATOM   138  N N   . LYS A 1 19  ? 41.134 37.089 18.011 1.00 26.21 ? 19  LYS D N   1 
ATOM   139  C CA  . LYS A 1 19  ? 42.239 36.531 17.241 1.00 32.27 ? 19  LYS D CA  1 
ATOM   140  C C   . LYS A 1 19  ? 42.909 35.388 17.991 1.00 40.00 ? 19  LYS D C   1 
ATOM   141  O O   . LYS A 1 19  ? 42.242 34.616 18.689 1.00 36.71 ? 19  LYS D O   1 
ATOM   142  C CB  . LYS A 1 19  ? 43.276 37.614 16.921 1.00 34.65 ? 19  LYS D CB  1 
ATOM   143  C CG  . LYS A 1 19  ? 42.778 38.715 16.007 1.00 32.70 ? 19  LYS D CG  1 
ATOM   144  C CD  . LYS A 1 19  ? 43.916 39.615 15.533 1.00 30.19 ? 19  LYS D CD  1 
ATOM   145  C CE  . LYS A 1 19  ? 44.751 38.944 14.453 1.00 29.47 ? 19  LYS D CE  1 
ATOM   146  N NZ  . LYS A 1 19  ? 45.645 39.923 13.772 1.00 23.83 ? 19  LYS D NZ  1 
ATOM   147  N N   . GLY A 1 20  ? 44.228 35.278 17.849 1.00 43.33 ? 20  GLY D N   1 
ATOM   148  C CA  . GLY A 1 20  ? 44.971 34.229 18.516 1.00 48.66 ? 20  GLY D CA  1 
ATOM   149  C C   . GLY A 1 20  ? 44.967 32.898 17.804 1.00 50.63 ? 20  GLY D C   1 
ATOM   150  O O   . GLY A 1 20  ? 45.144 31.860 18.449 1.00 54.73 ? 20  GLY D O   1 
ATOM   151  N N   . SER A 1 21  ? 44.783 32.891 16.482 1.00 49.38 ? 21  SER D N   1 
ATOM   152  C CA  . SER A 1 21  ? 44.633 31.645 15.746 1.00 51.21 ? 21  SER D CA  1 
ATOM   153  C C   . SER A 1 21  ? 45.479 31.532 14.485 1.00 53.60 ? 21  SER D C   1 
ATOM   154  O O   . SER A 1 21  ? 45.495 30.453 13.880 1.00 53.37 ? 21  SER D O   1 
ATOM   155  C CB  . SER A 1 21  ? 43.161 31.403 15.390 1.00 43.65 ? 21  SER D CB  1 
ATOM   156  O OG  . SER A 1 21  ? 42.687 32.379 14.479 1.00 45.55 ? 21  SER D OG  1 
ATOM   157  N N   . ASN A 1 22  ? 46.159 32.599 14.062 1.00 55.44 ? 22  ASN D N   1 
ATOM   158  C CA  . ASN A 1 22  ? 47.119 32.547 12.962 1.00 55.84 ? 22  ASN D CA  1 
ATOM   159  C C   . ASN A 1 22  ? 46.502 32.158 11.623 1.00 54.20 ? 22  ASN D C   1 
ATOM   160  O O   . ASN A 1 22  ? 46.530 30.986 11.233 1.00 54.25 ? 22  ASN D O   1 
ATOM   161  C CB  . ASN A 1 22  ? 48.292 31.621 13.298 1.00 56.12 ? 22  ASN D CB  1 
ATOM   162  C CG  . ASN A 1 22  ? 49.082 32.098 14.497 1.00 58.55 ? 22  ASN D CG  1 
ATOM   163  O OD1 . ASN A 1 22  ? 49.189 33.300 14.746 1.00 58.32 ? 22  ASN D OD1 1 
ATOM   164  N ND2 . ASN A 1 22  ? 49.646 31.157 15.248 1.00 57.47 ? 22  ASN D ND2 1 
ATOM   165  N N   . ALA A 1 23  ? 45.951 33.139 10.910 1.00 52.15 ? 23  ALA D N   1 
ATOM   166  C CA  . ALA A 1 23  ? 45.567 32.966 9.513  1.00 50.65 ? 23  ALA D CA  1 
ATOM   167  C C   . ALA A 1 23  ? 46.687 33.569 8.669  1.00 49.49 ? 23  ALA D C   1 
ATOM   168  O O   . ALA A 1 23  ? 46.573 34.663 8.117  1.00 48.57 ? 23  ALA D O   1 
ATOM   169  C CB  . ALA A 1 23  ? 44.218 33.620 9.234  1.00 45.92 ? 23  ALA D CB  1 
ATOM   170  N N   . GLU A 1 24  ? 47.798 32.832 8.586  1.00 50.42 ? 24  GLU D N   1 
ATOM   171  C CA  . GLU A 1 24  ? 48.966 33.307 7.852  1.00 51.40 ? 24  GLU D CA  1 
ATOM   172  C C   . GLU A 1 24  ? 48.703 33.456 6.359  1.00 47.11 ? 24  GLU D C   1 
ATOM   173  O O   . GLU A 1 24  ? 49.575 33.955 5.639  1.00 46.39 ? 24  GLU D O   1 
ATOM   174  C CB  . GLU A 1 24  ? 50.165 32.391 8.111  1.00 54.53 ? 24  GLU D CB  1 
ATOM   175  C CG  . GLU A 1 24  ? 50.325 31.970 9.572  1.00 56.27 ? 24  GLU D CG  1 
ATOM   176  C CD  . GLU A 1 24  ? 50.988 33.031 10.438 1.00 58.55 ? 24  GLU D CD  1 
ATOM   177  O OE1 . GLU A 1 24  ? 50.552 34.202 10.406 1.00 59.55 ? 24  GLU D OE1 1 
ATOM   178  O OE2 . GLU A 1 24  ? 51.949 32.690 11.159 1.00 59.58 ? 24  GLU D OE2 1 
ATOM   179  N N   . ASN A 1 25  ? 47.536 33.031 5.881  1.00 43.41 ? 25  ASN D N   1 
ATOM   180  C CA  . ASN A 1 25  ? 47.078 33.343 4.537  1.00 39.70 ? 25  ASN D CA  1 
ATOM   181  C C   . ASN A 1 25  ? 46.318 34.660 4.470  1.00 38.36 ? 25  ASN D C   1 
ATOM   182  O O   . ASN A 1 25  ? 45.973 35.103 3.370  1.00 37.02 ? 25  ASN D O   1 
ATOM   183  C CB  . ASN A 1 25  ? 46.192 32.212 4.007  1.00 37.41 ? 25  ASN D CB  1 
ATOM   184  C CG  . ASN A 1 25  ? 45.106 31.816 4.990  1.00 39.30 ? 25  ASN D CG  1 
ATOM   185  O OD1 . ASN A 1 25  ? 45.326 31.804 6.202  1.00 44.33 ? 25  ASN D OD1 1 
ATOM   186  N ND2 . ASN A 1 25  ? 43.928 31.488 4.472  1.00 34.18 ? 25  ASN D ND2 1 
ATOM   187  N N   . LEU A 1 26  ? 46.052 35.290 5.611  1.00 40.01 ? 26  LEU D N   1 
ATOM   188  C CA  . LEU A 1 26  ? 45.351 36.562 5.673  1.00 36.18 ? 26  LEU D CA  1 
ATOM   189  C C   . LEU A 1 26  ? 46.267 37.621 6.269  1.00 33.22 ? 26  LEU D C   1 
ATOM   190  O O   . LEU A 1 26  ? 47.164 37.315 7.060  1.00 36.75 ? 26  LEU D O   1 
ATOM   191  C CB  . LEU A 1 26  ? 44.082 36.453 6.528  1.00 35.90 ? 26  LEU D CB  1 
ATOM   192  C CG  . LEU A 1 26  ? 42.760 36.360 5.765  1.00 35.16 ? 26  LEU D CG  1 
ATOM   193  C CD1 . LEU A 1 26  ? 42.597 34.985 5.140  1.00 33.36 ? 26  LEU D CD1 1 
ATOM   194  C CD2 . LEU A 1 26  ? 41.589 36.676 6.685  1.00 29.51 ? 26  LEU D CD2 1 
ATOM   195  N N   . ARG A 1 27  ? 46.036 38.874 5.876  1.00 32.37 ? 27  ARG D N   1 
ATOM   196  C CA  . ARG A 1 27  ? 46.825 39.968 6.425  1.00 35.20 ? 27  ARG D CA  1 
ATOM   197  C C   . ARG A 1 27  ? 46.408 40.304 7.853  1.00 33.74 ? 27  ARG D C   1 
ATOM   198  O O   . ARG A 1 27  ? 47.259 40.676 8.668  1.00 34.05 ? 27  ARG D O   1 
ATOM   199  C CB  . ARG A 1 27  ? 46.728 41.199 5.520  1.00 34.87 ? 27  ARG D CB  1 
ATOM   200  C CG  . ARG A 1 27  ? 47.918 42.146 5.620  1.00 35.46 ? 27  ARG D CG  1 
ATOM   201  C CD  . ARG A 1 27  ? 47.877 43.205 4.528  1.00 34.98 ? 27  ARG D CD  1 
ATOM   202  N NE  . ARG A 1 27  ? 48.764 42.885 3.413  1.00 33.52 ? 27  ARG D NE  1 
ATOM   203  C CZ  . ARG A 1 27  ? 48.917 43.653 2.338  1.00 31.73 ? 27  ARG D CZ  1 
ATOM   204  N NH1 . ARG A 1 27  ? 48.240 44.789 2.230  1.00 33.26 ? 27  ARG D NH1 1 
ATOM   205  N NH2 . ARG A 1 27  ? 49.747 43.287 1.372  1.00 29.41 ? 27  ARG D NH2 1 
ATOM   206  N N   . ASP A 1 28  ? 45.119 40.162 8.181  1.00 28.74 ? 28  ASP D N   1 
ATOM   207  C CA  . ASP A 1 28  ? 44.644 40.475 9.529  1.00 29.29 ? 28  ASP D CA  1 
ATOM   208  C C   . ASP A 1 28  ? 43.355 39.688 9.779  1.00 26.68 ? 28  ASP D C   1 
ATOM   209  O O   . ASP A 1 28  ? 42.267 40.153 9.428  1.00 25.19 ? 28  ASP D O   1 
ATOM   210  C CB  . ASP A 1 28  ? 44.423 41.969 9.693  1.00 27.65 ? 28  ASP D CB  1 
ATOM   211  C CG  . ASP A 1 28  ? 43.981 42.344 11.095 1.00 26.83 ? 28  ASP D CG  1 
ATOM   212  O OD1 . ASP A 1 28  ? 43.955 41.463 11.985 1.00 25.68 ? 28  ASP D OD1 1 
ATOM   213  O OD2 . ASP A 1 28  ? 43.643 43.523 11.308 1.00 29.18 ? 28  ASP D OD2 1 
ATOM   214  N N   . SER A 1 29  ? 43.490 38.523 10.415 1.00 27.90 ? 29  SER D N   1 
ATOM   215  C CA  . SER A 1 29  ? 42.327 37.707 10.744 1.00 28.19 ? 29  SER D CA  1 
ATOM   216  C C   . SER A 1 29  ? 41.458 38.312 11.840 1.00 23.97 ? 29  SER D C   1 
ATOM   217  O O   . SER A 1 29  ? 40.408 37.739 12.155 1.00 23.99 ? 29  SER D O   1 
ATOM   218  C CB  . SER A 1 29  ? 42.764 36.295 11.134 1.00 31.55 ? 29  SER D CB  1 
ATOM   219  O OG  . SER A 1 29  ? 43.487 36.309 12.351 1.00 33.63 ? 29  SER D OG  1 
ATOM   220  N N   . GLY A 1 30  ? 41.866 39.435 12.437 1.00 24.07 ? 30  GLY D N   1 
ATOM   221  C CA  . GLY A 1 30  ? 40.994 40.158 13.345 1.00 24.58 ? 30  GLY D CA  1 
ATOM   222  C C   . GLY A 1 30  ? 40.019 41.098 12.673 1.00 21.47 ? 30  GLY D C   1 
ATOM   223  O O   . GLY A 1 30  ? 39.076 41.569 13.316 1.00 21.67 ? 30  GLY D O   1 
ATOM   224  N N   . ASP A 1 31  ? 40.231 41.377 11.395 1.00 21.17 ? 31  ASP D N   1 
ATOM   225  C CA  . ASP A 1 31  ? 39.366 42.279 10.648 1.00 20.91 ? 31  ASP D CA  1 
ATOM   226  C C   . ASP A 1 31  ? 38.086 41.554 10.250 1.00 18.59 ? 31  ASP D C   1 
ATOM   227  O O   . ASP A 1 31  ? 38.152 40.569 9.506  1.00 18.70 ? 31  ASP D O   1 
ATOM   228  C CB  . ASP A 1 31  ? 40.109 42.741 9.402  1.00 20.97 ? 31  ASP D CB  1 
ATOM   229  C CG  . ASP A 1 31  ? 39.262 43.609 8.491  1.00 22.94 ? 31  ASP D CG  1 
ATOM   230  O OD1 . ASP A 1 31  ? 38.206 44.114 8.921  1.00 25.20 ? 31  ASP D OD1 1 
ATOM   231  O OD2 . ASP A 1 31  ? 39.666 43.784 7.322  1.00 25.68 ? 31  ASP D OD2 1 
ATOM   232  N N   . PRO A 1 32  ? 36.910 42.011 10.695 1.00 17.78 ? 32  PRO D N   1 
ATOM   233  C CA  . PRO A 1 32  ? 35.669 41.313 10.314 1.00 17.41 ? 32  PRO D CA  1 
ATOM   234  C C   . PRO A 1 32  ? 35.383 41.364 8.829  1.00 17.21 ? 32  PRO D C   1 
ATOM   235  O O   . PRO A 1 32  ? 34.758 40.441 8.293  1.00 18.25 ? 32  PRO D O   1 
ATOM   236  C CB  . PRO A 1 32  ? 34.589 42.038 11.128 1.00 19.97 ? 32  PRO D CB  1 
ATOM   237  C CG  . PRO A 1 32  ? 35.176 43.383 11.422 1.00 22.77 ? 32  PRO D CG  1 
ATOM   238  C CD  . PRO A 1 32  ? 36.650 43.159 11.579 1.00 19.84 ? 32  PRO D CD  1 
ATOM   239  N N   . VAL A 1 33  ? 35.818 42.423 8.148  1.00 18.72 ? 33  VAL D N   1 
ATOM   240  C CA  . VAL A 1 33  ? 35.627 42.510 6.706  1.00 19.69 ? 33  VAL D CA  1 
ATOM   241  C C   . VAL A 1 33  ? 36.473 41.462 5.994  1.00 17.84 ? 33  VAL D C   1 
ATOM   242  O O   . VAL A 1 33  ? 35.958 40.643 5.224  1.00 18.17 ? 33  VAL D O   1 
ATOM   243  C CB  . VAL A 1 33  ? 35.934 43.934 6.212  1.00 23.15 ? 33  VAL D CB  1 
ATOM   244  C CG1 . VAL A 1 33  ? 35.861 43.996 4.697  1.00 23.80 ? 33  VAL D CG1 1 
ATOM   245  C CG2 . VAL A 1 33  ? 34.976 44.928 6.848  1.00 24.23 ? 33  VAL D CG2 1 
ATOM   246  N N   . GLU A 1 34  ? 37.785 41.457 6.252  1.00 19.11 ? 34  GLU D N   1 
ATOM   247  C CA  . GLU A 1 34  ? 38.658 40.527 5.543  1.00 19.05 ? 34  GLU D CA  1 
ATOM   248  C C   . GLU A 1 34  ? 38.327 39.082 5.889  1.00 15.51 ? 34  GLU D C   1 
ATOM   249  O O   . GLU A 1 34  ? 38.318 38.214 5.010  1.00 15.77 ? 34  GLU D O   1 
ATOM   250  C CB  . GLU A 1 34  ? 40.126 40.831 5.838  1.00 21.68 ? 34  GLU D CB  1 
ATOM   251  C CG  . GLU A 1 34  ? 41.088 40.027 4.974  1.00 25.48 ? 34  GLU D CG  1 
ATOM   252  C CD  . GLU A 1 34  ? 42.522 40.094 5.460  1.00 29.38 ? 34  GLU D CD  1 
ATOM   253  O OE1 . GLU A 1 34  ? 42.775 40.762 6.484  1.00 31.20 ? 34  GLU D OE1 1 
ATOM   254  O OE2 . GLU A 1 34  ? 43.397 39.476 4.815  1.00 30.31 ? 34  GLU D OE2 1 
ATOM   255  N N   . LEU A 1 35  ? 38.051 38.806 7.165  1.00 16.68 ? 35  LEU D N   1 
ATOM   256  C CA  . LEU A 1 35  ? 37.757 37.435 7.562  1.00 16.86 ? 35  LEU D CA  1 
ATOM   257  C C   . LEU A 1 35  ? 36.419 36.975 7.000  1.00 14.93 ? 35  LEU D C   1 
ATOM   258  O O   . LEU A 1 35  ? 36.309 35.859 6.481  1.00 15.90 ? 35  LEU D O   1 
ATOM   259  C CB  . LEU A 1 35  ? 37.780 37.304 9.083  1.00 17.10 ? 35  LEU D CB  1 
ATOM   260  C CG  . LEU A 1 35  ? 37.552 35.885 9.600  1.00 17.87 ? 35  LEU D CG  1 
ATOM   261  C CD1 . LEU A 1 35  ? 38.657 34.954 9.130  1.00 19.66 ? 35  LEU D CD1 1 
ATOM   262  C CD2 . LEU A 1 35  ? 37.470 35.915 11.107 1.00 17.44 ? 35  LEU D CD2 1 
ATOM   263  N N   . GLY A 1 36  ? 35.397 37.827 7.082  1.00 16.47 ? 36  GLY D N   1 
ATOM   264  C CA  . GLY A 1 36  ? 34.104 37.462 6.526  1.00 15.70 ? 36  GLY D CA  1 
ATOM   265  C C   . GLY A 1 36  ? 34.160 37.260 5.026  1.00 16.96 ? 36  GLY D C   1 
ATOM   266  O O   . GLY A 1 36  ? 33.563 36.320 4.492  1.00 17.07 ? 36  GLY D O   1 
ATOM   267  N N   . LYS A 1 37  ? 34.890 38.130 4.327  1.00 15.99 ? 37  LYS D N   1 
ATOM   268  C CA  . LYS A 1 37  ? 35.030 37.978 2.883  1.00 17.34 ? 37  LYS D CA  1 
ATOM   269  C C   . LYS A 1 37  ? 35.747 36.682 2.533  1.00 17.91 ? 37  LYS D C   1 
ATOM   270  O O   . LYS A 1 37  ? 35.356 35.983 1.591  1.00 17.47 ? 37  LYS D O   1 
ATOM   271  C CB  . LYS A 1 37  ? 35.776 39.174 2.301  1.00 17.52 ? 37  LYS D CB  1 
ATOM   272  C CG  . LYS A 1 37  ? 36.007 39.065 0.803  1.00 22.36 ? 37  LYS D CG  1 
ATOM   273  C CD  . LYS A 1 37  ? 36.130 40.433 0.160  1.00 25.90 ? 37  LYS D CD  1 
ATOM   274  C CE  . LYS A 1 37  ? 36.332 40.312 -1.344 1.00 28.72 ? 37  LYS D CE  1 
ATOM   275  N NZ  . LYS A 1 37  ? 35.368 39.357 -1.960 1.00 32.85 ? 37  LYS D NZ  1 
ATOM   276  N N   . PHE A 1 38  ? 36.796 36.345 3.282  1.00 15.20 ? 38  PHE D N   1 
ATOM   277  C CA  . PHE A 1 38  ? 37.495 35.086 3.060  1.00 16.61 ? 38  PHE D CA  1 
ATOM   278  C C   . PHE A 1 38  ? 36.541 33.905 3.211  1.00 16.61 ? 38  PHE D C   1 
ATOM   279  O O   . PHE A 1 38  ? 36.444 33.053 2.320  1.00 17.46 ? 38  PHE D O   1 
ATOM   280  C CB  . PHE A 1 38  ? 38.671 34.980 4.032  1.00 18.43 ? 38  PHE D CB  1 
ATOM   281  C CG  . PHE A 1 38  ? 39.241 33.598 4.159  1.00 21.77 ? 38  PHE D CG  1 
ATOM   282  C CD1 . PHE A 1 38  ? 39.952 33.025 3.115  1.00 23.47 ? 38  PHE D CD1 1 
ATOM   283  C CD2 . PHE A 1 38  ? 39.084 32.878 5.331  1.00 23.18 ? 38  PHE D CD2 1 
ATOM   284  C CE1 . PHE A 1 38  ? 40.489 31.751 3.241  1.00 24.95 ? 38  PHE D CE1 1 
ATOM   285  C CE2 . PHE A 1 38  ? 39.615 31.607 5.459  1.00 25.69 ? 38  PHE D CE2 1 
ATOM   286  C CZ  . PHE A 1 38  ? 40.318 31.045 4.414  1.00 25.90 ? 38  PHE D CZ  1 
ATOM   287  N N   . TYR A 1 39  ? 35.801 33.852 4.327  1.00 15.89 ? 39  TYR D N   1 
ATOM   288  C CA  . TYR A 1 39  ? 34.856 32.752 4.520  1.00 16.57 ? 39  TYR D CA  1 
ATOM   289  C C   . TYR A 1 39  ? 33.853 32.681 3.378  1.00 15.64 ? 39  TYR D C   1 
ATOM   290  O O   . TYR A 1 39  ? 33.519 31.589 2.902  1.00 17.07 ? 39  TYR D O   1 
ATOM   291  C CB  . TYR A 1 39  ? 34.132 32.896 5.859  1.00 15.60 ? 39  TYR D CB  1 
ATOM   292  C CG  . TYR A 1 39  ? 34.980 32.488 7.031  1.00 16.54 ? 39  TYR D CG  1 
ATOM   293  C CD1 . TYR A 1 39  ? 35.916 31.476 6.907  1.00 21.17 ? 39  TYR D CD1 1 
ATOM   294  C CD2 . TYR A 1 39  ? 34.858 33.120 8.258  1.00 19.89 ? 39  TYR D CD2 1 
ATOM   295  C CE1 . TYR A 1 39  ? 36.703 31.097 7.970  1.00 23.29 ? 39  TYR D CE1 1 
ATOM   296  C CE2 . TYR A 1 39  ? 35.643 32.745 9.327  1.00 22.09 ? 39  TYR D CE2 1 
ATOM   297  C CZ  . TYR A 1 39  ? 36.563 31.736 9.176  1.00 18.75 ? 39  TYR D CZ  1 
ATOM   298  O OH  . TYR A 1 39  ? 37.353 31.359 10.235 1.00 20.77 ? 39  TYR D OH  1 
ATOM   299  N N   . SER A 1 40  ? 33.363 33.839 2.936  1.00 16.17 ? 40  SER D N   1 
ATOM   300  C CA  . SER A 1 40  ? 32.461 33.909 1.789  1.00 18.69 ? 40  SER D CA  1 
ATOM   301  C C   . SER A 1 40  ? 33.069 33.269 0.550  1.00 21.37 ? 40  SER D C   1 
ATOM   302  O O   . SER A 1 40  ? 32.359 32.665 -0.262 1.00 22.57 ? 40  SER D O   1 
ATOM   303  C CB  . SER A 1 40  ? 32.141 35.376 1.497  1.00 23.76 ? 40  SER D CB  1 
ATOM   304  O OG  . SER A 1 40  ? 31.053 35.518 0.604  1.00 31.53 ? 40  SER D OG  1 
ATOM   305  N N   . GLU A 1 41  ? 34.381 33.403 0.378  1.00 18.61 ? 41  GLU D N   1 
ATOM   306  C CA  . GLU A 1 41  ? 35.029 32.927 -0.837 1.00 19.36 ? 41  GLU D CA  1 
ATOM   307  C C   . GLU A 1 41  ? 35.390 31.451 -0.777 1.00 22.87 ? 41  GLU D C   1 
ATOM   308  O O   . GLU A 1 41  ? 35.571 30.830 -1.830 1.00 23.26 ? 41  GLU D O   1 
ATOM   309  C CB  . GLU A 1 41  ? 36.257 33.790 -1.142 1.00 19.52 ? 41  GLU D CB  1 
ATOM   310  C CG  . GLU A 1 41  ? 35.886 35.225 -1.500 1.00 24.44 ? 41  GLU D CG  1 
ATOM   311  C CD  . GLU A 1 41  ? 37.077 36.158 -1.564 1.00 26.94 ? 41  GLU D CD  1 
ATOM   312  O OE1 . GLU A 1 41  ? 38.117 35.846 -0.946 1.00 27.42 ? 41  GLU D OE1 1 
ATOM   313  O OE2 . GLU A 1 41  ? 36.965 37.210 -2.232 1.00 31.82 ? 41  GLU D OE2 1 
ATOM   314  N N   . ILE A 1 42  ? 35.484 30.870 0.420  1.00 20.48 ? 42  ILE D N   1 
ATOM   315  C CA  . ILE A 1 42  ? 35.844 29.466 0.557  1.00 20.70 ? 42  ILE D CA  1 
ATOM   316  C C   . ILE A 1 42  ? 34.641 28.570 0.793  1.00 19.39 ? 42  ILE D C   1 
ATOM   317  O O   . ILE A 1 42  ? 34.818 27.369 1.033  1.00 21.86 ? 42  ILE D O   1 
ATOM   318  C CB  . ILE A 1 42  ? 36.932 29.237 1.622  1.00 24.47 ? 42  ILE D CB  1 
ATOM   319  C CG1 . ILE A 1 42  ? 36.396 29.589 3.008  1.00 23.77 ? 42  ILE D CG1 1 
ATOM   320  C CG2 . ILE A 1 42  ? 38.173 30.050 1.284  1.00 24.74 ? 42  ILE D CG2 1 
ATOM   321  C CD1 . ILE A 1 42  ? 37.314 29.180 4.131  1.00 27.17 ? 42  ILE D CD1 1 
ATOM   322  N N   . GLY A 1 43  ? 33.427 29.114 0.755  1.00 18.71 ? 43  GLY D N   1 
ATOM   323  C CA  . GLY A 1 43  ? 32.230 28.302 0.753  1.00 18.89 ? 43  GLY D CA  1 
ATOM   324  C C   . GLY A 1 43  ? 31.347 28.364 1.985  1.00 14.14 ? 43  GLY D C   1 
ATOM   325  O O   . GLY A 1 43  ? 30.373 27.610 2.049  1.00 16.57 ? 43  GLY D O   1 
ATOM   326  N N   . ILE A 1 44  ? 31.659 29.201 2.975  1.00 13.14 ? 44  ILE D N   1 
ATOM   327  C CA  . ILE A 1 44  ? 30.745 29.396 4.095  1.00 11.97 ? 44  ILE D CA  1 
ATOM   328  C C   . ILE A 1 44  ? 29.477 30.056 3.571  1.00 12.03 ? 44  ILE D C   1 
ATOM   329  O O   . ILE A 1 44  ? 29.530 30.966 2.733  1.00 13.20 ? 44  ILE D O   1 
ATOM   330  C CB  . ILE A 1 44  ? 31.436 30.227 5.190  1.00 11.71 ? 44  ILE D CB  1 
ATOM   331  C CG1 . ILE A 1 44  ? 32.485 29.376 5.905  1.00 15.36 ? 44  ILE D CG1 1 
ATOM   332  C CG2 . ILE A 1 44  ? 30.440 30.732 6.209  1.00 13.08 ? 44  ILE D CG2 1 
ATOM   333  C CD1 . ILE A 1 44  ? 31.889 28.245 6.726  1.00 14.02 ? 44  ILE D CD1 1 
ATOM   334  N N   . ASP A 1 45  ? 28.318 29.578 4.032  1.00 11.11 ? 45  ASP D N   1 
ATOM   335  C CA  . ASP A 1 45  ? 27.050 30.063 3.503  1.00 10.10 ? 45  ASP D CA  1 
ATOM   336  C C   . ASP A 1 45  ? 26.562 31.341 4.166  1.00 11.24 ? 45  ASP D C   1 
ATOM   337  O O   . ASP A 1 45  ? 25.935 32.169 3.508  1.00 11.43 ? 45  ASP D O   1 
ATOM   338  C CB  . ASP A 1 45  ? 25.985 28.981 3.626  1.00 11.25 ? 45  ASP D CB  1 
ATOM   339  C CG  . ASP A 1 45  ? 26.344 27.751 2.848  1.00 11.10 ? 45  ASP D CG  1 
ATOM   340  O OD1 . ASP A 1 45  ? 26.647 27.885 1.638  1.00 13.03 ? 45  ASP D OD1 1 
ATOM   341  O OD2 . ASP A 1 45  ? 26.346 26.661 3.432  1.00 10.79 ? 45  ASP D OD2 1 
ATOM   342  N N   . GLU A 1 46  ? 26.796 31.505 5.467  1.00 10.09 ? 46  GLU D N   1 
ATOM   343  C CA  . GLU A 1 46  ? 26.392 32.698 6.197  1.00 8.98  ? 46  GLU D CA  1 
ATOM   344  C C   . GLU A 1 46  ? 27.374 32.894 7.330  1.00 8.35  ? 46  GLU D C   1 
ATOM   345  O O   . GLU A 1 46  ? 28.126 31.983 7.679  1.00 10.00 ? 46  GLU D O   1 
ATOM   346  C CB  . GLU A 1 46  ? 24.984 32.588 6.802  1.00 10.56 ? 46  GLU D CB  1 
ATOM   347  C CG  . GLU A 1 46  ? 23.883 32.252 5.838  1.00 11.10 ? 46  GLU D CG  1 
ATOM   348  C CD  . GLU A 1 46  ? 22.520 32.263 6.484  1.00 12.29 ? 46  GLU D CD  1 
ATOM   349  O OE1 . GLU A 1 46  ? 22.374 32.854 7.573  1.00 12.93 ? 46  GLU D OE1 1 
ATOM   350  O OE2 . GLU A 1 46  ? 21.578 31.720 5.870  1.00 14.11 ? 46  GLU D OE2 1 
ATOM   351  N N   . LEU A 1 47  ? 27.350 34.078 7.914  1.00 8.93  ? 47  LEU D N   1 
ATOM   352  C CA  . LEU A 1 47  ? 28.154 34.367 9.082  1.00 9.53  ? 47  LEU D CA  1 
ATOM   353  C C   . LEU A 1 47  ? 27.250 34.768 10.231 1.00 9.24  ? 47  LEU D C   1 
ATOM   354  O O   . LEU A 1 47  ? 26.158 35.310 10.033 1.00 9.57  ? 47  LEU D O   1 
ATOM   355  C CB  . LEU A 1 47  ? 29.082 35.548 8.827  1.00 9.90  ? 47  LEU D CB  1 
ATOM   356  C CG  . LEU A 1 47  ? 29.988 35.405 7.614  1.00 11.65 ? 47  LEU D CG  1 
ATOM   357  C CD1 . LEU A 1 47  ? 30.663 36.728 7.302  1.00 13.51 ? 47  LEU D CD1 1 
ATOM   358  C CD2 . LEU A 1 47  ? 31.022 34.324 7.840  1.00 13.51 ? 47  LEU D CD2 1 
ATOM   359  N N   . VAL A 1 48  ? 27.744 34.549 11.440 1.00 9.91  ? 48  VAL D N   1 
ATOM   360  C CA  . VAL A 1 48  ? 27.191 35.164 12.634 1.00 9.26  ? 48  VAL D CA  1 
ATOM   361  C C   . VAL A 1 48  ? 28.321 35.933 13.291 1.00 11.11 ? 48  VAL D C   1 
ATOM   362  O O   . VAL A 1 48  ? 29.400 35.372 13.523 1.00 11.76 ? 48  VAL D O   1 
ATOM   363  C CB  . VAL A 1 48  ? 26.623 34.119 13.611 1.00 9.28  ? 48  VAL D CB  1 
ATOM   364  C CG1 . VAL A 1 48  ? 26.192 34.794 14.919 1.00 12.08 ? 48  VAL D CG1 1 
ATOM   365  C CG2 . VAL A 1 48  ? 25.469 33.366 12.982 1.00 10.84 ? 48  VAL D CG2 1 
ATOM   366  N N   . PHE A 1 49  ? 28.089 37.213 13.562 1.00 9.92  ? 49  PHE D N   1 
ATOM   367  C CA  . PHE A 1 49  ? 29.000 38.021 14.364 1.00 10.60 ? 49  PHE D CA  1 
ATOM   368  C C   . PHE A 1 49  ? 28.390 38.131 15.751 1.00 11.68 ? 49  PHE D C   1 
ATOM   369  O O   . PHE A 1 49  ? 27.324 38.730 15.920 1.00 12.24 ? 49  PHE D O   1 
ATOM   370  C CB  . PHE A 1 49  ? 29.195 39.403 13.750 1.00 12.16 ? 49  PHE D CB  1 
ATOM   371  C CG  . PHE A 1 49  ? 29.948 39.387 12.462 1.00 12.10 ? 49  PHE D CG  1 
ATOM   372  C CD1 . PHE A 1 49  ? 31.328 39.436 12.448 1.00 13.66 ? 49  PHE D CD1 1 
ATOM   373  C CD2 . PHE A 1 49  ? 29.275 39.323 11.259 1.00 13.57 ? 49  PHE D CD2 1 
ATOM   374  C CE1 . PHE A 1 49  ? 32.021 39.434 11.254 1.00 14.62 ? 49  PHE D CE1 1 
ATOM   375  C CE2 . PHE A 1 49  ? 29.962 39.311 10.068 1.00 14.62 ? 49  PHE D CE2 1 
ATOM   376  C CZ  . PHE A 1 49  ? 31.340 39.367 10.066 1.00 14.90 ? 49  PHE D CZ  1 
ATOM   377  N N   . LEU A 1 50  ? 29.055 37.536 16.729 1.00 11.86 ? 50  LEU D N   1 
ATOM   378  C CA  . LEU A 1 50  ? 28.559 37.458 18.093 1.00 11.95 ? 50  LEU D CA  1 
ATOM   379  C C   . LEU A 1 50  ? 29.449 38.341 18.954 1.00 12.90 ? 50  LEU D C   1 
ATOM   380  O O   . LEU A 1 50  ? 30.634 38.044 19.136 1.00 12.95 ? 50  LEU D O   1 
ATOM   381  C CB  . LEU A 1 50  ? 28.618 36.012 18.576 1.00 15.71 ? 50  LEU D CB  1 
ATOM   382  C CG  . LEU A 1 50  ? 28.090 35.706 19.975 1.00 16.52 ? 50  LEU D CG  1 
ATOM   383  C CD1 . LEU A 1 50  ? 26.671 36.208 20.131 1.00 19.27 ? 50  LEU D CD1 1 
ATOM   384  C CD2 . LEU A 1 50  ? 28.173 34.213 20.258 1.00 19.73 ? 50  LEU D CD2 1 
ATOM   385  N N   . ASP A 1 51  ? 28.904 39.442 19.461 1.00 11.80 ? 51  ASP D N   1 
ATOM   386  C CA  . ASP A 1 51  ? 29.666 40.228 20.425 1.00 13.95 ? 51  ASP D CA  1 
ATOM   387  C C   . ASP A 1 51  ? 29.641 39.497 21.759 1.00 14.98 ? 51  ASP D C   1 
ATOM   388  O O   . ASP A 1 51  ? 28.591 39.397 22.399 1.00 15.86 ? 51  ASP D O   1 
ATOM   389  C CB  . ASP A 1 51  ? 29.151 41.657 20.546 1.00 19.78 ? 51  ASP D CB  1 
ATOM   390  C CG  . ASP A 1 51  ? 30.089 42.531 21.365 1.00 18.95 ? 51  ASP D CG  1 
ATOM   391  O OD1 . ASP A 1 51  ? 30.348 42.180 22.538 1.00 20.81 ? 51  ASP D OD1 1 
ATOM   392  O OD2 . ASP A 1 51  ? 30.600 43.539 20.835 1.00 24.68 ? 51  ASP D OD2 1 
ATOM   393  N N   . ILE A 1 52  ? 30.803 38.979 22.172 1.00 16.41 ? 52  ILE D N   1 
ATOM   394  C CA  . ILE A 1 52  ? 30.901 38.149 23.374 1.00 17.82 ? 52  ILE D CA  1 
ATOM   395  C C   . ILE A 1 52  ? 31.143 38.962 24.633 1.00 18.67 ? 52  ILE D C   1 
ATOM   396  O O   . ILE A 1 52  ? 31.139 38.396 25.739 1.00 21.81 ? 52  ILE D O   1 
ATOM   397  C CB  . ILE A 1 52  ? 31.982 37.059 23.229 1.00 18.78 ? 52  ILE D CB  1 
ATOM   398  C CG1 . ILE A 1 52  ? 33.362 37.698 23.049 1.00 20.40 ? 52  ILE D CG1 1 
ATOM   399  C CG2 . ILE A 1 52  ? 31.642 36.131 22.070 1.00 19.90 ? 52  ILE D CG2 1 
ATOM   400  C CD1 . ILE A 1 52  ? 34.515 36.718 23.154 1.00 20.87 ? 52  ILE D CD1 1 
ATOM   401  N N   . THR A 1 53  ? 31.402 40.259 24.496 1.00 19.26 ? 53  THR D N   1 
ATOM   402  C CA  . THR A 1 53  ? 31.401 41.159 25.638 1.00 24.84 ? 53  THR D CA  1 
ATOM   403  C C   . THR A 1 53  ? 29.992 41.678 25.884 1.00 30.62 ? 53  THR D C   1 
ATOM   404  O O   . THR A 1 53  ? 29.520 41.708 27.024 1.00 40.20 ? 53  THR D O   1 
ATOM   405  C CB  . THR A 1 53  ? 32.350 42.319 25.354 1.00 23.10 ? 53  THR D CB  1 
ATOM   406  O OG1 . THR A 1 53  ? 31.669 43.299 24.563 1.00 25.57 ? 53  THR D OG1 1 
ATOM   407  C CG2 . THR A 1 53  ? 33.565 41.829 24.581 1.00 22.08 ? 53  THR D CG2 1 
ATOM   408  N N   . ALA A 1 54  ? 29.310 42.082 24.812 1.00 33.38 ? 54  ALA D N   1 
ATOM   409  C CA  . ALA A 1 54  ? 27.902 42.473 24.821 1.00 37.26 ? 54  ALA D CA  1 
ATOM   410  C C   . ALA A 1 54  ? 27.619 43.664 25.733 1.00 42.26 ? 54  ALA D C   1 
ATOM   411  O O   . ALA A 1 54  ? 26.471 43.877 26.138 1.00 44.40 ? 54  ALA D O   1 
ATOM   412  C CB  . ALA A 1 54  ? 26.978 41.292 25.149 1.00 35.85 ? 54  ALA D CB  1 
ATOM   413  N N   . SER A 1 55  ? 28.636 44.468 26.052 1.00 43.83 ? 55  SER D N   1 
ATOM   414  C CA  . SER A 1 55  ? 28.485 45.465 27.106 1.00 46.86 ? 55  SER D CA  1 
ATOM   415  C C   . SER A 1 55  ? 28.945 46.863 26.707 1.00 47.47 ? 55  SER D C   1 
ATOM   416  O O   . SER A 1 55  ? 28.200 47.613 26.068 1.00 47.92 ? 55  SER D O   1 
ATOM   417  C CB  . SER A 1 55  ? 29.232 45.011 28.363 1.00 46.49 ? 55  SER D CB  1 
ATOM   418  O OG  . SER A 1 55  ? 30.632 44.989 28.146 1.00 44.71 ? 55  SER D OG  1 
ATOM   419  N N   . VAL A 1 56  ? 30.167 47.219 27.092 1.00 47.87 ? 56  VAL D N   1 
ATOM   420  C CA  . VAL A 1 56  ? 30.622 48.605 27.048 1.00 48.93 ? 56  VAL D CA  1 
ATOM   421  C C   . VAL A 1 56  ? 30.989 48.980 25.620 1.00 46.92 ? 56  VAL D C   1 
ATOM   422  O O   . VAL A 1 56  ? 31.767 48.279 24.961 1.00 47.24 ? 56  VAL D O   1 
ATOM   423  C CB  . VAL A 1 56  ? 31.810 48.812 28.000 1.00 48.10 ? 56  VAL D CB  1 
ATOM   424  C CG1 . VAL A 1 56  ? 32.075 50.298 28.198 1.00 48.68 ? 56  VAL D CG1 1 
ATOM   425  C CG2 . VAL A 1 56  ? 31.546 48.123 29.329 1.00 47.66 ? 56  VAL D CG2 1 
ATOM   426  N N   . GLU A 1 57  ? 30.435 50.095 25.143 1.00 44.48 ? 57  GLU D N   1 
ATOM   427  C CA  . GLU A 1 57  ? 30.622 50.593 23.783 1.00 42.31 ? 57  GLU D CA  1 
ATOM   428  C C   . GLU A 1 57  ? 30.185 49.596 22.717 1.00 38.70 ? 57  GLU D C   1 
ATOM   429  O O   . GLU A 1 57  ? 30.389 49.847 21.524 1.00 32.94 ? 57  GLU D O   1 
ATOM   430  C CB  . GLU A 1 57  ? 32.056 51.079 23.528 1.00 43.59 ? 57  GLU D CB  1 
ATOM   431  C CG  . GLU A 1 57  ? 32.423 52.363 24.257 1.00 46.14 ? 57  GLU D CG  1 
ATOM   432  C CD  . GLU A 1 57  ? 33.118 53.365 23.356 1.00 48.24 ? 57  GLU D CD  1 
ATOM   433  O OE1 . GLU A 1 57  ? 32.452 53.917 22.454 1.00 46.47 ? 57  GLU D OE1 1 
ATOM   434  O OE2 . GLU A 1 57  ? 34.332 53.594 23.546 1.00 49.63 ? 57  GLU D OE2 1 
ATOM   435  N N   . LYS A 1 58  ? 29.582 48.475 23.127 1.00 39.14 ? 58  LYS D N   1 
ATOM   436  C CA  . LYS A 1 58  ? 29.165 47.433 22.194 1.00 34.06 ? 58  LYS D CA  1 
ATOM   437  C C   . LYS A 1 58  ? 28.252 47.988 21.112 1.00 33.02 ? 58  LYS D C   1 
ATOM   438  O O   . LYS A 1 58  ? 28.419 47.686 19.926 1.00 27.49 ? 58  LYS D O   1 
ATOM   439  C CB  . LYS A 1 58  ? 28.410 46.348 22.959 1.00 35.80 ? 58  LYS D CB  1 
ATOM   440  C CG  . LYS A 1 58  ? 28.139 45.109 22.134 1.00 36.76 ? 58  LYS D CG  1 
ATOM   441  C CD  . LYS A 1 58  ? 26.939 44.337 22.665 1.00 35.45 ? 58  LYS D CD  1 
ATOM   442  C CE  . LYS A 1 58  ? 25.722 44.497 21.763 1.00 36.48 ? 58  LYS D CE  1 
ATOM   443  N NZ  . LYS A 1 58  ? 26.072 44.383 20.316 1.00 34.83 ? 58  LYS D NZ  1 
ATOM   444  N N   . ARG A 1 59  ? 27.264 48.791 21.510 1.00 32.09 ? 59  ARG D N   1 
ATOM   445  C CA  . ARG A 1 59  ? 26.278 49.302 20.566 1.00 32.61 ? 59  ARG D CA  1 
ATOM   446  C C   . ARG A 1 59  ? 26.943 50.020 19.398 1.00 30.52 ? 59  ARG D C   1 
ATOM   447  O O   . ARG A 1 59  ? 26.741 49.645 18.239 1.00 25.12 ? 59  ARG D O   1 
ATOM   448  C CB  . ARG A 1 59  ? 25.289 50.216 21.287 1.00 33.57 ? 59  ARG D CB  1 
ATOM   449  C CG  . ARG A 1 59  ? 24.076 50.541 20.448 1.00 29.58 ? 59  ARG D CG  1 
ATOM   450  C CD  . ARG A 1 59  ? 22.861 50.784 21.308 1.00 33.74 ? 59  ARG D CD  1 
ATOM   451  N NE  . ARG A 1 59  ? 21.707 51.135 20.492 1.00 29.54 ? 59  ARG D NE  1 
ATOM   452  C CZ  . ARG A 1 59  ? 20.562 51.592 20.980 1.00 28.51 ? 59  ARG D CZ  1 
ATOM   453  N NH1 . ARG A 1 59  ? 20.411 51.747 22.288 1.00 32.68 ? 59  ARG D NH1 1 
ATOM   454  N NH2 . ARG A 1 59  ? 19.565 51.886 20.161 1.00 27.88 ? 59  ARG D NH2 1 
ATOM   455  N N   . LYS A 1 60  ? 27.740 51.064 19.685 1.00 29.02 ? 60  LYS D N   1 
ATOM   456  C CA  . LYS A 1 60  ? 28.402 51.823 18.619 1.00 27.80 ? 60  LYS D CA  1 
ATOM   457  C C   . LYS A 1 60  ? 29.357 50.944 17.812 1.00 26.92 ? 60  LYS D C   1 
ATOM   458  O O   . LYS A 1 60  ? 29.259 50.903 16.579 1.00 26.67 ? 60  LYS D O   1 
ATOM   459  C CB  . LYS A 1 60  ? 29.054 53.114 19.160 1.00 34.24 ? 60  LYS D CB  1 
ATOM   460  C CG  . LYS A 1 60  ? 30.155 53.788 18.303 1.00 36.22 ? 60  LYS D CG  1 
ATOM   461  C CD  . LYS A 1 60  ? 29.953 53.689 16.776 1.00 34.83 ? 60  LYS D CD  1 
ATOM   462  C CE  . LYS A 1 60  ? 30.738 54.677 16.017 1.00 34.38 ? 60  LYS D CE  1 
ATOM   463  N NZ  . LYS A 1 60  ? 30.248 56.043 16.111 1.00 34.07 ? 60  LYS D NZ  1 
ATOM   464  N N   . THR A 1 61  ? 30.245 50.194 18.480 1.00 25.21 ? 61  THR D N   1 
ATOM   465  C CA  . THR A 1 61  ? 31.244 49.422 17.743 1.00 24.42 ? 61  THR D CA  1 
ATOM   466  C C   . THR A 1 61  ? 30.599 48.376 16.842 1.00 20.79 ? 61  THR D C   1 
ATOM   467  O O   . THR A 1 61  ? 31.097 48.120 15.741 1.00 18.86 ? 61  THR D O   1 
ATOM   468  C CB  . THR A 1 61  ? 32.271 48.779 18.688 1.00 24.68 ? 61  THR D CB  1 
ATOM   469  O OG1 . THR A 1 61  ? 31.642 47.799 19.525 1.00 24.57 ? 61  THR D OG1 1 
ATOM   470  C CG2 . THR A 1 61  ? 32.941 49.832 19.566 1.00 25.71 ? 61  THR D CG2 1 
ATOM   471  N N   . MET A 1 62  ? 29.490 47.776 17.279 1.00 20.19 ? 62  MET D N   1 
ATOM   472  C CA  . MET A 1 62  ? 28.809 46.808 16.426 1.00 18.74 ? 62  MET D CA  1 
ATOM   473  C C   . MET A 1 62  ? 28.142 47.480 15.234 1.00 19.16 ? 62  MET D C   1 
ATOM   474  O O   . MET A 1 62  ? 28.108 46.911 14.137 1.00 17.89 ? 62  MET D O   1 
ATOM   475  C CB  . MET A 1 62  ? 27.809 45.987 17.232 1.00 19.86 ? 62  MET D CB  1 
ATOM   476  C CG  . MET A 1 62  ? 27.207 44.855 16.440 1.00 22.63 ? 62  MET D CG  1 
ATOM   477  S SD  . MET A 1 62  ? 28.427 43.726 15.720 1.00 27.29 ? 62  MET D SD  1 
ATOM   478  C CE  . MET A 1 62  ? 29.511 43.519 17.118 1.00 17.14 ? 62  MET D CE  1 
ATOM   479  N N   . LEU A 1 63  ? 27.603 48.685 15.425 1.00 18.89 ? 63  LEU D N   1 
ATOM   480  C CA  . LEU A 1 63  ? 27.046 49.418 14.292 1.00 18.21 ? 63  LEU D CA  1 
ATOM   481  C C   . LEU A 1 63  ? 28.108 49.678 13.231 1.00 17.42 ? 63  LEU D C   1 
ATOM   482  O O   . LEU A 1 63  ? 27.853 49.522 12.032 1.00 17.23 ? 63  LEU D O   1 
ATOM   483  C CB  . LEU A 1 63  ? 26.438 50.736 14.769 1.00 19.01 ? 63  LEU D CB  1 
ATOM   484  C CG  . LEU A 1 63  ? 25.182 50.652 15.637 1.00 23.18 ? 63  LEU D CG  1 
ATOM   485  C CD1 . LEU A 1 63  ? 24.784 52.033 16.131 1.00 27.47 ? 63  LEU D CD1 1 
ATOM   486  C CD2 . LEU A 1 63  ? 24.038 50.004 14.887 1.00 23.21 ? 63  LEU D CD2 1 
ATOM   487  N N   . GLU A 1 64  ? 29.313 50.071 13.655 1.00 19.70 ? 64  GLU D N   1 
ATOM   488  C CA  . GLU A 1 64  ? 30.381 50.325 12.694 1.00 18.78 ? 64  GLU D CA  1 
ATOM   489  C C   . GLU A 1 64  ? 30.804 49.047 11.989 1.00 16.40 ? 64  GLU D C   1 
ATOM   490  O O   . GLU A 1 64  ? 31.071 49.058 10.785 1.00 17.07 ? 64  GLU D O   1 
ATOM   491  C CB  . GLU A 1 64  ? 31.584 50.960 13.386 1.00 24.62 ? 64  GLU D CB  1 
ATOM   492  C CG  . GLU A 1 64  ? 31.562 52.467 13.401 1.00 29.36 ? 64  GLU D CG  1 
ATOM   493  C CD  . GLU A 1 64  ? 32.922 53.058 13.722 1.00 31.62 ? 64  GLU D CD  1 
ATOM   494  O OE1 . GLU A 1 64  ? 33.159 53.458 14.877 1.00 35.82 ? 64  GLU D OE1 1 
ATOM   495  O OE2 . GLU A 1 64  ? 33.766 53.127 12.809 1.00 37.71 ? 64  GLU D OE2 1 
ATOM   496  N N   . LEU A 1 65  ? 30.890 47.938 12.728 1.00 17.68 ? 65  LEU D N   1 
ATOM   497  C CA  . LEU A 1 65  ? 31.203 46.660 12.101 1.00 15.29 ? 65  LEU D CA  1 
ATOM   498  C C   . LEU A 1 65  ? 30.179 46.318 11.030 1.00 14.13 ? 65  LEU D C   1 
ATOM   499  O O   . LEU A 1 65  ? 30.539 45.909 9.920  1.00 14.81 ? 65  LEU D O   1 
ATOM   500  C CB  . LEU A 1 65  ? 31.270 45.557 13.160 1.00 15.80 ? 65  LEU D CB  1 
ATOM   501  C CG  . LEU A 1 65  ? 31.586 44.130 12.684 1.00 15.31 ? 65  LEU D CG  1 
ATOM   502  C CD1 . LEU A 1 65  ? 32.257 43.345 13.795 1.00 15.39 ? 65  LEU D CD1 1 
ATOM   503  C CD2 . LEU A 1 65  ? 30.330 43.377 12.217 1.00 18.06 ? 65  LEU D CD2 1 
ATOM   504  N N   . VAL A 1 66  ? 28.894 46.461 11.360 1.00 13.94 ? 66  VAL D N   1 
ATOM   505  C CA  . VAL A 1 66  ? 27.833 46.156 10.402 1.00 13.89 ? 66  VAL D CA  1 
ATOM   506  C C   . VAL A 1 66  ? 27.984 47.011 9.155  1.00 14.82 ? 66  VAL D C   1 
ATOM   507  O O   . VAL A 1 66  ? 27.890 46.516 8.025  1.00 15.12 ? 66  VAL D O   1 
ATOM   508  C CB  . VAL A 1 66  ? 26.450 46.348 11.048 1.00 13.54 ? 66  VAL D CB  1 
ATOM   509  C CG1 . VAL A 1 66  ? 25.362 46.279 9.988  1.00 15.22 ? 66  VAL D CG1 1 
ATOM   510  C CG2 . VAL A 1 66  ? 26.221 45.287 12.101 1.00 14.06 ? 66  VAL D CG2 1 
ATOM   511  N N   . GLU A 1 67  ? 28.206 48.313 9.347  1.00 14.22 ? 67  GLU D N   1 
ATOM   512  C CA  . GLU A 1 67  ? 28.359 49.218 8.214  1.00 16.11 ? 67  GLU D CA  1 
ATOM   513  C C   . GLU A 1 67  ? 29.494 48.766 7.306  1.00 18.72 ? 67  GLU D C   1 
ATOM   514  O O   . GLU A 1 67  ? 29.337 48.716 6.080  1.00 20.58 ? 67  GLU D O   1 
ATOM   515  C CB  . GLU A 1 67  ? 28.579 50.642 8.728  1.00 16.66 ? 67  GLU D CB  1 
ATOM   516  C CG  . GLU A 1 67  ? 27.297 51.273 9.276  1.00 17.60 ? 67  GLU D CG  1 
ATOM   517  C CD  . GLU A 1 67  ? 27.530 52.471 10.177 1.00 20.46 ? 67  GLU D CD  1 
ATOM   518  O OE1 . GLU A 1 67  ? 28.679 52.946 10.292 1.00 22.28 ? 67  GLU D OE1 1 
ATOM   519  O OE2 . GLU A 1 67  ? 26.543 52.931 10.781 1.00 20.06 ? 67  GLU D OE2 1 
ATOM   520  N N   . LYS A 1 68  ? 30.631 48.384 7.890  1.00 17.43 ? 68  LYS D N   1 
ATOM   521  C CA  . LYS A 1 68  ? 31.766 47.964 7.074  1.00 18.84 ? 68  LYS D CA  1 
ATOM   522  C C   . LYS A 1 68  ? 31.538 46.596 6.444  1.00 18.70 ? 68  LYS D C   1 
ATOM   523  O O   . LYS A 1 68  ? 31.872 46.383 5.274  1.00 21.52 ? 68  LYS D O   1 
ATOM   524  C CB  . LYS A 1 68  ? 33.049 47.983 7.905  1.00 19.41 ? 68  LYS D CB  1 
ATOM   525  C CG  . LYS A 1 68  ? 33.427 49.374 8.383  1.00 23.30 ? 68  LYS D CG  1 
ATOM   526  C CD  . LYS A 1 68  ? 34.793 49.397 9.046  1.00 28.07 ? 68  LYS D CD  1 
ATOM   527  C CE  . LYS A 1 68  ? 34.797 48.603 10.336 1.00 27.86 ? 68  LYS D CE  1 
ATOM   528  N NZ  . LYS A 1 68  ? 36.079 47.866 10.527 1.00 32.87 ? 68  LYS D NZ  1 
ATOM   529  N N   . VAL A 1 69  ? 30.966 45.657 7.197  1.00 17.22 ? 69  VAL D N   1 
ATOM   530  C CA  . VAL A 1 69  ? 30.799 44.301 6.684  1.00 16.31 ? 69  VAL D CA  1 
ATOM   531  C C   . VAL A 1 69  ? 29.766 44.261 5.565  1.00 15.89 ? 69  VAL D C   1 
ATOM   532  O O   . VAL A 1 69  ? 29.987 43.639 4.519  1.00 16.83 ? 69  VAL D O   1 
ATOM   533  C CB  . VAL A 1 69  ? 30.448 43.331 7.824  1.00 15.39 ? 69  VAL D CB  1 
ATOM   534  C CG1 . VAL A 1 69  ? 29.987 42.002 7.259  1.00 17.29 ? 69  VAL D CG1 1 
ATOM   535  C CG2 . VAL A 1 69  ? 31.651 43.130 8.741  1.00 15.43 ? 69  VAL D CG2 1 
ATOM   536  N N   . ALA A 1 70  ? 28.625 44.918 5.769  1.00 16.08 ? 70  ALA D N   1 
ATOM   537  C CA  . ALA A 1 70  ? 27.520 44.809 4.820  1.00 16.09 ? 70  ALA D CA  1 
ATOM   538  C C   . ALA A 1 70  ? 27.931 45.242 3.421  1.00 19.21 ? 70  ALA D C   1 
ATOM   539  O O   . ALA A 1 70  ? 27.453 44.683 2.428  1.00 17.55 ? 70  ALA D O   1 
ATOM   540  C CB  . ALA A 1 70  ? 26.331 45.634 5.302  1.00 19.43 ? 70  ALA D CB  1 
ATOM   541  N N   . GLU A 1 71  ? 28.819 46.230 3.317  1.00 18.52 ? 71  GLU D N   1 
ATOM   542  C CA  . GLU A 1 71  ? 29.173 46.736 1.998  1.00 22.71 ? 71  GLU D CA  1 
ATOM   543  C C   . GLU A 1 71  ? 30.222 45.889 1.292  1.00 22.63 ? 71  GLU D C   1 
ATOM   544  O O   . GLU A 1 71  ? 30.454 46.097 0.095  1.00 25.83 ? 71  GLU D O   1 
ATOM   545  C CB  . GLU A 1 71  ? 29.634 48.194 2.071  1.00 26.00 ? 71  GLU D CB  1 
ATOM   546  C CG  . GLU A 1 71  ? 30.834 48.441 2.953  1.00 26.53 ? 71  GLU D CG  1 
ATOM   547  C CD  . GLU A 1 71  ? 31.149 49.918 3.087  1.00 30.96 ? 71  GLU D CD  1 
ATOM   548  O OE1 . GLU A 1 71  ? 30.312 50.746 2.664  1.00 33.49 ? 71  GLU D OE1 1 
ATOM   549  O OE2 . GLU A 1 71  ? 32.232 50.254 3.613  1.00 35.89 ? 71  GLU D OE2 1 
ATOM   550  N N   . GLN A 1 72  ? 30.848 44.935 1.983  1.00 19.89 ? 72  GLN D N   1 
ATOM   551  C CA  . GLN A 1 72  ? 31.945 44.172 1.410  1.00 21.15 ? 72  GLN D CA  1 
ATOM   552  C C   . GLN A 1 72  ? 31.674 42.686 1.245  1.00 23.98 ? 72  GLN D C   1 
ATOM   553  O O   . GLN A 1 72  ? 32.377 42.040 0.460  1.00 25.69 ? 72  GLN D O   1 
ATOM   554  C CB  . GLN A 1 72  ? 33.215 44.339 2.256  1.00 23.40 ? 72  GLN D CB  1 
ATOM   555  C CG  . GLN A 1 72  ? 33.512 45.776 2.641  1.00 29.61 ? 72  GLN D CG  1 
ATOM   556  C CD  . GLN A 1 72  ? 34.569 46.414 1.768  1.00 34.47 ? 72  GLN D CD  1 
ATOM   557  O OE1 . GLN A 1 72  ? 35.763 46.323 2.056  1.00 35.98 ? 72  GLN D OE1 1 
ATOM   558  N NE2 . GLN A 1 72  ? 34.136 47.072 0.698  1.00 36.84 ? 72  GLN D NE2 1 
ATOM   559  N N   . ILE A 1 73  ? 30.706 42.117 1.954  1.00 18.49 ? 73  ILE D N   1 
ATOM   560  C CA  . ILE A 1 73  ? 30.479 40.679 1.879  1.00 22.26 ? 73  ILE D CA  1 
ATOM   561  C C   . ILE A 1 73  ? 29.170 40.396 1.163  1.00 20.98 ? 73  ILE D C   1 
ATOM   562  O O   . ILE A 1 73  ? 28.216 41.181 1.221  1.00 22.39 ? 73  ILE D O   1 
ATOM   563  C CB  . ILE A 1 73  ? 30.547 39.947 3.235  1.00 23.65 ? 73  ILE D CB  1 
ATOM   564  C CG1 . ILE A 1 73  ? 29.290 40.220 4.051  1.00 20.84 ? 73  ILE D CG1 1 
ATOM   565  C CG2 . ILE A 1 73  ? 31.798 40.347 3.999  1.00 22.66 ? 73  ILE D CG2 1 
ATOM   566  C CD1 . ILE A 1 73  ? 29.040 39.191 5.119  1.00 21.26 ? 73  ILE D CD1 1 
ATOM   567  N N   . ASP A 1 74  ? 29.126 39.242 0.502  1.00 16.82 ? 74  ASP D N   1 
ATOM   568  C CA  . ASP A 1 74  ? 28.022 38.885 -0.376 1.00 17.83 ? 74  ASP D CA  1 
ATOM   569  C C   . ASP A 1 74  ? 27.230 37.684 0.122  1.00 18.37 ? 74  ASP D C   1 
ATOM   570  O O   . ASP A 1 74  ? 26.422 37.132 -0.633 1.00 20.83 ? 74  ASP D O   1 
ATOM   571  C CB  . ASP A 1 74  ? 28.540 38.626 -1.791 1.00 21.08 ? 74  ASP D CB  1 
ATOM   572  C CG  . ASP A 1 74  ? 29.272 39.817 -2.361 1.00 29.23 ? 74  ASP D CG  1 
ATOM   573  O OD1 . ASP A 1 74  ? 28.732 40.941 -2.271 1.00 29.86 ? 74  ASP D OD1 1 
ATOM   574  O OD2 . ASP A 1 74  ? 30.393 39.629 -2.879 1.00 32.34 ? 74  ASP D OD2 1 
ATOM   575  N N   . ILE A 1 75  ? 27.454 37.256 1.354  1.00 14.33 ? 75  ILE D N   1 
ATOM   576  C CA  . ILE A 1 75  ? 26.640 36.213 1.979  1.00 12.58 ? 75  ILE D CA  1 
ATOM   577  C C   . ILE A 1 75  ? 25.913 36.847 3.153  1.00 10.85 ? 75  ILE D C   1 
ATOM   578  O O   . ILE A 1 75  ? 26.341 37.885 3.680  1.00 11.69 ? 75  ILE D O   1 
ATOM   579  C CB  . ILE A 1 75  ? 27.492 35.003 2.417  1.00 12.88 ? 75  ILE D CB  1 
ATOM   580  C CG1 . ILE A 1 75  ? 28.622 35.448 3.344  1.00 12.87 ? 75  ILE D CG1 1 
ATOM   581  C CG2 . ILE A 1 75  ? 28.007 34.250 1.204  1.00 15.50 ? 75  ILE D CG2 1 
ATOM   582  C CD1 . ILE A 1 75  ? 29.300 34.298 4.046  1.00 12.65 ? 75  ILE D CD1 1 
ATOM   583  N N   . PRO A 1 76  ? 24.807 36.247 3.585  1.00 11.28 ? 76  PRO D N   1 
ATOM   584  C CA  . PRO A 1 76  ? 24.061 36.821 4.707  1.00 10.22 ? 76  PRO D CA  1 
ATOM   585  C C   . PRO A 1 76  ? 24.872 36.773 5.987  1.00 9.38  ? 76  PRO D C   1 
ATOM   586  O O   . PRO A 1 76  ? 25.675 35.860 6.205  1.00 10.30 ? 76  PRO D O   1 
ATOM   587  C CB  . PRO A 1 76  ? 22.832 35.910 4.821  1.00 12.63 ? 76  PRO D CB  1 
ATOM   588  C CG  . PRO A 1 76  ? 22.680 35.302 3.477  1.00 12.69 ? 76  PRO D CG  1 
ATOM   589  C CD  . PRO A 1 76  ? 24.083 35.123 2.970  1.00 12.33 ? 76  PRO D CD  1 
ATOM   590  N N   . PHE A 1 77  ? 24.650 37.769 6.838  1.00 10.53 ? 77  PHE D N   1 
ATOM   591  C CA  . PHE A 1 77  ? 25.192 37.707 8.182  1.00 10.45 ? 77  PHE D CA  1 
ATOM   592  C C   . PHE A 1 77  ? 24.159 38.118 9.214  1.00 9.29  ? 77  PHE D C   1 
ATOM   593  O O   . PHE A 1 77  ? 23.278 38.957 8.973  1.00 9.39  ? 77  PHE D O   1 
ATOM   594  C CB  . PHE A 1 77  ? 26.510 38.459 8.371  1.00 10.46 ? 77  PHE D CB  1 
ATOM   595  C CG  . PHE A 1 77  ? 26.391 39.948 8.308  1.00 11.42 ? 77  PHE D CG  1 
ATOM   596  C CD1 . PHE A 1 77  ? 26.303 40.589 7.090  1.00 12.16 ? 77  PHE D CD1 1 
ATOM   597  C CD2 . PHE A 1 77  ? 26.400 40.713 9.459  1.00 13.06 ? 77  PHE D CD2 1 
ATOM   598  C CE1 . PHE A 1 77  ? 26.217 41.965 7.015  1.00 14.23 ? 77  PHE D CE1 1 
ATOM   599  C CE2 . PHE A 1 77  ? 26.313 42.094 9.390  1.00 14.55 ? 77  PHE D CE2 1 
ATOM   600  C CZ  . PHE A 1 77  ? 26.223 42.718 8.166  1.00 14.39 ? 77  PHE D CZ  1 
ATOM   601  N N   . THR A 1 78  ? 24.289 37.486 10.371 1.00 8.96  ? 78  THR D N   1 
ATOM   602  C CA  . THR A 1 78  ? 23.496 37.761 11.552 1.00 8.92  ? 78  THR D CA  1 
ATOM   603  C C   . THR A 1 78  ? 24.405 38.417 12.571 1.00 8.69  ? 78  THR D C   1 
ATOM   604  O O   . THR A 1 78  ? 25.598 38.123 12.640 1.00 10.01 ? 78  THR D O   1 
ATOM   605  C CB  . THR A 1 78  ? 23.007 36.441 12.146 1.00 9.80  ? 78  THR D CB  1 
ATOM   606  O OG1 . THR A 1 78  ? 22.177 35.774 11.192 1.00 10.14 ? 78  THR D OG1 1 
ATOM   607  C CG2 . THR A 1 78  ? 22.222 36.642 13.432 1.00 10.53 ? 78  THR D CG2 1 
ATOM   608  N N   . VAL A 1 79  ? 23.900 39.339 13.360 1.00 30.00 ? 79  VAL D N   1 
ATOM   609  C CA  . VAL A 1 79  ? 24.639 39.912 14.478 1.00 30.00 ? 79  VAL D CA  1 
ATOM   610  C C   . VAL A 1 79  ? 24.021 39.506 15.812 1.00 30.00 ? 79  VAL D C   1 
ATOM   611  O O   . VAL A 1 79  ? 22.810 39.745 16.022 1.00 30.00 ? 79  VAL D O   1 
ATOM   612  C CB  . VAL A 1 79  ? 24.688 41.449 14.394 1.00 30.00 ? 79  VAL D CB  1 
ATOM   613  C CG1 . VAL A 1 79  ? 25.355 42.030 15.631 1.00 30.00 ? 79  VAL D CG1 1 
ATOM   614  C CG2 . VAL A 1 79  ? 25.414 41.890 13.132 1.00 30.00 ? 79  VAL D CG2 1 
ATOM   615  N N   . GLY A 1 80  ? 24.583 39.227 16.730 1.00 10.86 ? 80  GLY D N   1 
ATOM   616  C CA  . GLY A 1 80  ? 23.980 38.931 18.011 1.00 12.99 ? 80  GLY D CA  1 
ATOM   617  C C   . GLY A 1 80  ? 24.899 39.340 19.138 1.00 11.74 ? 80  GLY D C   1 
ATOM   618  O O   . GLY A 1 80  ? 26.058 39.695 18.929 1.00 12.04 ? 80  GLY D O   1 
ATOM   619  N N   . GLY A 1 81  ? 24.353 39.274 20.347 1.00 13.96 ? 81  GLY D N   1 
ATOM   620  C CA  . GLY A 1 81  ? 25.128 39.494 21.549 1.00 15.57 ? 81  GLY D CA  1 
ATOM   621  C C   . GLY A 1 81  ? 24.712 40.768 22.246 1.00 19.68 ? 81  GLY D C   1 
ATOM   622  O O   . GLY A 1 81  ? 25.235 41.844 21.950 1.00 22.46 ? 81  GLY D O   1 
ATOM   623  N N   . GLY A 1 82  ? 23.756 40.659 23.162 1.00 16.84 ? 82  GLY D N   1 
ATOM   624  C CA  . GLY A 1 82  ? 23.315 41.811 23.916 1.00 19.12 ? 82  GLY D CA  1 
ATOM   625  C C   . GLY A 1 82  ? 22.420 42.769 23.167 1.00 17.19 ? 82  GLY D C   1 
ATOM   626  O O   . GLY A 1 82  ? 22.386 43.957 23.499 1.00 22.40 ? 82  GLY D O   1 
ATOM   627  N N   . ILE A 1 83  ? 21.700 42.297 22.153 1.00 16.27 ? 83  ILE D N   1 
ATOM   628  C CA  . ILE A 1 83  ? 20.684 43.109 21.494 1.00 14.64 ? 83  ILE D CA  1 
ATOM   629  C C   . ILE A 1 83  ? 19.473 43.118 22.415 1.00 14.56 ? 83  ILE D C   1 
ATOM   630  O O   . ILE A 1 83  ? 18.781 42.107 22.562 1.00 16.12 ? 83  ILE D O   1 
ATOM   631  C CB  . ILE A 1 83  ? 20.336 42.563 20.107 1.00 14.57 ? 83  ILE D CB  1 
ATOM   632  C CG1 . ILE A 1 83  ? 21.570 42.642 19.205 1.00 14.59 ? 83  ILE D CG1 1 
ATOM   633  C CG2 . ILE A 1 83  ? 19.148 43.321 19.524 1.00 14.59 ? 83  ILE D CG2 1 
ATOM   634  C CD1 . ILE A 1 83  ? 21.369 42.033 17.845 1.00 13.69 ? 83  ILE D CD1 1 
ATOM   635  N N   . HIS A 1 84  ? 19.235 44.255 23.064 1.00 16.27 ? 84  HIS D N   1 
ATOM   636  C CA  . HIS A 1 84  ? 18.292 44.329 24.171 1.00 18.34 ? 84  HIS D CA  1 
ATOM   637  C C   . HIS A 1 84  ? 16.920 44.865 23.789 1.00 15.96 ? 84  HIS D C   1 
ATOM   638  O O   . HIS A 1 84  ? 15.993 44.754 24.598 1.00 17.84 ? 84  HIS D O   1 
ATOM   639  C CB  . HIS A 1 84  ? 18.849 45.199 25.312 1.00 22.93 ? 84  HIS D CB  1 
ATOM   640  C CG  . HIS A 1 84  ? 20.208 44.791 25.791 1.00 23.23 ? 84  HIS D CG  1 
ATOM   641  N ND1 . HIS A 1 84  ? 20.494 43.512 26.218 1.00 24.77 ? 84  HIS D ND1 1 
ATOM   642  C CD2 . HIS A 1 84  ? 21.353 45.501 25.934 1.00 24.62 ? 84  HIS D CD2 1 
ATOM   643  C CE1 . HIS A 1 84  ? 21.760 43.447 26.589 1.00 24.56 ? 84  HIS D CE1 1 
ATOM   644  N NE2 . HIS A 1 84  ? 22.304 44.640 26.427 1.00 28.43 ? 84  HIS D NE2 1 
ATOM   645  N N   . ASP A 1 85  ? 16.753 45.463 22.612 1.00 14.42 ? 85  ASP D N   1 
ATOM   646  C CA  . ASP A 1 85  ? 15.486 46.128 22.344 1.00 14.82 ? 85  ASP D CA  1 
ATOM   647  C C   . ASP A 1 85  ? 15.296 46.306 20.846 1.00 13.71 ? 85  ASP D C   1 
ATOM   648  O O   . ASP A 1 85  ? 16.202 46.059 20.044 1.00 14.46 ? 85  ASP D O   1 
ATOM   649  C CB  . ASP A 1 85  ? 15.426 47.483 23.053 1.00 15.87 ? 85  ASP D CB  1 
ATOM   650  C CG  . ASP A 1 85  ? 16.708 48.258 22.901 1.00 19.47 ? 85  ASP D CG  1 
ATOM   651  O OD1 . ASP A 1 85  ? 17.130 48.462 21.750 1.00 17.34 ? 85  ASP D OD1 1 
ATOM   652  O OD2 . ASP A 1 85  ? 17.301 48.652 23.927 1.00 27.49 ? 85  ASP D OD2 1 
ATOM   653  N N   . PHE A 1 86  ? 14.096 46.765 20.489 1.00 13.15 ? 86  PHE D N   1 
ATOM   654  C CA  . PHE A 1 86  ? 13.744 46.932 19.086 1.00 13.73 ? 86  PHE D CA  1 
ATOM   655  C C   . PHE A 1 86  ? 14.627 47.967 18.401 1.00 13.38 ? 86  PHE D C   1 
ATOM   656  O O   . PHE A 1 86  ? 15.048 47.768 17.257 1.00 14.05 ? 86  PHE D O   1 
ATOM   657  C CB  . PHE A 1 86  ? 12.269 47.311 18.961 1.00 15.86 ? 86  PHE D CB  1 
ATOM   658  C CG  . PHE A 1 86  ? 11.845 47.614 17.555 1.00 15.00 ? 86  PHE D CG  1 
ATOM   659  C CD1 . PHE A 1 86  ? 11.488 46.595 16.689 1.00 16.90 ? 86  PHE D CD1 1 
ATOM   660  C CD2 . PHE A 1 86  ? 11.808 48.925 17.091 1.00 17.50 ? 86  PHE D CD2 1 
ATOM   661  C CE1 . PHE A 1 86  ? 11.101 46.863 15.399 1.00 18.01 ? 86  PHE D CE1 1 
ATOM   662  C CE2 . PHE A 1 86  ? 11.421 49.203 15.793 1.00 20.48 ? 86  PHE D CE2 1 
ATOM   663  C CZ  . PHE A 1 86  ? 11.070 48.170 14.942 1.00 20.41 ? 86  PHE D CZ  1 
ATOM   664  N N   . GLU A 1 87  ? 14.906 49.084 19.076 1.00 14.54 ? 87  GLU D N   1 
ATOM   665  C CA  . GLU A 1 87  ? 15.710 50.129 18.449 1.00 15.05 ? 87  GLU D CA  1 
ATOM   666  C C   . GLU A 1 87  ? 17.098 49.622 18.080 1.00 13.58 ? 87  GLU D C   1 
ATOM   667  O O   . GLU A 1 87  ? 17.604 49.912 16.991 1.00 14.00 ? 87  GLU D O   1 
ATOM   668  C CB  . GLU A 1 87  ? 15.795 51.350 19.364 1.00 15.07 ? 87  GLU D CB  1 
ATOM   669  C CG  . GLU A 1 87  ? 16.694 52.456 18.842 1.00 18.48 ? 87  GLU D CG  1 
ATOM   670  C CD  . GLU A 1 87  ? 16.285 52.973 17.476 1.00 20.67 ? 87  GLU D CD  1 
ATOM   671  O OE1 . GLU A 1 87  ? 15.087 52.922 17.136 1.00 23.71 ? 87  GLU D OE1 1 
ATOM   672  O OE2 . GLU A 1 87  ? 17.172 53.444 16.738 1.00 20.97 ? 87  GLU D OE2 1 
ATOM   673  N N   . THR A 1 88  ? 17.724 48.857 18.970 1.00 14.10 ? 88  THR D N   1 
ATOM   674  C CA  . THR A 1 88  ? 19.039 48.310 18.667 1.00 14.08 ? 88  THR D CA  1 
ATOM   675  C C   . THR A 1 88  ? 18.975 47.382 17.460 1.00 12.38 ? 88  THR D C   1 
ATOM   676  O O   . THR A 1 88  ? 19.804 47.468 16.548 1.00 13.06 ? 88  THR D O   1 
ATOM   677  C CB  . THR A 1 88  ? 19.578 47.569 19.889 1.00 15.42 ? 88  THR D CB  1 
ATOM   678  O OG1 . THR A 1 88  ? 19.611 48.465 21.011 1.00 16.50 ? 88  THR D OG1 1 
ATOM   679  C CG2 . THR A 1 88  ? 20.973 47.065 19.624 1.00 15.95 ? 88  THR D CG2 1 
ATOM   680  N N   . ALA A 1 89  ? 17.988 46.482 17.440 1.00 12.92 ? 89  ALA D N   1 
ATOM   681  C CA  . ALA A 1 89  ? 17.845 45.576 16.310 1.00 11.92 ? 89  ALA D CA  1 
ATOM   682  C C   . ALA A 1 89  ? 17.614 46.354 15.026 1.00 11.43 ? 89  ALA D C   1 
ATOM   683  O O   . ALA A 1 89  ? 18.224 46.061 13.991 1.00 12.17 ? 89  ALA D O   1 
ATOM   684  C CB  . ALA A 1 89  ? 16.674 44.631 16.561 1.00 13.49 ? 89  ALA D CB  1 
ATOM   685  N N   . SER A 1 90  ? 16.738 47.363 15.088 1.00 12.80 ? 90  SER D N   1 
ATOM   686  C CA  . SER A 1 90  ? 16.418 48.174 13.919 1.00 12.39 ? 90  SER D CA  1 
ATOM   687  C C   . SER A 1 90  ? 17.660 48.854 13.361 1.00 11.90 ? 90  SER D C   1 
ATOM   688  O O   . SER A 1 90  ? 17.895 48.847 12.147 1.00 12.87 ? 90  SER D O   1 
ATOM   689  C CB  . SER A 1 90  ? 15.376 49.221 14.305 1.00 13.69 ? 90  SER D CB  1 
ATOM   690  O OG  A SER A 1 90  ? 14.106 48.632 14.492 0.29 13.42 ? 90  SER D OG  1 
ATOM   691  O OG  B SER A 1 90  ? 15.133 50.118 13.238 0.71 15.29 ? 90  SER D OG  1 
ATOM   692  N N   . GLU A 1 91  ? 18.468 49.447 14.238 1.00 12.85 ? 91  GLU D N   1 
ATOM   693  C CA  . GLU A 1 91  ? 19.662 50.139 13.774 1.00 14.94 ? 91  GLU D CA  1 
ATOM   694  C C   . GLU A 1 91  ? 20.583 49.187 13.038 1.00 12.52 ? 91  GLU D C   1 
ATOM   695  O O   . GLU A 1 91  ? 21.146 49.530 11.992 1.00 13.13 ? 91  GLU D O   1 
ATOM   696  C CB  . GLU A 1 91  ? 20.400 50.770 14.949 1.00 14.19 ? 91  GLU D CB  1 
ATOM   697  C CG  . GLU A 1 91  ? 19.701 51.979 15.546 1.00 18.37 ? 91  GLU D CG  1 
ATOM   698  C CD  . GLU A 1 91  ? 20.301 52.411 16.871 1.00 21.55 ? 91  GLU D CD  1 
ATOM   699  O OE1 . GLU A 1 91  ? 21.431 51.986 17.188 1.00 23.82 ? 91  GLU D OE1 1 
ATOM   700  O OE2 . GLU A 1 91  ? 19.654 53.203 17.589 1.00 25.29 ? 91  GLU D OE2 1 
ATOM   701  N N   . LEU A 1 92  ? 20.733 47.976 13.566 1.00 11.46 ? 92  LEU D N   1 
ATOM   702  C CA  . LEU A 1 92  ? 21.637 47.011 12.954 1.00 10.79 ? 92  LEU D CA  1 
ATOM   703  C C   . LEU A 1 92  ? 21.134 46.579 11.583 1.00 10.87 ? 92  LEU D C   1 
ATOM   704  O O   . LEU A 1 92  ? 21.911 46.503 10.627 1.00 12.29 ? 92  LEU D O   1 
ATOM   705  C CB  . LEU A 1 92  ? 21.810 45.811 13.881 1.00 12.09 ? 92  LEU D CB  1 
ATOM   706  C CG  . LEU A 1 92  ? 22.560 46.154 15.170 1.00 13.39 ? 92  LEU D CG  1 
ATOM   707  C CD1 . LEU A 1 92  ? 22.285 45.129 16.262 1.00 15.05 ? 92  LEU D CD1 1 
ATOM   708  C CD2 . LEU A 1 92  ? 24.059 46.292 14.943 1.00 14.98 ? 92  LEU D CD2 1 
ATOM   709  N N   . ILE A 1 93  ? 19.845 46.267 11.474 1.00 11.44 ? 93  ILE D N   1 
ATOM   710  C CA  . ILE A 1 93  ? 19.310 45.842 10.185 1.00 11.41 ? 93  ILE D CA  1 
ATOM   711  C C   . ILE A 1 93  ? 19.379 46.979 9.179  1.00 12.01 ? 93  ILE D C   1 
ATOM   712  O O   . ILE A 1 93  ? 19.739 46.777 8.011  1.00 13.51 ? 93  ILE D O   1 
ATOM   713  C CB  . ILE A 1 93  ? 17.877 45.323 10.343 1.00 10.31 ? 93  ILE D CB  1 
ATOM   714  C CG1 . ILE A 1 93  ? 17.857 44.092 11.244 1.00 11.60 ? 93  ILE D CG1 1 
ATOM   715  C CG2 . ILE A 1 93  ? 17.292 44.994 8.977  1.00 13.98 ? 93  ILE D CG2 1 
ATOM   716  C CD1 . ILE A 1 93  ? 16.495 43.724 11.721 1.00 13.69 ? 93  ILE D CD1 1 
ATOM   717  N N   . LEU A 1 94  ? 19.026 48.191 9.611  1.00 12.65 ? 94  LEU D N   1 
ATOM   718  C CA  . LEU A 1 94  ? 19.036 49.327 8.697  1.00 13.71 ? 94  LEU D CA  1 
ATOM   719  C C   . LEU A 1 94  ? 20.432 49.607 8.172  1.00 15.16 ? 94  LEU D C   1 
ATOM   720  O O   . LEU A 1 94  ? 20.580 50.136 7.062  1.00 17.31 ? 94  LEU D O   1 
ATOM   721  C CB  . LEU A 1 94  ? 18.463 50.564 9.382  1.00 16.28 ? 94  LEU D CB  1 
ATOM   722  C CG  . LEU A 1 94  ? 16.956 50.507 9.628  1.00 16.51 ? 94  LEU D CG  1 
ATOM   723  C CD1 . LEU A 1 94  ? 16.517 51.600 10.587 1.00 17.29 ? 94  LEU D CD1 1 
ATOM   724  C CD2 . LEU A 1 94  ? 16.216 50.599 8.315  1.00 18.08 ? 94  LEU D CD2 1 
ATOM   725  N N   . ARG A 1 95  ? 21.461 49.284 8.944  1.00 14.31 ? 95  ARG D N   1 
ATOM   726  C CA  . ARG A 1 95  ? 22.824 49.480 8.481  1.00 13.90 ? 95  ARG D CA  1 
ATOM   727  C C   . ARG A 1 95  ? 23.351 48.322 7.651  1.00 14.54 ? 95  ARG D C   1 
ATOM   728  O O   . ARG A 1 95  ? 24.476 48.402 7.151  1.00 15.76 ? 95  ARG D O   1 
ATOM   729  C CB  . ARG A 1 95  ? 23.736 49.770 9.667  1.00 15.81 ? 95  ARG D CB  1 
ATOM   730  C CG  . ARG A 1 95  ? 23.588 51.194 10.170 1.00 19.48 ? 95  ARG D CG  1 
ATOM   731  C CD  . ARG A 1 95  ? 23.976 51.297 11.624 1.00 17.33 ? 95  ARG D CD  1 
ATOM   732  N NE  . ARG A 1 95  ? 23.724 52.623 12.183 1.00 18.17 ? 95  ARG D NE  1 
ATOM   733  C CZ  . ARG A 1 95  ? 22.517 53.131 12.402 1.00 18.12 ? 95  ARG D CZ  1 
ATOM   734  N NH1 . ARG A 1 95  ? 21.425 52.434 12.104 1.00 17.20 ? 95  ARG D NH1 1 
ATOM   735  N NH2 . ARG A 1 95  ? 22.401 54.348 12.922 1.00 19.92 ? 95  ARG D NH2 1 
ATOM   736  N N   . GLY A 1 96  ? 22.574 47.259 7.479  1.00 13.22 ? 96  GLY D N   1 
ATOM   737  C CA  . GLY A 1 96  ? 22.946 46.197 6.564  1.00 13.71 ? 96  GLY D CA  1 
ATOM   738  C C   . GLY A 1 96  ? 23.069 44.823 7.183  1.00 12.25 ? 96  GLY D C   1 
ATOM   739  O O   . GLY A 1 96  ? 23.379 43.876 6.452  1.00 12.74 ? 96  GLY D O   1 
ATOM   740  N N   . ALA A 1 97  ? 22.847 44.633 8.483  1.00 11.41 ? 97  ALA D N   1 
ATOM   741  C CA  . ALA A 1 97  ? 22.758 43.273 8.992  1.00 10.50 ? 97  ALA D CA  1 
ATOM   742  C C   . ALA A 1 97  ? 21.567 42.587 8.341  1.00 10.33 ? 97  ALA D C   1 
ATOM   743  O O   . ALA A 1 97  ? 20.475 43.149 8.272  1.00 11.46 ? 97  ALA D O   1 
ATOM   744  C CB  . ALA A 1 97  ? 22.601 43.277 10.514 1.00 11.24 ? 97  ALA D CB  1 
ATOM   745  N N   . ASP A 1 98  ? 21.774 41.371 7.840  1.00 9.62  ? 98  ASP D N   1 
ATOM   746  C CA  . ASP A 1 98  ? 20.651 40.656 7.255  1.00 10.06 ? 98  ASP D CA  1 
ATOM   747  C C   . ASP A 1 98  ? 19.720 40.124 8.319  1.00 9.69  ? 98  ASP D C   1 
ATOM   748  O O   . ASP A 1 98  ? 18.507 40.056 8.103  1.00 10.41 ? 98  ASP D O   1 
ATOM   749  C CB  . ASP A 1 98  ? 21.167 39.540 6.374  1.00 10.95 ? 98  ASP D CB  1 
ATOM   750  C CG  . ASP A 1 98  ? 22.111 40.068 5.332  1.00 10.53 ? 98  ASP D CG  1 
ATOM   751  O OD1 . ASP A 1 98  ? 21.642 40.790 4.418  1.00 13.21 ? 98  ASP D OD1 1 
ATOM   752  O OD2 . ASP A 1 98  ? 23.320 39.835 5.439  1.00 12.18 ? 98  ASP D OD2 1 
ATOM   753  N N   . LYS A 1 99  ? 20.264 39.755 9.473  1.00 9.31  ? 99  LYS D N   1 
ATOM   754  C CA  . LYS A 1 99  ? 19.463 39.209 10.549 1.00 9.21  ? 99  LYS D CA  1 
ATOM   755  C C   . LYS A 1 99  ? 20.051 39.672 11.863 1.00 8.13  ? 99  LYS D C   1 
ATOM   756  O O   . LYS A 1 99  ? 21.241 39.973 11.964 1.00 8.88  ? 99  LYS D O   1 
ATOM   757  C CB  . LYS A 1 99  ? 19.470 37.678 10.521 1.00 10.58 ? 99  LYS D CB  1 
ATOM   758  C CG  . LYS A 1 99  ? 19.154 37.067 9.172  1.00 11.98 ? 99  LYS D CG  1 
ATOM   759  C CD  . LYS A 1 99  ? 19.387 35.573 9.194  1.00 12.47 ? 99  LYS D CD  1 
ATOM   760  C CE  . LYS A 1 99  ? 19.249 34.926 7.826  1.00 15.29 ? 99  LYS D CE  1 
ATOM   761  N NZ  A LYS A 1 99  ? 19.650 33.492 7.860  0.73 16.51 ? 99  LYS D NZ  1 
ATOM   762  N NZ  B LYS A 1 99  ? 17.872 35.078 7.291  0.27 19.76 ? 99  LYS D NZ  1 
ATOM   763  N N   . VAL A 1 100 ? 19.201 39.706 12.872 1.00 8.77  ? 100 VAL D N   1 
ATOM   764  C CA  . VAL A 1 100 ? 19.651 39.904 14.238 1.00 8.60  ? 100 VAL D CA  1 
ATOM   765  C C   . VAL A 1 100 ? 19.259 38.691 15.045 1.00 8.57  ? 100 VAL D C   1 
ATOM   766  O O   . VAL A 1 100 ? 18.214 38.078 14.808 1.00 10.30 ? 100 VAL D O   1 
ATOM   767  C CB  . VAL A 1 100 ? 19.055 41.163 14.892 1.00 9.70  ? 100 VAL D CB  1 
ATOM   768  C CG1 . VAL A 1 100 ? 19.567 42.404 14.210 1.00 11.92 ? 100 VAL D CG1 1 
ATOM   769  C CG2 . VAL A 1 100 ? 17.536 41.116 14.864 1.00 12.98 ? 100 VAL D CG2 1 
ATOM   770  N N   . SER A 1 101 ? 20.096 38.361 16.016 1.00 8.43  ? 101 SER D N   1 
ATOM   771  C CA  . SER A 1 101 ? 19.832 37.276 16.945 1.00 9.40  ? 101 SER D CA  1 
ATOM   772  C C   . SER A 1 101 ? 19.486 37.877 18.297 1.00 9.72  ? 101 SER D C   1 
ATOM   773  O O   . SER A 1 101 ? 20.255 38.679 18.841 1.00 11.53 ? 101 SER D O   1 
ATOM   774  C CB  . SER A 1 101 ? 21.073 36.407 17.076 1.00 11.30 ? 101 SER D CB  1 
ATOM   775  O OG  . SER A 1 101 ? 20.882 35.375 18.021 1.00 12.75 ? 101 SER D OG  1 
ATOM   776  N N   . ILE A 1 102 ? 18.325 37.513 18.817 1.00 9.22  ? 102 ILE D N   1 
ATOM   777  C CA  . ILE A 1 102 ? 17.884 37.952 20.130 1.00 9.06  ? 102 ILE D CA  1 
ATOM   778  C C   . ILE A 1 102 ? 17.640 36.718 20.981 1.00 8.32  ? 102 ILE D C   1 
ATOM   779  O O   . ILE A 1 102 ? 17.237 35.661 20.486 1.00 8.67  ? 102 ILE D O   1 
ATOM   780  C CB  . ILE A 1 102 ? 16.627 38.848 20.056 1.00 10.84 ? 102 ILE D CB  1 
ATOM   781  C CG1 . ILE A 1 102 ? 15.501 38.160 19.286 1.00 11.04 ? 102 ILE D CG1 1 
ATOM   782  C CG2 . ILE A 1 102 ? 16.988 40.191 19.440 1.00 12.41 ? 102 ILE D CG2 1 
ATOM   783  C CD1 . ILE A 1 102 ? 14.210 38.959 19.241 1.00 12.86 ? 102 ILE D CD1 1 
ATOM   784  N N   . ASN A 1 103 ? 17.886 36.859 22.277 1.00 9.35  ? 103 ASN D N   1 
ATOM   785  C CA  . ASN A 1 103 ? 17.788 35.727 23.175 1.00 8.97  ? 103 ASN D CA  1 
ATOM   786  C C   . ASN A 1 103 ? 17.161 36.205 24.473 1.00 8.38  ? 103 ASN D C   1 
ATOM   787  O O   . ASN A 1 103 ? 15.944 36.141 24.627 1.00 8.99  ? 103 ASN D O   1 
ATOM   788  C CB  . ASN A 1 103 ? 19.177 35.156 23.419 1.00 12.28 ? 103 ASN D CB  1 
ATOM   789  C CG  . ASN A 1 103 ? 19.152 33.937 24.315 1.00 13.03 ? 103 ASN D CG  1 
ATOM   790  O OD1 . ASN A 1 103 ? 18.148 33.636 24.956 1.00 12.07 ? 103 ASN D OD1 1 
ATOM   791  N ND2 . ASN A 1 103 ? 20.257 33.191 24.321 1.00 19.21 ? 103 ASN D ND2 1 
ATOM   792  N N   . THR A 1 104 ? 17.972 36.723 25.394 1.00 8.11  ? 104 THR D N   1 
ATOM   793  C CA  . THR A 1 104 ? 17.424 37.168 26.671 1.00 9.02  ? 104 THR D CA  1 
ATOM   794  C C   . THR A 1 104 ? 16.316 38.188 26.461 1.00 9.21  ? 104 THR D C   1 
ATOM   795  O O   . THR A 1 104 ? 15.269 38.124 27.112 1.00 10.54 ? 104 THR D O   1 
ATOM   796  C CB  . THR A 1 104 ? 18.525 37.767 27.542 1.00 10.58 ? 104 THR D CB  1 
ATOM   797  O OG1 . THR A 1 104 ? 19.521 36.773 27.792 1.00 11.81 ? 104 THR D OG1 1 
ATOM   798  C CG2 . THR A 1 104 ? 17.959 38.265 28.873 1.00 12.50 ? 104 THR D CG2 1 
ATOM   799  N N   . ALA A 1 105 ? 16.513 39.125 25.537 1.00 10.42 ? 105 ALA D N   1 
ATOM   800  C CA  . ALA A 1 105 ? 15.498 40.149 25.310 1.00 11.36 ? 105 ALA D CA  1 
ATOM   801  C C   . ALA A 1 105 ? 14.213 39.555 24.754 1.00 11.68 ? 105 ALA D C   1 
ATOM   802  O O   . ALA A 1 105 ? 13.119 40.070 25.024 1.00 12.42 ? 105 ALA D O   1 
ATOM   803  C CB  . ALA A 1 105 ? 16.035 41.214 24.355 1.00 14.32 ? 105 ALA D CB  1 
ATOM   804  N N   . ALA A 1 106 ? 14.321 38.487 23.962 1.00 10.07 ? 106 ALA D N   1 
ATOM   805  C CA  . ALA A 1 106 ? 13.126 37.823 23.454 1.00 9.98  ? 106 ALA D CA  1 
ATOM   806  C C   . ALA A 1 106 ? 12.375 37.110 24.571 1.00 10.56 ? 106 ALA D C   1 
ATOM   807  O O   . ALA A 1 106 ? 11.144 37.184 24.652 1.00 10.51 ? 106 ALA D O   1 
ATOM   808  C CB  . ALA A 1 106 ? 13.509 36.825 22.366 1.00 10.48 ? 106 ALA D CB  1 
ATOM   809  N N   . VAL A 1 107 ? 13.097 36.370 25.413 1.00 9.17  ? 107 VAL D N   1 
ATOM   810  C CA  . VAL A 1 107 ? 12.459 35.683 26.534 1.00 10.06 ? 107 VAL D CA  1 
ATOM   811  C C   . VAL A 1 107 ? 11.713 36.676 27.407 1.00 11.15 ? 107 VAL D C   1 
ATOM   812  O O   . VAL A 1 107 ? 10.583 36.419 27.848 1.00 13.03 ? 107 VAL D O   1 
ATOM   813  C CB  . VAL A 1 107 ? 13.503 34.885 27.337 1.00 9.32  ? 107 VAL D CB  1 
ATOM   814  C CG1 . VAL A 1 107 ? 12.898 34.386 28.641 1.00 11.94 ? 107 VAL D CG1 1 
ATOM   815  C CG2 . VAL A 1 107 ? 14.016 33.738 26.510 1.00 10.17 ? 107 VAL D CG2 1 
ATOM   816  N N   . GLU A 1 108 ? 12.313 37.834 27.640 1.00 11.07 ? 108 GLU D N   1 
ATOM   817  C CA  . GLU A 1 108 ? 11.734 38.806 28.553 1.00 13.22 ? 108 GLU D CA  1 
ATOM   818  C C   . GLU A 1 108 ? 10.672 39.675 27.902 1.00 12.31 ? 108 GLU D C   1 
ATOM   819  O O   . GLU A 1 108 ? 9.910  40.338 28.618 1.00 13.50 ? 108 GLU D O   1 
ATOM   820  C CB  . GLU A 1 108 ? 12.854 39.630 29.181 1.00 14.94 ? 108 GLU D CB  1 
ATOM   821  C CG  . GLU A 1 108 ? 13.680 38.753 30.101 1.00 17.18 ? 108 GLU D CG  1 
ATOM   822  C CD  . GLU A 1 108 ? 14.833 39.459 30.769 1.00 17.55 ? 108 GLU D CD  1 
ATOM   823  O OE1 . GLU A 1 108 ? 15.090 40.636 30.443 1.00 21.16 ? 108 GLU D OE1 1 
ATOM   824  O OE2 . GLU A 1 108 ? 15.483 38.818 31.625 1.00 18.06 ? 108 GLU D OE2 1 
ATOM   825  N N   . ASN A 1 109 ? 10.576 39.660 26.579 1.00 11.70 ? 109 ASN D N   1 
ATOM   826  C CA  . ASN A 1 109 ? 9.577  40.444 25.863 1.00 11.31 ? 109 ASN D CA  1 
ATOM   827  C C   . ASN A 1 109 ? 9.317  39.739 24.544 1.00 11.50 ? 109 ASN D C   1 
ATOM   828  O O   . ASN A 1 109 ? 9.855  40.120 23.500 1.00 11.62 ? 109 ASN D O   1 
ATOM   829  C CB  . ASN A 1 109 ? 10.088 41.868 25.648 1.00 13.07 ? 109 ASN D CB  1 
ATOM   830  C CG  . ASN A 1 109 ? 9.136  42.726 24.847 1.00 13.21 ? 109 ASN D CG  1 
ATOM   831  O OD1 . ASN A 1 109 ? 7.924  42.500 24.833 1.00 15.56 ? 109 ASN D OD1 1 
ATOM   832  N ND2 . ASN A 1 109 ? 9.681  43.725 24.174 1.00 14.06 ? 109 ASN D ND2 1 
ATOM   833  N N   . PRO A 1 110 ? 8.509  38.676 24.557 1.00 10.20 ? 110 PRO D N   1 
ATOM   834  C CA  . PRO A 1 110 ? 8.346  37.876 23.331 1.00 11.89 ? 110 PRO D CA  1 
ATOM   835  C C   . PRO A 1 110 ? 7.815  38.648 22.136 1.00 10.60 ? 110 PRO D C   1 
ATOM   836  O O   . PRO A 1 110 ? 8.143  38.286 20.999 1.00 11.00 ? 110 PRO D O   1 
ATOM   837  C CB  . PRO A 1 110 ? 7.408  36.751 23.779 1.00 11.62 ? 110 PRO D CB  1 
ATOM   838  C CG  . PRO A 1 110 ? 7.725  36.596 25.250 1.00 13.45 ? 110 PRO D CG  1 
ATOM   839  C CD  . PRO A 1 110 ? 7.971  37.985 25.743 1.00 12.51 ? 110 PRO D CD  1 
ATOM   840  N N   . SER A 1 111 ? 7.024  39.705 22.345 1.00 11.40 ? 111 SER D N   1 
ATOM   841  C CA  . SER A 1 111 ? 6.550  40.467 21.199 1.00 12.32 ? 111 SER D CA  1 
ATOM   842  C C   . SER A 1 111 ? 7.662  41.257 20.532 1.00 11.60 ? 111 SER D C   1 
ATOM   843  O O   . SER A 1 111 ? 7.448  41.756 19.425 1.00 12.18 ? 111 SER D O   1 
ATOM   844  C CB  . SER A 1 111 ? 5.389  41.395 21.568 1.00 15.44 ? 111 SER D CB  1 
ATOM   845  O OG  . SER A 1 111 ? 5.779  42.324 22.553 1.00 16.94 ? 111 SER D OG  1 
ATOM   846  N N   . LEU A 1 112 ? 8.839  41.374 21.152 1.00 11.40 ? 112 LEU D N   1 
ATOM   847  C CA  . LEU A 1 112 ? 9.985  41.918 20.428 1.00 10.98 ? 112 LEU D CA  1 
ATOM   848  C C   . LEU A 1 112 ? 10.235 41.134 19.149 1.00 10.84 ? 112 LEU D C   1 
ATOM   849  O O   . LEU A 1 112 ? 10.558 41.717 18.107 1.00 11.03 ? 112 LEU D O   1 
ATOM   850  C CB  . LEU A 1 112 ? 11.231 41.880 21.305 1.00 11.59 ? 112 LEU D CB  1 
ATOM   851  C CG  . LEU A 1 112 ? 12.530 42.318 20.631 1.00 11.43 ? 112 LEU D CG  1 
ATOM   852  C CD1 . LEU A 1 112 ? 12.397 43.743 20.100 1.00 14.32 ? 112 LEU D CD1 1 
ATOM   853  C CD2 . LEU A 1 112 ? 13.685 42.212 21.613 1.00 13.54 ? 112 LEU D CD2 1 
ATOM   854  N N   . ILE A 1 113 ? 10.090 39.808 19.215 1.00 9.01  ? 113 ILE D N   1 
ATOM   855  C CA  . ILE A 1 113 ? 10.223 38.964 18.029 1.00 9.87  ? 113 ILE D CA  1 
ATOM   856  C C   . ILE A 1 113 ? 9.300  39.461 16.932 1.00 10.85 ? 113 ILE D C   1 
ATOM   857  O O   . ILE A 1 113 ? 9.710  39.667 15.783 1.00 10.91 ? 113 ILE D O   1 
ATOM   858  C CB  . ILE A 1 113 ? 9.881  37.507 18.383 1.00 9.74  ? 113 ILE D CB  1 
ATOM   859  C CG1 . ILE A 1 113 ? 10.840 36.926 19.424 1.00 9.87  ? 113 ILE D CG1 1 
ATOM   860  C CG2 . ILE A 1 113 ? 9.845  36.660 17.117 1.00 10.36 ? 113 ILE D CG2 1 
ATOM   861  C CD1 . ILE A 1 113 ? 10.299 35.654 20.086 1.00 10.65 ? 113 ILE D CD1 1 
ATOM   862  N N   . THR A 1 114 ? 8.023  39.628 17.283 1.00 10.69 ? 114 THR D N   1 
ATOM   863  C CA  . THR A 1 114 ? 7.003  40.004 16.313 1.00 11.72 ? 114 THR D CA  1 
ATOM   864  C C   . THR A 1 114 ? 7.257  41.400 15.770 1.00 12.54 ? 114 THR D C   1 
ATOM   865  O O   . THR A 1 114 ? 7.056  41.656 14.578 1.00 12.50 ? 114 THR D O   1 
ATOM   866  C CB  . THR A 1 114 ? 5.642  39.962 16.999 1.00 13.36 ? 114 THR D CB  1 
ATOM   867  O OG1 . THR A 1 114 ? 5.554  38.768 17.788 1.00 12.74 ? 114 THR D OG1 1 
ATOM   868  C CG2 . THR A 1 114 ? 4.513  40.003 15.973 1.00 17.69 ? 114 THR D CG2 1 
ATOM   869  N N   . GLN A 1 115 ? 7.702  42.313 16.629 1.00 11.94 ? 115 GLN D N   1 
ATOM   870  C CA  . GLN A 1 115 ? 7.970  43.676 16.185 1.00 12.77 ? 115 GLN D CA  1 
ATOM   871  C C   . GLN A 1 115 ? 9.055  43.705 15.126 1.00 12.53 ? 115 GLN D C   1 
ATOM   872  O O   . GLN A 1 115 ? 8.911  44.369 14.092 1.00 13.05 ? 115 GLN D O   1 
ATOM   873  C CB  . GLN A 1 115 ? 8.364  44.548 17.366 1.00 13.85 ? 115 GLN D CB  1 
ATOM   874  C CG  . GLN A 1 115 ? 7.240  44.744 18.350 1.00 16.34 ? 115 GLN D CG  1 
ATOM   875  C CD  . GLN A 1 115 ? 7.739  45.250 19.676 1.00 22.68 ? 115 GLN D CD  1 
ATOM   876  O OE1 . GLN A 1 115 ? 8.717  45.997 19.740 1.00 26.43 ? 115 GLN D OE1 1 
ATOM   877  N NE2 . GLN A 1 115 ? 7.080  44.838 20.751 1.00 22.28 ? 115 GLN D NE2 1 
ATOM   878  N N   . ILE A 1 116 ? 10.167 43.011 15.372 1.00 12.35 ? 116 ILE D N   1 
ATOM   879  C CA  . ILE A 1 116 ? 11.214 42.966 14.362 1.00 11.69 ? 116 ILE D CA  1 
ATOM   880  C C   . ILE A 1 116 ? 10.700 42.297 13.101 1.00 11.74 ? 116 ILE D C   1 
ATOM   881  O O   . ILE A 1 116 ? 10.931 42.783 11.988 1.00 12.52 ? 116 ILE D O   1 
ATOM   882  C CB  . ILE A 1 116 ? 12.484 42.292 14.906 1.00 12.59 ? 116 ILE D CB  1 
ATOM   883  C CG1 . ILE A 1 116 ? 12.979 43.011 16.155 1.00 11.51 ? 116 ILE D CG1 1 
ATOM   884  C CG2 . ILE A 1 116 ? 13.566 42.302 13.840 1.00 13.55 ? 116 ILE D CG2 1 
ATOM   885  C CD1 . ILE A 1 116 ? 14.014 42.219 16.942 1.00 12.49 ? 116 ILE D CD1 1 
ATOM   886  N N   . ALA A 1 117 ? 9.971  41.193 13.247 1.00 11.64 ? 117 ALA D N   1 
ATOM   887  C CA  . ALA A 1 117 ? 9.501  40.465 12.073 1.00 12.01 ? 117 ALA D CA  1 
ATOM   888  C C   . ALA A 1 117 ? 8.547  41.309 11.242 1.00 12.41 ? 117 ALA D C   1 
ATOM   889  O O   . ALA A 1 117 ? 8.587  41.273 10.004 1.00 12.77 ? 117 ALA D O   1 
ATOM   890  C CB  . ALA A 1 117 ? 8.811  39.175 12.505 1.00 12.27 ? 117 ALA D CB  1 
ATOM   891  N N   . GLN A 1 118 ? 7.656  42.045 11.901 1.00 12.84 ? 118 GLN D N   1 
ATOM   892  C CA  . GLN A 1 118 ? 6.678  42.832 11.157 1.00 15.11 ? 118 GLN D CA  1 
ATOM   893  C C   . GLN A 1 118 ? 7.340  43.982 10.413 1.00 15.42 ? 118 GLN D C   1 
ATOM   894  O O   . GLN A 1 118 ? 6.923  44.323 9.301  1.00 18.89 ? 118 GLN D O   1 
ATOM   895  C CB  . GLN A 1 118 ? 5.594  43.334 12.102 1.00 18.33 ? 118 GLN D CB  1 
ATOM   896  C CG  . GLN A 1 118 ? 4.527  42.291 12.357 1.00 20.24 ? 118 GLN D CG  1 
ATOM   897  C CD  . GLN A 1 118 ? 3.680  42.611 13.561 1.00 22.66 ? 118 GLN D CD  1 
ATOM   898  O OE1 . GLN A 1 118 ? 4.003  43.514 14.336 1.00 20.64 ? 118 GLN D OE1 1 
ATOM   899  N NE2 . GLN A 1 118 ? 2.587  41.874 13.731 1.00 25.39 ? 118 GLN D NE2 1 
ATOM   900  N N   . THR A 1 119 ? 8.376  44.583 10.993 1.00 14.19 ? 119 THR D N   1 
ATOM   901  C CA  . THR A 1 119 ? 9.016  45.716 10.338 1.00 14.11 ? 119 THR D CA  1 
ATOM   902  C C   . THR A 1 119 ? 9.955  45.258 9.233  1.00 13.96 ? 119 THR D C   1 
ATOM   903  O O   . THR A 1 119 ? 9.936  45.809 8.123  1.00 16.10 ? 119 THR D O   1 
ATOM   904  C CB  . THR A 1 119 ? 9.796  46.525 11.370 1.00 17.05 ? 119 THR D CB  1 
ATOM   905  O OG1 . THR A 1 119 ? 8.897  47.001 12.384 1.00 22.10 ? 119 THR D OG1 1 
ATOM   906  C CG2 . THR A 1 119 ? 10.489 47.705 10.703 1.00 18.63 ? 119 THR D CG2 1 
ATOM   907  N N   . PHE A 1 120 ? 10.759 44.231 9.507  1.00 11.84 ? 120 PHE D N   1 
ATOM   908  C CA  . PHE A 1 120 ? 11.865 43.862 8.640  1.00 12.50 ? 120 PHE D CA  1 
ATOM   909  C C   . PHE A 1 120 ? 11.664 42.531 7.945  1.00 12.45 ? 120 PHE D C   1 
ATOM   910  O O   . PHE A 1 120 ? 12.509 42.136 7.131  1.00 14.54 ? 120 PHE D O   1 
ATOM   911  C CB  . PHE A 1 120 ? 13.168 43.834 9.440  1.00 12.83 ? 120 PHE D CB  1 
ATOM   912  C CG  . PHE A 1 120 ? 13.542 45.160 10.005 1.00 11.50 ? 120 PHE D CG  1 
ATOM   913  C CD1 . PHE A 1 120 ? 14.100 46.134 9.203  1.00 13.89 ? 120 PHE D CD1 1 
ATOM   914  C CD2 . PHE A 1 120 ? 13.329 45.440 11.344 1.00 12.88 ? 120 PHE D CD2 1 
ATOM   915  C CE1 . PHE A 1 120 ? 14.452 47.363 9.731  1.00 16.02 ? 120 PHE D CE1 1 
ATOM   916  C CE2 . PHE A 1 120 ? 13.674 46.672 11.875 1.00 14.17 ? 120 PHE D CE2 1 
ATOM   917  C CZ  . PHE A 1 120 ? 14.234 47.635 11.064 1.00 15.65 ? 120 PHE D CZ  1 
ATOM   918  N N   . GLY A 1 121 ? 10.573 41.837 8.237  1.00 12.25 ? 121 GLY D N   1 
ATOM   919  C CA  . GLY A 1 121 ? 10.365 40.505 7.716  1.00 12.16 ? 121 GLY D CA  1 
ATOM   920  C C   . GLY A 1 121 ? 10.820 39.462 8.713  1.00 11.16 ? 121 GLY D C   1 
ATOM   921  O O   . GLY A 1 121 ? 11.802 39.665 9.430  1.00 11.09 ? 121 GLY D O   1 
ATOM   922  N N   . SER A 1 122 ? 10.110 38.335 8.765  1.00 11.23 ? 122 SER D N   1 
ATOM   923  C CA  . SER A 1 122 ? 10.467 37.281 9.708  1.00 11.56 ? 122 SER D CA  1 
ATOM   924  C C   . SER A 1 122 ? 11.880 36.774 9.488  1.00 10.97 ? 122 SER D C   1 
ATOM   925  O O   . SER A 1 122 ? 12.542 36.363 10.449 1.00 11.43 ? 122 SER D O   1 
ATOM   926  C CB  . SER A 1 122 ? 9.475  36.130 9.590  1.00 12.20 ? 122 SER D CB  1 
ATOM   927  O OG  A SER A 1 122 ? 8.312  36.404 10.349 0.51 13.92 ? 122 SER D OG  1 
ATOM   928  O OG  B SER A 1 122 ? 9.585  35.511 8.314  0.49 13.68 ? 122 SER D OG  1 
ATOM   929  N N   . GLN A 1 123 ? 12.362 36.783 8.245  1.00 12.10 ? 123 GLN D N   1 
ATOM   930  C CA  . GLN A 1 123 ? 13.688 36.240 7.985  1.00 13.35 ? 123 GLN D CA  1 
ATOM   931  C C   . GLN A 1 123 ? 14.783 37.053 8.655  1.00 12.97 ? 123 GLN D C   1 
ATOM   932  O O   . GLN A 1 123 ? 15.908 36.558 8.788  1.00 14.60 ? 123 GLN D O   1 
ATOM   933  C CB  . GLN A 1 123 ? 13.928 36.135 6.480  1.00 15.29 ? 123 GLN D CB  1 
ATOM   934  C CG  . GLN A 1 123 ? 12.995 35.146 5.801  1.00 24.24 ? 123 GLN D CG  1 
ATOM   935  C CD  . GLN A 1 123 ? 12.720 35.495 4.350  1.00 29.39 ? 123 GLN D CD  1 
ATOM   936  O OE1 . GLN A 1 123 ? 11.765 36.214 4.038  1.00 30.20 ? 123 GLN D OE1 1 
ATOM   937  N NE2 . GLN A 1 123 ? 13.549 34.977 3.454  1.00 27.77 ? 123 GLN D NE2 1 
ATOM   938  N N   . ALA A 1 124 ? 14.482 38.276 9.087  1.00 11.64 ? 124 ALA D N   1 
ATOM   939  C CA  . ALA A 1 124 ? 15.472 39.088 9.769  1.00 11.66 ? 124 ALA D CA  1 
ATOM   940  C C   . ALA A 1 124 ? 15.595 38.763 11.243 1.00 11.99 ? 124 ALA D C   1 
ATOM   941  O O   . ALA A 1 124 ? 16.480 39.319 11.899 1.00 11.74 ? 124 ALA D O   1 
ATOM   942  C CB  . ALA A 1 124 ? 15.125 40.567 9.628  1.00 12.48 ? 124 ALA D CB  1 
ATOM   943  N N   . VAL A 1 125 ? 14.737 37.911 11.790 1.00 10.57 ? 125 VAL D N   1 
ATOM   944  C CA  . VAL A 1 125 ? 14.746 37.661 13.224 1.00 10.72 ? 125 VAL D CA  1 
ATOM   945  C C   . VAL A 1 125 ? 15.135 36.218 13.498 1.00 10.58 ? 125 VAL D C   1 
ATOM   946  O O   . VAL A 1 125 ? 14.417 35.274 13.147 1.00 11.94 ? 125 VAL D O   1 
ATOM   947  C CB  . VAL A 1 125 ? 13.445 38.085 13.924 1.00 16.25 ? 125 VAL D CB  1 
ATOM   948  C CG1 . VAL A 1 125 ? 12.225 37.481 13.286 1.00 20.32 ? 125 VAL D CG1 1 
ATOM   949  C CG2 . VAL A 1 125 ? 13.505 37.747 15.399 1.00 16.59 ? 125 VAL D CG2 1 
ATOM   950  N N   . VAL A 1 126 ? 16.290 36.071 14.122 1.00 8.27  ? 126 VAL D N   1 
ATOM   951  C CA  . VAL A 1 126 ? 16.783 34.797 14.617 1.00 8.15  ? 126 VAL D CA  1 
ATOM   952  C C   . VAL A 1 126 ? 16.596 34.827 16.127 1.00 8.44  ? 126 VAL D C   1 
ATOM   953  O O   . VAL A 1 126 ? 17.063 35.759 16.792 1.00 9.33  ? 126 VAL D O   1 
ATOM   954  C CB  . VAL A 1 126 ? 18.262 34.626 14.259 1.00 7.98  ? 126 VAL D CB  1 
ATOM   955  C CG1 . VAL A 1 126 ? 18.831 33.363 14.895 1.00 11.18 ? 126 VAL D CG1 1 
ATOM   956  C CG2 . VAL A 1 126 ? 18.432 34.602 12.756 1.00 9.26  ? 126 VAL D CG2 1 
ATOM   957  N N   . VAL A 1 127 ? 15.876 33.866 16.688 1.00 7.82  ? 127 VAL D N   1 
ATOM   958  C CA  . VAL A 1 127 ? 15.804 33.745 18.136 1.00 7.98  ? 127 VAL D CA  1 
ATOM   959  C C   . VAL A 1 127 ? 16.820 32.700 18.544 1.00 7.42  ? 127 VAL D C   1 
ATOM   960  O O   . VAL A 1 127 ? 16.724 31.531 18.151 1.00 7.28  ? 127 VAL D O   1 
ATOM   961  C CB  . VAL A 1 127 ? 14.398 33.405 18.628 1.00 8.47  ? 127 VAL D CB  1 
ATOM   962  C CG1 . VAL A 1 127 ? 14.441 33.174 20.133 1.00 9.26  ? 127 VAL D CG1 1 
ATOM   963  C CG2 . VAL A 1 127 ? 13.447 34.536 18.287 1.00 10.29 ? 127 VAL D CG2 1 
ATOM   964  N N   . ALA A 1 128 ? 17.825 33.146 19.282 1.00 7.62  ? 128 ALA D N   1 
ATOM   965  C CA  . ALA A 1 128 ? 18.818 32.250 19.840 1.00 7.93  ? 128 ALA D CA  1 
ATOM   966  C C   . ALA A 1 128 ? 18.249 31.682 21.126 1.00 7.59  ? 128 ALA D C   1 
ATOM   967  O O   . ALA A 1 128 ? 17.856 32.435 22.026 1.00 8.62  ? 128 ALA D O   1 
ATOM   968  C CB  . ALA A 1 128 ? 20.111 33.013 20.097 1.00 10.07 ? 128 ALA D CB  1 
ATOM   969  N N   . ILE A 1 129 ? 18.165 30.366 21.200 1.00 7.90  ? 129 ILE D N   1 
ATOM   970  C CA  . ILE A 1 129 ? 17.706 29.658 22.381 1.00 8.60  ? 129 ILE D CA  1 
ATOM   971  C C   . ILE A 1 129 ? 18.878 28.860 22.896 1.00 8.06  ? 129 ILE D C   1 
ATOM   972  O O   . ILE A 1 129 ? 19.379 27.968 22.201 1.00 9.19  ? 129 ILE D O   1 
ATOM   973  C CB  . ILE A 1 129 ? 16.520 28.732 22.071 1.00 9.05  ? 129 ILE D CB  1 
ATOM   974  C CG1 . ILE A 1 129 ? 15.388 29.504 21.390 1.00 9.75  ? 129 ILE D CG1 1 
ATOM   975  C CG2 . ILE A 1 129 ? 16.065 28.041 23.346 1.00 9.99  ? 129 ILE D CG2 1 
ATOM   976  C CD1 . ILE A 1 129 ? 14.209 28.619 20.991 1.00 9.24  ? 129 ILE D CD1 1 
ATOM   977  N N   . ASP A 1 130 ? 19.322 29.194 24.098 1.00 8.66  ? 130 ASP D N   1 
ATOM   978  C CA  . ASP A 1 130 ? 20.352 28.443 24.790 1.00 8.78  ? 130 ASP D CA  1 
ATOM   979  C C   . ASP A 1 130 ? 19.646 27.527 25.766 1.00 9.38  ? 130 ASP D C   1 
ATOM   980  O O   . ASP A 1 130 ? 18.806 27.980 26.549 1.00 10.22 ? 130 ASP D O   1 
ATOM   981  C CB  . ASP A 1 130 ? 21.244 29.379 25.597 1.00 9.41  ? 130 ASP D CB  1 
ATOM   982  C CG  . ASP A 1 130 ? 22.048 30.323 24.734 1.00 11.16 ? 130 ASP D CG  1 
ATOM   983  O OD1 . ASP A 1 130 ? 22.166 30.106 23.518 1.00 12.37 ? 130 ASP D OD1 1 
ATOM   984  O OD2 . ASP A 1 130 ? 22.561 31.316 25.290 1.00 14.88 ? 130 ASP D OD2 1 
ATOM   985  N N   . ALA A 1 131 ? 19.953 26.245 25.701 1.00 8.56  ? 131 ALA D N   1 
ATOM   986  C CA  . ALA A 1 131 ? 19.255 25.283 26.532 1.00 8.36  ? 131 ALA D CA  1 
ATOM   987  C C   . ALA A 1 131 ? 20.235 24.308 27.156 1.00 8.23  ? 131 ALA D C   1 
ATOM   988  O O   . ALA A 1 131 ? 21.336 24.081 26.652 1.00 9.09  ? 131 ALA D O   1 
ATOM   989  C CB  . ALA A 1 131 ? 18.192 24.521 25.739 1.00 10.75 ? 131 ALA D CB  1 
ATOM   990  N N   . LYS A 1 132 ? 19.793 23.732 28.272 1.00 8.87  ? 132 LYS D N   1 
ATOM   991  C CA  . LYS A 1 132 ? 20.473 22.659 28.983 1.00 9.71  ? 132 LYS D CA  1 
ATOM   992  C C   . LYS A 1 132 ? 19.420 21.664 29.427 1.00 9.40  ? 132 LYS D C   1 
ATOM   993  O O   . LYS A 1 132 ? 18.272 22.030 29.694 1.00 9.51  ? 132 LYS D O   1 
ATOM   994  C CB  . LYS A 1 132 ? 21.190 23.145 30.261 1.00 10.94 ? 132 LYS D CB  1 
ATOM   995  C CG  . LYS A 1 132 ? 22.168 24.270 30.044 1.00 10.77 ? 132 LYS D CG  1 
ATOM   996  C CD  . LYS A 1 132 ? 23.039 24.437 31.271 1.00 12.42 ? 132 LYS D CD  1 
ATOM   997  C CE  . LYS A 1 132 ? 24.011 25.571 31.102 1.00 14.47 ? 132 LYS D CE  1 
ATOM   998  N NZ  . LYS A 1 132 ? 25.296 25.211 31.752 1.00 12.08 ? 132 LYS D NZ  1 
ATOM   999  N N   . ARG A 1 133 ? 19.837 20.411 29.552 1.00 9.88  ? 133 ARG D N   1 
ATOM   1000 C CA  . ARG A 1 133 ? 18.980 19.414 30.172 1.00 10.84 ? 133 ARG D CA  1 
ATOM   1001 C C   . ARG A 1 133 ? 19.132 19.534 31.685 1.00 12.11 ? 133 ARG D C   1 
ATOM   1002 O O   . ARG A 1 133 ? 20.246 19.439 32.219 1.00 13.92 ? 133 ARG D O   1 
ATOM   1003 C CB  . ARG A 1 133 ? 19.304 18.018 29.654 1.00 14.27 ? 133 ARG D CB  1 
ATOM   1004 C CG  . ARG A 1 133 ? 18.505 16.933 30.338 1.00 22.03 ? 133 ARG D CG  1 
ATOM   1005 C CD  . ARG A 1 133 ? 18.812 15.536 29.802 1.00 25.69 ? 133 ARG D CD  1 
ATOM   1006 N NE  . ARG A 1 133 ? 18.461 14.479 30.739 1.00 34.79 ? 133 ARG D NE  1 
ATOM   1007 C CZ  . ARG A 1 133 ? 19.012 14.294 31.939 1.00 31.18 ? 133 ARG D CZ  1 
ATOM   1008 N NH1 . ARG A 1 133 ? 20.011 15.079 32.349 1.00 33.94 ? 133 ARG D NH1 1 
ATOM   1009 N NH2 . ARG A 1 133 ? 18.604 13.314 32.729 1.00 34.15 ? 133 ARG D NH2 1 
ATOM   1010 N N   . VAL A 1 134 ? 18.019 19.796 32.362 1.00 11.78 ? 134 VAL D N   1 
ATOM   1011 C CA  . VAL A 1 134 ? 17.973 20.023 33.800 1.00 12.24 ? 134 VAL D CA  1 
ATOM   1012 C C   . VAL A 1 134 ? 17.106 18.912 34.367 1.00 12.13 ? 134 VAL D C   1 
ATOM   1013 O O   . VAL A 1 134 ? 15.893 18.893 34.140 1.00 12.05 ? 134 VAL D O   1 
ATOM   1014 C CB  . VAL A 1 134 ? 17.367 21.394 34.126 1.00 11.47 ? 134 VAL D CB  1 
ATOM   1015 C CG1 . VAL A 1 134 ? 17.307 21.621 35.629 1.00 13.29 ? 134 VAL D CG1 1 
ATOM   1016 C CG2 . VAL A 1 134 ? 18.157 22.506 33.439 1.00 12.58 ? 134 VAL D CG2 1 
ATOM   1017 N N   . ASP A 1 135 ? 17.714 17.983 35.104 1.00 15.73 ? 135 ASP D N   1 
ATOM   1018 C CA  . ASP A 1 135 ? 16.975 16.843 35.652 1.00 16.91 ? 135 ASP D CA  1 
ATOM   1019 C C   . ASP A 1 135 ? 16.108 16.183 34.588 1.00 15.23 ? 135 ASP D C   1 
ATOM   1020 O O   . ASP A 1 135 ? 14.925 15.925 34.796 1.00 17.29 ? 135 ASP D O   1 
ATOM   1021 C CB  . ASP A 1 135 ? 16.101 17.260 36.835 1.00 19.77 ? 135 ASP D CB  1 
ATOM   1022 C CG  . ASP A 1 135 ? 16.863 17.374 38.118 1.00 24.85 ? 135 ASP D CG  1 
ATOM   1023 O OD1 . ASP A 1 135 ? 17.950 16.768 38.228 1.00 29.04 ? 135 ASP D OD1 1 
ATOM   1024 O OD2 . ASP A 1 135 ? 16.365 18.067 39.031 1.00 30.32 ? 135 ASP D OD2 1 
ATOM   1025 N N   . GLY A 1 136 ? 16.677 15.972 33.404 1.00 15.54 ? 136 GLY D N   1 
ATOM   1026 C CA  . GLY A 1 136 ? 15.936 15.267 32.380 1.00 14.84 ? 136 GLY D CA  1 
ATOM   1027 C C   . GLY A 1 136 ? 14.994 16.098 31.534 1.00 14.28 ? 136 GLY D C   1 
ATOM   1028 O O   . GLY A 1 136 ? 14.309 15.531 30.676 1.00 16.04 ? 136 GLY D O   1 
ATOM   1029 N N   . GLU A 1 137 ? 14.929 17.414 31.739 1.00 12.09 ? 137 GLU D N   1 
ATOM   1030 C CA  . GLU A 1 137 ? 14.042 18.267 30.959 1.00 10.58 ? 137 GLU D CA  1 
ATOM   1031 C C   . GLU A 1 137 ? 14.844 19.403 30.356 1.00 9.96  ? 137 GLU D C   1 
ATOM   1032 O O   . GLU A 1 137 ? 15.591 20.080 31.060 1.00 10.05 ? 137 GLU D O   1 
ATOM   1033 C CB  . GLU A 1 137 ? 12.934 18.844 31.827 1.00 10.87 ? 137 GLU D CB  1 
ATOM   1034 C CG  . GLU A 1 137 ? 11.968 17.805 32.321 1.00 13.51 ? 137 GLU D CG  1 
ATOM   1035 C CD  . GLU A 1 137 ? 10.896 18.423 33.161 1.00 14.19 ? 137 GLU D CD  1 
ATOM   1036 O OE1 . GLU A 1 137 ? 11.133 18.576 34.370 1.00 17.99 ? 137 GLU D OE1 1 
ATOM   1037 O OE2 . GLU A 1 137 ? 9.836  18.791 32.622 1.00 15.31 ? 137 GLU D OE2 1 
ATOM   1038 N N   . PHE A 1 138 ? 14.668 19.638 29.066 1.00 8.86  ? 138 PHE D N   1 
ATOM   1039 C CA  . PHE A 1 138 ? 15.348 20.757 28.424 1.00 8.51  ? 138 PHE D CA  1 
ATOM   1040 C C   . PHE A 1 138 ? 14.722 22.067 28.872 1.00 8.40  ? 138 PHE D C   1 
ATOM   1041 O O   . PHE A 1 138 ? 13.512 22.269 28.726 1.00 9.24  ? 138 PHE D O   1 
ATOM   1042 C CB  . PHE A 1 138 ? 15.256 20.639 26.916 1.00 9.12  ? 138 PHE D CB  1 
ATOM   1043 C CG  . PHE A 1 138 ? 16.128 19.575 26.349 1.00 9.20  ? 138 PHE D CG  1 
ATOM   1044 C CD1 . PHE A 1 138 ? 17.506 19.652 26.448 1.00 10.47 ? 138 PHE D CD1 1 
ATOM   1045 C CD2 . PHE A 1 138 ? 15.567 18.510 25.673 1.00 11.12 ? 138 PHE D CD2 1 
ATOM   1046 C CE1 . PHE A 1 138 ? 18.308 18.667 25.899 1.00 11.60 ? 138 PHE D CE1 1 
ATOM   1047 C CE2 . PHE A 1 138 ? 16.367 17.519 25.129 1.00 12.62 ? 138 PHE D CE2 1 
ATOM   1048 C CZ  . PHE A 1 138 ? 17.739 17.602 25.246 1.00 12.06 ? 138 PHE D CZ  1 
ATOM   1049 N N   . MET A 1 139 ? 15.553 22.966 29.393 1.00 8.66  ? 139 MET D N   1 
ATOM   1050 C CA  . MET A 1 139 ? 15.119 24.259 29.894 1.00 9.06  ? 139 MET D CA  1 
ATOM   1051 C C   . MET A 1 139 ? 15.887 25.375 29.210 1.00 7.62  ? 139 MET D C   1 
ATOM   1052 O O   . MET A 1 139 ? 17.036 25.201 28.804 1.00 9.04  ? 139 MET D O   1 
ATOM   1053 C CB  . MET A 1 139 ? 15.348 24.365 31.393 1.00 9.79  ? 139 MET D CB  1 
ATOM   1054 C CG  . MET A 1 139 ? 14.553 23.347 32.140 1.00 11.51 ? 139 MET D CG  1 
ATOM   1055 S SD  . MET A 1 139 ? 14.227 23.680 33.851 1.00 16.64 ? 139 MET D SD  1 
ATOM   1056 C CE  . MET A 1 139 ? 13.539 22.071 34.258 1.00 24.54 ? 139 MET D CE  1 
ATOM   1057 N N   . VAL A 1 140 ? 15.241 26.522 29.130 1.00 8.74  ? 140 VAL D N   1 
ATOM   1058 C CA  . VAL A 1 140 ? 15.785 27.709 28.483 1.00 8.66  ? 140 VAL D CA  1 
ATOM   1059 C C   . VAL A 1 140 ? 16.601 28.503 29.492 1.00 8.48  ? 140 VAL D C   1 
ATOM   1060 O O   . VAL A 1 140 ? 16.120 28.806 30.593 1.00 9.37  ? 140 VAL D O   1 
ATOM   1061 C CB  . VAL A 1 140 ? 14.639 28.566 27.927 1.00 9.13  ? 140 VAL D CB  1 
ATOM   1062 C CG1 . VAL A 1 140 ? 15.161 29.876 27.342 1.00 10.93 ? 140 VAL D CG1 1 
ATOM   1063 C CG2 . VAL A 1 140 ? 13.874 27.767 26.886 1.00 10.40 ? 140 VAL D CG2 1 
ATOM   1064 N N   . PHE A 1 141 ? 17.825 28.862 29.119 1.00 8.05  ? 141 PHE D N   1 
ATOM   1065 C CA  . PHE A 1 141 ? 18.713 29.656 29.952 1.00 8.91  ? 141 PHE D CA  1 
ATOM   1066 C C   . PHE A 1 141 ? 18.975 30.992 29.286 1.00 9.52  ? 141 PHE D C   1 
ATOM   1067 O O   . PHE A 1 141 ? 19.200 31.053 28.074 1.00 9.82  ? 141 PHE D O   1 
ATOM   1068 C CB  . PHE A 1 141 ? 20.046 28.960 30.155 1.00 10.13 ? 141 PHE D CB  1 
ATOM   1069 C CG  . PHE A 1 141 ? 20.005 27.879 31.181 1.00 10.09 ? 141 PHE D CG  1 
ATOM   1070 C CD1 . PHE A 1 141 ? 19.278 26.723 30.960 1.00 10.60 ? 141 PHE D CD1 1 
ATOM   1071 C CD2 . PHE A 1 141 ? 20.671 28.025 32.383 1.00 11.21 ? 141 PHE D CD2 1 
ATOM   1072 C CE1 . PHE A 1 141 ? 19.231 25.716 31.909 1.00 11.57 ? 141 PHE D CE1 1 
ATOM   1073 C CE2 . PHE A 1 141 ? 20.631 27.019 33.346 1.00 12.57 ? 141 PHE D CE2 1 
ATOM   1074 C CZ  . PHE A 1 141 ? 19.908 25.863 33.107 1.00 12.58 ? 141 PHE D CZ  1 
ATOM   1075 N N   . THR A 1 142 ? 18.953 32.055 30.076 1.00 9.19  ? 142 THR D N   1 
ATOM   1076 C CA  . THR A 1 142 ? 19.252 33.393 29.593 1.00 10.19 ? 142 THR D CA  1 
ATOM   1077 C C   . THR A 1 142 ? 20.497 33.926 30.300 1.00 10.65 ? 142 THR D C   1 
ATOM   1078 O O   . THR A 1 142 ? 21.100 33.252 31.131 1.00 11.21 ? 142 THR D O   1 
ATOM   1079 C CB  . THR A 1 142 ? 18.052 34.319 29.782 1.00 11.61 ? 142 THR D CB  1 
ATOM   1080 O OG1 . THR A 1 142 ? 17.607 34.247 31.142 1.00 11.71 ? 142 THR D OG1 1 
ATOM   1081 C CG2 . THR A 1 142 ? 16.911 33.905 28.841 1.00 11.14 ? 142 THR D CG2 1 
ATOM   1082 N N   . TYR A 1 143 ? 20.897 35.142 29.939 1.00 10.87 ? 143 TYR D N   1 
ATOM   1083 C CA  . TYR A 1 143 ? 22.069 35.792 30.534 1.00 11.26 ? 143 TYR D CA  1 
ATOM   1084 C C   . TYR A 1 143 ? 23.322 34.934 30.374 1.00 14.97 ? 143 TYR D C   1 
ATOM   1085 O O   . TYR A 1 143 ? 23.973 34.556 31.343 1.00 14.12 ? 143 TYR D O   1 
ATOM   1086 C CB  . TYR A 1 143 ? 21.828 36.185 31.999 1.00 13.79 ? 143 TYR D CB  1 
ATOM   1087 C CG  . TYR A 1 143 ? 20.713 37.187 32.127 1.00 11.18 ? 143 TYR D CG  1 
ATOM   1088 C CD1 . TYR A 1 143 ? 20.960 38.540 31.995 1.00 14.17 ? 143 TYR D CD1 1 
ATOM   1089 C CD2 . TYR A 1 143 ? 19.408 36.775 32.357 1.00 12.43 ? 143 TYR D CD2 1 
ATOM   1090 C CE1 . TYR A 1 143 ? 19.943 39.454 32.082 1.00 14.28 ? 143 TYR D CE1 1 
ATOM   1091 C CE2 . TYR A 1 143 ? 18.387 37.684 32.446 1.00 14.74 ? 143 TYR D CE2 1 
ATOM   1092 C CZ  . TYR A 1 143 ? 18.660 39.016 32.310 1.00 14.57 ? 143 TYR D CZ  1 
ATOM   1093 O OH  . TYR A 1 143 ? 17.629 39.921 32.396 1.00 18.16 ? 143 TYR D OH  1 
ATOM   1094 N N   . SER A 1 144 ? 23.633 34.601 29.125 1.00 15.51 ? 144 SER D N   1 
ATOM   1095 C CA  . SER A 1 144 ? 24.812 33.795 28.807 1.00 17.46 ? 144 SER D CA  1 
ATOM   1096 C C   . SER A 1 144 ? 24.856 32.509 29.636 1.00 20.97 ? 144 SER D C   1 
ATOM   1097 O O   . SER A 1 144 ? 25.883 32.145 30.211 1.00 22.22 ? 144 SER D O   1 
ATOM   1098 C CB  . SER A 1 144 ? 26.100 34.608 28.968 1.00 19.71 ? 144 SER D CB  1 
ATOM   1099 O OG  . SER A 1 144 ? 26.056 35.796 28.204 1.00 23.84 ? 144 SER D OG  1 
ATOM   1100 N N   . GLY A 1 145 ? 23.713 31.826 29.716 1.00 19.01 ? 145 GLY D N   1 
ATOM   1101 C CA  . GLY A 1 145 ? 23.643 30.549 30.405 1.00 18.67 ? 145 GLY D CA  1 
ATOM   1102 C C   . GLY A 1 145 ? 23.679 30.592 31.916 1.00 19.25 ? 145 GLY D C   1 
ATOM   1103 O O   . GLY A 1 145 ? 23.801 29.539 32.550 1.00 22.32 ? 145 GLY D O   1 
ATOM   1104 N N   . LYS A 1 146 ? 23.567 31.763 32.527 1.00 19.93 ? 146 LYS D N   1 
ATOM   1105 C CA  . LYS A 1 146 ? 23.640 31.841 33.977 1.00 19.92 ? 146 LYS D CA  1 
ATOM   1106 C C   . LYS A 1 146 ? 22.279 31.894 34.652 1.00 18.75 ? 146 LYS D C   1 
ATOM   1107 O O   . LYS A 1 146 ? 22.217 31.843 35.887 1.00 21.90 ? 146 LYS D O   1 
ATOM   1108 C CB  . LYS A 1 146 ? 24.484 33.042 34.414 1.00 21.09 ? 146 LYS D CB  1 
ATOM   1109 C CG  . LYS A 1 146 ? 25.977 32.799 34.330 1.00 22.01 ? 146 LYS D CG  1 
ATOM   1110 C CD  . LYS A 1 146 ? 26.374 31.463 34.963 1.00 20.19 ? 146 LYS D CD  1 
ATOM   1111 C CE  . LYS A 1 146 ? 26.415 31.546 36.485 1.00 19.37 ? 146 LYS D CE  1 
ATOM   1112 N NZ  . LYS A 1 146 ? 27.136 30.397 37.125 1.00 22.30 ? 146 LYS D NZ  1 
ATOM   1113 N N   . LYS A 1 147 ? 21.191 31.992 33.895 1.00 15.06 ? 147 LYS D N   1 
ATOM   1114 C CA  . LYS A 1 147 ? 19.862 32.029 34.488 1.00 14.34 ? 147 LYS D CA  1 
ATOM   1115 C C   . LYS A 1 147 ? 19.019 30.919 33.888 1.00 12.26 ? 147 LYS D C   1 
ATOM   1116 O O   . LYS A 1 147 ? 18.667 30.964 32.702 1.00 11.81 ? 147 LYS D O   1 
ATOM   1117 C CB  . LYS A 1 147 ? 19.178 33.375 34.291 1.00 13.95 ? 147 LYS D CB  1 
ATOM   1118 C CG  . LYS A 1 147 ? 17.764 33.384 34.856 1.00 16.69 ? 147 LYS D CG  1 
ATOM   1119 C CD  . LYS A 1 147 ? 17.059 34.697 34.612 1.00 17.31 ? 147 LYS D CD  1 
ATOM   1120 C CE  . LYS A 1 147 ? 15.682 34.689 35.256 1.00 19.06 ? 147 LYS D CE  1 
ATOM   1121 N NZ  . LYS A 1 147 ? 14.962 35.967 35.016 1.00 22.61 ? 147 LYS D NZ  1 
ATOM   1122 N N   . ASN A 1 148 ? 18.689 29.931 34.702 1.00 12.84 ? 148 ASN D N   1 
ATOM   1123 C CA  . ASN A 1 148 ? 17.641 28.997 34.330 1.00 12.09 ? 148 ASN D CA  1 
ATOM   1124 C C   . ASN A 1 148 ? 16.314 29.729 34.452 1.00 12.39 ? 148 ASN D C   1 
ATOM   1125 O O   . ASN A 1 148 ? 15.883 30.065 35.562 1.00 15.76 ? 148 ASN D O   1 
ATOM   1126 C CB  . ASN A 1 148 ? 17.669 27.790 35.261 1.00 14.17 ? 148 ASN D CB  1 
ATOM   1127 C CG  . ASN A 1 148 ? 16.639 26.753 34.888 1.00 15.29 ? 148 ASN D CG  1 
ATOM   1128 O OD1 . ASN A 1 148 ? 15.773 27.000 34.042 1.00 16.02 ? 148 ASN D OD1 1 
ATOM   1129 N ND2 . ASN A 1 148 ? 16.713 25.587 35.511 1.00 13.66 ? 148 ASN D ND2 1 
ATOM   1130 N N   . THR A 1 149 ? 15.661 29.990 33.318 1.00 12.28 ? 149 THR D N   1 
ATOM   1131 C CA  . THR A 1 149 ? 14.381 30.686 33.338 1.00 13.52 ? 149 THR D CA  1 
ATOM   1132 C C   . THR A 1 149 ? 13.254 29.829 33.889 1.00 14.86 ? 149 THR D C   1 
ATOM   1133 O O   . THR A 1 149 ? 12.174 30.365 34.158 1.00 17.03 ? 149 THR D O   1 
ATOM   1134 C CB  . THR A 1 149 ? 13.971 31.078 31.919 1.00 13.12 ? 149 THR D CB  1 
ATOM   1135 O OG1 . THR A 1 149 ? 13.747 29.887 31.156 1.00 11.43 ? 149 THR D OG1 1 
ATOM   1136 C CG2 . THR A 1 149 ? 15.050 31.922 31.260 1.00 13.97 ? 149 THR D CG2 1 
ATOM   1137 N N   . GLY A 1 150 ? 13.456 28.520 34.007 1.00 14.79 ? 150 GLY D N   1 
ATOM   1138 C CA  . GLY A 1 150 ? 12.367 27.617 34.311 1.00 17.01 ? 150 GLY D CA  1 
ATOM   1139 C C   . GLY A 1 150 ? 11.368 27.419 33.193 1.00 15.45 ? 150 GLY D C   1 
ATOM   1140 O O   . GLY A 1 150 ? 10.361 26.726 33.400 1.00 17.12 ? 150 GLY D O   1 
ATOM   1141 N N   . ILE A 1 151 ? 11.599 28.008 32.019 1.00 12.70 ? 151 ILE D N   1 
ATOM   1142 C CA  . ILE A 1 151 ? 10.738 27.808 30.861 1.00 11.52 ? 151 ILE D CA  1 
ATOM   1143 C C   . ILE A 1 151 ? 11.221 26.564 30.140 1.00 9.60  ? 151 ILE D C   1 
ATOM   1144 O O   . ILE A 1 151 ? 12.415 26.426 29.857 1.00 10.06 ? 151 ILE D O   1 
ATOM   1145 C CB  . ILE A 1 151 ? 10.793 29.023 29.926 1.00 11.14 ? 151 ILE D CB  1 
ATOM   1146 C CG1 . ILE A 1 151 ? 10.325 30.286 30.647 1.00 13.11 ? 151 ILE D CG1 1 
ATOM   1147 C CG2 . ILE A 1 151 ? 9.945  28.770 28.700 1.00 13.17 ? 151 ILE D CG2 1 
ATOM   1148 C CD1 . ILE A 1 151 ? 10.692 31.558 29.910 1.00 17.28 ? 151 ILE D CD1 1 
ATOM   1149 N N   . LEU A 1 152 ? 10.302 25.659 29.842 1.00 10.49 ? 152 LEU D N   1 
ATOM   1150 C CA  . LEU A 1 152 ? 10.669 24.466 29.103 1.00 9.58  ? 152 LEU D CA  1 
ATOM   1151 C C   . LEU A 1 152 ? 10.999 24.829 27.662 1.00 9.74  ? 152 LEU D C   1 
ATOM   1152 O O   . LEU A 1 152 ? 10.294 25.618 27.026 1.00 8.99  ? 152 LEU D O   1 
ATOM   1153 C CB  . LEU A 1 152 ? 9.516  23.472 29.117 1.00 10.40 ? 152 LEU D CB  1 
ATOM   1154 C CG  . LEU A 1 152 ? 9.242  22.789 30.457 1.00 11.95 ? 152 LEU D CG  1 
ATOM   1155 C CD1 . LEU A 1 152 ? 7.943  21.993 30.380 1.00 17.22 ? 152 LEU D CD1 1 
ATOM   1156 C CD2 . LEU A 1 152 ? 10.396 21.875 30.829 1.00 17.00 ? 152 LEU D CD2 1 
ATOM   1157 N N   . LEU A 1 153 ? 12.080 24.238 27.154 1.00 8.83  ? 153 LEU D N   1 
ATOM   1158 C CA  . LEU A 1 153 ? 12.456 24.413 25.756 1.00 8.94  ? 153 LEU D CA  1 
ATOM   1159 C C   . LEU A 1 153 ? 11.283 24.125 24.829 1.00 8.67  ? 153 LEU D C   1 
ATOM   1160 O O   . LEU A 1 153 ? 11.038 24.872 23.877 1.00 9.60  ? 153 LEU D O   1 
ATOM   1161 C CB  . LEU A 1 153 ? 13.628 23.489 25.448 1.00 9.03  ? 153 LEU D CB  1 
ATOM   1162 C CG  . LEU A 1 153 ? 14.102 23.492 23.998 1.00 8.92  ? 153 LEU D CG  1 
ATOM   1163 C CD1 . LEU A 1 153 ? 14.566 24.887 23.583 1.00 9.28  ? 153 LEU D CD1 1 
ATOM   1164 C CD2 . LEU A 1 153 ? 15.212 22.476 23.812 1.00 8.85  ? 153 LEU D CD2 1 
ATOM   1165 N N   . ARG A 1 154 ? 10.525 23.061 25.117 1.00 9.76  ? 154 ARG D N   1 
ATOM   1166 C CA  . ARG A 1 154 ? 9.387  22.703 24.279 1.00 10.45 ? 154 ARG D CA  1 
ATOM   1167 C C   . ARG A 1 154 ? 8.417  23.865 24.146 1.00 10.36 ? 154 ARG D C   1 
ATOM   1168 O O   . ARG A 1 154 ? 7.973  24.201 23.039 1.00 12.67 ? 154 ARG D O   1 
ATOM   1169 C CB  . ARG A 1 154 ? 8.684  21.484 24.870 1.00 11.19 ? 154 ARG D CB  1 
ATOM   1170 C CG  . ARG A 1 154 ? 7.407  21.092 24.151 1.00 14.04 ? 154 ARG D CG  1 
ATOM   1171 C CD  . ARG A 1 154 ? 6.506  20.248 25.043 1.00 14.71 ? 154 ARG D CD  1 
ATOM   1172 N NE  . ARG A 1 154 ? 5.997  21.034 26.154 1.00 15.16 ? 154 ARG D NE  1 
ATOM   1173 C CZ  . ARG A 1 154 ? 5.796  20.566 27.380 1.00 15.67 ? 154 ARG D CZ  1 
ATOM   1174 N NH1 . ARG A 1 154 ? 6.062  19.297 27.675 1.00 15.98 ? 154 ARG D NH1 1 
ATOM   1175 N NH2 . ARG A 1 154 ? 5.333  21.380 28.312 1.00 19.55 ? 154 ARG D NH2 1 
ATOM   1176 N N   . ASP A 1 155 ? 8.086  24.500 25.266 1.00 10.94 ? 155 ASP D N   1 
ATOM   1177 C CA  . ASP A 1 155 ? 7.114  25.582 25.244 1.00 10.93 ? 155 ASP D CA  1 
ATOM   1178 C C   . ASP A 1 155 ? 7.669  26.811 24.551 1.00 10.98 ? 155 ASP D C   1 
ATOM   1179 O O   . ASP A 1 155 ? 6.953  27.483 23.798 1.00 10.89 ? 155 ASP D O   1 
ATOM   1180 C CB  . ASP A 1 155 ? 6.706  25.937 26.668 1.00 12.63 ? 155 ASP D CB  1 
ATOM   1181 C CG  . ASP A 1 155 ? 5.976  24.816 27.358 1.00 14.07 ? 155 ASP D CG  1 
ATOM   1182 O OD1 . ASP A 1 155 ? 5.311  24.022 26.661 1.00 14.77 ? 155 ASP D OD1 1 
ATOM   1183 O OD2 . ASP A 1 155 ? 6.070  24.732 28.600 1.00 15.99 ? 155 ASP D OD2 1 
ATOM   1184 N N   . TRP A 1 156 ? 8.940  27.128 24.794 1.00 8.99  ? 156 TRP D N   1 
ATOM   1185 C CA  . TRP A 1 156 ? 9.498  28.336 24.202 1.00 9.51  ? 156 TRP D CA  1 
ATOM   1186 C C   . TRP A 1 156 ? 9.643  28.205 22.690 1.00 8.69  ? 156 TRP D C   1 
ATOM   1187 O O   . TRP A 1 156 ? 9.381  29.164 21.957 1.00 8.98  ? 156 TRP D O   1 
ATOM   1188 C CB  . TRP A 1 156 ? 10.820 28.679 24.886 1.00 9.62  ? 156 TRP D CB  1 
ATOM   1189 C CG  . TRP A 1 156 ? 11.467 29.932 24.440 1.00 8.39  ? 156 TRP D CG  1 
ATOM   1190 C CD1 . TRP A 1 156 ? 12.766 30.074 24.070 1.00 8.35  ? 156 TRP D CD1 1 
ATOM   1191 C CD2 . TRP A 1 156 ? 10.877 31.241 24.340 1.00 8.79  ? 156 TRP D CD2 1 
ATOM   1192 N NE1 . TRP A 1 156 ? 13.030 31.375 23.747 1.00 9.07  ? 156 TRP D NE1 1 
ATOM   1193 C CE2 . TRP A 1 156 ? 11.887 32.115 23.892 1.00 9.69  ? 156 TRP D CE2 1 
ATOM   1194 C CE3 . TRP A 1 156 ? 9.595  31.761 24.582 1.00 9.83  ? 156 TRP D CE3 1 
ATOM   1195 C CZ2 . TRP A 1 156 ? 11.659 33.471 23.664 1.00 10.13 ? 156 TRP D CZ2 1 
ATOM   1196 C CZ3 . TRP A 1 156 ? 9.371  33.110 24.353 1.00 11.87 ? 156 TRP D CZ3 1 
ATOM   1197 C CH2 . TRP A 1 156 ? 10.401 33.947 23.897 1.00 11.37 ? 156 TRP D CH2 1 
ATOM   1198 N N   . VAL A 1 157 ? 10.043 27.034 22.202 1.00 8.67  ? 157 VAL D N   1 
ATOM   1199 C CA  . VAL A 1 157 ? 10.145 26.837 20.758 1.00 8.67  ? 157 VAL D CA  1 
ATOM   1200 C C   . VAL A 1 157 ? 8.811  27.130 20.085 1.00 9.54  ? 157 VAL D C   1 
ATOM   1201 O O   . VAL A 1 157 ? 8.742  27.848 19.077 1.00 9.04  ? 157 VAL D O   1 
ATOM   1202 C CB  . VAL A 1 157 ? 10.643 25.419 20.446 1.00 8.96  ? 157 VAL D CB  1 
ATOM   1203 C CG1 . VAL A 1 157 ? 10.395 25.082 18.982 1.00 9.68  ? 157 VAL D CG1 1 
ATOM   1204 C CG2 . VAL A 1 157 ? 12.114 25.290 20.809 1.00 9.09  ? 157 VAL D CG2 1 
ATOM   1205 N N   . VAL A 1 158 ? 7.728  26.577 20.630 1.00 10.86 ? 158 VAL D N   1 
ATOM   1206 C CA  . VAL A 1 158 ? 6.410  26.785 20.038 1.00 10.93 ? 158 VAL D CA  1 
ATOM   1207 C C   . VAL A 1 158 ? 6.036  28.261 20.081 1.00 11.48 ? 158 VAL D C   1 
ATOM   1208 O O   . VAL A 1 158 ? 5.539  28.825 19.094 1.00 11.46 ? 158 VAL D O   1 
ATOM   1209 C CB  . VAL A 1 158 ? 5.373  25.896 20.746 1.00 14.02 ? 158 VAL D CB  1 
ATOM   1210 C CG1 . VAL A 1 158 ? 3.974  26.189 20.234 1.00 16.38 ? 158 VAL D CG1 1 
ATOM   1211 C CG2 . VAL A 1 158 ? 5.718  24.434 20.544 1.00 13.25 ? 158 VAL D CG2 1 
ATOM   1212 N N   . GLU A 1 159 ? 6.299  28.916 21.211 1.00 10.72 ? 159 GLU D N   1 
ATOM   1213 C CA  . GLU A 1 159 ? 5.984  30.335 21.326 1.00 11.15 ? 159 GLU D CA  1 
ATOM   1214 C C   . GLU A 1 159 ? 6.784  31.167 20.333 1.00 10.07 ? 159 GLU D C   1 
ATOM   1215 O O   . GLU A 1 159 ? 6.260  32.119 19.744 1.00 10.18 ? 159 GLU D O   1 
ATOM   1216 C CB  . GLU A 1 159 ? 6.257  30.815 22.744 1.00 12.59 ? 159 GLU D CB  1 
ATOM   1217 C CG  . GLU A 1 159 ? 5.833  32.236 22.984 1.00 13.92 ? 159 GLU D CG  1 
ATOM   1218 C CD  . GLU A 1 159 ? 4.335  32.428 22.848 1.00 16.33 ? 159 GLU D CD  1 
ATOM   1219 O OE1 . GLU A 1 159 ? 3.573  31.523 23.254 1.00 18.57 ? 159 GLU D OE1 1 
ATOM   1220 O OE2 . GLU A 1 159 ? 3.903  33.505 22.385 1.00 18.12 ? 159 GLU D OE2 1 
ATOM   1221 N N   . VAL A 1 160 ? 8.068  30.862 20.169 1.00 9.65  ? 160 VAL D N   1 
ATOM   1222 C CA  . VAL A 1 160 ? 8.922  31.645 19.284 1.00 9.59  ? 160 VAL D CA  1 
ATOM   1223 C C   . VAL A 1 160 ? 8.392  31.606 17.858 1.00 9.25  ? 160 VAL D C   1 
ATOM   1224 O O   . VAL A 1 160 ? 8.358  32.625 17.159 1.00 10.40 ? 160 VAL D O   1 
ATOM   1225 C CB  . VAL A 1 160 ? 10.361 31.111 19.389 1.00 10.99 ? 160 VAL D CB  1 
ATOM   1226 C CG1 . VAL A 1 160 ? 11.205 31.498 18.190 1.00 11.92 ? 160 VAL D CG1 1 
ATOM   1227 C CG2 . VAL A 1 160 ? 10.985 31.587 20.689 1.00 10.83 ? 160 VAL D CG2 1 
ATOM   1228 N N   . GLU A 1 161 ? 7.958  30.437 17.402 1.00 10.07 ? 161 GLU D N   1 
ATOM   1229 C CA  . GLU A 1 161 ? 7.381  30.381 16.067 1.00 10.01 ? 161 GLU D CA  1 
ATOM   1230 C C   . GLU A 1 161 ? 6.067  31.151 16.011 1.00 12.03 ? 161 GLU D C   1 
ATOM   1231 O O   . GLU A 1 161 ? 5.822  31.903 15.059 1.00 11.10 ? 161 GLU D O   1 
ATOM   1232 C CB  . GLU A 1 161 ? 7.196  28.938 15.608 1.00 11.49 ? 161 GLU D CB  1 
ATOM   1233 C CG  . GLU A 1 161 ? 6.430  28.856 14.293 1.00 12.12 ? 161 GLU D CG  1 
ATOM   1234 C CD  . GLU A 1 161 ? 6.472  27.499 13.616 1.00 13.34 ? 161 GLU D CD  1 
ATOM   1235 O OE1 . GLU A 1 161 ? 7.199  26.609 14.074 1.00 13.78 ? 161 GLU D OE1 1 
ATOM   1236 O OE2 . GLU A 1 161 ? 5.756  27.321 12.603 1.00 18.11 ? 161 GLU D OE2 1 
ATOM   1237 N N   . LYS A 1 162 ? 5.222  30.994 17.035 1.00 11.14 ? 162 LYS D N   1 
ATOM   1238 C CA  . LYS A 1 162 ? 3.961  31.727 17.099 1.00 12.33 ? 162 LYS D CA  1 
ATOM   1239 C C   . LYS A 1 162 ? 4.194  33.227 17.019 1.00 11.71 ? 162 LYS D C   1 
ATOM   1240 O O   . LYS A 1 162 ? 3.412  33.950 16.392 1.00 13.41 ? 162 LYS D O   1 
ATOM   1241 C CB  . LYS A 1 162 ? 3.246  31.372 18.401 1.00 12.84 ? 162 LYS D CB  1 
ATOM   1242 C CG  . LYS A 1 162 ? 1.833  31.917 18.554 1.00 19.50 ? 162 LYS D CG  1 
ATOM   1243 C CD  . LYS A 1 162 ? 1.135  31.196 19.708 1.00 25.71 ? 162 LYS D CD  1 
ATOM   1244 C CE  . LYS A 1 162 ? -0.099 31.943 20.193 1.00 32.80 ? 162 LYS D CE  1 
ATOM   1245 N NZ  . LYS A 1 162 ? -0.833 31.179 21.238 1.00 32.77 ? 162 LYS D NZ  1 
ATOM   1246 N N   . ARG A 1 163 ? 5.279  33.713 17.623 1.00 11.31 ? 163 ARG D N   1 
ATOM   1247 C CA  . ARG A 1 163 ? 5.596  35.133 17.631 1.00 12.68 ? 163 ARG D CA  1 
ATOM   1248 C C   . ARG A 1 163 ? 6.153  35.633 16.308 1.00 11.21 ? 163 ARG D C   1 
ATOM   1249 O O   . ARG A 1 163 ? 6.325  36.841 16.153 1.00 12.37 ? 163 ARG D O   1 
ATOM   1250 C CB  . ARG A 1 163 ? 6.588  35.447 18.752 1.00 11.93 ? 163 ARG D CB  1 
ATOM   1251 C CG  . ARG A 1 163 ? 6.024  35.271 20.144 1.00 12.83 ? 163 ARG D CG  1 
ATOM   1252 C CD  . ARG A 1 163 ? 4.988  36.319 20.479 1.00 13.77 ? 163 ARG D CD  1 
ATOM   1253 N NE  . ARG A 1 163 ? 4.492  36.099 21.833 1.00 13.72 ? 163 ARG D NE  1 
ATOM   1254 C CZ  . ARG A 1 163 ? 3.748  36.965 22.516 1.00 15.87 ? 163 ARG D CZ  1 
ATOM   1255 N NH1 . ARG A 1 163 ? 3.394  38.125 21.971 1.00 15.66 ? 163 ARG D NH1 1 
ATOM   1256 N NH2 . ARG A 1 163 ? 3.358  36.665 23.747 1.00 19.17 ? 163 ARG D NH2 1 
ATOM   1257 N N   . GLY A 1 164 ? 6.453  34.752 15.368 1.00 11.87 ? 164 GLY D N   1 
ATOM   1258 C CA  . GLY A 1 164 ? 6.860  35.165 14.048 1.00 12.30 ? 164 GLY D CA  1 
ATOM   1259 C C   . GLY A 1 164 ? 8.347  35.152 13.786 1.00 11.18 ? 164 GLY D C   1 
ATOM   1260 O O   . GLY A 1 164 ? 8.782  35.774 12.811 1.00 11.67 ? 164 GLY D O   1 
ATOM   1261 N N   . ALA A 1 165 ? 9.143  34.462 14.604 1.00 10.25 ? 165 ALA D N   1 
ATOM   1262 C CA  . ALA A 1 165 ? 10.561 34.367 14.306 1.00 9.64  ? 165 ALA D CA  1 
ATOM   1263 C C   . ALA A 1 165 ? 10.776 33.699 12.953 1.00 8.90  ? 165 ALA D C   1 
ATOM   1264 O O   . ALA A 1 165 ? 9.971  32.881 12.500 1.00 9.92  ? 165 ALA D O   1 
ATOM   1265 C CB  . ALA A 1 165 ? 11.274 33.563 15.385 1.00 10.31 ? 165 ALA D CB  1 
ATOM   1266 N N   . GLY A 1 166 ? 11.894 34.031 12.321 1.00 8.95  ? 166 GLY D N   1 
ATOM   1267 C CA  . GLY A 1 166 ? 12.232 33.395 11.069 1.00 9.23  ? 166 GLY D CA  1 
ATOM   1268 C C   . GLY A 1 166 ? 13.058 32.142 11.230 1.00 8.88  ? 166 GLY D C   1 
ATOM   1269 O O   . GLY A 1 166 ? 12.957 31.231 10.410 1.00 9.47  ? 166 GLY D O   1 
ATOM   1270 N N   . GLU A 1 167 ? 13.871 32.069 12.282 1.00 9.08  ? 167 GLU D N   1 
ATOM   1271 C CA  . GLU A 1 167 ? 14.776 30.945 12.469 1.00 7.88  ? 167 GLU D CA  1 
ATOM   1272 C C   . GLU A 1 167 ? 15.067 30.834 13.950 1.00 7.41  ? 167 GLU D C   1 
ATOM   1273 O O   . GLU A 1 167 ? 14.978 31.821 14.693 1.00 8.60  ? 167 GLU D O   1 
ATOM   1274 C CB  . GLU A 1 167 ? 16.112 31.182 11.782 1.00 11.09 ? 167 GLU D CB  1 
ATOM   1275 C CG  . GLU A 1 167 ? 16.137 31.162 10.286 1.00 13.19 ? 167 GLU D CG  1 
ATOM   1276 C CD  . GLU A 1 167 ? 17.563 31.210 9.810  1.00 15.28 ? 167 GLU D CD  1 
ATOM   1277 O OE1 . GLU A 1 167 ? 18.114 32.318 9.784  1.00 15.32 ? 167 GLU D OE1 1 
ATOM   1278 O OE2 . GLU A 1 167 ? 18.163 30.143 9.544  1.00 15.71 ? 167 GLU D OE2 1 
ATOM   1279 N N   . ILE A 1 168 ? 15.448 29.632 14.375 1.00 7.52  ? 168 ILE D N   1 
ATOM   1280 C CA  . ILE A 1 168 ? 15.874 29.383 15.744 1.00 7.34  ? 168 ILE D CA  1 
ATOM   1281 C C   . ILE A 1 168 ? 17.336 28.986 15.708 1.00 7.34  ? 168 ILE D C   1 
ATOM   1282 O O   . ILE A 1 168 ? 17.712 28.065 14.968 1.00 9.60  ? 168 ILE D O   1 
ATOM   1283 C CB  . ILE A 1 168 ? 15.017 28.288 16.399 1.00 8.56  ? 168 ILE D CB  1 
ATOM   1284 C CG1 . ILE A 1 168 ? 13.618 28.823 16.661 1.00 9.71  ? 168 ILE D CG1 1 
ATOM   1285 C CG2 . ILE A 1 168 ? 15.661 27.802 17.680 1.00 9.40  ? 168 ILE D CG2 1 
ATOM   1286 C CD1 . ILE A 1 168 ? 12.632 27.765 17.068 1.00 12.01 ? 168 ILE D CD1 1 
ATOM   1287 N N   . LEU A 1 169 ? 18.154 29.679 16.487 1.00 7.47  ? 169 LEU D N   1 
ATOM   1288 C CA  . LEU A 1 169 ? 19.556 29.337 16.648 1.00 7.71  ? 169 LEU D CA  1 
ATOM   1289 C C   . LEU A 1 169 ? 19.637 28.593 17.976 1.00 7.25  ? 169 LEU D C   1 
ATOM   1290 O O   . LEU A 1 169 ? 19.506 29.202 19.045 1.00 7.93  ? 169 LEU D O   1 
ATOM   1291 C CB  . LEU A 1 169 ? 20.402 30.610 16.640 1.00 7.94  ? 169 LEU D CB  1 
ATOM   1292 C CG  . LEU A 1 169 ? 21.905 30.474 16.450 1.00 10.31 ? 169 LEU D CG  1 
ATOM   1293 C CD1 . LEU A 1 169 ? 22.528 31.823 16.138 1.00 13.80 ? 169 LEU D CD1 1 
ATOM   1294 C CD2 . LEU A 1 169 ? 22.577 29.877 17.662 1.00 13.68 ? 169 LEU D CD2 1 
ATOM   1295 N N   . LEU A 1 170 ? 19.807 27.280 17.911 1.00 7.14  ? 170 LEU D N   1 
ATOM   1296 C CA  . LEU A 1 170 ? 19.626 26.406 19.059 1.00 7.49  ? 170 LEU D CA  1 
ATOM   1297 C C   . LEU A 1 170 ? 21.000 26.009 19.566 1.00 7.41  ? 170 LEU D C   1 
ATOM   1298 O O   . LEU A 1 170 ? 21.693 25.211 18.927 1.00 8.40  ? 170 LEU D O   1 
ATOM   1299 C CB  . LEU A 1 170 ? 18.841 25.179 18.619 1.00 8.30  ? 170 LEU D CB  1 
ATOM   1300 C CG  . LEU A 1 170 ? 18.559 24.153 19.707 1.00 8.42  ? 170 LEU D CG  1 
ATOM   1301 C CD1 . LEU A 1 170 ? 17.609 24.726 20.728 1.00 10.55 ? 170 LEU D CD1 1 
ATOM   1302 C CD2 . LEU A 1 170 ? 17.969 22.905 19.076 1.00 10.35 ? 170 LEU D CD2 1 
ATOM   1303 N N   . THR A 1 171 ? 21.385 26.542 20.720 1.00 8.30  ? 171 THR D N   1 
ATOM   1304 C CA  . THR A 1 171 ? 22.709 26.302 21.271 1.00 9.02  ? 171 THR D CA  1 
ATOM   1305 C C   . THR A 1 171 ? 22.608 25.379 22.471 1.00 9.31  ? 171 THR D C   1 
ATOM   1306 O O   . THR A 1 171 ? 21.877 25.659 23.427 1.00 9.30  ? 171 THR D O   1 
ATOM   1307 C CB  . THR A 1 171 ? 23.383 27.604 21.699 1.00 9.01  ? 171 THR D CB  1 
ATOM   1308 O OG1 . THR A 1 171 ? 23.552 28.445 20.554 1.00 11.00 ? 171 THR D OG1 1 
ATOM   1309 C CG2 . THR A 1 171 ? 24.760 27.330 22.320 1.00 13.07 ? 171 THR D CG2 1 
ATOM   1310 N N   . SER A 1 172 ? 23.359 24.294 22.431 1.00 9.33  ? 172 SER D N   1 
ATOM   1311 C CA  . SER A 1 172 ? 23.535 23.459 23.605 1.00 9.42  ? 172 SER D CA  1 
ATOM   1312 C C   . SER A 1 172 ? 24.740 23.992 24.361 1.00 9.38  ? 172 SER D C   1 
ATOM   1313 O O   . SER A 1 172 ? 25.887 23.753 23.978 1.00 9.21  ? 172 SER D O   1 
ATOM   1314 C CB  . SER A 1 172 ? 23.722 22.008 23.204 1.00 9.94  ? 172 SER D CB  1 
ATOM   1315 O OG  . SER A 1 172 ? 23.850 21.234 24.381 1.00 10.89 ? 172 SER D OG  1 
ATOM   1316 N N   . ILE A 1 173 ? 24.467 24.751 25.426 1.00 10.32 ? 173 ILE D N   1 
ATOM   1317 C CA  . ILE A 1 173 ? 25.540 25.353 26.221 1.00 11.12 ? 173 ILE D CA  1 
ATOM   1318 C C   . ILE A 1 173 ? 26.549 24.296 26.626 1.00 9.51  ? 173 ILE D C   1 
ATOM   1319 O O   . ILE A 1 173 ? 27.761 24.518 26.593 1.00 10.52 ? 173 ILE D O   1 
ATOM   1320 C CB  . ILE A 1 173 ? 24.960 26.061 27.461 1.00 11.82 ? 173 ILE D CB  1 
ATOM   1321 C CG1 . ILE A 1 173 ? 24.105 27.260 27.064 1.00 11.87 ? 173 ILE D CG1 1 
ATOM   1322 C CG2 . ILE A 1 173 ? 26.079 26.457 28.441 1.00 12.04 ? 173 ILE D CG2 1 
ATOM   1323 C CD1 . ILE A 1 173 ? 23.169 27.705 28.178 1.00 15.34 ? 173 ILE D CD1 1 
ATOM   1324 N N   . ASP A 1 174 ? 26.061 23.126 26.997 1.00 9.18  ? 174 ASP D N   1 
ATOM   1325 C CA  . ASP A 1 174 ? 26.919 22.145 27.629 1.00 9.21  ? 174 ASP D CA  1 
ATOM   1326 C C   . ASP A 1 174 ? 27.783 21.398 26.633 1.00 10.58 ? 174 ASP D C   1 
ATOM   1327 O O   . ASP A 1 174 ? 28.684 20.664 27.063 1.00 11.79 ? 174 ASP D O   1 
ATOM   1328 C CB  . ASP A 1 174 ? 26.076 21.191 28.468 1.00 11.39 ? 174 ASP D CB  1 
ATOM   1329 C CG  . ASP A 1 174 ? 25.366 21.900 29.604 1.00 12.06 ? 174 ASP D CG  1 
ATOM   1330 O OD1 . ASP A 1 174 ? 25.813 22.998 29.994 1.00 11.71 ? 174 ASP D OD1 1 
ATOM   1331 O OD2 . ASP A 1 174 ? 24.353 21.363 30.122 1.00 13.99 ? 174 ASP D OD2 1 
ATOM   1332 N N   . ARG A 1 175 ? 27.542 21.576 25.325 1.00 9.83  ? 175 ARG D N   1 
ATOM   1333 C CA  . ARG A 1 175 ? 28.456 21.079 24.302 1.00 10.39 ? 175 ARG D CA  1 
ATOM   1334 C C   . ARG A 1 175 ? 29.298 22.179 23.672 1.00 10.17 ? 175 ARG D C   1 
ATOM   1335 O O   . ARG A 1 175 ? 30.301 21.879 23.020 1.00 10.37 ? 175 ARG D O   1 
ATOM   1336 C CB  . ARG A 1 175 ? 27.688 20.405 23.158 1.00 12.56 ? 175 ARG D CB  1 
ATOM   1337 C CG  . ARG A 1 175 ? 26.710 19.331 23.553 1.00 17.34 ? 175 ARG D CG  1 
ATOM   1338 C CD  . ARG A 1 175 ? 27.347 18.244 24.366 1.00 21.19 ? 175 ARG D CD  1 
ATOM   1339 N NE  A ARG A 1 175 ? 26.631 16.974 24.267 0.62 21.60 ? 175 ARG D NE  1 
ATOM   1340 N NE  B ARG A 1 175 ? 26.400 17.149 24.559 0.38 21.44 ? 175 ARG D NE  1 
ATOM   1341 C CZ  A ARG A 1 175 ? 26.904 16.023 23.379 0.62 19.52 ? 175 ARG D CZ  1 
ATOM   1342 C CZ  B ARG A 1 175 ? 25.453 17.131 25.491 0.38 21.10 ? 175 ARG D CZ  1 
ATOM   1343 N NH1 A ARG A 1 175 ? 27.882 16.193 22.498 0.62 19.53 ? 175 ARG D NH1 1 
ATOM   1344 N NH1 B ARG A 1 175 ? 25.325 18.145 26.337 0.38 20.78 ? 175 ARG D NH1 1 
ATOM   1345 N NH2 A ARG A 1 175 ? 26.200 14.899 23.372 0.62 24.72 ? 175 ARG D NH2 1 
ATOM   1346 N NH2 B ARG A 1 175 ? 24.632 16.093 25.579 0.38 20.93 ? 175 ARG D NH2 1 
ATOM   1347 N N   . ASP A 1 176 ? 28.906 23.435 23.837 1.00 10.27 ? 176 ASP D N   1 
ATOM   1348 C CA  . ASP A 1 176 ? 29.555 24.544 23.155 1.00 10.32 ? 176 ASP D CA  1 
ATOM   1349 C C   . ASP A 1 176 ? 31.038 24.596 23.504 1.00 11.61 ? 176 ASP D C   1 
ATOM   1350 O O   . ASP A 1 176 ? 31.412 24.607 24.682 1.00 11.25 ? 176 ASP D O   1 
ATOM   1351 C CB  . ASP A 1 176 ? 28.840 25.823 23.591 1.00 10.93 ? 176 ASP D CB  1 
ATOM   1352 C CG  . ASP A 1 176 ? 29.124 27.014 22.699 1.00 13.45 ? 176 ASP D CG  1 
ATOM   1353 O OD1 . ASP A 1 176 ? 29.994 26.946 21.818 1.00 18.55 ? 176 ASP D OD1 1 
ATOM   1354 O OD2 . ASP A 1 176 ? 28.463 28.056 22.908 1.00 16.78 ? 176 ASP D OD2 1 
ATOM   1355 N N   . GLY A 1 177 ? 31.883 24.599 22.481 1.00 10.09 ? 177 GLY D N   1 
ATOM   1356 C CA  . GLY A 1 177 ? 33.317 24.661 22.628 1.00 10.29 ? 177 GLY D CA  1 
ATOM   1357 C C   . GLY A 1 177 ? 33.987 23.354 22.983 1.00 9.97  ? 177 GLY D C   1 
ATOM   1358 O O   . GLY A 1 177 ? 35.222 23.319 23.072 1.00 12.06 ? 177 GLY D O   1 
ATOM   1359 N N   . THR A 1 178 ? 33.227 22.283 23.178 1.00 10.01 ? 178 THR D N   1 
ATOM   1360 C CA  . THR A 1 178 ? 33.834 21.046 23.649 1.00 10.33 ? 178 THR D CA  1 
ATOM   1361 C C   . THR A 1 178 ? 34.400 20.196 22.532 1.00 10.29 ? 178 THR D C   1 
ATOM   1362 O O   . THR A 1 178 ? 35.170 19.268 22.816 1.00 11.04 ? 178 THR D O   1 
ATOM   1363 C CB  . THR A 1 178 ? 32.825 20.164 24.380 1.00 11.19 ? 178 THR D CB  1 
ATOM   1364 O OG1 . THR A 1 178 ? 31.811 19.730 23.460 1.00 11.30 ? 178 THR D OG1 1 
ATOM   1365 C CG2 . THR A 1 178 ? 32.214 20.898 25.561 1.00 13.49 ? 178 THR D CG2 1 
ATOM   1366 N N   . LYS A 1 179 ? 34.027 20.475 21.281 1.00 9.92  ? 179 LYS D N   1 
ATOM   1367 C CA  . LYS A 1 179 ? 34.435 19.684 20.128 1.00 10.96 ? 179 LYS D CA  1 
ATOM   1368 C C   . LYS A 1 179 ? 33.977 18.239 20.237 1.00 9.98  ? 179 LYS D C   1 
ATOM   1369 O O   . LYS A 1 179 ? 34.485 17.366 19.525 1.00 13.30 ? 179 LYS D O   1 
ATOM   1370 C CB  . LYS A 1 179 ? 35.942 19.779 19.861 1.00 12.57 ? 179 LYS D CB  1 
ATOM   1371 C CG  . LYS A 1 179 ? 36.429 21.207 19.701 1.00 13.13 ? 179 LYS D CG  1 
ATOM   1372 C CD  . LYS A 1 179 ? 37.942 21.254 19.653 1.00 15.30 ? 179 LYS D CD  1 
ATOM   1373 C CE  . LYS A 1 179 ? 38.450 22.682 19.742 1.00 16.76 ? 179 LYS D CE  1 
ATOM   1374 N NZ  . LYS A 1 179 ? 39.939 22.700 19.747 1.00 16.83 ? 179 LYS D NZ  1 
ATOM   1375 N N   . SER A 1 180 ? 32.995 17.970 21.080 1.00 11.00 ? 180 SER D N   1 
ATOM   1376 C CA  . SER A 1 180 ? 32.533 16.615 21.340 1.00 12.42 ? 180 SER D CA  1 
ATOM   1377 C C   . SER A 1 180 ? 31.342 16.221 20.479 1.00 11.59 ? 180 SER D C   1 
ATOM   1378 O O   . SER A 1 180 ? 30.863 15.087 20.598 1.00 13.71 ? 180 SER D O   1 
ATOM   1379 C CB  . SER A 1 180 ? 32.193 16.434 22.827 1.00 14.08 ? 180 SER D CB  1 
ATOM   1380 O OG  . SER A 1 180 ? 31.025 17.156 23.185 1.00 13.87 ? 180 SER D OG  1 
ATOM   1381 N N   . GLY A 1 181 ? 30.856 17.123 19.631 1.00 10.98 ? 181 GLY D N   1 
ATOM   1382 C CA  . GLY A 1 181 ? 29.696 16.846 18.814 1.00 10.59 ? 181 GLY D CA  1 
ATOM   1383 C C   . GLY A 1 181 ? 28.535 17.751 19.153 1.00 9.22  ? 181 GLY D C   1 
ATOM   1384 O O   . GLY A 1 181 ? 28.428 18.260 20.274 1.00 10.04 ? 181 GLY D O   1 
ATOM   1385 N N   . TYR A 1 182 ? 27.675 17.993 18.171 1.00 9.57  ? 182 TYR D N   1 
ATOM   1386 C CA  . TYR A 1 182 ? 26.452 18.719 18.441 1.00 9.44  ? 182 TYR D CA  1 
ATOM   1387 C C   . TYR A 1 182 ? 25.553 17.906 19.361 1.00 9.80  ? 182 TYR D C   1 
ATOM   1388 O O   . TYR A 1 182 ? 25.659 16.680 19.464 1.00 9.95  ? 182 TYR D O   1 
ATOM   1389 C CB  . TYR A 1 182 ? 25.698 18.985 17.142 1.00 9.42  ? 182 TYR D CB  1 
ATOM   1390 C CG  . TYR A 1 182 ? 26.324 20.022 16.245 1.00 9.20  ? 182 TYR D CG  1 
ATOM   1391 C CD1 . TYR A 1 182 ? 26.107 21.373 16.460 1.00 9.18  ? 182 TYR D CD1 1 
ATOM   1392 C CD2 . TYR A 1 182 ? 27.129 19.652 15.183 1.00 10.10 ? 182 TYR D CD2 1 
ATOM   1393 C CE1 . TYR A 1 182 ? 26.667 22.329 15.634 1.00 8.89  ? 182 TYR D CE1 1 
ATOM   1394 C CE2 . TYR A 1 182 ? 27.689 20.601 14.350 1.00 9.70  ? 182 TYR D CE2 1 
ATOM   1395 C CZ  . TYR A 1 182 ? 27.453 21.932 14.576 1.00 9.19  ? 182 TYR D CZ  1 
ATOM   1396 O OH  . TYR A 1 182 ? 28.008 22.872 13.742 1.00 9.60  ? 182 TYR D OH  1 
ATOM   1397 N N   . ASP A 1 183 ? 24.636 18.603 20.016 1.00 9.13  ? 183 ASP D N   1 
ATOM   1398 C CA  . ASP A 1 183 ? 23.659 17.968 20.892 1.00 9.75  ? 183 ASP D CA  1 
ATOM   1399 C C   . ASP A 1 183 ? 22.514 17.469 20.023 1.00 9.34  ? 183 ASP D C   1 
ATOM   1400 O O   . ASP A 1 183 ? 21.456 18.091 19.896 1.00 9.41  ? 183 ASP D O   1 
ATOM   1401 C CB  . ASP A 1 183 ? 23.180 18.967 21.927 1.00 10.68 ? 183 ASP D CB  1 
ATOM   1402 C CG  . ASP A 1 183 ? 22.423 18.327 23.060 1.00 10.01 ? 183 ASP D CG  1 
ATOM   1403 O OD1 . ASP A 1 183 ? 21.884 17.210 22.879 1.00 11.25 ? 183 ASP D OD1 1 
ATOM   1404 O OD2 . ASP A 1 183 ? 22.349 18.976 24.125 1.00 11.43 ? 183 ASP D OD2 1 
ATOM   1405 N N   . THR A 1 184 ? 22.729 16.299 19.421 1.00 9.86  ? 184 THR D N   1 
ATOM   1406 C CA  . THR A 1 184 ? 21.736 15.782 18.488 1.00 9.60  ? 184 THR D CA  1 
ATOM   1407 C C   . THR A 1 184 ? 20.443 15.408 19.190 1.00 10.49 ? 184 THR D C   1 
ATOM   1408 O O   . THR A 1 184 ? 19.371 15.500 18.589 1.00 10.30 ? 184 THR D O   1 
ATOM   1409 C CB  . THR A 1 184 ? 22.303 14.604 17.702 1.00 10.84 ? 184 THR D CB  1 
ATOM   1410 O OG1 . THR A 1 184 ? 22.837 13.637 18.609 1.00 13.19 ? 184 THR D OG1 1 
ATOM   1411 C CG2 . THR A 1 184 ? 23.418 15.064 16.780 1.00 13.20 ? 184 THR D CG2 1 
ATOM   1412 N N   . GLU A 1 185 ? 20.516 14.984 20.453 1.00 10.26 ? 185 GLU D N   1 
ATOM   1413 C CA  . GLU A 1 185 ? 19.291 14.749 21.205 1.00 13.08 ? 185 GLU D CA  1 
ATOM   1414 C C   . GLU A 1 185 ? 18.465 16.023 21.308 1.00 10.25 ? 185 GLU D C   1 
ATOM   1415 O O   . GLU A 1 185 ? 17.244 15.998 21.132 1.00 10.46 ? 185 GLU D O   1 
ATOM   1416 C CB  . GLU A 1 185 ? 19.636 14.191 22.588 1.00 14.83 ? 185 GLU D CB  1 
ATOM   1417 C CG  . GLU A 1 185 ? 18.442 13.885 23.491 1.00 20.24 ? 185 GLU D CG  1 
ATOM   1418 C CD  . GLU A 1 185 ? 18.813 13.856 24.973 1.00 28.87 ? 185 GLU D CD  1 
ATOM   1419 O OE1 . GLU A 1 185 ? 20.005 13.652 25.290 1.00 32.55 ? 185 GLU D OE1 1 
ATOM   1420 O OE2 . GLU A 1 185 ? 17.912 14.034 25.824 1.00 30.64 ? 185 GLU D OE2 1 
ATOM   1421 N N   . MET A 1 186 ? 19.117 17.152 21.582 1.00 9.85  ? 186 MET D N   1 
ATOM   1422 C CA  . MET A 1 186 ? 18.387 18.411 21.652 1.00 9.10  ? 186 MET D CA  1 
ATOM   1423 C C   . MET A 1 186 ? 17.809 18.800 20.303 1.00 8.68  ? 186 MET D C   1 
ATOM   1424 O O   . MET A 1 186 ? 16.668 19.271 20.226 1.00 8.99  ? 186 MET D O   1 
ATOM   1425 C CB  . MET A 1 186 ? 19.286 19.514 22.196 1.00 9.25  ? 186 MET D CB  1 
ATOM   1426 C CG  . MET A 1 186 ? 18.532 20.797 22.466 1.00 9.42  ? 186 MET D CG  1 
ATOM   1427 S SD  . MET A 1 186 ? 19.632 22.165 22.854 1.00 10.34 ? 186 MET D SD  1 
ATOM   1428 C CE  . MET A 1 186 ? 20.242 21.658 24.453 1.00 11.94 ? 186 MET D CE  1 
ATOM   1429 N N   . ILE A 1 187 ? 18.591 18.631 19.238 1.00 8.78  ? 187 ILE D N   1 
ATOM   1430 C CA  . ILE A 1 187 ? 18.108 18.989 17.913 1.00 8.65  ? 187 ILE D CA  1 
ATOM   1431 C C   . ILE A 1 187 ? 16.886 18.157 17.561 1.00 9.14  ? 187 ILE D C   1 
ATOM   1432 O O   . ILE A 1 187 ? 15.877 18.685 17.085 1.00 9.24  ? 187 ILE D O   1 
ATOM   1433 C CB  . ILE A 1 187 ? 19.220 18.820 16.865 1.00 8.57  ? 187 ILE D CB  1 
ATOM   1434 C CG1 . ILE A 1 187 ? 20.394 19.746 17.158 1.00 9.81  ? 187 ILE D CG1 1 
ATOM   1435 C CG2 . ILE A 1 187 ? 18.675 19.054 15.458 1.00 10.34 ? 187 ILE D CG2 1 
ATOM   1436 C CD1 . ILE A 1 187 ? 21.649 19.346 16.435 1.00 11.17 ? 187 ILE D CD1 1 
ATOM   1437 N N   . ARG A 1 188 ? 16.964 16.840 17.804 1.00 9.32  ? 188 ARG D N   1 
ATOM   1438 C CA  . ARG A 1 188 ? 15.852 15.945 17.499 1.00 10.33 ? 188 ARG D CA  1 
ATOM   1439 C C   . ARG A 1 188 ? 14.629 16.300 18.321 1.00 10.41 ? 188 ARG D C   1 
ATOM   1440 O O   . ARG A 1 188 ? 13.492 16.137 17.868 1.00 10.82 ? 188 ARG D O   1 
ATOM   1441 C CB  . ARG A 1 188 ? 16.240 14.502 17.818 1.00 14.05 ? 188 ARG D CB  1 
ATOM   1442 C CG  . ARG A 1 188 ? 17.140 13.808 16.840 1.00 19.14 ? 188 ARG D CG  1 
ATOM   1443 C CD  . ARG A 1 188 ? 17.135 12.309 17.124 1.00 21.36 ? 188 ARG D CD  1 
ATOM   1444 N NE  . ARG A 1 188 ? 17.639 12.005 18.465 1.00 24.25 ? 188 ARG D NE  1 
ATOM   1445 C CZ  . ARG A 1 188 ? 18.923 11.808 18.736 1.00 21.87 ? 188 ARG D CZ  1 
ATOM   1446 N NH1 . ARG A 1 188 ? 19.819 11.888 17.762 1.00 25.33 ? 188 ARG D NH1 1 
ATOM   1447 N NH2 . ARG A 1 188 ? 19.314 11.538 19.969 1.00 25.27 ? 188 ARG D NH2 1 
ATOM   1448 N N   . PHE A 1 189 ? 14.852 16.727 19.561 1.00 9.71  ? 189 PHE D N   1 
ATOM   1449 C CA  . PHE A 1 189 ? 13.756 17.122 20.433 1.00 9.72  ? 189 PHE D CA  1 
ATOM   1450 C C   . PHE A 1 189 ? 13.020 18.328 19.872 1.00 9.76  ? 189 PHE D C   1 
ATOM   1451 O O   . PHE A 1 189 ? 11.788 18.392 19.918 1.00 10.65 ? 189 PHE D O   1 
ATOM   1452 C CB  . PHE A 1 189 ? 14.325 17.444 21.813 1.00 11.55 ? 189 PHE D CB  1 
ATOM   1453 C CG  . PHE A 1 189 ? 13.305 17.929 22.787 1.00 10.70 ? 189 PHE D CG  1 
ATOM   1454 C CD1 . PHE A 1 189 ? 12.579 17.025 23.541 1.00 12.69 ? 189 PHE D CD1 1 
ATOM   1455 C CD2 . PHE A 1 189 ? 13.091 19.285 22.982 1.00 10.54 ? 189 PHE D CD2 1 
ATOM   1456 C CE1 . PHE A 1 189 ? 11.637 17.457 24.439 1.00 12.48 ? 189 PHE D CE1 1 
ATOM   1457 C CE2 . PHE A 1 189 ? 12.140 19.727 23.883 1.00 10.84 ? 189 PHE D CE2 1 
ATOM   1458 C CZ  . PHE A 1 189 ? 11.417 18.809 24.622 1.00 11.51 ? 189 PHE D CZ  1 
ATOM   1459 N N   . VAL A 1 190 ? 13.765 19.303 19.351 1.00 9.56  ? 190 VAL D N   1 
ATOM   1460 C CA  . VAL A 1 190 ? 13.171 20.538 18.859 1.00 9.42  ? 190 VAL D CA  1 
ATOM   1461 C C   . VAL A 1 190 ? 12.536 20.355 17.489 1.00 9.47  ? 190 VAL D C   1 
ATOM   1462 O O   . VAL A 1 190 ? 11.537 21.009 17.183 1.00 10.09 ? 190 VAL D O   1 
ATOM   1463 C CB  . VAL A 1 190 ? 14.239 21.647 18.858 1.00 8.78  ? 190 VAL D CB  1 
ATOM   1464 C CG1 . VAL A 1 190 ? 13.754 22.901 18.157 1.00 10.31 ? 190 VAL D CG1 1 
ATOM   1465 C CG2 . VAL A 1 190 ? 14.651 21.954 20.281 1.00 10.06 ? 190 VAL D CG2 1 
ATOM   1466 N N   . ARG A 1 191 ? 13.095 19.480 16.653 1.00 9.20  ? 191 ARG D N   1 
ATOM   1467 C CA  . ARG A 1 191 ? 12.670 19.382 15.256 1.00 9.45  ? 191 ARG D CA  1 
ATOM   1468 C C   . ARG A 1 191 ? 11.170 19.236 15.065 1.00 9.69  ? 191 ARG D C   1 
ATOM   1469 O O   . ARG A 1 191 ? 10.612 19.949 14.213 1.00 10.60 ? 191 ARG D O   1 
ATOM   1470 C CB  . ARG A 1 191 ? 13.437 18.261 14.545 1.00 10.96 ? 191 ARG D CB  1 
ATOM   1471 C CG  . ARG A 1 191 ? 13.045 18.065 13.090 1.00 10.48 ? 191 ARG D CG  1 
ATOM   1472 C CD  . ARG A 1 191 ? 13.544 19.209 12.231 1.00 10.73 ? 191 ARG D CD  1 
ATOM   1473 N NE  . ARG A 1 191 ? 12.696 20.395 12.278 1.00 10.56 ? 191 ARG D NE  1 
ATOM   1474 C CZ  . ARG A 1 191 ? 13.032 21.549 11.715 1.00 10.20 ? 191 ARG D CZ  1 
ATOM   1475 N NH1 . ARG A 1 191 ? 14.203 21.663 11.102 1.00 10.49 ? 191 ARG D NH1 1 
ATOM   1476 N NH2 . ARG A 1 191 ? 12.219 22.588 11.785 1.00 10.58 ? 191 ARG D NH2 1 
ATOM   1477 N N   . PRO A 1 192 ? 10.461 18.354 15.773 1.00 11.30 ? 192 PRO D N   1 
ATOM   1478 C CA  . PRO A 1 192 ? 9.021  18.212 15.517 1.00 11.67 ? 192 PRO D CA  1 
ATOM   1479 C C   . PRO A 1 192 ? 8.201  19.348 16.068 1.00 12.60 ? 192 PRO D C   1 
ATOM   1480 O O   . PRO A 1 192 ? 7.004  19.434 15.756 1.00 14.98 ? 192 PRO D O   1 
ATOM   1481 C CB  . PRO A 1 192 ? 8.665  16.893 16.212 1.00 13.31 ? 192 PRO D CB  1 
ATOM   1482 C CG  . PRO A 1 192 ? 9.670  16.743 17.271 1.00 14.57 ? 192 PRO D CG  1 
ATOM   1483 C CD  . PRO A 1 192 ? 10.931 17.380 16.776 1.00 11.91 ? 192 PRO D CD  1 
ATOM   1484 N N   . LEU A 1 193 ? 8.801  20.234 16.856 1.00 10.13 ? 193 LEU D N   1 
ATOM   1485 C CA  . LEU A 1 193 ? 8.065  21.299 17.515 1.00 11.88 ? 193 LEU D CA  1 
ATOM   1486 C C   . LEU A 1 193 ? 7.965  22.565 16.688 1.00 12.12 ? 193 LEU D C   1 
ATOM   1487 O O   . LEU A 1 193 ? 7.222  23.475 17.067 1.00 15.12 ? 193 LEU D O   1 
ATOM   1488 C CB  . LEU A 1 193 ? 8.731  21.648 18.838 1.00 11.24 ? 193 LEU D CB  1 
ATOM   1489 C CG  . LEU A 1 193 ? 8.915  20.483 19.804 1.00 12.35 ? 193 LEU D CG  1 
ATOM   1490 C CD1 . LEU A 1 193 ? 9.664  20.947 21.036 1.00 13.37 ? 193 LEU D CD1 1 
ATOM   1491 C CD2 . LEU A 1 193 ? 7.577  19.858 20.187 1.00 18.96 ? 193 LEU D CD2 1 
ATOM   1492 N N   . THR A 1 194 ? 8.704  22.666 15.589 1.00 11.94 ? 194 THR D N   1 
ATOM   1493 C CA  . THR A 1 194 ? 8.720  23.897 14.824 1.00 11.62 ? 194 THR D CA  1 
ATOM   1494 C C   . THR A 1 194 ? 8.934  23.575 13.355 1.00 10.90 ? 194 THR D C   1 
ATOM   1495 O O   . THR A 1 194 ? 9.616  22.610 13.006 1.00 11.42 ? 194 THR D O   1 
ATOM   1496 C CB  . THR A 1 194 ? 9.810  24.857 15.339 1.00 10.57 ? 194 THR D CB  1 
ATOM   1497 O OG1 . THR A 1 194 ? 9.778  26.079 14.594 1.00 10.76 ? 194 THR D OG1 1 
ATOM   1498 C CG2 . THR A 1 194 ? 11.191 24.246 15.211 1.00 12.38 ? 194 THR D CG2 1 
ATOM   1499 N N   . THR A 1 195 ? 8.356  24.413 12.505 1.00 10.74 ? 195 THR D N   1 
ATOM   1500 C CA  . THR A 1 195 ? 8.605  24.363 11.074 1.00 11.95 ? 195 THR D CA  1 
ATOM   1501 C C   . THR A 1 195 ? 9.732  25.290 10.661 1.00 11.21 ? 195 THR D C   1 
ATOM   1502 O O   . THR A 1 195 ? 10.106 25.305 9.487  1.00 12.67 ? 195 THR D O   1 
ATOM   1503 C CB  . THR A 1 195 ? 7.341  24.762 10.303 1.00 14.47 ? 195 THR D CB  1 
ATOM   1504 O OG1 . THR A 1 195 ? 7.072  26.147 10.530 1.00 16.01 ? 195 THR D OG1 1 
ATOM   1505 C CG2 . THR A 1 195 ? 6.145  23.943 10.770 1.00 16.64 ? 195 THR D CG2 1 
ATOM   1506 N N   . LEU A 1 196 ? 10.257 26.084 11.585 1.00 9.96  ? 196 LEU D N   1 
ATOM   1507 C CA  . LEU A 1 196 ? 11.260 27.068 11.241 1.00 9.33  ? 196 LEU D CA  1 
ATOM   1508 C C   . LEU A 1 196 ? 12.600 26.405 11.010 1.00 9.97  ? 196 LEU D C   1 
ATOM   1509 O O   . LEU A 1 196 ? 12.874 25.330 11.543 1.00 9.77  ? 196 LEU D O   1 
ATOM   1510 C CB  . LEU A 1 196 ? 11.431 28.038 12.392 1.00 10.40 ? 196 LEU D CB  1 
ATOM   1511 C CG  . LEU A 1 196 ? 10.213 28.878 12.752 1.00 10.97 ? 196 LEU D CG  1 
ATOM   1512 C CD1 . LEU A 1 196 ? 10.568 29.766 13.922 1.00 10.58 ? 196 LEU D CD1 1 
ATOM   1513 C CD2 . LEU A 1 196 ? 9.716  29.677 11.548 1.00 12.35 ? 196 LEU D CD2 1 
ATOM   1514 N N   . PRO A 1 197 ? 13.464 27.038 10.232 1.00 9.23  ? 197 PRO D N   1 
ATOM   1515 C CA  . PRO A 1 197 ? 14.838 26.553 10.133 1.00 9.69  ? 197 PRO D CA  1 
ATOM   1516 C C   . PRO A 1 197 ? 15.505 26.574 11.496 1.00 8.36  ? 197 PRO D C   1 
ATOM   1517 O O   . PRO A 1 197 ? 15.397 27.546 12.250 1.00 8.94  ? 197 PRO D O   1 
ATOM   1518 C CB  . PRO A 1 197 ? 15.492 27.543 9.168  1.00 10.19 ? 197 PRO D CB  1 
ATOM   1519 C CG  . PRO A 1 197 ? 14.333 28.127 8.393  1.00 13.63 ? 197 PRO D CG  1 
ATOM   1520 C CD  . PRO A 1 197 ? 13.212 28.197 9.363  1.00 10.70 ? 197 PRO D CD  1 
ATOM   1521 N N   . ILE A 1 198 ? 16.181 25.479 11.806 1.00 7.82  ? 198 ILE D N   1 
ATOM   1522 C CA  . ILE A 1 198 ? 16.938 25.331 13.036 1.00 7.90  ? 198 ILE D CA  1 
ATOM   1523 C C   . ILE A 1 198 ? 18.410 25.405 12.687 1.00 7.96  ? 198 ILE D C   1 
ATOM   1524 O O   . ILE A 1 198 ? 18.912 24.596 11.895 1.00 8.32  ? 198 ILE D O   1 
ATOM   1525 C CB  . ILE A 1 198 ? 16.649 23.996 13.727 1.00 8.97  ? 198 ILE D CB  1 
ATOM   1526 C CG1 . ILE A 1 198 ? 15.186 23.932 14.143 1.00 9.20  ? 198 ILE D CG1 1 
ATOM   1527 C CG2 . ILE A 1 198 ? 17.577 23.818 14.918 1.00 9.76  ? 198 ILE D CG2 1 
ATOM   1528 C CD1 . ILE A 1 198 ? 14.725 22.545 14.518 1.00 12.10 ? 198 ILE D CD1 1 
ATOM   1529 N N   . ILE A 1 199 ? 19.097 26.377 13.276 1.00 7.55  ? 199 ILE D N   1 
ATOM   1530 C CA  . ILE A 1 199 ? 20.546 26.467 13.190 1.00 7.69  ? 199 ILE D CA  1 
ATOM   1531 C C   . ILE A 1 199 ? 21.081 25.795 14.440 1.00 7.81  ? 199 ILE D C   1 
ATOM   1532 O O   . ILE A 1 199 ? 20.918 26.319 15.545 1.00 7.99  ? 199 ILE D O   1 
ATOM   1533 C CB  . ILE A 1 199 ? 21.016 27.923 13.154 1.00 8.34  ? 199 ILE D CB  1 
ATOM   1534 C CG1 . ILE A 1 199 ? 20.317 28.716 12.050 1.00 9.24  ? 199 ILE D CG1 1 
ATOM   1535 C CG2 . ILE A 1 199 ? 22.506 27.967 13.041 1.00 9.14  ? 199 ILE D CG2 1 
ATOM   1536 C CD1 . ILE A 1 199 ? 20.486 30.218 12.205 1.00 13.10 ? 199 ILE D CD1 1 
ATOM   1537 N N   . ALA A 1 200 ? 21.730 24.655 14.280 1.00 7.86  ? 200 ALA D N   1 
ATOM   1538 C CA  . ALA A 1 200 ? 22.312 23.979 15.423 1.00 8.71  ? 200 ALA D CA  1 
ATOM   1539 C C   . ALA A 1 200 ? 23.648 24.615 15.758 1.00 7.74  ? 200 ALA D C   1 
ATOM   1540 O O   . ALA A 1 200 ? 24.442 24.921 14.866 1.00 8.25  ? 200 ALA D O   1 
ATOM   1541 C CB  . ALA A 1 200 ? 22.524 22.506 15.102 1.00 9.76  ? 200 ALA D CB  1 
ATOM   1542 N N   . SER A 1 201 ? 23.912 24.787 17.053 1.00 8.59  ? 201 SER D N   1 
ATOM   1543 C CA  . SER A 1 201 ? 25.139 25.440 17.473 1.00 8.71  ? 201 SER D CA  1 
ATOM   1544 C C   . SER A 1 201 ? 25.682 24.815 18.747 1.00 7.88  ? 201 SER D C   1 
ATOM   1545 O O   . SER A 1 201 ? 24.947 24.570 19.707 1.00 8.80  ? 201 SER D O   1 
ATOM   1546 C CB  . SER A 1 201 ? 24.910 26.934 17.719 1.00 9.42  ? 201 SER D CB  1 
ATOM   1547 O OG  . SER A 1 201 ? 26.140 27.542 18.071 1.00 12.15 ? 201 SER D OG  1 
ATOM   1548 N N   . GLY A 1 202 ? 26.990 24.605 18.743 1.00 8.71  ? 202 GLY D N   1 
ATOM   1549 C CA  . GLY A 1 202 ? 27.707 24.212 19.934 1.00 8.92  ? 202 GLY D CA  1 
ATOM   1550 C C   . GLY A 1 202 ? 28.113 22.754 19.894 1.00 8.71  ? 202 GLY D C   1 
ATOM   1551 O O   . GLY A 1 202 ? 27.267 21.856 19.913 1.00 10.05 ? 202 GLY D O   1 
ATOM   1552 N N   . GLY A 1 203 ? 29.414 22.514 19.844 1.00 8.44  ? 203 GLY D N   1 
ATOM   1553 C CA  . GLY A 1 203 ? 29.955 21.173 19.929 1.00 9.60  ? 203 GLY D CA  1 
ATOM   1554 C C   . GLY A 1 203 ? 30.709 20.694 18.712 1.00 9.96  ? 203 GLY D C   1 
ATOM   1555 O O   . GLY A 1 203 ? 31.394 19.661 18.808 1.00 10.24 ? 203 GLY D O   1 
ATOM   1556 N N   . ALA A 1 204 ? 30.621 21.365 17.562 1.00 9.34  ? 204 ALA D N   1 
ATOM   1557 C CA  . ALA A 1 204 ? 31.259 20.827 16.369 1.00 9.78  ? 204 ALA D CA  1 
ATOM   1558 C C   . ALA A 1 204 ? 32.754 20.635 16.595 1.00 9.88  ? 204 ALA D C   1 
ATOM   1559 O O   . ALA A 1 204 ? 33.442 21.536 17.081 1.00 10.00 ? 204 ALA D O   1 
ATOM   1560 C CB  . ALA A 1 204 ? 31.040 21.767 15.192 1.00 9.58  ? 204 ALA D CB  1 
ATOM   1561 N N   . GLY A 1 205 ? 33.254 19.463 16.215 1.00 10.67 ? 205 GLY D N   1 
ATOM   1562 C CA  . GLY A 1 205 ? 34.664 19.150 16.342 1.00 12.24 ? 205 GLY D CA  1 
ATOM   1563 C C   . GLY A 1 205 ? 35.234 18.497 15.094 1.00 12.80 ? 205 GLY D C   1 
ATOM   1564 O O   . GLY A 1 205 ? 36.428 18.632 14.811 1.00 14.32 ? 205 GLY D O   1 
ATOM   1565 N N   . LYS A 1 206 ? 34.401 17.790 14.329 1.00 13.59 ? 206 LYS D N   1 
ATOM   1566 C CA  . LYS A 1 206 ? 34.873 17.077 13.147 1.00 12.92 ? 206 LYS D CA  1 
ATOM   1567 C C   . LYS A 1 206 ? 33.744 17.004 12.127 1.00 12.49 ? 206 LYS D C   1 
ATOM   1568 O O   . LYS A 1 206 ? 32.575 17.217 12.451 1.00 12.62 ? 206 LYS D O   1 
ATOM   1569 C CB  . LYS A 1 206 ? 35.389 15.680 13.503 1.00 16.84 ? 206 LYS D CB  1 
ATOM   1570 C CG  . LYS A 1 206 ? 34.312 14.758 14.000 1.00 16.65 ? 206 LYS D CG  1 
ATOM   1571 C CD  . LYS A 1 206 ? 34.895 13.399 14.345 1.00 20.14 ? 206 LYS D CD  1 
ATOM   1572 C CE  . LYS A 1 206 ? 33.828 12.456 14.863 1.00 23.88 ? 206 LYS D CE  1 
ATOM   1573 N NZ  . LYS A 1 206 ? 34.428 11.154 15.255 1.00 27.99 ? 206 LYS D NZ  1 
ATOM   1574 N N   . MET A 1 207 ? 34.105 16.672 10.883 1.00 13.24 ? 207 MET D N   1 
ATOM   1575 C CA  . MET A 1 207 ? 33.118 16.677 9.803  1.00 12.97 ? 207 MET D CA  1 
ATOM   1576 C C   . MET A 1 207 ? 31.909 15.811 10.123 1.00 12.50 ? 207 MET D C   1 
ATOM   1577 O O   . MET A 1 207 ? 30.765 16.204 9.867  1.00 12.79 ? 207 MET D O   1 
ATOM   1578 C CB  . MET A 1 207 ? 33.771 16.231 8.499  1.00 14.70 ? 207 MET D CB  1 
ATOM   1579 C CG  . MET A 1 207 ? 34.857 17.160 8.040  1.00 16.34 ? 207 MET D CG  1 
ATOM   1580 S SD  . MET A 1 207 ? 35.368 16.812 6.358  1.00 21.02 ? 207 MET D SD  1 
ATOM   1581 C CE  . MET A 1 207 ? 34.932 15.086 6.201  1.00 27.24 ? 207 MET D CE  1 
ATOM   1582 N N   . GLU A 1 208 ? 32.134 14.630 10.690 1.00 12.14 ? 208 GLU D N   1 
ATOM   1583 C CA  . GLU A 1 208 ? 31.021 13.732 10.966 1.00 12.84 ? 208 GLU D CA  1 
ATOM   1584 C C   . GLU A 1 208 ? 30.001 14.362 11.911 1.00 11.02 ? 208 GLU D C   1 
ATOM   1585 O O   . GLU A 1 208 ? 28.810 14.039 11.844 1.00 11.80 ? 208 GLU D O   1 
ATOM   1586 C CB  . GLU A 1 208 ? 31.563 12.418 11.512 1.00 16.93 ? 208 GLU D CB  1 
ATOM   1587 C CG  . GLU A 1 208 ? 30.571 11.294 11.487 1.00 21.78 ? 208 GLU D CG  1 
ATOM   1588 C CD  . GLU A 1 208 ? 29.843 11.196 12.804 1.00 25.31 ? 208 GLU D CD  1 
ATOM   1589 O OE1 . GLU A 1 208 ? 30.004 12.112 13.631 1.00 27.64 ? 208 GLU D OE1 1 
ATOM   1590 O OE2 . GLU A 1 208 ? 29.134 10.200 13.030 1.00 28.83 ? 208 GLU D OE2 1 
ATOM   1591 N N   . HIS A 1 209 ? 30.437 15.266 12.796 1.00 11.70 ? 209 HIS D N   1 
ATOM   1592 C CA  . HIS A 1 209 ? 29.489 15.911 13.701 1.00 11.00 ? 209 HIS D CA  1 
ATOM   1593 C C   . HIS A 1 209 ? 28.456 16.702 12.924 1.00 10.11 ? 209 HIS D C   1 
ATOM   1594 O O   . HIS A 1 209 ? 27.284 16.759 13.307 1.00 10.36 ? 209 HIS D O   1 
ATOM   1595 C CB  . HIS A 1 209 ? 30.216 16.859 14.640 1.00 10.32 ? 209 HIS D CB  1 
ATOM   1596 C CG  . HIS A 1 209 ? 31.106 16.171 15.610 1.00 11.38 ? 209 HIS D CG  1 
ATOM   1597 N ND1 . HIS A 1 209 ? 32.113 16.833 16.271 1.00 11.29 ? 209 HIS D ND1 1 
ATOM   1598 C CD2 . HIS A 1 209 ? 31.134 14.890 16.050 1.00 12.55 ? 209 HIS D CD2 1 
ATOM   1599 C CE1 . HIS A 1 209 ? 32.725 15.992 17.085 1.00 11.93 ? 209 HIS D CE1 1 
ATOM   1600 N NE2 . HIS A 1 209 ? 32.155 14.806 16.966 1.00 13.87 ? 209 HIS D NE2 1 
ATOM   1601 N N   . PHE A 1 210 ? 28.890 17.352 11.848 1.00 10.13 ? 210 PHE D N   1 
ATOM   1602 C CA  . PHE A 1 210 ? 27.962 18.093 11.009 1.00 9.64  ? 210 PHE D CA  1 
ATOM   1603 C C   . PHE A 1 210 ? 26.933 17.163 10.397 1.00 9.23  ? 210 PHE D C   1 
ATOM   1604 O O   . PHE A 1 210 ? 25.744 17.482 10.362 1.00 9.58  ? 210 PHE D O   1 
ATOM   1605 C CB  . PHE A 1 210 ? 28.719 18.827 9.909  1.00 11.54 ? 210 PHE D CB  1 
ATOM   1606 C CG  . PHE A 1 210 ? 29.497 20.017 10.406 1.00 9.90  ? 210 PHE D CG  1 
ATOM   1607 C CD1 . PHE A 1 210 ? 30.736 19.858 10.993 1.00 11.65 ? 210 PHE D CD1 1 
ATOM   1608 C CD2 . PHE A 1 210 ? 28.974 21.300 10.297 1.00 9.79  ? 210 PHE D CD2 1 
ATOM   1609 C CE1 . PHE A 1 210 ? 31.442 20.964 11.452 1.00 11.46 ? 210 PHE D CE1 1 
ATOM   1610 C CE2 . PHE A 1 210 ? 29.675 22.402 10.764 1.00 11.37 ? 210 PHE D CE2 1 
ATOM   1611 C CZ  . PHE A 1 210 ? 30.903 22.235 11.346 1.00 11.06 ? 210 PHE D CZ  1 
ATOM   1612 N N   . LEU A 1 211 ? 27.377 16.004 9.897  1.00 9.90  ? 211 LEU D N   1 
ATOM   1613 C CA  . LEU A 1 211 ? 26.437 15.037 9.342  1.00 10.10 ? 211 LEU D CA  1 
ATOM   1614 C C   . LEU A 1 211 ? 25.388 14.659 10.371 1.00 9.85  ? 211 LEU D C   1 
ATOM   1615 O O   . LEU A 1 211 ? 24.187 14.650 10.078 1.00 9.93  ? 211 LEU D O   1 
ATOM   1616 C CB  . LEU A 1 211 ? 27.182 13.797 8.854  1.00 12.36 ? 211 LEU D CB  1 
ATOM   1617 C CG  . LEU A 1 211 ? 26.249 12.689 8.359  1.00 11.75 ? 211 LEU D CG  1 
ATOM   1618 C CD1 . LEU A 1 211 ? 25.419 13.182 7.200  1.00 13.95 ? 211 LEU D CD1 1 
ATOM   1619 C CD2 . LEU A 1 211 ? 27.039 11.440 7.973  1.00 14.85 ? 211 LEU D CD2 1 
ATOM   1620 N N   . GLU A 1 212 ? 25.822 14.373 11.598 1.00 9.53  ? 212 GLU D N   1 
ATOM   1621 C CA  . GLU A 1 212 ? 24.865 13.982 12.627 1.00 9.70  ? 212 GLU D CA  1 
ATOM   1622 C C   . GLU A 1 212 ? 23.871 15.104 12.925 1.00 9.43  ? 212 GLU D C   1 
ATOM   1623 O O   . GLU A 1 212 ? 22.688 14.843 13.172 1.00 10.25 ? 212 GLU D O   1 
ATOM   1624 C CB  . GLU A 1 212 ? 25.583 13.526 13.899 1.00 11.38 ? 212 GLU D CB  1 
ATOM   1625 C CG  . GLU A 1 212 ? 26.657 12.475 13.672 1.00 14.53 ? 212 GLU D CG  1 
ATOM   1626 C CD  . GLU A 1 212 ? 26.181 11.328 12.828 1.00 20.34 ? 212 GLU D CD  1 
ATOM   1627 O OE1 . GLU A 1 212 ? 25.076 10.806 13.075 1.00 22.45 ? 212 GLU D OE1 1 
ATOM   1628 O OE2 . GLU A 1 212 ? 26.904 10.979 11.879 1.00 27.44 ? 212 GLU D OE2 1 
ATOM   1629 N N   . ALA A 1 213 ? 24.335 16.360 12.942 1.00 9.32  ? 213 ALA D N   1 
ATOM   1630 C CA  . ALA A 1 213 ? 23.422 17.470 13.204 1.00 9.48  ? 213 ALA D CA  1 
ATOM   1631 C C   . ALA A 1 213 ? 22.349 17.553 12.130 1.00 9.02  ? 213 ALA D C   1 
ATOM   1632 O O   . ALA A 1 213 ? 21.163 17.745 12.427 1.00 9.10  ? 213 ALA D O   1 
ATOM   1633 C CB  . ALA A 1 213 ? 24.206 18.780 13.268 1.00 10.53 ? 213 ALA D CB  1 
ATOM   1634 N N   . PHE A 1 214 ? 22.748 17.399 10.869 1.00 9.29  ? 214 PHE D N   1 
ATOM   1635 C CA  . PHE A 1 214 ? 21.770 17.433 9.786  1.00 9.66  ? 214 PHE D CA  1 
ATOM   1636 C C   . PHE A 1 214 ? 20.835 16.231 9.834  1.00 9.37  ? 214 PHE D C   1 
ATOM   1637 O O   . PHE A 1 214 ? 19.622 16.369 9.632  1.00 10.45 ? 214 PHE D O   1 
ATOM   1638 C CB  . PHE A 1 214 ? 22.487 17.555 8.448  1.00 10.12 ? 214 PHE D CB  1 
ATOM   1639 C CG  . PHE A 1 214 ? 23.088 18.904 8.235  1.00 8.36  ? 214 PHE D CG  1 
ATOM   1640 C CD1 . PHE A 1 214 ? 22.290 20.039 8.269  1.00 8.99  ? 214 PHE D CD1 1 
ATOM   1641 C CD2 . PHE A 1 214 ? 24.443 19.048 8.029  1.00 9.54  ? 214 PHE D CD2 1 
ATOM   1642 C CE1 . PHE A 1 214 ? 22.841 21.304 8.085  1.00 10.11 ? 214 PHE D CE1 1 
ATOM   1643 C CE2 . PHE A 1 214 ? 25.003 20.315 7.851  1.00 10.30 ? 214 PHE D CE2 1 
ATOM   1644 C CZ  . PHE A 1 214 ? 24.197 21.440 7.868  1.00 9.37  ? 214 PHE D CZ  1 
ATOM   1645 N N   . LEU A 1 215 ? 21.366 15.049 10.149 1.00 9.79  ? 215 LEU D N   1 
ATOM   1646 C CA  . LEU A 1 215 ? 20.490 13.885 10.265 1.00 10.81 ? 215 LEU D CA  1 
ATOM   1647 C C   . LEU A 1 215 ? 19.502 14.039 11.409 1.00 10.95 ? 215 LEU D C   1 
ATOM   1648 O O   . LEU A 1 215 ? 18.405 13.477 11.356 1.00 12.40 ? 215 LEU D O   1 
ATOM   1649 C CB  . LEU A 1 215 ? 21.305 12.605 10.435 1.00 12.45 ? 215 LEU D CB  1 
ATOM   1650 C CG  . LEU A 1 215 ? 22.112 12.198 9.203  1.00 12.49 ? 215 LEU D CG  1 
ATOM   1651 C CD1 . LEU A 1 215 ? 23.011 11.012 9.552  1.00 15.26 ? 215 LEU D CD1 1 
ATOM   1652 C CD2 . LEU A 1 215 ? 21.205 11.879 8.003  1.00 18.06 ? 215 LEU D CD2 1 
ATOM   1653 N N   . ALA A 1 216 ? 19.855 14.808 12.435 1.00 10.25 ? 216 ALA D N   1 
ATOM   1654 C CA  . ALA A 1 216 ? 18.954 15.071 13.549 1.00 11.91 ? 216 ALA D CA  1 
ATOM   1655 C C   . ALA A 1 216 ? 17.882 16.091 13.208 1.00 11.22 ? 216 ALA D C   1 
ATOM   1656 O O   . ALA A 1 216 ? 16.947 16.270 13.999 1.00 12.56 ? 216 ALA D O   1 
ATOM   1657 C CB  . ALA A 1 216 ? 19.736 15.542 14.777 1.00 11.03 ? 216 ALA D CB  1 
ATOM   1658 N N   . GLY A 1 217 ? 17.998 16.763 12.072 1.00 11.36 ? 217 GLY D N   1 
ATOM   1659 C CA  . GLY A 1 217 ? 16.976 17.689 11.631 1.00 12.03 ? 217 GLY D CA  1 
ATOM   1660 C C   . GLY A 1 217 ? 17.425 19.130 11.521 1.00 10.43 ? 217 GLY D C   1 
ATOM   1661 O O   . GLY A 1 217 ? 16.595 19.982 11.172 1.00 10.82 ? 217 GLY D O   1 
ATOM   1662 N N   . ALA A 1 218 ? 18.686 19.459 11.799 1.00 8.84  ? 218 ALA D N   1 
ATOM   1663 C CA  . ALA A 1 218 ? 19.125 20.837 11.653 1.00 7.74  ? 218 ALA D CA  1 
ATOM   1664 C C   . ALA A 1 218 ? 19.009 21.257 10.200 1.00 8.20  ? 218 ALA D C   1 
ATOM   1665 O O   . ALA A 1 218 ? 19.207 20.457 9.270  1.00 8.79  ? 218 ALA D O   1 
ATOM   1666 C CB  . ALA A 1 218 ? 20.585 20.976 12.068 1.00 9.70  ? 218 ALA D CB  1 
ATOM   1667 N N   . ASP A 1 219 ? 18.703 22.530 10.002 1.00 8.39  ? 219 ASP D N   1 
ATOM   1668 C CA  . ASP A 1 219 ? 18.747 23.125 8.677  1.00 8.28  ? 219 ASP D CA  1 
ATOM   1669 C C   . ASP A 1 219 ? 20.039 23.859 8.404  1.00 7.61  ? 219 ASP D C   1 
ATOM   1670 O O   . ASP A 1 219 ? 20.377 24.092 7.239  1.00 8.99  ? 219 ASP D O   1 
ATOM   1671 C CB  . ASP A 1 219 ? 17.561 24.058 8.495  1.00 11.31 ? 219 ASP D CB  1 
ATOM   1672 C CG  . ASP A 1 219 ? 16.276 23.339 8.728  1.00 10.17 ? 219 ASP D CG  1 
ATOM   1673 O OD1 . ASP A 1 219 ? 15.968 22.451 7.907  1.00 14.98 ? 219 ASP D OD1 1 
ATOM   1674 O OD2 . ASP A 1 219 ? 15.607 23.574 9.744  1.00 10.62 ? 219 ASP D OD2 1 
ATOM   1675 N N   . ALA A 1 220 ? 20.749 24.240 9.456  1.00 7.85  ? 220 ALA D N   1 
ATOM   1676 C CA  . ALA A 1 220 ? 22.050 24.856 9.323  1.00 7.63  ? 220 ALA D CA  1 
ATOM   1677 C C   . ALA A 1 220 ? 22.882 24.400 10.504 1.00 6.94  ? 220 ALA D C   1 
ATOM   1678 O O   . ALA A 1 220 ? 22.354 24.068 11.566 1.00 8.40  ? 220 ALA D O   1 
ATOM   1679 C CB  . ALA A 1 220 ? 21.947 26.380 9.319  1.00 8.97  ? 220 ALA D CB  1 
ATOM   1680 N N   . ALA A 1 221 ? 24.186 24.383 10.297 1.00 7.60  ? 221 ALA D N   1 
ATOM   1681 C CA  . ALA A 1 221 ? 25.139 24.047 11.337 1.00 7.97  ? 221 ALA D CA  1 
ATOM   1682 C C   . ALA A 1 221 ? 26.049 25.242 11.538 1.00 8.04  ? 221 ALA D C   1 
ATOM   1683 O O   . ALA A 1 221 ? 26.761 25.653 10.617 1.00 9.25  ? 221 ALA D O   1 
ATOM   1684 C CB  . ALA A 1 221 ? 25.938 22.800 10.965 1.00 9.59  ? 221 ALA D CB  1 
ATOM   1685 N N   . LEU A 1 222 ? 26.004 25.810 12.731 1.00 8.08  ? 222 LEU D N   1 
ATOM   1686 C CA  . LEU A 1 222 ? 26.863 26.913 13.115 1.00 8.49  ? 222 LEU D CA  1 
ATOM   1687 C C   . LEU A 1 222 ? 28.047 26.355 13.882 1.00 8.32  ? 222 LEU D C   1 
ATOM   1688 O O   . LEU A 1 222 ? 27.901 25.445 14.707 1.00 8.44  ? 222 LEU D O   1 
ATOM   1689 C CB  . LEU A 1 222 ? 26.087 27.853 14.030 1.00 8.33  ? 222 LEU D CB  1 
ATOM   1690 C CG  . LEU A 1 222 ? 26.796 29.129 14.496 1.00 8.91  ? 222 LEU D CG  1 
ATOM   1691 C CD1 . LEU A 1 222 ? 27.130 30.003 13.304 1.00 10.45 ? 222 LEU D CD1 1 
ATOM   1692 C CD2 . LEU A 1 222 ? 25.977 29.899 15.530 1.00 9.93  ? 222 LEU D CD2 1 
ATOM   1693 N N   . ALA A 1 223 ? 29.222 26.912 13.628 1.00 9.26  ? 223 ALA D N   1 
ATOM   1694 C CA  . ALA A 1 223 ? 30.387 26.508 14.389 1.00 9.45  ? 223 ALA D CA  1 
ATOM   1695 C C   . ALA A 1 223 ? 31.308 27.698 14.544 1.00 9.51  ? 223 ALA D C   1 
ATOM   1696 O O   . ALA A 1 223 ? 31.440 28.536 13.643 1.00 9.72  ? 223 ALA D O   1 
ATOM   1697 C CB  . ALA A 1 223 ? 31.115 25.321 13.752 1.00 10.22 ? 223 ALA D CB  1 
ATOM   1698 N N   . ALA A 1 224 ? 31.927 27.762 15.713 1.00 10.56 ? 224 ALA D N   1 
ATOM   1699 C CA  . ALA A 1 224 ? 32.940 28.752 16.024 1.00 11.03 ? 224 ALA D CA  1 
ATOM   1700 C C   . ALA A 1 224 ? 34.313 28.101 16.069 1.00 11.84 ? 224 ALA D C   1 
ATOM   1701 O O   . ALA A 1 224 ? 35.151 28.377 15.214 1.00 13.49 ? 224 ALA D O   1 
ATOM   1702 C CB  . ALA A 1 224 ? 32.617 29.442 17.357 1.00 12.12 ? 224 ALA D CB  1 
ATOM   1703 N N   . SER A 1 225 ? 34.528 27.184 17.018 1.00 12.21 ? 225 SER D N   1 
ATOM   1704 C CA  . SER A 1 225 ? 35.859 26.631 17.270 1.00 12.30 ? 225 SER D CA  1 
ATOM   1705 C C   . SER A 1 225 ? 36.505 26.042 16.020 1.00 12.26 ? 225 SER D C   1 
ATOM   1706 O O   . SER A 1 225 ? 37.676 26.315 15.735 1.00 14.54 ? 225 SER D O   1 
ATOM   1707 C CB  . SER A 1 225 ? 35.810 25.591 18.389 1.00 13.16 ? 225 SER D CB  1 
ATOM   1708 O OG  . SER A 1 225 ? 35.333 26.144 19.605 1.00 13.68 ? 225 SER D OG  1 
ATOM   1709 N N   . VAL A 1 226 ? 35.783 25.200 15.279 1.00 13.02 ? 226 VAL D N   1 
ATOM   1710 C CA  . VAL A 1 226 ? 36.458 24.485 14.196 1.00 14.29 ? 226 VAL D CA  1 
ATOM   1711 C C   . VAL A 1 226 ? 36.917 25.419 13.090 1.00 13.87 ? 226 VAL D C   1 
ATOM   1712 O O   . VAL A 1 226 ? 37.842 25.079 12.346 1.00 18.20 ? 226 VAL D O   1 
ATOM   1713 C CB  . VAL A 1 226 ? 35.667 23.307 13.595 1.00 12.80 ? 226 VAL D CB  1 
ATOM   1714 C CG1 . VAL A 1 226 ? 35.530 22.198 14.611 1.00 13.15 ? 226 VAL D CG1 1 
ATOM   1715 C CG2 . VAL A 1 226 ? 34.311 23.763 13.054 1.00 14.12 ? 226 VAL D CG2 1 
ATOM   1716 N N   . PHE A 1 227 ? 36.278 26.576 12.937 1.00 13.57 ? 227 PHE D N   1 
ATOM   1717 C CA  . PHE A 1 227 ? 36.764 27.557 11.980 1.00 14.32 ? 227 PHE D CA  1 
ATOM   1718 C C   . PHE A 1 227 ? 37.751 28.519 12.629 1.00 15.73 ? 227 PHE D C   1 
ATOM   1719 O O   . PHE A 1 227 ? 38.783 28.845 12.033 1.00 18.87 ? 227 PHE D O   1 
ATOM   1720 C CB  . PHE A 1 227 ? 35.584 28.293 11.332 1.00 13.88 ? 227 PHE D CB  1 
ATOM   1721 C CG  . PHE A 1 227 ? 34.578 27.376 10.690 1.00 13.84 ? 227 PHE D CG  1 
ATOM   1722 C CD1 . PHE A 1 227 ? 34.989 26.405 9.794  1.00 18.04 ? 227 PHE D CD1 1 
ATOM   1723 C CD2 . PHE A 1 227 ? 33.225 27.477 10.985 1.00 13.64 ? 227 PHE D CD2 1 
ATOM   1724 C CE1 . PHE A 1 227 ? 34.078 25.556 9.206  1.00 16.92 ? 227 PHE D CE1 1 
ATOM   1725 C CE2 . PHE A 1 227 ? 32.309 26.626 10.394 1.00 14.36 ? 227 PHE D CE2 1 
ATOM   1726 C CZ  . PHE A 1 227 ? 32.731 25.672 9.504  1.00 17.52 ? 227 PHE D CZ  1 
ATOM   1727 N N   . HIS A 1 228 ? 37.473 28.928 13.870 1.00 15.69 ? 228 HIS D N   1 
ATOM   1728 C CA  . HIS A 1 228 ? 38.368 29.823 14.598 1.00 16.69 ? 228 HIS D CA  1 
ATOM   1729 C C   . HIS A 1 228 ? 39.754 29.207 14.762 1.00 18.50 ? 228 HIS D C   1 
ATOM   1730 O O   . HIS A 1 228 ? 40.770 29.861 14.503 1.00 21.18 ? 228 HIS D O   1 
ATOM   1731 C CB  . HIS A 1 228 ? 37.742 30.158 15.952 1.00 17.38 ? 228 HIS D CB  1 
ATOM   1732 C CG  . HIS A 1 228 ? 38.604 31.010 16.829 1.00 20.41 ? 228 HIS D CG  1 
ATOM   1733 N ND1 . HIS A 1 228 ? 38.915 32.318 16.526 1.00 25.19 ? 228 HIS D ND1 1 
ATOM   1734 C CD2 . HIS A 1 228 ? 39.217 30.739 18.005 1.00 23.43 ? 228 HIS D CD2 1 
ATOM   1735 C CE1 . HIS A 1 228 ? 39.685 32.816 17.477 1.00 29.32 ? 228 HIS D CE1 1 
ATOM   1736 N NE2 . HIS A 1 228 ? 39.883 31.879 18.387 1.00 27.63 ? 228 HIS D NE2 1 
ATOM   1737 N N   . PHE A 1 229 ? 39.814 27.942 15.175 1.00 17.46 ? 229 PHE D N   1 
ATOM   1738 C CA  . PHE A 1 229 ? 41.075 27.238 15.375 1.00 18.78 ? 229 PHE D CA  1 
ATOM   1739 C C   . PHE A 1 229 ? 41.576 26.540 14.114 1.00 19.50 ? 229 PHE D C   1 
ATOM   1740 O O   . PHE A 1 229 ? 42.577 25.818 14.179 1.00 20.59 ? 229 PHE D O   1 
ATOM   1741 C CB  . PHE A 1 229 ? 40.948 26.236 16.523 1.00 17.42 ? 229 PHE D CB  1 
ATOM   1742 C CG  . PHE A 1 229 ? 40.726 26.880 17.861 1.00 19.68 ? 229 PHE D CG  1 
ATOM   1743 C CD1 . PHE A 1 229 ? 41.697 27.699 18.419 1.00 21.93 ? 229 PHE D CD1 1 
ATOM   1744 C CD2 . PHE A 1 229 ? 39.559 26.656 18.574 1.00 17.93 ? 229 PHE D CD2 1 
ATOM   1745 C CE1 . PHE A 1 229 ? 41.504 28.292 19.654 1.00 23.53 ? 229 PHE D CE1 1 
ATOM   1746 C CE2 . PHE A 1 229 ? 39.358 27.247 19.813 1.00 19.98 ? 229 PHE D CE2 1 
ATOM   1747 C CZ  . PHE A 1 229 ? 40.334 28.062 20.354 1.00 20.15 ? 229 PHE D CZ  1 
ATOM   1748 N N   . ARG A 1 230 ? 40.911 26.748 12.974 1.00 18.79 ? 230 ARG D N   1 
ATOM   1749 C CA  . ARG A 1 230 ? 41.306 26.165 11.686 1.00 17.44 ? 230 ARG D CA  1 
ATOM   1750 C C   . ARG A 1 230 ? 41.447 24.643 11.759 1.00 21.04 ? 230 ARG D C   1 
ATOM   1751 O O   . ARG A 1 230 ? 42.470 24.067 11.375 1.00 22.71 ? 230 ARG D O   1 
ATOM   1752 C CB  . ARG A 1 230 ? 42.579 26.819 11.130 1.00 21.46 ? 230 ARG D CB  1 
ATOM   1753 C CG  . ARG A 1 230 ? 42.686 28.322 11.347 1.00 28.17 ? 230 ARG D CG  1 
ATOM   1754 C CD  . ARG A 1 230 ? 43.653 28.926 10.347 1.00 37.39 ? 230 ARG D CD  1 
ATOM   1755 N NE  . ARG A 1 230 ? 43.304 28.513 8.994  1.00 39.32 ? 230 ARG D NE  1 
ATOM   1756 C CZ  . ARG A 1 230 ? 44.141 28.519 7.964  1.00 40.94 ? 230 ARG D CZ  1 
ATOM   1757 N NH1 . ARG A 1 230 ? 45.395 28.920 8.122  1.00 40.50 ? 230 ARG D NH1 1 
ATOM   1758 N NH2 . ARG A 1 230 ? 43.714 28.125 6.774  1.00 42.19 ? 230 ARG D NH2 1 
ATOM   1759 N N   . GLU A 1 231 ? 40.387 23.984 12.227 1.00 16.88 ? 231 GLU D N   1 
ATOM   1760 C CA  . GLU A 1 231 ? 40.374 22.540 12.418 1.00 17.41 ? 231 GLU D CA  1 
ATOM   1761 C C   . GLU A 1 231 ? 39.621 21.782 11.332 1.00 19.90 ? 231 GLU D C   1 
ATOM   1762 O O   . GLU A 1 231 ? 39.806 20.566 11.209 1.00 22.79 ? 231 GLU D O   1 
ATOM   1763 C CB  . GLU A 1 231 ? 39.800 22.189 13.799 1.00 16.57 ? 231 GLU D CB  1 
ATOM   1764 C CG  . GLU A 1 231 ? 40.658 22.731 14.943 1.00 18.72 ? 231 GLU D CG  1 
ATOM   1765 C CD  . GLU A 1 231 ? 39.974 22.681 16.301 1.00 19.37 ? 231 GLU D CD  1 
ATOM   1766 O OE1 . GLU A 1 231 ? 38.734 22.532 16.356 1.00 19.54 ? 231 GLU D OE1 1 
ATOM   1767 O OE2 . GLU A 1 231 ? 40.684 22.802 17.324 1.00 18.76 ? 231 GLU D OE2 1 
ATOM   1768 N N   . ILE A 1 232 ? 38.786 22.456 10.548 1.00 19.36 ? 232 ILE D N   1 
ATOM   1769 C CA  . ILE A 1 232 ? 38.003 21.812 9.500  1.00 18.17 ? 232 ILE D CA  1 
ATOM   1770 C C   . ILE A 1 232 ? 38.058 22.681 8.255  1.00 21.91 ? 232 ILE D C   1 
ATOM   1771 O O   . ILE A 1 232 ? 37.923 23.907 8.334  1.00 23.72 ? 232 ILE D O   1 
ATOM   1772 C CB  . ILE A 1 232 ? 36.536 21.594 9.931  1.00 17.26 ? 232 ILE D CB  1 
ATOM   1773 C CG1 . ILE A 1 232 ? 36.453 20.628 11.112 1.00 20.57 ? 232 ILE D CG1 1 
ATOM   1774 C CG2 . ILE A 1 232 ? 35.715 21.050 8.770  1.00 20.18 ? 232 ILE D CG2 1 
ATOM   1775 C CD1 . ILE A 1 232 ? 35.037 20.250 11.468 1.00 22.69 ? 232 ILE D CD1 1 
ATOM   1776 N N   . ASP A 1 233 ? 38.243 22.042 7.101  1.00 21.08 ? 233 ASP D N   1 
ATOM   1777 C CA  . ASP A 1 233 ? 38.210 22.731 5.820  1.00 19.88 ? 233 ASP D CA  1 
ATOM   1778 C C   . ASP A 1 233 ? 36.780 22.761 5.297  1.00 18.95 ? 233 ASP D C   1 
ATOM   1779 O O   . ASP A 1 233 ? 36.106 21.727 5.260  1.00 18.49 ? 233 ASP D O   1 
ATOM   1780 C CB  . ASP A 1 233 ? 39.122 22.035 4.811  1.00 22.79 ? 233 ASP D CB  1 
ATOM   1781 C CG  . ASP A 1 233 ? 39.099 22.708 3.458  1.00 23.82 ? 233 ASP D CG  1 
ATOM   1782 O OD1 . ASP A 1 233 ? 39.736 23.775 3.325  1.00 27.47 ? 233 ASP D OD1 1 
ATOM   1783 O OD2 . ASP A 1 233 ? 38.461 22.177 2.525  1.00 22.41 ? 233 ASP D OD2 1 
ATOM   1784 N N   . VAL A 1 234 ? 36.326 23.943 4.880  1.00 19.75 ? 234 VAL D N   1 
ATOM   1785 C CA  . VAL A 1 234 ? 34.920 24.114 4.520  1.00 19.41 ? 234 VAL D CA  1 
ATOM   1786 C C   . VAL A 1 234 ? 34.573 23.312 3.267  1.00 16.43 ? 234 VAL D C   1 
ATOM   1787 O O   . VAL A 1 234 ? 33.544 22.631 3.213  1.00 18.63 ? 234 VAL D O   1 
ATOM   1788 C CB  . VAL A 1 234 ? 34.574 25.604 4.369  1.00 17.62 ? 234 VAL D CB  1 
ATOM   1789 C CG1 . VAL A 1 234 ? 33.155 25.761 3.836  1.00 19.88 ? 234 VAL D CG1 1 
ATOM   1790 C CG2 . VAL A 1 234 ? 34.750 26.327 5.699  1.00 19.87 ? 234 VAL D CG2 1 
ATOM   1791 N N   . ARG A 1 235 ? 35.419 23.388 2.238  1.00 21.24 ? 235 ARG D N   1 
ATOM   1792 C CA  . ARG A 1 235 ? 35.138 22.637 1.018  1.00 19.66 ? 235 ARG D CA  1 
ATOM   1793 C C   . ARG A 1 235 ? 35.136 21.139 1.278  1.00 18.37 ? 235 ARG D C   1 
ATOM   1794 O O   . ARG A 1 235 ? 34.244 20.423 0.806  1.00 21.10 ? 235 ARG D O   1 
ATOM   1795 C CB  . ARG A 1 235 ? 36.140 22.993 -0.080 1.00 21.77 ? 235 ARG D CB  1 
ATOM   1796 C CG  . ARG A 1 235 ? 35.981 22.141 -1.334 1.00 24.21 ? 235 ARG D CG  1 
ATOM   1797 C CD  . ARG A 1 235 ? 36.866 22.652 -2.463 1.00 29.30 ? 235 ARG D CD  1 
ATOM   1798 N NE  . ARG A 1 235 ? 36.457 22.197 -3.793 1.00 33.51 ? 235 ARG D NE  1 
ATOM   1799 C CZ  . ARG A 1 235 ? 36.549 20.940 -4.215 1.00 33.41 ? 235 ARG D CZ  1 
ATOM   1800 N NH1 . ARG A 1 235 ? 37.018 20.007 -3.406 1.00 34.88 ? 235 ARG D NH1 1 
ATOM   1801 N NH2 . ARG A 1 235 ? 36.165 20.613 -5.443 1.00 34.18 ? 235 ARG D NH2 1 
ATOM   1802 N N   . GLU A 1 236 ? 36.127 20.647 2.024  1.00 20.75 ? 236 GLU D N   1 
ATOM   1803 C CA  . GLU A 1 236 ? 36.157 19.225 2.341  1.00 21.60 ? 236 GLU D CA  1 
ATOM   1804 C C   . GLU A 1 236 ? 34.898 18.810 3.102  1.00 18.56 ? 236 GLU D C   1 
ATOM   1805 O O   . GLU A 1 236 ? 34.305 17.760 2.824  1.00 18.24 ? 236 GLU D O   1 
ATOM   1806 C CB  . GLU A 1 236 ? 37.413 18.907 3.151  1.00 24.54 ? 236 GLU D CB  1 
ATOM   1807 C CG  . GLU A 1 236 ? 37.571 17.447 3.523  1.00 27.31 ? 236 GLU D CG  1 
ATOM   1808 C CD  . GLU A 1 236 ? 38.910 17.160 4.175  1.00 27.85 ? 236 GLU D CD  1 
ATOM   1809 O OE1 . GLU A 1 236 ? 39.575 18.120 4.620  1.00 25.56 ? 236 GLU D OE1 1 
ATOM   1810 O OE2 . GLU A 1 236 ? 39.308 15.976 4.225  1.00 35.11 ? 236 GLU D OE2 1 
ATOM   1811 N N   . LEU A 1 237 ? 34.462 19.645 4.047  1.00 16.90 ? 237 LEU D N   1 
ATOM   1812 C CA  . LEU A 1 237 ? 33.251 19.365 4.814  1.00 15.88 ? 237 LEU D CA  1 
ATOM   1813 C C   . LEU A 1 237 ? 32.027 19.276 3.906  1.00 14.65 ? 237 LEU D C   1 
ATOM   1814 O O   . LEU A 1 237 ? 31.232 18.335 3.999  1.00 14.70 ? 237 LEU D O   1 
ATOM   1815 C CB  . LEU A 1 237 ? 33.069 20.468 5.853  1.00 14.59 ? 237 LEU D CB  1 
ATOM   1816 C CG  . LEU A 1 237 ? 31.736 20.488 6.595  1.00 12.99 ? 237 LEU D CG  1 
ATOM   1817 C CD1 . LEU A 1 237 ? 31.534 19.207 7.388  1.00 14.78 ? 237 LEU D CD1 1 
ATOM   1818 C CD2 . LEU A 1 237 ? 31.669 21.703 7.507  1.00 15.89 ? 237 LEU D CD2 1 
ATOM   1819 N N   . LYS A 1 238 ? 31.841 20.264 3.035  1.00 13.75 ? 238 LYS D N   1 
ATOM   1820 C CA  . LYS A 1 238 ? 30.666 20.251 2.169  1.00 14.93 ? 238 LYS D CA  1 
ATOM   1821 C C   . LYS A 1 238 ? 30.678 19.060 1.217  1.00 15.44 ? 238 LYS D C   1 
ATOM   1822 O O   . LYS A 1 238 ? 29.634 18.447 0.962  1.00 14.27 ? 238 LYS D O   1 
ATOM   1823 C CB  . LYS A 1 238 ? 30.570 21.563 1.404  1.00 14.59 ? 238 LYS D CB  1 
ATOM   1824 C CG  . LYS A 1 238 ? 30.042 22.708 2.236  1.00 13.51 ? 238 LYS D CG  1 
ATOM   1825 C CD  . LYS A 1 238 ? 29.814 23.908 1.359  1.00 14.94 ? 238 LYS D CD  1 
ATOM   1826 C CE  . LYS A 1 238 ? 28.742 24.816 1.927  1.00 14.20 ? 238 LYS D CE  1 
ATOM   1827 N NZ  . LYS A 1 238 ? 28.506 25.966 1.020  1.00 13.23 ? 238 LYS D NZ  1 
ATOM   1828 N N   . GLU A 1 239 ? 31.850 18.715 0.675  1.00 16.68 ? 239 GLU D N   1 
ATOM   1829 C CA  . GLU A 1 239 ? 31.924 17.551 -0.204 1.00 16.08 ? 239 GLU D CA  1 
ATOM   1830 C C   . GLU A 1 239 ? 31.510 16.283 0.528  1.00 17.64 ? 239 GLU D C   1 
ATOM   1831 O O   . GLU A 1 239 ? 30.752 15.467 -0.005 1.00 16.31 ? 239 GLU D O   1 
ATOM   1832 C CB  . GLU A 1 239 ? 33.334 17.393 -0.773 1.00 20.57 ? 239 GLU D CB  1 
ATOM   1833 C CG  . GLU A 1 239 ? 33.829 18.557 -1.614 1.00 19.26 ? 239 GLU D CG  1 
ATOM   1834 C CD  . GLU A 1 239 ? 33.094 18.710 -2.932 1.00 22.26 ? 239 GLU D CD  1 
ATOM   1835 O OE1 . GLU A 1 239 ? 32.296 17.818 -3.295 1.00 24.49 ? 239 GLU D OE1 1 
ATOM   1836 O OE2 . GLU A 1 239 ? 33.332 19.726 -3.619 1.00 28.16 ? 239 GLU D OE2 1 
ATOM   1837 N N   . TYR A 1 240 ? 31.995 16.108 1.757  1.00 15.64 ? 240 TYR D N   1 
ATOM   1838 C CA  . TYR A 1 240 ? 31.613 14.951 2.556  1.00 16.84 ? 240 TYR D CA  1 
ATOM   1839 C C   . TYR A 1 240 ? 30.114 14.939 2.824  1.00 15.15 ? 240 TYR D C   1 
ATOM   1840 O O   . TYR A 1 240 ? 29.461 13.899 2.699  1.00 15.53 ? 240 TYR D O   1 
ATOM   1841 C CB  . TYR A 1 240 ? 32.406 14.992 3.856  1.00 16.73 ? 240 TYR D CB  1 
ATOM   1842 C CG  . TYR A 1 240 ? 31.862 14.163 4.988  1.00 14.68 ? 240 TYR D CG  1 
ATOM   1843 C CD1 . TYR A 1 240 ? 32.110 12.798 5.065  1.00 17.79 ? 240 TYR D CD1 1 
ATOM   1844 C CD2 . TYR A 1 240 ? 31.137 14.758 6.010  1.00 15.57 ? 240 TYR D CD2 1 
ATOM   1845 C CE1 . TYR A 1 240 ? 31.625 12.046 6.121  1.00 18.28 ? 240 TYR D CE1 1 
ATOM   1846 C CE2 . TYR A 1 240 ? 30.649 14.021 7.058  1.00 15.61 ? 240 TYR D CE2 1 
ATOM   1847 C CZ  . TYR A 1 240 ? 30.897 12.670 7.117  1.00 17.26 ? 240 TYR D CZ  1 
ATOM   1848 O OH  . TYR A 1 240 ? 30.408 11.943 8.175  1.00 19.42 ? 240 TYR D OH  1 
ATOM   1849 N N   . LEU A 1 241 ? 29.549 16.093 3.188  1.00 12.86 ? 241 LEU D N   1 
ATOM   1850 C CA  . LEU A 1 241 ? 28.124 16.151 3.491  1.00 12.61 ? 241 LEU D CA  1 
ATOM   1851 C C   . LEU A 1 241 ? 27.286 15.849 2.260  1.00 14.46 ? 241 LEU D C   1 
ATOM   1852 O O   . LEU A 1 241 ? 26.298 15.112 2.338  1.00 14.71 ? 241 LEU D O   1 
ATOM   1853 C CB  . LEU A 1 241 ? 27.776 17.530 4.045  1.00 12.28 ? 241 LEU D CB  1 
ATOM   1854 C CG  . LEU A 1 241 ? 28.293 17.788 5.458  1.00 12.32 ? 241 LEU D CG  1 
ATOM   1855 C CD1 . LEU A 1 241 ? 28.040 19.232 5.834  1.00 12.31 ? 241 LEU D CD1 1 
ATOM   1856 C CD2 . LEU A 1 241 ? 27.639 16.848 6.445  1.00 12.40 ? 241 LEU D CD2 1 
ATOM   1857 N N   . LYS A 1 242 ? 27.657 16.424 1.117  1.00 14.63 ? 242 LYS D N   1 
ATOM   1858 C CA  . LYS A 1 242 ? 26.910 16.153 -0.107 1.00 16.68 ? 242 LYS D CA  1 
ATOM   1859 C C   . LYS A 1 242 ? 26.974 14.675 -0.468 1.00 20.30 ? 242 LYS D C   1 
ATOM   1860 O O   . LYS A 1 242 ? 25.974 14.091 -0.898 1.00 18.95 ? 242 LYS D O   1 
ATOM   1861 C CB  . LYS A 1 242 ? 27.429 17.026 -1.250 1.00 18.67 ? 242 LYS D CB  1 
ATOM   1862 C CG  . LYS A 1 242 ? 26.467 17.145 -2.424 1.00 17.66 ? 242 LYS D CG  1 
ATOM   1863 C CD  . LYS A 1 242 ? 25.268 18.019 -2.068 1.00 19.30 ? 242 LYS D CD  1 
ATOM   1864 C CE  . LYS A 1 242 ? 24.558 18.536 -3.311 1.00 21.62 ? 242 LYS D CE  1 
ATOM   1865 N NZ  . LYS A 1 242 ? 23.472 19.498 -2.972 1.00 19.42 ? 242 LYS D NZ  1 
ATOM   1866 N N   . LYS A 1 243 ? 28.134 14.045 -0.260 1.00 17.63 ? 243 LYS D N   1 
ATOM   1867 C CA  . LYS A 1 243 ? 28.275 12.616 -0.529 1.00 20.81 ? 243 LYS D CA  1 
ATOM   1868 C C   . LYS A 1 243 ? 27.328 11.789 0.330  1.00 22.29 ? 243 LYS D C   1 
ATOM   1869 O O   . LYS A 1 243 ? 26.914 10.695 -0.073 1.00 26.06 ? 243 LYS D O   1 
ATOM   1870 C CB  . LYS A 1 243 ? 29.727 12.188 -0.293 1.00 23.06 ? 243 LYS D CB  1 
ATOM   1871 C CG  . LYS A 1 243 ? 29.988 10.686 -0.391 1.00 26.98 ? 243 LYS D CG  1 
ATOM   1872 C CD  . LYS A 1 243 ? 31.458 10.358 -0.147 1.00 31.16 ? 243 LYS D CD  1 
ATOM   1873 C CE  . LYS A 1 243 ? 31.837 9.005  -0.732 1.00 35.66 ? 243 LYS D CE  1 
ATOM   1874 N NZ  . LYS A 1 243 ? 33.314 8.787  -0.723 1.00 41.48 ? 243 LYS D NZ  1 
ATOM   1875 N N   . HIS A 1 244 ? 26.968 12.289 1.512  1.00 20.01 ? 244 HIS D N   1 
ATOM   1876 C CA  . HIS A 1 244 ? 26.080 11.584 2.423  1.00 21.07 ? 244 HIS D CA  1 
ATOM   1877 C C   . HIS A 1 244 ? 24.645 12.094 2.355  1.00 20.57 ? 244 HIS D C   1 
ATOM   1878 O O   . HIS A 1 244 ? 23.871 11.884 3.295  1.00 24.62 ? 244 HIS D O   1 
ATOM   1879 C CB  . HIS A 1 244 ? 26.641 11.619 3.846  1.00 21.60 ? 244 HIS D CB  1 
ATOM   1880 C CG  . HIS A 1 244 ? 27.840 10.743 4.032  1.00 21.13 ? 244 HIS D CG  1 
ATOM   1881 N ND1 . HIS A 1 244 ? 29.117 11.145 3.703  1.00 25.00 ? 244 HIS D ND1 1 
ATOM   1882 C CD2 . HIS A 1 244 ? 27.955 9.476  4.497  1.00 24.40 ? 244 HIS D CD2 1 
ATOM   1883 C CE1 . HIS A 1 244 ? 29.966 10.166 3.960  1.00 24.66 ? 244 HIS D CE1 1 
ATOM   1884 N NE2 . HIS A 1 244 ? 29.286 9.142  4.444  1.00 30.68 ? 244 HIS D NE2 1 
ATOM   1885 N N   . GLY A 1 245 ? 24.276 12.756 1.260  1.00 21.91 ? 245 GLY D N   1 
ATOM   1886 C CA  . GLY A 1 245 ? 22.897 13.106 1.005  1.00 22.60 ? 245 GLY D CA  1 
ATOM   1887 C C   . GLY A 1 245 ? 22.429 14.435 1.560  1.00 21.16 ? 245 GLY D C   1 
ATOM   1888 O O   . GLY A 1 245 ? 21.258 14.785 1.362  1.00 22.63 ? 245 GLY D O   1 
ATOM   1889 N N   . VAL A 1 246 ? 23.294 15.190 2.235  1.00 15.96 ? 246 VAL D N   1 
ATOM   1890 C CA  . VAL A 1 246 ? 22.894 16.465 2.821  1.00 14.59 ? 246 VAL D CA  1 
ATOM   1891 C C   . VAL A 1 246 ? 22.927 17.538 1.745  1.00 12.25 ? 246 VAL D C   1 
ATOM   1892 O O   . VAL A 1 246 ? 23.928 17.692 1.032  1.00 15.35 ? 246 VAL D O   1 
ATOM   1893 C CB  . VAL A 1 246 ? 23.810 16.837 3.998  1.00 14.59 ? 246 VAL D CB  1 
ATOM   1894 C CG1 . VAL A 1 246 ? 23.353 18.144 4.630  1.00 14.02 ? 246 VAL D CG1 1 
ATOM   1895 C CG2 . VAL A 1 246 ? 23.848 15.719 5.028  1.00 15.85 ? 246 VAL D CG2 1 
ATOM   1896 N N   . ASN A 1 247 ? 21.855 18.327 1.664  1.00 13.78 ? 247 ASN D N   1 
ATOM   1897 C CA  . ASN A 1 247 ? 21.676 19.281 0.568  1.00 14.41 ? 247 ASN D CA  1 
ATOM   1898 C C   . ASN A 1 247 ? 22.425 20.596 0.812  1.00 12.15 ? 247 ASN D C   1 
ATOM   1899 O O   . ASN A 1 247 ? 21.847 21.679 0.856  1.00 13.07 ? 247 ASN D O   1 
ATOM   1900 C CB  . ASN A 1 247 ? 20.198 19.525 0.294  1.00 13.58 ? 247 ASN D CB  1 
ATOM   1901 C CG  . ASN A 1 247 ? 19.978 20.390 -0.928 1.00 14.14 ? 247 ASN D CG  1 
ATOM   1902 O OD1 . ASN A 1 247 ? 20.786 20.368 -1.855 1.00 13.81 ? 247 ASN D OD1 1 
ATOM   1903 N ND2 . ASN A 1 247 ? 18.907 21.171 -0.929 1.00 15.41 ? 247 ASN D ND2 1 
ATOM   1904 N N   . VAL A 1 248 ? 23.749 20.487 0.915  1.00 12.87 ? 248 VAL D N   1 
ATOM   1905 C CA  . VAL A 1 248 ? 24.604 21.667 0.974  1.00 13.38 ? 248 VAL D CA  1 
ATOM   1906 C C   . VAL A 1 248 ? 24.839 22.212 -0.432 1.00 13.07 ? 248 VAL D C   1 
ATOM   1907 O O   . VAL A 1 248 ? 24.692 21.510 -1.442 1.00 15.67 ? 248 VAL D O   1 
ATOM   1908 C CB  . VAL A 1 248 ? 25.940 21.369 1.680  1.00 12.52 ? 248 VAL D CB  1 
ATOM   1909 C CG1 . VAL A 1 248 ? 25.720 21.073 3.155  1.00 14.76 ? 248 VAL D CG1 1 
ATOM   1910 C CG2 . VAL A 1 248 ? 26.672 20.225 1.001  1.00 16.02 ? 248 VAL D CG2 1 
ATOM   1911 N N   . ARG A 1 249 ? 25.237 23.477 -0.489 1.00 14.64 ? 249 ARG D N   1 
ATOM   1912 C CA  . ARG A 1 249 ? 25.519 24.162 -1.741 1.00 16.35 ? 249 ARG D CA  1 
ATOM   1913 C C   . ARG A 1 249 ? 27.001 24.008 -2.057 1.00 15.19 ? 249 ARG D C   1 
ATOM   1914 O O   . ARG A 1 249 ? 27.856 24.459 -1.286 1.00 15.60 ? 249 ARG D O   1 
ATOM   1915 C CB  . ARG A 1 249 ? 25.158 25.640 -1.604 1.00 19.37 ? 249 ARG D CB  1 
ATOM   1916 C CG  . ARG A 1 249 ? 25.876 26.552 -2.579 1.00 26.26 ? 249 ARG D CG  1 
ATOM   1917 C CD  . ARG A 1 249 ? 25.464 28.002 -2.416 1.00 30.00 ? 249 ARG D CD  1 
ATOM   1918 N NE  . ARG A 1 249 ? 26.104 28.852 -3.417 1.00 36.04 ? 249 ARG D NE  1 
ATOM   1919 C CZ  . ARG A 1 249 ? 27.220 29.543 -3.206 1.00 36.99 ? 249 ARG D CZ  1 
ATOM   1920 N NH1 . ARG A 1 249 ? 27.823 29.489 -2.027 1.00 37.16 ? 249 ARG D NH1 1 
ATOM   1921 N NH2 . ARG A 1 249 ? 27.734 30.290 -4.176 1.00 37.22 ? 249 ARG D NH2 1 
ATOM   1922 N N   . LEU A 1 250 ? 27.305 23.366 -3.188 1.00 14.79 ? 250 LEU D N   1 
ATOM   1923 C CA  . LEU A 1 250 ? 28.686 23.215 -3.628 1.00 16.25 ? 250 LEU D CA  1 
ATOM   1924 C C   . LEU A 1 250 ? 29.112 24.299 -4.607 1.00 18.38 ? 250 LEU D C   1 
ATOM   1925 O O   . LEU A 1 250 ? 30.305 24.394 -4.913 1.00 20.97 ? 250 LEU D O   1 
ATOM   1926 C CB  . LEU A 1 250 ? 28.900 21.841 -4.274 1.00 15.83 ? 250 LEU D CB  1 
ATOM   1927 C CG  . LEU A 1 250 ? 28.679 20.627 -3.369 1.00 15.59 ? 250 LEU D CG  1 
ATOM   1928 C CD1 . LEU A 1 250 ? 29.109 19.371 -4.106 1.00 19.62 ? 250 LEU D CD1 1 
ATOM   1929 C CD2 . LEU A 1 250 ? 29.417 20.754 -2.036 1.00 19.42 ? 250 LEU D CD2 1 
ATOM   1930 N N   . GLU A 1 251 ? 28.165 25.089 -5.117 1.00 19.93 ? 251 GLU D N   1 
ATOM   1931 C CA  . GLU A 1 251 ? 28.482 26.219 -5.983 1.00 24.72 ? 251 GLU D CA  1 
ATOM   1932 C C   . GLU A 1 251 ? 29.576 27.081 -5.371 1.00 26.68 ? 251 GLU D C   1 
ATOM   1933 O O   . GLU A 1 251 ? 29.568 27.362 -4.171 1.00 33.32 ? 251 GLU D O   1 
ATOM   1934 C CB  . GLU A 1 251 ? 27.238 27.092 -6.157 1.00 28.65 ? 251 GLU D CB  1 
ATOM   1935 C CG  . GLU A 1 251 ? 26.067 26.437 -6.837 1.00 29.00 ? 251 GLU D CG  1 
ATOM   1936 C CD  . GLU A 1 251 ? 25.182 25.627 -5.911 1.00 28.13 ? 251 GLU D CD  1 
ATOM   1937 O OE1 . GLU A 1 251 ? 23.942 25.731 -6.036 1.00 31.85 ? 251 GLU D OE1 1 
ATOM   1938 O OE2 . GLU A 1 251 ? 25.717 24.860 -5.086 1.00 32.04 ? 251 GLU D OE2 1 
ATOM   1939 N N   . GLY A 1 252 ? 30.517 27.507 -6.210 1.00 31.16 ? 252 GLY D N   1 
ATOM   1940 C CA  . GLY A 1 252 ? 31.543 28.437 -5.797 1.00 35.20 ? 252 GLY D CA  1 
ATOM   1941 C C   . GLY A 1 252 ? 32.691 27.844 -5.011 1.00 38.99 ? 252 GLY D C   1 
ATOM   1942 O O   . GLY A 1 252 ? 33.606 28.588 -4.634 1.00 39.90 ? 252 GLY D O   1 
ATOM   1943 N N   . LEU A 1 253 ? 32.679 26.542 -4.744 1.00 33.18 ? 253 LEU D N   1 
ATOM   1944 C CA  . LEU A 1 253 ? 33.794 25.905 -4.051 1.00 36.35 ? 253 LEU D CA  1 
ATOM   1945 C C   . LEU A 1 253 ? 34.960 25.681 -5.007 1.00 38.77 ? 253 LEU D C   1 
ATOM   1946 O O   . LEU A 1 253 ? 36.085 25.427 -4.578 1.00 40.00 ? 253 LEU D O   1 
ATOM   1947 C CB  . LEU A 1 253 ? 33.370 24.573 -3.431 1.00 30.05 ? 253 LEU D CB  1 
ATOM   1948 C CG  . LEU A 1 253 ? 32.465 24.631 -2.202 1.00 29.12 ? 253 LEU D CG  1 
ATOM   1949 C CD1 . LEU A 1 253 ? 32.002 23.234 -1.825 1.00 25.60 ? 253 LEU D CD1 1 
ATOM   1950 C CD2 . LEU A 1 253 ? 33.183 25.296 -1.041 1.00 28.09 ? 253 LEU D CD2 1 
HETATM 1951 P P   . PO4 B 2 .   ? 31.552 25.910 18.906 0.00 11.71 ? 301 PO4 D P   1 
HETATM 1952 O O1  . PO4 B 2 .   ? 31.665 25.480 17.463 0.00 11.08 ? 301 PO4 D O1  1 
HETATM 1953 O O2  . PO4 B 2 .   ? 32.860 26.512 19.359 0.00 13.18 ? 301 PO4 D O2  1 
HETATM 1954 O O3  . PO4 B 2 .   ? 31.227 24.711 19.765 0.00 11.19 ? 301 PO4 D O3  1 
HETATM 1955 O O4  . PO4 B 2 .   ? 30.455 26.939 19.037 0.00 12.36 ? 301 PO4 D O4  1 
HETATM 1956 P P   . PO4 C 2 .   ? 21.542 38.172 24.758 0.00 15.96 ? 302 PO4 D P   1 
HETATM 1957 O O1  . PO4 C 2 .   ? 20.848 38.260 23.419 0.00 15.00 ? 302 PO4 D O1  1 
HETATM 1958 O O2  . PO4 C 2 .   ? 23.028 38.010 24.545 0.00 17.81 ? 302 PO4 D O2  1 
HETATM 1959 O O3  . PO4 C 2 .   ? 21.012 36.982 25.521 0.00 14.78 ? 302 PO4 D O3  1 
HETATM 1960 O O4  . PO4 C 2 .   ? 21.280 39.433 25.545 0.00 16.94 ? 302 PO4 D O4  1 
HETATM 1961 O O   . HOH D 3 .   ? 19.426 12.424 15.968 1.00 28.68 ? 401 HOH D O   1 
HETATM 1962 O O   . HOH D 3 .   ? 38.346 18.512 -3.160 1.00 33.28 ? 402 HOH D O   1 
HETATM 1963 O O   . HOH D 3 .   ? 6.432  36.688 11.198 1.00 22.93 ? 403 HOH D O   1 
HETATM 1964 O O   . HOH D 3 .   ? 19.512 41.655 26.088 1.00 32.59 ? 404 HOH D O   1 
HETATM 1965 O O   . HOH D 3 .   ? 42.094 34.411 13.888 1.00 30.79 ? 405 HOH D O   1 
HETATM 1966 O O   . HOH D 3 .   ? 42.587 42.937 6.906  1.00 30.12 ? 406 HOH D O   1 
HETATM 1967 O O   . HOH D 3 .   ? 38.020 24.522 -5.232 1.00 34.20 ? 407 HOH D O   1 
HETATM 1968 O O   . HOH D 3 .   ? 17.136 17.632 41.089 1.00 30.21 ? 408 HOH D O   1 
HETATM 1969 O O   . HOH D 3 .   ? 41.229 31.943 12.708 1.00 31.54 ? 409 HOH D O   1 
HETATM 1970 O O   . HOH D 3 .   ? 37.521 46.359 8.988  1.00 29.22 ? 410 HOH D O   1 
HETATM 1971 O O   . HOH D 3 .   ? 20.690 32.001 9.389  1.00 22.15 ? 411 HOH D O   1 
HETATM 1972 O O   . HOH D 3 .   ? 15.293 20.194 8.404  1.00 23.14 ? 412 HOH D O   1 
HETATM 1973 O O   . HOH D 3 .   ? 33.426 24.233 16.322 1.00 11.12 ? 413 HOH D O   1 
HETATM 1974 O O   . HOH D 3 .   ? 18.661 39.352 23.475 1.00 13.75 ? 414 HOH D O   1 
HETATM 1975 O O   . HOH D 3 .   ? 16.294 11.489 20.453 1.00 27.20 ? 415 HOH D O   1 
HETATM 1976 O O   . HOH D 3 .   ? 1.247  31.965 23.942 1.00 28.80 ? 416 HOH D O   1 
HETATM 1977 O O   . HOH D 3 .   ? 39.342 45.744 5.803  1.00 30.27 ? 417 HOH D O   1 
HETATM 1978 O O   . HOH D 3 .   ? 32.076 20.076 -5.765 1.00 24.81 ? 418 HOH D O   1 
HETATM 1979 O O   . HOH D 3 .   ? 39.397 25.929 8.813  1.00 33.46 ? 419 HOH D O   1 
HETATM 1980 O O   . HOH D 3 .   ? 27.609 45.191 -0.069 1.00 35.90 ? 420 HOH D O   1 
HETATM 1981 O O   . HOH D 3 .   ? 18.956 16.173 40.521 1.00 32.56 ? 421 HOH D O   1 
HETATM 1982 O O   . HOH D 3 .   ? 21.545 30.054 20.817 1.00 11.72 ? 422 HOH D O   1 
HETATM 1983 O O   . HOH D 3 .   ? 25.829 29.599 19.607 1.00 20.68 ? 423 HOH D O   1 
HETATM 1984 O O   . HOH D 3 .   ? 35.786 32.650 20.809 1.00 27.34 ? 424 HOH D O   1 
HETATM 1985 O O   . HOH D 3 .   ? 22.296 35.005 26.592 1.00 16.74 ? 425 HOH D O   1 
HETATM 1986 O O   . HOH D 3 .   ? 30.139 31.374 0.113  1.00 23.35 ? 426 HOH D O   1 
HETATM 1987 O O   . HOH D 3 .   ? 32.353 12.998 21.052 1.00 30.38 ? 427 HOH D O   1 
HETATM 1988 O O   . HOH D 3 .   ? 25.349 24.703 2.018  1.00 17.17 ? 428 HOH D O   1 
HETATM 1989 O O   . HOH D 3 .   ? 21.612 17.333 32.957 1.00 24.11 ? 429 HOH D O   1 
HETATM 1990 O O   . HOH D 3 .   ? 33.590 48.565 15.053 1.00 23.91 ? 430 HOH D O   1 
HETATM 1991 O O   . HOH D 3 .   ? 14.210 18.330 -3.841 1.00 15.74 ? 431 HOH D O   1 
HETATM 1992 O O   . HOH D 3 .   ? 8.328  35.157 28.329 1.00 23.47 ? 432 HOH D O   1 
HETATM 1993 O O   . HOH D 3 .   ? 7.483  26.232 30.232 1.00 15.90 ? 433 HOH D O   1 
HETATM 1994 O O   . HOH D 3 .   ? 24.813 31.812 1.157  1.00 22.86 ? 434 HOH D O   1 
HETATM 1995 O O   . HOH D 3 .   ? 14.109 43.074 30.280 1.00 26.36 ? 435 HOH D O   1 
HETATM 1996 O O   . HOH D 3 .   ? 10.074 26.922 7.408  1.00 31.02 ? 436 HOH D O   1 
HETATM 1997 O O   . HOH D 3 .   ? 3.799  25.656 13.183 1.00 29.35 ? 437 HOH D O   1 
HETATM 1998 O O   . HOH D 3 .   ? 23.244 34.706 18.985 1.00 27.07 ? 438 HOH D O   1 
HETATM 1999 O O   . HOH D 3 .   ? 42.926 44.849 9.142  1.00 31.44 ? 439 HOH D O   1 
HETATM 2000 O O   . HOH D 3 .   ? 17.931 31.086 25.602 1.00 10.65 ? 440 HOH D O   1 
HETATM 2001 O O   . HOH D 3 .   ? 28.849 28.134 17.315 1.00 14.15 ? 441 HOH D O   1 
HETATM 2002 O O   . HOH D 3 .   ? 3.910  21.274 30.537 1.00 19.00 ? 442 HOH D O   1 
HETATM 2003 O O   . HOH D 3 .   ? 23.184 43.035 3.952  1.00 15.44 ? 443 HOH D O   1 
HETATM 2004 O O   . HOH D 3 .   ? 3.449  38.973 19.378 1.00 17.11 ? 444 HOH D O   1 
HETATM 2005 O O   . HOH D 3 .   ? 8.322  45.956 23.726 1.00 30.80 ? 445 HOH D O   1 
HETATM 2006 O O   . HOH D 3 .   ? 15.890 33.821 8.524  1.00 29.34 ? 446 HOH D O   1 
HETATM 2007 O O   . HOH D 3 .   ? 47.948 35.528 14.016 1.00 41.97 ? 447 HOH D O   1 
HETATM 2008 O O   . HOH D 3 .   ? 41.082 28.122 6.437  1.00 40.76 ? 448 HOH D O   1 
HETATM 2009 O O   . HOH D 3 .   ? 38.184 19.882 16.363 1.00 20.39 ? 449 HOH D O   1 
HETATM 2010 O O   . HOH D 3 .   ? 36.642 32.111 12.684 1.00 22.65 ? 450 HOH D O   1 
HETATM 2011 O O   . HOH D 3 .   ? 18.316 17.875 7.872  1.00 22.26 ? 451 HOH D O   1 
HETATM 2012 O O   . HOH D 3 .   ? 21.686 32.280 27.610 1.00 15.45 ? 452 HOH D O   1 
HETATM 2013 O O   . HOH D 3 .   ? 29.627 18.214 27.530 1.00 22.28 ? 453 HOH D O   1 
HETATM 2014 O O   . HOH D 3 .   ? 19.496 42.375 4.492  1.00 22.68 ? 454 HOH D O   1 
HETATM 2015 O O   . HOH D 3 .   ? 11.418 31.153 8.228  1.00 17.93 ? 455 HOH D O   1 
HETATM 2016 O O   . HOH D 3 .   ? 30.617 9.273  8.117  1.00 27.56 ? 456 HOH D O   1 
HETATM 2017 O O   . HOH D 3 .   ? 27.141 29.780 30.230 1.00 24.26 ? 457 HOH D O   1 
HETATM 2018 O O   . HOH D 3 .   ? 35.638 16.629 22.705 1.00 27.73 ? 458 HOH D O   1 
HETATM 2019 O O   . HOH D 3 .   ? 15.718 43.536 26.979 1.00 23.48 ? 459 HOH D O   1 
HETATM 2020 O O   . HOH D 3 .   ? 36.850 24.998 21.735 1.00 14.92 ? 460 HOH D O   1 
HETATM 2021 O O   . HOH D 3 .   ? 35.566 15.662 1.695  1.00 22.04 ? 461 HOH D O   1 
HETATM 2022 O O   . HOH D 3 .   ? 21.555 39.473 21.116 1.00 14.77 ? 462 HOH D O   1 
HETATM 2023 O O   . HOH D 3 .   ? 27.060 28.308 25.198 1.00 20.21 ? 463 HOH D O   1 
HETATM 2024 O O   . HOH D 3 .   ? 13.532 18.753 35.595 1.00 16.45 ? 464 HOH D O   1 
HETATM 2025 O O   . HOH D 3 .   ? 27.514 50.148 4.695  1.00 28.16 ? 465 HOH D O   1 
HETATM 2026 O O   . HOH D 3 .   ? 24.694 35.089 -1.007 1.00 31.52 ? 466 HOH D O   1 
HETATM 2027 O O   . HOH D 3 .   ? 4.244  23.798 30.359 1.00 25.02 ? 467 HOH D O   1 
HETATM 2028 O O   . HOH D 3 .   ? 27.138 14.426 19.278 1.00 21.51 ? 468 HOH D O   1 
HETATM 2029 O O   . HOH D 3 .   ? 34.407 30.599 13.512 1.00 18.44 ? 469 HOH D O   1 
HETATM 2030 O O   . HOH D 3 .   ? 4.944  46.036 14.074 1.00 27.89 ? 470 HOH D O   1 
HETATM 2031 O O   . HOH D 3 .   ? 12.718 50.984 12.379 1.00 28.41 ? 471 HOH D O   1 
HETATM 2032 O O   . HOH D 3 .   ? 7.343  32.243 12.696 1.00 16.41 ? 472 HOH D O   1 
HETATM 2033 O O   . HOH D 3 .   ? 9.019  18.002 30.158 1.00 15.04 ? 473 HOH D O   1 
HETATM 2034 O O   . HOH D 3 .   ? 13.335 20.134 2.622  1.00 29.27 ? 474 HOH D O   1 
HETATM 2035 O O   . HOH D 3 .   ? 23.694 33.922 9.696  1.00 16.52 ? 475 HOH D O   1 
HETATM 2036 O O   . HOH D 3 .   ? 2.880  29.099 22.236 1.00 21.90 ? 476 HOH D O   1 
HETATM 2037 O O   . HOH D 3 .   ? 11.885 38.288 5.794  1.00 21.83 ? 477 HOH D O   1 
HETATM 2038 O O   . HOH D 3 .   ? 37.779 33.802 14.549 1.00 24.05 ? 478 HOH D O   1 
HETATM 2039 O O   . HOH D 3 .   ? 14.752 14.695 13.634 1.00 17.80 ? 479 HOH D O   1 
HETATM 2040 O O   . HOH D 3 .   ? 23.317 22.232 26.959 1.00 11.51 ? 480 HOH D O   1 
HETATM 2041 O O   . HOH D 3 .   ? 7.474  46.779 14.702 1.00 27.98 ? 481 HOH D O   1 
HETATM 2042 O O   . HOH D 3 .   ? 15.570 32.620 23.505 1.00 11.65 ? 482 HOH D O   1 
HETATM 2043 O O   . HOH D 3 .   ? 34.630 46.906 13.114 1.00 25.15 ? 483 HOH D O   1 
HETATM 2044 O O   . HOH D 3 .   ? 12.428 52.311 17.216 1.00 31.89 ? 484 HOH D O   1 
HETATM 2045 O O   . HOH D 3 .   ? 22.562 19.721 28.876 1.00 17.87 ? 485 HOH D O   1 
HETATM 2046 O O   . HOH D 3 .   ? 47.715 39.514 12.037 1.00 33.42 ? 486 HOH D O   1 
HETATM 2047 O O   . HOH D 3 .   ? 1.064  33.376 15.118 1.00 29.97 ? 487 HOH D O   1 
HETATM 2048 O O   . HOH D 3 .   ? 27.296 37.321 23.616 1.00 29.18 ? 488 HOH D O   1 
HETATM 2049 O O   . HOH D 3 .   ? 4.052  27.727 17.081 1.00 19.37 ? 489 HOH D O   1 
HETATM 2050 O O   . HOH D 3 .   ? 15.577 13.943 21.824 1.00 18.57 ? 490 HOH D O   1 
HETATM 2051 O O   . HOH D 3 .   ? 13.013 14.536 15.698 1.00 19.99 ? 491 HOH D O   1 
HETATM 2052 O O   . HOH D 3 .   ? 32.628 47.453 22.057 1.00 30.61 ? 492 HOH D O   1 
HETATM 2053 O O   . HOH D 3 .   ? 10.140 25.346 35.758 1.00 26.04 ? 493 HOH D O   1 
HETATM 2054 O O   . HOH D 3 .   ? 23.435 32.209 22.300 1.00 28.81 ? 494 HOH D O   1 
HETATM 2055 O O   . HOH D 3 .   ? 22.641 54.107 18.438 1.00 27.34 ? 495 HOH D O   1 
HETATM 2056 O O   . HOH D 3 .   ? 4.218  27.325 23.945 1.00 16.56 ? 496 HOH D O   1 
HETATM 2057 O O   . HOH D 3 .   ? 33.325 28.627 21.051 1.00 20.84 ? 497 HOH D O   1 
HETATM 2058 O O   . HOH D 3 .   ? 24.570 21.358 19.706 1.00 10.86 ? 498 HOH D O   1 
HETATM 2059 O O   . HOH D 3 .   ? 12.265 44.653 24.398 1.00 20.70 ? 499 HOH D O   1 
HETATM 2060 O O   . HOH D 3 .   ? 17.786 10.934 10.494 1.00 16.56 ? 500 HOH D O   1 
HETATM 2061 O O   . HOH D 3 .   ? 15.450 35.928 31.499 1.00 18.80 ? 501 HOH D O   1 
HETATM 2062 O O   . HOH D 3 .   ? 7.926  27.820 8.509  1.00 25.10 ? 502 HOH D O   1 
HETATM 2063 O O   . HOH D 3 .   ? 17.254 19.101 2.473  1.00 18.71 ? 503 HOH D O   1 
HETATM 2064 O O   . HOH D 3 .   ? 9.721  17.003 21.121 1.00 16.35 ? 504 HOH D O   1 
HETATM 2065 O O   . HOH D 3 .   ? 43.368 23.452 17.521 1.00 25.83 ? 505 HOH D O   1 
HETATM 2066 O O   . HOH D 3 .   ? 39.247 19.462 7.131  1.00 26.54 ? 506 HOH D O   1 
HETATM 2067 O O   . HOH D 3 .   ? 31.023 15.326 -2.758 1.00 24.55 ? 507 HOH D O   1 
HETATM 2068 O O   . HOH D 3 .   ? 31.686 38.218 0.206  1.00 26.18 ? 508 HOH D O   1 
HETATM 2069 O O   . HOH D 3 .   ? 31.892 45.045 18.885 1.00 23.46 ? 509 HOH D O   1 
HETATM 2070 O O   . HOH D 3 .   ? 29.433 27.154 -1.310 1.00 32.32 ? 510 HOH D O   1 
HETATM 2071 O O   . HOH D 3 .   ? 18.337 26.057 5.727  1.00 18.39 ? 511 HOH D O   1 
HETATM 2072 O O   . HOH D 3 .   ? 1.414  34.191 21.362 1.00 26.93 ? 512 HOH D O   1 
HETATM 2073 O O   . HOH D 3 .   ? 31.771 30.852 20.246 1.00 20.65 ? 513 HOH D O   1 
HETATM 2074 O O   . HOH D 3 .   ? 21.992 36.341 20.377 1.00 27.62 ? 514 HOH D O   1 
HETATM 2075 O O   . HOH D 3 .   ? 21.864 12.582 14.566 1.00 16.65 ? 515 HOH D O   1 
HETATM 2076 O O   . HOH D 3 .   ? 26.198 27.829 32.028 1.00 18.15 ? 516 HOH D O   1 
HETATM 2077 O O   . HOH D 3 .   ? 23.665 15.038 -2.133 1.00 25.45 ? 517 HOH D O   1 
HETATM 2078 O O   . HOH D 3 .   ? 14.995 43.125 6.340  1.00 24.00 ? 518 HOH D O   1 
HETATM 2079 O O   . HOH D 3 .   ? 9.787  47.612 21.750 1.00 28.71 ? 519 HOH D O   1 
HETATM 2080 O O   . HOH D 3 .   ? 41.049 24.777 21.248 1.00 28.49 ? 520 HOH D O   1 
HETATM 2081 O O   . HOH D 3 .   ? 33.122 22.637 19.759 1.00 10.62 ? 521 HOH D O   1 
HETATM 2082 O O   . HOH D 3 .   ? 15.382 31.885 37.624 1.00 26.58 ? 522 HOH D O   1 
HETATM 2083 O O   . HOH D 3 .   ? 32.719 44.652 22.286 1.00 24.62 ? 523 HOH D O   1 
HETATM 2084 O O   . HOH D 3 .   ? 11.610 33.082 33.763 1.00 25.72 ? 524 HOH D O   1 
HETATM 2085 O O   . HOH D 3 .   ? 38.355 17.986 12.877 1.00 26.52 ? 525 HOH D O   1 
HETATM 2086 O O   . HOH D 3 .   ? 19.008 53.787 12.567 1.00 23.12 ? 526 HOH D O   1 
HETATM 2087 O O   . HOH D 3 .   ? 13.657 39.724 6.260  1.00 18.05 ? 527 HOH D O   1 
HETATM 2088 O O   . HOH D 3 .   ? 44.995 24.714 10.326 1.00 31.25 ? 528 HOH D O   1 
HETATM 2089 O O   . HOH D 3 .   ? 12.214 46.812 22.584 1.00 20.09 ? 529 HOH D O   1 
HETATM 2090 O O   . HOH D 3 .   ? 24.499 47.946 18.044 1.00 25.08 ? 530 HOH D O   1 
HETATM 2091 O O   . HOH D 3 .   ? 12.727 17.984 27.862 1.00 12.09 ? 531 HOH D O   1 
HETATM 2092 O O   . HOH D 3 .   ? 19.513 17.520 3.016  1.00 15.09 ? 532 HOH D O   1 
HETATM 2093 O O   . HOH D 3 .   ? 29.758 35.965 26.149 1.00 24.35 ? 533 HOH D O   1 
HETATM 2094 O O   . HOH D 3 .   ? 27.203 16.135 16.062 1.00 12.06 ? 534 HOH D O   1 
HETATM 2095 O O   . HOH D 3 .   ? 4.503  29.499 11.309 1.00 27.01 ? 535 HOH D O   1 
HETATM 2096 O O   . HOH D 3 .   ? 22.668 13.039 24.568 1.00 35.47 ? 536 HOH D O   1 
HETATM 2097 O O   . HOH D 3 .   ? 31.919 22.690 -6.491 1.00 22.70 ? 537 HOH D O   1 
HETATM 2098 O O   . HOH D 3 .   ? 13.342 42.737 25.958 1.00 18.02 ? 538 HOH D O   1 
HETATM 2099 O O   . HOH D 3 .   ? 21.589 31.355 3.058  1.00 23.26 ? 539 HOH D O   1 
HETATM 2100 O O   . HOH D 3 .   ? 25.188 12.331 17.709 1.00 33.25 ? 540 HOH D O   1 
HETATM 2101 O O   . HOH D 3 .   ? 6.661  40.828 7.966  1.00 23.60 ? 541 HOH D O   1 
HETATM 2102 O O   . HOH D 3 .   ? 25.506 50.979 6.543  1.00 25.23 ? 542 HOH D O   1 
HETATM 2103 O O   . HOH D 3 .   ? 29.199 24.159 16.960 1.00 9.14  ? 543 HOH D O   1 
HETATM 2104 O O   . HOH D 3 .   ? 16.555 52.507 13.835 1.00 24.01 ? 544 HOH D O   1 
HETATM 2105 O O   . HOH D 3 .   ? 21.917 38.721 28.226 1.00 26.68 ? 545 HOH D O   1 
HETATM 2106 O O   . HOH D 3 .   ? 38.093 26.159 5.166  1.00 27.79 ? 546 HOH D O   1 
HETATM 2107 O O   . HOH D 3 .   ? 39.373 42.607 19.922 1.00 32.99 ? 547 HOH D O   1 
HETATM 2108 O O   . HOH D 3 .   ? 39.760 35.755 14.100 1.00 24.08 ? 548 HOH D O   1 
HETATM 2109 O O   . HOH D 3 .   ? 22.052 32.947 11.557 1.00 22.86 ? 549 HOH D O   1 
HETATM 2110 O O   . HOH D 3 .   ? 16.721 38.182 35.422 1.00 24.88 ? 550 HOH D O   1 
HETATM 2111 O O   . HOH D 3 .   ? 24.163 33.684 25.223 1.00 25.27 ? 551 HOH D O   1 
HETATM 2112 O O   . HOH D 3 .   ? 20.618 46.759 23.089 1.00 22.18 ? 552 HOH D O   1 
HETATM 2113 O O   . HOH D 3 .   ? 29.862 16.125 25.592 1.00 25.19 ? 553 HOH D O   1 
HETATM 2114 O O   . HOH D 3 .   ? 6.133  34.582 9.917  1.00 29.49 ? 554 HOH D O   1 
HETATM 2115 O O   . HOH D 3 .   ? 39.496 38.541 2.409  1.00 23.99 ? 555 HOH D O   1 
HETATM 2116 O O   . HOH D 3 .   ? 22.601 18.163 31.165 1.00 28.01 ? 556 HOH D O   1 
HETATM 2117 O O   . HOH D 3 .   ? 1.002  41.316 16.069 1.00 26.55 ? 557 HOH D O   1 
HETATM 2118 O O   . HOH D 3 .   ? 24.342 18.528 29.614 1.00 24.87 ? 558 HOH D O   1 
HETATM 2119 O O   . HOH D 3 .   ? 6.219  16.513 26.953 1.00 23.97 ? 559 HOH D O   1 
HETATM 2120 O O   . HOH D 3 .   ? 11.765 14.107 18.967 1.00 25.34 ? 560 HOH D O   1 
HETATM 2121 O O   . HOH D 3 .   ? 22.032 22.499 19.855 1.00 11.98 ? 561 HOH D O   1 
HETATM 2122 O O   . HOH D 3 .   ? 29.617 31.795 36.651 1.00 25.63 ? 562 HOH D O   1 
HETATM 2123 O O   . HOH D 3 .   ? 34.678 13.258 10.681 1.00 17.03 ? 563 HOH D O   1 
HETATM 2124 O O   . HOH D 3 .   ? 11.332 21.175 27.174 1.00 10.07 ? 564 HOH D O   1 
HETATM 2125 O O   . HOH D 3 .   ? 19.540 44.706 6.000  1.00 22.04 ? 565 HOH D O   1 
HETATM 2126 O O   . HOH D 3 .   ? 4.251  30.105 25.685 1.00 28.32 ? 566 HOH D O   1 
HETATM 2127 O O   . HOH D 3 .   ? 19.823 29.682 37.355 1.00 21.52 ? 567 HOH D O   1 
HETATM 2128 O O   . HOH D 3 .   ? 35.978 34.278 16.539 1.00 31.89 ? 568 HOH D O   1 
HETATM 2129 O O   . HOH D 3 .   ? 4.249  44.511 20.225 1.00 27.65 ? 569 HOH D O   1 
HETATM 2130 O O   . HOH D 3 .   ? 7.631  38.065 7.281  1.00 20.98 ? 570 HOH D O   1 
HETATM 2131 O O   . HOH D 3 .   ? 25.815 21.934 -5.229 1.00 24.25 ? 571 HOH D O   1 
HETATM 2132 O O   . HOH D 3 .   ? 18.711 14.735 2.760  1.00 24.29 ? 572 HOH D O   1 
HETATM 2133 O O   . HOH D 3 .   ? 46.916 36.380 17.754 1.00 33.60 ? 573 HOH D O   1 
HETATM 2134 O O   . HOH D 3 .   ? 18.679 32.282 5.393  1.00 29.28 ? 574 HOH D O   1 
HETATM 2135 O O   . HOH D 3 .   ? 40.876 40.792 18.173 1.00 29.86 ? 575 HOH D O   1 
HETATM 2136 O O   . HOH D 3 .   ? 37.010 16.572 10.604 1.00 20.22 ? 576 HOH D O   1 
HETATM 2137 O O   . HOH D 3 .   ? 11.669 14.347 31.126 1.00 23.65 ? 577 HOH D O   1 
HETATM 2138 O O   . HOH D 3 .   ? 22.987 14.621 22.055 1.00 18.44 ? 578 HOH D O   1 
HETATM 2139 O O   . HOH D 3 .   ? 8.182  20.103 12.453 1.00 22.68 ? 579 HOH D O   1 
HETATM 2140 O O   . HOH D 3 .   ? 37.396 25.564 2.119  1.00 29.53 ? 580 HOH D O   1 
HETATM 2141 O O   . HOH D 3 .   ? 21.235 12.426 4.485  1.00 29.05 ? 581 HOH D O   1 
HETATM 2142 O O   . HOH D 3 .   ? 41.399 20.450 20.997 1.00 19.97 ? 582 HOH D O   1 
HETATM 2143 O O   . HOH D 3 .   ? 23.759 11.099 15.711 1.00 27.37 ? 583 HOH D O   1 
HETATM 2144 O O   . HOH D 3 .   ? 33.615 12.724 18.487 1.00 29.90 ? 584 HOH D O   1 
HETATM 2145 O O   . HOH D 3 .   ? 13.535 50.055 21.522 1.00 20.99 ? 585 HOH D O   1 
HETATM 2146 O O   . HOH D 3 .   ? 15.237 14.026 24.535 1.00 28.05 ? 586 HOH D O   1 
HETATM 2147 O O   . HOH D 3 .   ? 18.273 22.768 -3.353 1.00 22.21 ? 587 HOH D O   1 
HETATM 2148 O O   . HOH D 3 .   ? 26.503 30.399 40.029 1.00 17.89 ? 588 HOH D O   1 
HETATM 2149 O O   . HOH D 3 .   ? 14.157 54.757 14.990 1.00 34.66 ? 589 HOH D O   1 
HETATM 2150 O O   . HOH D 3 .   ? 22.189 49.078 17.326 1.00 22.85 ? 590 HOH D O   1 
HETATM 2151 O O   . HOH D 3 .   ? 5.709  34.021 24.713 1.00 30.60 ? 591 HOH D O   1 
HETATM 2152 O O   . HOH D 3 .   ? 21.553 23.651 -1.378 1.00 29.61 ? 592 HOH D O   1 
HETATM 2153 O O   . HOH D 3 .   ? 34.927 30.822 19.190 1.00 28.47 ? 593 HOH D O   1 
HETATM 2154 O O   . HOH D 3 .   ? 14.810 18.936 5.801  1.00 31.43 ? 594 HOH D O   1 
HETATM 2155 O O   . HOH D 3 .   ? 21.915 17.124 -1.958 1.00 23.84 ? 595 HOH D O   1 
HETATM 2156 O O   . HOH D 3 .   ? 39.660 23.308 0.000  0.50 28.24 ? 596 HOH D O   1 
HETATM 2157 O O   . HOH D 3 .   ? 4.355  34.637 25.757 1.00 29.05 ? 597 HOH D O   1 
HETATM 2158 O O   . HOH D 3 .   ? 31.345 38.227 28.761 1.00 30.34 ? 598 HOH D O   1 
HETATM 2159 O O   . HOH D 3 .   ? 25.024 29.917 0.028  1.00 31.01 ? 599 HOH D O   1 
HETATM 2160 O O   . HOH D 3 .   ? 40.486 46.897 21.862 1.00 27.21 ? 600 HOH D O   1 
HETATM 2161 O O   . HOH D 3 .   ? 19.886 38.752 2.939  1.00 28.17 ? 601 HOH D O   1 
HETATM 2162 O O   . HOH D 3 .   ? 8.770  32.646 9.660  1.00 30.76 ? 602 HOH D O   1 
HETATM 2163 O O   . HOH D 3 .   ? 17.205 42.104 6.185  1.00 26.97 ? 603 HOH D O   1 
HETATM 2164 O O   . HOH D 3 .   ? 6.091  21.549 13.682 1.00 23.26 ? 604 HOH D O   1 
HETATM 2165 O O   . HOH D 3 .   ? 19.333 52.915 6.464  1.00 27.49 ? 605 HOH D O   1 
HETATM 2166 O O   . HOH D 3 .   ? 4.145  22.654 24.118 1.00 23.67 ? 606 HOH D O   1 
HETATM 2167 O O   . HOH D 3 .   ? 14.378 23.588 36.091 1.00 26.59 ? 607 HOH D O   1 
HETATM 2168 O O   . HOH D 3 .   ? 12.789 23.801 8.404  1.00 23.44 ? 608 HOH D O   1 
HETATM 2169 O O   . HOH D 3 .   ? 32.410 27.916 23.563 1.00 19.57 ? 609 HOH D O   1 
HETATM 2170 O O   . HOH D 3 .   ? 19.450 14.234 -1.153 1.00 34.10 ? 610 HOH D O   1 
HETATM 2171 O O   . HOH D 3 .   ? 13.736 19.264 40.284 1.00 26.38 ? 611 HOH D O   1 
HETATM 2172 O O   . HOH D 3 .   ? 29.644 34.799 -2.125 1.00 33.87 ? 612 HOH D O   1 
HETATM 2173 O O   . HOH D 3 .   ? 8.418  48.518 17.867 1.00 32.04 ? 613 HOH D O   1 
HETATM 2174 O O   . HOH D 3 .   ? 44.168 27.678 16.183 1.00 35.58 ? 614 HOH D O   1 
HETATM 2175 O O   . HOH D 3 .   ? 39.660 20.689 0.000  0.50 26.78 ? 615 HOH D O   1 
HETATM 2176 O O   . HOH D 3 .   ? 37.499 26.048 -1.799 1.00 36.02 ? 616 HOH D O   1 
HETATM 2177 O O   . HOH D 3 .   ? 55.069 32.421 11.930 1.00 34.19 ? 617 HOH D O   1 
HETATM 2178 O O   . HOH D 3 .   ? 17.015 15.137 8.185  1.00 36.66 ? 618 HOH D O   1 
HETATM 2179 O O   . HOH D 3 .   ? 16.795 35.336 3.937  1.00 30.36 ? 619 HOH D O   1 
HETATM 2180 O O   . HOH D 3 .   ? 17.043 30.625 6.457  1.00 30.19 ? 620 HOH D O   1 
HETATM 2181 O O   . HOH D 3 .   ? 28.462 16.145 26.992 1.00 35.76 ? 621 HOH D O   1 
HETATM 2182 O O   . HOH D 3 .   ? 39.049 17.905 9.317  1.00 32.05 ? 622 HOH D O   1 
HETATM 2183 O O   . HOH D 3 .   ? 14.493 11.248 19.390 1.00 34.54 ? 623 HOH D O   1 
HETATM 2184 O O   . HOH D 3 .   ? 33.033 53.554 9.552  1.00 42.20 ? 624 HOH D O   1 
HETATM 2185 O O   . HOH D 3 .   ? 17.296 41.714 28.138 1.00 24.79 ? 625 HOH D O   1 
HETATM 2186 O O   . HOH D 3 .   ? 7.127  25.835 32.757 1.00 31.81 ? 626 HOH D O   1 
HETATM 2187 O O   . HOH D 3 .   ? 19.459 36.827 4.788  1.00 24.80 ? 627 HOH D O   1 
HETATM 2188 O O   . HOH D 3 .   ? 44.614 25.479 16.969 1.00 32.73 ? 628 HOH D O   1 
HETATM 2189 O O   . HOH D 3 .   ? 12.888 35.092 32.330 1.00 25.47 ? 629 HOH D O   1 
HETATM 2190 O O   . HOH D 3 .   ? 33.860 13.279 0.701  1.00 26.81 ? 630 HOH D O   1 
HETATM 2191 O O   . HOH D 3 .   ? 6.205  29.277 9.062  1.00 34.81 ? 631 HOH D O   1 
HETATM 2192 O O   . HOH D 3 .   ? 19.389 11.553 14.234 1.00 22.25 ? 632 HOH D O   1 
HETATM 2193 O O   . HOH D 3 .   ? 8.560  17.302 26.007 1.00 14.73 ? 633 HOH D O   1 
HETATM 2194 O O   . HOH D 3 .   ? 16.336 28.325 5.130  1.00 26.33 ? 634 HOH D O   1 
HETATM 2195 O O   . HOH D 3 .   ? 52.089 29.223 10.141 1.00 38.12 ? 635 HOH D O   1 
HETATM 2196 O O   . HOH D 3 .   ? 40.978 31.692 10.064 1.00 37.49 ? 636 HOH D O   1 
HETATM 2197 O O   . HOH D 3 .   ? 29.003 32.925 -1.737 1.00 33.37 ? 637 HOH D O   1 
HETATM 2198 O O   . HOH D 3 .   ? 3.720  27.551 28.794 1.00 31.79 ? 638 HOH D O   1 
HETATM 2199 O O   . HOH D 3 .   ? 2.731  29.125 15.065 1.00 25.80 ? 639 HOH D O   1 
HETATM 2200 O O   . HOH D 3 .   ? 35.585 13.918 18.013 1.00 35.31 ? 640 HOH D O   1 
HETATM 2201 O O   . HOH D 3 .   ? 6.176  30.625 10.923 1.00 29.40 ? 641 HOH D O   1 
HETATM 2202 O O   . HOH D 3 .   ? 22.694 34.795 21.957 1.00 27.23 ? 642 HOH D O   1 
HETATM 2203 O O   . HOH D 3 .   ? 15.085 32.564 6.909  1.00 33.45 ? 643 HOH D O   1 
HETATM 2204 O O   . HOH D 3 .   ? 0.790  27.779 20.993 1.00 29.29 ? 644 HOH D O   1 
HETATM 2205 O O   . HOH D 3 .   ? 3.004  24.835 23.718 1.00 25.89 ? 645 HOH D O   1 
HETATM 2206 O O   . HOH D 3 .   ? 13.596 15.398 26.863 1.00 22.53 ? 646 HOH D O   1 
HETATM 2207 O O   . HOH D 3 .   ? 6.954  30.197 26.620 1.00 22.42 ? 647 HOH D O   1 
HETATM 2208 O O   . HOH D 3 .   ? 23.820 32.381 20.300 1.00 27.58 ? 648 HOH D O   1 
HETATM 2209 O O   . HOH D 3 .   ? 25.164 8.354  4.526  1.00 36.92 ? 649 HOH D O   1 
HETATM 2210 O O   . HOH D 3 .   ? 1.289  35.997 19.337 1.00 27.73 ? 650 HOH D O   1 
HETATM 2211 O O   . HOH D 3 .   ? 11.950 51.602 20.187 1.00 32.51 ? 651 HOH D O   1 
HETATM 2212 O O   . HOH D 3 .   ? 20.099 16.989 5.656  1.00 16.68 ? 652 HOH D O   1 
HETATM 2213 O O   . HOH D 3 .   ? 34.348 11.123 8.756  1.00 32.50 ? 653 HOH D O   1 
HETATM 2214 O O   . HOH D 3 .   ? 10.093 18.766 27.792 1.00 11.76 ? 654 HOH D O   1 
HETATM 2215 O O   . HOH D 3 .   ? 13.037 13.642 21.600 1.00 33.42 ? 655 HOH D O   1 
HETATM 2216 O O   . HOH D 3 .   ? 6.376  28.795 29.212 1.00 24.77 ? 656 HOH D O   1 
HETATM 2217 O O   . HOH D 3 .   ? 19.949 14.277 5.313  1.00 27.57 ? 657 HOH D O   1 
HETATM 2218 O O   . HOH D 3 .   ? 13.720 49.136 26.150 1.00 33.56 ? 658 HOH D O   1 
HETATM 2219 O O   . HOH D 3 .   ? 37.397 13.922 10.435 1.00 25.04 ? 659 HOH D O   1 
HETATM 2220 O O   . HOH D 3 .   ? 41.806 47.321 6.010  1.00 38.99 ? 660 HOH D O   1 
HETATM 2221 O O   . HOH D 3 .   ? 13.103 30.908 6.085  1.00 28.22 ? 661 HOH D O   1 
HETATM 2222 O O   . HOH D 3 .   ? 17.938 13.090 7.049  1.00 30.18 ? 662 HOH D O   1 
HETATM 2223 O O   . HOH D 3 .   ? 15.195 18.127 3.628  1.00 28.58 ? 663 HOH D O   1 
HETATM 2224 O O   . HOH D 3 .   ? 6.488  37.393 29.078 1.00 18.72 ? 664 HOH D O   1 
HETATM 2225 O O   . HOH D 3 .   ? 39.428 41.033 -1.463 1.00 28.83 ? 665 HOH D O   1 
HETATM 2226 O O   . HOH D 3 .   ? 9.028  30.237 8.640  1.00 34.75 ? 666 HOH D O   1 
HETATM 2227 O O   . HOH D 3 .   ? 10.833 14.425 21.625 1.00 25.81 ? 667 HOH D O   1 
HETATM 2228 O O   . HOH D 3 .   ? 3.108  28.177 26.133 1.00 34.44 ? 668 HOH D O   1 
HETATM 2229 O O   . HOH D 3 .   ? 11.973 26.646 5.683  1.00 27.94 ? 669 HOH D O   1 
HETATM 2230 O O   . HOH D 3 .   ? 4.192  21.031 22.011 1.00 30.63 ? 670 HOH D O   1 
HETATM 2231 O O   . HOH D 3 .   ? 38.539 9.932  16.772 1.00 36.33 ? 671 HOH D O   1 
HETATM 2232 O O   . HOH D 3 .   ? 12.256 49.115 23.927 1.00 29.65 ? 672 HOH D O   1 
HETATM 2233 O O   . HOH D 3 .   ? 46.993 38.366 19.770 1.00 25.55 ? 673 HOH D O   1 
HETATM 2234 O O   . HOH D 3 .   ? 17.588 10.470 7.913  1.00 26.81 ? 674 HOH D O   1 
HETATM 2235 O O   . HOH D 3 .   ? 54.663 32.299 7.388  1.00 34.62 ? 675 HOH D O   1 
HETATM 2236 O O   . HOH D 3 .   ? 26.439 6.556  -2.184 1.00 33.59 ? 676 HOH D O   1 
HETATM 2237 O O   . HOH D 3 .   ? 8.113  17.694 23.307 1.00 20.44 ? 677 HOH D O   1 
HETATM 2238 O O   . HOH D 3 .   ? 3.489  21.992 20.144 1.00 34.40 ? 678 HOH D O   1 
HETATM 2239 O O   . HOH D 3 .   ? 15.115 10.492 22.833 1.00 40.89 ? 679 HOH D O   1 
HETATM 2240 O O   . HOH D 3 .   ? 13.644 28.376 4.968  1.00 27.24 ? 680 HOH D O   1 
HETATM 2241 O O   . HOH D 3 .   ? 10.213 14.876 27.062 1.00 27.18 ? 681 HOH D O   1 
# 
