data_9BXH
# 
_entry.id   9BXH 
# 
_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   9BXH         pdb_00009bxh 10.2210/pdb9bxh/pdb 
WWPDB D_1000280398 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-01-08 ? 
2 'Structure model' 1 1 2025-02-05 ? 
3 'Structure model' 1 2 2025-03-19 ? 
# 
_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             ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1 2 'Structure model' 'Database references' 
2 3 'Structure model' 'Database references' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' citation        
2 2 'Structure model' citation_author 
3 3 'Structure model' citation        
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_citation.pdbx_database_id_DOI'    
2 2 'Structure model' '_citation.pdbx_database_id_PubMed' 
3 2 'Structure model' '_citation.title'                   
4 2 'Structure model' '_citation.year'                    
5 2 'Structure model' '_citation_author.identifier_ORCID' 
6 3 'Structure model' '_citation.journal_volume'          
7 3 'Structure model' '_citation.page_first'              
8 3 'Structure model' '_citation.page_last'               
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9BXH 
_pdbx_database_status.recvd_initial_deposition_date   2024-05-22 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 3 
_pdbx_contact_author.email              katherine.davis@emory.edu 
_pdbx_contact_author.name_first         Katherine 
_pdbx_contact_author.name_last          Davis 
_pdbx_contact_author.name_mi            M 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-0258-8907 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Ireland, K.A.' 1 0000-0003-0986-5142 
'Davis, K.M.'   2 0000-0002-0258-8907 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   UK 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Structure 
_citation.journal_id_ASTM           STRUE6 
_citation.journal_id_CSD            2005 
_citation.journal_id_ISSN           0969-2126 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            33 
_citation.language                  ? 
_citation.page_first                528 
_citation.page_last                 538.e5 
_citation.title                     
'Structural and functional analysis of SAM-dependent N-methyltransferases involved in ovoselenol and ovothiol biosynthesis.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1016/j.str.2024.12.020 
_citation.pdbx_database_id_PubMed   39862859 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Ireland, K.A.'        1 ? 
primary 'Kayrouz, C.M.'        2 ? 
primary 'Abbott, M.L.'         3 ? 
primary 'Seyedsayamdost, M.R.' 4 ? 
primary 'Davis, K.M.'          5 ? 
# 
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 '5-selenohistidine N-methyltransferase OvsM' 29997.824 1   ? ? ? ? 
2 non-polymer syn 1,2-ETHANEDIOL                               62.068    3   ? ? ? ? 
3 water       nat water                                        18.015    286 ? ? ? ? 
# 
_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       
;MGSSHHHHHHSSGLVPRGSHMTDNPYETDELLGQYLDFHYGPGHFDVPNYPKACIEQALAHHTGTTGRALDLGCAVGRSS
FELARRFDEVIGIDLSRRFIDSATRLAEQGQLQYQVTLEGELIERRTADLAALELSNTAGRTRFQVGDACALDDTLGRFD
LIFAGNLIDRLPDPAAFLAQLPALVRPGGLLMITSPYTLLPEFTPRERWIGGFERNGQPVRMLDGLRHHLEPDFVLLEPT
RDIPFVIRETTRKYQHTVAEASLWRRA
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MGSSHHHHHHSSGLVPRGSHMTDNPYETDELLGQYLDFHYGPGHFDVPNYPKACIEQALAHHTGTTGRALDLGCAVGRSS
FELARRFDEVIGIDLSRRFIDSATRLAEQGQLQYQVTLEGELIERRTADLAALELSNTAGRTRFQVGDACALDDTLGRFD
LIFAGNLIDRLPDPAAFLAQLPALVRPGGLLMITSPYTLLPEFTPRERWIGGFERNGQPVRMLDGLRHHLEPDFVLLEPT
RDIPFVIRETTRKYQHTVAEASLWRRA
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 1,2-ETHANEDIOL EDO 
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   GLY n 
1 3   SER n 
1 4   SER n 
1 5   HIS n 
1 6   HIS n 
1 7   HIS n 
1 8   HIS n 
1 9   HIS n 
1 10  HIS n 
1 11  SER n 
1 12  SER n 
1 13  GLY n 
1 14  LEU n 
1 15  VAL n 
1 16  PRO n 
1 17  ARG n 
1 18  GLY n 
1 19  SER n 
1 20  HIS n 
1 21  MET n 
1 22  THR n 
1 23  ASP n 
1 24  ASN n 
1 25  PRO n 
1 26  TYR n 
1 27  GLU n 
1 28  THR n 
1 29  ASP n 
1 30  GLU n 
1 31  LEU n 
1 32  LEU n 
1 33  GLY n 
1 34  GLN n 
1 35  TYR n 
1 36  LEU n 
1 37  ASP n 
1 38  PHE n 
1 39  HIS n 
1 40  TYR n 
1 41  GLY n 
1 42  PRO n 
1 43  GLY n 
1 44  HIS n 
1 45  PHE n 
1 46  ASP n 
1 47  VAL n 
1 48  PRO n 
1 49  ASN n 
1 50  TYR n 
1 51  PRO n 
1 52  LYS n 
1 53  ALA n 
1 54  CYS n 
1 55  ILE n 
1 56  GLU n 
1 57  GLN n 
1 58  ALA n 
1 59  LEU n 
1 60  ALA n 
1 61  HIS n 
1 62  HIS n 
1 63  THR n 
1 64  GLY n 
1 65  THR n 
1 66  THR n 
1 67  GLY n 
1 68  ARG n 
1 69  ALA n 
1 70  LEU n 
1 71  ASP n 
1 72  LEU n 
1 73  GLY n 
1 74  CYS n 
1 75  ALA n 
1 76  VAL n 
1 77  GLY n 
1 78  ARG n 
1 79  SER n 
1 80  SER n 
1 81  PHE n 
1 82  GLU n 
1 83  LEU n 
1 84  ALA n 
1 85  ARG n 
1 86  ARG n 
1 87  PHE n 
1 88  ASP n 
1 89  GLU n 
1 90  VAL n 
1 91  ILE n 
1 92  GLY n 
1 93  ILE n 
1 94  ASP n 
1 95  LEU n 
1 96  SER n 
1 97  ARG n 
1 98  ARG n 
1 99  PHE n 
1 100 ILE n 
1 101 ASP n 
1 102 SER n 
1 103 ALA n 
1 104 THR n 
1 105 ARG n 
1 106 LEU n 
1 107 ALA n 
1 108 GLU n 
1 109 GLN n 
1 110 GLY n 
1 111 GLN n 
1 112 LEU n 
1 113 GLN n 
1 114 TYR n 
1 115 GLN n 
1 116 VAL n 
1 117 THR n 
1 118 LEU n 
1 119 GLU n 
1 120 GLY n 
1 121 GLU n 
1 122 LEU n 
1 123 ILE n 
1 124 GLU n 
1 125 ARG n 
1 126 ARG n 
1 127 THR n 
1 128 ALA n 
1 129 ASP n 
1 130 LEU n 
1 131 ALA n 
1 132 ALA n 
1 133 LEU n 
1 134 GLU n 
1 135 LEU n 
1 136 SER n 
1 137 ASN n 
1 138 THR n 
1 139 ALA n 
1 140 GLY n 
1 141 ARG n 
1 142 THR n 
1 143 ARG n 
1 144 PHE n 
1 145 GLN n 
1 146 VAL n 
1 147 GLY n 
1 148 ASP n 
1 149 ALA n 
1 150 CYS n 
1 151 ALA n 
1 152 LEU n 
1 153 ASP n 
1 154 ASP n 
1 155 THR n 
1 156 LEU n 
1 157 GLY n 
1 158 ARG n 
1 159 PHE n 
1 160 ASP n 
1 161 LEU n 
1 162 ILE n 
1 163 PHE n 
1 164 ALA n 
1 165 GLY n 
1 166 ASN n 
1 167 LEU n 
1 168 ILE n 
1 169 ASP n 
1 170 ARG n 
1 171 LEU n 
1 172 PRO n 
1 173 ASP n 
1 174 PRO n 
1 175 ALA n 
1 176 ALA n 
1 177 PHE n 
1 178 LEU n 
1 179 ALA n 
1 180 GLN n 
1 181 LEU n 
1 182 PRO n 
1 183 ALA n 
1 184 LEU n 
1 185 VAL n 
1 186 ARG n 
1 187 PRO n 
1 188 GLY n 
1 189 GLY n 
1 190 LEU n 
1 191 LEU n 
1 192 MET n 
1 193 ILE n 
1 194 THR n 
1 195 SER n 
1 196 PRO n 
1 197 TYR n 
1 198 THR n 
1 199 LEU n 
1 200 LEU n 
1 201 PRO n 
1 202 GLU n 
1 203 PHE n 
1 204 THR n 
1 205 PRO n 
1 206 ARG n 
1 207 GLU n 
1 208 ARG n 
1 209 TRP n 
1 210 ILE n 
1 211 GLY n 
1 212 GLY n 
1 213 PHE n 
1 214 GLU n 
1 215 ARG n 
1 216 ASN n 
1 217 GLY n 
1 218 GLN n 
1 219 PRO n 
1 220 VAL n 
1 221 ARG n 
1 222 MET n 
1 223 LEU n 
1 224 ASP n 
1 225 GLY n 
1 226 LEU n 
1 227 ARG n 
1 228 HIS n 
1 229 HIS n 
1 230 LEU n 
1 231 GLU n 
1 232 PRO n 
1 233 ASP n 
1 234 PHE n 
1 235 VAL n 
1 236 LEU n 
1 237 LEU n 
1 238 GLU n 
1 239 PRO n 
1 240 THR n 
1 241 ARG n 
1 242 ASP n 
1 243 ILE n 
1 244 PRO n 
1 245 PHE n 
1 246 VAL n 
1 247 ILE n 
1 248 ARG n 
1 249 GLU n 
1 250 THR n 
1 251 THR n 
1 252 ARG n 
1 253 LYS n 
1 254 TYR n 
1 255 GLN n 
1 256 HIS n 
1 257 THR n 
1 258 VAL n 
1 259 ALA n 
1 260 GLU n 
1 261 ALA n 
1 262 SER n 
1 263 LEU n 
1 264 TRP n 
1 265 ARG n 
1 266 ARG n 
1 267 ALA 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                   267 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 EDC38_1804 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    'DSM 16974' 
_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      'Marinimicrobium koreense' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     306545 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli BL21(DE3)' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     469008 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ?                 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ?                 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE      ?                 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ?                 'C4 H7 N O4'     133.103 
CYS 'L-peptide linking' y CYSTEINE        ?                 'C3 H7 N O2 S'   121.158 
EDO non-polymer         . 1,2-ETHANEDIOL  'ETHYLENE GLYCOL' 'C2 H6 O2'       62.068  
GLN 'L-peptide linking' y GLUTAMINE       ?                 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ?                 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE         ?                 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE       ?                 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER           ?                 'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE      ?                 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE         ?                 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE          ?                 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE      ?                 'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE   ?                 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE         ?                 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE          ?                 'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE       ?                 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN      ?                 'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE        ?                 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE          ?                 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   MET 1   -19 ?   ?   ?   A . n 
A 1 2   GLY 2   -18 ?   ?   ?   A . n 
A 1 3   SER 3   -17 ?   ?   ?   A . n 
A 1 4   SER 4   -16 ?   ?   ?   A . n 
A 1 5   HIS 5   -15 ?   ?   ?   A . n 
A 1 6   HIS 6   -14 ?   ?   ?   A . n 
A 1 7   HIS 7   -13 ?   ?   ?   A . n 
A 1 8   HIS 8   -12 ?   ?   ?   A . n 
A 1 9   HIS 9   -11 ?   ?   ?   A . n 
A 1 10  HIS 10  -10 ?   ?   ?   A . n 
A 1 11  SER 11  -9  ?   ?   ?   A . n 
A 1 12  SER 12  -8  ?   ?   ?   A . n 
A 1 13  GLY 13  -7  ?   ?   ?   A . n 
A 1 14  LEU 14  -6  ?   ?   ?   A . n 
A 1 15  VAL 15  -5  ?   ?   ?   A . n 
A 1 16  PRO 16  -4  ?   ?   ?   A . n 
A 1 17  ARG 17  -3  ?   ?   ?   A . n 
A 1 18  GLY 18  -2  ?   ?   ?   A . n 
A 1 19  SER 19  -1  ?   ?   ?   A . n 
A 1 20  HIS 20  0   ?   ?   ?   A . n 
A 1 21  MET 21  1   ?   ?   ?   A . n 
A 1 22  THR 22  2   ?   ?   ?   A . n 
A 1 23  ASP 23  3   ?   ?   ?   A . n 
A 1 24  ASN 24  4   ?   ?   ?   A . n 
A 1 25  PRO 25  5   ?   ?   ?   A . n 
A 1 26  TYR 26  6   ?   ?   ?   A . n 
A 1 27  GLU 27  7   ?   ?   ?   A . n 
A 1 28  THR 28  8   ?   ?   ?   A . n 
A 1 29  ASP 29  9   9   ASP ASP A . n 
A 1 30  GLU 30  10  10  GLU GLU A . n 
A 1 31  LEU 31  11  11  LEU LEU A . n 
A 1 32  LEU 32  12  12  LEU LEU A . n 
A 1 33  GLY 33  13  13  GLY GLY A . n 
A 1 34  GLN 34  14  14  GLN GLN A . n 
A 1 35  TYR 35  15  15  TYR TYR A . n 
A 1 36  LEU 36  16  16  LEU LEU A . n 
A 1 37  ASP 37  17  17  ASP ASP A . n 
A 1 38  PHE 38  18  18  PHE PHE A . n 
A 1 39  HIS 39  19  19  HIS HIS A . n 
A 1 40  TYR 40  20  20  TYR TYR A . n 
A 1 41  GLY 41  21  21  GLY GLY A . n 
A 1 42  PRO 42  22  22  PRO PRO A . n 
A 1 43  GLY 43  23  23  GLY GLY A . n 
A 1 44  HIS 44  24  24  HIS HIS A . n 
A 1 45  PHE 45  25  25  PHE PHE A . n 
A 1 46  ASP 46  26  26  ASP ASP A . n 
A 1 47  VAL 47  27  27  VAL VAL A . n 
A 1 48  PRO 48  28  28  PRO PRO A . n 
A 1 49  ASN 49  29  29  ASN ASN A . n 
A 1 50  TYR 50  30  30  TYR TYR A . n 
A 1 51  PRO 51  31  31  PRO PRO A . n 
A 1 52  LYS 52  32  32  LYS LYS A . n 
A 1 53  ALA 53  33  33  ALA ALA A . n 
A 1 54  CYS 54  34  34  CYS CYS A . n 
A 1 55  ILE 55  35  35  ILE ILE A . n 
A 1 56  GLU 56  36  36  GLU GLU A . n 
A 1 57  GLN 57  37  37  GLN GLN A . n 
A 1 58  ALA 58  38  38  ALA ALA A . n 
A 1 59  LEU 59  39  39  LEU LEU A . n 
A 1 60  ALA 60  40  40  ALA ALA A . n 
A 1 61  HIS 61  41  41  HIS HIS A . n 
A 1 62  HIS 62  42  42  HIS HIS A . n 
A 1 63  THR 63  43  43  THR THR A . n 
A 1 64  GLY 64  44  44  GLY GLY A . n 
A 1 65  THR 65  45  45  THR THR A . n 
A 1 66  THR 66  46  46  THR THR A . n 
A 1 67  GLY 67  47  47  GLY GLY A . n 
A 1 68  ARG 68  48  48  ARG ARG A . n 
A 1 69  ALA 69  49  49  ALA ALA A . n 
A 1 70  LEU 70  50  50  LEU LEU A . n 
A 1 71  ASP 71  51  51  ASP ASP A . n 
A 1 72  LEU 72  52  52  LEU LEU A . n 
A 1 73  GLY 73  53  53  GLY GLY A . n 
A 1 74  CYS 74  54  54  CYS CYS A . n 
A 1 75  ALA 75  55  55  ALA ALA A . n 
A 1 76  VAL 76  56  56  VAL VAL A . n 
A 1 77  GLY 77  57  57  GLY GLY A . n 
A 1 78  ARG 78  58  58  ARG ARG A . n 
A 1 79  SER 79  59  59  SER SER A . n 
A 1 80  SER 80  60  60  SER SER A . n 
A 1 81  PHE 81  61  61  PHE PHE A . n 
A 1 82  GLU 82  62  62  GLU GLU A . n 
A 1 83  LEU 83  63  63  LEU LEU A . n 
A 1 84  ALA 84  64  64  ALA ALA A . n 
A 1 85  ARG 85  65  65  ARG ARG A . n 
A 1 86  ARG 86  66  66  ARG ARG A . n 
A 1 87  PHE 87  67  67  PHE PHE A . n 
A 1 88  ASP 88  68  68  ASP ASP A . n 
A 1 89  GLU 89  69  69  GLU GLU A . n 
A 1 90  VAL 90  70  70  VAL VAL A . n 
A 1 91  ILE 91  71  71  ILE ILE A . n 
A 1 92  GLY 92  72  72  GLY GLY A . n 
A 1 93  ILE 93  73  73  ILE ILE A . n 
A 1 94  ASP 94  74  74  ASP ASP A . n 
A 1 95  LEU 95  75  75  LEU LEU A . n 
A 1 96  SER 96  76  76  SER SER A . n 
A 1 97  ARG 97  77  77  ARG ARG A . n 
A 1 98  ARG 98  78  78  ARG ARG A . n 
A 1 99  PHE 99  79  79  PHE PHE A . n 
A 1 100 ILE 100 80  80  ILE ILE A . n 
A 1 101 ASP 101 81  81  ASP ASP A . n 
A 1 102 SER 102 82  82  SER SER A . n 
A 1 103 ALA 103 83  83  ALA ALA A . n 
A 1 104 THR 104 84  84  THR THR A . n 
A 1 105 ARG 105 85  85  ARG ARG A . n 
A 1 106 LEU 106 86  86  LEU LEU A . n 
A 1 107 ALA 107 87  87  ALA ALA A . n 
A 1 108 GLU 108 88  88  GLU GLU A . n 
A 1 109 GLN 109 89  89  GLN GLN A . n 
A 1 110 GLY 110 90  90  GLY GLY A . n 
A 1 111 GLN 111 91  91  GLN GLN A . n 
A 1 112 LEU 112 92  92  LEU LEU A . n 
A 1 113 GLN 113 93  93  GLN GLN A . n 
A 1 114 TYR 114 94  94  TYR TYR A . n 
A 1 115 GLN 115 95  95  GLN GLN A . n 
A 1 116 VAL 116 96  96  VAL VAL A . n 
A 1 117 THR 117 97  97  THR THR A . n 
A 1 118 LEU 118 98  98  LEU LEU A . n 
A 1 119 GLU 119 99  99  GLU GLU A . n 
A 1 120 GLY 120 100 100 GLY GLY A . n 
A 1 121 GLU 121 101 101 GLU GLU A . n 
A 1 122 LEU 122 102 102 LEU LEU A . n 
A 1 123 ILE 123 103 103 ILE ILE A . n 
A 1 124 GLU 124 104 104 GLU GLU A . n 
A 1 125 ARG 125 105 105 ARG ARG A . n 
A 1 126 ARG 126 106 106 ARG ARG A . n 
A 1 127 THR 127 107 107 THR THR A . n 
A 1 128 ALA 128 108 108 ALA ALA A . n 
A 1 129 ASP 129 109 109 ASP ASP A . n 
A 1 130 LEU 130 110 110 LEU LEU A . n 
A 1 131 ALA 131 111 111 ALA ALA A . n 
A 1 132 ALA 132 112 112 ALA ALA A . n 
A 1 133 LEU 133 113 113 LEU LEU A . n 
A 1 134 GLU 134 114 114 GLU GLU A . n 
A 1 135 LEU 135 115 115 LEU LEU A . n 
A 1 136 SER 136 116 116 SER SER A . n 
A 1 137 ASN 137 117 117 ASN ASN A . n 
A 1 138 THR 138 118 118 THR THR A . n 
A 1 139 ALA 139 119 119 ALA ALA A . n 
A 1 140 GLY 140 120 120 GLY GLY A . n 
A 1 141 ARG 141 121 121 ARG ARG A . n 
A 1 142 THR 142 122 122 THR THR A . n 
A 1 143 ARG 143 123 123 ARG ARG A . n 
A 1 144 PHE 144 124 124 PHE PHE A . n 
A 1 145 GLN 145 125 125 GLN GLN A . n 
A 1 146 VAL 146 126 126 VAL VAL A . n 
A 1 147 GLY 147 127 127 GLY GLY A . n 
A 1 148 ASP 148 128 128 ASP ASP A . n 
A 1 149 ALA 149 129 129 ALA ALA A . n 
A 1 150 CYS 150 130 130 CYS CYS A . n 
A 1 151 ALA 151 131 131 ALA ALA A . n 
A 1 152 LEU 152 132 132 LEU LEU A . n 
A 1 153 ASP 153 133 133 ASP ASP A . n 
A 1 154 ASP 154 134 134 ASP ASP A . n 
A 1 155 THR 155 135 135 THR THR A . n 
A 1 156 LEU 156 136 136 LEU LEU A . n 
A 1 157 GLY 157 137 137 GLY GLY A . n 
A 1 158 ARG 158 138 138 ARG ARG A . n 
A 1 159 PHE 159 139 139 PHE PHE A . n 
A 1 160 ASP 160 140 140 ASP ASP A . n 
A 1 161 LEU 161 141 141 LEU LEU A . n 
A 1 162 ILE 162 142 142 ILE ILE A . n 
A 1 163 PHE 163 143 143 PHE PHE A . n 
A 1 164 ALA 164 144 144 ALA ALA A . n 
A 1 165 GLY 165 145 145 GLY GLY A . n 
A 1 166 ASN 166 146 146 ASN ASN A . n 
A 1 167 LEU 167 147 147 LEU LEU A . n 
A 1 168 ILE 168 148 148 ILE ILE A . n 
A 1 169 ASP 169 149 149 ASP ASP A . n 
A 1 170 ARG 170 150 150 ARG ARG A . n 
A 1 171 LEU 171 151 151 LEU LEU A . n 
A 1 172 PRO 172 152 152 PRO PRO A . n 
A 1 173 ASP 173 153 153 ASP ASP A . n 
A 1 174 PRO 174 154 154 PRO PRO A . n 
A 1 175 ALA 175 155 155 ALA ALA A . n 
A 1 176 ALA 176 156 156 ALA ALA A . n 
A 1 177 PHE 177 157 157 PHE PHE A . n 
A 1 178 LEU 178 158 158 LEU LEU A . n 
A 1 179 ALA 179 159 159 ALA ALA A . n 
A 1 180 GLN 180 160 160 GLN GLN A . n 
A 1 181 LEU 181 161 161 LEU LEU A . n 
A 1 182 PRO 182 162 162 PRO PRO A . n 
A 1 183 ALA 183 163 163 ALA ALA A . n 
A 1 184 LEU 184 164 164 LEU LEU A . n 
A 1 185 VAL 185 165 165 VAL VAL A . n 
A 1 186 ARG 186 166 166 ARG ARG A . n 
A 1 187 PRO 187 167 167 PRO PRO A . n 
A 1 188 GLY 188 168 168 GLY GLY A . n 
A 1 189 GLY 189 169 169 GLY GLY A . n 
A 1 190 LEU 190 170 170 LEU LEU A . n 
A 1 191 LEU 191 171 171 LEU LEU A . n 
A 1 192 MET 192 172 172 MET MET A . n 
A 1 193 ILE 193 173 173 ILE ILE A . n 
A 1 194 THR 194 174 174 THR THR A . n 
A 1 195 SER 195 175 175 SER SER A . n 
A 1 196 PRO 196 176 176 PRO PRO A . n 
A 1 197 TYR 197 177 177 TYR TYR A . n 
A 1 198 THR 198 178 178 THR THR A . n 
A 1 199 LEU 199 179 179 LEU LEU A . n 
A 1 200 LEU 200 180 180 LEU LEU A . n 
A 1 201 PRO 201 181 181 PRO PRO A . n 
A 1 202 GLU 202 182 182 GLU GLU A . n 
A 1 203 PHE 203 183 183 PHE PHE A . n 
A 1 204 THR 204 184 184 THR THR A . n 
A 1 205 PRO 205 185 185 PRO PRO A . n 
A 1 206 ARG 206 186 186 ARG ARG A . n 
A 1 207 GLU 207 187 187 GLU GLU A . n 
A 1 208 ARG 208 188 188 ARG ARG A . n 
A 1 209 TRP 209 189 189 TRP TRP A . n 
A 1 210 ILE 210 190 190 ILE ILE A . n 
A 1 211 GLY 211 191 191 GLY GLY A . n 
A 1 212 GLY 212 192 192 GLY GLY A . n 
A 1 213 PHE 213 193 193 PHE PHE A . n 
A 1 214 GLU 214 194 194 GLU GLU A . n 
A 1 215 ARG 215 195 195 ARG ARG A . n 
A 1 216 ASN 216 196 196 ASN ASN A . n 
A 1 217 GLY 217 197 197 GLY GLY A . n 
A 1 218 GLN 218 198 198 GLN GLN A . n 
A 1 219 PRO 219 199 199 PRO PRO A . n 
A 1 220 VAL 220 200 200 VAL VAL A . n 
A 1 221 ARG 221 201 201 ARG ARG A . n 
A 1 222 MET 222 202 202 MET MET A . n 
A 1 223 LEU 223 203 203 LEU LEU A . n 
A 1 224 ASP 224 204 204 ASP ASP A . n 
A 1 225 GLY 225 205 205 GLY GLY A . n 
A 1 226 LEU 226 206 206 LEU LEU A . n 
A 1 227 ARG 227 207 207 ARG ARG A . n 
A 1 228 HIS 228 208 208 HIS HIS A . n 
A 1 229 HIS 229 209 209 HIS HIS A . n 
A 1 230 LEU 230 210 210 LEU LEU A . n 
A 1 231 GLU 231 211 211 GLU GLU A . n 
A 1 232 PRO 232 212 212 PRO PRO A . n 
A 1 233 ASP 233 213 213 ASP ASP A . n 
A 1 234 PHE 234 214 214 PHE PHE A . n 
A 1 235 VAL 235 215 215 VAL VAL A . n 
A 1 236 LEU 236 216 216 LEU LEU A . n 
A 1 237 LEU 237 217 217 LEU LEU A . n 
A 1 238 GLU 238 218 218 GLU GLU A . n 
A 1 239 PRO 239 219 219 PRO PRO A . n 
A 1 240 THR 240 220 220 THR THR A . n 
A 1 241 ARG 241 221 221 ARG ARG A . n 
A 1 242 ASP 242 222 222 ASP ASP A . n 
A 1 243 ILE 243 223 223 ILE ILE A . n 
A 1 244 PRO 244 224 224 PRO PRO A . n 
A 1 245 PHE 245 225 225 PHE PHE A . n 
A 1 246 VAL 246 226 226 VAL VAL A . n 
A 1 247 ILE 247 227 227 ILE ILE A . n 
A 1 248 ARG 248 228 228 ARG ARG A . n 
A 1 249 GLU 249 229 229 GLU GLU A . n 
A 1 250 THR 250 230 230 THR THR A . n 
A 1 251 THR 251 231 231 THR THR A . n 
A 1 252 ARG 252 232 232 ARG ARG A . n 
A 1 253 LYS 253 233 233 LYS LYS A . n 
A 1 254 TYR 254 234 234 TYR TYR A . n 
A 1 255 GLN 255 235 235 GLN GLN A . n 
A 1 256 HIS 256 236 236 HIS HIS A . n 
A 1 257 THR 257 237 237 THR THR A . n 
A 1 258 VAL 258 238 238 VAL VAL A . n 
A 1 259 ALA 259 239 239 ALA ALA A . n 
A 1 260 GLU 260 240 240 GLU GLU A . n 
A 1 261 ALA 261 241 241 ALA ALA A . n 
A 1 262 SER 262 242 242 SER SER A . n 
A 1 263 LEU 263 243 243 LEU LEU A . n 
A 1 264 TRP 264 244 244 TRP TRP A . n 
A 1 265 ARG 265 245 245 ARG ARG A . n 
A 1 266 ARG 266 246 246 ARG ARG A . n 
A 1 267 ALA 267 247 247 ALA ALA A . 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 EDO 1   301 301 EDO EDO A . 
C 2 EDO 1   302 302 EDO EDO A . 
D 2 EDO 1   303 303 EDO EDO A . 
E 3 HOH 1   401 231 HOH HOH A . 
E 3 HOH 2   402 54  HOH HOH A . 
E 3 HOH 3   403 60  HOH HOH A . 
E 3 HOH 4   404 221 HOH HOH A . 
E 3 HOH 5   405 223 HOH HOH A . 
E 3 HOH 6   406 182 HOH HOH A . 
E 3 HOH 7   407 108 HOH HOH A . 
E 3 HOH 8   408 57  HOH HOH A . 
E 3 HOH 9   409 146 HOH HOH A . 
E 3 HOH 10  410 111 HOH HOH A . 
E 3 HOH 11  411 35  HOH HOH A . 
E 3 HOH 12  412 113 HOH HOH A . 
E 3 HOH 13  413 17  HOH HOH A . 
E 3 HOH 14  414 81  HOH HOH A . 
E 3 HOH 15  415 158 HOH HOH A . 
E 3 HOH 16  416 55  HOH HOH A . 
E 3 HOH 17  417 102 HOH HOH A . 
E 3 HOH 18  418 21  HOH HOH A . 
E 3 HOH 19  419 28  HOH HOH A . 
E 3 HOH 20  420 154 HOH HOH A . 
E 3 HOH 21  421 94  HOH HOH A . 
E 3 HOH 22  422 167 HOH HOH A . 
E 3 HOH 23  423 91  HOH HOH A . 
E 3 HOH 24  424 15  HOH HOH A . 
E 3 HOH 25  425 100 HOH HOH A . 
E 3 HOH 26  426 12  HOH HOH A . 
E 3 HOH 27  427 135 HOH HOH A . 
E 3 HOH 28  428 66  HOH HOH A . 
E 3 HOH 29  429 212 HOH HOH A . 
E 3 HOH 30  430 143 HOH HOH A . 
E 3 HOH 31  431 148 HOH HOH A . 
E 3 HOH 32  432 64  HOH HOH A . 
E 3 HOH 33  433 159 HOH HOH A . 
E 3 HOH 34  434 95  HOH HOH A . 
E 3 HOH 35  435 127 HOH HOH A . 
E 3 HOH 36  436 310 HOH HOH A . 
E 3 HOH 37  437 177 HOH HOH A . 
E 3 HOH 38  438 41  HOH HOH A . 
E 3 HOH 39  439 18  HOH HOH A . 
E 3 HOH 40  440 119 HOH HOH A . 
E 3 HOH 41  441 48  HOH HOH A . 
E 3 HOH 42  442 109 HOH HOH A . 
E 3 HOH 43  443 53  HOH HOH A . 
E 3 HOH 44  444 87  HOH HOH A . 
E 3 HOH 45  445 16  HOH HOH A . 
E 3 HOH 46  446 106 HOH HOH A . 
E 3 HOH 47  447 225 HOH HOH A . 
E 3 HOH 48  448 38  HOH HOH A . 
E 3 HOH 49  449 233 HOH HOH A . 
E 3 HOH 50  450 78  HOH HOH A . 
E 3 HOH 51  451 174 HOH HOH A . 
E 3 HOH 52  452 4   HOH HOH A . 
E 3 HOH 53  453 33  HOH HOH A . 
E 3 HOH 54  454 20  HOH HOH A . 
E 3 HOH 55  455 83  HOH HOH A . 
E 3 HOH 56  456 166 HOH HOH A . 
E 3 HOH 57  457 173 HOH HOH A . 
E 3 HOH 58  458 39  HOH HOH A . 
E 3 HOH 59  459 147 HOH HOH A . 
E 3 HOH 60  460 123 HOH HOH A . 
E 3 HOH 61  461 77  HOH HOH A . 
E 3 HOH 62  462 49  HOH HOH A . 
E 3 HOH 63  463 40  HOH HOH A . 
E 3 HOH 64  464 121 HOH HOH A . 
E 3 HOH 65  465 85  HOH HOH A . 
E 3 HOH 66  466 224 HOH HOH A . 
E 3 HOH 67  467 8   HOH HOH A . 
E 3 HOH 68  468 9   HOH HOH A . 
E 3 HOH 69  469 201 HOH HOH A . 
E 3 HOH 70  470 19  HOH HOH A . 
E 3 HOH 71  471 31  HOH HOH A . 
E 3 HOH 72  472 75  HOH HOH A . 
E 3 HOH 73  473 118 HOH HOH A . 
E 3 HOH 74  474 61  HOH HOH A . 
E 3 HOH 75  475 32  HOH HOH A . 
E 3 HOH 76  476 80  HOH HOH A . 
E 3 HOH 77  477 120 HOH HOH A . 
E 3 HOH 78  478 65  HOH HOH A . 
E 3 HOH 79  479 45  HOH HOH A . 
E 3 HOH 80  480 79  HOH HOH A . 
E 3 HOH 81  481 27  HOH HOH A . 
E 3 HOH 82  482 1   HOH HOH A . 
E 3 HOH 83  483 134 HOH HOH A . 
E 3 HOH 84  484 2   HOH HOH A . 
E 3 HOH 85  485 321 HOH HOH A . 
E 3 HOH 86  486 131 HOH HOH A . 
E 3 HOH 87  487 51  HOH HOH A . 
E 3 HOH 88  488 47  HOH HOH A . 
E 3 HOH 89  489 82  HOH HOH A . 
E 3 HOH 90  490 43  HOH HOH A . 
E 3 HOH 91  491 13  HOH HOH A . 
E 3 HOH 92  492 84  HOH HOH A . 
E 3 HOH 93  493 52  HOH HOH A . 
E 3 HOH 94  494 273 HOH HOH A . 
E 3 HOH 95  495 157 HOH HOH A . 
E 3 HOH 96  496 30  HOH HOH A . 
E 3 HOH 97  497 112 HOH HOH A . 
E 3 HOH 98  498 128 HOH HOH A . 
E 3 HOH 99  499 42  HOH HOH A . 
E 3 HOH 100 500 202 HOH HOH A . 
E 3 HOH 101 501 73  HOH HOH A . 
E 3 HOH 102 502 7   HOH HOH A . 
E 3 HOH 103 503 320 HOH HOH A . 
E 3 HOH 104 504 197 HOH HOH A . 
E 3 HOH 105 505 14  HOH HOH A . 
E 3 HOH 106 506 185 HOH HOH A . 
E 3 HOH 107 507 259 HOH HOH A . 
E 3 HOH 108 508 37  HOH HOH A . 
E 3 HOH 109 509 26  HOH HOH A . 
E 3 HOH 110 510 3   HOH HOH A . 
E 3 HOH 111 511 6   HOH HOH A . 
E 3 HOH 112 512 11  HOH HOH A . 
E 3 HOH 113 513 10  HOH HOH A . 
E 3 HOH 114 514 261 HOH HOH A . 
E 3 HOH 115 515 76  HOH HOH A . 
E 3 HOH 116 516 180 HOH HOH A . 
E 3 HOH 117 517 160 HOH HOH A . 
E 3 HOH 118 518 240 HOH HOH A . 
E 3 HOH 119 519 196 HOH HOH A . 
E 3 HOH 120 520 207 HOH HOH A . 
E 3 HOH 121 521 187 HOH HOH A . 
E 3 HOH 122 522 104 HOH HOH A . 
E 3 HOH 123 523 178 HOH HOH A . 
E 3 HOH 124 524 136 HOH HOH A . 
E 3 HOH 125 525 298 HOH HOH A . 
E 3 HOH 126 526 130 HOH HOH A . 
E 3 HOH 127 527 213 HOH HOH A . 
E 3 HOH 128 528 98  HOH HOH A . 
E 3 HOH 129 529 5   HOH HOH A . 
E 3 HOH 130 530 141 HOH HOH A . 
E 3 HOH 131 531 86  HOH HOH A . 
E 3 HOH 132 532 67  HOH HOH A . 
E 3 HOH 133 533 107 HOH HOH A . 
E 3 HOH 134 534 133 HOH HOH A . 
E 3 HOH 135 535 25  HOH HOH A . 
E 3 HOH 136 536 232 HOH HOH A . 
E 3 HOH 137 537 139 HOH HOH A . 
E 3 HOH 138 538 198 HOH HOH A . 
E 3 HOH 139 539 191 HOH HOH A . 
E 3 HOH 140 540 170 HOH HOH A . 
E 3 HOH 141 541 70  HOH HOH A . 
E 3 HOH 142 542 205 HOH HOH A . 
E 3 HOH 143 543 171 HOH HOH A . 
E 3 HOH 144 544 293 HOH HOH A . 
E 3 HOH 145 545 92  HOH HOH A . 
E 3 HOH 146 546 163 HOH HOH A . 
E 3 HOH 147 547 34  HOH HOH A . 
E 3 HOH 148 548 105 HOH HOH A . 
E 3 HOH 149 549 59  HOH HOH A . 
E 3 HOH 150 550 63  HOH HOH A . 
E 3 HOH 151 551 312 HOH HOH A . 
E 3 HOH 152 552 282 HOH HOH A . 
E 3 HOH 153 553 152 HOH HOH A . 
E 3 HOH 154 554 74  HOH HOH A . 
E 3 HOH 155 555 89  HOH HOH A . 
E 3 HOH 156 556 116 HOH HOH A . 
E 3 HOH 157 557 99  HOH HOH A . 
E 3 HOH 158 558 279 HOH HOH A . 
E 3 HOH 159 559 122 HOH HOH A . 
E 3 HOH 160 560 285 HOH HOH A . 
E 3 HOH 161 561 62  HOH HOH A . 
E 3 HOH 162 562 151 HOH HOH A . 
E 3 HOH 163 563 22  HOH HOH A . 
E 3 HOH 164 564 193 HOH HOH A . 
E 3 HOH 165 565 220 HOH HOH A . 
E 3 HOH 166 566 36  HOH HOH A . 
E 3 HOH 167 567 208 HOH HOH A . 
E 3 HOH 168 568 124 HOH HOH A . 
E 3 HOH 169 569 68  HOH HOH A . 
E 3 HOH 170 570 162 HOH HOH A . 
E 3 HOH 171 571 125 HOH HOH A . 
E 3 HOH 172 572 58  HOH HOH A . 
E 3 HOH 173 573 229 HOH HOH A . 
E 3 HOH 174 574 219 HOH HOH A . 
E 3 HOH 175 575 165 HOH HOH A . 
E 3 HOH 176 576 210 HOH HOH A . 
E 3 HOH 177 577 101 HOH HOH A . 
E 3 HOH 178 578 114 HOH HOH A . 
E 3 HOH 179 579 29  HOH HOH A . 
E 3 HOH 180 580 237 HOH HOH A . 
E 3 HOH 181 581 46  HOH HOH A . 
E 3 HOH 182 582 244 HOH HOH A . 
E 3 HOH 183 583 115 HOH HOH A . 
E 3 HOH 184 584 149 HOH HOH A . 
E 3 HOH 185 585 153 HOH HOH A . 
E 3 HOH 186 586 247 HOH HOH A . 
E 3 HOH 187 587 24  HOH HOH A . 
E 3 HOH 188 588 144 HOH HOH A . 
E 3 HOH 189 589 226 HOH HOH A . 
E 3 HOH 190 590 260 HOH HOH A . 
E 3 HOH 191 591 69  HOH HOH A . 
E 3 HOH 192 592 132 HOH HOH A . 
E 3 HOH 193 593 161 HOH HOH A . 
E 3 HOH 194 594 164 HOH HOH A . 
E 3 HOH 195 595 71  HOH HOH A . 
E 3 HOH 196 596 50  HOH HOH A . 
E 3 HOH 197 597 176 HOH HOH A . 
E 3 HOH 198 598 254 HOH HOH A . 
E 3 HOH 199 599 230 HOH HOH A . 
E 3 HOH 200 600 222 HOH HOH A . 
E 3 HOH 201 601 252 HOH HOH A . 
E 3 HOH 202 602 96  HOH HOH A . 
E 3 HOH 203 603 126 HOH HOH A . 
E 3 HOH 204 604 314 HOH HOH A . 
E 3 HOH 205 605 302 HOH HOH A . 
E 3 HOH 206 606 294 HOH HOH A . 
E 3 HOH 207 607 227 HOH HOH A . 
E 3 HOH 208 608 138 HOH HOH A . 
E 3 HOH 209 609 287 HOH HOH A . 
E 3 HOH 210 610 300 HOH HOH A . 
E 3 HOH 211 611 297 HOH HOH A . 
E 3 HOH 212 612 315 HOH HOH A . 
E 3 HOH 213 613 303 HOH HOH A . 
E 3 HOH 214 614 256 HOH HOH A . 
E 3 HOH 215 615 214 HOH HOH A . 
E 3 HOH 216 616 209 HOH HOH A . 
E 3 HOH 217 617 235 HOH HOH A . 
E 3 HOH 218 618 142 HOH HOH A . 
E 3 HOH 219 619 251 HOH HOH A . 
E 3 HOH 220 620 307 HOH HOH A . 
E 3 HOH 221 621 313 HOH HOH A . 
E 3 HOH 222 622 291 HOH HOH A . 
E 3 HOH 223 623 200 HOH HOH A . 
E 3 HOH 224 624 188 HOH HOH A . 
E 3 HOH 225 625 90  HOH HOH A . 
E 3 HOH 226 626 265 HOH HOH A . 
E 3 HOH 227 627 317 HOH HOH A . 
E 3 HOH 228 628 304 HOH HOH A . 
E 3 HOH 229 629 270 HOH HOH A . 
E 3 HOH 230 630 280 HOH HOH A . 
E 3 HOH 231 631 319 HOH HOH A . 
E 3 HOH 232 632 239 HOH HOH A . 
E 3 HOH 233 633 295 HOH HOH A . 
E 3 HOH 234 634 140 HOH HOH A . 
E 3 HOH 235 635 236 HOH HOH A . 
E 3 HOH 236 636 190 HOH HOH A . 
E 3 HOH 237 637 301 HOH HOH A . 
E 3 HOH 238 638 218 HOH HOH A . 
E 3 HOH 239 639 172 HOH HOH A . 
E 3 HOH 240 640 292 HOH HOH A . 
E 3 HOH 241 641 234 HOH HOH A . 
E 3 HOH 242 642 194 HOH HOH A . 
E 3 HOH 243 643 296 HOH HOH A . 
E 3 HOH 244 644 204 HOH HOH A . 
E 3 HOH 245 645 117 HOH HOH A . 
E 3 HOH 246 646 175 HOH HOH A . 
E 3 HOH 247 647 156 HOH HOH A . 
E 3 HOH 248 648 189 HOH HOH A . 
E 3 HOH 249 649 150 HOH HOH A . 
E 3 HOH 250 650 309 HOH HOH A . 
E 3 HOH 251 651 203 HOH HOH A . 
E 3 HOH 252 652 305 HOH HOH A . 
E 3 HOH 253 653 299 HOH HOH A . 
E 3 HOH 254 654 72  HOH HOH A . 
E 3 HOH 255 655 183 HOH HOH A . 
E 3 HOH 256 656 311 HOH HOH A . 
E 3 HOH 257 657 129 HOH HOH A . 
E 3 HOH 258 658 245 HOH HOH A . 
E 3 HOH 259 659 93  HOH HOH A . 
E 3 HOH 260 660 44  HOH HOH A . 
E 3 HOH 261 661 246 HOH HOH A . 
E 3 HOH 262 662 253 HOH HOH A . 
E 3 HOH 263 663 243 HOH HOH A . 
E 3 HOH 264 664 286 HOH HOH A . 
E 3 HOH 265 665 181 HOH HOH A . 
E 3 HOH 266 666 199 HOH HOH A . 
E 3 HOH 267 667 179 HOH HOH A . 
E 3 HOH 268 668 283 HOH HOH A . 
E 3 HOH 269 669 97  HOH HOH A . 
E 3 HOH 270 670 169 HOH HOH A . 
E 3 HOH 271 671 284 HOH HOH A . 
E 3 HOH 272 672 216 HOH HOH A . 
E 3 HOH 273 673 23  HOH HOH A . 
E 3 HOH 274 674 228 HOH HOH A . 
E 3 HOH 275 675 145 HOH HOH A . 
E 3 HOH 276 676 248 HOH HOH A . 
E 3 HOH 277 677 206 HOH HOH A . 
E 3 HOH 278 678 192 HOH HOH A . 
E 3 HOH 279 679 56  HOH HOH A . 
E 3 HOH 280 680 272 HOH HOH A . 
E 3 HOH 281 681 184 HOH HOH A . 
E 3 HOH 282 682 268 HOH HOH A . 
E 3 HOH 283 683 274 HOH HOH A . 
E 3 HOH 284 684 275 HOH HOH A . 
E 3 HOH 285 685 186 HOH HOH A . 
E 3 HOH 286 686 306 HOH HOH A . 
# 
loop_
_pdbx_unobs_or_zero_occ_atoms.id 
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num 
_pdbx_unobs_or_zero_occ_atoms.polymer_flag 
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag 
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id 
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id 
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id 
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code 
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id 
_pdbx_unobs_or_zero_occ_atoms.label_alt_id 
_pdbx_unobs_or_zero_occ_atoms.label_asym_id 
_pdbx_unobs_or_zero_occ_atoms.label_comp_id 
_pdbx_unobs_or_zero_occ_atoms.label_seq_id 
_pdbx_unobs_or_zero_occ_atoms.label_atom_id 
1  1 Y 1 A ASP 9   ? CB  ? A ASP 29  CB  
2  1 Y 1 A ASP 9   ? CG  ? A ASP 29  CG  
3  1 Y 1 A ASP 9   ? OD1 ? A ASP 29  OD1 
4  1 Y 1 A ASP 9   ? OD2 ? A ASP 29  OD2 
5  1 Y 1 A GLU 10  ? CD  ? A GLU 30  CD  
6  1 Y 1 A GLU 10  ? OE1 ? A GLU 30  OE1 
7  1 Y 1 A GLU 10  ? OE2 ? A GLU 30  OE2 
8  1 Y 1 A LEU 11  ? CD1 ? A LEU 31  CD1 
9  1 Y 1 A LEU 11  ? CD2 ? A LEU 31  CD2 
10 1 Y 1 A LYS 32  ? NZ  ? A LYS 52  NZ  
11 1 Y 1 A ARG 65  ? CZ  ? A ARG 85  CZ  
12 1 Y 1 A ARG 65  ? NH1 ? A ARG 85  NH1 
13 1 Y 1 A ARG 65  ? NH2 ? A ARG 85  NH2 
14 1 Y 1 A ARG 66  ? CG  ? A ARG 86  CG  
15 1 Y 1 A ARG 66  ? CD  ? A ARG 86  CD  
16 1 Y 1 A ARG 66  ? NE  ? A ARG 86  NE  
17 1 Y 1 A ARG 66  ? CZ  ? A ARG 86  CZ  
18 1 Y 1 A ARG 66  ? NH1 ? A ARG 86  NH1 
19 1 Y 1 A ARG 66  ? NH2 ? A ARG 86  NH2 
20 1 Y 1 A LEU 75  ? CD2 ? A LEU 95  CD2 
21 1 Y 1 A GLN 89  ? NE2 ? A GLN 109 NE2 
22 1 Y 1 A GLU 182 ? CG  ? A GLU 202 CG  
23 1 Y 1 A GLU 182 ? CD  ? A GLU 202 CD  
24 1 Y 1 A GLU 182 ? OE1 ? A GLU 202 OE1 
25 1 Y 1 A GLU 182 ? OE2 ? A GLU 202 OE2 
26 1 Y 1 A GLU 187 ? OE2 ? A GLU 207 OE2 
27 1 Y 1 A ASN 196 ? CG  ? A ASN 216 CG  
28 1 Y 1 A ASN 196 ? OD1 ? A ASN 216 OD1 
29 1 Y 1 A ASN 196 ? ND2 ? A ASN 216 ND2 
30 1 Y 1 A GLN 198 ? CG  ? A GLN 218 CG  
31 1 Y 1 A GLN 198 ? CD  ? A GLN 218 CD  
32 1 Y 1 A GLN 198 ? OE1 ? A GLN 218 OE1 
33 1 Y 1 A GLN 198 ? NE2 ? A GLN 218 NE2 
34 1 Y 1 A GLU 218 ? OE1 ? A GLU 238 OE1 
35 1 Y 1 A ARG 221 ? CG  ? A ARG 241 CG  
36 1 Y 1 A ARG 221 ? CD  ? A ARG 241 CD  
37 1 Y 1 A ARG 221 ? NE  ? A ARG 241 NE  
38 1 Y 1 A ARG 221 ? CZ  ? A ARG 241 CZ  
39 1 Y 1 A ARG 221 ? NH1 ? A ARG 241 NH1 
40 1 Y 1 A ARG 221 ? NH2 ? A ARG 241 NH2 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? XDS-Apple_M1 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? XDS-Apple_M1 2 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? 1.20.1_4487  3 
? 'model building' ? ? ? ? ? ? ? ? ? ? ? Coot   ? ? ? 0.9.8.7      4 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.20.1_4487  5 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9BXH 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     83.838 
_cell.length_a_esd                 ? 
_cell.length_b                     90.058 
_cell.length_b_esd                 ? 
_cell.length_c                     80.321 
_cell.length_c_esd                 ? 
_cell.volume                       606446.249 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9BXH 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                20 
_symmetry.space_group_name_Hall            'C 2c 2' 
_symmetry.space_group_name_H-M             'C 2 2 21' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9BXH 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.52 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          51.3 
_exptl_crystal.description                  Plates 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              7.0 
_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    '0.1 M HEPES, pH 7.0, 5% v/v Tacsimate, pH 7.0, 10% w/v PEG5000 MME' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER2 S 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-10-19 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.9686 
_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                        'CHESS BEAMLINE 7B2' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.9686 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   7B2 
_diffrn_source.pdbx_synchrotron_site       CHESS 
# 
_reflns.B_iso_Wilson_estimate                          18.51 
_reflns.entry_id                                       9BXH 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.48 
_reflns.d_resolution_low                               29 
_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                                     50394 
_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                           98.86 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                2.0 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          11.38 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.04142 
_reflns.pdbx_Rpim_I_all                                0.02929 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.999 
_reflns.pdbx_CC_star                                   1 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.02929 
_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                                    1.48 
_reflns_shell.d_res_low                                     1.533 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           1.10 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             4614 
_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                               2.0 
_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                               0.9602 
_reflns_shell.pdbx_Rpim_I_all                               0.679 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.56 
_reflns_shell.pdbx_CC_star                                  0.847 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          90.99 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  0.679 
_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                               23.51 
_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                                 9BXH 
_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                            1.48 
_refine.ls_d_res_low                             29.00 
_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                     50353 
_refine.ls_number_reflns_R_free                  1912 
_refine.ls_number_reflns_R_work                  48441 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    98.88 
_refine.ls_percent_reflns_R_free                 3.80 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1772 
_refine.ls_R_factor_R_free                       0.1964 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1764 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.34 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'GeoStd + Monomer Library + CDL v1.2' 
_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             1.1000 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.9000 
_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                 20.4259 
_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                            0.1471 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.48 
_refine_hist.d_res_low                        29.00 
_refine_hist.number_atoms_solvent             286 
_refine_hist.number_atoms_total               2153 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        1855 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         12 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.0051  ? 1907 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.7762  ? 2583 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0731  ? 286  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0099  ? 340  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 13.4348 ? 696  ? f_dihedral_angle_d ? ? 
# 
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' 1.48 1.52  . . 119 3126 89.59  . . . . 0.3257 . . . . . . . . . . . 0.3414 
'X-RAY DIFFRACTION' 1.52 1.56  . . 138 3332 96.47  . . . . 0.2752 . . . . . . . . . . . 0.2504 
'X-RAY DIFFRACTION' 1.56 1.60  . . 125 3414 98.77  . . . . 0.2246 . . . . . . . . . . . 0.2451 
'X-RAY DIFFRACTION' 1.60 1.66  . . 139 3460 99.81  . . . . 0.2029 . . . . . . . . . . . 0.2467 
'X-RAY DIFFRACTION' 1.66 1.71  . . 134 3478 99.92  . . . . 0.1973 . . . . . . . . . . . 0.1952 
'X-RAY DIFFRACTION' 1.71 1.78  . . 143 3445 99.94  . . . . 0.1922 . . . . . . . . . . . 0.2326 
'X-RAY DIFFRACTION' 1.78 1.86  . . 132 3502 99.97  . . . . 0.1742 . . . . . . . . . . . 0.1907 
'X-RAY DIFFRACTION' 1.86 1.96  . . 136 3452 99.89  . . . . 0.1709 . . . . . . . . . . . 0.1722 
'X-RAY DIFFRACTION' 1.96 2.09  . . 129 3486 99.97  . . . . 0.1666 . . . . . . . . . . . 0.2004 
'X-RAY DIFFRACTION' 2.09 2.25  . . 147 3490 99.97  . . . . 0.1724 . . . . . . . . . . . 0.1895 
'X-RAY DIFFRACTION' 2.25 2.47  . . 139 3516 99.97  . . . . 0.1747 . . . . . . . . . . . 0.1671 
'X-RAY DIFFRACTION' 2.47 2.83  . . 141 3514 100.00 . . . . 0.1768 . . . . . . . . . . . 0.1901 
'X-RAY DIFFRACTION' 2.83 3.56  . . 143 3542 100.00 . . . . 0.1724 . . . . . . . . . . . 0.1868 
'X-RAY DIFFRACTION' 3.57 29.00 . . 147 3684 99.90  . . . . 0.1566 . . . . . . . . . . . 0.1997 
# 
_struct.entry_id                     9BXH 
_struct.title                        
'OvsM from Marinimicrobium koreense, a SAM-dependent N-methyltransferase involved in ovoselenol biosynthesis' 
_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        9BXH 
_struct_keywords.text            'ovoselenol, 5-selenohistidine, S-adenosyl-L-methionine, N-methyltransferase, TRANSFERASE' 
_struct_keywords.pdbx_keywords   TRANSFERASE 
# 
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 2 ? 
E N N 3 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    A0A3N1P0S2_9GAMM 
_struct_ref.pdbx_db_accession          A0A3N1P0S2 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;MTDNPYETDELLGQYLDFHYGPGHFDVPNYPKACIEQALAHHTGTTGRALDLGCAVGRSSFELARRFDEVIGIDLSRRFI
DSATRLAEQGQLQYQVTLEGELIERRTADLAALELSNTAGRTRFQVGDACALDDTLGRFDLIFAGNLIDRLPDPAAFLAQ
LPALVRPGGLLMITSPYTLLPEFTPRERWIGGFERNGQPVRMLDGLRHHLEPDFVLLEPTRDIPFVIRETTRKYQHTVAE
ASLWRRA
;
_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              9BXH 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 21 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 267 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             A0A3N1P0S2 
_struct_ref_seq.db_align_beg                  1 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  247 
_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       247 
# 
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 9BXH MET A 1  ? UNP A0A3N1P0S2 ? ? 'expression tag' -19 1  
1 9BXH GLY A 2  ? UNP A0A3N1P0S2 ? ? 'expression tag' -18 2  
1 9BXH SER A 3  ? UNP A0A3N1P0S2 ? ? 'expression tag' -17 3  
1 9BXH SER A 4  ? UNP A0A3N1P0S2 ? ? 'expression tag' -16 4  
1 9BXH HIS A 5  ? UNP A0A3N1P0S2 ? ? 'expression tag' -15 5  
1 9BXH HIS A 6  ? UNP A0A3N1P0S2 ? ? 'expression tag' -14 6  
1 9BXH HIS A 7  ? UNP A0A3N1P0S2 ? ? 'expression tag' -13 7  
1 9BXH HIS A 8  ? UNP A0A3N1P0S2 ? ? 'expression tag' -12 8  
1 9BXH HIS A 9  ? UNP A0A3N1P0S2 ? ? 'expression tag' -11 9  
1 9BXH HIS A 10 ? UNP A0A3N1P0S2 ? ? 'expression tag' -10 10 
1 9BXH SER A 11 ? UNP A0A3N1P0S2 ? ? 'expression tag' -9  11 
1 9BXH SER A 12 ? UNP A0A3N1P0S2 ? ? 'expression tag' -8  12 
1 9BXH GLY A 13 ? UNP A0A3N1P0S2 ? ? 'expression tag' -7  13 
1 9BXH LEU A 14 ? UNP A0A3N1P0S2 ? ? 'expression tag' -6  14 
1 9BXH VAL A 15 ? UNP A0A3N1P0S2 ? ? 'expression tag' -5  15 
1 9BXH PRO A 16 ? UNP A0A3N1P0S2 ? ? 'expression tag' -4  16 
1 9BXH ARG A 17 ? UNP A0A3N1P0S2 ? ? 'expression tag' -3  17 
1 9BXH GLY A 18 ? UNP A0A3N1P0S2 ? ? 'expression tag' -2  18 
1 9BXH SER A 19 ? UNP A0A3N1P0S2 ? ? 'expression tag' -1  19 
1 9BXH HIS A 20 ? UNP A0A3N1P0S2 ? ? 'expression tag' 0   20 
# 
_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)' 490   ? 
1 MORE         8     ? 
1 'SSA (A^2)'  11610 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E 
# 
_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 29  ? GLY A 41  ? ASP A 9   GLY A 21  1 ? 13 
HELX_P HELX_P2  AA2 ASN A 49  ? HIS A 62  ? ASN A 29  HIS A 42  1 ? 14 
HELX_P HELX_P3  AA3 GLY A 77  ? ALA A 84  ? GLY A 57  ALA A 64  1 ? 8  
HELX_P HELX_P4  AA4 SER A 96  ? GLY A 110 ? SER A 76  GLY A 90  1 ? 15 
HELX_P HELX_P5  AA5 ALA A 131 ? GLU A 134 ? ALA A 111 GLU A 114 5 ? 4  
HELX_P HELX_P6  AA6 THR A 138 ? GLY A 140 ? THR A 118 GLY A 120 5 ? 3  
HELX_P HELX_P7  AA7 LEU A 167 ? LEU A 171 ? LEU A 147 LEU A 151 5 ? 5  
HELX_P HELX_P8  AA8 ASP A 173 ? GLN A 180 ? ASP A 153 GLN A 160 1 ? 8  
HELX_P HELX_P9  AA9 GLN A 180 ? LEU A 184 ? GLN A 160 LEU A 164 1 ? 5  
HELX_P HELX_P10 AB1 PRO A 205 ? TRP A 209 ? PRO A 185 TRP A 189 5 ? 5  
HELX_P HELX_P11 AB2 ARG A 221 ? GLU A 231 ? ARG A 201 GLU A 211 1 ? 11 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_mon_prot_cis.pdbx_id 
_struct_mon_prot_cis.label_comp_id 
_struct_mon_prot_cis.label_seq_id 
_struct_mon_prot_cis.label_asym_id 
_struct_mon_prot_cis.label_alt_id 
_struct_mon_prot_cis.pdbx_PDB_ins_code 
_struct_mon_prot_cis.auth_comp_id 
_struct_mon_prot_cis.auth_seq_id 
_struct_mon_prot_cis.auth_asym_id 
_struct_mon_prot_cis.pdbx_label_comp_id_2 
_struct_mon_prot_cis.pdbx_label_seq_id_2 
_struct_mon_prot_cis.pdbx_label_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2 
_struct_mon_prot_cis.pdbx_auth_comp_id_2 
_struct_mon_prot_cis.pdbx_auth_seq_id_2 
_struct_mon_prot_cis.pdbx_auth_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_model_num 
_struct_mon_prot_cis.pdbx_omega_angle 
1 GLU 231 A . ? GLU 211 A PRO 232 A ? PRO 212 A 1 -0.38 
2 GLU 238 A . ? GLU 218 A PRO 239 A ? PRO 219 A 1 -1.50 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 7 ? 
AA2 ? 7 ? 
AA3 ? 2 ? 
AA4 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? parallel      
AA1 2 3 ? parallel      
AA1 3 4 ? parallel      
AA1 4 5 ? parallel      
AA1 5 6 ? anti-parallel 
AA1 6 7 ? anti-parallel 
AA2 1 2 ? parallel      
AA2 2 3 ? parallel      
AA2 3 4 ? parallel      
AA2 4 5 ? parallel      
AA2 5 6 ? anti-parallel 
AA2 6 7 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA4 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 THR A 142 ? VAL A 146 ? THR A 122 VAL A 126 
AA1 2 GLU A 89  ? ASP A 94  ? GLU A 69  ASP A 74  
AA1 3 ARG A 68  ? LEU A 72  ? ARG A 48  LEU A 52  
AA1 4 PHE A 159 ? GLY A 165 ? PHE A 139 GLY A 145 
AA1 5 VAL A 185 ? SER A 195 ? VAL A 165 SER A 175 
AA1 6 TYR A 254 ? ARG A 266 ? TYR A 234 ARG A 246 
AA1 7 PHE A 234 ? LEU A 236 ? PHE A 214 LEU A 216 
AA2 1 THR A 142 ? VAL A 146 ? THR A 122 VAL A 126 
AA2 2 GLU A 89  ? ASP A 94  ? GLU A 69  ASP A 74  
AA2 3 ARG A 68  ? LEU A 72  ? ARG A 48  LEU A 52  
AA2 4 PHE A 159 ? GLY A 165 ? PHE A 139 GLY A 145 
AA2 5 VAL A 185 ? SER A 195 ? VAL A 165 SER A 175 
AA2 6 TYR A 254 ? ARG A 266 ? TYR A 234 ARG A 246 
AA2 7 ARG A 241 ? ARG A 248 ? ARG A 221 ARG A 228 
AA3 1 GLN A 111 ? GLU A 119 ? GLN A 91  GLU A 99  
AA3 2 LEU A 122 ? ASP A 129 ? LEU A 102 ASP A 109 
AA4 1 PHE A 213 ? ARG A 215 ? PHE A 193 ARG A 195 
AA4 2 GLN A 218 ? VAL A 220 ? GLN A 198 VAL A 200 
# 
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 GLN A 145 ? O GLN A 125 N GLY A 92  ? N GLY A 72  
AA1 2 3 O ILE A 91  ? O ILE A 71  N ASP A 71  ? N ASP A 51  
AA1 3 4 N LEU A 72  ? N LEU A 52  O PHE A 163 ? O PHE A 143 
AA1 4 5 N ILE A 162 ? N ILE A 142 O MET A 192 ? O MET A 172 
AA1 5 6 N ILE A 193 ? N ILE A 173 O SER A 262 ? O SER A 242 
AA1 6 7 O ARG A 265 ? O ARG A 245 N VAL A 235 ? N VAL A 215 
AA2 1 2 O GLN A 145 ? O GLN A 125 N GLY A 92  ? N GLY A 72  
AA2 2 3 O ILE A 91  ? O ILE A 71  N ASP A 71  ? N ASP A 51  
AA2 3 4 N LEU A 72  ? N LEU A 52  O PHE A 163 ? O PHE A 143 
AA2 4 5 N ILE A 162 ? N ILE A 142 O MET A 192 ? O MET A 172 
AA2 5 6 N ILE A 193 ? N ILE A 173 O SER A 262 ? O SER A 242 
AA2 6 7 O ALA A 261 ? O ALA A 241 N ARG A 241 ? N ARG A 221 
AA3 1 2 N TYR A 114 ? N TYR A 94  O ARG A 126 ? O ARG A 106 
AA4 1 2 N PHE A 213 ? N PHE A 193 O VAL A 220 ? O VAL A 200 
# 
_pdbx_entry_details.entry_id                   9BXH 
_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_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 ALA A 55  ? ? 50.31   -126.14 
2 1 ALA A 131 ? ? -155.90 70.87   
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z               
2 x,-y,-z             
3 -x,y,-z+1/2         
4 -x,-y,z+1/2         
5 x+1/2,y+1/2,z       
6 x+1/2,-y+1/2,-z     
7 -x+1/2,y+1/2,-z+1/2 
8 -x+1/2,-y+1/2,z+1/2 
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? A HOH 685 ? 5.86 . 
2 1 O ? A HOH 686 ? 6.55 . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 A MET -19 ? A MET 1  
2  1 Y 1 A GLY -18 ? A GLY 2  
3  1 Y 1 A SER -17 ? A SER 3  
4  1 Y 1 A SER -16 ? A SER 4  
5  1 Y 1 A HIS -15 ? A HIS 5  
6  1 Y 1 A HIS -14 ? A HIS 6  
7  1 Y 1 A HIS -13 ? A HIS 7  
8  1 Y 1 A HIS -12 ? A HIS 8  
9  1 Y 1 A HIS -11 ? A HIS 9  
10 1 Y 1 A HIS -10 ? A HIS 10 
11 1 Y 1 A SER -9  ? A SER 11 
12 1 Y 1 A SER -8  ? A SER 12 
13 1 Y 1 A GLY -7  ? A GLY 13 
14 1 Y 1 A LEU -6  ? A LEU 14 
15 1 Y 1 A VAL -5  ? A VAL 15 
16 1 Y 1 A PRO -4  ? A PRO 16 
17 1 Y 1 A ARG -3  ? A ARG 17 
18 1 Y 1 A GLY -2  ? A GLY 18 
19 1 Y 1 A SER -1  ? A SER 19 
20 1 Y 1 A HIS 0   ? A HIS 20 
21 1 Y 1 A MET 1   ? A MET 21 
22 1 Y 1 A THR 2   ? A THR 22 
23 1 Y 1 A ASP 3   ? A ASP 23 
24 1 Y 1 A ASN 4   ? A ASN 24 
25 1 Y 1 A PRO 5   ? A PRO 25 
26 1 Y 1 A TYR 6   ? A TYR 26 
27 1 Y 1 A GLU 7   ? A GLU 27 
28 1 Y 1 A THR 8   ? A THR 28 
# 
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  
EDO C1   C N N 88  
EDO O1   O N N 89  
EDO C2   C N N 90  
EDO O2   O N N 91  
EDO H11  H N N 92  
EDO H12  H N N 93  
EDO HO1  H N N 94  
EDO H21  H N N 95  
EDO H22  H N N 96  
EDO HO2  H N N 97  
GLN N    N N N 98  
GLN CA   C N S 99  
GLN C    C N N 100 
GLN O    O N N 101 
GLN CB   C N N 102 
GLN CG   C N N 103 
GLN CD   C N N 104 
GLN OE1  O N N 105 
GLN NE2  N N N 106 
GLN OXT  O N N 107 
GLN H    H N N 108 
GLN H2   H N N 109 
GLN HA   H N N 110 
GLN HB2  H N N 111 
GLN HB3  H N N 112 
GLN HG2  H N N 113 
GLN HG3  H N N 114 
GLN HE21 H N N 115 
GLN HE22 H N N 116 
GLN HXT  H N N 117 
GLU N    N N N 118 
GLU CA   C N S 119 
GLU C    C N N 120 
GLU O    O N N 121 
GLU CB   C N N 122 
GLU CG   C N N 123 
GLU CD   C N N 124 
GLU OE1  O N N 125 
GLU OE2  O N N 126 
GLU OXT  O N N 127 
GLU H    H N N 128 
GLU H2   H N N 129 
GLU HA   H N N 130 
GLU HB2  H N N 131 
GLU HB3  H N N 132 
GLU HG2  H N N 133 
GLU HG3  H N N 134 
GLU HE2  H N N 135 
GLU HXT  H N N 136 
GLY N    N N N 137 
GLY CA   C N N 138 
GLY C    C N N 139 
GLY O    O N N 140 
GLY OXT  O N N 141 
GLY H    H N N 142 
GLY H2   H N N 143 
GLY HA2  H N N 144 
GLY HA3  H N N 145 
GLY HXT  H N N 146 
HIS N    N N N 147 
HIS CA   C N S 148 
HIS C    C N N 149 
HIS O    O N N 150 
HIS CB   C N N 151 
HIS CG   C Y N 152 
HIS ND1  N Y N 153 
HIS CD2  C Y N 154 
HIS CE1  C Y N 155 
HIS NE2  N Y N 156 
HIS OXT  O N N 157 
HIS H    H N N 158 
HIS H2   H N N 159 
HIS HA   H N N 160 
HIS HB2  H N N 161 
HIS HB3  H N N 162 
HIS HD1  H N N 163 
HIS HD2  H N N 164 
HIS HE1  H N N 165 
HIS HE2  H N N 166 
HIS HXT  H N N 167 
HOH O    O N N 168 
HOH H1   H N N 169 
HOH H2   H N N 170 
ILE N    N N N 171 
ILE CA   C N S 172 
ILE C    C N N 173 
ILE O    O N N 174 
ILE CB   C N S 175 
ILE CG1  C N N 176 
ILE CG2  C N N 177 
ILE CD1  C N N 178 
ILE OXT  O N N 179 
ILE H    H N N 180 
ILE H2   H N N 181 
ILE HA   H N N 182 
ILE HB   H N N 183 
ILE HG12 H N N 184 
ILE HG13 H N N 185 
ILE HG21 H N N 186 
ILE HG22 H N N 187 
ILE HG23 H N N 188 
ILE HD11 H N N 189 
ILE HD12 H N N 190 
ILE HD13 H N N 191 
ILE HXT  H N N 192 
LEU N    N N N 193 
LEU CA   C N S 194 
LEU C    C N N 195 
LEU O    O N N 196 
LEU CB   C N N 197 
LEU CG   C N N 198 
LEU CD1  C N N 199 
LEU CD2  C N N 200 
LEU OXT  O N N 201 
LEU H    H N N 202 
LEU H2   H N N 203 
LEU HA   H N N 204 
LEU HB2  H N N 205 
LEU HB3  H N N 206 
LEU HG   H N N 207 
LEU HD11 H N N 208 
LEU HD12 H N N 209 
LEU HD13 H N N 210 
LEU HD21 H N N 211 
LEU HD22 H N N 212 
LEU HD23 H N N 213 
LEU HXT  H N N 214 
LYS N    N N N 215 
LYS CA   C N S 216 
LYS C    C N N 217 
LYS O    O N N 218 
LYS CB   C N N 219 
LYS CG   C N N 220 
LYS CD   C N N 221 
LYS CE   C N N 222 
LYS NZ   N N N 223 
LYS OXT  O N N 224 
LYS H    H N N 225 
LYS H2   H N N 226 
LYS HA   H N N 227 
LYS HB2  H N N 228 
LYS HB3  H N N 229 
LYS HG2  H N N 230 
LYS HG3  H N N 231 
LYS HD2  H N N 232 
LYS HD3  H N N 233 
LYS HE2  H N N 234 
LYS HE3  H N N 235 
LYS HZ1  H N N 236 
LYS HZ2  H N N 237 
LYS HZ3  H N N 238 
LYS HXT  H N N 239 
MET N    N N N 240 
MET CA   C N S 241 
MET C    C N N 242 
MET O    O N N 243 
MET CB   C N N 244 
MET CG   C N N 245 
MET SD   S N N 246 
MET CE   C N N 247 
MET OXT  O N N 248 
MET H    H N N 249 
MET H2   H N N 250 
MET HA   H N N 251 
MET HB2  H N N 252 
MET HB3  H N N 253 
MET HG2  H N N 254 
MET HG3  H N N 255 
MET HE1  H N N 256 
MET HE2  H N N 257 
MET HE3  H N N 258 
MET HXT  H N N 259 
PHE N    N N N 260 
PHE CA   C N S 261 
PHE C    C N N 262 
PHE O    O N N 263 
PHE CB   C N N 264 
PHE CG   C Y N 265 
PHE CD1  C Y N 266 
PHE CD2  C Y N 267 
PHE CE1  C Y N 268 
PHE CE2  C Y N 269 
PHE CZ   C Y N 270 
PHE OXT  O N N 271 
PHE H    H N N 272 
PHE H2   H N N 273 
PHE HA   H N N 274 
PHE HB2  H N N 275 
PHE HB3  H N N 276 
PHE HD1  H N N 277 
PHE HD2  H N N 278 
PHE HE1  H N N 279 
PHE HE2  H N N 280 
PHE HZ   H N N 281 
PHE HXT  H N N 282 
PRO N    N N N 283 
PRO CA   C N S 284 
PRO C    C N N 285 
PRO O    O N N 286 
PRO CB   C N N 287 
PRO CG   C N N 288 
PRO CD   C N N 289 
PRO OXT  O N N 290 
PRO H    H N N 291 
PRO HA   H N N 292 
PRO HB2  H N N 293 
PRO HB3  H N N 294 
PRO HG2  H N N 295 
PRO HG3  H N N 296 
PRO HD2  H N N 297 
PRO HD3  H N N 298 
PRO HXT  H N N 299 
SER N    N N N 300 
SER CA   C N S 301 
SER C    C N N 302 
SER O    O N N 303 
SER CB   C N N 304 
SER OG   O N N 305 
SER OXT  O N N 306 
SER H    H N N 307 
SER H2   H N N 308 
SER HA   H N N 309 
SER HB2  H N N 310 
SER HB3  H N N 311 
SER HG   H N N 312 
SER HXT  H N N 313 
THR N    N N N 314 
THR CA   C N S 315 
THR C    C N N 316 
THR O    O N N 317 
THR CB   C N R 318 
THR OG1  O N N 319 
THR CG2  C N N 320 
THR OXT  O N N 321 
THR H    H N N 322 
THR H2   H N N 323 
THR HA   H N N 324 
THR HB   H N N 325 
THR HG1  H N N 326 
THR HG21 H N N 327 
THR HG22 H N N 328 
THR HG23 H N N 329 
THR HXT  H N N 330 
TRP N    N N N 331 
TRP CA   C N S 332 
TRP C    C N N 333 
TRP O    O N N 334 
TRP CB   C N N 335 
TRP CG   C Y N 336 
TRP CD1  C Y N 337 
TRP CD2  C Y N 338 
TRP NE1  N Y N 339 
TRP CE2  C Y N 340 
TRP CE3  C Y N 341 
TRP CZ2  C Y N 342 
TRP CZ3  C Y N 343 
TRP CH2  C Y N 344 
TRP OXT  O N N 345 
TRP H    H N N 346 
TRP H2   H N N 347 
TRP HA   H N N 348 
TRP HB2  H N N 349 
TRP HB3  H N N 350 
TRP HD1  H N N 351 
TRP HE1  H N N 352 
TRP HE3  H N N 353 
TRP HZ2  H N N 354 
TRP HZ3  H N N 355 
TRP HH2  H N N 356 
TRP HXT  H N N 357 
TYR N    N N N 358 
TYR CA   C N S 359 
TYR C    C N N 360 
TYR O    O N N 361 
TYR CB   C N N 362 
TYR CG   C Y N 363 
TYR CD1  C Y N 364 
TYR CD2  C Y N 365 
TYR CE1  C Y N 366 
TYR CE2  C Y N 367 
TYR CZ   C Y N 368 
TYR OH   O N N 369 
TYR OXT  O N N 370 
TYR H    H N N 371 
TYR H2   H N N 372 
TYR HA   H N N 373 
TYR HB2  H N N 374 
TYR HB3  H N N 375 
TYR HD1  H N N 376 
TYR HD2  H N N 377 
TYR HE1  H N N 378 
TYR HE2  H N N 379 
TYR HH   H N N 380 
TYR HXT  H N N 381 
VAL N    N N N 382 
VAL CA   C N S 383 
VAL C    C N N 384 
VAL O    O N N 385 
VAL CB   C N N 386 
VAL CG1  C N N 387 
VAL CG2  C N N 388 
VAL OXT  O N N 389 
VAL H    H N N 390 
VAL H2   H N N 391 
VAL HA   H N N 392 
VAL HB   H N N 393 
VAL HG11 H N N 394 
VAL HG12 H N N 395 
VAL HG13 H N N 396 
VAL HG21 H N N 397 
VAL HG22 H N N 398 
VAL HG23 H N N 399 
VAL HXT  H N N 400 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
EDO C1  O1   sing N N 83  
EDO C1  C2   sing N N 84  
EDO C1  H11  sing N N 85  
EDO C1  H12  sing N N 86  
EDO O1  HO1  sing N N 87  
EDO C2  O2   sing N N 88  
EDO C2  H21  sing N N 89  
EDO C2  H22  sing N N 90  
EDO O2  HO2  sing N N 91  
GLN N   CA   sing N N 92  
GLN N   H    sing N N 93  
GLN N   H2   sing N N 94  
GLN CA  C    sing N N 95  
GLN CA  CB   sing N N 96  
GLN CA  HA   sing N N 97  
GLN C   O    doub N N 98  
GLN C   OXT  sing N N 99  
GLN CB  CG   sing N N 100 
GLN CB  HB2  sing N N 101 
GLN CB  HB3  sing N N 102 
GLN CG  CD   sing N N 103 
GLN CG  HG2  sing N N 104 
GLN CG  HG3  sing N N 105 
GLN CD  OE1  doub N N 106 
GLN CD  NE2  sing N N 107 
GLN NE2 HE21 sing N N 108 
GLN NE2 HE22 sing N N 109 
GLN OXT HXT  sing N N 110 
GLU N   CA   sing N N 111 
GLU N   H    sing N N 112 
GLU N   H2   sing N N 113 
GLU CA  C    sing N N 114 
GLU CA  CB   sing N N 115 
GLU CA  HA   sing N N 116 
GLU C   O    doub N N 117 
GLU C   OXT  sing N N 118 
GLU CB  CG   sing N N 119 
GLU CB  HB2  sing N N 120 
GLU CB  HB3  sing N N 121 
GLU CG  CD   sing N N 122 
GLU CG  HG2  sing N N 123 
GLU CG  HG3  sing N N 124 
GLU CD  OE1  doub N N 125 
GLU CD  OE2  sing N N 126 
GLU OE2 HE2  sing N N 127 
GLU OXT HXT  sing N N 128 
GLY N   CA   sing N N 129 
GLY N   H    sing N N 130 
GLY N   H2   sing N N 131 
GLY CA  C    sing N N 132 
GLY CA  HA2  sing N N 133 
GLY CA  HA3  sing N N 134 
GLY C   O    doub N N 135 
GLY C   OXT  sing N N 136 
GLY OXT HXT  sing N N 137 
HIS N   CA   sing N N 138 
HIS N   H    sing N N 139 
HIS N   H2   sing N N 140 
HIS CA  C    sing N N 141 
HIS CA  CB   sing N N 142 
HIS CA  HA   sing N N 143 
HIS C   O    doub N N 144 
HIS C   OXT  sing N N 145 
HIS CB  CG   sing N N 146 
HIS CB  HB2  sing N N 147 
HIS CB  HB3  sing N N 148 
HIS CG  ND1  sing Y N 149 
HIS CG  CD2  doub Y N 150 
HIS ND1 CE1  doub Y N 151 
HIS ND1 HD1  sing N N 152 
HIS CD2 NE2  sing Y N 153 
HIS CD2 HD2  sing N N 154 
HIS CE1 NE2  sing Y N 155 
HIS CE1 HE1  sing N N 156 
HIS NE2 HE2  sing N N 157 
HIS OXT HXT  sing N N 158 
HOH O   H1   sing N N 159 
HOH O   H2   sing N N 160 
ILE N   CA   sing N N 161 
ILE N   H    sing N N 162 
ILE N   H2   sing N N 163 
ILE CA  C    sing N N 164 
ILE CA  CB   sing N N 165 
ILE CA  HA   sing N N 166 
ILE C   O    doub N N 167 
ILE C   OXT  sing N N 168 
ILE CB  CG1  sing N N 169 
ILE CB  CG2  sing N N 170 
ILE CB  HB   sing N N 171 
ILE CG1 CD1  sing N N 172 
ILE CG1 HG12 sing N N 173 
ILE CG1 HG13 sing N N 174 
ILE CG2 HG21 sing N N 175 
ILE CG2 HG22 sing N N 176 
ILE CG2 HG23 sing N N 177 
ILE CD1 HD11 sing N N 178 
ILE CD1 HD12 sing N N 179 
ILE CD1 HD13 sing N N 180 
ILE OXT HXT  sing N N 181 
LEU N   CA   sing N N 182 
LEU N   H    sing N N 183 
LEU N   H2   sing N N 184 
LEU CA  C    sing N N 185 
LEU CA  CB   sing N N 186 
LEU CA  HA   sing N N 187 
LEU C   O    doub N N 188 
LEU C   OXT  sing N N 189 
LEU CB  CG   sing N N 190 
LEU CB  HB2  sing N N 191 
LEU CB  HB3  sing N N 192 
LEU CG  CD1  sing N N 193 
LEU CG  CD2  sing N N 194 
LEU CG  HG   sing N N 195 
LEU CD1 HD11 sing N N 196 
LEU CD1 HD12 sing N N 197 
LEU CD1 HD13 sing N N 198 
LEU CD2 HD21 sing N N 199 
LEU CD2 HD22 sing N N 200 
LEU CD2 HD23 sing N N 201 
LEU OXT HXT  sing N N 202 
LYS N   CA   sing N N 203 
LYS N   H    sing N N 204 
LYS N   H2   sing N N 205 
LYS CA  C    sing N N 206 
LYS CA  CB   sing N N 207 
LYS CA  HA   sing N N 208 
LYS C   O    doub N N 209 
LYS C   OXT  sing N N 210 
LYS CB  CG   sing N N 211 
LYS CB  HB2  sing N N 212 
LYS CB  HB3  sing N N 213 
LYS CG  CD   sing N N 214 
LYS CG  HG2  sing N N 215 
LYS CG  HG3  sing N N 216 
LYS CD  CE   sing N N 217 
LYS CD  HD2  sing N N 218 
LYS CD  HD3  sing N N 219 
LYS CE  NZ   sing N N 220 
LYS CE  HE2  sing N N 221 
LYS CE  HE3  sing N N 222 
LYS NZ  HZ1  sing N N 223 
LYS NZ  HZ2  sing N N 224 
LYS NZ  HZ3  sing N N 225 
LYS OXT HXT  sing N N 226 
MET N   CA   sing N N 227 
MET N   H    sing N N 228 
MET N   H2   sing N N 229 
MET CA  C    sing N N 230 
MET CA  CB   sing N N 231 
MET CA  HA   sing N N 232 
MET C   O    doub N N 233 
MET C   OXT  sing N N 234 
MET CB  CG   sing N N 235 
MET CB  HB2  sing N N 236 
MET CB  HB3  sing N N 237 
MET CG  SD   sing N N 238 
MET CG  HG2  sing N N 239 
MET CG  HG3  sing N N 240 
MET SD  CE   sing N N 241 
MET CE  HE1  sing N N 242 
MET CE  HE2  sing N N 243 
MET CE  HE3  sing N N 244 
MET OXT HXT  sing N N 245 
PHE N   CA   sing N N 246 
PHE N   H    sing N N 247 
PHE N   H2   sing N N 248 
PHE CA  C    sing N N 249 
PHE CA  CB   sing N N 250 
PHE CA  HA   sing N N 251 
PHE C   O    doub N N 252 
PHE C   OXT  sing N N 253 
PHE CB  CG   sing N N 254 
PHE CB  HB2  sing N N 255 
PHE CB  HB3  sing N N 256 
PHE CG  CD1  doub Y N 257 
PHE CG  CD2  sing Y N 258 
PHE CD1 CE1  sing Y N 259 
PHE CD1 HD1  sing N N 260 
PHE CD2 CE2  doub Y N 261 
PHE CD2 HD2  sing N N 262 
PHE CE1 CZ   doub Y N 263 
PHE CE1 HE1  sing N N 264 
PHE CE2 CZ   sing Y N 265 
PHE CE2 HE2  sing N N 266 
PHE CZ  HZ   sing N N 267 
PHE OXT HXT  sing N N 268 
PRO N   CA   sing N N 269 
PRO N   CD   sing N N 270 
PRO N   H    sing N N 271 
PRO CA  C    sing N N 272 
PRO CA  CB   sing N N 273 
PRO CA  HA   sing N N 274 
PRO C   O    doub N N 275 
PRO C   OXT  sing N N 276 
PRO CB  CG   sing N N 277 
PRO CB  HB2  sing N N 278 
PRO CB  HB3  sing N N 279 
PRO CG  CD   sing N N 280 
PRO CG  HG2  sing N N 281 
PRO CG  HG3  sing N N 282 
PRO CD  HD2  sing N N 283 
PRO CD  HD3  sing N N 284 
PRO OXT HXT  sing N N 285 
SER N   CA   sing N N 286 
SER N   H    sing N N 287 
SER N   H2   sing N N 288 
SER CA  C    sing N N 289 
SER CA  CB   sing N N 290 
SER CA  HA   sing N N 291 
SER C   O    doub N N 292 
SER C   OXT  sing N N 293 
SER CB  OG   sing N N 294 
SER CB  HB2  sing N N 295 
SER CB  HB3  sing N N 296 
SER OG  HG   sing N N 297 
SER OXT HXT  sing N N 298 
THR N   CA   sing N N 299 
THR N   H    sing N N 300 
THR N   H2   sing N N 301 
THR CA  C    sing N N 302 
THR CA  CB   sing N N 303 
THR CA  HA   sing N N 304 
THR C   O    doub N N 305 
THR C   OXT  sing N N 306 
THR CB  OG1  sing N N 307 
THR CB  CG2  sing N N 308 
THR CB  HB   sing N N 309 
THR OG1 HG1  sing N N 310 
THR CG2 HG21 sing N N 311 
THR CG2 HG22 sing N N 312 
THR CG2 HG23 sing N N 313 
THR OXT HXT  sing N N 314 
TRP N   CA   sing N N 315 
TRP N   H    sing N N 316 
TRP N   H2   sing N N 317 
TRP CA  C    sing N N 318 
TRP CA  CB   sing N N 319 
TRP CA  HA   sing N N 320 
TRP C   O    doub N N 321 
TRP C   OXT  sing N N 322 
TRP CB  CG   sing N N 323 
TRP CB  HB2  sing N N 324 
TRP CB  HB3  sing N N 325 
TRP CG  CD1  doub Y N 326 
TRP CG  CD2  sing Y N 327 
TRP CD1 NE1  sing Y N 328 
TRP CD1 HD1  sing N N 329 
TRP CD2 CE2  doub Y N 330 
TRP CD2 CE3  sing Y N 331 
TRP NE1 CE2  sing Y N 332 
TRP NE1 HE1  sing N N 333 
TRP CE2 CZ2  sing Y N 334 
TRP CE3 CZ3  doub Y N 335 
TRP CE3 HE3  sing N N 336 
TRP CZ2 CH2  doub Y N 337 
TRP CZ2 HZ2  sing N N 338 
TRP CZ3 CH2  sing Y N 339 
TRP CZ3 HZ3  sing N N 340 
TRP CH2 HH2  sing N N 341 
TRP OXT HXT  sing N N 342 
TYR N   CA   sing N N 343 
TYR N   H    sing N N 344 
TYR N   H2   sing N N 345 
TYR CA  C    sing N N 346 
TYR CA  CB   sing N N 347 
TYR CA  HA   sing N N 348 
TYR C   O    doub N N 349 
TYR C   OXT  sing N N 350 
TYR CB  CG   sing N N 351 
TYR CB  HB2  sing N N 352 
TYR CB  HB3  sing N N 353 
TYR CG  CD1  doub Y N 354 
TYR CG  CD2  sing Y N 355 
TYR CD1 CE1  sing Y N 356 
TYR CD1 HD1  sing N N 357 
TYR CD2 CE2  doub Y N 358 
TYR CD2 HD2  sing N N 359 
TYR CE1 CZ   doub Y N 360 
TYR CE1 HE1  sing N N 361 
TYR CE2 CZ   sing Y N 362 
TYR CE2 HE2  sing N N 363 
TYR CZ  OH   sing N N 364 
TYR OH  HH   sing N N 365 
TYR OXT HXT  sing N N 366 
VAL N   CA   sing N N 367 
VAL N   H    sing N N 368 
VAL N   H2   sing N N 369 
VAL CA  C    sing N N 370 
VAL CA  CB   sing N N 371 
VAL CA  HA   sing N N 372 
VAL C   O    doub N N 373 
VAL C   OXT  sing N N 374 
VAL CB  CG1  sing N N 375 
VAL CB  CG2  sing N N 376 
VAL CB  HB   sing N N 377 
VAL CG1 HG11 sing N N 378 
VAL CG1 HG12 sing N N 379 
VAL CG1 HG13 sing N N 380 
VAL CG2 HG21 sing N N 381 
VAL CG2 HG22 sing N N 382 
VAL CG2 HG23 sing N N 383 
VAL OXT HXT  sing N N 384 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'National Science Foundation (NSF, United States)'                                         'United States' 1937971  1 
'National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)' 'United States' GM147557 2 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'in silico model' 
_pdbx_initial_refinement_model.source_name      AlphaFold 
_pdbx_initial_refinement_model.accession_code   ? 
_pdbx_initial_refinement_model.details          ? 
# 
_space_group.name_H-M_alt     'C 2 2 21' 
_space_group.name_Hall        'C 2c 2' 
_space_group.IT_number        20 
_space_group.crystal_system   orthorhombic 
_space_group.id               1 
# 
_atom_sites.entry_id                    9BXH 
_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]   0.011928 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.011104 
_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]   0.012450 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.scat_dispersion_real 
_atom_type.scat_dispersion_imag 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
_atom_type.scat_source 
_atom_type.scat_dispersion_source 
C   ? ? 3.54356 2.42580 ? ? 25.62398 1.50364  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
N   ? ? 4.01032 2.96436 ? ? 19.97189 1.75589  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O   ? ? 4.49882 3.47563 ? ? 15.80542 1.70748  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O1- ? ? 5.12366 3.84317 ? ? 3.49406  27.47979 ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
S   ? ? 9.55732 6.39887 ? ? 1.23737  29.19336 ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
# 
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   . ASP A 1 29  ? -26.21700 -14.10800 -6.72500  1.000 42.73187 ?  9   ASP A N   1 
ATOM   2    C CA  . ASP A 1 29  ? -25.39600 -14.21800 -7.92700  1.000 35.26389 ?  9   ASP A CA  1 
ATOM   3    C C   . ASP A 1 29  ? -24.29100 -13.16600 -7.93400  1.000 32.51012 ?  9   ASP A C   1 
ATOM   4    O O   . ASP A 1 29  ? -23.10600 -13.50100 -7.97800  1.000 38.29197 ?  9   ASP A O   1 
ATOM   5    N N   . GLU A 1 30  ? -24.68400 -11.89000 -7.90500  1.000 38.94204 ?  10  GLU A N   1 
ATOM   6    C CA  . GLU A 1 30  ? -23.69800 -10.81400 -7.85700  1.000 33.58938 ?  10  GLU A CA  1 
ATOM   7    C C   . GLU A 1 30  ? -22.80000 -10.95200 -6.63400  1.000 31.08292 ?  10  GLU A C   1 
ATOM   8    O O   . GLU A 1 30  ? -21.56800 -10.90400 -6.74100  1.000 27.31776 ?  10  GLU A O   1 
ATOM   9    C CB  . GLU A 1 30  ? -24.39500 -9.45400  -7.87100  1.000 41.53933 ?  10  GLU A CB  1 
ATOM   10   C CG  . GLU A 1 30  ? -23.45200 -8.27700  -8.07900  1.000 38.89044 ?  10  GLU A CG  1 
ATOM   11   N N   . LEU A 1 31  ? -23.40100 -11.13700 -5.45600  1.000 27.04836 ?  11  LEU A N   1 
ATOM   12   C CA  . LEU A 1 31  ? -22.58600 -11.32900 -4.26300  1.000 25.29878 ?  11  LEU A CA  1 
ATOM   13   C C   . LEU A 1 31  ? -21.75400 -12.60100 -4.35900  1.000 22.00301 ?  11  LEU A C   1 
ATOM   14   O O   . LEU A 1 31  ? -20.63500 -12.64600 -3.84000  1.000 21.18938 ?  11  LEU A O   1 
ATOM   15   C CB  . LEU A 1 31  ? -23.45300 -11.32900 -3.00200  1.000 28.52197 ?  11  LEU A CB  1 
ATOM   16   C CG  . LEU A 1 31  ? -23.59300 -9.97900  -2.29400  1.000 44.14141 ?  11  LEU A CG  1 
ATOM   17   N N   . LEU A 1 32  ? -22.26500 -13.63300 -5.03800  1.000 23.56573 ?  12  LEU A N   1 
ATOM   18   C CA  . LEU A 1 32  ? -21.52700 -14.89000 -5.13600  1.000 22.06419 ?  12  LEU A CA  1 
ATOM   19   C C   . LEU A 1 32  ? -20.18000 -14.68500 -5.82000  1.000 19.92383 ?  12  LEU A C   1 
ATOM   20   O O   . LEU A 1 32  ? -19.14700 -15.16400 -5.34000  1.000 19.98723 ?  12  LEU A O   1 
ATOM   21   C CB  . LEU A 1 32  ? -22.36100 -15.93600 -5.88300  1.000 27.98017 ?  12  LEU A CB  1 
ATOM   22   C CG  . LEU A 1 32  ? -21.74600 -17.33300 -6.02200  1.000 26.61045 ?  12  LEU A CG  1 
ATOM   23   C CD1 . LEU A 1 32  ? -21.35600 -17.89800 -4.66900  1.000 25.36456 ?  12  LEU A CD1 1 
ATOM   24   C CD2 . LEU A 1 32  ? -22.70500 -18.27700 -6.72700  1.000 31.47704 ?  12  LEU A CD2 1 
ATOM   25   N N   . GLY A 1 33  ? -20.17300 -13.99400 -6.96000  1.000 22.22901 ?  13  GLY A N   1 
ATOM   26   C CA  . GLY A 1 33  ? -18.91400 -13.72200 -7.63500  1.000 20.15690 ?  13  GLY A CA  1 
ATOM   27   C C   . GLY A 1 33  ? -17.96300 -12.89500 -6.79100  1.000 18.50289 ?  13  GLY A C   1 
ATOM   28   O O   . GLY A 1 33  ? -16.75800 -13.15900 -6.76000  1.000 18.91435 ?  13  GLY A O   1 
ATOM   29   N N   . GLN A 1 34  ? -18.48500 -11.86900 -6.11100  1.000 18.02797 ?  14  GLN A N   1 
ATOM   30   C CA  . GLN A 1 34  ? -17.65700 -11.07500 -5.20800  1.000 18.98471 ?  14  GLN A CA  1 
ATOM   31   C C   . GLN A 1 34  ? -16.99800 -11.96600 -4.16800  1.000 16.51270 ?  14  GLN A C   1 
ATOM   32   O O   . GLN A 1 34  ? -15.80000 -11.82600 -3.87700  1.000 17.24472 ?  14  GLN A O   1 
ATOM   33   C CB  . GLN A 1 34  ? -18.51500 -10.02800 -4.49500  1.000 18.03438 ?  14  GLN A CB  1 
ATOM   34   C CG  . GLN A 1 34  ? -19.04000 -8.91100  -5.38200  1.000 20.04422 ?  14  GLN A CG  1 
ATOM   35   C CD  . GLN A 1 34  ? -19.74400 -7.83600  -4.58700  1.000 22.14835 ?  14  GLN A CD  1 
ATOM   36   O OE1 . GLN A 1 34  ? -19.71000 -7.83500  -3.35200  1.000 27.33225 ?  14  GLN A OE1 1 
ATOM   37   N NE2 . GLN A 1 34  ? -20.40600 -6.91800  -5.29100  1.000 23.63817 ?  14  GLN A NE2 1 
ATOM   38   N N   . TYR A 1 35  ? -17.77000 -12.88200 -3.59200  1.000 16.41101 ?  15  TYR A N   1 
ATOM   39   C CA  . TYR A 1 35  ? -17.23400 -13.72600 -2.53500  1.000 17.04113 ?  15  TYR A CA  1 
ATOM   40   C C   . TYR A 1 35  ? -16.30500 -14.80300 -3.07000  1.000 16.47696 ?  15  TYR A C   1 
ATOM   41   O O   . TYR A 1 35  ? -15.32900 -15.14900 -2.40100  1.000 14.95999 ?  15  TYR A O   1 
ATOM   42   C CB  . TYR A 1 35  ? -18.36400 -14.25400 -1.64800  1.000 17.53817 ?  15  TYR A CB  1 
ATOM   43   C CG  . TYR A 1 35  ? -18.57100 -13.26200 -0.52500  1.000 20.42124 ?  15  TYR A CG  1 
ATOM   44   C CD1 . TYR A 1 35  ? -19.16400 -12.03100 -0.78200  1.000 22.15476 ?  15  TYR A CD1 1 
ATOM   45   C CD2 . TYR A 1 35  ? -18.09800 -13.50700 0.75900   1.000 24.00066 ?  15  TYR A CD2 1 
ATOM   46   C CE1 . TYR A 1 35  ? -19.31900 -11.08700 0.21200   1.000 22.48915 ?  15  TYR A CE1 1 
ATOM   47   C CE2 . TYR A 1 35  ? -18.24900 -12.56200 1.76800   1.000 25.44103 ?  15  TYR A CE2 1 
ATOM   48   C CZ  . TYR A 1 35  ? -18.86800 -11.35600 1.48500   1.000 24.93506 ?  15  TYR A CZ  1 
ATOM   49   O OH  . TYR A 1 35  ? -19.02800 -10.40100 2.47100   1.000 26.85184 ?  15  TYR A OH  1 
ATOM   50   N N   . LEU A 1 36  ? -16.55400 -15.31500 -4.27800  1.000 16.15243 ?  16  LEU A N   1 
ATOM   51   C CA  . LEU A 1 36  ? -15.62300 -16.28100 -4.84900  1.000 14.83057 ?  16  LEU A CA  1 
ATOM   52   C C   . LEU A 1 36  ? -14.28100 -15.62300 -5.16400  1.000 16.41979 ?  16  LEU A C   1 
ATOM   53   O O   . LEU A 1 36  ? -13.22200 -16.23400 -4.95800  1.000 16.09140 ?  16  LEU A O   1 
ATOM   54   C CB  . LEU A 1 36  ? -16.23600 -16.95500 -6.08600  1.000 15.74404 ?  16  LEU A CB  1 
ATOM   55   C CG  . LEU A 1 36  ? -17.30200 -18.00800 -5.73700  1.000 17.77355 ?  16  LEU A CG  1 
ATOM   56   C CD1 . LEU A 1 36  ? -18.13900 -18.37200 -6.96100  1.000 17.75318 ?  16  LEU A CD1 1 
ATOM   57   C CD2 . LEU A 1 36  ? -16.68200 -19.25900 -5.10200  1.000 17.24928 ?  16  LEU A CD2 1 
ATOM   58   N N   . ASP A 1 37  ? -14.29300 -14.36800 -5.63500  1.000 15.59358 ?  17  ASP A N   1 
ATOM   59   C CA  . ASP A 1 37  ? -13.02300 -13.66600 -5.81500  1.000 16.14776 ?  17  ASP A CA  1 
ATOM   60   C C   . ASP A 1 37  ? -12.36900 -13.35300 -4.47200  1.000 17.29743 ?  17  ASP A C   1 
ATOM   61   O O   . ASP A 1 37  ? -11.13900 -13.43400 -4.33600  1.000 16.44132 ?  17  ASP A O   1 
ATOM   62   C CB  . ASP A 1 37  ? -13.21400 -12.39000 -6.64300  1.000 18.47822 ?  17  ASP A CB  1 
ATOM   63   C CG  . ASP A 1 37  ? -11.96200 -11.51400 -6.66200  1.000 18.07559 ?  17  ASP A CG  1 
ATOM   64   O OD1 . ASP A 1 37  ? -11.09400 -11.75800 -7.52500  1.000 21.94105 ?  17  ASP A OD1 1 
ATOM   65   O OD2 . ASP A 1 37  ? -11.83400 -10.61700 -5.79900  1.000 20.38098 -1 17  ASP A OD2 1 
ATOM   66   N N   . PHE A 1 38  ? -13.18000 -13.00200 -3.46800  1.000 15.40403 ?  18  PHE A N   1 
ATOM   67   C CA  . PHE A 1 38  ? -12.67000 -12.73100 -2.12500  1.000 15.35181 ?  18  PHE A CA  1 
ATOM   68   C C   . PHE A 1 38  ? -11.94100 -13.95200 -1.56400  1.000 16.49362 ?  18  PHE A C   1 
ATOM   69   O O   . PHE A 1 38  ? -10.83100 -13.84000 -1.02400  1.000 18.38997 ?  18  PHE A O   1 
ATOM   70   C CB  . PHE A 1 38  ? -13.85600 -12.33000 -1.23000  1.000 16.05041 ?  18  PHE A CB  1 
ATOM   71   C CG  . PHE A 1 38  ? -13.48400 -11.82800 0.15600   1.000 16.27938 ?  18  PHE A CG  1 
ATOM   72   C CD1 . PHE A 1 38  ? -12.37000 -11.02900 0.36200   1.000 19.60059 ?  18  PHE A CD1 1 
ATOM   73   C CD2 . PHE A 1 38  ? -14.29300 -12.12800 1.23600   1.000 24.52884 ?  18  PHE A CD2 1 
ATOM   74   C CE1 . PHE A 1 38  ? -12.05500 -10.55600 1.62900   1.000 21.52238 ?  18  PHE A CE1 1 
ATOM   75   C CE2 . PHE A 1 38  ? -13.98600 -11.66300 2.50800   1.000 21.82389 ?  18  PHE A CE2 1 
ATOM   76   C CZ  . PHE A 1 38  ? -12.86600 -10.87700 2.70100   1.000 20.08779 ?  18  PHE A CZ  1 
ATOM   77   N N   . HIS A 1 39  ? -12.54000 -15.13300 -1.71600  1.000 15.74261 ?  19  HIS A N   1 
ATOM   78   C CA  . HIS A 1 39  ? -11.99700 -16.34600 -1.12200  1.000 16.23815 ?  19  HIS A CA  1 
ATOM   79   C C   . HIS A 1 39  ? -10.91200 -17.00800 -1.96300  1.000 16.12591 ?  19  HIS A C   1 
ATOM   80   O O   . HIS A 1 39  ? -9.98700  -17.60600 -1.39400  1.000 17.60070 ?  19  HIS A O   1 
ATOM   81   C CB  . HIS A 1 39  ? -13.12700 -17.33100 -0.84200  1.000 16.59780 ?  19  HIS A CB  1 
ATOM   82   C CG  . HIS A 1 39  ? -13.86300 -17.04300 0.42600   1.000 16.52971 ?  19  HIS A CG  1 
ATOM   83   N ND1 . HIS A 1 39  ? -14.20100 -18.03300 1.32500   1.000 15.22578 ?  19  HIS A ND1 1 
ATOM   84   C CD2 . HIS A 1 39  ? -14.30200 -15.88100 0.96400   1.000 20.08778 ?  19  HIS A CD2 1 
ATOM   85   C CE1 . HIS A 1 39  ? -14.82300 -17.49700 2.35900   1.000 16.40537 ?  19  HIS A CE1 1 
ATOM   86   N NE2 . HIS A 1 39  ? -14.90200 -16.19000 2.16400   1.000 20.65875 ?  19  HIS A NE2 1 
ATOM   87   N N   . TYR A 1 40  ? -10.99500 -16.91000 -3.29900  1.000 14.85872 ?  20  TYR A N   1 
ATOM   88   C CA  . TYR A 1 40  ? -10.17700 -17.72300 -4.18700  1.000 15.26413 ?  20  TYR A CA  1 
ATOM   89   C C   . TYR A 1 40  ? -9.49100  -16.93300 -5.29100  1.000 17.68986 ?  20  TYR A C   1 
ATOM   90   O O   . TYR A 1 40  ? -8.79800  -17.53600 -6.12400  1.000 20.45893 ?  20  TYR A O   1 
ATOM   91   C CB  . TYR A 1 40  ? -11.03400 -18.83800 -4.82200  1.000 15.27530 ?  20  TYR A CB  1 
ATOM   92   C CG  . TYR A 1 40  ? -11.69600 -19.74600 -3.79600  1.000 14.68729 ?  20  TYR A CG  1 
ATOM   93   C CD1 . TYR A 1 40  ? -10.94200 -20.63000 -3.02900  1.000 18.37496 ?  20  TYR A CD1 1 
ATOM   94   C CD2 . TYR A 1 40  ? -13.07000 -19.69600 -3.58100  1.000 16.36962 ?  20  TYR A CD2 1 
ATOM   95   C CE1 . TYR A 1 40  ? -11.54500 -21.45800 -2.08600  1.000 17.02824 ?  20  TYR A CE1 1 
ATOM   96   C CE2 . TYR A 1 40  ? -13.68000 -20.50700 -2.63500  1.000 15.34277 ?  20  TYR A CE2 1 
ATOM   97   C CZ  . TYR A 1 40  ? -12.91000 -21.38700 -1.89400  1.000 15.81895 ?  20  TYR A CZ  1 
ATOM   98   O OH  . TYR A 1 40  ? -13.52000 -22.20300 -0.96300  1.000 16.93127 ?  20  TYR A OH  1 
ATOM   99   N N   . GLY A 1 41  ? -9.65500  -15.61300 -5.32700  1.000 16.71335 ?  21  GLY A N   1 
ATOM   100  C CA  . GLY A 1 41  ? -9.10600  -14.81300 -6.39400  1.000 18.10847 ?  21  GLY A CA  1 
ATOM   101  C C   . GLY A 1 41  ? -7.72900  -14.29100 -6.05200  1.000 19.48995 ?  21  GLY A C   1 
ATOM   102  O O   . GLY A 1 41  ? -7.16300  -14.59300 -4.99600  1.000 22.52334 ?  21  GLY A O   1 
ATOM   103  N N   . PRO A 1 42  ? -7.16500  -13.48400 -6.94600  1.000 21.73108 ?  22  PRO A N   1 
ATOM   104  C CA  . PRO A 1 42  ? -5.88200  -12.84500 -6.65400  1.000 24.45588 ?  22  PRO A CA  1 
ATOM   105  C C   . PRO A 1 42  ? -6.06500  -11.71500 -5.65000  1.000 21.96858 ?  22  PRO A C   1 
ATOM   106  O O   . PRO A 1 42  ? -7.15900  -11.18200 -5.45300  1.000 27.79097 ?  22  PRO A O   1 
ATOM   107  C CB  . PRO A 1 42  ? -5.45900  -12.28700 -8.01700  1.000 30.00798 ?  22  PRO A CB  1 
ATOM   108  C CG  . PRO A 1 42  ? -6.75600  -11.98100 -8.68700  1.000 30.97410 ?  22  PRO A CG  1 
ATOM   109  C CD  . PRO A 1 42  ? -7.70100  -13.07900 -8.25800  1.000 29.47471 ?  22  PRO A CD  1 
ATOM   110  N N   . GLY A 1 43  ? -4.96500  -11.34400 -5.01700  1.000 28.29650 ?  23  GLY A N   1 
ATOM   111  C CA  . GLY A 1 43  ? -5.00300  -10.24100 -4.08500  1.000 25.08364 ?  23  GLY A CA  1 
ATOM   112  C C   . GLY A 1 43  ? -5.26700  -8.92000  -4.77900  1.000 22.36074 ?  23  GLY A C   1 
ATOM   113  O O   . GLY A 1 43  ? -5.08000  -8.76100  -5.98700  1.000 25.47393 ?  23  GLY A O   1 
ATOM   114  N N   . HIS A 1 44  ? -5.73300  -7.96300  -3.98700  1.000 17.14219 ?  24  HIS A N   1 
ATOM   115  C CA  . HIS A 1 44  ? -5.93200  -6.59200  -4.42800  1.000 17.68020 ?  24  HIS A CA  1 
ATOM   116  C C   . HIS A 1 44  ? -5.16500  -5.65800  -3.50700  1.000 19.52464 ?  24  HIS A C   1 
ATOM   117  O O   . HIS A 1 44  ? -5.09300  -5.89400  -2.29500  1.000 18.57037 ?  24  HIS A O   1 
ATOM   118  C CB  . HIS A 1 44  ? -7.42100  -6.23200  -4.41500  1.000 18.14571 ?  24  HIS A CB  1 
ATOM   119  C CG  . HIS A 1 44  ? -8.28300  -7.22900  -5.12300  1.000 16.99329 ?  24  HIS A CG  1 
ATOM   120  N ND1 . HIS A 1 44  ? -8.21800  -7.42500  -6.48500  1.000 20.54463 ?  24  HIS A ND1 1 
ATOM   121  C CD2 . HIS A 1 44  ? -9.21900  -8.09300  -4.66200  1.000 19.30335 ?  24  HIS A CD2 1 
ATOM   122  C CE1 . HIS A 1 44  ? -9.07300  -8.37000  -6.83200  1.000 20.89280 ?  24  HIS A CE1 1 
ATOM   123  N NE2 . HIS A 1 44  ? -9.69500  -8.79100  -5.74500  1.000 21.64892 ?  24  HIS A NE2 1 
ATOM   124  N N   . PHE A 1 45  ? -4.58300  -4.60300  -4.09100  1.000 18.02767 ?  25  PHE A N   1 
ATOM   125  C CA  . PHE A 1 45  ? -3.82900  -3.60100  -3.32900  1.000 17.31265 ?  25  PHE A CA  1 
ATOM   126  C C   . PHE A 1 45  ? -2.73000  -4.24400  -2.48200  1.000 19.66634 ?  25  PHE A C   1 
ATOM   127  O O   . PHE A 1 45  ? -2.37300  -3.73400  -1.41800  1.000 22.88002 ?  25  PHE A O   1 
ATOM   128  C CB  . PHE A 1 45  ? -4.74900  -2.73500  -2.46000  1.000 18.42452 ?  25  PHE A CB  1 
ATOM   129  C CG  . PHE A 1 45  ? -5.81300  -2.00300  -3.22900  1.000 17.88450 ?  25  PHE A CG  1 
ATOM   130  C CD1 . PHE A 1 45  ? -5.47700  -1.01000  -4.15100  1.000 19.71101 ?  25  PHE A CD1 1 
ATOM   131  C CD2 . PHE A 1 45  ? -7.15400  -2.30100  -3.03800  1.000 19.35298 ?  25  PHE A CD2 1 
ATOM   132  C CE1 . PHE A 1 45  ? -6.46100  -0.32900  -4.85600  1.000 22.20083 ?  25  PHE A CE1 1 
ATOM   133  C CE2 . PHE A 1 45  ? -8.14200  -1.61800  -3.75100  1.000 19.79011 ?  25  PHE A CE2 1 
ATOM   134  C CZ  . PHE A 1 45  ? -7.79500  -0.64100  -4.65900  1.000 19.76581 ?  25  PHE A CZ  1 
ATOM   135  N N   . ASP A 1 46  ? -2.20600  -5.38000  -2.94000  1.000 23.04091 ?  26  ASP A N   1 
ATOM   136  C CA  . ASP A 1 46  ? -1.16500  -6.12400  -2.22800  1.000 24.93665 ?  26  ASP A CA  1 
ATOM   137  C C   . ASP A 1 46  ? -1.61300  -6.61500  -0.85000  1.000 27.79946 ?  26  ASP A C   1 
ATOM   138  O O   . ASP A 1 46  ? -0.77200  -6.92700  0.00100   1.000 27.77254 ?  26  ASP A O   1 
ATOM   139  C CB  . ASP A 1 46  ? 0.14100   -5.32500  -2.12100  1.000 31.43279 ?  26  ASP A CB  1 
ATOM   140  C CG  . ASP A 1 46  ? 0.75900   -5.03200  -3.47900  1.000 34.29133 ?  26  ASP A CG  1 
ATOM   141  O OD1 . ASP A 1 46  ? 0.77200   -5.93800  -4.33800  1.000 40.04967 ?  26  ASP A OD1 1 
ATOM   142  O OD2 . ASP A 1 46  ? 1.23700   -3.89600  -3.68300  1.000 41.80802 -1 26  ASP A OD2 1 
ATOM   143  N N   . VAL A 1 47  ? -2.91700  -6.69300  -0.60100  1.000 20.76164 ?  27  VAL A N   1 
ATOM   144  C CA  . VAL A 1 47  ? -3.43100  -7.21100  0.67100   1.000 20.17279 ?  27  VAL A CA  1 
ATOM   145  C C   . VAL A 1 47  ? -3.50100  -8.73500  0.60700   1.000 18.89991 ?  27  VAL A C   1 
ATOM   146  O O   . VAL A 1 47  ? -4.04500  -9.29200  -0.35700  1.000 19.05287 ?  27  VAL A O   1 
ATOM   147  C CB  . VAL A 1 47  ? -4.79900  -6.59700  1.00900   1.000 17.10329 ?  27  VAL A CB  1 
ATOM   148  C CG1 . VAL A 1 47  ? -5.36900  -7.20700  2.29100   1.000 20.57857 ?  27  VAL A CG1 1 
ATOM   149  C CG2 . VAL A 1 47  ? -4.69700  -5.07300  1.13600   1.000 19.34731 ?  27  VAL A CG2 1 
ATOM   150  N N   . PRO A 1 48  ? -2.96500  -9.45600  1.59400   1.000 18.33081 ?  28  PRO A N   1 
ATOM   151  C CA  . PRO A 1 48  ? -3.01000  -10.92400 1.53800   1.000 19.44809 ?  28  PRO A CA  1 
ATOM   152  C C   . PRO A 1 48  ? -4.44100  -11.44200 1.58800   1.000 16.71737 ?  28  PRO A C   1 
ATOM   153  O O   . PRO A 1 48  ? -5.34000  -10.79000 2.12400   1.000 19.07981 ?  28  PRO A O   1 
ATOM   154  C CB  . PRO A 1 48  ? -2.22000  -11.35000 2.78300   1.000 21.89544 ?  28  PRO A CB  1 
ATOM   155  C CG  . PRO A 1 48  ? -1.35400  -10.16400 3.10300   1.000 21.13820 ?  28  PRO A CG  1 
ATOM   156  C CD  . PRO A 1 48  ? -2.18400  -8.96500  2.74300   1.000 20.33665 ?  28  PRO A CD  1 
ATOM   157  N N   . ASN A 1 49  ? -4.64400  -12.62800 1.01000   1.000 17.64824 ?  29  ASN A N   1 
ATOM   158  C CA  . ASN A 1 49  ? -5.93600  -13.30100 1.10800   1.000 15.12333 ?  29  ASN A CA  1 
ATOM   159  C C   . ASN A 1 49  ? -6.38300  -13.35000 2.56400   1.000 17.52059 ?  29  ASN A C   1 
ATOM   160  O O   . ASN A 1 49  ? -5.64600  -13.81200 3.43900   1.000 16.84081 ?  29  ASN A O   1 
ATOM   161  C CB  . ASN A 1 49  ? -5.82700  -14.73000 0.56600   1.000 17.31965 ?  29  ASN A CB  1 
ATOM   162  C CG  . ASN A 1 49  ? -7.14900  -15.46600 0.59900   1.000 19.31446 ?  29  ASN A CG  1 
ATOM   163  O OD1 . ASN A 1 49  ? -7.44800  -16.18200 1.55500   1.000 17.35145 ?  29  ASN A OD1 1 
ATOM   164  N ND2 . ASN A 1 49  ? -7.95100  -15.30100 -0.45200  1.000 19.54456 ?  29  ASN A ND2 1 
ATOM   165  N N   . TYR A 1 50  ? -7.60500  -12.90400 2.81300   1.000 16.44594 ?  30  TYR A N   1 
ATOM   166  C CA  . TYR A 1 50  ? -8.07900  -12.70500 4.18000   1.000 14.19987 ?  30  TYR A CA  1 
ATOM   167  C C   . TYR A 1 50  ? -8.42100  -14.01800 4.87400   1.000 16.16366 ?  30  TYR A C   1 
ATOM   168  O O   . TYR A 1 50  ? -7.97300  -14.24100 6.00300   1.000 16.06323 ?  30  TYR A O   1 
ATOM   169  C CB  . TYR A 1 50  ? -9.27200  -11.75700 4.16000   1.000 15.25585 ?  30  TYR A CB  1 
ATOM   170  C CG  . TYR A 1 50  ? -9.94300  -11.49000 5.49200   1.000 14.34102 ?  30  TYR A CG  1 
ATOM   171  C CD1 . TYR A 1 50  ? -9.31400  -10.73800 6.47800   1.000 14.15267 ?  30  TYR A CD1 1 
ATOM   172  C CD2 . TYR A 1 50  ? -11.23800 -11.92800 5.73200   1.000 16.06259 ?  30  TYR A CD2 1 
ATOM   173  C CE1 . TYR A 1 50  ? -9.95000  -10.46000 7.68500   1.000 14.44949 ?  30  TYR A CE1 1 
ATOM   174  C CE2 . TYR A 1 50  ? -11.88200 -11.65000 6.94100   1.000 15.70391 ?  30  TYR A CE2 1 
ATOM   175  C CZ  . TYR A 1 50  ? -11.23200 -10.91300 7.89800   1.000 14.26499 ?  30  TYR A CZ  1 
ATOM   176  O OH  . TYR A 1 50  ? -11.88100 -10.61900 9.08300   1.000 16.30477 ?  30  TYR A OH  1 
ATOM   177  N N   . PRO A 1 51  ? -9.21900  -14.89500 4.25800   1.000 14.33400 ?  31  PRO A N   1 
ATOM   178  C CA  . PRO A 1 51  ? -9.47500  -16.19500 4.89800   1.000 16.11085 ?  31  PRO A CA  1 
ATOM   179  C C   . PRO A 1 51  ? -8.18700  -16.90900 5.27400   1.000 16.35544 ?  31  PRO A C   1 
ATOM   180  O O   . PRO A 1 51  ? -8.06000  -17.41000 6.40000   1.000 17.55069 ?  31  PRO A O   1 
ATOM   181  C CB  . PRO A 1 51  ? -10.31300 -16.94600 3.84600   1.000 19.27263 ?  31  PRO A CB  1 
ATOM   182  C CG  . PRO A 1 51  ? -11.03000 -15.84600 3.11600   1.000 18.28935 ?  31  PRO A CG  1 
ATOM   183  C CD  . PRO A 1 51  ? -10.01300 -14.71300 3.02600   1.000 15.96895 ?  31  PRO A CD  1 
ATOM   184  N N   . LYS A 1 52  ? -7.21000  -16.94700 4.36200   1.000 16.31249 ?  32  LYS A N   1 
ATOM   185  C CA  . LYS A 1 52  ? -5.93600  -17.58800 4.67300   1.000 16.23849 ?  32  LYS A CA  1 
ATOM   186  C C   . LYS A 1 52  ? -5.19800  -16.85600 5.79200   1.000 18.29159 ?  32  LYS A C   1 
ATOM   187  O O   . LYS A 1 52  ? -4.67000  -17.49300 6.71400   1.000 19.17150 ?  32  LYS A O   1 
ATOM   188  C CB  . LYS A 1 52  ? -5.06900  -17.69200 3.41800   1.000 19.60049 ?  32  LYS A CB  1 
ATOM   189  C CG  . LYS A 1 52  ? -3.77800  -18.45400 3.64600   1.000 23.36961 ?  32  LYS A CG  1 
ATOM   190  C CD  . LYS A 1 52  ? -2.98900  -18.60800 2.35900   1.000 25.51436 ?  32  LYS A CD  1 
ATOM   191  C CE  . LYS A 1 52  ? -1.70100  -19.38800 2.60600   1.000 33.83869 ?  32  LYS A CE  1 
ATOM   192  N N   . ALA A 1 53  ? -5.16300  -15.51900 5.74600   1.000 16.58279 ?  33  ALA A N   1 
ATOM   193  C CA  . ALA A 1 53  ? -4.48300  -14.76200 6.79200   1.000 17.49178 ?  33  ALA A CA  1 
ATOM   194  C C   . ALA A 1 53  ? -5.10500  -15.03500 8.15500   1.000 18.07026 ?  33  ALA A C   1 
ATOM   195  O O   . ALA A 1 53  ? -4.39300  -15.14800 9.16400   1.000 16.98650 ?  33  ALA A O   1 
ATOM   196  C CB  . ALA A 1 53  ? -4.53900  -13.26400 6.47800   1.000 17.69353 ?  33  ALA A CB  1 
ATOM   197  N N   . CYS A 1 54  ? -6.43700  -15.13500 8.20300   1.000 15.57765 ?  34  CYS A N   1 
ATOM   198  C CA  . CYS A 1 54  ? -7.11800  -15.38500 9.46800   1.000 15.74740 ?  34  CYS A CA  1 
ATOM   199  C C   . CYS A 1 54  ? -6.74700  -16.75400 10.03000  1.000 16.60839 ?  34  CYS A C   1 
ATOM   200  O O   . CYS A 1 54  ? -6.43900  -16.88400 11.22000  1.000 16.47746 ?  34  CYS A O   1 
ATOM   201  C CB  . CYS A 1 54  ? -8.63300  -15.29100 9.27900   1.000 14.24837 ?  34  CYS A CB  1 
ATOM   202  S SG  . CYS A 1 54  ? -9.25900  -13.61900 9.11100   1.000 16.43058 ?  34  CYS A SG  1 
ATOM   203  N N   . ILE A 1 55  ? -6.77800  -17.78600 9.18700   1.000 15.98338 ?  35  ILE A N   1 
ATOM   204  C CA  . ILE A 1 55  ? -6.48700  -19.13800 9.65300   1.000 14.42644 ?  35  ILE A CA  1 
ATOM   205  C C   . ILE A 1 55  ? -5.00900  -19.30000 10.00000  1.000 16.01913 ?  35  ILE A C   1 
ATOM   206  O O   . ILE A 1 55  ? -4.66000  -20.05600 10.91900  1.000 16.91524 ?  35  ILE A O   1 
ATOM   207  C CB  . ILE A 1 55  ? -6.99500  -20.17100 8.63600   1.000 14.89448 ?  35  ILE A CB  1 
ATOM   208  C CG1 . ILE A 1 55  ? -8.52300  -20.07900 8.50200   1.000 16.71818 ?  35  ILE A CG1 1 
ATOM   209  C CG2 . ILE A 1 55  ? -6.55700  -21.57400 9.05000   1.000 14.95351 ?  35  ILE A CG2 1 
ATOM   210  C CD1 . ILE A 1 55  ? -9.27400  -20.03200 9.84000   1.000 16.83059 ?  35  ILE A CD1 1 
ATOM   211  N N   . GLU A 1 56  ? -4.11800  -18.59100 9.30300   1.000 18.86073 ?  36  GLU A N   1 
ATOM   212  C CA  . GLU A 1 56  ? -2.71300  -18.59800 9.70200   1.000 18.26255 ?  36  GLU A CA  1 
ATOM   213  C C   . GLU A 1 56  ? -2.56800  -18.11300 11.13900  1.000 19.69572 ?  36  GLU A C   1 
ATOM   214  O O   . GLU A 1 56  ? -1.81700  -18.69300 11.93300  1.000 19.37506 ?  36  GLU A O   1 
ATOM   215  C CB  . GLU A 1 56  ? -1.90000  -17.70900 8.75800   1.000 19.59894 ?  36  GLU A CB  1 
ATOM   216  C CG  . GLU A 1 56  ? -1.49500  -18.39300 7.45900   1.000 22.66772 ?  36  GLU A CG  1 
ATOM   217  C CD  . GLU A 1 56  ? -0.84700  -17.44100 6.45900   1.000 23.99535 ?  36  GLU A CD  1 
ATOM   218  O OE1 . GLU A 1 56  ? -0.78100  -16.22400 6.73200   1.000 29.44854 ?  36  GLU A OE1 1 
ATOM   219  O OE2 . GLU A 1 56  ? -0.39900  -17.92700 5.39400   1.000 31.32231 -1 36  GLU A OE2 1 
ATOM   220  N N   . GLN A 1 57  ? -3.29600  -17.05500 11.49600  1.000 16.74397 ?  37  GLN A N   1 
ATOM   221  C CA  . GLN A 1 57  ? -3.24000  -16.53700 12.85900  1.000 16.15142 ?  37  GLN A CA  1 
ATOM   222  C C   . GLN A 1 57  ? -3.85900  -17.51400 13.85100  1.000 21.39321 ?  37  GLN A C   1 
ATOM   223  O O   . GLN A 1 57  ? -3.32300  -17.71900 14.94600  1.000 18.61002 ?  37  GLN A O   1 
ATOM   224  C CB  . GLN A 1 57  ? -3.94900  -15.18900 12.92500  1.000 21.27806 ?  37  GLN A CB  1 
ATOM   225  C CG  . GLN A 1 57  ? -3.08900  -14.04400 12.44900  1.000 25.93300 ?  37  GLN A CG  1 
ATOM   226  C CD  . GLN A 1 57  ? -1.80000  -13.95900 13.23200  1.000 40.13769 ?  37  GLN A CD  1 
ATOM   227  O OE1 . GLN A 1 57  ? -1.80400  -14.06700 14.45800  1.000 35.58201 ?  37  GLN A OE1 1 
ATOM   228  N NE2 . GLN A 1 57  ? -0.68800  -13.76800 12.53100  1.000 49.53469 ?  37  GLN A NE2 1 
ATOM   229  N N   . ALA A 1 58  ? -4.99300  -18.12000 13.49700  1.000 17.24070 ?  38  ALA A N   1 
ATOM   230  C CA  . ALA A 1 58  ? -5.58900  -19.11900 14.38000  1.000 15.36751 ?  38  ALA A CA  1 
ATOM   231  C C   . ALA A 1 58  ? -4.61000  -20.25200 14.66500  1.000 19.64134 ?  38  ALA A C   1 
ATOM   232  O O   . ALA A 1 58  ? -4.44700  -20.67300 15.81900  1.000 19.13217 ?  38  ALA A O   1 
ATOM   233  C CB  . ALA A 1 58  ? -6.86600  -19.67700 13.75000  1.000 17.66438 ?  38  ALA A CB  1 
ATOM   234  N N   . LEU A 1 59  ? -3.95500  -20.76400 13.61800  1.000 18.00293 ?  39  LEU A N   1 
ATOM   235  C CA  . LEU A 1 59  ? -3.07200  -21.91300 13.77200  1.000 16.85800 ?  39  LEU A CA  1 
ATOM   236  C C   . LEU A 1 59  ? -1.78900  -21.54500 14.49600  1.000 20.34119 ?  39  LEU A C   1 
ATOM   237  O O   . LEU A 1 59  ? -1.14900  -22.42500 15.07700  1.000 20.96211 ?  39  LEU A O   1 
ATOM   238  C CB  . LEU A 1 59  ? -2.73600  -22.48700 12.39400  1.000 17.37567 ?  39  LEU A CB  1 
ATOM   239  C CG  . LEU A 1 59  ? -3.87800  -23.21400 11.68900  1.000 20.99710 ?  39  LEU A CG  1 
ATOM   240  C CD1 . LEU A 1 59  ? -3.46900  -23.60700 10.27300  1.000 23.47266 ?  39  LEU A CD1 1 
ATOM   241  C CD2 . LEU A 1 59  ? -4.32600  -24.43300 12.48300  1.000 26.79549 ?  39  LEU A CD2 1 
ATOM   242  N N   . ALA A 1 60  ? -1.39100  -20.27300 14.46000  1.000 19.49821 ?  40  ALA A N   1 
ATOM   243  C CA  . ALA A 1 60  ? -0.22900  -19.82900 15.22300  1.000 16.09873 ?  40  ALA A CA  1 
ATOM   244  C C   . ALA A 1 60  ? -0.50100  -19.75800 16.72000  1.000 19.57732 ?  40  ALA A C   1 
ATOM   245  O O   . ALA A 1 60  ? 0.45000   -19.63700 17.50000  1.000 19.81085 ?  40  ALA A O   1 
ATOM   246  C CB  . ALA A 1 60  ? 0.25400   -18.46200 14.71600  1.000 18.62691 ?  40  ALA A CB  1 
ATOM   247  N N   . HIS A 1 61  ? -1.77000  -19.81200 17.14200  1.000 17.14644 ?  41  HIS A N   1 
ATOM   248  C CA  . HIS A 1 61  ? -2.12500  -19.67700 18.54800  1.000 16.63971 ?  41  HIS A CA  1 
ATOM   249  C C   . HIS A 1 61  ? -2.85700  -20.87400 19.13200  1.000 19.60819 ?  41  HIS A C   1 
ATOM   250  O O   . HIS A 1 61  ? -3.09600  -20.89000 20.34600  1.000 23.16034 ?  41  HIS A O   1 
ATOM   251  C CB  . HIS A 1 61  ? -2.98600  -18.42200 18.75700  1.000 20.20657 ?  41  HIS A CB  1 
ATOM   252  C CG  . HIS A 1 61  ? -2.23200  -17.15000 18.55400  1.000 20.70826 ?  41  HIS A CG  1 
ATOM   253  N ND1 . HIS A 1 61  ? -2.15200  -16.52100 17.33000  1.000 24.48631 ?  41  HIS A ND1 1 
ATOM   254  C CD2 . HIS A 1 61  ? -1.51500  -16.39100 19.41700  1.000 24.94331 ?  41  HIS A CD2 1 
ATOM   255  C CE1 . HIS A 1 61  ? -1.41600  -15.43100 17.44700  1.000 24.92995 ?  41  HIS A CE1 1 
ATOM   256  N NE2 . HIS A 1 61  ? -1.02100  -15.32600 18.70300  1.000 31.71148 ?  41  HIS A NE2 1 
ATOM   257  N N   . HIS A 1 62  ? -3.22500  -21.85800 18.32100  1.000 18.94712 ?  42  HIS A N   1 
ATOM   258  C CA  . HIS A 1 62  ? -3.93600  -23.03000 18.81300  1.000 19.60049 ?  42  HIS A CA  1 
ATOM   259  C C   . HIS A 1 62  ? -2.94900  -24.00100 19.44500  1.000 20.29103 ?  42  HIS A C   1 
ATOM   260  O O   . HIS A 1 62  ? -2.04100  -24.50500 18.77200  1.000 19.53210 ?  42  HIS A O   1 
ATOM   261  C CB  . HIS A 1 62  ? -4.72700  -23.69400 17.68700  1.000 20.76256 ?  42  HIS A CB  1 
ATOM   262  C CG  . HIS A 1 62  ? -5.46700  -24.92600 18.11400  1.000 19.18220 ?  42  HIS A CG  1 
ATOM   263  N ND1 . HIS A 1 62  ? -6.43200  -24.90700 19.09700  1.000 20.94259 ?  42  HIS A ND1 1 
ATOM   264  C CD2 . HIS A 1 62  ? -5.40600  -26.20500 17.66900  1.000 18.91127 ?  42  HIS A CD2 1 
ATOM   265  C CE1 . HIS A 1 62  ? -6.92100  -26.12500 19.25400  1.000 17.87379 ?  42  HIS A CE1 1 
ATOM   266  N NE2 . HIS A 1 62  ? -6.31900  -26.93100 18.39700  1.000 18.63626 ?  42  HIS A NE2 1 
ATOM   267  N N   . THR A 1 63  ? -3.13500  -24.26200 20.73800  1.000 17.73842 ?  43  THR A N   1 
ATOM   268  C CA  . THR A 1 63  ? -2.27600  -25.16100 21.50000  1.000 18.65523 ?  43  THR A CA  1 
ATOM   269  C C   . THR A 1 63  ? -2.95700  -26.47600 21.84900  1.000 23.48803 ?  43  THR A C   1 
ATOM   270  O O   . THR A 1 63  ? -2.37200  -27.29300 22.57300  1.000 24.51891 ?  43  THR A O   1 
ATOM   271  C CB  . THR A 1 63  ? -1.76500  -24.46600 22.76900  1.000 19.94194 ?  43  THR A CB  1 
ATOM   272  O OG1 . THR A 1 63  ? -2.87600  -24.06800 23.58600  1.000 19.82421 ?  43  THR A OG1 1 
ATOM   273  C CG2 . THR A 1 63  ? -0.94200  -23.23900 22.40200  1.000 21.52883 ?  43  THR A CG2 1 
ATOM   274  N N   . GLY A 1 64  ? -4.17200  -26.70100 21.36100  1.000 20.19758 ?  44  GLY A N   1 
ATOM   275  C CA  . GLY A 1 64  ? -4.90900  -27.91700 21.62800  1.000 21.09161 ?  44  GLY A CA  1 
ATOM   276  C C   . GLY A 1 64  ? -4.69400  -28.97200 20.56400  1.000 23.13859 ?  44  GLY A C   1 
ATOM   277  O O   . GLY A 1 64  ? -3.74400  -28.92100 19.77700  1.000 25.01497 ?  44  GLY A O   1 
ATOM   278  N N   . THR A 1 65  ? -5.61300  -29.93800 20.53300  1.000 22.53650 ?  45  THR A N   1 
ATOM   279  C CA  . THR A 1 65  ? -5.57000  -31.03700 19.58000  1.000 23.04637 ?  45  THR A CA  1 
ATOM   280  C C   . THR A 1 65  ? -6.24400  -30.62400 18.27200  1.000 21.27662 ?  45  THR A C   1 
ATOM   281  O O   . THR A 1 65  ? -6.94300  -29.61100 18.19400  1.000 20.73601 ?  45  THR A O   1 
ATOM   282  C CB  . THR A 1 65  ? -6.24200  -32.28100 20.16900  1.000 28.85783 ?  45  THR A CB  1 
ATOM   283  O OG1 . THR A 1 65  ? -7.43600  -31.91200 20.86600  1.000 30.75371 ?  45  THR A OG1 1 
ATOM   284  C CG2 . THR A 1 65  ? -5.31200  -32.95200 21.17100  1.000 32.13981 ?  45  THR A CG2 1 
ATOM   285  N N   . THR A 1 66  ? -6.03600  -31.42700 17.23400  1.000 26.36210 ?  46  THR A N   1 
ATOM   286  C CA  . THR A 1 66  ? -6.44500  -31.04500 15.88700  1.000 22.43294 ?  46  THR A CA  1 
ATOM   287  C C   . THR A 1 66  ? -7.49600  -31.98800 15.31500  1.000 22.94108 ?  46  THR A C   1 
ATOM   288  O O   . THR A 1 66  ? -7.49000  -32.30900 14.12300  1.000 22.13017 ?  46  THR A O   1 
ATOM   289  C CB  . THR A 1 66  ? -5.23500  -30.91400 14.96800  1.000 29.26695 ?  46  THR A CB  1 
ATOM   290  O OG1 . THR A 1 66  ? -4.46200  -32.12000 15.03100  1.000 30.82921 ?  46  THR A OG1 1 
ATOM   291  C CG2 . THR A 1 66  ? -4.37500  -29.72600 15.40200  1.000 30.83617 ?  46  THR A CG2 1 
ATOM   292  N N   . GLY A 1 67  ? -8.43000  -32.42600 16.15200  1.000 22.30816 ?  47  GLY A N   1 
ATOM   293  C CA  . GLY A 1 67  ? -9.46000  -33.33800 15.70800  1.000 21.06213 ?  47  GLY A CA  1 
ATOM   294  C C   . GLY A 1 67  ? -10.57700 -32.69300 14.91300  1.000 21.43669 ?  47  GLY A C   1 
ATOM   295  O O   . GLY A 1 67  ? -10.97600 -33.22400 13.87100  1.000 22.58950 ?  47  GLY A O   1 
ATOM   296  N N   . ARG A 1 68  ? -11.08800 -31.55100 15.38000  1.000 17.83728 ?  48  ARG A N   1 
ATOM   297  C CA  . ARG A 1 68  ? -12.34100 -31.03700 14.84100  1.000 18.37591 ?  48  ARG A CA  1 
ATOM   298  C C   . ARG A 1 68  ? -12.39600 -29.52000 14.91900  1.000 16.24973 ?  48  ARG A C   1 
ATOM   299  O O   . ARG A 1 68  ? -12.18700 -28.94800 15.99200  1.000 16.91948 ?  48  ARG A O   1 
ATOM   300  C CB  . ARG A 1 68  ? -13.49000 -31.63500 15.65000  1.000 22.15877 ?  48  ARG A CB  1 
ATOM   301  C CG  . ARG A 1 68  ? -14.75400 -31.83700 14.88400  1.000 27.08517 ?  48  ARG A CG  1 
ATOM   302  C CD  . ARG A 1 68  ? -15.76100 -32.58200 15.75900  1.000 24.17513 ?  48  ARG A CD  1 
ATOM   303  N NE  . ARG A 1 68  ? -17.02300 -32.72500 15.05500  1.000 24.91565 ?  48  ARG A NE  1 
ATOM   304  C CZ  . ARG A 1 68  ? -18.19000 -32.31600 15.52500  1.000 19.93607 ?  48  ARG A CZ  1 
ATOM   305  N NH1 . ARG A 1 68  ? -18.30700 -31.81800 16.75200  1.000 20.63004 ?  48  ARG A NH1 1 
ATOM   306  N NH2 . ARG A 1 68  ? -19.26700 -32.41300 14.75200  1.000 24.84348 ?  48  ARG A NH2 1 
ATOM   307  N N   . ALA A 1 69  ? -12.70000 -28.86900 13.78700  1.000 17.78138 ?  49  ALA A N   1 
ATOM   308  C CA  . ALA A 1 69  ? -12.88100 -27.42500 13.77000  1.000 15.71904 ?  49  ALA A CA  1 
ATOM   309  C C   . ALA A 1 69  ? -14.21700 -27.06500 13.13200  1.000 15.70972 ?  49  ALA A C   1 
ATOM   310  O O   . ALA A 1 69  ? -14.76100 -27.81900 12.30900  1.000 17.51683 ?  49  ALA A O   1 
ATOM   311  C CB  . ALA A 1 69  ? -11.74300 -26.71200 13.02100  1.000 16.78711 ?  49  ALA A CB  1 
ATOM   312  N N   . LEU A 1 70  ? -14.73100 -25.89600 13.52300  1.000 15.48909 ?  50  LEU A N   1 
ATOM   313  C CA  . LEU A 1 70  ? -16.00500 -25.36600 13.04800  1.000 15.75010 ?  50  LEU A CA  1 
ATOM   314  C C   . LEU A 1 70  ? -15.78000 -23.97100 12.47900  1.000 15.51508 ?  50  LEU A C   1 
ATOM   315  O O   . LEU A 1 70  ? -15.12300 -23.14000 13.11000  1.000 16.10112 ?  50  LEU A O   1 
ATOM   316  C CB  . LEU A 1 70  ? -17.01600 -25.30700 14.20100  1.000 15.59672 ?  50  LEU A CB  1 
ATOM   317  C CG  . LEU A 1 70  ? -18.40000 -24.72300 13.90100  1.000 16.50489 ?  50  LEU A CG  1 
ATOM   318  C CD1 . LEU A 1 70  ? -19.14700 -25.65600 12.97300  1.000 18.04697 ?  50  LEU A CD1 1 
ATOM   319  C CD2 . LEU A 1 70  ? -19.18500 -24.49000 15.19300  1.000 17.94525 ?  50  LEU A CD2 1 
ATOM   320  N N   . ASP A 1 71  ? -16.31100 -23.72900 11.27900  1.000 15.70847 ?  51  ASP A N   1 
ATOM   321  C CA  . ASP A 1 71  ? -16.18100 -22.45600 10.56300  1.000 13.76498 ?  51  ASP A CA  1 
ATOM   322  C C   . ASP A 1 71  ? -17.59900 -21.89800 10.41500  1.000 15.21220 ?  51  ASP A C   1 
ATOM   323  O O   . ASP A 1 71  ? -18.37900 -22.38300 9.58400   1.000 16.67100 ?  51  ASP A O   1 
ATOM   324  C CB  . ASP A 1 71  ? -15.51400 -22.71400 9.20700   1.000 15.28974 ?  51  ASP A CB  1 
ATOM   325  C CG  . ASP A 1 71  ? -15.34600 -21.46300 8.36500   1.000 18.28693 ?  51  ASP A CG  1 
ATOM   326  O OD1 . ASP A 1 71  ? -15.69100 -20.34700 8.83100   1.000 19.02425 ?  51  ASP A OD1 1 
ATOM   327  O OD2 . ASP A 1 71  ? -14.85800 -21.60800 7.21500   1.000 19.50744 -1 51  ASP A OD2 1 
ATOM   328  N N   . LEU A 1 72  ? -17.93800 -20.89400 11.23000  1.000 15.65572 ?  52  LEU A N   1 
ATOM   329  C CA  . LEU A 1 72  ? -19.28200 -20.32300 11.25400  1.000 16.95500 ?  52  LEU A CA  1 
ATOM   330  C C   . LEU A 1 72  ? -19.35800 -19.10200 10.34200  1.000 18.11282 ?  52  LEU A C   1 
ATOM   331  O O   . LEU A 1 72  ? -18.53100 -18.19000 10.44000  1.000 17.08099 ?  52  LEU A O   1 
ATOM   332  C CB  . LEU A 1 72  ? -19.64700 -19.93500 12.69000  1.000 16.21860 ?  52  LEU A CB  1 
ATOM   333  C CG  . LEU A 1 72  ? -19.83000 -21.13100 13.63000  1.000 16.59054 ?  52  LEU A CG  1 
ATOM   334  C CD1 . LEU A 1 72  ? -20.14100 -20.68200 15.06700  1.000 18.20805 ?  52  LEU A CD1 1 
ATOM   335  C CD2 . LEU A 1 72  ? -20.92600 -22.05200 13.10400  1.000 20.37055 ?  52  LEU A CD2 1 
ATOM   336  N N   . GLY A 1 73  ? -20.36900 -19.06500 9.48200   1.000 17.07505 ?  53  GLY A N   1 
ATOM   337  C CA  . GLY A 1 73  ? -20.38800 -18.06500 8.42600   1.000 16.45733 ?  53  GLY A CA  1 
ATOM   338  C C   . GLY A 1 73  ? -19.31700 -18.33900 7.39800   1.000 17.86003 ?  53  GLY A C   1 
ATOM   339  O O   . GLY A 1 73  ? -18.61800 -17.41100 6.95900   1.000 18.15317 ?  53  GLY A O   1 
ATOM   340  N N   . CYS A 1 74  ? -19.16700 -19.60300 7.00700   1.000 17.16389 ?  54  CYS A N   1 
ATOM   341  C CA  . CYS A 1 74  ? -18.06800 -20.03900 6.15800   1.000 16.22250 ?  54  CYS A CA  1 
ATOM   342  C C   . CYS A 1 74  ? -18.14000 -19.50200 4.73400   1.000 18.02287 ?  54  CYS A C   1 
ATOM   343  O O   . CYS A 1 74  ? -17.15000 -19.62600 4.00600   1.000 18.12034 ?  54  CYS A O   1 
ATOM   344  C CB  . CYS A 1 74  ? -18.02400 -21.56600 6.14100   1.000 14.50471 ?  54  CYS A CB  1 
ATOM   345  S SG  . CYS A 1 74  ? -19.44100 -22.34400 5.32200   1.000 17.49668 ?  54  CYS A SG  1 
ATOM   346  N N   . ALA A 1 75  ? -19.27800 -18.94900 4.31200   1.000 16.89840 ?  55  ALA A N   1 
ATOM   347  C CA  . ALA A 1 75  ? -19.46900 -18.43700 2.94200   1.000 18.05605 ?  55  ALA A CA  1 
ATOM   348  C C   . ALA A 1 75  ? -19.03200 -19.52200 1.95400   1.000 17.32455 ?  55  ALA A C   1 
ATOM   349  O O   . ALA A 1 75  ? -19.50700 -20.66200 2.06100   1.000 17.28480 ?  55  ALA A O   1 
ATOM   350  C CB  . ALA A 1 75  ? -18.79800 -17.07200 2.79700   1.000 19.21629 ?  55  ALA A CB  1 
ATOM   351  N N   . VAL A 1 76  ? -18.12700 -19.22400 1.01200   1.000 16.74207 ?  56  VAL A N   1 
ATOM   352  C CA  . VAL A 1 76  ? -17.76400 -20.15900 -0.04900  1.000 16.33722 ?  56  VAL A CA  1 
ATOM   353  C C   . VAL A 1 76  ? -16.57600 -21.03700 0.32300   1.000 15.89679 ?  56  VAL A C   1 
ATOM   354  O O   . VAL A 1 76  ? -16.09700 -21.79900 -0.52700  1.000 17.42613 ?  56  VAL A O   1 
ATOM   355  C CB  . VAL A 1 76  ? -17.53900 -19.44900 -1.40600  1.000 16.07334 ?  56  VAL A CB  1 
ATOM   356  C CG1 . VAL A 1 76  ? -18.87400 -18.90100 -1.95000  1.000 21.01576 ?  56  VAL A CG1 1 
ATOM   357  C CG2 . VAL A 1 76  ? -16.47700 -18.35400 -1.28800  1.000 16.26415 ?  56  VAL A CG2 1 
ATOM   358  N N   . GLY A 1 77  ? -16.07100 -20.95000 1.55600   1.000 16.09327 ?  57  GLY A N   1 
ATOM   359  C CA  . GLY A 1 77  ? -15.31200 -22.05000 2.12800   1.000 15.75733 ?  57  GLY A CA  1 
ATOM   360  C C   . GLY A 1 77  ? -13.80100 -21.92900 2.26700   1.000 17.26699 ?  57  GLY A C   1 
ATOM   361  O O   . GLY A 1 77  ? -13.18700 -22.89100 2.75300   1.000 15.80036 ?  57  GLY A O   1 
ATOM   362  N N   . ARG A 1 78  ? -13.16100 -20.81200 1.89100   1.000 15.02164 ?  58  ARG A N   1 
ATOM   363  C CA  . ARG A 1 78  ? -11.69300 -20.80000 1.90700   1.000 16.71961 ?  58  ARG A CA  1 
ATOM   364  C C   . ARG A 1 78  ? -11.13100 -21.08700 3.29700   1.000 15.65932 ?  58  ARG A C   1 
ATOM   365  O O   . ARG A 1 78  ? -10.15100 -21.83200 3.43200   1.000 15.90542 ?  58  ARG A O   1 
ATOM   366  C CB  . ARG A 1 78  ? -11.13100 -19.49100 1.34400   1.000 16.80258 ?  58  ARG A CB  1 
ATOM   367  C CG  . ARG A 1 78  ? -9.59700  -19.38600 1.39800   1.000 16.91565 ?  58  ARG A CG  1 
ATOM   368  C CD  . ARG A 1 78  ? -8.89300  -20.29000 0.37200   1.000 17.46383 ?  58  ARG A CD  1 
ATOM   369  N NE  . ARG A 1 78  ? -7.44100  -20.12400 0.42400   1.000 18.40926 ?  58  ARG A NE  1 
ATOM   370  C CZ  . ARG A 1 78  ? -6.74100  -19.31700 -0.36900  1.000 18.97258 ?  58  ARG A CZ  1 
ATOM   371  N NH1 . ARG A 1 78  ? -7.33100  -18.51400 -1.24800  1.000 19.05525 ?  58  ARG A NH1 1 
ATOM   372  N NH2 . ARG A 1 78  ? -5.41700  -19.29500 -0.26600  1.000 20.18558 ?  58  ARG A NH2 1 
ATOM   373  N N   . SER A 1 79  ? -11.72600 -20.50700 4.34100   1.000 16.13300 ?  59  SER A N   1 
ATOM   374  C CA  . SER A 1 79  ? -11.22600 -20.74900 5.69300   1.000 16.34072 ?  59  SER A CA  1 
ATOM   375  C C   . SER A 1 79  ? -11.39000 -22.20500 6.10100   1.000 14.47560 ?  59  SER A C   1 
ATOM   376  O O   . SER A 1 79  ? -10.55100 -22.74200 6.83600   1.000 16.49976 ?  59  SER A O   1 
ATOM   377  C CB  . SER A 1 79  ? -11.92200 -19.83000 6.70000   1.000 17.64754 ?  59  SER A CB  1 
ATOM   378  O OG  . SER A 1 79  ? -11.60000 -18.47900 6.45300   1.000 22.61923 ?  59  SER A OG  1 
ATOM   379  N N   . SER A 1 80  ? -12.46100 -22.85800 5.63800   1.000 14.53251 ?  60  SER A N   1 
ATOM   380  C CA  . SER A 1 80  ? -12.65600 -24.26600 5.97400   1.000 16.56308 ?  60  SER A CA  1 
ATOM   381  C C   . SER A 1 80  ? -11.60900 -25.13300 5.29300   1.000 16.31948 ?  60  SER A C   1 
ATOM   382  O O   . SER A 1 80  ? -11.04000 -26.03500 5.91800   1.000 16.11363 ?  60  SER A O   1 
ATOM   383  C CB  . SER A 1 80  ? -14.06300 -24.71800 5.57300   1.000 18.14687 ?  60  SER A CB  1 
ATOM   384  O OG  . SER A 1 80  ? -15.05200 -24.08600 6.37600   1.000 19.59986 ?  60  SER A OG  1 
ATOM   385  N N   . PHE A 1 81  ? -11.33800 -24.87600 4.00800   1.000 16.71614 ?  61  PHE A N   1 
ATOM   386  C CA  . PHE A 1 81  ? -10.30300 -25.63400 3.31500   1.000 16.57833 ?  61  PHE A CA  1 
ATOM   387  C C   . PHE A 1 81  ? -8.92500  -25.38600 3.91700   1.000 17.21433 ?  61  PHE A C   1 
ATOM   388  O O   . PHE A 1 81  ? -8.09800  -26.30700 3.96800   1.000 18.52079 ?  61  PHE A O   1 
ATOM   389  C CB  . PHE A 1 81  ? -10.31900 -25.30400 1.82200   1.000 16.60468 ?  61  PHE A CB  1 
ATOM   390  C CG  . PHE A 1 81  ? -11.53000 -25.82700 1.09900   1.000 16.31300 ?  61  PHE A CG  1 
ATOM   391  C CD1 . PHE A 1 81  ? -11.87200 -27.17600 1.14300   1.000 17.87982 ?  61  PHE A CD1 1 
ATOM   392  C CD2 . PHE A 1 81  ? -12.35600 -24.95400 0.40000   1.000 17.93537 ?  61  PHE A CD2 1 
ATOM   393  C CE1 . PHE A 1 81  ? -12.99900 -27.64600 0.48300   1.000 18.50048 ?  61  PHE A CE1 1 
ATOM   394  C CE2 . PHE A 1 81  ? -13.48700 -25.41700 -0.26800  1.000 15.54433 ?  61  PHE A CE2 1 
ATOM   395  C CZ  . PHE A 1 81  ? -13.81000 -26.76800 -0.22500  1.000 19.99885 ?  61  PHE A CZ  1 
ATOM   396  N N   . GLU A 1 82  ? -8.65300  -24.16300 4.38000   1.000 16.11317 ?  62  GLU A N   1 
ATOM   397  C CA  . GLU A 1 82  ? -7.37200  -23.90200 5.03600   1.000 16.73805 ?  62  GLU A CA  1 
ATOM   398  C C   . GLU A 1 82  ? -7.27900  -24.65300 6.36500   1.000 18.68062 ?  62  GLU A C   1 
ATOM   399  O O   . GLU A 1 82  ? -6.24200  -25.25300 6.68200   1.000 18.94876 ?  62  GLU A O   1 
ATOM   400  C CB  . GLU A 1 82  ? -7.17800  -22.39400 5.25600   1.000 14.95742 ?  62  GLU A CB  1 
ATOM   401  C CG  . GLU A 1 82  ? -7.01400  -21.58300 3.96500   1.000 17.13918 ?  62  GLU A CG  1 
ATOM   402  C CD  . GLU A 1 82  ? -5.66200  -21.78100 3.29300   1.000 22.91821 ?  62  GLU A CD  1 
ATOM   403  O OE1 . GLU A 1 82  ? -4.72200  -22.26900 3.95400   1.000 22.66075 ?  62  GLU A OE1 1 
ATOM   404  O OE2 . GLU A 1 82  ? -5.54800  -21.47100 2.08300   1.000 19.81302 -1 62  GLU A OE2 1 
ATOM   405  N N   . LEU A 1 83  ? -8.36200  -24.65500 7.14600   1.000 16.65546 ?  63  LEU A N   1 
ATOM   406  C CA  . LEU A 1 83  ? -8.36100  -25.40800 8.39500   1.000 16.82367 ?  63  LEU A CA  1 
ATOM   407  C C   . LEU A 1 83  ? -8.17700  -26.90100 8.14700   1.000 19.33301 ?  63  LEU A C   1 
ATOM   408  O O   . LEU A 1 83  ? -7.54100  -27.59000 8.95400   1.000 19.98178 ?  63  LEU A O   1 
ATOM   409  C CB  . LEU A 1 83  ? -9.67000  -25.16400 9.14000   1.000 16.79562 ?  63  LEU A CB  1 
ATOM   410  C CG  . LEU A 1 83  ? -9.73500  -23.85300 9.92700   1.000 16.91774 ?  63  LEU A CG  1 
ATOM   411  C CD1 . LEU A 1 83  ? -11.18400 -23.55600 10.29200  1.000 16.97941 ?  63  LEU A CD1 1 
ATOM   412  C CD2 . LEU A 1 83  ? -8.84900  -23.90500 11.17500  1.000 17.26729 ?  63  LEU A CD2 1 
ATOM   413  N N   . ALA A 1 84  ? -8.70600  -27.41600 7.03100   1.000 16.13231 ?  64  ALA A N   1 
ATOM   414  C CA  . ALA A 1 84  ? -8.62700  -28.84000 6.72100   1.000 17.79190 ?  64  ALA A CA  1 
ATOM   415  C C   . ALA A 1 84  ? -7.20500  -29.30300 6.44300   1.000 21.02198 ?  64  ALA A C   1 
ATOM   416  O O   . ALA A 1 84  ? -6.94900  -30.51500 6.47300   1.000 20.67253 ?  64  ALA A O   1 
ATOM   417  C CB  . ALA A 1 84  ? -9.55300  -29.17800 5.55600   1.000 20.05651 ?  64  ALA A CB  1 
ATOM   418  N N   . ARG A 1 85  ? -6.27200  -28.38100 6.19600   1.000 19.91640 ?  65  ARG A N   1 
ATOM   419  C CA  . ARG A 1 85  ? -4.88300  -28.79200 6.05200   1.000 24.72007 ?  65  ARG A CA  1 
ATOM   420  C C   . ARG A 1 85  ? -4.30700  -29.30600 7.36000   1.000 24.21435 ?  65  ARG A C   1 
ATOM   421  O O   . ARG A 1 85  ? -3.32600  -30.06000 7.33400   1.000 26.37504 ?  65  ARG A O   1 
ATOM   422  C CB  . ARG A 1 85  ? -4.03600  -27.63600 5.52000   1.000 23.67713 ?  65  ARG A CB  1 
ATOM   423  C CG  . ARG A 1 85  ? -4.42200  -27.21100 4.11300   1.000 24.90217 ?  65  ARG A CG  1 
ATOM   424  C CD  . ARG A 1 85  ? -3.47900  -26.13300 3.57600   1.000 32.79174 ?  65  ARG A CD  1 
ATOM   425  N NE  . ARG A 1 85  ? -2.09100  -26.57800 3.55400   1.000 42.54630 ?  65  ARG A NE  1 
ATOM   426  N N   . ARG A 1 86  ? -4.90500  -28.93400 8.49400   1.000 19.95717 ?  66  ARG A N   1 
ATOM   427  C CA  . ARG A 1 86  ? -4.40700  -29.30200 9.81500   1.000 20.00519 ?  66  ARG A CA  1 
ATOM   428  C C   . ARG A 1 86  ? -5.37100  -30.13600 10.65500  1.000 24.17831 ?  66  ARG A C   1 
ATOM   429  O O   . ARG A 1 86  ? -4.90800  -30.93500 11.47400  1.000 27.36854 ?  66  ARG A O   1 
ATOM   430  C CB  . ARG A 1 86  ? -4.01200  -28.04600 10.60900  1.000 24.43543 ?  66  ARG A CB  1 
ATOM   431  N N   . PHE A 1 87  ? -6.68400  -29.98800 10.48400  1.000 18.92262 ?  67  PHE A N   1 
ATOM   432  C CA  . PHE A 1 87  ? -7.66900  -30.65100 11.33400  1.000 18.87860 ?  67  PHE A CA  1 
ATOM   433  C C   . PHE A 1 87  ? -8.25200  -31.88300 10.64400  1.000 19.76348 ?  67  PHE A C   1 
ATOM   434  O O   . PHE A 1 87  ? -8.42000  -31.91000 9.42100   1.000 19.52084 ?  67  PHE A O   1 
ATOM   435  C CB  . PHE A 1 87  ? -8.79600  -29.67700 11.70300  1.000 19.04424 ?  67  PHE A CB  1 
ATOM   436  C CG  . PHE A 1 87  ? -8.40400  -28.68200 12.76100  1.000 17.62786 ?  67  PHE A CG  1 
ATOM   437  C CD1 . PHE A 1 87  ? -7.73700  -27.51600 12.41700  1.000 18.74840 ?  67  PHE A CD1 1 
ATOM   438  C CD2 . PHE A 1 87  ? -8.67700  -28.92100 14.09900  1.000 16.75774 ?  67  PHE A CD2 1 
ATOM   439  C CE1 . PHE A 1 87  ? -7.35100  -26.60900 13.38400  1.000 17.70039 ?  67  PHE A CE1 1 
ATOM   440  C CE2 . PHE A 1 87  ? -8.30000  -28.01500 15.07700  1.000 19.41439 ?  67  PHE A CE2 1 
ATOM   441  C CZ  . PHE A 1 87  ? -7.63700  -26.85000 14.71800  1.000 19.79168 ?  67  PHE A CZ  1 
ATOM   442  N N   . ASP A 1 88  ? -8.58500  -32.90500 11.44700  1.000 19.42419 ?  68  ASP A N   1 
ATOM   443  C CA  . ASP A 1 88  ? -9.08000  -34.15500 10.86400  1.000 20.30071 ?  68  ASP A CA  1 
ATOM   444  C C   . ASP A 1 88  ? -10.46600 -33.99200 10.24300  1.000 21.48044 ?  68  ASP A C   1 
ATOM   445  O O   . ASP A 1 88  ? -10.80000 -34.69700 9.28400   1.000 20.40716 ?  68  ASP A O   1 
ATOM   446  C CB  . ASP A 1 88  ? -9.12300  -35.27800 11.90500  1.000 20.05464 ?  68  ASP A CB  1 
ATOM   447  C CG  . ASP A 1 88  ? -7.76000  -35.58200 12.50400  1.000 26.42247 ?  68  ASP A CG  1 
ATOM   448  O OD1 . ASP A 1 88  ? -6.74900  -35.49700 11.78300  1.000 27.19946 ?  68  ASP A OD1 1 
ATOM   449  O OD2 . ASP A 1 88  ? -7.71200  -35.97000 13.69100  1.000 33.93336 -1 68  ASP A OD2 1 
ATOM   450  N N   . GLU A 1 89  ? -11.28600 -33.09500 10.79200  1.000 19.40619 ?  69  GLU A N   1 
ATOM   451  C CA  . GLU A 1 89  ? -12.63600 -32.83200 10.31700  1.000 18.08926 ?  69  GLU A CA  1 
ATOM   452  C C   . GLU A 1 89  ? -12.89900 -31.34500 10.48600  1.000 16.10879 ?  69  GLU A C   1 
ATOM   453  O O   . GLU A 1 89  ? -12.57400 -30.77400 11.53300  1.000 16.12482 ?  69  GLU A O   1 
ATOM   454  C CB  . GLU A 1 89  ? -13.68500 -33.56300 11.16500  1.000 19.27598 ?  69  GLU A CB  1 
ATOM   455  C CG  . GLU A 1 89  ? -15.12000 -33.27100 10.73100  1.000 21.97095 ?  69  GLU A CG  1 
ATOM   456  C CD  . GLU A 1 89  ? -16.16100 -34.08400 11.48400  1.000 25.82248 ?  69  GLU A CD  1 
ATOM   457  O OE1 . GLU A 1 89  ? -16.12400 -34.09800 12.73200  1.000 26.71758 ?  69  GLU A OE1 1 
ATOM   458  O OE2 . GLU A 1 89  ? -17.02100 -34.70400 10.82400  1.000 32.68963 -1 69  GLU A OE2 1 
ATOM   459  N N   . VAL A 1 90  ? -13.47500 -30.72500 9.45300   1.000 16.83161 ?  70  VAL A N   1 
ATOM   460  C CA  . VAL A 1 90  ? -13.87100 -29.31900 9.48500   1.000 16.39092 ?  70  VAL A CA  1 
ATOM   461  C C   . VAL A 1 90  ? -15.31300 -29.21800 9.01200   1.000 15.62362 ?  70  VAL A C   1 
ATOM   462  O O   . VAL A 1 90  ? -15.65200 -29.70800 7.92500   1.000 17.79391 ?  70  VAL A O   1 
ATOM   463  C CB  . VAL A 1 90  ? -12.96300 -28.44400 8.59700   1.000 17.39792 ?  70  VAL A CB  1 
ATOM   464  C CG1 . VAL A 1 90  ? -13.40200 -26.98900 8.68800   1.000 16.47951 ?  70  VAL A CG1 1 
ATOM   465  C CG2 . VAL A 1 90  ? -11.50100 -28.60200 8.99900   1.000 17.38067 ?  70  VAL A CG2 1 
ATOM   466  N N   . ILE A 1 91  ? -16.15500 -28.57900 9.82200   1.000 14.93478 ?  71  ILE A N   1 
ATOM   467  C CA  . ILE A 1 91  ? -17.56200 -28.35400 9.51100   1.000 17.57198 ?  71  ILE A CA  1 
ATOM   468  C C   . ILE A 1 91  ? -17.72700 -26.87100 9.20300   1.000 16.02391 ?  71  ILE A C   1 
ATOM   469  O O   . ILE A 1 91  ? -17.38600 -26.02100 10.03500  1.000 16.46363 ?  71  ILE A O   1 
ATOM   470  C CB  . ILE A 1 91  ? -18.46900 -28.75700 10.68500  1.000 15.93317 ?  71  ILE A CB  1 
ATOM   471  C CG1 . ILE A 1 91  ? -18.21900 -30.21100 11.11700  1.000 22.46306 ?  71  ILE A CG1 1 
ATOM   472  C CG2 . ILE A 1 91  ? -19.93500 -28.51500 10.34700  1.000 19.77115 ?  71  ILE A CG2 1 
ATOM   473  C CD1 . ILE A 1 91  ? -18.37200 -31.20700 9.99900   1.000 26.17035 ?  71  ILE A CD1 1 
ATOM   474  N N   . GLY A 1 92  ? -18.25800 -26.55600 8.02300   1.000 16.87846 ?  72  GLY A N   1 
ATOM   475  C CA  . GLY A 1 92  ? -18.55200 -25.18200 7.62900   1.000 16.17295 ?  72  GLY A CA  1 
ATOM   476  C C   . GLY A 1 92  ? -20.05600 -24.97000 7.54500   1.000 16.27676 ?  72  GLY A C   1 
ATOM   477  O O   . GLY A 1 92  ? -20.76600 -25.75500 6.91400   1.000 17.43728 ?  72  GLY A O   1 
ATOM   478  N N   . ILE A 1 93  ? -20.52800 -23.90700 8.19500   1.000 16.13086 ?  73  ILE A N   1 
ATOM   479  C CA  . ILE A 1 93  ? -21.95500 -23.60700 8.28100   1.000 16.67395 ?  73  ILE A CA  1 
ATOM   480  C C   . ILE A 1 93  ? -22.20800 -22.19000 7.77900   1.000 18.11584 ?  73  ILE A C   1 
ATOM   481  O O   . ILE A 1 93  ? -21.49700 -21.25100 8.15400   1.000 17.47252 ?  73  ILE A O   1 
ATOM   482  C CB  . ILE A 1 93  ? -22.49300 -23.78500 9.71500   1.000 16.96923 ?  73  ILE A CB  1 
ATOM   483  C CG1 . ILE A 1 93  ? -22.33300 -25.24600 10.15100  1.000 19.43046 ?  73  ILE A CG1 1 
ATOM   484  C CG2 . ILE A 1 93  ? -23.95200 -23.36200 9.80500   1.000 20.33251 ?  73  ILE A CG2 1 
ATOM   485  C CD1 . ILE A 1 93  ? -22.73200 -25.52800 11.58400  1.000 23.03490 ?  73  ILE A CD1 1 
ATOM   486  N N   . ASP A 1 94  ? -23.21500 -22.03600 6.92400   1.000 17.06716 ?  74  ASP A N   1 
ATOM   487  C CA  . ASP A 1 94  ? -23.61300 -20.71800 6.44700   1.000 16.67114 ?  74  ASP A CA  1 
ATOM   488  C C   . ASP A 1 94  ? -25.10900 -20.75200 6.18300   1.000 18.14011 ?  74  ASP A C   1 
ATOM   489  O O   . ASP A 1 94  ? -25.67600 -21.81100 5.89300   1.000 19.74215 ?  74  ASP A O   1 
ATOM   490  C CB  . ASP A 1 94  ? -22.86700 -20.35200 5.14700   1.000 16.87273 ?  74  ASP A CB  1 
ATOM   491  C CG  . ASP A 1 94  ? -22.86200 -18.85600 4.86600   1.000 19.03207 ?  74  ASP A CG  1 
ATOM   492  O OD1 . ASP A 1 94  ? -23.86000 -18.35300 4.29400   1.000 21.51097 ?  74  ASP A OD1 1 
ATOM   493  O OD2 . ASP A 1 94  ? -21.86700 -18.17000 5.21200   1.000 19.80934 -1 74  ASP A OD2 1 
ATOM   494  N N   . LEU A 1 95  ? -25.74700 -19.58500 6.28400   1.000 18.52964 ?  75  LEU A N   1 
ATOM   495  C CA  . LEU A 1 95  ? -27.17900 -19.50800 6.01500   1.000 21.08021 ?  75  LEU A CA  1 
ATOM   496  C C   . LEU A 1 95  ? -27.50200 -19.61100 4.52800   1.000 21.22185 ?  75  LEU A C   1 
ATOM   497  O O   . LEU A 1 95  ? -28.62900 -19.98100 4.17900   1.000 23.51951 ?  75  LEU A O   1 
ATOM   498  C CB  . LEU A 1 95  ? -27.74900 -18.20400 6.57900   1.000 24.79961 ?  75  LEU A CB  1 
ATOM   499  C CG  . LEU A 1 95  ? -29.22100 -18.27800 6.98700   1.000 35.97265 ?  75  LEU A CG  1 
ATOM   500  C CD1 . LEU A 1 95  ? -29.40700 -19.30000 8.08500   1.000 35.10920 ?  75  LEU A CD1 1 
ATOM   501  N N   . SER A 1 96  ? -26.55100 -19.30300 3.64900   1.000 21.09174 ?  76  SER A N   1 
ATOM   502  C CA  . SER A 1 96  ? -26.81600 -19.21500 2.21300   1.000 21.41761 ?  76  SER A CA  1 
ATOM   503  C C   . SER A 1 96  ? -26.64500 -20.57400 1.54800   1.000 22.38263 ?  76  SER A C   1 
ATOM   504  O O   . SER A 1 96  ? -25.53400 -21.11000 1.50900   1.000 20.74633 ?  76  SER A O   1 
ATOM   505  C CB  . SER A 1 96  ? -25.84200 -18.24300 1.55500   1.000 21.39902 ?  76  SER A CB  1 
ATOM   506  O OG  . SER A 1 96  ? -25.95500 -18.33600 0.13500   1.000 22.41767 ?  76  SER A OG  1 
ATOM   507  N N   . ARG A 1 97  ? -27.72900 -21.10400 0.97200   1.000 23.24704 ?  77  ARG A N   1 
ATOM   508  C CA  . ARG A 1 97  ? -27.61400 -22.36200 0.24000   1.000 28.43803 ?  77  ARG A CA  1 
ATOM   509  C C   . ARG A 1 97  ? -26.73000 -22.20800 -0.99300  1.000 22.97199 ?  77  ARG A C   1 
ATOM   510  O O   . ARG A 1 97  ? -25.98600 -23.13200 -1.34600  1.000 22.80881 ?  77  ARG A O   1 
ATOM   511  C CB  . ARG A 1 97  ? -28.99600 -22.90900 -0.13000  1.000 27.91335 ?  77  ARG A CB  1 
ATOM   512  C CG  . ARG A 1 97  ? -28.94200 -24.30400 -0.76800  1.000 31.02161 ?  77  ARG A CG  1 
ATOM   513  C CD  . ARG A 1 97  ? -30.28000 -25.03200 -0.71700  1.000 46.45302 ?  77  ARG A CD  1 
ATOM   514  N NE  . ARG A 1 97  ? -30.86700 -25.09300 0.61900   1.000 47.95163 ?  77  ARG A NE  1 
ATOM   515  C CZ  . ARG A 1 97  ? -30.50200 -25.94900 1.56400   1.000 44.71500 ?  77  ARG A CZ  1 
ATOM   516  N NH1 . ARG A 1 97  ? -29.51100 -26.80600 1.37600   1.000 50.65333 ?  77  ARG A NH1 1 
ATOM   517  N NH2 . ARG A 1 97  ? -31.15300 -25.95200 2.72400   1.000 41.16348 ?  77  ARG A NH2 1 
ATOM   518  N N   . ARG A 1 98  ? -26.79200 -21.04800 -1.65800  1.000 21.40777 ?  78  ARG A N   1 
ATOM   519  C CA  . ARG A 1 98  ? -25.95900 -20.82200 -2.83400  1.000 22.27980 ?  78  ARG A CA  1 
ATOM   520  C C   . ARG A 1 98  ? -24.48000 -20.87100 -2.47000  1.000 23.43207 ?  78  ARG A C   1 
ATOM   521  O O   . ARG A 1 98  ? -23.66200 -21.42400 -3.21400  1.000 21.08714 ?  78  ARG A O   1 
ATOM   522  C CB  . ARG A 1 98  ? -26.30000 -19.46300 -3.44400  1.000 24.95647 ?  78  ARG A CB  1 
ATOM   523  C CG  . ARG A 1 98  ? -26.17000 -19.38700 -4.94600  1.000 35.08561 ?  78  ARG A CG  1 
ATOM   524  C CD  . ARG A 1 98  ? -27.00600 -18.23500 -5.49100  1.000 31.19519 ?  78  ARG A CD  1 
ATOM   525  N NE  . ARG A 1 98  ? -27.19400 -18.33300 -6.93000  1.000 46.95853 ?  78  ARG A NE  1 
ATOM   526  C CZ  . ARG A 1 98  ? -28.11600 -19.08800 -7.51200  1.000 32.94271 ?  78  ARG A CZ  1 
ATOM   527  N NH1 . ARG A 1 98  ? -29.02300 -19.73700 -6.80300  1.000 42.71416 ?  78  ARG A NH1 1 
ATOM   528  N NH2 . ARG A 1 98  ? -28.13700 -19.17800 -8.83700  1.000 40.15435 ?  78  ARG A NH2 1 
ATOM   529  N N   . PHE A 1 99  ? -24.11600 -20.28200 -1.33100  1.000 18.73612 ?  79  PHE A N   1 
ATOM   530  C CA  . PHE A 1 99  ? -22.72700 -20.33600 -0.88400  1.000 18.97494 ?  79  PHE A CA  1 
ATOM   531  C C   . PHE A 1 99  ? -22.32500 -21.75900 -0.51300  1.000 20.04870 ?  79  PHE A C   1 
ATOM   532  O O   . PHE A 1 99  ? -21.23400 -22.21800 -0.87300  1.000 17.75959 ?  79  PHE A O   1 
ATOM   533  C CB  . PHE A 1 99  ? -22.53700 -19.41900 0.32400   1.000 19.94590 ?  79  PHE A CB  1 
ATOM   534  C CG  . PHE A 1 99  ? -22.44600 -17.96100 -0.01500  1.000 23.93435 ?  79  PHE A CG  1 
ATOM   535  C CD1 . PHE A 1 99  ? -22.71400 -17.50700 -1.29200  1.000 26.98189 ?  79  PHE A CD1 1 
ATOM   536  C CD2 . PHE A 1 99  ? -22.10900 -17.03800 0.96200   1.000 29.78686 ?  79  PHE A CD2 1 
ATOM   537  C CE1 . PHE A 1 99  ? -22.63300 -16.16400 -1.59700  1.000 34.06646 ?  79  PHE A CE1 1 
ATOM   538  C CE2 . PHE A 1 99  ? -22.02400 -15.68800 0.66000   1.000 33.14455 ?  79  PHE A CE2 1 
ATOM   539  C CZ  . PHE A 1 99  ? -22.28300 -15.25700 -0.62500  1.000 28.93011 ?  79  PHE A CZ  1 
ATOM   540  N N   . ILE A 1 100 ? -23.18500 -22.46400 0.22900   1.000 18.39069 ?  80  ILE A N   1 
ATOM   541  C CA  . ILE A 1 100 ? -22.87400 -23.82700 0.65400   1.000 18.49520 ?  80  ILE A CA  1 
ATOM   542  C C   . ILE A 1 100 ? -22.72200 -24.74600 -0.55700  1.000 18.09741 ?  80  ILE A C   1 
ATOM   543  O O   . ILE A 1 100 ? -21.79400 -25.56200 -0.62600  1.000 19.08967 ?  80  ILE A O   1 
ATOM   544  C CB  . ILE A 1 100 ? -23.94400 -24.32000 1.65000   1.000 18.67449 ?  80  ILE A CB  1 
ATOM   545  C CG1 . ILE A 1 100 ? -23.78400 -23.61300 3.00600   1.000 21.86877 ?  80  ILE A CG1 1 
ATOM   546  C CG2 . ILE A 1 100 ? -23.88200 -25.83300 1.81100   1.000 19.28023 ?  80  ILE A CG2 1 
ATOM   547  C CD1 . ILE A 1 100 ? -22.39900 -23.77400 3.65000   1.000 19.27871 ?  80  ILE A CD1 1 
ATOM   548  N N   . ASP A 1 101 ? -23.61200 -24.60600 -1.54600  1.000 19.09528 ?  81  ASP A N   1 
ATOM   549  C CA  . ASP A 1 101 ? -23.50100 -25.40800 -2.76500  1.000 18.77170 ?  81  ASP A CA  1 
ATOM   550  C C   . ASP A 1 101 ? -22.18700 -25.14000 -3.49800  1.000 18.83688 ?  81  ASP A C   1 
ATOM   551  O O   . ASP A 1 101 ? -21.61200 -26.05200 -4.10500  1.000 20.95155 ?  81  ASP A O   1 
ATOM   552  C CB  . ASP A 1 101 ? -24.68200 -25.10500 -3.69300  1.000 24.48111 ?  81  ASP A CB  1 
ATOM   553  C CG  . ASP A 1 101 ? -25.97400 -25.77600 -3.25200  1.000 25.57816 ?  81  ASP A CG  1 
ATOM   554  O OD1 . ASP A 1 101 ? -25.93300 -26.64700 -2.36300  1.000 28.10624 ?  81  ASP A OD1 1 
ATOM   555  O OD2 . ASP A 1 101 ? -27.03400 -25.41600 -3.81200  1.000 27.60243 -1 81  ASP A OD2 1 
ATOM   556  N N   . SER A 1 102 ? -21.70700 -23.89200 -3.48500  1.000 17.62524 ?  82  SER A N   1 
ATOM   557  C CA  . SER A 1 102 ? -20.43400 -23.60400 -4.14200  1.000 16.92436 ?  82  SER A CA  1 
ATOM   558  C C   . SER A 1 102 ? -19.26600 -24.24700 -3.40200  1.000 16.51365 ?  82  SER A C   1 
ATOM   559  O O   . SER A 1 102 ? -18.36500 -24.81700 -4.03200  1.000 17.03631 ?  82  SER A O   1 
ATOM   560  C CB  . SER A 1 102 ? -20.22200 -22.09600 -4.29100  1.000 20.17691 ?  82  SER A CB  1 
ATOM   561  O OG  . SER A 1 102 ? -21.32100 -21.49300 -4.96300  1.000 25.71611 ?  82  SER A OG  1 
ATOM   562  N N   . ALA A 1 103 ? -19.25100 -24.15200 -2.07000  1.000 17.22389 ?  83  ALA A N   1 
ATOM   563  C CA  . ALA A 1 103 ? -18.18200 -24.78100 -1.30600  1.000 16.00129 ?  83  ALA A CA  1 
ATOM   564  C C   . ALA A 1 103 ? -18.16800 -26.28600 -1.53000  1.000 16.65748 ?  83  ALA A C   1 
ATOM   565  O O   . ALA A 1 103 ? -17.09800 -26.88500 -1.68300  1.000 16.02234 ?  83  ALA A O   1 
ATOM   566  C CB  . ALA A 1 103 ? -18.33400 -24.46000 0.18300   1.000 16.76486 ?  83  ALA A CB  1 
ATOM   567  N N   . THR A 1 104 ? -19.35100 -26.91000 -1.57800  1.000 17.20342 ?  84  THR A N   1 
ATOM   568  C CA  . THR A 1 104 ? -19.41900 -28.35300 -1.79500  1.000 18.44163 ?  84  THR A CA  1 
ATOM   569  C C   . THR A 1 104 ? -18.92700 -28.73000 -3.18600  1.000 17.72458 ?  84  THR A C   1 
ATOM   570  O O   . THR A 1 104 ? -18.21100 -29.72700 -3.34100  1.000 18.35114 ?  84  THR A O   1 
ATOM   571  C CB  . THR A 1 104 ? -20.84200 -28.85700 -1.54500  1.000 18.17849 ?  84  THR A CB  1 
ATOM   572  O OG1 . THR A 1 104 ? -21.19100 -28.61900 -0.17200  1.000 22.03403 ?  84  THR A OG1 1 
ATOM   573  C CG2 . THR A 1 104 ? -20.95400 -30.35000 -1.84000  1.000 21.60780 ?  84  THR A CG2 1 
ATOM   574  N N   . ARG A 1 105 ? -19.28900 -27.94300 -4.20700  1.000 18.44495 ?  85  ARG A N   1 
ATOM   575  C CA  . ARG A 1 105 ? -18.78400 -28.22000 -5.54800  1.000 17.17169 ?  85  ARG A CA  1 
ATOM   576  C C   . ARG A 1 105 ? -17.26400 -28.15000 -5.56900  1.000 20.63256 ?  85  ARG A C   1 
ATOM   577  O O   . ARG A 1 105 ? -16.59900 -29.00200 -6.16800  1.000 18.99898 ?  85  ARG A O   1 
ATOM   578  C CB  . ARG A 1 105 ? -19.39000 -27.25100 -6.56800  1.000 17.15781 ?  85  ARG A CB  1 
ATOM   579  C CG  . ARG A 1 105 ? -18.70300 -27.29400 -7.93300  1.000 16.32002 ?  85  ARG A CG  1 
ATOM   580  C CD  . ARG A 1 105 ? -19.40400 -26.41700 -8.97900  1.000 20.15352 ?  85  ARG A CD  1 
ATOM   581  N NE  . ARG A 1 105 ? -20.69500 -26.95700 -9.39800  1.000 21.11460 ?  85  ARG A NE  1 
ATOM   582  C CZ  . ARG A 1 105 ? -20.86300 -27.86700 -10.35200 1.000 23.72821 ?  85  ARG A CZ  1 
ATOM   583  N NH1 . ARG A 1 105 ? -19.83400 -28.40900 -10.98700 1.000 23.94582 ?  85  ARG A NH1 1 
ATOM   584  N NH2 . ARG A 1 105 ? -22.09600 -28.24700 -10.67100 1.000 22.84225 ?  85  ARG A NH2 1 
ATOM   585  N N   . LEU A 1 106 ? -16.69000 -27.15500 -4.89400  1.000 16.27647 ?  86  LEU A N   1 
ATOM   586  C CA  . LEU A 1 106 ? -15.23600 -27.06400 -4.84600  1.000 16.85517 ?  86  LEU A CA  1 
ATOM   587  C C   . LEU A 1 106 ? -14.64100 -28.28400 -4.15300  1.000 20.26392 ?  86  LEU A C   1 
ATOM   588  O O   . LEU A 1 106 ? -13.65300 -28.85600 -4.62900  1.000 20.75471 ?  86  LEU A O   1 
ATOM   589  C CB  . LEU A 1 106 ? -14.82500 -25.78600 -4.11700  1.000 17.93696 ?  86  LEU A CB  1 
ATOM   590  C CG  . LEU A 1 106 ? -14.72500 -24.57800 -5.04000  1.000 18.94471 ?  86  LEU A CG  1 
ATOM   591  C CD1 . LEU A 1 106 ? -14.73700 -23.29100 -4.20800  1.000 20.58687 ?  86  LEU A CD1 1 
ATOM   592  C CD2 . LEU A 1 106 ? -13.48400 -24.65100 -5.93700  1.000 18.86641 ?  86  LEU A CD2 1 
ATOM   593  N N   . ALA A 1 107 ? -15.24000 -28.70700 -3.03600  1.000 19.35774 ?  87  ALA A N   1 
ATOM   594  C CA  . ALA A 1 107 ? -14.73900 -29.87700 -2.32000  1.000 19.49458 ?  87  ALA A CA  1 
ATOM   595  C C   . ALA A 1 107 ? -14.78800 -31.12400 -3.18900  1.000 21.96364 ?  87  ALA A C   1 
ATOM   596  O O   . ALA A 1 107 ? -13.87700 -31.96000 -3.14100  1.000 26.07392 ?  87  ALA A O   1 
ATOM   597  C CB  . ALA A 1 107 ? -15.54200 -30.09900 -1.03900  1.000 19.50918 ?  87  ALA A CB  1 
ATOM   598  N N   . GLU A 1 108 ? -15.84800 -31.27700 -3.98000  1.000 20.06457 ?  88  GLU A N   1 
ATOM   599  C CA  . GLU A 1 108 ? -16.05900 -32.51600 -4.72000  1.000 21.09392 ?  88  GLU A CA  1 
ATOM   600  C C   . GLU A 1 108 ? -15.39900 -32.51000 -6.09100  1.000 25.85109 ?  88  GLU A C   1 
ATOM   601  O O   . GLU A 1 108 ? -14.88100 -33.54500 -6.52900  1.000 26.11464 ?  88  GLU A O   1 
ATOM   602  C CB  . GLU A 1 108 ? -17.55600 -32.79600 -4.85700  1.000 23.37028 ?  88  GLU A CB  1 
ATOM   603  C CG  . GLU A 1 108 ? -18.23300 -33.12900 -3.54300  1.000 27.49646 ?  88  GLU A CG  1 
ATOM   604  C CD  . GLU A 1 108 ? -19.72800 -33.33100 -3.68100  1.000 26.40485 ?  88  GLU A CD  1 
ATOM   605  O OE1 . GLU A 1 108 ? -20.26400 -33.09600 -4.78700  1.000 37.30507 ?  88  GLU A OE1 1 
ATOM   606  O OE2 . GLU A 1 108 ? -20.36900 -33.71600 -2.67900  1.000 33.92486 -1 88  GLU A OE2 1 
ATOM   607  N N   . GLN A 1 109 ? -15.40800 -31.37300 -6.78300  1.000 20.84848 ?  89  GLN A N   1 
ATOM   608  C CA  . GLN A 1 109 ? -14.86100 -31.30500 -8.13300  1.000 21.49643 ?  89  GLN A CA  1 
ATOM   609  C C   . GLN A 1 109 ? -13.48300 -30.66300 -8.18100  1.000 20.70638 ?  89  GLN A C   1 
ATOM   610  O O   . GLN A 1 109 ? -12.76400 -30.84200 -9.17200  1.000 25.26347 ?  89  GLN A O   1 
ATOM   611  C CB  . GLN A 1 109 ? -15.80100 -30.51300 -9.05500  1.000 24.15361 ?  89  GLN A CB  1 
ATOM   612  C CG  . GLN A 1 109 ? -17.19700 -31.09100 -9.15800  1.000 27.30566 ?  89  GLN A CG  1 
ATOM   613  C CD  . GLN A 1 109 ? -17.34000 -32.07000 -10.31100 1.000 37.90758 ?  89  GLN A CD  1 
ATOM   614  O OE1 . GLN A 1 109 ? -16.34400 -32.48200 -10.90800 1.000 40.67513 ?  89  GLN A OE1 1 
ATOM   615  N N   . GLY A 1 110 ? -13.10500 -29.90500 -7.14900  1.000 19.95748 ?  90  GLY A N   1 
ATOM   616  C CA  . GLY A 1 110 ? -11.80700 -29.26700 -7.09900  1.000 20.71085 ?  90  GLY A CA  1 
ATOM   617  C C   . GLY A 1 110 ? -11.73500 -27.90600 -7.75800  1.000 19.51715 ?  90  GLY A C   1 
ATOM   618  O O   . GLY A 1 110 ? -10.70800 -27.23100 -7.64400  1.000 20.49230 ?  90  GLY A O   1 
ATOM   619  N N   . GLN A 1 111 ? -12.78700 -27.49700 -8.45100  1.000 18.20873 ?  91  GLN A N   1 
ATOM   620  C CA  . GLN A 1 111 ? -12.77100 -26.25300 -9.20100  1.000 19.92296 ?  91  GLN A CA  1 
ATOM   621  C C   . GLN A 1 111 ? -14.20500 -25.82400 -9.45100  1.000 19.30147 ?  91  GLN A C   1 
ATOM   622  O O   . GLN A 1 111 ? -15.13500 -26.63300 -9.39200  1.000 20.38784 ?  91  GLN A O   1 
ATOM   623  C CB  . GLN A 1 111 ? -12.03100 -26.44400 -10.53000 1.000 24.73888 ?  91  GLN A CB  1 
ATOM   624  C CG  . GLN A 1 111 ? -12.90200 -27.05300 -11.61100 1.000 29.63492 ?  91  GLN A CG  1 
ATOM   625  C CD  . GLN A 1 111 ? -12.23000 -27.05700 -12.97100 1.000 43.04192 ?  91  GLN A CD  1 
ATOM   626  O OE1 . GLN A 1 111 ? -11.23600 -26.36100 -13.18900 1.000 47.27843 ?  91  GLN A OE1 1 
ATOM   627  N NE2 . GLN A 1 111 ? -12.76500 -27.85200 -13.89200 1.000 48.00168 ?  91  GLN A NE2 1 
ATOM   628  N N   . LEU A 1 112 ? -14.37400 -24.53200 -9.72700  1.000 17.10027 ?  92  LEU A N   1 
ATOM   629  C CA  . LEU A 1 112 ? -15.64500 -24.06400 -10.25000 1.000 19.59911 ?  92  LEU A CA  1 
ATOM   630  C C   . LEU A 1 112 ? -15.36800 -22.80000 -11.04400 1.000 17.32046 ?  92  LEU A C   1 
ATOM   631  O O   . LEU A 1 112 ? -14.28200 -22.22600 -10.96400 1.000 23.98989 ?  92  LEU A O   1 
ATOM   632  C CB  . LEU A 1 112 ? -16.69100 -23.84100 -9.15200  1.000 25.96913 ?  92  LEU A CB  1 
ATOM   633  C CG  . LEU A 1 112 ? -16.39500 -22.89600 -7.99700  1.000 20.87524 ?  92  LEU A CG  1 
ATOM   634  C CD1 . LEU A 1 112 ? -16.20600 -21.43600 -8.47700  1.000 20.22719 ?  92  LEU A CD1 1 
ATOM   635  C CD2 . LEU A 1 112 ? -17.47600 -22.98700 -6.91700  1.000 24.99803 ?  92  LEU A CD2 1 
ATOM   636  N N   . GLN A 1 113 ? -16.34800 -22.39000 -11.83600 1.000 16.18870 ?  93  GLN A N   1 
ATOM   637  C CA  . GLN A 1 113 ? -16.24000 -21.15700 -12.59800 1.000 15.99842 ?  93  GLN A CA  1 
ATOM   638  C C   . GLN A 1 113 ? -17.34100 -20.19100 -12.18400 1.000 17.68023 ?  93  GLN A C   1 
ATOM   639  O O   . GLN A 1 113 ? -18.41200 -20.60100 -11.72500 1.000 18.05730 ?  93  GLN A O   1 
ATOM   640  C CB  . GLN A 1 113 ? -16.30300 -21.46200 -14.10300 1.000 17.02851 ?  93  GLN A CB  1 
ATOM   641  C CG  . GLN A 1 113 ? -15.05800 -22.19400 -14.58600 1.000 17.04162 ?  93  GLN A CG  1 
ATOM   642  C CD  . GLN A 1 113 ? -14.98100 -22.31500 -16.09300 1.000 18.78843 ?  93  GLN A CD  1 
ATOM   643  O OE1 . GLN A 1 113 ? -15.59400 -21.54300 -16.82100 1.000 20.65175 ?  93  GLN A OE1 1 
ATOM   644  N NE2 . GLN A 1 113 ? -14.21700 -23.29300 -16.56600 1.000 27.16195 ?  93  GLN A NE2 1 
ATOM   645  N N   . TYR A 1 114 ? -17.06700 -18.89500 -12.33500 1.000 15.20649 ?  94  TYR A N   1 
ATOM   646  C CA  . TYR A 1 114 ? -17.99300 -17.86300 -11.88500 1.000 15.36496 ?  94  TYR A CA  1 
ATOM   647  C C   . TYR A 1 114 ? -17.73600 -16.60300 -12.69900 1.000 14.91847 ?  94  TYR A C   1 
ATOM   648  O O   . TYR A 1 114 ? -16.72500 -16.49300 -13.39600 1.000 17.54463 ?  94  TYR A O   1 
ATOM   649  C CB  . TYR A 1 114 ? -17.85300 -17.59900 -10.37300 1.000 14.85543 ?  94  TYR A CB  1 
ATOM   650  C CG  . TYR A 1 114 ? -16.48600 -17.11500 -9.92600  1.000 14.11587 ?  94  TYR A CG  1 
ATOM   651  C CD1 . TYR A 1 114 ? -15.43500 -18.00800 -9.73600  1.000 16.84405 ?  94  TYR A CD1 1 
ATOM   652  C CD2 . TYR A 1 114 ? -16.25000 -15.75900 -9.68900  1.000 14.58589 ?  94  TYR A CD2 1 
ATOM   653  C CE1 . TYR A 1 114 ? -14.19800 -17.57600 -9.32600  1.000 15.87712 ?  94  TYR A CE1 1 
ATOM   654  C CE2 . TYR A 1 114 ? -15.01000 -15.31500 -9.25800  1.000 16.29247 ?  94  TYR A CE2 1 
ATOM   655  C CZ  . TYR A 1 114 ? -13.98700 -16.22600 -9.08500  1.000 15.97710 ?  94  TYR A CZ  1 
ATOM   656  O OH  . TYR A 1 114 ? -12.74300 -15.79800 -8.66200  1.000 18.07858 ?  94  TYR A OH  1 
ATOM   657  N N   . GLN A 1 115 ? -18.67400 -15.66500 -12.62500 1.000 16.32024 ?  95  GLN A N   1 
ATOM   658  C CA  . GLN A 1 115 ? -18.52400 -14.37800 -13.29400 1.000 15.16507 ?  95  GLN A CA  1 
ATOM   659  C C   . GLN A 1 115 ? -18.24900 -13.28000 -12.27700 1.000 17.89441 ?  95  GLN A C   1 
ATOM   660  O O   . GLN A 1 115 ? -18.74000 -13.32500 -11.14500 1.000 18.48805 ?  95  GLN A O   1 
ATOM   661  C CB  . GLN A 1 115 ? -19.79600 -13.98700 -14.05100 1.000 16.35116 ?  95  GLN A CB  1 
ATOM   662  C CG  . GLN A 1 115 ? -20.29600 -15.05300 -15.00200 1.000 17.18034 ?  95  GLN A CG  1 
ATOM   663  C CD  . GLN A 1 115 ? -19.60200 -15.04600 -16.33800 1.000 17.47666 ?  95  GLN A CD  1 
ATOM   664  O OE1 . GLN A 1 115 ? -18.73300 -14.22300 -16.60400 1.000 17.49336 ?  95  GLN A OE1 1 
ATOM   665  N NE2 . GLN A 1 115 ? -19.94900 -16.01900 -17.17600 1.000 19.70802 ?  95  GLN A NE2 1 
ATOM   666  N N   . VAL A 1 116 ? -17.47700 -12.27600 -12.70400 1.000 15.18740 ?  96  VAL A N   1 
ATOM   667  C CA  . VAL A 1 116 ? -17.30500 -11.04600 -11.94100 1.000 13.66747 ?  96  VAL A CA  1 
ATOM   668  C C   . VAL A 1 116 ? -17.66200 -9.86600  -12.83800 1.000 17.04622 ?  96  VAL A C   1 
ATOM   669  O O   . VAL A 1 116 ? -17.56300 -9.93000  -14.06900 1.000 17.02246 ?  96  VAL A O   1 
ATOM   670  C CB  . VAL A 1 116 ? -15.88300 -10.86800 -11.36600 1.000 15.59050 ?  96  VAL A CB  1 
ATOM   671  C CG1 . VAL A 1 116 ? -15.55300 -11.99600 -10.34300 1.000 16.06154 ?  96  VAL A CG1 1 
ATOM   672  C CG2 . VAL A 1 116 ? -14.83300 -10.73500 -12.45900 1.000 19.06312 ?  96  VAL A CG2 1 
ATOM   673  N N   . THR A 1 117 ? -18.06100 -8.76400  -12.20100 1.000 17.15294 ?  97  THR A N   1 
ATOM   674  C CA  . THR A 1 117 ? -18.41400 -7.56200  -12.94500 1.000 15.99175 ?  97  THR A CA  1 
ATOM   675  C C   . THR A 1 117 ? -17.16800 -6.76200  -13.30500 1.000 17.10447 ?  97  THR A C   1 
ATOM   676  O O   . THR A 1 117 ? -16.32800 -6.47700  -12.44200 1.000 18.04353 ?  97  THR A O   1 
ATOM   677  C CB  . THR A 1 117 ? -19.37900 -6.70000  -12.13300 1.000 17.36623 ?  97  THR A CB  1 
ATOM   678  O OG1 . THR A 1 117 ? -20.63000 -7.39200  -11.97800 1.000 20.42209 ?  97  THR A OG1 1 
ATOM   679  C CG2 . THR A 1 117 ? -19.60200 -5.35600  -12.81800 1.000 17.46621 ?  97  THR A CG2 1 
ATOM   680  N N   . LEU A 1 118 ? -17.04700 -6.39900  -14.58300 1.000 16.13094 ?  98  LEU A N   1 
ATOM   681  C CA  . LEU A 1 118 ? -16.00600 -5.45500  -14.99300 1.000 16.87930 ?  98  LEU A CA  1 
ATOM   682  C C   . LEU A 1 118 ? -16.52800 -4.01900  -14.90000 1.000 15.87416 ?  98  LEU A C   1 
ATOM   683  O O   . LEU A 1 118 ? -16.01600 -3.19700  -14.13000 1.000 17.56313 ?  98  LEU A O   1 
ATOM   684  C CB  . LEU A 1 118 ? -15.53000 -5.77500  -16.42000 1.000 15.79672 ?  98  LEU A CB  1 
ATOM   685  C CG  . LEU A 1 118 ? -14.91500 -7.15900  -16.67700 1.000 15.86163 ?  98  LEU A CG  1 
ATOM   686  C CD1 . LEU A 1 118 ? -14.53500 -7.31600  -18.16000 1.000 19.34930 ?  98  LEU A CD1 1 
ATOM   687  C CD2 . LEU A 1 118 ? -13.71600 -7.45200  -15.79000 1.000 17.26258 ?  98  LEU A CD2 1 
ATOM   688  N N   . GLU A 1 119 ? -17.58500 -3.73100  -15.65500 1.000 17.34052 ?  99  GLU A N   1 
ATOM   689  C CA  . GLU A 1 119 ? -18.17100 -2.40000  -15.79000 1.000 17.03527 ?  99  GLU A CA  1 
ATOM   690  C C   . GLU A 1 119 ? -19.59200 -2.58200  -16.28600 1.000 15.29278 ?  99  GLU A C   1 
ATOM   691  O O   . GLU A 1 119 ? -19.79000 -3.08600  -17.39800 1.000 17.93563 ?  99  GLU A O   1 
ATOM   692  C CB  . GLU A 1 119 ? -17.37300 -1.59500  -16.80100 1.000 19.40158 ?  99  GLU A CB  1 
ATOM   693  C CG  . GLU A 1 119 ? -17.74600 -0.12000  -16.87600 1.000 18.71347 ?  99  GLU A CG  1 
ATOM   694  C CD  . GLU A 1 119 ? -17.04600 0.57900   -18.01600 1.000 23.08721 ?  99  GLU A CD  1 
ATOM   695  O OE1 . GLU A 1 119 ? -15.80700 0.72400   -17.94800 1.000 21.55907 ?  99  GLU A OE1 1 
ATOM   696  O OE2 . GLU A 1 119 ? -17.72700 0.92800   -19.00600 1.000 25.99432 -1 99  GLU A OE2 1 
ATOM   697  N N   . GLY A 1 120 ? -20.56700 -2.18900  -15.47400 1.000 18.52653 ?  100 GLY A N   1 
ATOM   698  C CA  . GLY A 1 120 ? -21.95500 -2.29700  -15.89400 1.000 19.96333 ?  100 GLY A CA  1 
ATOM   699  C C   . GLY A 1 120 ? -22.32200 -3.74600  -16.16200 1.000 20.58482 ?  100 GLY A C   1 
ATOM   700  O O   . GLY A 1 120 ? -22.15900 -4.61900  -15.30200 1.000 21.42528 ?  100 GLY A O   1 
ATOM   701  N N   . GLU A 1 121 ? -22.80600 -4.01400  -17.37500 1.000 19.23886 ?  101 GLU A N   1 
ATOM   702  C CA  . GLU A 1 121 ? -23.18500 -5.35400  -17.80200 1.000 20.36108 ?  101 GLU A CA  1 
ATOM   703  C C   . GLU A 1 121 ? -22.01000 -6.13200  -18.38400 1.000 20.67584 ?  101 GLU A C   1 
ATOM   704  O O   . GLU A 1 121 ? -22.17500 -7.29900  -18.76000 1.000 21.43133 ?  101 GLU A O   1 
ATOM   705  C CB  . GLU A 1 121 ? -24.31600 -5.26000  -18.83900 1.000 20.81577 ?  101 GLU A CB  1 
ATOM   706  C CG  . GLU A 1 121 ? -25.64200 -4.79200  -18.24300 1.000 21.59883 ?  101 GLU A CG  1 
ATOM   707  C CD  . GLU A 1 121 ? -26.74800 -4.63100  -19.27400 1.000 25.52089 ?  101 GLU A CD  1 
ATOM   708  O OE1 . GLU A 1 121 ? -26.47600 -4.78300  -20.48300 1.000 26.69424 ?  101 GLU A OE1 1 
ATOM   709  O OE2 . GLU A 1 121 ? -27.89500 -4.34300  -18.86100 1.000 31.61015 -1 101 GLU A OE2 1 
ATOM   710  N N   . LEU A 1 122 ? -20.83300 -5.51800  -18.49400 1.000 18.78868 ?  102 LEU A N   1 
ATOM   711  C CA  . LEU A 1 122 ? -19.66200 -6.22400  -18.99700 1.000 17.62776 ?  102 LEU A CA  1 
ATOM   712  C C   . LEU A 1 122 ? -19.06500 -7.05600  -17.86500 1.000 17.67988 ?  102 LEU A C   1 
ATOM   713  O O   . LEU A 1 122 ? -18.74000 -6.51900  -16.79300 1.000 17.86999 ?  102 LEU A O   1 
ATOM   714  C CB  . LEU A 1 122 ? -18.63800 -5.23200  -19.55300 1.000 17.47255 ?  102 LEU A CB  1 
ATOM   715  C CG  . LEU A 1 122 ? -19.10900 -4.32400  -20.69500 1.000 16.83159 ?  102 LEU A CG  1 
ATOM   716  C CD1 . LEU A 1 122 ? -18.04000 -3.29100  -21.02700 1.000 22.17981 ?  102 LEU A CD1 1 
ATOM   717  C CD2 . LEU A 1 122 ? -19.47200 -5.14900  -21.92100 1.000 20.97518 ?  102 LEU A CD2 1 
ATOM   718  N N   . ILE A 1 123 ? -18.94200 -8.36700  -18.09900 1.000 16.37299 ?  103 ILE A N   1 
ATOM   719  C CA  . ILE A 1 123 ? -18.53400 -9.33000  -17.08100 1.000 16.87265 ?  103 ILE A CA  1 
ATOM   720  C C   . ILE A 1 123 ? -17.40700 -10.19700 -17.62600 1.000 17.87756 ?  103 ILE A C   1 
ATOM   721  O O   . ILE A 1 123 ? -17.13100 -10.21900 -18.82700 1.000 18.39643 ?  103 ILE A O   1 
ATOM   722  C CB  . ILE A 1 123 ? -19.70900 -10.19000 -16.57300 1.000 15.97807 ?  103 ILE A CB  1 
ATOM   723  C CG1 . ILE A 1 123 ? -20.31600 -11.02600 -17.71300 1.000 17.42589 ?  103 ILE A CG1 1 
ATOM   724  C CG2 . ILE A 1 123 ? -20.76800 -9.29100  -15.93000 1.000 18.75045 ?  103 ILE A CG2 1 
ATOM   725  C CD1 . ILE A 1 123 ? -21.46500 -11.92100 -17.25500 1.000 19.38878 ?  103 ILE A CD1 1 
ATOM   726  N N   . GLU A 1 124 ? -16.75700 -10.93200 -16.71900 1.000 16.07783 ?  104 GLU A N   1 
ATOM   727  C CA  . GLU A 1 124 ? -15.62800 -11.78100 -17.07900 1.000 16.51846 ?  104 GLU A CA  1 
ATOM   728  C C   . GLU A 1 124 ? -15.68400 -13.07600 -16.28100 1.000 16.30182 ?  104 GLU A C   1 
ATOM   729  O O   . GLU A 1 124 ? -15.90400 -13.05600 -15.06600 1.000 16.10183 ?  104 GLU A O   1 
ATOM   730  C CB  . GLU A 1 124 ? -14.30500 -11.06000 -16.80500 1.000 18.91166 ?  104 GLU A CB  1 
ATOM   731  C CG  . GLU A 1 124 ? -13.04400 -11.85500 -17.11200 1.000 20.26811 ?  104 GLU A CG  1 
ATOM   732  C CD  . GLU A 1 124 ? -11.79800 -11.01600 -16.85900 1.000 24.70636 ?  104 GLU A CD  1 
ATOM   733  O OE1 . GLU A 1 124 ? -11.52300 -10.10400 -17.67200 1.000 27.24169 ?  104 GLU A OE1 1 
ATOM   734  O OE2 . GLU A 1 124 ? -11.11800 -11.23700 -15.83800 1.000 23.08859 -1 104 GLU A OE2 1 
ATOM   735  N N   . ARG A 1 125 ? -15.49000 -14.20200 -16.96100 1.000 15.54875 ?  105 ARG A N   1 
ATOM   736  C CA  . ARG A 1 125 ? -15.57600 -15.50000 -16.30400 1.000 15.11711 ?  105 ARG A CA  1 
ATOM   737  C C   . ARG A 1 125 ? -14.21800 -15.86800 -15.71500 1.000 18.88180 ?  105 ARG A C   1 
ATOM   738  O O   . ARG A 1 125 ? -13.17500 -15.61600 -16.32700 1.000 20.29339 ?  105 ARG A O   1 
ATOM   739  C CB  . ARG A 1 125 ? -16.04800 -16.55600 -17.30800 1.000 15.22857 ?  105 ARG A CB  1 
ATOM   740  C CG  . ARG A 1 125 ? -16.47700 -17.87700 -16.67000 1.000 15.80042 ?  105 ARG A CG  1 
ATOM   741  C CD  . ARG A 1 125 ? -17.19200 -18.79400 -17.68100 1.000 17.90586 ?  105 ARG A CD  1 
ATOM   742  N NE  . ARG A 1 125 ? -16.22300 -19.51900 -18.49400 1.000 16.58733 ?  105 ARG A NE  1 
ATOM   743  C CZ  . ARG A 1 125 ? -15.86900 -19.17000 -19.72700 1.000 16.53146 ?  105 ARG A CZ  1 
ATOM   744  N NH1 . ARG A 1 125 ? -16.47200 -18.18200 -20.37300 1.000 18.58754 ?  105 ARG A NH1 1 
ATOM   745  N NH2 . ARG A 1 125 ? -14.88700 -19.83000 -20.32700 1.000 20.83083 ?  105 ARG A NH2 1 
ATOM   746  N N   . ARG A 1 126 ? -14.24400 -16.45900 -14.51500 1.000 16.88435 ?  106 ARG A N   1 
ATOM   747  C CA  . ARG A 1 126 ? -13.05400 -16.78400 -13.73500 1.000 17.40903 ?  106 ARG A CA  1 
ATOM   748  C C   . ARG A 1 126 ? -13.17300 -18.20400 -13.18400 1.000 16.07590 ?  106 ARG A C   1 
ATOM   749  O O   . ARG A 1 126 ? -14.25700 -18.79200 -13.15800 1.000 17.72385 ?  106 ARG A O   1 
ATOM   750  C CB  . ARG A 1 126 ? -12.92600 -15.81800 -12.54400 1.000 17.67404 ?  106 ARG A CB  1 
ATOM   751  C CG  . ARG A 1 126 ? -12.92200 -14.32700 -12.94600 1.000 25.48077 ?  106 ARG A CG  1 
ATOM   752  C CD  . ARG A 1 126 ? -11.53100 -13.72500 -12.91300 1.000 32.85520 ?  106 ARG A CD  1 
ATOM   753  N NE  . ARG A 1 126 ? -11.50900 -12.32900 -13.34600 1.000 20.51587 ?  106 ARG A NE  1 
ATOM   754  C CZ  . ARG A 1 126 ? -11.19800 -11.30100 -12.56500 1.000 26.18554 ?  106 ARG A CZ  1 
ATOM   755  N NH1 . ARG A 1 126 ? -11.05000 -11.44200 -11.25800 1.000 23.02118 ?  106 ARG A NH1 1 
ATOM   756  N NH2 . ARG A 1 126 ? -11.04500 -10.09400 -13.11000 1.000 22.11274 ?  106 ARG A NH2 1 
ATOM   757  N N   . THR A 1 127 ? -12.04600 -18.74600 -12.71700 1.000 18.11271 ?  107 THR A N   1 
ATOM   758  C CA  . THR A 1 127 ? -12.00300 -20.07800 -12.12000 1.000 18.04859 ?  107 THR A CA  1 
ATOM   759  C C   . THR A 1 127 ? -11.43300 -20.01800 -10.71000 1.000 16.71809 ?  107 THR A C   1 
ATOM   760  O O   . THR A 1 127 ? -10.42900 -19.34400 -10.46100 1.000 21.23238 ?  107 THR A O   1 
ATOM   761  C CB  . THR A 1 127 ? -11.14400 -21.03600 -12.95300 1.000 19.55918 ?  107 THR A CB  1 
ATOM   762  O OG1 . THR A 1 127 ? -11.66600 -21.12700 -14.28400 1.000 21.61738 ?  107 THR A OG1 1 
ATOM   763  C CG2 . THR A 1 127 ? -11.13100 -22.43000 -12.32900 1.000 20.61511 ?  107 THR A CG2 1 
ATOM   764  N N   . ALA A 1 128 ? -12.07500 -20.73700 -9.79000  1.000 18.31156 ?  108 ALA A N   1 
ATOM   765  C CA  . ALA A 1 128 ? -11.50300 -21.03600 -8.48400  1.000 16.70207 ?  108 ALA A CA  1 
ATOM   766  C C   . ALA A 1 128 ? -11.00800 -22.47700 -8.51300  1.000 18.01753 ?  108 ALA A C   1 
ATOM   767  O O   . ALA A 1 128 ? -11.73600 -23.37100 -8.95100  1.000 19.99901 ?  108 ALA A O   1 
ATOM   768  C CB  . ALA A 1 128 ? -12.55400 -20.87500 -7.38700  1.000 18.65925 ?  108 ALA A CB  1 
ATOM   769  N N   . ASP A 1 129 ? -9.78000  -22.69800 -8.04300  1.000 20.22268 ?  109 ASP A N   1 
ATOM   770  C CA  . ASP A 1 129 ? -9.10300  -23.98400 -8.20900  1.000 20.61278 ?  109 ASP A CA  1 
ATOM   771  C C   . ASP A 1 129 ? -8.39500  -24.35900 -6.91300  1.000 20.40549 ?  109 ASP A C   1 
ATOM   772  O O   . ASP A 1 129 ? -7.39700  -23.72800 -6.54800  1.000 21.46149 ?  109 ASP A O   1 
ATOM   773  C CB  . ASP A 1 129 ? -8.10000  -23.89900 -9.36100  1.000 23.80970 ?  109 ASP A CB  1 
ATOM   774  C CG  . ASP A 1 129 ? -7.56300  -25.25700 -9.76800  1.000 36.02268 ?  109 ASP A CG  1 
ATOM   775  O OD1 . ASP A 1 129 ? -6.99100  -25.95200 -8.90600  1.000 30.72638 ?  109 ASP A OD1 1 
ATOM   776  O OD2 . ASP A 1 129 ? -7.70300  -25.62700 -10.95100 1.000 51.07312 -1 109 ASP A OD2 1 
ATOM   777  N N   . LEU A 1 130 ? -8.89500  -25.39900 -6.23700  1.000 19.48870 ?  110 LEU A N   1 
ATOM   778  C CA  . LEU A 1 130 ? -8.30200  -25.82300 -4.96900  1.000 20.68395 ?  110 LEU A CA  1 
ATOM   779  C C   . LEU A 1 130 ? -6.88900  -26.36600 -5.15800  1.000 21.71416 ?  110 LEU A C   1 
ATOM   780  O O   . LEU A 1 130 ? -6.01700  -26.14000 -4.31000  1.000 20.95759 ?  110 LEU A O   1 
ATOM   781  C CB  . LEU A 1 130 ? -9.18500  -26.87300 -4.30200  1.000 22.55769 ?  110 LEU A CB  1 
ATOM   782  C CG  . LEU A 1 130 ? -10.54900 -26.46100 -3.75200  1.000 19.34069 ?  110 LEU A CG  1 
ATOM   783  C CD1 . LEU A 1 130 ? -11.02800 -27.53100 -2.78100  1.000 25.65448 ?  110 LEU A CD1 1 
ATOM   784  C CD2 . LEU A 1 130 ? -10.49400 -25.09500 -3.06100  1.000 20.49668 ?  110 LEU A CD2 1 
ATOM   785  N N   . ALA A 1 131 ? -6.64000  -27.08400 -6.25800  1.000 24.27055 ?  111 ALA A N   1 
ATOM   786  C CA  . ALA A 1 131 ? -5.31200  -27.65400 -6.47600  1.000 25.82170 ?  111 ALA A CA  1 
ATOM   787  C C   . ALA A 1 131 ? -4.24900  -26.56700 -6.58900  1.000 23.70718 ?  111 ALA A C   1 
ATOM   788  O O   . ALA A 1 131 ? -3.15200  -26.70100 -6.03000  1.000 28.72920 ?  111 ALA A O   1 
ATOM   789  C CB  . ALA A 1 131 ? -5.31800  -28.54400 -7.71800  1.000 26.96143 ?  111 ALA A CB  1 
ATOM   790  N N   . ALA A 1 132 ? -4.55600  -25.47900 -7.30100  1.000 24.20422 ?  112 ALA A N   1 
ATOM   791  C CA  . ALA A 1 132 ? -3.61000  -24.37600 -7.43100  1.000 26.34898 ?  112 ALA A CA  1 
ATOM   792  C C   . ALA A 1 132 ? -3.28100  -23.73500 -6.09000  1.000 28.28569 ?  112 ALA A C   1 
ATOM   793  O O   . ALA A 1 132 ? -2.24100  -23.07900 -5.96500  1.000 30.34943 ?  112 ALA A O   1 
ATOM   794  C CB  . ALA A 1 132 ? -4.17100  -23.31300 -8.37800  1.000 26.51864 ?  112 ALA A CB  1 
ATOM   795  N N   . LEU A 1 133 ? -4.14600  -23.89400 -5.09500  1.000 21.95680 ?  113 LEU A N   1 
ATOM   796  C CA  . LEU A 1 133 ? -3.95100  -23.30900 -3.77700  1.000 24.10254 ?  113 LEU A CA  1 
ATOM   797  C C   . LEU A 1 133 ? -3.46800  -24.33300 -2.75900  1.000 24.72530 ?  113 LEU A C   1 
ATOM   798  O O   . LEU A 1 133 ? -3.37700  -24.01300 -1.57000  1.000 24.26135 ?  113 LEU A O   1 
ATOM   799  C CB  . LEU A 1 133 ? -5.26900  -22.68500 -3.30300  1.000 22.92846 ?  113 LEU A CB  1 
ATOM   800  C CG  . LEU A 1 133 ? -5.77200  -21.53100 -4.17300  1.000 22.31092 ?  113 LEU A CG  1 
ATOM   801  C CD1 . LEU A 1 133 ? -7.21700  -21.17600 -3.83300  1.000 21.90854 ?  113 LEU A CD1 1 
ATOM   802  C CD2 . LEU A 1 133 ? -4.87900  -20.30400 -4.02400  1.000 23.41575 ?  113 LEU A CD2 1 
ATOM   803  N N   . GLU A 1 134 ? -3.17100  -25.55800 -3.19900  1.000 24.84670 ?  114 GLU A N   1 
ATOM   804  C CA  . GLU A 1 134 ? -2.70000  -26.63000 -2.32600  1.000 29.45753 ?  114 GLU A CA  1 
ATOM   805  C C   . GLU A 1 134 ? -3.75400  -27.05300 -1.30800  1.000 26.18356 ?  114 GLU A C   1 
ATOM   806  O O   . GLU A 1 134 ? -3.42700  -27.45600 -0.18600  1.000 27.24171 ?  114 GLU A O   1 
ATOM   807  C CB  . GLU A 1 134 ? -1.37300  -26.27300 -1.65100  1.000 36.04659 ?  114 GLU A CB  1 
ATOM   808  C CG  . GLU A 1 134 ? -0.36400  -25.69100 -2.63100  1.000 38.62064 ?  114 GLU A CG  1 
ATOM   809  C CD  . GLU A 1 134 ? 1.03200   -26.25100 -2.46000  1.000 58.47755 ?  114 GLU A CD  1 
ATOM   810  O OE1 . GLU A 1 134 ? 1.38700   -26.65000 -1.33000  1.000 60.45785 ?  114 GLU A OE1 1 
ATOM   811  O OE2 . GLU A 1 134 ? 1.77300   -26.29300 -3.46400  1.000 66.76735 -1 114 GLU A OE2 1 
ATOM   812  N N   . LEU A 1 135 ? -5.02900  -26.98100 -1.70000  1.000 22.05712 ?  115 LEU A N   1 
ATOM   813  C CA  . LEU A 1 135 ? -6.15000  -27.27900 -0.82100  1.000 20.06325 ?  115 LEU A CA  1 
ATOM   814  C C   . LEU A 1 135 ? -6.92900  -28.51900 -1.23300  1.000 20.57686 ?  115 LEU A C   1 
ATOM   815  O O   . LEU A 1 135 ? -7.82900  -28.93800 -0.49800  1.000 21.05933 ?  115 LEU A O   1 
ATOM   816  C CB  . LEU A 1 135 ? -7.11900  -26.08300 -0.81100  1.000 19.41318 ?  115 LEU A CB  1 
ATOM   817  C CG  . LEU A 1 135 ? -6.53000  -24.80000 -0.24300  1.000 22.22234 ?  115 LEU A CG  1 
ATOM   818  C CD1 . LEU A 1 135 ? -7.54700  -23.66300 -0.35800  1.000 21.47063 ?  115 LEU A CD1 1 
ATOM   819  C CD2 . LEU A 1 135 ? -6.09400  -25.01100 1.21100   1.000 22.07299 ?  115 LEU A CD2 1 
ATOM   820  N N   . SER A 1 136 ? -6.61900  -29.11800 -2.38600  1.000 21.65187 ?  116 SER A N   1 
ATOM   821  C CA  . SER A 1 136 ? -7.41500  -30.24500 -2.85400  1.000 20.80925 ?  116 SER A CA  1 
ATOM   822  C C   . SER A 1 136 ? -7.13800  -31.52300 -2.07000  1.000 21.52483 ?  116 SER A C   1 
ATOM   823  O O   . SER A 1 136 ? -8.05800  -32.31800 -1.86000  1.000 22.87387 ?  116 SER A O   1 
ATOM   824  C CB  . SER A 1 136 ? -7.18200  -30.47600 -4.35000  1.000 27.90884 ?  116 SER A CB  1 
ATOM   825  O OG  . SER A 1 136 ? -5.79700  -30.46600 -4.64800  1.000 28.50854 ?  116 SER A OG  1 
ATOM   826  N N   . ASN A 1 137 ? -5.89600  -31.73200 -1.62600  1.000 22.15949 ?  117 ASN A N   1 
ATOM   827  C CA  . ASN A 1 137 ? -5.55000  -33.02000 -1.03000  1.000 25.42114 ?  117 ASN A CA  1 
ATOM   828  C C   . ASN A 1 137 ? -6.34300  -33.29400 0.24000   1.000 26.45111 ?  117 ASN A C   1 
ATOM   829  O O   . ASN A 1 137 ? -6.60800  -34.46100 0.56000   1.000 26.53826 ?  117 ASN A O   1 
ATOM   830  C CB  . ASN A 1 137 ? -4.04300  -33.12600 -0.78200  1.000 34.43568 ?  117 ASN A CB  1 
ATOM   831  C CG  . ASN A 1 137 ? -3.26400  -33.42400 -2.05200  1.000 44.63989 ?  117 ASN A CG  1 
ATOM   832  O OD1 . ASN A 1 137 ? -3.77800  -34.06000 -2.97300  1.000 46.55278 ?  117 ASN A OD1 1 
ATOM   833  N ND2 . ASN A 1 137 ? -2.01200  -32.97900 -2.10100  1.000 45.13693 ?  117 ASN A ND2 1 
ATOM   834  N N   . THR A 1 138 ? -6.74700  -32.24600 0.96200   1.000 24.43040 ?  118 THR A N   1 
ATOM   835  C CA  . THR A 1 138 ? -7.46400  -32.39300 2.22300   1.000 23.34100 ?  118 THR A CA  1 
ATOM   836  C C   . THR A 1 138 ? -8.91900  -31.94100 2.14600   1.000 21.33639 ?  118 THR A C   1 
ATOM   837  O O   . THR A 1 138 ? -9.59500  -31.89200 3.17900   1.000 22.70491 ?  118 THR A O   1 
ATOM   838  C CB  . THR A 1 138 ? -6.74600  -31.64000 3.34900   1.000 23.21142 ?  118 THR A CB  1 
ATOM   839  O OG1 . THR A 1 138 ? -6.43100  -30.31000 2.91600   1.000 24.07288 ?  118 THR A OG1 1 
ATOM   840  C CG2 . THR A 1 138 ? -5.45300  -32.35000 3.71500   1.000 26.09500 ?  118 THR A CG2 1 
ATOM   841  N N   . ALA A 1 139 ? -9.42100  -31.61900 0.94900   1.000 20.01193 ?  119 ALA A N   1 
ATOM   842  C CA  . ALA A 1 139 ? -10.79700 -31.14600 0.82600   1.000 22.75530 ?  119 ALA A CA  1 
ATOM   843  C C   . ALA A 1 139 ? -11.80700 -32.17000 1.32800   1.000 23.19767 ?  119 ALA A C   1 
ATOM   844  O O   . ALA A 1 139 ? -12.89900 -31.79400 1.77000   1.000 22.31851 ?  119 ALA A O   1 
ATOM   845  C CB  . ALA A 1 139 ? -11.09500 -30.76900 -0.62600  1.000 23.62024 ?  119 ALA A CB  1 
ATOM   846  N N   . GLY A 1 140 ? -11.46900 -33.46000 1.28000   1.000 22.39539 ?  120 GLY A N   1 
ATOM   847  C CA  . GLY A 1 140 ? -12.38600 -34.48200 1.75800   1.000 25.00662 ?  120 GLY A CA  1 
ATOM   848  C C   . GLY A 1 140 ? -12.63400 -34.45100 3.25100   1.000 22.03159 ?  120 GLY A C   1 
ATOM   849  O O   . GLY A 1 140 ? -13.54100 -35.14300 3.72800   1.000 24.50438 ?  120 GLY A O   1 
ATOM   850  N N   . ARG A 1 141 ? -11.85400 -33.66900 3.99300   1.000 18.41876 ?  121 ARG A N   1 
ATOM   851  C CA  . ARG A 1 141 ? -12.05100 -33.55100 5.43000   1.000 19.65763 ?  121 ARG A CA  1 
ATOM   852  C C   . ARG A 1 141 ? -13.10500 -32.51100 5.78500   1.000 19.45730 ?  121 ARG A C   1 
ATOM   853  O O   . ARG A 1 141 ? -13.44100 -32.38000 6.96700   1.000 19.97229 ?  121 ARG A O   1 
ATOM   854  C CB  . ARG A 1 141 ? -10.74200 -33.17100 6.11900   1.000 20.57942 ?  121 ARG A CB  1 
ATOM   855  C CG  . ARG A 1 141 ? -9.61200  -34.16500 5.95900   1.000 24.99994 ?  121 ARG A CG  1 
ATOM   856  C CD  . ARG A 1 141 ? -8.33400  -33.52700 6.46400   1.000 26.29004 ?  121 ARG A CD  1 
ATOM   857  N NE  . ARG A 1 141 ? -7.20800  -34.44800 6.49600   1.000 30.73423 ?  121 ARG A NE  1 
ATOM   858  C CZ  . ARG A 1 141 ? -6.05000  -34.18300 7.08700   1.000 36.64482 ?  121 ARG A CZ  1 
ATOM   859  N NH1 . ARG A 1 141 ? -5.86300  -33.06800 7.77500   1.000 29.05176 ?  121 ARG A NH1 1 
ATOM   860  N NH2 . ARG A 1 141 ? -5.05500  -35.06000 6.98800   1.000 46.06485 ?  121 ARG A NH2 1 
ATOM   861  N N   . THR A 1 142 ? -13.62100 -31.77200 4.80500   1.000 19.13182 ?  122 THR A N   1 
ATOM   862  C CA  . THR A 1 142 ? -14.65200 -30.77300 5.04600   1.000 18.61740 ?  122 THR A CA  1 
ATOM   863  C C   . THR A 1 142 ? -16.05000 -31.34500 4.86100   1.000 17.74553 ?  122 THR A C   1 
ATOM   864  O O   . THR A 1 142 ? -16.26600 -32.29900 4.10600   1.000 22.17946 ?  122 THR A O   1 
ATOM   865  C CB  . THR A 1 142 ? -14.49400 -29.57500 4.10700   1.000 19.61288 ?  122 THR A CB  1 
ATOM   866  O OG1 . THR A 1 142 ? -14.80900 -29.97300 2.75700   1.000 20.37877 ?  122 THR A OG1 1 
ATOM   867  C CG2 . THR A 1 142 ? -13.09500 -28.97600 4.19000   1.000 20.46122 ?  122 THR A CG2 1 
ATOM   868  N N   . ARG A 1 143 ? -17.01100 -30.72000 5.54000   1.000 18.22995 ?  123 ARG A N   1 
ATOM   869  C CA  . ARG A 1 143 ? -18.42500 -30.94200 5.29000   1.000 19.10718 ?  123 ARG A CA  1 
ATOM   870  C C   . ARG A 1 143 ? -19.11400 -29.59900 5.46100   1.000 19.78414 ?  123 ARG A C   1 
ATOM   871  O O   . ARG A 1 143 ? -18.95100 -28.94500 6.49800   1.000 21.17595 ?  123 ARG A O   1 
ATOM   872  C CB  . ARG A 1 143 ? -19.02200 -31.96700 6.26100   1.000 23.98333 ?  123 ARG A CB  1 
ATOM   873  C CG  . ARG A 1 143 ? -20.50900 -32.21600 6.02900   1.000 31.74751 ?  123 ARG A CG  1 
ATOM   874  C CD  . ARG A 1 143 ? -21.09500 -33.14900 7.08300   1.000 35.39116 ?  123 ARG A CD  1 
ATOM   875  N NE  . ARG A 1 143 ? -21.65300 -32.42700 8.22000   1.000 36.74461 ?  123 ARG A NE  1 
ATOM   876  C CZ  . ARG A 1 143 ? -21.51900 -32.80800 9.48400   1.000 43.14992 ?  123 ARG A CZ  1 
ATOM   877  N NH1 . ARG A 1 143 ? -20.82500 -33.88500 9.81200   1.000 46.78267 ?  123 ARG A NH1 1 
ATOM   878  N NH2 . ARG A 1 143 ? -22.09300 -32.08900 10.44400  1.000 36.77784 ?  123 ARG A NH2 1 
ATOM   879  N N   . PHE A 1 144 ? -19.85100 -29.17600 4.44000   1.000 18.09071 ?  124 PHE A N   1 
ATOM   880  C CA  . PHE A 1 144 ? -20.52900 -27.89100 4.43700   1.000 17.06669 ?  124 PHE A CA  1 
ATOM   881  C C   . PHE A 1 144 ? -22.03200 -28.10600 4.54700   1.000 19.96920 ?  124 PHE A C   1 
ATOM   882  O O   . PHE A 1 144 ? -22.59000 -28.97900 3.87800   1.000 20.58250 ?  124 PHE A O   1 
ATOM   883  C CB  . PHE A 1 144 ? -20.21100 -27.12000 3.15300   1.000 18.77252 ?  124 PHE A CB  1 
ATOM   884  C CG  . PHE A 1 144 ? -18.76200 -26.75700 3.02000   1.000 16.94725 ?  124 PHE A CG  1 
ATOM   885  C CD1 . PHE A 1 144 ? -18.25100 -25.67000 3.70800   1.000 15.95349 ?  124 PHE A CD1 1 
ATOM   886  C CD2 . PHE A 1 144 ? -17.90800 -27.50600 2.22700   1.000 17.09419 ?  124 PHE A CD2 1 
ATOM   887  C CE1 . PHE A 1 144 ? -16.90900 -25.32300 3.60400   1.000 16.64565 ?  124 PHE A CE1 1 
ATOM   888  C CE2 . PHE A 1 144 ? -16.57200 -27.16700 2.11300   1.000 17.51725 ?  124 PHE A CE2 1 
ATOM   889  C CZ  . PHE A 1 144 ? -16.06700 -26.07800 2.80500   1.000 18.18231 ?  124 PHE A CZ  1 
ATOM   890  N N   . GLN A 1 145 ? -22.68800 -27.29700 5.38000   1.000 18.98431 ?  125 GLN A N   1 
ATOM   891  C CA  . GLN A 1 145 ? -24.12400 -27.44200 5.57900   1.000 19.34520 ?  125 GLN A CA  1 
ATOM   892  C C   . GLN A 1 145 ? -24.76100 -26.08300 5.83100   1.000 22.78063 ?  125 GLN A C   1 
ATOM   893  O O   . GLN A 1 145 ? -24.13800 -25.17200 6.39000   1.000 20.83357 ?  125 GLN A O   1 
ATOM   894  C CB  . GLN A 1 145 ? -24.43800 -28.38000 6.74800   1.000 28.40856 ?  125 GLN A CB  1 
ATOM   895  C CG  . GLN A 1 145 ? -23.69300 -28.05600 8.03100   1.000 26.93083 ?  125 GLN A CG  1 
ATOM   896  C CD  . GLN A 1 145 ? -23.78900 -29.18100 9.04500   1.000 29.46700 ?  125 GLN A CD  1 
ATOM   897  O OE1 . GLN A 1 145 ? -23.21600 -30.25400 8.85600   1.000 30.18906 ?  125 GLN A OE1 1 
ATOM   898  N NE2 . GLN A 1 145 ? -24.52100 -28.93900 10.12600  1.000 31.88717 ?  125 GLN A NE2 1 
ATOM   899  N N   . VAL A 1 146 ? -26.02000 -25.95700 5.41300   1.000 21.85832 ?  126 VAL A N   1 
ATOM   900  C CA  . VAL A 1 146 ? -26.78800 -24.75700 5.70900   1.000 21.84974 ?  126 VAL A CA  1 
ATOM   901  C C   . VAL A 1 146 ? -27.15900 -24.76800 7.18300   1.000 21.21829 ?  126 VAL A C   1 
ATOM   902  O O   . VAL A 1 146 ? -27.50600 -25.81500 7.75100   1.000 24.18683 ?  126 VAL A O   1 
ATOM   903  C CB  . VAL A 1 146 ? -28.03300 -24.69400 4.80800   1.000 23.63252 ?  126 VAL A CB  1 
ATOM   904  C CG1 . VAL A 1 146 ? -28.99900 -23.61900 5.29800   1.000 28.69078 ?  126 VAL A CG1 1 
ATOM   905  C CG2 . VAL A 1 146 ? -27.63200 -24.44000 3.36300   1.000 25.18327 ?  126 VAL A CG2 1 
ATOM   906  N N   . GLY A 1 147 ? -27.04800 -23.61000 7.82300   1.000 21.30338 ?  127 GLY A N   1 
ATOM   907  C CA  . GLY A 1 147 ? -27.38200 -23.51300 9.23100   1.000 20.94994 ?  127 GLY A CA  1 
ATOM   908  C C   . GLY A 1 147 ? -27.38500 -22.06600 9.66600   1.000 19.82262 ?  127 GLY A C   1 
ATOM   909  O O   . GLY A 1 147 ? -26.89300 -21.17900 8.96300   1.000 20.23876 ?  127 GLY A O   1 
ATOM   910  N N   . ASP A 1 148 ? -27.94500 -21.84500 10.85300  1.000 20.99972 ?  128 ASP A N   1 
ATOM   911  C CA  . ASP A 1 148 ? -28.14000 -20.51400 11.40900  1.000 22.23593 ?  128 ASP A CA  1 
ATOM   912  C C   . ASP A 1 148 ? -27.23500 -20.39500 12.63100  1.000 20.00887 ?  128 ASP A C   1 
ATOM   913  O O   . ASP A 1 148 ? -27.43000 -21.09300 13.63700  1.000 20.73204 ?  128 ASP A O   1 
ATOM   914  C CB  . ASP A 1 148 ? -29.60900 -20.33700 11.77600  1.000 23.03522 ?  128 ASP A CB  1 
ATOM   915  C CG  . ASP A 1 148 ? -29.88300 -19.05600 12.52100  1.000 27.13352 ?  128 ASP A CG  1 
ATOM   916  O OD1 . ASP A 1 148 ? -28.94400 -18.27500 12.80200  1.000 24.73082 ?  128 ASP A OD1 1 
ATOM   917  O OD2 . ASP A 1 148 ? -31.06900 -18.80800 12.81600  1.000 33.94342 -1 128 ASP A OD2 1 
ATOM   918  N N   . ALA A 1 149 ? -26.24100 -19.50900 12.54400  1.000 19.99788 ?  129 ALA A N   1 
ATOM   919  C CA  . ALA A 1 149 ? -25.25700 -19.39200 13.61500  1.000 18.66395 ?  129 ALA A CA  1 
ATOM   920  C C   . ALA A 1 149 ? -25.86400 -18.92800 14.92900  1.000 21.22751 ?  129 ALA A C   1 
ATOM   921  O O   . ALA A 1 149 ? -25.22300 -19.07800 15.97600  1.000 22.68470 ?  129 ALA A O   1 
ATOM   922  C CB  . ALA A 1 149 ? -24.14100 -18.42600 13.20700  1.000 20.94677 ?  129 ALA A CB  1 
ATOM   923  N N   . CYS A 1 150 ? -27.06200 -18.35000 14.90500  1.000 19.64619 ?  130 CYS A N   1 
ATOM   924  C CA  . CYS A 1 150 ? -27.72000 -17.92400 16.13400  1.000 18.93111 ?  130 CYS A CA  1 
ATOM   925  C C   . CYS A 1 150 ? -28.55900 -19.02800 16.76400  1.000 21.66217 ?  130 CYS A C   1 
ATOM   926  O O   . CYS A 1 150 ? -29.09100 -18.82900 17.86100  1.000 23.84382 ?  130 CYS A O   1 
ATOM   927  C CB  . CYS A 1 150 ? -28.62300 -16.71700 15.86900  1.000 20.51834 ?  130 CYS A CB  1 
ATOM   928  S SG  . CYS A 1 150 ? -27.73400 -15.19800 15.37600  1.000 24.44445 ?  130 CYS A SG  1 
ATOM   929  N N   . ALA A 1 151 ? -28.68900 -20.17400 16.09800  1.000 17.29129 ?  131 ALA A N   1 
ATOM   930  C CA  . ALA A 1 151 ? -29.49600 -21.28900 16.58100  1.000 19.87294 ?  131 ALA A CA  1 
ATOM   931  C C   . ALA A 1 151 ? -28.99500 -22.59100 15.96800  1.000 21.02236 ?  131 ALA A C   1 
ATOM   932  O O   . ALA A 1 151 ? -29.65500 -23.18700 15.10700  1.000 20.82306 ?  131 ALA A O   1 
ATOM   933  C CB  . ALA A 1 151 ? -30.97300 -21.06100 16.25400  1.000 23.27878 ?  131 ALA A CB  1 
ATOM   934  N N   . LEU A 1 152 ? -27.82000 -23.03000 16.40500  1.000 18.54730 ?  132 LEU A N   1 
ATOM   935  C CA  . LEU A 1 152 ? -27.17100 -24.19800 15.83600  1.000 18.37618 ?  132 LEU A CA  1 
ATOM   936  C C   . LEU A 1 152 ? -27.82500 -25.48400 16.34400  1.000 18.60473 ?  132 LEU A C   1 
ATOM   937  O O   . LEU A 1 152 ? -28.39900 -25.52300 17.43800  1.000 20.88475 ?  132 LEU A O   1 
ATOM   938  C CB  . LEU A 1 152 ? -25.68800 -24.17900 16.20800  1.000 18.35804 ?  132 LEU A CB  1 
ATOM   939  C CG  . LEU A 1 152 ? -24.89900 -23.03800 15.55700  1.000 17.95456 ?  132 LEU A CG  1 
ATOM   940  C CD1 . LEU A 1 152 ? -23.55800 -22.83100 16.24400  1.000 20.86405 ?  132 LEU A CD1 1 
ATOM   941  C CD2 . LEU A 1 152 ? -24.70700 -23.32900 14.07200  1.000 19.00044 ?  132 LEU A CD2 1 
ATOM   942  N N   . ASP A 1 153 ? -27.73400 -26.54500 15.53900  1.000 19.84973 ?  133 ASP A N   1 
ATOM   943  C CA  . ASP A 1 153 ? -28.33400 -27.82100 15.92300  1.000 21.13754 ?  133 ASP A CA  1 
ATOM   944  C C   . ASP A 1 153 ? -27.72600 -28.34200 17.22000  1.000 18.86280 ?  133 ASP A C   1 
ATOM   945  O O   . ASP A 1 153 ? -26.52200 -28.20600 17.45700  1.000 19.96893 ?  133 ASP A O   1 
ATOM   946  C CB  . ASP A 1 153 ? -28.11200 -28.85700 14.82300  1.000 24.52625 ?  133 ASP A CB  1 
ATOM   947  C CG  . ASP A 1 153 ? -28.98400 -28.61700 13.61000  1.000 37.27262 ?  133 ASP A CG  1 
ATOM   948  O OD1 . ASP A 1 153 ? -29.91700 -27.78900 13.69700  1.000 34.07773 ?  133 ASP A OD1 1 
ATOM   949  O OD2 . ASP A 1 153 ? -28.73500 -29.26300 12.57200  1.000 41.59781 -1 133 ASP A OD2 1 
ATOM   950  N N   . ASP A 1 154 ? -28.55700 -28.98000 18.05100  1.000 20.67139 ?  134 ASP A N   1 
ATOM   951  C CA  . ASP A 1 154 ? -28.07000 -29.48600 19.33400  1.000 21.77005 ?  134 ASP A CA  1 
ATOM   952  C C   . ASP A 1 154 ? -27.26200 -30.77200 19.19600  1.000 21.08132 ?  134 ASP A C   1 
ATOM   953  O O   . ASP A 1 154 ? -26.76300 -31.28300 20.20700  1.000 17.88929 ?  134 ASP A O   1 
ATOM   954  C CB  . ASP A 1 154 ? -29.20800 -29.64600 20.35900  1.000 22.09836 ?  134 ASP A CB  1 
ATOM   955  C CG  . ASP A 1 154 ? -30.22100 -30.71900 19.98200  1.000 27.67234 ?  134 ASP A CG  1 
ATOM   956  O OD1 . ASP A 1 154 ? -30.03200 -31.42900 18.97200  1.000 27.94301 ?  134 ASP A OD1 1 
ATOM   957  O OD2 . ASP A 1 154 ? -31.23100 -30.83800 20.70900  1.000 27.99265 -1 134 ASP A OD2 1 
ATOM   958  N N   . THR A 1 155 ? -27.10400 -31.27800 17.96900  1.000 21.10019 ?  135 THR A N   1 
ATOM   959  C CA  . THR A 1 155 ? -26.34200 -32.47700 17.64700  1.000 20.02802 ?  135 THR A CA  1 
ATOM   960  C C   . THR A 1 155 ? -24.92200 -32.16800 17.19000  1.000 19.05494 ?  135 THR A C   1 
ATOM   961  O O   . THR A 1 155 ? -24.17600 -33.08900 16.84200  1.000 21.13676 ?  135 THR A O   1 
ATOM   962  C CB  . THR A 1 155 ? -27.04500 -33.22300 16.50000  1.000 22.08720 ?  135 THR A CB  1 
ATOM   963  O OG1 . THR A 1 155 ? -27.27400 -32.31600 15.41200  1.000 28.04494 ?  135 THR A OG1 1 
ATOM   964  C CG2 . THR A 1 155 ? -28.38500 -33.76000 16.95200  1.000 25.02741 ?  135 THR A CG2 1 
ATOM   965  N N   . LEU A 1 156 ? -24.53100 -30.89300 17.18400  1.000 19.26314 ?  136 LEU A N   1 
ATOM   966  C CA  . LEU A 1 156 ? -23.27300 -30.48200 16.57600  1.000 19.29665 ?  136 LEU A CA  1 
ATOM   967  C C   . LEU A 1 156 ? -22.03300 -30.94100 17.33500  1.000 20.10514 ?  136 LEU A C   1 
ATOM   968  O O   . LEU A 1 156 ? -20.94800 -30.98200 16.74500  1.000 20.04884 ?  136 LEU A O   1 
ATOM   969  C CB  . LEU A 1 156 ? -23.28700 -28.96700 16.39500  1.000 23.01773 ?  136 LEU A CB  1 
ATOM   970  C CG  . LEU A 1 156 ? -22.38100 -28.38800 15.32300  1.000 25.78757 ?  136 LEU A CG  1 
ATOM   971  C CD1 . LEU A 1 156 ? -22.66500 -28.99000 13.96000  1.000 21.83553 ?  136 LEU A CD1 1 
ATOM   972  C CD2 . LEU A 1 156 ? -22.61500 -26.88500 15.31200  1.000 24.44161 ?  136 LEU A CD2 1 
ATOM   973  N N   . GLY A 1 157 ? -22.15200 -31.28100 18.61700  1.000 17.93955 ?  137 GLY A N   1 
ATOM   974  C CA  . GLY A 1 157 ? -20.97700 -31.68100 19.36900  1.000 18.88713 ?  137 GLY A CA  1 
ATOM   975  C C   . GLY A 1 157 ? -20.10400 -30.49800 19.75500  1.000 16.61253 ?  137 GLY A C   1 
ATOM   976  O O   . GLY A 1 157 ? -20.54000 -29.34400 19.79200  1.000 19.17540 ?  137 GLY A O   1 
ATOM   977  N N   . ARG A 1 158 ? -18.84800 -30.81300 20.06200  1.000 18.43379 ?  138 ARG A N   1 
ATOM   978  C CA  . ARG A 1 158 ? -17.86300 -29.85100 20.53500  1.000 19.21617 ?  138 ARG A CA  1 
ATOM   979  C C   . ARG A 1 158 ? -16.66300 -29.86500 19.60400  1.000 19.66729 ?  138 ARG A C   1 
ATOM   980  O O   . ARG A 1 158 ? -16.45700 -30.81300 18.84200  1.000 20.12513 ?  138 ARG A O   1 
ATOM   981  C CB  . ARG A 1 158 ? -17.37800 -30.21500 21.94500  1.000 28.86234 ?  138 ARG A CB  1 
ATOM   982  C CG  . ARG A 1 158 ? -18.41700 -30.04800 23.02000  1.000 38.83551 ?  138 ARG A CG  1 
ATOM   983  C CD  . ARG A 1 158 ? -17.76900 -29.92300 24.38400  1.000 33.62281 ?  138 ARG A CD  1 
ATOM   984  N NE  . ARG A 1 158 ? -17.00000 -31.10700 24.74800  1.000 37.45993 ?  138 ARG A NE  1 
ATOM   985  C CZ  . ARG A 1 158 ? -16.35400 -31.24400 25.89900  1.000 47.71311 ?  138 ARG A CZ  1 
ATOM   986  N NH1 . ARG A 1 158 ? -16.35700 -30.28400 26.81000  1.000 40.62115 ?  138 ARG A NH1 1 
ATOM   987  N NH2 . ARG A 1 158 ? -15.69600 -32.37400 26.14400  1.000 46.22099 ?  138 ARG A NH2 1 
ATOM   988  N N   . PHE A 1 159 ? -15.84800 -28.81500 19.70700  1.000 18.00827 ?  139 PHE A N   1 
ATOM   989  C CA  . PHE A 1 159 ? -14.78200 -28.58000 18.75100  1.000 17.69288 ?  139 PHE A CA  1 
ATOM   990  C C   . PHE A 1 159 ? -13.50300 -28.16900 19.45900  1.000 15.05078 ?  139 PHE A C   1 
ATOM   991  O O   . PHE A 1 159 ? -13.53000 -27.59000 20.55200  1.000 17.02897 ?  139 PHE A O   1 
ATOM   992  C CB  . PHE A 1 159 ? -15.20000 -27.50100 17.75200  1.000 15.49020 ?  139 PHE A CB  1 
ATOM   993  C CG  . PHE A 1 159 ? -16.36500 -27.91400 16.91200  1.000 15.10087 ?  139 PHE A CG  1 
ATOM   994  C CD1 . PHE A 1 159 ? -17.66100 -27.71100 17.35800  1.000 17.23253 ?  139 PHE A CD1 1 
ATOM   995  C CD2 . PHE A 1 159 ? -16.16400 -28.52900 15.68800  1.000 15.40762 ?  139 PHE A CD2 1 
ATOM   996  C CE1 . PHE A 1 159 ? -18.74200 -28.11100 16.59200  1.000 16.44359 ?  139 PHE A CE1 1 
ATOM   997  C CE2 . PHE A 1 159 ? -17.23500 -28.93600 14.92000  1.000 16.70371 ?  139 PHE A CE2 1 
ATOM   998  C CZ  . PHE A 1 159 ? -18.52800 -28.72400 15.37300  1.000 15.79161 ?  139 PHE A CZ  1 
ATOM   999  N N   . ASP A 1 160 ? -12.38200 -28.44500 18.79500  1.000 15.34777 ?  140 ASP A N   1 
ATOM   1000 C CA  . ASP A 1 160 ? -11.09000 -27.95400 19.26200  1.000 15.95428 ?  140 ASP A CA  1 
ATOM   1001 C C   . ASP A 1 160 ? -10.86400 -26.49900 18.88400  1.000 15.78726 ?  140 ASP A C   1 
ATOM   1002 O O   . ASP A 1 160 ? -10.13500 -25.78500 19.58800  1.000 17.04002 ?  140 ASP A O   1 
ATOM   1003 C CB  . ASP A 1 160 ? -9.97400  -28.79700 18.65500  1.000 17.78916 ?  140 ASP A CB  1 
ATOM   1004 C CG  . ASP A 1 160 ? -10.04400 -30.23300 19.09400  1.000 19.35076 ?  140 ASP A CG  1 
ATOM   1005 O OD1 . ASP A 1 160 ? -9.89800  -30.46900 20.31500  1.000 19.33556 ?  140 ASP A OD1 1 
ATOM   1006 O OD2 . ASP A 1 160 ? -10.26600 -31.11200 18.23200  1.000 19.47256 -1 140 ASP A OD2 1 
ATOM   1007 N N   . LEU A 1 161 ? -11.48400 -26.04400 17.80000  1.000 15.64069 ?  141 LEU A N   1 
ATOM   1008 C CA  . LEU A 1 161 ? -11.28100 -24.69000 17.29600  1.000 14.37483 ?  141 LEU A CA  1 
ATOM   1009 C C   . LEU A 1 161 ? -12.54800 -24.24900 16.58000  1.000 15.30828 ?  141 LEU A C   1 
ATOM   1010 O O   . LEU A 1 161 ? -13.13200 -25.02000 15.81300  1.000 15.78214 ?  141 LEU A O   1 
ATOM   1011 C CB  . LEU A 1 161 ? -10.12300 -24.65400 16.29800  1.000 17.24014 ?  141 LEU A CB  1 
ATOM   1012 C CG  . LEU A 1 161 ? -9.66000  -23.27200 15.81800  1.000 16.85374 ?  141 LEU A CG  1 
ATOM   1013 C CD1 . LEU A 1 161 ? -8.16500  -23.28600 15.55000  1.000 17.87136 ?  141 LEU A CD1 1 
ATOM   1014 C CD2 . LEU A 1 161 ? -10.44500 -22.82000 14.56900  1.000 15.58024 ?  141 LEU A CD2 1 
ATOM   1015 N N   . ILE A 1 162 ? -12.95600 -23.00700 16.82400  1.000 14.12687 ?  142 ILE A N   1 
ATOM   1016 C CA  . ILE A 1 162 ? -14.08100 -22.38800 16.13000  1.000 14.11834 ?  142 ILE A CA  1 
ATOM   1017 C C   . ILE A 1 162 ? -13.60400 -21.06600 15.55300  1.000 13.36281 ?  142 ILE A C   1 
ATOM   1018 O O   . ILE A 1 162 ? -13.00500 -20.25700 16.27300  1.000 14.83158 ?  142 ILE A O   1 
ATOM   1019 C CB  . ILE A 1 162 ? -15.25700 -22.14700 17.08800  1.000 15.55335 ?  142 ILE A CB  1 
ATOM   1020 C CG1 . ILE A 1 162 ? -15.75300 -23.48600 17.64900  1.000 16.80861 ?  142 ILE A CG1 1 
ATOM   1021 C CG2 . ILE A 1 162 ? -16.37800 -21.36600 16.37200  1.000 18.34485 ?  142 ILE A CG2 1 
ATOM   1022 C CD1 . ILE A 1 162 ? -17.03100 -23.35500 18.45900  1.000 20.39860 ?  142 ILE A CD1 1 
ATOM   1023 N N   . PHE A 1 163 ? -13.87400 -20.85400 14.26300  1.000 14.59094 ?  143 PHE A N   1 
ATOM   1024 C CA  . PHE A 1 163 ? -13.59800 -19.60100 13.57200  1.000 13.53936 ?  143 PHE A CA  1 
ATOM   1025 C C   . PHE A 1 163 ? -14.91400 -18.96500 13.13700  1.000 15.26822 ?  143 PHE A C   1 
ATOM   1026 O O   . PHE A 1 163 ? -15.75500 -19.62300 12.51700  1.000 15.13480 ?  143 PHE A O   1 
ATOM   1027 C CB  . PHE A 1 163 ? -12.74700 -19.87400 12.32500  1.000 15.37386 ?  143 PHE A CB  1 
ATOM   1028 C CG  . PHE A 1 163 ? -12.45200 -18.64700 11.52200  1.000 14.94884 ?  143 PHE A CG  1 
ATOM   1029 C CD1 . PHE A 1 163 ? -11.66400 -17.63500 12.04800  1.000 17.10296 ?  143 PHE A CD1 1 
ATOM   1030 C CD2 . PHE A 1 163 ? -12.98600 -18.49200 10.25300  1.000 16.49502 ?  143 PHE A CD2 1 
ATOM   1031 C CE1 . PHE A 1 163 ? -11.40000 -16.48300 11.31600  1.000 18.24537 ?  143 PHE A CE1 1 
ATOM   1032 C CE2 . PHE A 1 163 ? -12.71400 -17.33800 9.51100   1.000 17.67125 ?  143 PHE A CE2 1 
ATOM   1033 C CZ  . PHE A 1 163 ? -11.92700 -16.34400 10.05100  1.000 17.86343 ?  143 PHE A CZ  1 
ATOM   1034 N N   . ALA A 1 164 ? -15.08400 -17.67900 13.43400  1.000 15.33768 ?  144 ALA A N   1 
ATOM   1035 C CA  . ALA A 1 164 ? -16.26600 -16.93200 13.00300  1.000 15.41396 ?  144 ALA A CA  1 
ATOM   1036 C C   . ALA A 1 164 ? -15.75600 -15.64200 12.37800  1.000 14.99917 ?  144 ALA A C   1 
ATOM   1037 O O   . ALA A 1 164 ? -15.55700 -14.64600 13.08000  1.000 15.68863 ?  144 ALA A O   1 
ATOM   1038 C CB  . ALA A 1 164 ? -17.20600 -16.66000 14.17200  1.000 17.63454 ?  144 ALA A CB  1 
ATOM   1039 N N   . GLY A 1 165 ? -15.55500 -15.66500 11.06000  1.000 15.39767 ?  145 GLY A N   1 
ATOM   1040 C CA  . GLY A 1 165 ? -14.99300 -14.52200 10.35500  1.000 16.28092 ?  145 GLY A CA  1 
ATOM   1041 C C   . GLY A 1 165 ? -16.06100 -13.60400 9.79400   1.000 17.55666 ?  145 GLY A C   1 
ATOM   1042 O O   . GLY A 1 165 ? -16.97700 -14.05300 9.10100   1.000 18.53840 ?  145 GLY A O   1 
ATOM   1043 N N   . ASN A 1 166 ? -15.93200 -12.31000 10.09200  1.000 15.11320 ?  146 ASN A N   1 
ATOM   1044 C CA  . ASN A 1 166 ? -16.82800 -11.28100 9.55500   1.000 15.03444 ?  146 ASN A CA  1 
ATOM   1045 C C   . ASN A 1 166 ? -18.29800 -11.63000 9.76600   1.000 20.58891 ?  146 ASN A C   1 
ATOM   1046 O O   . ASN A 1 166 ? -19.14300 -11.39400 8.89600   1.000 22.56876 ?  146 ASN A O   1 
ATOM   1047 C CB  . ASN A 1 166 ? -16.55300 -11.00800 8.07700   1.000 18.32097 ?  146 ASN A CB  1 
ATOM   1048 C CG  . ASN A 1 166 ? -15.24400 -10.27500 7.83900   1.000 16.44042 ?  146 ASN A CG  1 
ATOM   1049 O OD1 . ASN A 1 166 ? -14.52100 -9.93300  8.76500   1.000 18.59106 ?  146 ASN A OD1 1 
ATOM   1050 N ND2 . ASN A 1 166 ? -14.94300 -10.02900 6.56700   1.000 18.56535 ?  146 ASN A ND2 1 
ATOM   1051 N N   . LEU A 1 167 ? -18.62100 -12.16800 10.94100  1.000 16.60160 ?  147 LEU A N   1 
ATOM   1052 C CA  . LEU A 1 167 ? -19.95300 -12.70000 11.20100  1.000 17.83765 ?  147 LEU A CA  1 
ATOM   1053 C C   . LEU A 1 167 ? -20.74500 -11.91600 12.23900  1.000 19.24712 ?  147 LEU A C   1 
ATOM   1054 O O   . LEU A 1 167 ? -21.92500 -11.61900 12.01500  1.000 18.46065 ?  147 LEU A O   1 
ATOM   1055 C CB  . LEU A 1 167 ? -19.85300 -14.17000 11.62700  1.000 17.29141 ?  147 LEU A CB  1 
ATOM   1056 C CG  . LEU A 1 167 ? -21.20600 -14.83200 11.84900  1.000 18.77454 ?  147 LEU A CG  1 
ATOM   1057 C CD1 . LEU A 1 167 ? -21.99000 -14.86000 10.54200  1.000 22.18030 ?  147 LEU A CD1 1 
ATOM   1058 C CD2 . LEU A 1 167 ? -20.98000 -16.23700 12.37700  1.000 20.93532 ?  147 LEU A CD2 1 
ATOM   1059 N N   . ILE A 1 168 ? -20.13200 -11.57100 13.37500  1.000 16.77245 ?  148 ILE A N   1 
ATOM   1060 C CA  . ILE A 1 168 ? -20.89300 -11.08900 14.53200  1.000 19.66795 ?  148 ILE A CA  1 
ATOM   1061 C C   . ILE A 1 168 ? -21.70400 -9.83700  14.19800  1.000 22.35365 ?  148 ILE A C   1 
ATOM   1062 O O   . ILE A 1 168 ? -22.84100 -9.68100  14.66000  1.000 20.80648 ?  148 ILE A O   1 
ATOM   1063 C CB  . ILE A 1 168 ? -19.97400 -10.89600 15.75300  1.000 17.89898 ?  148 ILE A CB  1 
ATOM   1064 C CG1 . ILE A 1 168 ? -20.79800 -10.60200 17.01100  1.000 27.72163 ?  148 ILE A CG1 1 
ATOM   1065 C CG2 . ILE A 1 168 ? -18.95800 -9.80600  15.48500  1.000 19.77092 ?  148 ILE A CG2 1 
ATOM   1066 C CD1 . ILE A 1 168 ? -21.24300 -11.82400 17.75400  1.000 32.09089 ?  148 ILE A CD1 1 
ATOM   1067 N N   . ASP A 1 169 ? -21.14400 -8.92900  13.40300  1.000 18.09458 ?  149 ASP A N   1 
ATOM   1068 C CA  . ASP A 1 169 ? -21.84000 -7.68400  13.06900  1.000 19.59635 ?  149 ASP A CA  1 
ATOM   1069 C C   . ASP A 1 169 ? -22.88700 -7.85600  11.97100  1.000 22.66190 ?  149 ASP A C   1 
ATOM   1070 O O   . ASP A 1 169 ? -23.49500 -6.86800  11.53500  1.000 22.72203 ?  149 ASP A O   1 
ATOM   1071 C CB  . ASP A 1 169 ? -20.84500 -6.54500  12.76700  1.000 21.25251 ?  149 ASP A CB  1 
ATOM   1072 C CG  . ASP A 1 169 ? -19.79100 -6.91700  11.72700  1.000 24.24470 ?  149 ASP A CG  1 
ATOM   1073 O OD1 . ASP A 1 169 ? -19.37600 -8.09900  11.65100  1.000 22.82086 ?  149 ASP A OD1 1 
ATOM   1074 O OD2 . ASP A 1 169 ? -19.33000 -5.99400  11.01400  1.000 20.82448 -1 149 ASP A OD2 1 
ATOM   1075 N N   . ARG A 1 170 ? -23.13000 -9.08700  11.53000  1.000 20.51253 ?  150 ARG A N   1 
ATOM   1076 C CA  . ARG A 1 170 ? -24.16800 -9.37300  10.55100  1.000 22.54984 ?  150 ARG A CA  1 
ATOM   1077 C C   . ARG A 1 170 ? -25.26600 -10.26400 11.12200  1.000 23.27193 ?  150 ARG A C   1 
ATOM   1078 O O   . ARG A 1 170 ? -26.13200 -10.72200 10.36700  1.000 29.70399 ?  150 ARG A O   1 
ATOM   1079 C CB  . ARG A 1 170 ? -23.55800 -9.98800  9.28500   1.000 23.99836 ?  150 ARG A CB  1 
ATOM   1080 C CG  . ARG A 1 170 ? -22.57700 -9.03800  8.59500   1.000 27.57046 ?  150 ARG A CG  1 
ATOM   1081 C CD  . ARG A 1 170 ? -21.90200 -9.65100  7.38000   1.000 38.77580 ?  150 ARG A CD  1 
ATOM   1082 N NE  . ARG A 1 170 ? -22.79100 -9.76100  6.23000   1.000 46.13679 ?  150 ARG A NE  1 
ATOM   1083 C CZ  . ARG A 1 170 ? -22.93500 -8.82500  5.30000   1.000 47.87055 ?  150 ARG A CZ  1 
ATOM   1084 N NH1 . ARG A 1 170 ? -22.30300 -7.66400  5.38300   1.000 48.55156 ?  150 ARG A NH1 1 
ATOM   1085 N NH2 . ARG A 1 170 ? -23.73100 -9.05900  4.26000   1.000 39.00764 ?  150 ARG A NH2 1 
ATOM   1086 N N   . LEU A 1 171 ? -25.26700 -10.49900 12.43500  1.000 21.44485 ?  151 LEU A N   1 
ATOM   1087 C CA  . LEU A 1 171 ? -26.22800 -11.41400 13.03500  1.000 21.97322 ?  151 LEU A CA  1 
ATOM   1088 C C   . LEU A 1 171 ? -27.37300 -10.65400 13.68200  1.000 20.58556 ?  151 LEU A C   1 
ATOM   1089 O O   . LEU A 1 171 ? -27.15700 -9.60400  14.29300  1.000 21.34005 ?  151 LEU A O   1 
ATOM   1090 C CB  . LEU A 1 171 ? -25.54800 -12.24400 14.12100  1.000 19.46847 ?  151 LEU A CB  1 
ATOM   1091 C CG  . LEU A 1 171 ? -24.47000 -13.21900 13.65600  1.000 18.96105 ?  151 LEU A CG  1 
ATOM   1092 C CD1 . LEU A 1 171 ? -23.92300 -13.95400 14.87200  1.000 19.83866 ?  151 LEU A CD1 1 
ATOM   1093 C CD2 . LEU A 1 171 ? -25.01500 -14.20100 12.62600  1.000 21.34496 ?  151 LEU A CD2 1 
ATOM   1094 N N   . PRO A 1 172 ? -28.59700 -11.18100 13.59800  1.000 22.60696 ?  152 PRO A N   1 
ATOM   1095 C CA  . PRO A 1 172 ? -29.72800 -10.49900 14.24000  1.000 24.35288 ?  152 PRO A CA  1 
ATOM   1096 C C   . PRO A 1 172 ? -29.78000 -10.67500 15.74600  1.000 25.38902 ?  152 PRO A C   1 
ATOM   1097 O O   . PRO A 1 172 ? -30.45300 -9.88500  16.41800  1.000 24.95690 ?  152 PRO A O   1 
ATOM   1098 C CB  . PRO A 1 172 ? -30.94400 -11.13900 13.56100  1.000 25.71710 ?  152 PRO A CB  1 
ATOM   1099 C CG  . PRO A 1 172 ? -30.47800 -12.52900 13.26900  1.000 27.74024 ?  152 PRO A CG  1 
ATOM   1100 C CD  . PRO A 1 172 ? -29.03000 -12.37600 12.85200  1.000 26.25480 ?  152 PRO A CD  1 
ATOM   1101 N N   . ASP A 1 173 ? -29.09300 -11.67100 16.30100  1.000 22.63090 ?  153 ASP A N   1 
ATOM   1102 C CA  . ASP A 1 173 ? -29.11800 -11.95200 17.73800  1.000 25.24919 ?  153 ASP A CA  1 
ATOM   1103 C C   . ASP A 1 173 ? -27.72000 -12.33600 18.19700  1.000 26.23434 ?  153 ASP A C   1 
ATOM   1104 O O   . ASP A 1 173 ? -27.43000 -13.51100 18.45700  1.000 22.84375 ?  153 ASP A O   1 
ATOM   1105 C CB  . ASP A 1 173 ? -30.12400 -13.06200 18.05100  1.000 29.00027 ?  153 ASP A CB  1 
ATOM   1106 C CG  . ASP A 1 173 ? -30.52700 -13.09700 19.51800  1.000 30.48098 ?  153 ASP A CG  1 
ATOM   1107 O OD1 . ASP A 1 173 ? -29.81000 -12.50900 20.35100  1.000 30.53171 ?  153 ASP A OD1 1 
ATOM   1108 O OD2 . ASP A 1 173 ? -31.56600 -13.71400 19.82900  1.000 35.59479 -1 153 ASP A OD2 1 
ATOM   1109 N N   . PRO A 1 174 ? -26.81600 -11.35800 18.30700  1.000 23.15532 ?  154 PRO A N   1 
ATOM   1110 C CA  . PRO A 1 174 ? -25.43600 -11.68900 18.70300  1.000 19.87142 ?  154 PRO A CA  1 
ATOM   1111 C C   . PRO A 1 174 ? -25.33800 -12.37100 20.05400  1.000 24.20425 ?  154 PRO A C   1 
ATOM   1112 O O   . PRO A 1 174 ? -24.48900 -13.25100 20.23900  1.000 20.98261 ?  154 PRO A O   1 
ATOM   1113 C CB  . PRO A 1 174 ? -24.71700 -10.33000 18.70300  1.000 22.61109 ?  154 PRO A CB  1 
ATOM   1114 C CG  . PRO A 1 174 ? -25.62500 -9.38600  18.00600  1.000 29.27883 ?  154 PRO A CG  1 
ATOM   1115 C CD  . PRO A 1 174 ? -27.01600 -9.91100  18.10700  1.000 23.88287 ?  154 PRO A CD  1 
ATOM   1116 N N   . ALA A 1 175 ? -26.18100 -11.98100 21.01300  1.000 21.03925 ?  155 ALA A N   1 
ATOM   1117 C CA  . ALA A 1 175 ? -26.14400 -12.62000 22.32500  1.000 23.19787 ?  155 ALA A CA  1 
ATOM   1118 C C   . ALA A 1 175 ? -26.48400 -14.10100 22.23600  1.000 23.03067 ?  155 ALA A C   1 
ATOM   1119 O O   . ALA A 1 175 ? -25.84200 -14.92800 22.89300  1.000 22.13864 ?  155 ALA A O   1 
ATOM   1120 C CB  . ALA A 1 175 ? -27.09500 -11.90600 23.28700  1.000 24.31561 ?  155 ALA A CB  1 
ATOM   1121 N N   . ALA A 1 176 ? -27.49000 -14.45700 21.42900  1.000 24.80186 ?  156 ALA A N   1 
ATOM   1122 C CA  . ALA A 1 176 ? -27.84500 -15.86500 21.26500  1.000 22.81489 ?  156 ALA A CA  1 
ATOM   1123 C C   . ALA A 1 176 ? -26.70100 -16.64800 20.63600  1.000 22.00001 ?  156 ALA A C   1 
ATOM   1124 O O   . ALA A 1 176 ? -26.43500 -17.79400 21.02000  1.000 22.01985 ?  156 ALA A O   1 
ATOM   1125 C CB  . ALA A 1 176 ? -29.11000 -15.99800 20.41600  1.000 22.97749 ?  156 ALA A CB  1 
ATOM   1126 N N   . PHE A 1 177 ? -26.02000 -16.04300 19.66400  1.000 20.84697 ?  157 PHE A N   1 
ATOM   1127 C CA  . PHE A 1 177 ? -24.85400 -16.67000 19.05200  1.000 18.15360 ?  157 PHE A CA  1 
ATOM   1128 C C   . PHE A 1 177 ? -23.77500 -16.94000 20.09900  1.000 19.41282 ?  157 PHE A C   1 
ATOM   1129 O O   . PHE A 1 177 ? -23.29300 -18.07200 20.23500  1.000 17.47058 ?  157 PHE A O   1 
ATOM   1130 C CB  . PHE A 1 177 ? -24.34400 -15.75100 17.93800  1.000 18.18694 ?  157 PHE A CB  1 
ATOM   1131 C CG  . PHE A 1 177 ? -22.92200 -16.00300 17.51300  1.000 17.53729 ?  157 PHE A CG  1 
ATOM   1132 C CD1 . PHE A 1 177 ? -22.58300 -17.15300 16.81900  1.000 22.24067 ?  157 PHE A CD1 1 
ATOM   1133 C CD2 . PHE A 1 177 ? -21.93600 -15.07000 17.77500  1.000 22.87466 ?  157 PHE A CD2 1 
ATOM   1134 C CE1 . PHE A 1 177 ? -21.27100 -17.37500 16.41100  1.000 21.75261 ?  157 PHE A CE1 1 
ATOM   1135 C CE2 . PHE A 1 177 ? -20.62600 -15.28500 17.37400  1.000 22.84818 ?  157 PHE A CE2 1 
ATOM   1136 C CZ  . PHE A 1 177 ? -20.29500 -16.44100 16.69100  1.000 21.83706 ?  157 PHE A CZ  1 
ATOM   1137 N N   . LEU A 1 178 ? -23.40800 -15.91300 20.87900  1.000 16.94475 ?  158 LEU A N   1 
ATOM   1138 C CA  . LEU A 1 178 ? -22.31000 -16.04600 21.83400  1.000 16.97200 ?  158 LEU A CA  1 
ATOM   1139 C C   . LEU A 1 178 ? -22.65400 -17.02100 22.95200  1.000 16.06700 ?  158 LEU A C   1 
ATOM   1140 O O   . LEU A 1 178 ? -21.76400 -17.69000 23.48900  1.000 16.96671 ?  158 LEU A O   1 
ATOM   1141 C CB  . LEU A 1 178 ? -21.95600 -14.67000 22.41900  1.000 17.29778 ?  158 LEU A CB  1 
ATOM   1142 C CG  . LEU A 1 178 ? -21.42200 -13.63600 21.41700  1.000 16.02981 ?  158 LEU A CG  1 
ATOM   1143 C CD1 . LEU A 1 178 ? -21.35800 -12.24800 22.05400  1.000 19.54992 ?  158 LEU A CD1 1 
ATOM   1144 C CD2 . LEU A 1 178 ? -20.05400 -14.02700 20.91400  1.000 19.45069 ?  158 LEU A CD2 1 
ATOM   1145 N N   . ALA A 1 179 ? -23.93300 -17.12100 23.31200  1.000 16.99501 ?  159 ALA A N   1 
ATOM   1146 C CA  . ALA A 1 179 ? -24.33600 -18.00200 24.40900  1.000 17.47047 ?  159 ALA A CA  1 
ATOM   1147 C C   . ALA A 1 179 ? -24.04100 -19.47200 24.13000  1.000 18.23795 ?  159 ALA A C   1 
ATOM   1148 O O   . ALA A 1 179 ? -23.94200 -20.26500 25.07800  1.000 17.86532 ?  159 ALA A O   1 
ATOM   1149 C CB  . ALA A 1 179 ? -25.82800 -17.82400 24.68500  1.000 20.29262 ?  159 ALA A CB  1 
ATOM   1150 N N   . GLN A 1 180 ? -23.89800 -19.85600 22.86200  1.000 16.05237 ?  160 GLN A N   1 
ATOM   1151 C CA  . GLN A 1 180 ? -23.60800 -21.24000 22.51100  1.000 16.23418 ?  160 GLN A CA  1 
ATOM   1152 C C   . GLN A 1 180 ? -22.13000 -21.58600 22.65800  1.000 15.34538 ?  160 GLN A C   1 
ATOM   1153 O O   . GLN A 1 180 ? -21.78600 -22.76900 22.75800  1.000 17.44065 ?  160 GLN A O   1 
ATOM   1154 C CB  . GLN A 1 180 ? -24.02300 -21.48500 21.05600  1.000 14.59418 ?  160 GLN A CB  1 
ATOM   1155 C CG  . GLN A 1 180 ? -25.47100 -21.12500 20.75100  1.000 16.62462 ?  160 GLN A CG  1 
ATOM   1156 C CD  . GLN A 1 180 ? -25.75100 -21.05200 19.25400  1.000 20.04709 ?  160 GLN A CD  1 
ATOM   1157 O OE1 . GLN A 1 180 ? -26.59700 -21.77700 18.72900  1.000 19.33593 ?  160 GLN A OE1 1 
ATOM   1158 N NE2 . GLN A 1 180 ? -25.02400 -20.18100 18.56000  1.000 19.19276 ?  160 GLN A NE2 1 
ATOM   1159 N N   . LEU A 1 181 ? -21.24200 -20.58300 22.63500  1.000 15.65845 ?  161 LEU A N   1 
ATOM   1160 C CA  . LEU A 1 181 ? -19.82700 -20.86100 22.40700  1.000 16.79108 ?  161 LEU A CA  1 
ATOM   1161 C C   . LEU A 1 181 ? -19.11300 -21.59100 23.54700  1.000 15.46288 ?  161 LEU A C   1 
ATOM   1162 O O   . LEU A 1 181 ? -18.30400 -22.48700 23.27000  1.000 16.40788 ?  161 LEU A O   1 
ATOM   1163 C CB  . LEU A 1 181 ? -19.08600 -19.59600 21.95200  1.000 16.63670 ?  161 LEU A CB  1 
ATOM   1164 C CG  . LEU A 1 181 ? -19.66300 -19.00800 20.66000  1.000 15.02053 ?  161 LEU A CG  1 
ATOM   1165 C CD1 . LEU A 1 181 ? -18.95700 -17.71700 20.29300  1.000 18.44633 ?  161 LEU A CD1 1 
ATOM   1166 C CD2 . LEU A 1 181 ? -19.52900 -20.00300 19.49500  1.000 19.22112 ?  161 LEU A CD2 1 
ATOM   1167 N N   . PRO A 1 182 ? -19.34600 -21.25000 24.82200  1.000 16.40032 ?  162 PRO A N   1 
ATOM   1168 C CA  . PRO A 1 182 ? -18.69100 -22.03500 25.88300  1.000 17.02881 ?  162 PRO A CA  1 
ATOM   1169 C C   . PRO A 1 182 ? -18.95600 -23.52500 25.74300  1.000 19.88929 ?  162 PRO A C   1 
ATOM   1170 O O   . PRO A 1 182 ? -18.04600 -24.34000 25.94000  1.000 19.86241 ?  162 PRO A O   1 
ATOM   1171 C CB  . PRO A 1 182 ? -19.26400 -21.44000 27.17600  1.000 17.49033 ?  162 PRO A CB  1 
ATOM   1172 C CG  . PRO A 1 182 ? -19.60700 -20.00500 26.80100  1.000 17.40513 ?  162 PRO A CG  1 
ATOM   1173 C CD  . PRO A 1 182 ? -20.09800 -20.09800 25.36600  1.000 17.19336 ?  162 PRO A CD  1 
ATOM   1174 N N   . ALA A 1 183 ? -20.18000 -23.90100 25.36400  1.000 15.83115 ?  163 ALA A N   1 
ATOM   1175 C CA  . ALA A 1 183 ? -20.51800 -25.31200 25.24700  1.000 14.38122 ?  163 ALA A CA  1 
ATOM   1176 C C   . ALA A 1 183 ? -19.94400 -25.95700 23.99300  1.000 17.16552 ?  163 ALA A C   1 
ATOM   1177 O O   . ALA A 1 183 ? -19.78700 -27.18100 23.95900  1.000 16.43748 ?  163 ALA A O   1 
ATOM   1178 C CB  . ALA A 1 183 ? -22.04300 -25.49400 25.25800  1.000 17.23301 ?  163 ALA A CB  1 
ATOM   1179 N N   . LEU A 1 184 ? -19.61400 -25.16900 22.97300  1.000 16.64077 ?  164 LEU A N   1 
ATOM   1180 C CA  . LEU A 1 184 ? -19.13700 -25.71500 21.70900  1.000 14.07402 ?  164 LEU A CA  1 
ATOM   1181 C C   . LEU A 1 184 ? -17.62300 -25.87000 21.64400  1.000 17.43680 ?  164 LEU A C   1 
ATOM   1182 O O   . LEU A 1 184 ? -17.13500 -26.54500 20.73400  1.000 17.94153 ?  164 LEU A O   1 
ATOM   1183 C CB  . LEU A 1 184 ? -19.58100 -24.81700 20.54600  1.000 17.65896 ?  164 LEU A CB  1 
ATOM   1184 C CG  . LEU A 1 184 ? -21.06400 -24.85400 20.18700  1.000 17.48926 ?  164 LEU A CG  1 
ATOM   1185 C CD1 . LEU A 1 184 ? -21.41400 -23.72100 19.22800  1.000 17.57907 ?  164 LEU A CD1 1 
ATOM   1186 C CD2 . LEU A 1 184 ? -21.42100 -26.19800 19.57300  1.000 22.93067 ?  164 LEU A CD2 1 
ATOM   1187 N N   . VAL A 1 185 ? -16.86400 -25.27000 22.56100  1.000 17.18050 ?  165 VAL A N   1 
ATOM   1188 C CA  . VAL A 1 185 ? -15.40400 -25.36000 22.55100  1.000 16.89480 ?  165 VAL A CA  1 
ATOM   1189 C C   . VAL A 1 185 ? -14.93100 -26.20500 23.73000  1.000 18.42728 ?  165 VAL A C   1 
ATOM   1190 O O   . VAL A 1 185 ? -15.28200 -25.92500 24.88300  1.000 18.79818 ?  165 VAL A O   1 
ATOM   1191 C CB  . VAL A 1 185 ? -14.75000 -23.97000 22.57000  1.000 15.46254 ?  165 VAL A CB  1 
ATOM   1192 C CG1 . VAL A 1 185 ? -13.24800 -24.12300 22.40900  1.000 18.20567 ?  165 VAL A CG1 1 
ATOM   1193 C CG2 . VAL A 1 185 ? -15.31500 -23.10200 21.44600  1.000 17.49791 ?  165 VAL A CG2 1 
ATOM   1194 N N   . ARG A 1 186 ? -14.12400 -27.22800 23.43700  1.000 19.67914 ?  166 ARG A N   1 
ATOM   1195 C CA  . ARG A 1 186 ? -13.52300 -28.04800 24.47900  1.000 21.05886 ?  166 ARG A CA  1 
ATOM   1196 C C   . ARG A 1 186 ? -12.54000 -27.21500 25.29400  1.000 21.46355 ?  166 ARG A C   1 
ATOM   1197 O O   . ARG A 1 186 ? -11.86600 -26.33000 24.75700  1.000 19.34014 ?  166 ARG A O   1 
ATOM   1198 C CB  . ARG A 1 186 ? -12.74100 -29.20500 23.86000  1.000 23.97493 ?  166 ARG A CB  1 
ATOM   1199 C CG  . ARG A 1 186 ? -13.52800 -30.08200 22.91100  1.000 27.35278 ?  166 ARG A CG  1 
ATOM   1200 C CD  . ARG A 1 186 ? -12.63300 -31.15200 22.29600  1.000 29.28711 ?  166 ARG A CD  1 
ATOM   1201 N NE  . ARG A 1 186 ? -13.42200 -32.22100 21.69800  1.000 37.90097 ?  166 ARG A NE  1 
ATOM   1202 C CZ  . ARG A 1 186 ? -13.98400 -33.20600 22.38500  1.000 47.37329 ?  166 ARG A CZ  1 
ATOM   1203 N NH1 . ARG A 1 186 ? -13.81600 -33.31900 23.69300  1.000 51.49600 ?  166 ARG A NH1 1 
ATOM   1204 N NH2 . ARG A 1 186 ? -14.73200 -34.09900 21.74400  1.000 47.74221 ?  166 ARG A NH2 1 
ATOM   1205 N N   . PRO A 1 187 ? -12.41600 -27.49300 26.58700  1.000 19.90994 ?  167 PRO A N   1 
ATOM   1206 C CA  . PRO A 1 187 ? -11.40100 -26.80200 27.38800  1.000 18.97250 ?  167 PRO A CA  1 
ATOM   1207 C C   . PRO A 1 187 ? -10.03200 -26.95500 26.74500  1.000 17.57922 ?  167 PRO A C   1 
ATOM   1208 O O   . PRO A 1 187 ? -9.64400  -28.04400 26.31300  1.000 19.64020 ?  167 PRO A O   1 
ATOM   1209 C CB  . PRO A 1 187 ? -11.48300 -27.52400 28.73900  1.000 22.53284 ?  167 PRO A CB  1 
ATOM   1210 C CG  . PRO A 1 187 ? -12.92200 -27.95600 28.81300  1.000 27.25051 ?  167 PRO A CG  1 
ATOM   1211 C CD  . PRO A 1 187 ? -13.23800 -28.40200 27.40100  1.000 23.06829 ?  167 PRO A CD  1 
ATOM   1212 N N   . GLY A 1 188 ? -9.30000  -25.84100 26.66700  1.000 18.26401 ?  168 GLY A N   1 
ATOM   1213 C CA  . GLY A 1 188 ? -8.03500  -25.81000 25.96900  1.000 19.06399 ?  168 GLY A CA  1 
ATOM   1214 C C   . GLY A 1 188 ? -8.13000  -25.46000 24.49800  1.000 18.04505 ?  168 GLY A C   1 
ATOM   1215 O O   . GLY A 1 188 ? -7.08900  -25.26000 23.85600  1.000 18.70469 ?  168 GLY A O   1 
ATOM   1216 N N   . GLY A 1 189 ? -9.33500  -25.42200 23.94200  1.000 18.22519 ?  169 GLY A N   1 
ATOM   1217 C CA  . GLY A 1 189 ? -9.52600  -25.07900 22.55100  1.000 15.17613 ?  169 GLY A CA  1 
ATOM   1218 C C   . GLY A 1 189 ? -9.46800  -23.58300 22.32500  1.000 15.44415 ?  169 GLY A C   1 
ATOM   1219 O O   . GLY A 1 189 ? -9.30200  -22.78100 23.24800  1.000 16.93033 ?  169 GLY A O   1 
ATOM   1220 N N   . LEU A 1 190 ? -9.61700  -23.20400 21.05300  1.000 17.35446 ?  170 LEU A N   1 
ATOM   1221 C CA  . LEU A 1 190 ? -9.47100  -21.81600 20.62700  1.000 16.30896 ?  170 LEU A CA  1 
ATOM   1222 C C   . LEU A 1 190 ? -10.70300 -21.33900 19.86600  1.000 15.38383 ?  170 LEU A C   1 
ATOM   1223 O O   . LEU A 1 190 ? -11.21000 -22.04000 18.98000  1.000 16.02099 ?  170 LEU A O   1 
ATOM   1224 C CB  . LEU A 1 190 ? -8.21500  -21.64000 19.74800  1.000 18.34869 ?  170 LEU A CB  1 
ATOM   1225 C CG  . LEU A 1 190 ? -7.93900  -20.22800 19.23100  1.000 19.16768 ?  170 LEU A CG  1 
ATOM   1226 C CD1 . LEU A 1 190 ? -7.39800  -19.36500 20.35700  1.000 21.94116 ?  170 LEU A CD1 1 
ATOM   1227 C CD2 . LEU A 1 190 ? -6.95500  -20.27100 18.07300  1.000 22.37481 ?  170 LEU A CD2 1 
ATOM   1228 N N   . LEU A 1 191 ? -11.16300 -20.13300 20.20700  1.000 15.47322 ?  171 LEU A N   1 
ATOM   1229 C CA  . LEU A 1 191 ? -12.21600 -19.43300 19.47800  1.000 15.73455 ?  171 LEU A CA  1 
ATOM   1230 C C   . LEU A 1 191 ? -11.60100 -18.18200 18.86000  1.000 13.75708 ?  171 LEU A C   1 
ATOM   1231 O O   . LEU A 1 191 ? -10.92200 -17.41900 19.55600  1.000 16.99778 ?  171 LEU A O   1 
ATOM   1232 C CB  . LEU A 1 191 ? -13.34800 -19.04100 20.44100  1.000 15.75509 ?  171 LEU A CB  1 
ATOM   1233 C CG  . LEU A 1 191 ? -14.33000 -17.96100 19.96600  1.000 15.22597 ?  171 LEU A CG  1 
ATOM   1234 C CD1 . LEU A 1 191 ? -15.17800 -18.49500 18.81800  1.000 16.53479 ?  171 LEU A CD1 1 
ATOM   1235 C CD2 . LEU A 1 191 ? -15.21200 -17.43300 21.11400  1.000 15.87375 ?  171 LEU A CD2 1 
ATOM   1236 N N   . MET A 1 192 ? -11.82800 -17.97200 17.56300  1.000 14.44187 ?  172 MET A N   1 
ATOM   1237 C CA  . MET A 1 192 ? -11.33900 -16.78100 16.87300  1.000 14.74935 ?  172 MET A CA  1 
ATOM   1238 C C   . MET A 1 192 ? -12.52600 -16.06600 16.24600  1.000 15.06346 ?  172 MET A C   1 
ATOM   1239 O O   . MET A 1 192 ? -13.25000 -16.65200 15.43000  1.000 16.24822 ?  172 MET A O   1 
ATOM   1240 C CB  . MET A 1 192 ? -10.31300 -17.13100 15.79100  1.000 15.27764 ?  172 MET A CB  1 
ATOM   1241 C CG  . MET A 1 192 ? -9.78200  -15.90500 15.04400  1.000 16.36996 ?  172 MET A CG  1 
ATOM   1242 S SD  . MET A 1 192 ? -8.43200  -16.33500 13.93400  1.000 17.88674 ?  172 MET A SD  1 
ATOM   1243 C CE  . MET A 1 192 ? -8.01000  -14.72900 13.25500  1.000 15.36330 ?  172 MET A CE  1 
ATOM   1244 N N   . ILE A 1 193 ? -12.70600 -14.80000 16.61200  1.000 14.91893 ?  173 ILE A N   1 
ATOM   1245 C CA  . ILE A 1 193 ? -13.74800 -13.94100 16.06300  1.000 14.19013 ?  173 ILE A CA  1 
ATOM   1246 C C   . ILE A 1 193 ? -13.05900 -12.78900 15.34500  1.000 13.75997 ?  173 ILE A C   1 
ATOM   1247 O O   . ILE A 1 193 ? -12.15100 -12.16400 15.90500  1.000 15.75486 ?  173 ILE A O   1 
ATOM   1248 C CB  . ILE A 1 193 ? -14.65600 -13.41700 17.19200  1.000 13.78853 ?  173 ILE A CB  1 
ATOM   1249 C CG1 . ILE A 1 193 ? -15.52800 -14.55900 17.73200  1.000 15.38435 ?  173 ILE A CG1 1 
ATOM   1250 C CG2 . ILE A 1 193 ? -15.49700 -12.21800 16.72000  1.000 16.72965 ?  173 ILE A CG2 1 
ATOM   1251 C CD1 . ILE A 1 193 ? -16.26200 -14.21200 19.03800  1.000 18.79896 ?  173 ILE A CD1 1 
ATOM   1252 N N   . THR A 1 194 ? -13.46700 -12.51900 14.11200  1.000 13.83651 ?  174 THR A N   1 
ATOM   1253 C CA  . THR A 1 194 ? -13.01900 -11.31500 13.41700  1.000 14.68177 ?  174 THR A CA  1 
ATOM   1254 C C   . THR A 1 194 ? -14.21200 -10.46700 13.00500  1.000 14.66375 ?  174 THR A C   1 
ATOM   1255 O O   . THR A 1 194 ? -15.26500 -10.99000 12.62300  1.000 15.40078 ?  174 THR A O   1 
ATOM   1256 C CB  . THR A 1 194 ? -12.14000 -11.61600 12.18500  1.000 15.61943 ?  174 THR A CB  1 
ATOM   1257 O OG1 . THR A 1 194 ? -12.94800 -12.13200 11.11400  1.000 16.90658 ?  174 THR A OG1 1 
ATOM   1258 C CG2 . THR A 1 194 ? -11.04500 -12.60600 12.52600  1.000 16.91299 ?  174 THR A CG2 1 
ATOM   1259 N N   . SER A 1 195 ? -14.03500 -9.15000  13.06400  1.000 14.73277 ?  175 SER A N   1 
ATOM   1260 C CA  . SER A 1 195 ? -15.12500 -8.27000  12.66700  1.000 16.28810 ?  175 SER A CA  1 
ATOM   1261 C C   . SER A 1 195 ? -14.63400 -6.84600  12.45600  1.000 16.77728 ?  175 SER A C   1 
ATOM   1262 O O   . SER A 1 195 ? -13.79200 -6.35900  13.21900  1.000 16.78592 ?  175 SER A O   1 
ATOM   1263 C CB  . SER A 1 195 ? -16.21000 -8.24600  13.74900  1.000 16.81100 ?  175 SER A CB  1 
ATOM   1264 O OG  . SER A 1 195 ? -17.29400 -7.42800  13.33600  1.000 17.18972 ?  175 SER A OG  1 
ATOM   1265 N N   . PRO A 1 196 ? -15.17000 -6.13500  11.46200  1.000 16.95887 ?  176 PRO A N   1 
ATOM   1266 C CA  . PRO A 1 196 ? -14.95200 -4.68700  11.38200  1.000 15.40455 ?  176 PRO A CA  1 
ATOM   1267 C C   . PRO A 1 196 ? -15.91800 -3.88700  12.23900  1.000 16.40661 ?  176 PRO A C   1 
ATOM   1268 O O   . PRO A 1 196 ? -15.79200 -2.65900  12.30000  1.000 16.94243 ?  176 PRO A O   1 
ATOM   1269 C CB  . PRO A 1 196 ? -15.19600 -4.39200  9.89500   1.000 18.21661 ?  176 PRO A CB  1 
ATOM   1270 C CG  . PRO A 1 196 ? -16.23100 -5.40100  9.50100   1.000 18.29332 ?  176 PRO A CG  1 
ATOM   1271 C CD  . PRO A 1 196 ? -15.93200 -6.65500  10.31100  1.000 15.70131 ?  176 PRO A CD  1 
ATOM   1272 N N   . TYR A 1 197 ? -16.88400 -4.54300  12.88000  1.000 17.05488 ?  177 TYR A N   1 
ATOM   1273 C CA  . TYR A 1 197 ? -17.82200 -3.87600  13.78400  1.000 16.13040 ?  177 TYR A CA  1 
ATOM   1274 C C   . TYR A 1 197 ? -18.66800 -2.83200  13.05100  1.000 18.55712 ?  177 TYR A C   1 
ATOM   1275 O O   . TYR A 1 197 ? -18.83400 -1.70300  13.51400  1.000 20.28617 ?  177 TYR A O   1 
ATOM   1276 C CB  . TYR A 1 197 ? -17.11100 -3.26900  14.99600  1.000 17.23704 ?  177 TYR A CB  1 
ATOM   1277 C CG  . TYR A 1 197 ? -16.19200 -4.20300  15.75800  1.000 18.13292 ?  177 TYR A CG  1 
ATOM   1278 C CD1 . TYR A 1 197 ? -16.60900 -5.47500  16.14600  1.000 17.31763 ?  177 TYR A CD1 1 
ATOM   1279 C CD2 . TYR A 1 197 ? -14.91400 -3.79600  16.11900  1.000 17.84785 ?  177 TYR A CD2 1 
ATOM   1280 C CE1 . TYR A 1 197 ? -15.76400 -6.31500  16.88300  1.000 17.13787 ?  177 TYR A CE1 1 
ATOM   1281 C CE2 . TYR A 1 197 ? -14.07200 -4.61400  16.84500  1.000 16.30960 ?  177 TYR A CE2 1 
ATOM   1282 C CZ  . TYR A 1 197 ? -14.49700 -5.87800  17.22000  1.000 16.96378 ?  177 TYR A CZ  1 
ATOM   1283 O OH  . TYR A 1 197 ? -13.65000 -6.68500  17.94200  1.000 18.18019 ?  177 TYR A OH  1 
ATOM   1284 N N   . THR A 1 198 ? -19.20000 -3.22100  11.89300  1.000 17.31544 ?  178 THR A N   1 
ATOM   1285 C CA  . THR A 1 198 ? -20.10500 -2.37500  11.10700  1.000 19.48900 ?  178 THR A CA  1 
ATOM   1286 C C   . THR A 1 198 ? -21.52200 -2.61900  11.61100  1.000 21.08145 ?  178 THR A C   1 
ATOM   1287 O O   . THR A 1 198 ? -22.22900 -3.50900  11.13900  1.000 25.99091 ?  178 THR A O   1 
ATOM   1288 C CB  . THR A 1 198 ? -19.97300 -2.66000  9.61400   1.000 20.19880 ?  178 THR A CB  1 
ATOM   1289 O OG1 . THR A 1 198 ? -18.59600 -2.60500  9.21700   1.000 19.19955 ?  178 THR A OG1 1 
ATOM   1290 C CG2 . THR A 1 198 ? -20.78000 -1.65600  8.79500   1.000 22.74789 ?  178 THR A CG2 1 
ATOM   1291 N N   . LEU A 1 199 ? -21.94600 -1.81300  12.57500  1.000 21.65335 ?  179 LEU A N   1 
ATOM   1292 C CA  . LEU A 1 199 ? -23.23800 -1.99100  13.22100  1.000 23.06793 ?  179 LEU A CA  1 
ATOM   1293 C C   . LEU A 1 199 ? -24.31600 -1.27000  12.42000  1.000 24.65010 ?  179 LEU A C   1 
ATOM   1294 O O   . LEU A 1 199 ? -24.21000 -0.06200  12.17000  1.000 24.50298 ?  179 LEU A O   1 
ATOM   1295 C CB  . LEU A 1 199 ? -23.18200 -1.45700  14.64800  1.000 24.77624 ?  179 LEU A CB  1 
ATOM   1296 C CG  . LEU A 1 199 ? -22.23000 -2.27100  15.53100  1.000 26.27021 ?  179 LEU A CG  1 
ATOM   1297 C CD1 . LEU A 1 199 ? -21.94100 -1.56000  16.84300  1.000 24.34932 ?  179 LEU A CD1 1 
ATOM   1298 C CD2 . LEU A 1 199 ? -22.80400 -3.66400  15.78400  1.000 29.61105 ?  179 LEU A CD2 1 
ATOM   1299 N N   . LEU A 1 200 ? -25.35200 -2.01200  12.02100  1.000 23.66678 ?  180 LEU A N   1 
ATOM   1300 C CA  . LEU A 1 200 ? -26.41200 -1.48100  11.17000  1.000 26.86680 ?  180 LEU A CA  1 
ATOM   1301 C C   . LEU A 1 200 ? -27.75000 -2.06700  11.60600  1.000 29.67627 ?  180 LEU A C   1 
ATOM   1302 O O   . LEU A 1 200 ? -27.84400 -3.28700  11.82500  1.000 26.56557 ?  180 LEU A O   1 
ATOM   1303 C CB  . LEU A 1 200 ? -26.13900 -1.84800  9.71400   1.000 25.61083 ?  180 LEU A CB  1 
ATOM   1304 C CG  . LEU A 1 200 ? -24.88300 -1.24200  9.08400   1.000 29.35696 ?  180 LEU A CG  1 
ATOM   1305 C CD1 . LEU A 1 200 ? -24.55200 -1.94400  7.78100   1.000 27.37279 ?  180 LEU A CD1 1 
ATOM   1306 C CD2 . LEU A 1 200 ? -25.05500 0.25100   8.86600   1.000 29.85577 ?  180 LEU A CD2 1 
ATOM   1307 N N   . PRO A 1 201 ? -28.79300 -1.24400  11.73600  1.000 29.95616 ?  181 PRO A N   1 
ATOM   1308 C CA  . PRO A 1 201 ? -30.11600 -1.79300  12.07900  1.000 29.25233 ?  181 PRO A CA  1 
ATOM   1309 C C   . PRO A 1 201 ? -30.62200 -2.82600  11.09000  1.000 30.75722 ?  181 PRO A C   1 
ATOM   1310 O O   . PRO A 1 201 ? -31.40000 -3.71000  11.47600  1.000 34.48371 ?  181 PRO A O   1 
ATOM   1311 C CB  . PRO A 1 201 ? -31.00500 -0.54100  12.10000  1.000 33.62625 ?  181 PRO A CB  1 
ATOM   1312 C CG  . PRO A 1 201 ? -30.06000 0.53900   12.52200  1.000 36.68190 ?  181 PRO A CG  1 
ATOM   1313 C CD  . PRO A 1 201 ? -28.80600 0.22900   11.73800  1.000 31.38107 ?  181 PRO A CD  1 
ATOM   1314 N N   . GLU A 1 202 ? -30.20500 -2.75000  9.82300   1.000 33.26253 ?  182 GLU A N   1 
ATOM   1315 C CA  . GLU A 1 202 ? -30.63300 -3.73600  8.83900   1.000 31.20195 ?  182 GLU A CA  1 
ATOM   1316 C C   . GLU A 1 202 ? -30.13300 -5.13700  9.17100   1.000 34.08241 ?  182 GLU A C   1 
ATOM   1317 O O   . GLU A 1 202 ? -30.72200 -6.12000  8.70600   1.000 32.71722 ?  182 GLU A O   1 
ATOM   1318 C CB  . GLU A 1 202 ? -30.16100 -3.32600  7.44200   1.000 36.20466 ?  182 GLU A CB  1 
ATOM   1319 N N   . PHE A 1 203 ? -29.07300 -5.25200  9.96900   1.000 26.82853 ?  183 PHE A N   1 
ATOM   1320 C CA  . PHE A 1 203 ? -28.50600 -6.54500  10.33600  1.000 27.41532 ?  183 PHE A CA  1 
ATOM   1321 C C   . PHE A 1 203 ? -28.77800 -6.92400  11.78000  1.000 25.04586 ?  183 PHE A C   1 
ATOM   1322 O O   . PHE A 1 203 ? -29.05100 -8.09400  12.05900  1.000 25.88373 ?  183 PHE A O   1 
ATOM   1323 C CB  . PHE A 1 203 ? -26.99100 -6.54200  10.09100  1.000 23.07013 ?  183 PHE A CB  1 
ATOM   1324 C CG  . PHE A 1 203 ? -26.61500 -6.68400  8.64200   1.000 29.04732 ?  183 PHE A CG  1 
ATOM   1325 C CD1 . PHE A 1 203 ? -26.72200 -7.90600  7.99400   1.000 28.40408 ?  183 PHE A CD1 1 
ATOM   1326 C CD2 . PHE A 1 203 ? -26.17300 -5.58600  7.92200   1.000 33.40541 ?  183 PHE A CD2 1 
ATOM   1327 C CE1 . PHE A 1 203 ? -26.38100 -8.03000  6.66100   1.000 35.97994 ?  183 PHE A CE1 1 
ATOM   1328 C CE2 . PHE A 1 203 ? -25.83400 -5.70400  6.58500   1.000 33.95175 ?  183 PHE A CE2 1 
ATOM   1329 C CZ  . PHE A 1 203 ? -25.93700 -6.92700  5.95600   1.000 33.73690 ?  183 PHE A CZ  1 
ATOM   1330 N N   . THR A 1 204 ? -28.71300 -5.96500  12.70200  1.000 24.28976 ?  184 THR A N   1 
ATOM   1331 C CA  . THR A 1 204 ? -28.93700 -6.19200  14.12700  1.000 22.17992 ?  184 THR A CA  1 
ATOM   1332 C C   . THR A 1 204 ? -29.82700 -5.09900  14.70300  1.000 28.85471 ?  184 THR A C   1 
ATOM   1333 O O   . THR A 1 204 ? -29.45800 -3.91800  14.67800  1.000 26.68296 ?  184 THR A O   1 
ATOM   1334 C CB  . THR A 1 204 ? -27.61700 -6.18500  14.90100  1.000 22.75550 ?  184 THR A CB  1 
ATOM   1335 O OG1 . THR A 1 204 ? -26.64300 -6.99300  14.22700  1.000 23.02447 ?  184 THR A OG1 1 
ATOM   1336 C CG2 . THR A 1 204 ? -27.82900 -6.69100  16.32700  1.000 22.02839 ?  184 THR A CG2 1 
ATOM   1337 N N   . PRO A 1 205 ? -30.99000 -5.45200  15.24300  1.000 29.17191 ?  185 PRO A N   1 
ATOM   1338 C CA  . PRO A 1 205 ? -31.81300 -4.45700  15.94100  1.000 31.62720 ?  185 PRO A CA  1 
ATOM   1339 C C   . PRO A 1 205 ? -31.00300 -3.74400  17.01600  1.000 26.99972 ?  185 PRO A C   1 
ATOM   1340 O O   . PRO A 1 205 ? -30.23800 -4.36200  17.76000  1.000 26.23412 ?  185 PRO A O   1 
ATOM   1341 C CB  . PRO A 1 205 ? -32.93400 -5.30300  16.55400  1.000 32.58826 ?  185 PRO A CB  1 
ATOM   1342 C CG  . PRO A 1 205 ? -33.03400 -6.49400  15.65000  1.000 32.98494 ?  185 PRO A CG  1 
ATOM   1343 C CD  . PRO A 1 205 ? -31.61700 -6.78500  15.22900  1.000 29.50541 ?  185 PRO A CD  1 
ATOM   1344 N N   . ARG A 1 206 ? -31.18700 -2.42400  17.10300  1.000 27.86916 ?  186 ARG A N   1 
ATOM   1345 C CA  . ARG A 1 206 ? -30.38900 -1.62300  18.02600  1.000 24.92403 ?  186 ARG A CA  1 
ATOM   1346 C C   . ARG A 1 206 ? -30.45400 -2.16400  19.44900  1.000 23.99894 ?  186 ARG A C   1 
ATOM   1347 O O   . ARG A 1 206 ? -29.44200 -2.19500  20.15900  1.000 25.68940 ?  186 ARG A O   1 
ATOM   1348 C CB  . ARG A 1 206 ? -30.85400 -0.16400  17.98000  1.000 27.58285 ?  186 ARG A CB  1 
ATOM   1349 C CG  . ARG A 1 206 ? -30.24200 0.73500   19.03700  1.000 29.55189 ?  186 ARG A CG  1 
ATOM   1350 C CD  . ARG A 1 206 ? -28.73600 0.85300   18.87000  1.000 29.05520 ?  186 ARG A CD  1 
ATOM   1351 N NE  . ARG A 1 206 ? -28.14000 1.68000   19.91000  1.000 26.45476 ?  186 ARG A NE  1 
ATOM   1352 C CZ  . ARG A 1 206 ? -27.98000 1.32200   21.17700  1.000 26.86992 ?  186 ARG A CZ  1 
ATOM   1353 N NH1 . ARG A 1 206 ? -28.29300 0.10400   21.60400  1.000 26.82819 ?  186 ARG A NH1 1 
ATOM   1354 N NH2 . ARG A 1 206 ? -27.48500 2.20400   22.04000  1.000 31.19878 ?  186 ARG A NH2 1 
ATOM   1355 N N   . GLU A 1 207 ? -31.63800 -2.60200  19.88700  1.000 27.67928 ?  187 GLU A N   1 
ATOM   1356 C CA  . GLU A 1 207 ? -31.77200 -3.08800  21.25500  1.000 29.44976 ?  187 GLU A CA  1 
ATOM   1357 C C   . GLU A 1 207 ? -30.91000 -4.31600  21.51100  1.000 28.36198 ?  187 GLU A C   1 
ATOM   1358 O O   . GLU A 1 207 ? -30.67600 -4.66600  22.67300  1.000 29.76995 ?  187 GLU A O   1 
ATOM   1359 C CB  . GLU A 1 207 ? -33.23700 -3.40500  21.55900  1.000 33.49708 ?  187 GLU A CB  1 
ATOM   1360 C CG  . GLU A 1 207 ? -33.91300 -4.23800  20.48900  1.000 40.37474 ?  187 GLU A CG  1 
ATOM   1361 C CD  . GLU A 1 207 ? -34.77700 -3.40800  19.55700  1.000 48.42581 ?  187 GLU A CD  1 
ATOM   1362 O OE1 . GLU A 1 207 ? -34.21100 -2.67700  18.71400  1.000 50.70206 ?  187 GLU A OE1 1 
ATOM   1363 N N   . ARG A 1 208 ? -30.42000 -4.96200  20.45600  1.000 28.49453 ?  188 ARG A N   1 
ATOM   1364 C CA  . ARG A 1 208 ? -29.63300 -6.18000  20.58500  1.000 25.34012 ?  188 ARG A CA  1 
ATOM   1365 C C   . ARG A 1 208 ? -28.13600 -5.95400  20.41500  1.000 27.46967 ?  188 ARG A C   1 
ATOM   1366 O O   . ARG A 1 208 ? -27.36100 -6.89700  20.59000  1.000 25.34643 ?  188 ARG A O   1 
ATOM   1367 C CB  . ARG A 1 208 ? -30.13000 -7.22900  19.58600  1.000 27.39779 ?  188 ARG A CB  1 
ATOM   1368 C CG  . ARG A 1 208 ? -31.51400 -7.76700  19.92400  1.000 30.06587 ?  188 ARG A CG  1 
ATOM   1369 C CD  . ARG A 1 208 ? -31.75700 -9.10900  19.26400  1.000 31.58704 ?  188 ARG A CD  1 
ATOM   1370 N NE  . ARG A 1 208 ? -33.14800 -9.53000  19.36900  1.000 39.71078 ?  188 ARG A NE  1 
ATOM   1371 C CZ  . ARG A 1 208 ? -33.76100 -10.29900 18.48000  1.000 49.56154 ?  188 ARG A CZ  1 
ATOM   1372 N NH1 . ARG A 1 208 ? -33.15000 -10.70400 17.37700  1.000 40.77710 ?  188 ARG A NH1 1 
ATOM   1373 N NH2 . ARG A 1 208 ? -35.01600 -10.67900 18.70500  1.000 57.16480 ?  188 ARG A NH2 1 
ATOM   1374 N N   . TRP A 1 209 ? -27.70400 -4.73900  20.08300  1.000 23.56600 ?  189 TRP A N   1 
ATOM   1375 C CA  . TRP A 1 209 ? -26.27600 -4.48600  19.94900  1.000 23.65057 ?  189 TRP A CA  1 
ATOM   1376 C C   . TRP A 1 209 ? -25.56400 -4.81500  21.25400  1.000 20.14176 ?  189 TRP A C   1 
ATOM   1377 O O   . TRP A 1 209 ? -26.04000 -4.48600  22.34400  1.000 22.80888 ?  189 TRP A O   1 
ATOM   1378 C CB  . TRP A 1 209 ? -26.01900 -3.01700  19.59300  1.000 23.55963 ?  189 TRP A CB  1 
ATOM   1379 C CG  . TRP A 1 209 ? -26.47400 -2.58700  18.22900  1.000 22.41755 ?  189 TRP A CG  1 
ATOM   1380 C CD1 . TRP A 1 209 ? -27.25700 -3.28200  17.35100  1.000 23.33165 ?  189 TRP A CD1 1 
ATOM   1381 C CD2 . TRP A 1 209 ? -26.17200 -1.33800  17.59400  1.000 21.76529 ?  189 TRP A CD2 1 
ATOM   1382 N NE1 . TRP A 1 209 ? -27.45100 -2.54400  16.20200  1.000 25.88705 ?  189 TRP A NE1 1 
ATOM   1383 C CE2 . TRP A 1 209 ? -26.79600 -1.34600  16.33200  1.000 25.27192 ?  189 TRP A CE2 1 
ATOM   1384 C CE3 . TRP A 1 209 ? -25.42500 -0.21900  17.97100  1.000 24.75639 ?  189 TRP A CE3 1 
ATOM   1385 C CZ2 . TRP A 1 209 ? -26.70300 -0.27200  15.44700  1.000 25.93497 ?  189 TRP A CZ2 1 
ATOM   1386 C CZ3 . TRP A 1 209 ? -25.33300 0.84500   17.08900  1.000 23.13512 ?  189 TRP A CZ3 1 
ATOM   1387 C CH2 . TRP A 1 209 ? -25.96500 0.80700   15.84500  1.000 22.82962 ?  189 TRP A CH2 1 
ATOM   1388 N N   . ILE A 1 210 ? -24.40700 -5.47600  21.14400  1.000 21.58597 ?  190 ILE A N   1 
ATOM   1389 C CA  . ILE A 1 210 ? -23.60000 -5.76200  22.33100  1.000 20.70380 ?  190 ILE A CA  1 
ATOM   1390 C C   . ILE A 1 210 ? -22.52500 -4.71200  22.56800  1.000 21.68085 ?  190 ILE A C   1 
ATOM   1391 O O   . ILE A 1 210 ? -21.83100 -4.76500  23.59300  1.000 20.81819 ?  190 ILE A O   1 
ATOM   1392 C CB  . ILE A 1 210 ? -22.97700 -7.17300  22.28300  1.000 23.20168 ?  190 ILE A CB  1 
ATOM   1393 C CG1 . ILE A 1 210 ? -21.97800 -7.27700  21.12700  1.000 19.96096 ?  190 ILE A CG1 1 
ATOM   1394 C CG2 . ILE A 1 210 ? -24.06300 -8.24100  22.19200  1.000 23.51814 ?  190 ILE A CG2 1 
ATOM   1395 C CD1 . ILE A 1 210 ? -21.01400 -8.47300  21.24800  1.000 22.45338 ?  190 ILE A CD1 1 
ATOM   1396 N N   . GLY A 1 211 ? -22.36300 -3.76500  21.65300  1.000 19.11493 ?  191 GLY A N   1 
ATOM   1397 C CA  . GLY A 1 211 ? -21.41700 -2.67900  21.82400  1.000 22.34739 ?  191 GLY A CA  1 
ATOM   1398 C C   . GLY A 1 211 ? -21.70200 -1.63300  20.77200  1.000 18.78320 ?  191 GLY A C   1 
ATOM   1399 O O   . GLY A 1 211 ? -22.66300 -1.73800  20.00700  1.000 20.52342 ?  191 GLY A O   1 
ATOM   1400 N N   . GLY A 1 212 ? -20.83800 -0.61900  20.73600  1.000 19.37166 ?  192 GLY A N   1 
ATOM   1401 C CA  . GLY A 1 212 ? -21.02000 0.48200   19.80800  1.000 19.19382 ?  192 GLY A CA  1 
ATOM   1402 C C   . GLY A 1 212 ? -21.95100 1.56200   20.30700  1.000 18.72706 ?  192 GLY A C   1 
ATOM   1403 O O   . GLY A 1 212 ? -22.66100 2.18100   19.50600  1.000 20.56046 ?  192 GLY A O   1 
ATOM   1404 N N   . PHE A 1 213 ? -21.97700 1.80000   21.61400  1.000 21.16899 ?  193 PHE A N   1 
ATOM   1405 C CA  . PHE A 1 213 ? -22.85200 2.81100   22.18900  1.000 23.31896 ?  193 PHE A CA  1 
ATOM   1406 C C   . PHE A 1 213 ? -22.28500 3.21800   23.53900  1.000 20.39721 ?  193 PHE A C   1 
ATOM   1407 O O   . PHE A 1 213 ? -21.36100 2.59400   24.06500  1.000 20.94109 ?  193 PHE A O   1 
ATOM   1408 C CB  . PHE A 1 213 ? -24.27900 2.27800   22.35600  1.000 22.75354 ?  193 PHE A CB  1 
ATOM   1409 C CG  . PHE A 1 213 ? -24.34500 0.95900   23.06600  1.000 24.79926 ?  193 PHE A CG  1 
ATOM   1410 C CD1 . PHE A 1 213 ? -24.16100 0.88500   24.43700  1.000 24.30110 ?  193 PHE A CD1 1 
ATOM   1411 C CD2 . PHE A 1 213 ? -24.58000 -0.20800  22.36100  1.000 24.05847 ?  193 PHE A CD2 1 
ATOM   1412 C CE1 . PHE A 1 213 ? -24.21400 -0.34100  25.09700  1.000 29.70714 ?  193 PHE A CE1 1 
ATOM   1413 C CE2 . PHE A 1 213 ? -24.63500 -1.43100  23.00900  1.000 27.67298 ?  193 PHE A CE2 1 
ATOM   1414 C CZ  . PHE A 1 213 ? -24.45300 -1.49700  24.37500  1.000 26.69272 ?  193 PHE A CZ  1 
ATOM   1415 N N   . GLU A 1 214 ? -22.85800 4.27600   24.10000  1.000 24.19185 ?  194 GLU A N   1 
ATOM   1416 C CA  . GLU A 1 214 ? -22.49900 4.70900   25.43900  1.000 29.44939 ?  194 GLU A CA  1 
ATOM   1417 C C   . GLU A 1 214 ? -23.51400 4.18400   26.45000  1.000 28.37618 ?  194 GLU A C   1 
ATOM   1418 O O   . GLU A 1 214 ? -24.70000 4.02600   26.14500  1.000 30.08556 ?  194 GLU A O   1 
ATOM   1419 C CB  . GLU A 1 214 ? -22.45600 6.23300   25.50700  1.000 27.23148 ?  194 GLU A CB  1 
ATOM   1420 C CG  . GLU A 1 214 ? -21.07500 6.77800   25.25900  1.000 28.09830 ?  194 GLU A CG  1 
ATOM   1421 C CD  . GLU A 1 214 ? -20.94900 8.23800   25.62300  1.000 38.06716 ?  194 GLU A CD  1 
ATOM   1422 O OE1 . GLU A 1 214 ? -21.95900 8.84200   26.05700  1.000 32.78856 ?  194 GLU A OE1 1 
ATOM   1423 O OE2 . GLU A 1 214 ? -19.83800 8.78100   25.46100  1.000 36.28989 -1 194 GLU A OE2 1 
ATOM   1424 N N   . ARG A 1 215 ? -23.02300 3.89800   27.65500  1.000 35.58793 ?  195 ARG A N   1 
ATOM   1425 C CA  . ARG A 1 215 ? -23.85500 3.45100   28.77100  1.000 41.92836 ?  195 ARG A CA  1 
ATOM   1426 C C   . ARG A 1 215 ? -23.32600 4.13800   30.02300  1.000 34.84545 ?  195 ARG A C   1 
ATOM   1427 O O   . ARG A 1 215 ? -22.20200 3.86700   30.45600  1.000 43.78020 ?  195 ARG A O   1 
ATOM   1428 C CB  . ARG A 1 215 ? -23.80400 1.92800   28.90400  1.000 38.00309 ?  195 ARG A CB  1 
ATOM   1429 C CG  . ARG A 1 215 ? -24.96000 1.31300   29.68000  1.000 42.53683 ?  195 ARG A CG  1 
ATOM   1430 C CD  . ARG A 1 215 ? -24.59100 -0.07100  30.18500  1.000 42.28279 ?  195 ARG A CD  1 
ATOM   1431 N NE  . ARG A 1 215 ? -24.90700 -1.09500  29.19600  1.000 48.27522 ?  195 ARG A NE  1 
ATOM   1432 C CZ  . ARG A 1 215 ? -24.06200 -2.03800  28.80100  1.000 39.09355 ?  195 ARG A CZ  1 
ATOM   1433 N NH1 . ARG A 1 215 ? -22.83600 -2.11200  29.29000  1.000 45.10563 ?  195 ARG A NH1 1 
ATOM   1434 N NH2 . ARG A 1 215 ? -24.45400 -2.92200  27.88500  1.000 39.37613 ?  195 ARG A NH2 1 
ATOM   1435 N N   . ASN A 1 216 ? -24.11900 5.06000   30.57800  1.000 49.88263 ?  196 ASN A N   1 
ATOM   1436 C CA  . ASN A 1 216 ? -23.70200 5.87500   31.72500  1.000 40.78521 ?  196 ASN A CA  1 
ATOM   1437 C C   . ASN A 1 216 ? -22.49100 6.74600   31.39800  1.000 47.80934 ?  196 ASN A C   1 
ATOM   1438 O O   . ASN A 1 216 ? -21.53900 6.83600   32.17600  1.000 46.92526 ?  196 ASN A O   1 
ATOM   1439 C CB  . ASN A 1 216 ? -23.45200 5.02500   32.97200  1.000 51.65287 ?  196 ASN A CB  1 
ATOM   1440 N N   . GLY A 1 217 ? -22.52800 7.40200   30.24000  1.000 43.69437 ?  197 GLY A N   1 
ATOM   1441 C CA  . GLY A 1 217 ? -21.41200 8.22500   29.82800  1.000 37.02972 ?  197 GLY A CA  1 
ATOM   1442 C C   . GLY A 1 217 ? -20.11800 7.48600   29.58300  1.000 43.64535 ?  197 GLY A C   1 
ATOM   1443 O O   . GLY A 1 217 ? -19.07800 8.13200   29.42400  1.000 43.88835 ?  197 GLY A O   1 
ATOM   1444 N N   . GLN A 1 218 ? -20.14400 6.14900   29.56600  1.000 34.86704 ?  198 GLN A N   1 
ATOM   1445 C CA  . GLN A 1 218 ? -18.97200 5.34400   29.29200  1.000 41.19689 ?  198 GLN A CA  1 
ATOM   1446 C C   . GLN A 1 218 ? -19.14100 4.65200   27.95100  1.000 27.38216 ?  198 GLN A C   1 
ATOM   1447 O O   . GLN A 1 218 ? -20.20500 4.07200   27.68900  1.000 31.45102 ?  198 GLN A O   1 
ATOM   1448 C CB  . GLN A 1 218 ? -18.80000 4.28900   30.39300  1.000 37.76565 ?  198 GLN A CB  1 
ATOM   1449 N N   . PRO A 1 219 ? -18.13100 4.68900   27.08600  1.000 33.21141 ?  199 PRO A N   1 
ATOM   1450 C CA  . PRO A 1 219 ? -18.22300 3.94200   25.82800  1.000 22.04194 ?  199 PRO A CA  1 
ATOM   1451 C C   . PRO A 1 219 ? -18.20800 2.44400   26.09700  1.000 25.17550 ?  199 PRO A C   1 
ATOM   1452 O O   . PRO A 1 219 ? -17.45300 1.94900   26.93700  1.000 29.31964 ?  199 PRO A O   1 
ATOM   1453 C CB  . PRO A 1 219 ? -16.96200 4.36900   25.06500  1.000 27.33968 ?  199 PRO A CB  1 
ATOM   1454 C CG  . PRO A 1 219 ? -16.44600 5.58800   25.77000  1.000 39.83557 ?  199 PRO A CG  1 
ATOM   1455 C CD  . PRO A 1 219 ? -16.86900 5.43700   27.19700  1.000 37.13796 ?  199 PRO A CD  1 
ATOM   1456 N N   . VAL A 1 220 ? -19.06600 1.72700   25.38300  1.000 21.87057 ?  200 VAL A N   1 
ATOM   1457 C CA  . VAL A 1 220 ? -19.08000 0.26600   25.39300  1.000 19.27564 ?  200 VAL A CA  1 
ATOM   1458 C C   . VAL A 1 220 ? -18.73600 -0.14400  23.96700  1.000 19.82534 ?  200 VAL A C   1 
ATOM   1459 O O   . VAL A 1 220 ? -19.56800 -0.03000  23.05700  1.000 21.06269 ?  200 VAL A O   1 
ATOM   1460 C CB  . VAL A 1 220 ? -20.43600 -0.29900  25.82800  1.000 22.31303 ?  200 VAL A CB  1 
ATOM   1461 C CG1 . VAL A 1 220 ? -20.43200 -1.83600  25.75100  1.000 22.83230 ?  200 VAL A CG1 1 
ATOM   1462 C CG2 . VAL A 1 220 ? -20.78400 0.17500   27.23000  1.000 28.15123 ?  200 VAL A CG2 1 
ATOM   1463 N N   . ARG A 1 221 ? -17.50500 -0.59800  23.76300  1.000 19.68168 ?  201 ARG A N   1 
ATOM   1464 C CA  . ARG A 1 221 ? -17.06100 -1.05800  22.46100  1.000 20.10383 ?  201 ARG A CA  1 
ATOM   1465 C C   . ARG A 1 221 ? -17.54700 -2.48200  22.22400  1.000 19.55515 ?  201 ARG A C   1 
ATOM   1466 O O   . ARG A 1 221 ? -17.84300 -3.22500  23.16200  1.000 19.76581 ?  201 ARG A O   1 
ATOM   1467 C CB  . ARG A 1 221 ? -15.53400 -1.02200  22.41400  1.000 22.21278 ?  201 ARG A CB  1 
ATOM   1468 C CG  . ARG A 1 221 ? -14.97100 0.38800   22.39600  1.000 24.22419 ?  201 ARG A CG  1 
ATOM   1469 C CD  . ARG A 1 221 ? -15.11900 0.95400   21.00000  1.000 27.10140 ?  201 ARG A CD  1 
ATOM   1470 N NE  . ARG A 1 221 ? -14.31800 2.15400   20.79700  1.000 40.27826 ?  201 ARG A NE  1 
ATOM   1471 C CZ  . ARG A 1 221 ? -14.00200 2.63800   19.60400  1.000 39.48908 ?  201 ARG A CZ  1 
ATOM   1472 N NH1 . ARG A 1 221 ? -14.31600 1.99100   18.49400  1.000 31.69110 ?  201 ARG A NH1 1 
ATOM   1473 N NH2 . ARG A 1 221 ? -13.34500 3.79300   19.52400  1.000 33.73380 ?  201 ARG A NH2 1 
ATOM   1474 N N   . MET A 1 222 ? -17.64800 -2.85600  20.94500  1.000 18.30025 ?  202 MET A N   1 
ATOM   1475 C CA  . MET A 1 222 ? -17.97200 -4.24500  20.61900  1.000 18.63906 ?  202 MET A CA  1 
ATOM   1476 C C   . MET A 1 222 ? -17.06700 -5.21600  21.35800  1.000 19.90940 ?  202 MET A C   1 
ATOM   1477 O O   . MET A 1 222 ? -17.51500 -6.27500  21.82100  1.000 18.59334 ?  202 MET A O   1 
ATOM   1478 C CB  . MET A 1 222 ? -17.85200 -4.47000  19.11100  1.000 19.33393 ?  202 MET A CB  1 
ATOM   1479 C CG  . MET A 1 222 ? -19.04200 -3.96500  18.33800  1.000 21.90503 ?  202 MET A CG  1 
ATOM   1480 S SD  . MET A 1 222 ? -20.50100 -4.86600  18.83800  1.000 23.89800 ?  202 MET A SD  1 
ATOM   1481 C CE  . MET A 1 222 ? -20.21200 -6.44500  18.00300  1.000 24.20273 ?  202 MET A CE  1 
ATOM   1482 N N   . LEU A 1 223 ? -15.78500 -4.88300  21.47500  1.000 17.19661 ?  203 LEU A N   1 
ATOM   1483 C CA  . LEU A 1 223 ? -14.87400 -5.78800  22.16100  1.000 18.54095 ?  203 LEU A CA  1 
ATOM   1484 C C   . LEU A 1 223 ? -15.24300 -5.92400  23.63500  1.000 18.94146 ?  203 LEU A C   1 
ATOM   1485 O O   . LEU A 1 223 ? -15.14400 -7.02000  24.20300  1.000 18.26089 ?  203 LEU A O   1 
ATOM   1486 C CB  . LEU A 1 223 ? -13.42800 -5.33100  21.98500  1.000 21.83741 ?  203 LEU A CB  1 
ATOM   1487 C CG  . LEU A 1 223 ? -12.38300 -6.25100  22.62200  1.000 23.91059 ?  203 LEU A CG  1 
ATOM   1488 C CD1 . LEU A 1 223 ? -12.46000 -7.66000  22.01300  1.000 21.70826 ?  203 LEU A CD1 1 
ATOM   1489 C CD2 . LEU A 1 223 ? -10.98700 -5.65300  22.46600  1.000 24.75054 ?  203 LEU A CD2 1 
ATOM   1490 N N   . ASP A 1 224 ? -15.67700 -4.82800  24.27300  1.000 18.90385 ?  204 ASP A N   1 
ATOM   1491 C CA  . ASP A 1 224 ? -16.18900 -4.92200  25.64300  1.000 19.12272 ?  204 ASP A CA  1 
ATOM   1492 C C   . ASP A 1 224 ? -17.40200 -5.84000  25.71800  1.000 20.24595 ?  204 ASP A C   1 
ATOM   1493 O O   . ASP A 1 224 ? -17.55600 -6.60200  26.68100  1.000 20.04069 ?  204 ASP A O   1 
ATOM   1494 C CB  . ASP A 1 224 ? -16.58600 -3.53900  26.16500  1.000 20.49038 ?  204 ASP A CB  1 
ATOM   1495 C CG  . ASP A 1 224 ? -15.42700 -2.57100  26.21900  1.000 26.56166 ?  204 ASP A CG  1 
ATOM   1496 O OD1 . ASP A 1 224 ? -14.33000 -2.97000  26.65400  1.000 28.69588 ?  204 ASP A OD1 1 
ATOM   1497 O OD2 . ASP A 1 224 ? -15.62500 -1.39600  25.83500  1.000 28.47114 -1 204 ASP A OD2 1 
ATOM   1498 N N   . GLY A 1 225 ? -18.30300 -5.73700  24.74200  1.000 18.11140 ?  205 GLY A N   1 
ATOM   1499 C CA  . GLY A 1 225 ? -19.44000 -6.63900  24.69500  1.000 18.08231 ?  205 GLY A CA  1 
ATOM   1500 C C   . GLY A 1 225 ? -19.02300 -8.09300  24.57300  1.000 20.91237 ?  205 GLY A C   1 
ATOM   1501 O O   . GLY A 1 225 ? -19.57300 -8.96800  25.25000  1.000 20.35216 ?  205 GLY A O   1 
ATOM   1502 N N   . LEU A 1 226 ? -18.04500 -8.37400  23.70600  1.000 17.78370 ?  206 LEU A N   1 
ATOM   1503 C CA  . LEU A 1 226 ? -17.53600 -9.73700  23.58800  1.000 18.63487 ?  206 LEU A CA  1 
ATOM   1504 C C   . LEU A 1 226 ? -16.98400 -10.23700 24.92000  1.000 17.23388 ?  206 LEU A C   1 
ATOM   1505 O O   . LEU A 1 226 ? -17.25800 -11.37300 25.32400  1.000 17.24654 ?  206 LEU A O   1 
ATOM   1506 C CB  . LEU A 1 226 ? -16.45500 -9.78500  22.51100  1.000 17.58096 ?  206 LEU A CB  1 
ATOM   1507 C CG  . LEU A 1 226 ? -16.95600 -9.62500  21.07000  1.000 18.00355 ?  206 LEU A CG  1 
ATOM   1508 C CD1 . LEU A 1 226 ? -15.78500 -9.57900  20.10000  1.000 19.15609 ?  206 LEU A CD1 1 
ATOM   1509 C CD2 . LEU A 1 226 ? -17.92200 -10.74800 20.69200  1.000 19.58450 ?  206 LEU A CD2 1 
ATOM   1510 N N   . ARG A 1 227 ? -16.21000 -9.40400  25.62600  1.000 16.99367 ?  207 ARG A N   1 
ATOM   1511 C CA  . ARG A 1 227 ? -15.66100 -9.82800  26.91200  1.000 18.23884 ?  207 ARG A CA  1 
ATOM   1512 C C   . ARG A 1 227 ? -16.77200 -10.12400 27.91000  1.000 20.40922 ?  207 ARG A C   1 
ATOM   1513 O O   . ARG A 1 227 ? -16.71100 -11.12100 28.64700  1.000 18.63874 ?  207 ARG A O   1 
ATOM   1514 C CB  . ARG A 1 227 ? -14.75800 -8.73800  27.48300  1.000 21.93731 ?  207 ARG A CB  1 
ATOM   1515 C CG  . ARG A 1 227 ? -13.42100 -8.56400  26.80000  1.000 21.91617 ?  207 ARG A CG  1 
ATOM   1516 C CD  . ARG A 1 227 ? -12.71300 -7.39500  27.47300  1.000 30.19321 ?  207 ARG A CD  1 
ATOM   1517 N NE  . ARG A 1 227 ? -11.34300 -7.18700  27.02500  1.000 39.90552 ?  207 ARG A NE  1 
ATOM   1518 C CZ  . ARG A 1 227 ? -10.26300 -7.52500  27.71700  1.000 46.11275 ?  207 ARG A CZ  1 
ATOM   1519 N NH1 . ARG A 1 227 ? -10.35100 -8.22400  28.83800  1.000 46.01433 ?  207 ARG A NH1 1 
ATOM   1520 N NH2 . ARG A 1 227 ? -9.06600  -7.15500  27.27300  1.000 37.65445 ?  207 ARG A NH2 1 
ATOM   1521 N N   . HIS A 1 228 ? -17.78900 -9.26100  27.96000  1.000 18.83811 ?  208 HIS A N   1 
ATOM   1522 C CA  . HIS A 1 228 ? -18.88200 -9.45500  28.90400  1.000 19.20017 ?  208 HIS A CA  1 
ATOM   1523 C C   . HIS A 1 228 ? -19.56400 -10.80000 28.68500  1.000 21.38767 ?  208 HIS A C   1 
ATOM   1524 O O   . HIS A 1 228 ? -19.87300 -11.51300 29.65000  1.000 23.00051 ?  208 HIS A O   1 
ATOM   1525 C CB  . HIS A 1 228 ? -19.88700 -8.31600  28.75700  1.000 20.49068 ?  208 HIS A CB  1 
ATOM   1526 C CG  . HIS A 1 228 ? -21.19200 -8.57100  29.43800  1.000 22.45542 ?  208 HIS A CG  1 
ATOM   1527 N ND1 . HIS A 1 228 ? -21.34100 -8.48000  30.80600  1.000 32.72321 ?  208 HIS A ND1 1 
ATOM   1528 C CD2 . HIS A 1 228 ? -22.41000 -8.90200  28.94700  1.000 29.97915 ?  208 HIS A CD2 1 
ATOM   1529 C CE1 . HIS A 1 228 ? -22.59400 -8.75100  31.12800  1.000 29.90846 ?  208 HIS A CE1 1 
ATOM   1530 N NE2 . HIS A 1 228 ? -23.26300 -9.01000  30.01900  1.000 31.19677 ?  208 HIS A NE2 1 
ATOM   1531 N N   . HIS A 1 229 ? -19.78200 -11.17600 27.42500  1.000 17.83631 ?  209 HIS A N   1 
ATOM   1532 C CA  . HIS A 1 229 ? -20.52200 -12.39600 27.13500  1.000 17.64730 ?  209 HIS A CA  1 
ATOM   1533 C C   . HIS A 1 229 ? -19.65800 -13.64400 27.20700  1.000 20.13726 ?  209 HIS A C   1 
ATOM   1534 O O   . HIS A 1 229 ? -20.18700 -14.73200 27.46100  1.000 22.91485 ?  209 HIS A O   1 
ATOM   1535 C CB  . HIS A 1 229 ? -21.20000 -12.31300 25.76300  1.000 18.32997 ?  209 HIS A CB  1 
ATOM   1536 C CG  . HIS A 1 229 ? -22.36300 -11.37500 25.72900  1.000 22.75771 ?  209 HIS A CG  1 
ATOM   1537 N ND1 . HIS A 1 229 ? -23.66900 -11.80900 25.82100  1.000 31.28266 ?  209 HIS A ND1 1 
ATOM   1538 C CD2 . HIS A 1 229 ? -22.42300 -10.02800 25.58000  1.000 19.34518 ?  209 HIS A CD2 1 
ATOM   1539 C CE1 . HIS A 1 229 ? -24.48100 -10.76800 25.75800  1.000 33.83026 ?  209 HIS A CE1 1 
ATOM   1540 N NE2 . HIS A 1 229 ? -23.75100 -9.67500  25.61600  1.000 26.10102 ?  209 HIS A NE2 1 
ATOM   1541 N N   . LEU A 1 230 ? -18.34700 -13.52600 27.00300  1.000 16.36557 ?  210 LEU A N   1 
ATOM   1542 C CA  . LEU A 1 230 ? -17.49700 -14.70600 26.85600  1.000 18.13009 ?  210 LEU A CA  1 
ATOM   1543 C C   . LEU A 1 230 ? -16.66300 -15.03900 28.09000  1.000 18.91450 ?  210 LEU A C   1 
ATOM   1544 O O   . LEU A 1 230 ? -16.32600 -16.21600 28.29100  1.000 18.80163 ?  210 LEU A O   1 
ATOM   1545 C CB  . LEU A 1 230 ? -16.57300 -14.57100 25.63300  1.000 17.60159 ?  210 LEU A CB  1 
ATOM   1546 C CG  . LEU A 1 230 ? -17.26000 -14.55100 24.26900  1.000 15.36411 ?  210 LEU A CG  1 
ATOM   1547 C CD1 . LEU A 1 230 ? -16.25000 -14.20100 23.18600  1.000 16.81020 ?  210 LEU A CD1 1 
ATOM   1548 C CD2 . LEU A 1 230 ? -17.90900 -15.91300 24.00700  1.000 17.99980 ?  210 LEU A CD2 1 
ATOM   1549 N N   . GLU A 1 231 ? -16.29700 -14.03400 28.91100  1.000 18.40567 ?  211 GLU A N   1 
ATOM   1550 C CA  . GLU A 1 231 ? -15.50500 -14.28200 30.10600  1.000 19.48181 ?  211 GLU A CA  1 
ATOM   1551 C C   . GLU A 1 231 ? -16.42400 -14.73900 31.24000  1.000 21.47333 ?  211 GLU A C   1 
ATOM   1552 O O   . GLU A 1 231 ? -17.59400 -14.35200 31.28900  1.000 22.46530 ?  211 GLU A O   1 
ATOM   1553 C CB  . GLU A 1 231 ? -14.78600 -12.99900 30.52500  1.000 21.09630 ?  211 GLU A CB  1 
ATOM   1554 C CG  . GLU A 1 231 ? -13.79900 -12.47000 29.48000  1.000 21.31591 ?  211 GLU A CG  1 
ATOM   1555 C CD  . GLU A 1 231 ? -13.15600 -11.13800 29.87000  1.000 26.48086 ?  211 GLU A CD  1 
ATOM   1556 O OE1 . GLU A 1 231 ? -13.70600 -10.43100 30.74400  1.000 25.66069 ?  211 GLU A OE1 1 
ATOM   1557 O OE2 . GLU A 1 231 ? -12.10400 -10.79400 29.28600  1.000 25.77366 -1 211 GLU A OE2 1 
ATOM   1558 N N   . PRO A 1 232 ? -15.92500 -15.57400 32.16300  1.000 19.24619 ?  212 PRO A N   1 
ATOM   1559 C CA  . PRO A 1 232 ? -14.58300 -16.15100 32.26100  1.000 17.38419 ?  212 PRO A CA  1 
ATOM   1560 C C   . PRO A 1 232 ? -14.45900 -17.50400 31.57500  1.000 18.19882 ?  212 PRO A C   1 
ATOM   1561 O O   . PRO A 1 232 ? -13.39200 -18.12200 31.62600  1.000 18.96632 ?  212 PRO A O   1 
ATOM   1562 C CB  . PRO A 1 232 ? -14.41100 -16.28600 33.78300  1.000 21.67946 ?  212 PRO A CB  1 
ATOM   1563 C CG  . PRO A 1 232 ? -15.77300 -16.72500 34.22000  1.000 20.20979 ?  212 PRO A CG  1 
ATOM   1564 C CD  . PRO A 1 232 ? -16.74600 -15.96100 33.32900  1.000 20.84181 ?  212 PRO A CD  1 
ATOM   1565 N N   . ASP A 1 233 ? -15.52500 -18.00800 30.93900  1.000 19.52502 ?  213 ASP A N   1 
ATOM   1566 C CA  . ASP A 1 233 ? -15.42700 -19.27900 30.22400  1.000 18.83092 ?  213 ASP A CA  1 
ATOM   1567 C C   . ASP A 1 233 ? -14.29500 -19.25700 29.20700  1.000 18.42961 ?  213 ASP A C   1 
ATOM   1568 O O   . ASP A 1 233 ? -13.62700 -20.27500 28.98300  1.000 17.75261 ?  213 ASP A O   1 
ATOM   1569 C CB  . ASP A 1 233 ? -16.74700 -19.59800 29.52700  1.000 17.65386 ?  213 ASP A CB  1 
ATOM   1570 C CG  . ASP A 1 233 ? -17.92100 -19.60200 30.47300  1.000 23.27116 ?  213 ASP A CG  1 
ATOM   1571 O OD1 . ASP A 1 233 ? -18.25300 -18.54100 31.04100  1.000 24.42257 ?  213 ASP A OD1 1 
ATOM   1572 O OD2 . ASP A 1 233 ? -18.50800 -20.69800 30.64500  1.000 29.32737 -1 213 ASP A OD2 1 
ATOM   1573 N N   . PHE A 1 234 ? -14.07200 -18.10400 28.57700  1.000 17.36233 ?  214 PHE A N   1 
ATOM   1574 C CA  . PHE A 1 234 ? -12.96700 -17.89800 27.65500  1.000 16.82990 ?  214 PHE A CA  1 
ATOM   1575 C C   . PHE A 1 234 ? -12.05200 -16.83800 28.24600  1.000 17.68501 ?  214 PHE A C   1 
ATOM   1576 O O   . PHE A 1 234 ? -12.50100 -15.95500 28.98700  1.000 19.20103 ?  214 PHE A O   1 
ATOM   1577 C CB  . PHE A 1 234 ? -13.47000 -17.38500 26.29000  1.000 16.61128 ?  214 PHE A CB  1 
ATOM   1578 C CG  . PHE A 1 234 ? -14.18300 -18.43000 25.47100  1.000 14.01962 ?  214 PHE A CG  1 
ATOM   1579 C CD1 . PHE A 1 234 ? -13.47300 -19.32100 24.66100  1.000 14.86696 ?  214 PHE A CD1 1 
ATOM   1580 C CD2 . PHE A 1 234 ? -15.56900 -18.53200 25.51900  1.000 16.69897 ?  214 PHE A CD2 1 
ATOM   1581 C CE1 . PHE A 1 234 ? -14.13000 -20.27300 23.89600  1.000 15.74826 ?  214 PHE A CE1 1 
ATOM   1582 C CE2 . PHE A 1 234 ? -16.23500 -19.49500 24.75900  1.000 16.41354 ?  214 PHE A CE2 1 
ATOM   1583 C CZ  . PHE A 1 234 ? -15.51400 -20.36500 23.94400  1.000 16.13742 ?  214 PHE A CZ  1 
ATOM   1584 N N   . VAL A 1 235 ? -10.76800 -16.93900 27.91200  1.000 19.27789 ?  215 VAL A N   1 
ATOM   1585 C CA  . VAL A 1 235 ? -9.76600  -15.95000 28.28900  1.000 18.75602 ?  215 VAL A CA  1 
ATOM   1586 C C   . VAL A 1 235 ? -9.25100  -15.30400 27.00900  1.000 18.38884 ?  215 VAL A C   1 
ATOM   1587 O O   . VAL A 1 235 ? -8.74200  -15.99600 26.12200  1.000 18.09968 ?  215 VAL A O   1 
ATOM   1588 C CB  . VAL A 1 235 ? -8.61400  -16.59300 29.07200  1.000 20.20384 ?  215 VAL A CB  1 
ATOM   1589 C CG1 . VAL A 1 235 ? -7.52100  -15.56300 29.31800  1.000 23.50436 ?  215 VAL A CG1 1 
ATOM   1590 C CG2 . VAL A 1 235 ? -9.13000  -17.15200 30.38800  1.000 23.74559 ?  215 VAL A CG2 1 
ATOM   1591 N N   . LEU A 1 236 ? -9.37100  -13.98200 26.92200  1.000 17.73379 ?  216 LEU A N   1 
ATOM   1592 C CA  . LEU A 1 236 ? -8.86700  -13.26800 25.75400  1.000 17.78035 ?  216 LEU A CA  1 
ATOM   1593 C C   . LEU A 1 236 ? -7.34600  -13.33400 25.72500  1.000 21.40646 ?  216 LEU A C   1 
ATOM   1594 O O   . LEU A 1 236 ? -6.68100  -13.00400 26.71800  1.000 23.69953 ?  216 LEU A O   1 
ATOM   1595 C CB  . LEU A 1 236 ? -9.31100  -11.80900 25.81300  1.000 19.42183 ?  216 LEU A CB  1 
ATOM   1596 C CG  . LEU A 1 236 ? -8.79800  -10.93000 24.66800  1.000 17.93885 ?  216 LEU A CG  1 
ATOM   1597 C CD1 . LEU A 1 236 ? -9.31300  -11.41000 23.31500  1.000 18.87638 ?  216 LEU A CD1 1 
ATOM   1598 C CD2 . LEU A 1 236 ? -9.18400  -9.47100  24.90500  1.000 21.44945 ?  216 LEU A CD2 1 
ATOM   1599 N N   . LEU A 1 237 ? -6.79200  -13.75300 24.58800  1.000 20.33382 ?  217 LEU A N   1 
ATOM   1600 C CA  . LEU A 1 237 ? -5.34300  -13.78700 24.37700  1.000 21.35547 ?  217 LEU A CA  1 
ATOM   1601 C C   . LEU A 1 237 ? -4.92000  -12.41000 23.87800  1.000 22.48409 ?  217 LEU A C   1 
ATOM   1602 O O   . LEU A 1 237 ? -5.09400  -12.08100 22.70400  1.000 24.58227 ?  217 LEU A O   1 
ATOM   1603 C CB  . LEU A 1 237 ? -4.96700  -14.88100 23.38200  1.000 23.16717 ?  217 LEU A CB  1 
ATOM   1604 C CG  . LEU A 1 237 ? -5.40400  -16.30300 23.74500  1.000 22.78318 ?  217 LEU A CG  1 
ATOM   1605 C CD1 . LEU A 1 237 ? -5.12600  -17.27800 22.62300  1.000 26.39790 ?  217 LEU A CD1 1 
ATOM   1606 C CD2 . LEU A 1 237 ? -4.70700  -16.75700 25.01600  1.000 21.88588 ?  217 LEU A CD2 1 
ATOM   1607 N N   . GLU A 1 238 ? -4.36600  -11.60200 24.76300  1.000 26.23678 ?  218 GLU A N   1 
ATOM   1608 C CA  . GLU A 1 238 ? -4.07300  -10.22700 24.39700  1.000 24.88014 ?  218 GLU A CA  1 
ATOM   1609 C C   . GLU A 1 238 ? -2.73100  -10.13000 23.67800  1.000 28.77893 ?  218 GLU A C   1 
ATOM   1610 O O   . GLU A 1 238 ? -1.83200  -10.94200 23.90700  1.000 33.13059 ?  218 GLU A O   1 
ATOM   1611 C CB  . GLU A 1 238 ? -4.04800  -9.34500  25.64000  1.000 31.10244 ?  218 GLU A CB  1 
ATOM   1612 C CG  . GLU A 1 238 ? -5.31500  -8.52600  25.82500  1.000 36.64753 ?  218 GLU A CG  1 
ATOM   1613 C CD  . GLU A 1 238 ? -5.95100  -8.72800  27.18100  1.000 48.16591 ?  218 GLU A CD  1 
ATOM   1614 O OE2 . GLU A 1 238 ? -6.31000  -7.71400  27.81500  1.000 43.92224 -1 218 GLU A OE2 1 
ATOM   1615 N N   . PRO A 1 239 ? -2.57900  -9.14500  22.78400  1.000 24.48993 ?  219 PRO A N   1 
ATOM   1616 C CA  . PRO A 1 239 ? -3.57400  -8.14800  22.38300  1.000 21.36229 ?  219 PRO A CA  1 
ATOM   1617 C C   . PRO A 1 239 ? -4.39700  -8.63400  21.19600  1.000 18.57849 ?  219 PRO A C   1 
ATOM   1618 O O   . PRO A 1 239 ? -4.02700  -9.58500  20.51300  1.000 21.17225 ?  219 PRO A O   1 
ATOM   1619 C CB  . PRO A 1 239 ? -2.68700  -6.97200  21.96400  1.000 24.15832 ?  219 PRO A CB  1 
ATOM   1620 C CG  . PRO A 1 239 ? -1.53100  -7.65700  21.27800  1.000 28.57430 ?  219 PRO A CG  1 
ATOM   1621 C CD  . PRO A 1 239 ? -1.31200  -8.95700  22.05100  1.000 31.19283 ?  219 PRO A CD  1 
ATOM   1622 N N   . THR A 1 240 ? -5.52400  -7.97700  20.92300  1.000 18.57698 ?  220 THR A N   1 
ATOM   1623 C CA  . THR A 1 240 ? -6.19600  -8.21900  19.65700  1.000 15.95687 ?  220 THR A CA  1 
ATOM   1624 C C   . THR A 1 240 ? -5.30800  -7.71600  18.52100  1.000 20.13420 ?  220 THR A C   1 
ATOM   1625 O O   . THR A 1 240 ? -4.34400  -6.97600  18.73400  1.000 21.00263 ?  220 THR A O   1 
ATOM   1626 C CB  . THR A 1 240 ? -7.53100  -7.48800  19.61800  1.000 16.88619 ?  220 THR A CB  1 
ATOM   1627 O OG1 . THR A 1 240 ? -7.31500  -6.08800  19.85700  1.000 20.12950 ?  220 THR A OG1 1 
ATOM   1628 C CG2 . THR A 1 240 ? -8.46700  -8.02900  20.70100  1.000 19.61557 ?  220 THR A CG2 1 
ATOM   1629 N N   . ARG A 1 241 ? -5.64500  -8.12800  17.29800  1.000 18.08922 ?  221 ARG A N   1 
ATOM   1630 C CA  . ARG A 1 241 ? -4.83900  -7.83600  16.11900  1.000 19.39274 ?  221 ARG A CA  1 
ATOM   1631 C C   . ARG A 1 241 ? -5.73100  -7.34400  14.98900  1.000 17.61830 ?  221 ARG A C   1 
ATOM   1632 O O   . ARG A 1 241 ? -6.84200  -7.84800  14.80100  1.000 20.25283 ?  221 ARG A O   1 
ATOM   1633 C CB  . ARG A 1 241 ? -4.09900  -9.09200  15.64300  1.000 23.41010 ?  221 ARG A CB  1 
ATOM   1634 N N   . ASP A 1 242 ? -5.23400  -6.36100  14.23700  1.000 16.36926 ?  222 ASP A N   1 
ATOM   1635 C CA  . ASP A 1 242 ? -5.91000  -5.90100  13.02800  1.000 15.70729 ?  222 ASP A CA  1 
ATOM   1636 C C   . ASP A 1 242 ? -5.53100  -6.79600  11.84500  1.000 19.23601 ?  222 ASP A C   1 
ATOM   1637 O O   . ASP A 1 242 ? -4.35000  -7.10000  11.63400  1.000 19.71299 ?  222 ASP A O   1 
ATOM   1638 C CB  . ASP A 1 242 ? -5.50100  -4.45900  12.72000  1.000 18.86602 ?  222 ASP A CB  1 
ATOM   1639 C CG  . ASP A 1 242 ? -6.21200  -3.44400  13.60000  1.000 19.22389 ?  222 ASP A CG  1 
ATOM   1640 O OD1 . ASP A 1 242 ? -7.23400  -3.78900  14.23600  1.000 21.54882 ?  222 ASP A OD1 1 
ATOM   1641 O OD2 . ASP A 1 242 ? -5.75000  -2.28000  13.63100  1.000 29.71919 -1 222 ASP A OD2 1 
ATOM   1642 N N   . ILE A 1 243 ? -6.53400  -7.22400  11.07900  1.000 15.43453 ?  223 ILE A N   1 
ATOM   1643 C CA  . ILE A 1 243 ? -6.33200  -8.00000  9.85300   1.000 15.03629 ?  223 ILE A CA  1 
ATOM   1644 C C   . ILE A 1 243 ? -7.11800  -7.33200  8.73000   1.000 15.37685 ?  223 ILE A C   1 
ATOM   1645 O O   . ILE A 1 243 ? -8.35600  -7.31700  8.77900   1.000 16.42341 ?  223 ILE A O   1 
ATOM   1646 C CB  . ILE A 1 243 ? -6.76500  -9.46800  10.02400  1.000 16.15569 ?  223 ILE A CB  1 
ATOM   1647 C CG1 . ILE A 1 243 ? -6.11400  -10.11200 11.26300  1.000 16.79771 ?  223 ILE A CG1 1 
ATOM   1648 C CG2 . ILE A 1 243 ? -6.42400  -10.26300 8.76000   1.000 18.22978 ?  223 ILE A CG2 1 
ATOM   1649 C CD1 . ILE A 1 243 ? -6.39400  -11.61500 11.38400  1.000 17.87585 ?  223 ILE A CD1 1 
ATOM   1650 N N   . PRO A 1 244 ? -6.46000  -6.77000  7.72200   1.000 16.58713 ?  224 PRO A N   1 
ATOM   1651 C CA  . PRO A 1 244 ? -7.18200  -6.08000  6.65000   1.000 16.32354 ?  224 PRO A CA  1 
ATOM   1652 C C   . PRO A 1 244 ? -7.70700  -7.04700  5.59800   1.000 14.59681 ?  224 PRO A C   1 
ATOM   1653 O O   . PRO A 1 244 ? -7.24500  -8.18700  5.45100   1.000 15.86402 ?  224 PRO A O   1 
ATOM   1654 C CB  . PRO A 1 244 ? -6.11100  -5.16800  6.04600   1.000 15.91767 ?  224 PRO A CB  1 
ATOM   1655 C CG  . PRO A 1 244 ? -4.83900  -5.93700  6.22100   1.000 17.65410 ?  224 PRO A CG  1 
ATOM   1656 C CD  . PRO A 1 244 ? -4.99700  -6.66100  7.56200   1.000 19.32959 ?  224 PRO A CD  1 
ATOM   1657 N N   . PHE A 1 245 ? -8.70200  -6.56200  4.85200   1.000 15.43138 ?  225 PHE A N   1 
ATOM   1658 C CA  . PHE A 1 245 ? -9.27000  -7.34100  3.75800   1.000 13.83505 ?  225 PHE A CA  1 
ATOM   1659 C C   . PHE A 1 245 ? -9.80500  -6.41900  2.67400   1.000 13.45381 ?  225 PHE A C   1 
ATOM   1660 O O   . PHE A 1 245 ? -10.10200 -5.24500  2.91600   1.000 15.30543 ?  225 PHE A O   1 
ATOM   1661 C CB  . PHE A 1 245 ? -10.32200 -8.36000  4.24300   1.000 15.36958 ?  225 PHE A CB  1 
ATOM   1662 C CG  . PHE A 1 245 ? -11.61300 -7.75900  4.77000   1.000 16.92449 ?  225 PHE A CG  1 
ATOM   1663 C CD1 . PHE A 1 245 ? -12.63200 -7.39500  3.90600   1.000 16.81040 ?  225 PHE A CD1 1 
ATOM   1664 C CD2 . PHE A 1 245 ? -11.82300 -7.61700  6.14200   1.000 17.17245 ?  225 PHE A CD2 1 
ATOM   1665 C CE1 . PHE A 1 245 ? -13.83500 -6.88200  4.38300   1.000 15.45556 ?  225 PHE A CE1 1 
ATOM   1666 C CE2 . PHE A 1 245 ? -13.01900 -7.11600  6.62400   1.000 16.48717 ?  225 PHE A CE2 1 
ATOM   1667 C CZ  . PHE A 1 245 ? -14.02800 -6.74800  5.74600   1.000 16.73708 ?  225 PHE A CZ  1 
ATOM   1668 N N   . VAL A 1 246 ? -9.91400  -6.97400  1.46200   1.000 15.44407 ?  226 VAL A N   1 
ATOM   1669 C CA  . VAL A 1 246 ? -10.39000 -6.23300  0.29800   1.000 14.67752 ?  226 VAL A CA  1 
ATOM   1670 C C   . VAL A 1 246 ? -11.43100 -7.08300  -0.41900  1.000 15.88142 ?  226 VAL A C   1 
ATOM   1671 O O   . VAL A 1 246 ? -11.16800 -8.24800  -0.76200  1.000 17.60474 ?  226 VAL A O   1 
ATOM   1672 C CB  . VAL A 1 246 ? -9.25300  -5.87500  -0.67600  1.000 15.72483 ?  226 VAL A CB  1 
ATOM   1673 C CG1 . VAL A 1 246 ? -9.82500  -5.13700  -1.90000  1.000 16.46462 ?  226 VAL A CG1 1 
ATOM   1674 C CG2 . VAL A 1 246 ? -8.18300  -5.06000  0.00700   1.000 17.70791 ?  226 VAL A CG2 1 
ATOM   1675 N N   . ILE A 1 247 ? -12.61700 -6.51500  -0.62700  1.000 14.21429 ?  227 ILE A N   1 
ATOM   1676 C CA  . ILE A 1 247 ? -13.65700 -7.13700  -1.44000  1.000 16.20359 ?  227 ILE A CA  1 
ATOM   1677 C C   . ILE A 1 247 ? -13.80400 -6.36200  -2.74200  1.000 14.71674 ?  227 ILE A C   1 
ATOM   1678 O O   . ILE A 1 247 ? -13.94200 -5.13100  -2.73800  1.000 15.67266 ?  227 ILE A O   1 
ATOM   1679 C CB  . ILE A 1 247 ? -14.99500 -7.24300  -0.69200  1.000 17.31173 ?  227 ILE A CB  1 
ATOM   1680 C CG1 . ILE A 1 247 ? -14.81200 -8.03900  0.60100   1.000 18.20044 ?  227 ILE A CG1 1 
ATOM   1681 C CG2 . ILE A 1 247 ? -16.04100 -7.92400  -1.57900  1.000 19.88706 ?  227 ILE A CG2 1 
ATOM   1682 C CD1 . ILE A 1 247 ? -16.04600 -8.07800  1.47200   1.000 24.77039 ?  227 ILE A CD1 1 
ATOM   1683 N N   . ARG A 1 248 ? -13.77300 -7.08700  -3.85200  1.000 15.66927 ?  228 ARG A N   1 
ATOM   1684 C CA  . ARG A 1 248 ? -13.85800 -6.50800  -5.18700  1.000 15.61996 ?  228 ARG A CA  1 
ATOM   1685 C C   . ARG A 1 248 ? -15.31800 -6.45000  -5.62500  1.000 17.64219 ?  228 ARG A C   1 
ATOM   1686 O O   . ARG A 1 248 ? -16.01300 -7.47300  -5.63000  1.000 17.42315 ?  228 ARG A O   1 
ATOM   1687 C CB  . ARG A 1 248 ? -13.05700 -7.39200  -6.14700  1.000 14.76566 ?  228 ARG A CB  1 
ATOM   1688 C CG  . ARG A 1 248 ? -13.15900 -6.99800  -7.62200  1.000 15.11991 ?  228 ARG A CG  1 
ATOM   1689 C CD  . ARG A 1 248 ? -12.79300 -8.19900  -8.51600  1.000 16.55544 ?  228 ARG A CD  1 
ATOM   1690 N NE  . ARG A 1 248 ? -12.64800 -7.78900  -9.91400  1.000 16.09608 ?  228 ARG A NE  1 
ATOM   1691 C CZ  . ARG A 1 248 ? -13.66600 -7.48400  -10.70700 1.000 15.96048 ?  228 ARG A CZ  1 
ATOM   1692 N NH1 . ARG A 1 248 ? -14.91800 -7.58700  -10.29100 1.000 15.74862 ?  228 ARG A NH1 1 
ATOM   1693 N NH2 . ARG A 1 248 ? -13.42200 -7.07000  -11.95300 1.000 15.54636 ?  228 ARG A NH2 1 
ATOM   1694 N N   . GLU A 1 249 ? -15.77900 -5.25500  -5.99700  1.000 16.29849 ?  229 GLU A N   1 
ATOM   1695 C CA  . GLU A 1 249 ? -17.13600 -5.07300  -6.50400  1.000 15.65469 ?  229 GLU A CA  1 
ATOM   1696 C C   . GLU A 1 249 ? -17.17600 -4.91100  -8.01900  1.000 16.62837 ?  229 GLU A C   1 
ATOM   1697 O O   . GLU A 1 249 ? -18.08200 -5.44000  -8.67800  1.000 18.92684 ?  229 GLU A O   1 
ATOM   1698 C CB  . GLU A 1 249 ? -17.80100 -3.87300  -5.82100  1.000 17.34415 ?  229 GLU A CB  1 
ATOM   1699 C CG  . GLU A 1 249 ? -17.92200 -4.04700  -4.30500  1.000 20.00987 ?  229 GLU A CG  1 
ATOM   1700 C CD  . GLU A 1 249 ? -18.67500 -2.91100  -3.64200  1.000 24.95054 ?  229 GLU A CD  1 
ATOM   1701 O OE1 . GLU A 1 249 ? -19.43400 -2.20200  -4.34300  1.000 26.27846 ?  229 GLU A OE1 1 
ATOM   1702 O OE2 . GLU A 1 249 ? -18.51400 -2.73800  -2.41100  1.000 30.21171 -1 229 GLU A OE2 1 
ATOM   1703 N N   . THR A 1 250 ? -16.20600 -4.18900  -8.58600  1.000 15.30351 ?  230 THR A N   1 
ATOM   1704 C CA  . THR A 1 250 ? -16.03100 -4.05600  -10.02900 1.000 15.34826 ?  230 THR A CA  1 
ATOM   1705 C C   . THR A 1 250 ? -14.53600 -4.03000  -10.30600 1.000 14.21609 ?  230 THR A C   1 
ATOM   1706 O O   . THR A 1 250 ? -13.71600 -4.15600  -9.39500  1.000 16.19998 ?  230 THR A O   1 
ATOM   1707 C CB  . THR A 1 250 ? -16.67900 -2.77200  -10.57300 1.000 16.41717 ?  230 THR A CB  1 
ATOM   1708 O OG1 . THR A 1 250 ? -15.90500 -1.63900  -10.15200 1.000 15.69150 ?  230 THR A OG1 1 
ATOM   1709 C CG2 . THR A 1 250 ? -18.11500 -2.60600  -10.07500 1.000 17.12228 ?  230 THR A CG2 1 
ATOM   1710 N N   . THR A 1 251 ? -14.16200 -3.85000  -11.57600 1.000 14.97671 ?  231 THR A N   1 
ATOM   1711 C CA  . THR A 1 251 ? -12.74400 -3.66900  -11.86300 1.000 16.24035 ?  231 THR A CA  1 
ATOM   1712 C C   . THR A 1 251 ? -12.15500 -2.53500  -11.03200 1.000 16.10181 ?  231 THR A C   1 
ATOM   1713 O O   . THR A 1 251 ? -10.98400 -2.59600  -10.63700 1.000 16.05945 ?  231 THR A O   1 
ATOM   1714 C CB  . THR A 1 251 ? -12.54400 -3.40300  -13.35400 1.000 17.63731 ?  231 THR A CB  1 
ATOM   1715 O OG1 . THR A 1 251 ? -12.89600 -4.58400  -14.10000 1.000 17.23986 ?  231 THR A OG1 1 
ATOM   1716 C CG2 . THR A 1 251 ? -11.10800 -3.01600  -13.64900 1.000 19.74484 ?  231 THR A CG2 1 
ATOM   1717 N N   . ARG A 1 252 ? -12.95000 -1.50300  -10.74500 1.000 15.06185 ?  232 ARG A N   1 
ATOM   1718 C CA  . ARG A 1 252 ? -12.43700 -0.28200  -10.13900 1.000 15.00522 ?  232 ARG A CA  1 
ATOM   1719 C C   . ARG A 1 252 ? -12.84900 -0.06200  -8.68700  1.000 14.06753 ?  232 ARG A C   1 
ATOM   1720 O O   . ARG A 1 252 ? -12.13700 0.65600   -7.97300  1.000 15.28908 ?  232 ARG A O   1 
ATOM   1721 C CB  . ARG A 1 252 ? -12.87000 0.92700   -10.98200 1.000 14.22838 ?  232 ARG A CB  1 
ATOM   1722 C CG  . ARG A 1 252 ? -12.29300 0.89000   -12.40700 1.000 14.43883 ?  232 ARG A CG  1 
ATOM   1723 C CD  . ARG A 1 252 ? -12.57000 2.14000   -13.23400 1.000 14.12130 ?  232 ARG A CD  1 
ATOM   1724 N NE  . ARG A 1 252 ? -11.78300 2.14900   -14.46500 1.000 15.60043 ?  232 ARG A NE  1 
ATOM   1725 C CZ  . ARG A 1 252 ? -10.51000 2.51400   -14.53700 1.000 15.59032 ?  232 ARG A CZ  1 
ATOM   1726 N NH1 . ARG A 1 252 ? -9.86900  3.00000   -13.48500 1.000 18.09936 ?  232 ARG A NH1 1 
ATOM   1727 N NH2 . ARG A 1 252 ? -9.86500  2.39100   -15.69600 1.000 21.72482 ?  232 ARG A NH2 1 
ATOM   1728 N N   . LYS A 1 253 ? -13.96600 -0.63500  -8.23000  1.000 14.95669 ?  233 LYS A N   1 
ATOM   1729 C CA  . LYS A 1 253 ? -14.53700 -0.31700  -6.92100  1.000 15.21118 ?  233 LYS A CA  1 
ATOM   1730 C C   . LYS A 1 253 ? -14.32400 -1.46800  -5.94700  1.000 15.39205 ?  233 LYS A C   1 
ATOM   1731 O O   . LYS A 1 253 ? -14.65200 -2.62300  -6.26300  1.000 15.16494 ?  233 LYS A O   1 
ATOM   1732 C CB  . LYS A 1 253 ? -16.03700 -0.00600  -7.04800  1.000 16.29149 ?  233 LYS A CB  1 
ATOM   1733 C CG  . LYS A 1 253 ? -16.71800 0.32800   -5.71600  1.000 16.87622 ?  233 LYS A CG  1 
ATOM   1734 C CD  . LYS A 1 253 ? -18.17300 0.72500   -5.92500  1.000 23.38911 ?  233 LYS A CD  1 
ATOM   1735 C CE  . LYS A 1 253 ? -18.70600 1.53700   -4.75500  1.000 29.70134 ?  233 LYS A CE  1 
ATOM   1736 N NZ  . LYS A 1 253 ? -18.95300 0.66500   -3.58300  1.000 36.90805 ?  233 LYS A NZ  1 
ATOM   1737 N N   . TYR A 1 254 ? -13.79900 -1.15200  -4.75500  1.000 14.88516 ?  234 TYR A N   1 
ATOM   1738 C CA  . TYR A 1 254 ? -13.47400 -2.15000  -3.74400  1.000 14.80706 ?  234 TYR A CA  1 
ATOM   1739 C C   . TYR A 1 254 ? -13.87300 -1.63300  -2.37000  1.000 15.56321 ?  234 TYR A C   1 
ATOM   1740 O O   . TYR A 1 254 ? -13.91900 -0.41900  -2.12700  1.000 16.01089 ?  234 TYR A O   1 
ATOM   1741 C CB  . TYR A 1 254 ? -11.95900 -2.46800  -3.69800  1.000 14.76218 ?  234 TYR A CB  1 
ATOM   1742 C CG  . TYR A 1 254 ? -11.40300 -2.94700  -5.01800  1.000 14.09380 ?  234 TYR A CG  1 
ATOM   1743 C CD1 . TYR A 1 254 ? -11.14300 -2.04800  -6.05300  1.000 14.87803 ?  234 TYR A CD1 1 
ATOM   1744 C CD2 . TYR A 1 254 ? -11.15000 -4.29000  -5.24000  1.000 15.72822 ?  234 TYR A CD2 1 
ATOM   1745 C CE1 . TYR A 1 254 ? -10.65900 -2.49000  -7.27900  1.000 16.97584 ?  234 TYR A CE1 1 
ATOM   1746 C CE2 . TYR A 1 254 ? -10.66100 -4.73800  -6.45800  1.000 15.38861 ?  234 TYR A CE2 1 
ATOM   1747 C CZ  . TYR A 1 254 ? -10.41700 -3.83400  -7.47000  1.000 16.65946 ?  234 TYR A CZ  1 
ATOM   1748 O OH  . TYR A 1 254 ? -9.93600  -4.29500  -8.67900  1.000 17.35176 ?  234 TYR A OH  1 
ATOM   1749 N N   . GLN A 1 255 ? -14.14700 -2.57700  -1.46600  1.000 15.33133 ?  235 GLN A N   1 
ATOM   1750 C CA  . GLN A 1 255 ? -14.19100 -2.30500  -0.03600  1.000 14.80775 ?  235 GLN A CA  1 
ATOM   1751 C C   . GLN A 1 255 ? -12.82700 -2.69100  0.52700   1.000 14.01127 ?  235 GLN A C   1 
ATOM   1752 O O   . GLN A 1 255 ? -12.30000 -3.75400  0.19700   1.000 16.06235 ?  235 GLN A O   1 
ATOM   1753 C CB  . GLN A 1 255 ? -15.30000 -3.11400  0.65300   1.000 16.89743 ?  235 GLN A CB  1 
ATOM   1754 C CG  . GLN A 1 255 ? -15.33100 -2.88600  2.16700   1.000 20.04046 ?  235 GLN A CG  1 
ATOM   1755 C CD  . GLN A 1 255 ? -16.26900 -3.79200  2.93900   1.000 23.30921 ?  235 GLN A CD  1 
ATOM   1756 O OE1 . GLN A 1 255 ? -16.11100 -3.96900  4.15700   1.000 22.06929 ?  235 GLN A OE1 1 
ATOM   1757 N NE2 . GLN A 1 255 ? -17.25100 -4.36800  2.24800   1.000 22.25799 ?  235 GLN A NE2 1 
ATOM   1758 N N   . HIS A 1 256 ? -12.24100 -1.82200  1.34600   1.000 14.27009 ?  236 HIS A N   1 
ATOM   1759 C CA  . HIS A 1 256 ? -10.94400 -2.07700  1.97300   1.000 15.06714 ?  236 HIS A CA  1 
ATOM   1760 C C   . HIS A 1 256 ? -11.10800 -1.77900  3.45500   1.000 15.71146 ?  236 HIS A C   1 
ATOM   1761 O O   . HIS A 1 256 ? -11.28500 -0.61800  3.84500   1.000 16.09896 ?  236 HIS A O   1 
ATOM   1762 C CB  . HIS A 1 256 ? -9.87500  -1.19100  1.33100   1.000 16.59507 ?  236 HIS A CB  1 
ATOM   1763 C CG  . HIS A 1 256 ? -8.46500  -1.53200  1.70800   1.000 15.16335 ?  236 HIS A CG  1 
ATOM   1764 N ND1 . HIS A 1 256 ? -7.38300  -0.92200  1.10700   1.000 17.12377 ?  236 HIS A ND1 1 
ATOM   1765 C CD2 . HIS A 1 256 ? -7.95400  -2.37200  2.63900   1.000 16.29011 ?  236 HIS A CD2 1 
ATOM   1766 C CE1 . HIS A 1 256 ? -6.26600  -1.38400  1.63900   1.000 19.25803 ?  236 HIS A CE1 1 
ATOM   1767 N NE2 . HIS A 1 256 ? -6.58300  -2.26600  2.57200   1.000 17.57367 ?  236 HIS A NE2 1 
ATOM   1768 N N   . THR A 1 257 ? -11.08500 -2.83000  4.27500   1.000 13.60468 ?  237 THR A N   1 
ATOM   1769 C CA  . THR A 1 257 ? -11.55000 -2.73800  5.65200   1.000 14.87094 ?  237 THR A CA  1 
ATOM   1770 C C   . THR A 1 257 ? -10.56100 -3.41300  6.58500   1.000 12.59012 ?  237 THR A C   1 
ATOM   1771 O O   . THR A 1 257 ? -9.90100  -4.38400  6.20900   1.000 15.50262 ?  237 THR A O   1 
ATOM   1772 C CB  . THR A 1 257 ? -12.94100 -3.38100  5.73300   1.000 16.85615 ?  237 THR A CB  1 
ATOM   1773 O OG1 . THR A 1 257 ? -13.86000 -2.54700  5.01200   1.000 16.66646 ?  237 THR A OG1 1 
ATOM   1774 C CG2 . THR A 1 257 ? -13.41900 -3.56000  7.18200   1.000 18.27169 ?  237 THR A CG2 1 
ATOM   1775 N N   . VAL A 1 258 ? -10.46700 -2.90300  7.80600   1.000 15.00083 ?  238 VAL A N   1 
ATOM   1776 C CA  . VAL A 1 258 ? -9.54600  -3.43800  8.80500   1.000 14.79811 ?  238 VAL A CA  1 
ATOM   1777 C C   . VAL A 1 258 ? -10.37700 -4.12700  9.88700   1.000 15.39992 ?  238 VAL A C   1 
ATOM   1778 O O   . VAL A 1 258 ? -10.93600 -3.47900  10.77900  1.000 15.91791 ?  238 VAL A O   1 
ATOM   1779 C CB  . VAL A 1 258 ? -8.63500  -2.35400  9.39300   1.000 15.35323 ?  238 VAL A CB  1 
ATOM   1780 C CG1 . VAL A 1 258 ? -7.62100  -2.98600  10.34000  1.000 18.37904 ?  238 VAL A CG1 1 
ATOM   1781 C CG2 . VAL A 1 258 ? -7.92500  -1.57400  8.29100   1.000 18.20392 ?  238 VAL A CG2 1 
ATOM   1782 N N   . ALA A 1 259 ? -10.44800 -5.45600  9.83900   1.000 15.78349 ?  239 ALA A N   1 
ATOM   1783 C CA  . ALA A 1 259 ? -11.15300 -6.20700  10.86900  1.000 13.77177 ?  239 ALA A CA  1 
ATOM   1784 C C   . ALA A 1 259 ? -10.29500 -6.30900  12.13000  1.000 14.52069 ?  239 ALA A C   1 
ATOM   1785 O O   . ALA A 1 259 ? -9.06100  -6.27600  12.06800  1.000 16.60329 ?  239 ALA A O   1 
ATOM   1786 C CB  . ALA A 1 259 ? -11.47900 -7.61400  10.35800  1.000 13.89300 ?  239 ALA A CB  1 
ATOM   1787 N N   . GLU A 1 260 ? -10.95400 -6.41600  13.28100  1.000 14.34091 ?  240 GLU A N   1 
ATOM   1788 C CA  . GLU A 1 260 ? -10.26700 -6.74700  14.52700  1.000 14.61244 ?  240 GLU A CA  1 
ATOM   1789 C C   . GLU A 1 260 ? -10.43200 -8.23700  14.78700  1.000 15.27201 ?  240 GLU A C   1 
ATOM   1790 O O   . GLU A 1 260 ? -11.56000 -8.75100  14.79000  1.000 15.48257 ?  240 GLU A O   1 
ATOM   1791 C CB  . GLU A 1 260 ? -10.81500 -5.96300  15.72100  1.000 15.53701 ?  240 GLU A CB  1 
ATOM   1792 C CG  . GLU A 1 260 ? -10.19800 -6.40600  17.04400  1.000 15.94383 ?  240 GLU A CG  1 
ATOM   1793 C CD  . GLU A 1 260 ? -10.37100 -5.39100  18.15000  1.000 17.23718 ?  240 GLU A CD  1 
ATOM   1794 O OE1 . GLU A 1 260 ? -11.50100 -5.28400  18.66400  1.000 18.76072 ?  240 GLU A OE1 1 
ATOM   1795 O OE2 . GLU A 1 260 ? -9.38200  -4.72300  18.52800  1.000 22.49930 -1 240 GLU A OE2 1 
ATOM   1796 N N   . ALA A 1 261 ? -9.31100  -8.92600  14.99100  1.000 15.17880 ?  241 ALA A N   1 
ATOM   1797 C CA  . ALA A 1 261 ? -9.30600  -10.34200 15.32900  1.000 14.49916 ?  241 ALA A CA  1 
ATOM   1798 C C   . ALA A 1 261 ? -9.09200  -10.50300 16.82900  1.000 16.70305 ?  241 ALA A C   1 
ATOM   1799 O O   . ALA A 1 261 ? -8.13300  -9.96100  17.39200  1.000 15.61559 ?  241 ALA A O   1 
ATOM   1800 C CB  . ALA A 1 261 ? -8.18100  -11.04900 14.57600  1.000 15.83984 ?  241 ALA A CB  1 
ATOM   1801 N N   . SER A 1 262 ? -9.99000  -11.23800 17.47400  1.000 16.14775 ?  242 SER A N   1 
ATOM   1802 C CA  . SER A 1 262 ? -9.86100  -11.54400 18.89400  1.000 15.40229 ?  242 SER A CA  1 
ATOM   1803 C C   . SER A 1 262 ? -9.78500  -13.05500 19.07100  1.000 16.09847 ?  242 SER A C   1 
ATOM   1804 O O   . SER A 1 262 ? -10.60200 -13.80200 18.50900  1.000 15.79353 ?  242 SER A O   1 
ATOM   1805 C CB  . SER A 1 262 ? -10.99400 -10.92400 19.71900  1.000 16.84428 ?  242 SER A CB  1 
ATOM   1806 O OG  . SER A 1 262 ? -12.27600 -11.29700 19.24200  1.000 16.54659 ?  242 SER A OG  1 
ATOM   1807 N N   . LEU A 1 263 ? -8.75000  -13.47100 19.80300  1.000 15.49405 ?  243 LEU A N   1 
ATOM   1808 C CA  . LEU A 1 263 ? -8.49300  -14.91300 20.04600  1.000 15.93237 ?  243 LEU A CA  1 
ATOM   1809 C C   . LEU A 1 263 ? -8.78000  -15.24500 21.51000  1.000 16.58155 ?  243 LEU A C   1 
ATOM   1810 O O   . LEU A 1 263 ? -8.32100  -14.51300 22.37300  1.000 18.63035 ?  243 LEU A O   1 
ATOM   1811 C CB  . LEU A 1 263 ? -7.04900  -15.23800 19.66000  1.000 17.93118 ?  243 LEU A CB  1 
ATOM   1812 C CG  . LEU A 1 263 ? -6.75300  -15.24300 18.16400  1.000 24.45247 ?  243 LEU A CG  1 
ATOM   1813 C CD1 . LEU A 1 263 ? -5.25700  -15.20500 17.92900  1.000 34.39461 ?  243 LEU A CD1 1 
ATOM   1814 C CD2 . LEU A 1 263 ? -7.33600  -16.48000 17.52000  1.000 30.92912 ?  243 LEU A CD2 1 
ATOM   1815 N N   . TRP A 1 264 ? -9.48100  -16.35000 21.72700  1.000 17.46873 ?  244 TRP A N   1 
ATOM   1816 C CA  . TRP A 1 264 ? -10.00000 -16.66500 23.05600  1.000 15.77600 ?  244 TRP A CA  1 
ATOM   1817 C C   . TRP A 1 264 ? -9.71800  -18.12600 23.37400  1.000 14.97211 ?  244 TRP A C   1 
ATOM   1818 O O   . TRP A 1 264 ? -10.11700 -19.01500 22.61700  1.000 16.96293 ?  244 TRP A O   1 
ATOM   1819 C CB  . TRP A 1 264 ? -11.51100 -16.42300 23.10200  1.000 15.75365 ?  244 TRP A CB  1 
ATOM   1820 C CG  . TRP A 1 264 ? -11.96600 -15.09800 22.57200  1.000 17.02439 ?  244 TRP A CG  1 
ATOM   1821 C CD1 . TRP A 1 264 ? -12.09700 -14.73300 21.25600  1.000 16.02612 ?  244 TRP A CD1 1 
ATOM   1822 C CD2 . TRP A 1 264 ? -12.38600 -13.96500 23.34600  1.000 16.40269 ?  244 TRP A CD2 1 
ATOM   1823 N NE1 . TRP A 1 264 ? -12.56400 -13.44000 21.17000  1.000 16.31298 ?  244 TRP A NE1 1 
ATOM   1824 C CE2 . TRP A 1 264 ? -12.74900 -12.94800 22.43700  1.000 16.09999 ?  244 TRP A CE2 1 
ATOM   1825 C CE3 . TRP A 1 264 ? -12.48900 -13.71000 24.71900  1.000 18.94563 ?  244 TRP A CE3 1 
ATOM   1826 C CZ2 . TRP A 1 264 ? -13.20100 -11.69700 22.85700  1.000 16.68849 ?  244 TRP A CZ2 1 
ATOM   1827 C CZ3 . TRP A 1 264 ? -12.94100 -12.46400 25.13700  1.000 19.62875 ?  244 TRP A CZ3 1 
ATOM   1828 C CH2 . TRP A 1 264 ? -13.28800 -11.47200 24.20400  1.000 18.80380 ?  244 TRP A CH2 1 
ATOM   1829 N N   . ARG A 1 265 ? -9.04100  -18.38300 24.49300  1.000 17.38937 ?  245 ARG A N   1 
ATOM   1830 C CA  . ARG A 1 265 ? -8.80100  -19.74800 24.94200  1.000 15.03147 ?  245 ARG A CA  1 
ATOM   1831 C C   . ARG A 1 265 ? -9.94900  -20.19600 25.83800  1.000 16.13906 ?  245 ARG A C   1 
ATOM   1832 O O   . ARG A 1 265 ? -10.34800 -19.46700 26.75000  1.000 18.13933 ?  245 ARG A O   1 
ATOM   1833 C CB  . ARG A 1 265 ? -7.48900  -19.83100 25.73100  1.000 17.60565 ?  245 ARG A CB  1 
ATOM   1834 C CG  . ARG A 1 265 ? -7.04700  -21.26200 26.02300  1.000 18.12856 ?  245 ARG A CG  1 
ATOM   1835 C CD  . ARG A 1 265 ? -6.21500  -21.81400 24.87200  1.000 21.62103 ?  245 ARG A CD  1 
ATOM   1836 N NE  . ARG A 1 265 ? -4.92400  -21.13700 24.81000  1.000 20.06025 ?  245 ARG A NE  1 
ATOM   1837 C CZ  . ARG A 1 265 ? -4.24600  -20.88800 23.69900  1.000 20.61072 ?  245 ARG A CZ  1 
ATOM   1838 N NH1 . ARG A 1 265 ? -4.65100  -21.33500 22.52100  1.000 20.03865 ?  245 ARG A NH1 1 
ATOM   1839 N NH2 . ARG A 1 265 ? -3.12600  -20.17400 23.77300  1.000 22.75014 ?  245 ARG A NH2 1 
ATOM   1840 N N   . ARG A 1 266 ? -10.47600 -21.39500 25.58100  1.000 15.83747 ?  246 ARG A N   1 
ATOM   1841 C CA  . ARG A 1 266 ? -11.49100 -21.96500 26.46900  1.000 16.15343 ?  246 ARG A CA  1 
ATOM   1842 C C   . ARG A 1 266 ? -10.83300 -22.43500 27.76400  1.000 17.48338 ?  246 ARG A C   1 
ATOM   1843 O O   . ARG A 1 266 ? -9.94600  -23.29300 27.74100  1.000 19.22003 ?  246 ARG A O   1 
ATOM   1844 C CB  . ARG A 1 266 ? -12.18400 -23.13900 25.78400  1.000 17.06032 ?  246 ARG A CB  1 
ATOM   1845 C CG  . ARG A 1 266 ? -13.33000 -23.77100 26.59800  1.000 19.34937 ?  246 ARG A CG  1 
ATOM   1846 C CD  . ARG A 1 266 ? -14.50300 -22.81500 26.79000  1.000 17.58593 ?  246 ARG A CD  1 
ATOM   1847 N NE  . ARG A 1 266 ? -15.68700 -23.50000 27.31500  1.000 17.81610 ?  246 ARG A NE  1 
ATOM   1848 C CZ  . ARG A 1 266 ? -16.04500 -23.50000 28.59400  1.000 20.67268 ?  246 ARG A CZ  1 
ATOM   1849 N NH1 . ARG A 1 266 ? -15.32300 -22.88500 29.51600  1.000 21.87914 ?  246 ARG A NH1 1 
ATOM   1850 N NH2 . ARG A 1 266 ? -17.15600 -24.13500 28.95700  1.000 23.36058 ?  246 ARG A NH2 1 
ATOM   1851 N N   . ALA A 1 267 ? -11.27300 -21.87700 28.88500  1.000 18.36566 ?  247 ALA A N   1 
ATOM   1852 C CA  . ALA A 1 267 ? -10.76600 -22.27400 30.19400  1.000 23.78995 ?  247 ALA A CA  1 
ATOM   1853 C C   . ALA A 1 267 ? -11.34900 -23.61400 30.63500  1.000 31.14391 ?  247 ALA A C   1 
ATOM   1854 O O   . ALA A 1 267 ? -12.35800 -24.07400 30.09500  1.000 25.60724 ?  247 ALA A O   1 
ATOM   1855 C CB  . ALA A 1 267 ? -11.07500 -21.19500 31.22400  1.000 23.64297 ?  247 ALA A CB  1 
HETATM 1856 C C1  . EDO B 2 .   ? -17.74700 -7.04400  5.32500   0.754 30.92845 ?  301 EDO A C1  1 
HETATM 1857 O O1  . EDO B 2 .   ? -17.46700 -5.71300  5.79100   0.754 26.38555 ?  301 EDO A O1  1 
HETATM 1858 C C2  . EDO B 2 .   ? -19.13600 -7.09000  4.69400   0.754 36.84951 ?  301 EDO A C2  1 
HETATM 1859 O O2  . EDO B 2 .   ? -19.20500 -6.22500  3.54900   0.754 25.88840 ?  301 EDO A O2  1 
HETATM 1860 C C1  . EDO C 2 .   ? -29.41500 -25.65500 23.23900  1.000 28.76252 ?  302 EDO A C1  1 
HETATM 1861 O O1  . EDO C 2 .   ? -30.43700 -26.04500 24.16200  1.000 27.63254 ?  302 EDO A O1  1 
HETATM 1862 C C2  . EDO C 2 .   ? -29.57600 -26.46000 21.96000  1.000 31.93996 ?  302 EDO A C2  1 
HETATM 1863 O O2  . EDO C 2 .   ? -30.94200 -26.38500 21.53400  1.000 35.83106 ?  302 EDO A O2  1 
HETATM 1864 C C1  . EDO D 2 .   ? -6.77300  -3.34100  -6.85000  1.000 23.69731 ?  303 EDO A C1  1 
HETATM 1865 O O1  . EDO D 2 .   ? -5.55200  -4.08900  -6.96200  1.000 27.63271 ?  303 EDO A O1  1 
HETATM 1866 C C2  . EDO D 2 .   ? -7.08000  -2.67000  -8.18500  1.000 34.79019 ?  303 EDO A C2  1 
HETATM 1867 O O2  . EDO D 2 .   ? -5.86500  -2.20900  -8.78000  1.000 37.75266 ?  303 EDO A O2  1 
HETATM 1868 O O   . HOH E 3 .   ? -19.28200 -34.31300 -0.61800  1.000 42.23888 ?  401 HOH A O   1 
HETATM 1869 O O   . HOH E 3 .   ? -18.86000 -4.19600  7.04300   1.000 31.13717 ?  402 HOH A O   1 
HETATM 1870 O O   . HOH E 3 .   ? -28.33000 -15.91100 12.14500  1.000 32.64434 ?  403 HOH A O   1 
HETATM 1871 O O   . HOH E 3 .   ? -15.47700 -33.72200 19.33800  1.000 38.82460 ?  404 HOH A O   1 
HETATM 1872 O O   . HOH E 3 .   ? -33.28500 -32.35900 20.69900  1.000 45.69196 ?  405 HOH A O   1 
HETATM 1873 O O   . HOH E 3 .   ? -11.90200 -27.40500 -16.27300 1.000 38.21355 ?  406 HOH A O   1 
HETATM 1874 O O   . HOH E 3 .   ? -12.24500 -10.23300 -20.14100 1.000 36.12142 ?  407 HOH A O   1 
HETATM 1875 O O   . HOH E 3 .   ? -20.81800 -21.83900 30.62800  1.000 29.15712 ?  408 HOH A O   1 
HETATM 1876 O O   . HOH E 3 .   ? -24.65400 -28.88500 -2.57500  1.000 40.28187 ?  409 HOH A O   1 
HETATM 1877 O O   . HOH E 3 .   ? -30.24300 -19.83900 19.94500  1.000 30.71732 ?  410 HOH A O   1 
HETATM 1878 O O   . HOH E 3 .   ? -1.87700  -24.77200 15.89400  1.000 26.95604 ?  411 HOH A O   1 
HETATM 1879 O O   . HOH E 3 .   ? -24.62300 -15.87600 4.35500   1.000 33.35906 ?  412 HOH A O   1 
HETATM 1880 O O   . HOH E 3 .   ? -11.30700 -13.58500 -9.35700  1.000 22.81635 ?  413 HOH A O   1 
HETATM 1881 O O   . HOH E 3 .   ? -6.49600  -6.50700  -8.23000  1.000 31.82723 ?  414 HOH A O   1 
HETATM 1882 O O   . HOH E 3 .   ? -10.52700 -22.85200 -15.89900 1.000 38.08091 ?  415 HOH A O   1 
HETATM 1883 O O   . HOH E 3 .   ? -20.08100 -7.06800  -8.19000  1.000 26.66623 ?  416 HOH A O   1 
HETATM 1884 O O   . HOH E 3 .   ? -10.65100 -15.13600 -16.86500 1.000 33.10799 ?  417 HOH A O   1 
HETATM 1885 O O   . HOH E 3 .   ? -18.98800 -14.68800 7.53600   1.000 25.50627 ?  418 HOH A O   1 
HETATM 1886 O O   . HOH E 3 .   ? -10.15400 -12.56900 29.34500  1.000 23.60641 ?  419 HOH A O   1 
HETATM 1887 O O   . HOH E 3 .   ? -30.54300 -24.31600 18.39700  1.000 37.32645 ?  420 HOH A O   1 
HETATM 1888 O O   . HOH E 3 .   ? -20.04700 -6.77900  -0.94600  1.000 31.27227 ?  421 HOH A O   1 
HETATM 1889 O O   . HOH E 3 .   ? -21.78100 -15.52400 5.09400   1.000 35.49847 ?  422 HOH A O   1 
HETATM 1890 O O   . HOH E 3 .   ? -4.70400  -33.37300 12.51200  1.000 36.47749 ?  423 HOH A O   1 
HETATM 1891 O O   . HOH E 3 .   ? -9.11800  -11.55200 -3.69300  1.000 22.58524 ?  424 HOH A O   1 
HETATM 1892 O O   . HOH E 3 .   ? -17.13300 -36.18600 14.03600  1.000 34.07116 ?  425 HOH A O   1 
HETATM 1893 O O   . HOH E 3 .   ? -14.70000 -20.32800 4.88300   1.000 24.16325 ?  426 HOH A O   1 
HETATM 1894 O O   . HOH E 3 .   ? -22.63000 -6.93100  -14.06300 1.000 35.13702 ?  427 HOH A O   1 
HETATM 1895 O O   . HOH E 3 .   ? -1.08500  -14.24500 4.96600   1.000 27.13003 ?  428 HOH A O   1 
HETATM 1896 O O   . HOH E 3 .   ? -31.381   -33.733   18.992    1.000 35.31195 ?  429 HOH A O   1 
HETATM 1897 O O   . HOH E 3 .   ? -29.17600 -9.99000  10.17600  1.000 33.85560 ?  430 HOH A O   1 
HETATM 1898 O O   . HOH E 3 .   ? -25.32000 2.34300   12.54900  1.000 34.56066 ?  431 HOH A O   1 
HETATM 1899 O O   . HOH E 3 .   ? -20.17100 11.32800  24.68600  1.000 28.30432 ?  432 HOH A O   1 
HETATM 1900 O O   . HOH E 3 .   ? -23.44200 -31.46300 4.42900   1.000 39.68801 ?  433 HOH A O   1 
HETATM 1901 O O   . HOH E 3 .   ? 0.22300   -20.25600 11.16000  1.000 31.34503 ?  434 HOH A O   1 
HETATM 1902 O O   . HOH E 3 .   ? -9.02900  -2.99500  20.55100  1.000 38.05781 ?  435 HOH A O   1 
HETATM 1903 O O   . HOH E 3 .   ? -13.75700 -33.93300 -1.32100  1.000 38.84851 ?  436 HOH A O   1 
HETATM 1904 O O   . HOH E 3 .   ? -6.24300  -0.87800  -11.08500 1.000 39.72995 ?  437 HOH A O   1 
HETATM 1905 O O   . HOH E 3 .   ? -22.40600 10.90300  27.72700  1.000 28.00831 ?  438 HOH A O   1 
HETATM 1906 O O   . HOH E 3 .   ? -10.72900 -17.56400 -8.40100  1.000 23.51793 ?  439 HOH A O   1 
HETATM 1907 O O   . HOH E 3 .   ? -29.44300 -26.59500 -4.07000  1.000 32.98793 ?  440 HOH A O   1 
HETATM 1908 O O   . HOH E 3 .   ? -22.47000 -22.31800 26.02900  1.000 21.87995 ?  441 HOH A O   1 
HETATM 1909 O O   . HOH E 3 .   ? -9.03200  -33.36600 19.06400  1.000 32.73144 ?  442 HOH A O   1 
HETATM 1910 O O   . HOH E 3 .   ? -1.84300  -23.08200 25.88300  1.000 31.75057 ?  443 HOH A O   1 
HETATM 1911 O O   . HOH E 3 .   ? -3.62400  -21.75400 0.20000   1.000 28.72173 ?  444 HOH A O   1 
HETATM 1912 O O   . HOH E 3 .   ? -8.44600  -28.63800 2.22400   1.000 21.52137 ?  445 HOH A O   1 
HETATM 1913 O O   . HOH E 3 .   ? -27.81700 -9.52200  21.08500  1.000 34.77562 ?  446 HOH A O   1 
HETATM 1914 O O   . HOH E 3 .   ? -15.013   -36.795   21.730    1.000 44.34821 ?  447 HOH A O   1 
HETATM 1915 O O   . HOH E 3 .   ? -12.09300 -2.79500  19.56700  1.000 26.50125 ?  448 HOH A O   1 
HETATM 1916 O O   . HOH E 3 .   ? -21.15800 -1.48400  -6.32000  1.000 40.65631 ?  449 HOH A O   1 
HETATM 1917 O O   . HOH E 3 .   ? -7.34100  -11.91500 29.12200  1.000 30.61885 ?  450 HOH A O   1 
HETATM 1918 O O   . HOH E 3 .   ? 0.31900   -14.81700 8.78500   1.000 40.90171 ?  451 HOH A O   1 
HETATM 1919 O O   . HOH E 3 .   ? -16.10000 -17.66300 9.01900   1.000 20.56706 ?  452 HOH A O   1 
HETATM 1920 O O   . HOH E 3 .   ? -4.64100  -25.78800 24.92700  1.000 26.76844 ?  453 HOH A O   1 
HETATM 1921 O O   . HOH E 3 .   ? -16.952   -0.862    10.513    1.000 19.01965 ?  454 HOH A O   1 
HETATM 1922 O O   . HOH E 3 .   ? -22.81300 -5.24400  9.12100   1.000 27.75776 ?  455 HOH A O   1 
HETATM 1923 O O   . HOH E 3 .   ? -31.07300 -20.80700 5.06600   1.000 39.56735 ?  456 HOH A O   1 
HETATM 1924 O O   . HOH E 3 .   ? -25.10500 -31.92700 13.80100  1.000 38.14817 ?  457 HOH A O   1 
HETATM 1925 O O   . HOH E 3 .   ? -11.33300 -18.21600 33.41600  1.000 27.33703 ?  458 HOH A O   1 
HETATM 1926 O O   . HOH E 3 .   ? -8.41000  -28.70400 -7.77400  1.000 35.26816 ?  459 HOH A O   1 
HETATM 1927 O O   . HOH E 3 .   ? -10.28500 -30.63300 26.91500  1.000 33.57417 ?  460 HOH A O   1 
HETATM 1928 O O   . HOH E 3 .   ? -18.27000 -11.66100 31.86600  1.000 27.51040 ?  461 HOH A O   1 
HETATM 1929 O O   . HOH E 3 .   ? -23.96300 -9.36100  -18.47900 1.000 29.15864 ?  462 HOH A O   1 
HETATM 1930 O O   . HOH E 3 .   ? -9.15300  -10.04000 -1.28000  1.000 24.34878 ?  463 HOH A O   1 
HETATM 1931 O O   . HOH E 3 .   ? -16.16600 -9.71700  31.74700  1.000 33.54889 ?  464 HOH A O   1 
HETATM 1932 O O   . HOH E 3 .   ? -27.71800 -23.17600 -5.25600  1.000 38.20305 ?  465 HOH A O   1 
HETATM 1933 O O   . HOH E 3 .   ? -7.71500  -28.33300 -10.43700 1.000 41.81431 ?  466 HOH A O   1 
HETATM 1934 O O   . HOH E 3 .   ? -5.39500  -10.14600 4.87200   1.000 17.88549 ?  467 HOH A O   1 
HETATM 1935 O O   . HOH E 3 .   ? -16.02400 -9.00400  -7.92400  1.000 18.28992 ?  468 HOH A O   1 
HETATM 1936 O O   . HOH E 3 .   ? -12.38900 -8.11200  31.45200  1.000 44.89667 ?  469 HOH A O   1 
HETATM 1937 O O   . HOH E 3 .   ? -6.76600  -11.63300 20.55300  1.000 19.30284 ?  470 HOH A O   1 
HETATM 1938 O O   . HOH E 3 .   ? -18.80800 -8.31300  8.95300   1.000 25.68320 ?  471 HOH A O   1 
HETATM 1939 O O   . HOH E 3 .   ? -11.03700 -6.58800  -13.67900 1.000 31.99075 ?  472 HOH A O   1 
HETATM 1940 O O   . HOH E 3 .   ? -22.70400 -5.19600  26.18200  1.000 33.73783 ?  473 HOH A O   1 
HETATM 1941 O O   . HOH E 3 .   ? -16.91000 -5.84000  29.26300  1.000 31.34737 ?  474 HOH A O   1 
HETATM 1942 O O   . HOH E 3 .   ? -17.04400 -27.64200 -11.12500 1.000 25.68670 ?  475 HOH A O   1 
HETATM 1943 O O   . HOH E 3 .   ? -22.66300 -28.54600 -4.70300  1.000 26.92152 ?  476 HOH A O   1 
HETATM 1944 O O   . HOH E 3 .   ? -7.05900  -4.27500  17.08000  1.000 36.41937 ?  477 HOH A O   1 
HETATM 1945 O O   . HOH E 3 .   ? -11.62500 -14.48400 31.17100  1.000 25.09746 ?  478 HOH A O   1 
HETATM 1946 O O   . HOH E 3 .   ? -6.61500  -8.89400  -1.33000  1.000 26.32727 ?  479 HOH A O   1 
HETATM 1947 O O   . HOH E 3 .   ? -15.06700 -9.80400  -20.64200 1.000 26.85791 ?  480 HOH A O   1 
HETATM 1948 O O   . HOH E 3 .   ? -28.48000 -22.73700 20.53700  1.000 25.38225 ?  481 HOH A O   1 
HETATM 1949 O O   . HOH E 3 .   ? -17.35900 -12.57800 13.54800  1.000 16.43405 ?  482 HOH A O   1 
HETATM 1950 O O   . HOH E 3 .   ? -21.33500 -16.92700 26.13400  1.000 32.42390 ?  483 HOH A O   1 
HETATM 1951 O O   . HOH E 3 .   ? -13.05700 -9.40200  17.34500  1.000 15.89844 ?  484 HOH A O   1 
HETATM 1952 O O   . HOH E 3 .   ? -8.12500  -28.80500 21.69000  1.000 24.86489 ?  485 HOH A O   1 
HETATM 1953 O O   . HOH E 3 .   ? -3.90200  -11.89800 18.95100  1.000 36.95842 ?  486 HOH A O   1 
HETATM 1954 O O   . HOH E 3 .   ? -28.61000 -19.26600 21.99600  1.000 27.73353 ?  487 HOH A O   1 
HETATM 1955 O O   . HOH E 3 .   ? -4.49300  -29.93300 0.92800   1.000 28.61648 ?  488 HOH A O   1 
HETATM 1956 O O   . HOH E 3 .   ? -2.13000  -13.50700 9.35600   1.000 32.76925 ?  489 HOH A O   1 
HETATM 1957 O O   . HOH E 3 .   ? -12.59500 -3.76300  -16.76500 1.000 26.24481 ?  490 HOH A O   1 
HETATM 1958 O O   . HOH E 3 .   ? -20.072   -0.850    -13.059   1.000 20.29613 ?  491 HOH A O   1 
HETATM 1959 O O   . HOH E 3 .   ? -20.21800 -7.98500  1.61200   1.000 26.47304 ?  492 HOH A O   1 
HETATM 1960 O O   . HOH E 3 .   ? -14.83500 2.77100   -19.60800 1.000 23.14592 ?  493 HOH A O   1 
HETATM 1961 O O   . HOH E 3 .   ? 0.83200   -9.23700  -0.04000  1.000 46.07719 ?  494 HOH A O   1 
HETATM 1962 O O   . HOH E 3 .   ? -14.39000 -4.54900  28.98100  1.000 39.14768 ?  495 HOH A O   1 
HETATM 1963 O O   . HOH E 3 .   ? -15.42200 -0.53000  -13.45700 1.000 20.77289 ?  496 HOH A O   1 
HETATM 1964 O O   . HOH E 3 .   ? -20.26700 -11.10500 -9.23000  1.000 30.69965 ?  497 HOH A O   1 
HETATM 1965 O O   . HOH E 3 .   ? -9.46600  -6.59300  -10.23900 1.000 34.77363 ?  498 HOH A O   1 
HETATM 1966 O O   . HOH E 3 .   ? -25.03200 -4.90800  12.85500  1.000 24.91133 ?  499 HOH A O   1 
HETATM 1967 O O   . HOH E 3 .   ? -4.97500  -8.41700  -8.78500  1.000 45.11876 ?  500 HOH A O   1 
HETATM 1968 O O   . HOH E 3 .   ? -18.15200 -4.76900  -0.40100  1.000 28.59393 ?  501 HOH A O   1 
HETATM 1969 O O   . HOH E 3 .   ? -23.26400 -28.71200 20.21500  1.000 17.45030 ?  502 HOH A O   1 
HETATM 1970 O O   . HOH E 3 .   ? -8.05600  -30.87500 23.42400  1.000 37.81062 ?  503 HOH A O   1 
HETATM 1971 O O   . HOH E 3 .   ? -0.51200  -20.75500 5.37900   1.000 41.63533 ?  504 HOH A O   1 
HETATM 1972 O O   . HOH E 3 .   ? -14.10700 0.36100   -15.71400 1.000 19.67029 ?  505 HOH A O   1 
HETATM 1973 O O   . HOH E 3 .   ? -1.91700  -31.07200 5.09600   1.000 40.99950 ?  506 HOH A O   1 
HETATM 1974 O O   . HOH E 3 .   ? -2.17800  -31.10100 12.21000  1.000 43.55512 ?  507 HOH A O   1 
HETATM 1975 O O   . HOH E 3 .   ? -24.22300 -7.49500  15.81600  1.000 23.89433 ?  508 HOH A O   1 
HETATM 1976 O O   . HOH E 3 .   ? -3.04000  -14.85600 3.05900   1.000 22.65398 ?  509 HOH A O   1 
HETATM 1977 O O   . HOH E 3 .   ? -6.03600  -23.73500 21.71200  1.000 18.79013 ?  510 HOH A O   1 
HETATM 1978 O O   . HOH E 3 .   ? -17.94200 -13.70300 -19.27700 1.000 18.17202 ?  511 HOH A O   1 
HETATM 1979 O O   . HOH E 3 .   ? -9.16900  -12.08500 0.46600   1.000 17.19632 ?  512 HOH A O   1 
HETATM 1980 O O   . HOH E 3 .   ? -13.66100 -9.92300  -3.73900  1.000 18.74818 ?  513 HOH A O   1 
HETATM 1981 O O   . HOH E 3 .   ? -21.276   -4.335    3.099     1.000 47.61361 ?  514 HOH A O   1 
HETATM 1982 O O   . HOH E 3 .   ? -24.538   5.885     22.470    1.000 27.98861 ?  515 HOH A O   1 
HETATM 1983 O O   . HOH E 3 .   ? -30.77200 -13.44200 22.85800  1.000 41.87435 ?  516 HOH A O   1 
HETATM 1984 O O   . HOH E 3 .   ? -9.96000  -37.40800 14.68200  1.000 40.36261 ?  517 HOH A O   1 
HETATM 1985 O O   . HOH E 3 .   ? -12.97600 -36.11500 8.11500   1.000 41.03403 ?  518 HOH A O   1 
HETATM 1986 O O   . HOH E 3 .   ? -2.18900  -23.14900 2.98800   1.000 42.71390 ?  519 HOH A O   1 
HETATM 1987 O O   . HOH E 3 .   ? -24.569   -14.508   25.623    1.000 28.49882 ?  520 HOH A O   1 
HETATM 1988 O O   . HOH E 3 .   ? -23.63200 -12.41200 6.87600   1.000 44.11302 ?  521 HOH A O   1 
HETATM 1989 O O   . HOH E 3 .   ? -9.30900  -36.99800 8.47300   1.000 33.51705 ?  522 HOH A O   1 
HETATM 1990 O O   . HOH E 3 .   ? -33.78500 -3.10600  12.93600  1.000 41.76246 ?  523 HOH A O   1 
HETATM 1991 O O   . HOH E 3 .   ? -2.28700  -10.64200 -2.17000  1.000 40.77101 ?  524 HOH A O   1 
HETATM 1992 O O   . HOH E 3 .   ? -7.08200  -13.33400 -2.42500  1.000 26.90189 ?  525 HOH A O   1 
HETATM 1993 O O   . HOH E 3 .   ? -20.53100 2.04600   -1.62900  1.000 46.04425 ?  526 HOH A O   1 
HETATM 1994 O O   . HOH E 3 .   ? -17.08200 0.10100   -1.48400  1.000 36.22178 ?  527 HOH A O   1 
HETATM 1995 O O   . HOH E 3 .   ? -16.86500 -27.02400 27.00700  1.000 33.00051 ?  528 HOH A O   1 
HETATM 1996 O O   . HOH E 3 .   ? -4.29900  -2.99000  4.16000   1.000 20.03751 ?  529 HOH A O   1 
HETATM 1997 O O   . HOH E 3 .   ? -3.71900  -23.93000 6.28800   1.000 37.24622 ?  530 HOH A O   1 
HETATM 1998 O O   . HOH E 3 .   ? -26.71800 -27.04400 10.22900  1.000 33.75743 ?  531 HOH A O   1 
HETATM 1999 O O   . HOH E 3 .   ? -2.59600  -7.11200  -5.20800  1.000 28.30468 ?  532 HOH A O   1 
HETATM 2000 O O   . HOH E 3 .   ? -7.31500  -23.73300 28.84500  1.000 29.44617 ?  533 HOH A O   1 
HETATM 2001 O O   . HOH E 3 .   ? -30.24100 -19.69400 1.16600   1.000 40.96023 ?  534 HOH A O   1 
HETATM 2002 O O   . HOH E 3 .   ? -29.03800 -24.03900 12.41800  1.000 22.96179 ?  535 HOH A O   1 
HETATM 2003 O O   . HOH E 3 .   ? -26.06700 -9.49700  29.52800  1.000 47.65655 ?  536 HOH A O   1 
HETATM 2004 O O   . HOH E 3 .   ? -22.97900 -3.79200  -12.65700 1.000 33.03785 ?  537 HOH A O   1 
HETATM 2005 O O   . HOH E 3 .   ? -2.95600  -2.84200  -6.71700  1.000 43.38396 ?  538 HOH A O   1 
HETATM 2006 O O   . HOH E 3 .   ? -12.22900 -29.93100 -15.83300 1.000 42.63972 ?  539 HOH A O   1 
HETATM 2007 O O   . HOH E 3 .   ? -28.28400 -28.56900 7.30000   1.000 45.19448 ?  540 HOH A O   1 
HETATM 2008 O O   . HOH E 3 .   ? -6.30700  -16.94000 -3.45900  1.000 28.87038 ?  541 HOH A O   1 
HETATM 2009 O O   . HOH E 3 .   ? -2.31200  -13.71700 -0.33100  1.000 38.54030 ?  542 HOH A O   1 
HETATM 2010 O O   . HOH E 3 .   ? -23.63000 -29.58000 1.07500   1.000 43.70240 ?  543 HOH A O   1 
HETATM 2011 O O   . HOH E 3 .   ? 0.90300   -16.00800 11.58300  1.000 45.94551 ?  544 HOH A O   1 
HETATM 2012 O O   . HOH E 3 .   ? -31.41200 -28.79800 17.53600  1.000 31.69734 ?  545 HOH A O   1 
HETATM 2013 O O   . HOH E 3 .   ? -26.10000 -17.27100 10.69100  1.000 34.67729 ?  546 HOH A O   1 
HETATM 2014 O O   . HOH E 3 .   ? -8.28200  -20.14200 -7.32000  1.000 24.51695 ?  547 HOH A O   1 
HETATM 2015 O O   . HOH E 3 .   ? -11.63000 1.02500   -17.56900 1.000 31.34854 ?  548 HOH A O   1 
HETATM 2016 O O   . HOH E 3 .   ? -2.59000  -5.32100  14.89600  1.000 30.03282 ?  549 HOH A O   1 
HETATM 2017 O O   . HOH E 3 .   ? -27.14600 -28.27800 4.04500   1.000 30.50708 ?  550 HOH A O   1 
HETATM 2018 O O   . HOH E 3 .   ? -9.33800  -34.66900 -0.45600  1.000 41.38704 ?  551 HOH A O   1 
HETATM 2019 O O   . HOH E 3 .   ? -32.67500 -6.40500  6.55100   1.000 53.69361 ?  552 HOH A O   1 
HETATM 2020 O O   . HOH E 3 .   ? -21.28300 -20.39700 -11.18900 1.000 35.74450 ?  553 HOH A O   1 
HETATM 2021 O O   . HOH E 3 .   ? -21.19500 -10.26500 -12.05000 1.000 34.64599 ?  554 HOH A O   1 
HETATM 2022 O O   . HOH E 3 .   ? -21.79900 1.24000   11.12300  1.000 30.52186 ?  555 HOH A O   1 
HETATM 2023 O O   . HOH E 3 .   ? -29.23700 -0.45200  8.27400   1.000 37.23741 ?  556 HOH A O   1 
HETATM 2024 O O   . HOH E 3 .   ? -26.87600 -25.90200 12.80600  1.000 28.72509 ?  557 HOH A O   1 
HETATM 2025 O O   . HOH E 3 .   ? -13.72300 -35.78300 -5.02100  1.000 47.84379 ?  558 HOH A O   1 
HETATM 2026 O O   . HOH E 3 .   ? -22.63700 -7.54800  -21.65000 1.000 32.21722 ?  559 HOH A O   1 
HETATM 2027 O O   . HOH E 3 .   ? -3.12700  -19.84900 26.74400  1.000 33.00206 ?  560 HOH A O   1 
HETATM 2028 O O   . HOH E 3 .   ? -9.63400  -17.08300 -12.97300 1.000 29.03875 ?  561 HOH A O   1 
HETATM 2029 O O   . HOH E 3 .   ? -3.69800  -17.37400 -1.68400  1.000 35.82402 ?  562 HOH A O   1 
HETATM 2030 O O   . HOH E 3 .   ? -18.49100 -9.04400  -9.30300  1.000 19.80087 ?  563 HOH A O   1 
HETATM 2031 O O   . HOH E 3 .   ? -28.57900 -0.87100  24.37100  1.000 46.88577 ?  564 HOH A O   1 
HETATM 2032 O O   . HOH E 3 .   ? -1.43900  -27.51500 18.59400  1.000 39.83663 ?  565 HOH A O   1 
HETATM 2033 O O   . HOH E 3 .   ? -24.23600 -17.54500 7.78400   1.000 24.27249 ?  566 HOH A O   1 
HETATM 2034 O O   . HOH E 3 .   ? -3.66800  -29.99000 -2.46100  1.000 30.58237 ?  567 HOH A O   1 
HETATM 2035 O O   . HOH E 3 .   ? -4.28100  -4.23200  19.81300  1.000 43.78298 ?  568 HOH A O   1 
HETATM 2036 O O   . HOH E 3 .   ? -17.15700 -10.78700 4.72600   1.000 27.66909 ?  569 HOH A O   1 
HETATM 2037 O O   . HOH E 3 .   ? -5.98000  -17.19800 -6.95100  1.000 39.59115 ?  570 HOH A O   1 
HETATM 2038 O O   . HOH E 3 .   ? -2.56200  -5.30300  10.11300  1.000 36.66395 ?  571 HOH A O   1 
HETATM 2039 O O   . HOH E 3 .   ? -19.47300 -9.19900  -20.88900 1.000 26.47175 ?  572 HOH A O   1 
HETATM 2040 O O   . HOH E 3 .   ? -33.54300 -12.96000 15.49800  1.000 47.55259 ?  573 HOH A O   1 
HETATM 2041 O O   . HOH E 3 .   ? -18.126   8.463     23.063    1.000 41.32075 ?  574 HOH A O   1 
HETATM 2042 O O   . HOH E 3 .   ? -22.07400 -4.69800  -4.21700  1.000 41.96066 ?  575 HOH A O   1 
HETATM 2043 O O   . HOH E 3 .   ? -6.05000  -5.78800  22.87600  1.000 33.05892 ?  576 HOH A O   1 
HETATM 2044 O O   . HOH E 3 .   ? -15.72700 -22.38300 32.43000  1.000 33.81946 ?  577 HOH A O   1 
HETATM 2045 O O   . HOH E 3 .   ? -20.19100 -14.99900 32.62200  1.000 38.33535 ?  578 HOH A O   1 
HETATM 2046 O O   . HOH E 3 .   ? -18.29300 -33.74400 19.84900  1.000 25.80127 ?  579 HOH A O   1 
HETATM 2047 O O   . HOH E 3 .   ? -18.45400 -34.29200 3.66600   1.000 43.06312 ?  580 HOH A O   1 
HETATM 2048 O O   . HOH E 3 .   ? -19.87500 -30.74800 1.89200   1.000 25.20961 ?  581 HOH A O   1 
HETATM 2049 O O   . HOH E 3 .   ? -12.45300 -35.83200 13.98800  1.000 35.04887 ?  582 HOH A O   1 
HETATM 2050 O O   . HOH E 3 .   ? -33.24100 -1.15700  15.31700  1.000 38.08659 ?  583 HOH A O   1 
HETATM 2051 O O   . HOH E 3 .   ? -4.37100  -1.25700  11.16500  1.000 38.00055 ?  584 HOH A O   1 
HETATM 2052 O O   . HOH E 3 .   ? -3.35200  -12.67100 27.38200  1.000 42.43539 ?  585 HOH A O   1 
HETATM 2053 O O   . HOH E 3 .   ? -31.26700 -31.06700 16.25300  1.000 46.45144 ?  586 HOH A O   1 
HETATM 2054 O O   . HOH E 3 .   ? -23.68300 -5.98200  18.24800  1.000 22.50669 ?  587 HOH A O   1 
HETATM 2055 O O   . HOH E 3 .   ? -14.43200 -17.44400 6.17300   1.000 32.87194 ?  588 HOH A O   1 
HETATM 2056 O O   . HOH E 3 .   ? -1.13500  -30.21700 -1.20000  1.000 41.99005 ?  589 HOH A O   1 
HETATM 2057 O O   . HOH E 3 .   ? -10.22100 -30.23500 -10.72400 1.000 44.55273 ?  590 HOH A O   1 
HETATM 2058 O O   . HOH E 3 .   ? -19.25700 -23.52200 -11.58400 1.000 23.28400 ?  591 HOH A O   1 
HETATM 2059 O O   . HOH E 3 .   ? -10.17200 -8.14200  -15.77000 1.000 35.63407 ?  592 HOH A O   1 
HETATM 2060 O O   . HOH E 3 .   ? -0.29300  -5.00900  2.32800   1.000 41.61359 ?  593 HOH A O   1 
HETATM 2061 O O   . HOH E 3 .   ? -1.59600  -6.42200  17.52300  1.000 38.62358 ?  594 HOH A O   1 
HETATM 2062 O O   . HOH E 3 .   ? -17.32000 -30.91100 1.28800   1.000 26.77915 ?  595 HOH A O   1 
HETATM 2063 O O   . HOH E 3 .   ? -8.10800  -9.45500  1.42600   1.000 23.19767 ?  596 HOH A O   1 
HETATM 2064 O O   . HOH E 3 .   ? -4.92600  -26.90000 -11.26100 1.000 43.63854 ?  597 HOH A O   1 
HETATM 2065 O O   . HOH E 3 .   ? -3.07800  -33.41700 9.02900   1.000 47.40330 ?  598 HOH A O   1 
HETATM 2066 O O   . HOH E 3 .   ? -3.95500  -20.57500 6.42400   1.000 33.70191 ?  599 HOH A O   1 
HETATM 2067 O O   . HOH E 3 .   ? -11.904   1.159     16.715    1.000 40.70045 ?  600 HOH A O   1 
HETATM 2068 O O   . HOH E 3 .   ? -2.51300  -29.60000 -5.09300  1.000 43.39916 ?  601 HOH A O   1 
HETATM 2069 O O   . HOH E 3 .   ? -28.96000 -18.80300 -1.21100  1.000 36.59124 ?  602 HOH A O   1 
HETATM 2070 O O   . HOH E 3 .   ? -11.02800 -31.25700 -4.34500  1.000 39.25656 ?  603 HOH A O   1 
HETATM 2071 O O   . HOH E 3 .   ? -7.43100  -20.13400 -9.75000  1.000 44.04446 ?  604 HOH A O   1 
HETATM 2072 O O   . HOH E 3 .   ? -9.41500  -8.90900  -10.24300 1.000 37.23677 ?  605 HOH A O   1 
HETATM 2073 O O   . HOH E 3 .   ? 1.09200   -14.25300 15.88300  1.000 43.79000 ?  606 HOH A O   1 
HETATM 2074 O O   . HOH E 3 .   ? -24.396   -22.336   -6.242    1.000 42.59050 ?  607 HOH A O   1 
HETATM 2075 O O   . HOH E 3 .   ? -15.96200 -29.68900 -12.61300 1.000 34.07892 ?  608 HOH A O   1 
HETATM 2076 O O   . HOH E 3 .   ? -19.39500 -26.55900 28.91500  1.000 42.39942 ?  609 HOH A O   1 
HETATM 2077 O O   . HOH E 3 .   ? -2.16000  -12.49100 -6.33100  1.000 55.76740 ?  610 HOH A O   1 
HETATM 2078 O O   . HOH E 3 .   ? -4.08800  -13.48300 -2.65600  1.000 46.70844 ?  611 HOH A O   1 
HETATM 2079 O O   . HOH E 3 .   ? -20.65700 -6.20000  7.97700   1.000 38.26766 ?  612 HOH A O   1 
HETATM 2080 O O   . HOH E 3 .   ? -3.39200  -0.53200  -7.31200  1.000 48.06485 ?  613 HOH A O   1 
HETATM 2081 O O   . HOH E 3 .   ? -32.38300 -16.02300 17.55700  1.000 53.16884 ?  614 HOH A O   1 
HETATM 2082 O O   . HOH E 3 .   ? -25.548   6.800     28.090    1.000 38.05527 ?  615 HOH A O   1 
HETATM 2083 O O   . HOH E 3 .   ? -7.960    0.248     13.503    1.000 39.07318 ?  616 HOH A O   1 
HETATM 2084 O O   . HOH E 3 .   ? -8.52200  -13.39500 -15.34900 1.000 42.84019 ?  617 HOH A O   1 
HETATM 2085 O O   . HOH E 3 .   ? -2.48700  -12.86600 20.63300  1.000 41.24575 ?  618 HOH A O   1 
HETATM 2086 O O   . HOH E 3 .   ? -28.21300 -29.23500 -2.82700  1.000 46.06245 ?  619 HOH A O   1 
HETATM 2087 O O   . HOH E 3 .   ? -3.05800  -1.02100  0.71900   1.000 41.71324 ?  620 HOH A O   1 
HETATM 2088 O O   . HOH E 3 .   ? -3.54900  -31.84400 -7.03200  1.000 50.57220 ?  621 HOH A O   1 
HETATM 2089 O O   . HOH E 3 .   ? -16.00000 -35.20700 6.35700   1.000 45.54312 ?  622 HOH A O   1 
HETATM 2090 O O   . HOH E 3 .   ? -7.63000  -10.48500 -11.90600 1.000 43.51473 ?  623 HOH A O   1 
HETATM 2091 O O   . HOH E 3 .   ? -11.87800 -1.65200  24.34200  1.000 47.54900 ?  624 HOH A O   1 
HETATM 2092 O O   . HOH E 3 .   ? -8.01400  -13.02500 -12.50300 1.000 33.70486 ?  625 HOH A O   1 
HETATM 2093 O O   . HOH E 3 .   ? -2.58500  -26.95100 -9.98900  1.000 48.50535 ?  626 HOH A O   1 
HETATM 2094 O O   . HOH E 3 .   ? -27.09600 -9.19800  27.01700  1.000 50.30591 ?  627 HOH A O   1 
HETATM 2095 O O   . HOH E 3 .   ? -1.45300  -0.93600  -3.61300  1.000 39.43161 ?  628 HOH A O   1 
HETATM 2096 O O   . HOH E 3 .   ? -11.76600 -37.71900 5.69900   1.000 43.75714 ?  629 HOH A O   1 
HETATM 2097 O O   . HOH E 3 .   ? -19.109   -33.529   27.007    1.000 45.76371 ?  630 HOH A O   1 
HETATM 2098 O O   . HOH E 3 .   ? -22.31200 0.23100   -5.16700  1.000 49.52528 ?  631 HOH A O   1 
HETATM 2099 O O   . HOH E 3 .   ? -1.85900  -20.17800 -1.03700  1.000 46.67625 ?  632 HOH A O   1 
HETATM 2100 O O   . HOH E 3 .   ? -32.78500 -8.12900  11.69100  1.000 49.93927 ?  633 HOH A O   1 
HETATM 2101 O O   . HOH E 3 .   ? -4.99900  -3.41700  17.71200  1.000 49.34740 ?  634 HOH A O   1 
HETATM 2102 O O   . HOH E 3 .   ? -16.20500 6.30900   31.05600  1.000 51.45716 ?  635 HOH A O   1 
HETATM 2103 O O   . HOH E 3 .   ? -10.44000 -32.39000 -6.15100  1.000 38.49058 ?  636 HOH A O   1 
HETATM 2104 O O   . HOH E 3 .   ? -12.124   7.038     21.149    1.000 49.43166 ?  637 HOH A O   1 
HETATM 2105 O O   . HOH E 3 .   ? -21.78700 -13.66000 7.29600   1.000 41.08519 ?  638 HOH A O   1 
HETATM 2106 O O   . HOH E 3 .   ? -18.85200 -3.96700  29.16800  1.000 45.39572 ?  639 HOH A O   1 
HETATM 2107 O O   . HOH E 3 .   ? -0.68100  -21.41200 -2.49700  1.000 51.46227 ?  640 HOH A O   1 
HETATM 2108 O O   . HOH E 3 .   ? -25.73000 -29.11100 1.63200   1.000 43.95120 ?  641 HOH A O   1 
HETATM 2109 O O   . HOH E 3 .   ? -7.17400  -16.57300 -9.49700  1.000 42.40365 ?  642 HOH A O   1 
HETATM 2110 O O   . HOH E 3 .   ? -34.54700 -9.24800  14.05200  1.000 50.57524 ?  643 HOH A O   1 
HETATM 2111 O O   . HOH E 3 .   ? -23.75200 -15.38700 7.27300   1.000 43.71010 ?  644 HOH A O   1 
HETATM 2112 O O   . HOH E 3 .   ? -20.17400 -35.04800 18.13000  1.000 37.21555 ?  645 HOH A O   1 
HETATM 2113 O O   . HOH E 3 .   ? -2.14500  -15.73500 0.53400   1.000 43.45897 ?  646 HOH A O   1 
HETATM 2114 O O   . HOH E 3 .   ? -17.02500 -7.23400  31.37800  1.000 36.13743 ?  647 HOH A O   1 
HETATM 2115 O O   . HOH E 3 .   ? -18.09500 -13.53100 5.18300   1.000 37.90688 ?  648 HOH A O   1 
HETATM 2116 O O   . HOH E 3 .   ? -8.42900  -31.39600 -7.66400  1.000 37.08302 ?  649 HOH A O   1 
HETATM 2117 O O   . HOH E 3 .   ? -7.45200  -8.90400  -14.71800 1.000 50.17326 ?  650 HOH A O   1 
HETATM 2118 O O   . HOH E 3 .   ? -21.88900 -4.96700  -1.35300  1.000 48.58496 ?  651 HOH A O   1 
HETATM 2119 O O   . HOH E 3 .   ? 1.18200   -1.57100  -0.26400  1.000 51.33992 ?  652 HOH A O   1 
HETATM 2120 O O   . HOH E 3 .   ? -1.22500  -9.57900  -4.36100  1.000 52.76620 ?  653 HOH A O   1 
HETATM 2121 O O   . HOH E 3 .   ? -9.11000  -15.07800 -10.72400 1.000 31.95331 ?  654 HOH A O   1 
HETATM 2122 O O   . HOH E 3 .   ? -5.03900  -24.28900 27.53000  1.000 41.21045 ?  655 HOH A O   1 
HETATM 2123 O O   . HOH E 3 .   ? -16.79000 -33.50700 0.14900   1.000 40.34081 ?  656 HOH A O   1 
HETATM 2124 O O   . HOH E 3 .   ? -4.18100  -3.44000  9.12300   1.000 29.22477 ?  657 HOH A O   1 
HETATM 2125 O O   . HOH E 3 .   ? -1.47900  -28.89200 13.08900  1.000 44.72050 ?  658 HOH A O   1 
HETATM 2126 O O   . HOH E 3 .   ? -10.50600 -15.41700 33.42800  1.000 30.02093 ?  659 HOH A O   1 
HETATM 2127 O O   . HOH E 3 .   ? -1.22700  -11.90200 6.49600   1.000 28.85363 ?  660 HOH A O   1 
HETATM 2128 O O   . HOH E 3 .   ? -32.59900 -18.57300 5.31400   1.000 49.61980 ?  661 HOH A O   1 
HETATM 2129 O O   . HOH E 3 .   ? -28.29000 -0.98600  6.31700   1.000 48.30884 ?  662 HOH A O   1 
HETATM 2130 O O   . HOH E 3 .   ? -15.83000 -7.66100  -22.14400 1.000 38.88638 ?  663 HOH A O   1 
HETATM 2131 O O   . HOH E 3 .   ? 1.919     -18.533   9.557     1.000 46.00706 ?  664 HOH A O   1 
HETATM 2132 O O   . HOH E 3 .   ? -10.05700 -38.96400 10.33100  1.000 45.62977 ?  665 HOH A O   1 
HETATM 2133 O O   . HOH E 3 .   ? -8.42900  -5.85700  -12.59200 1.000 43.38412 ?  666 HOH A O   1 
HETATM 2134 O O   . HOH E 3 .   ? -21.22100 -32.73000 1.81500   1.000 44.93876 ?  667 HOH A O   1 
HETATM 2135 O O   . HOH E 3 .   ? -32.32800 -16.89700 22.92400  1.000 49.47667 ?  668 HOH A O   1 
HETATM 2136 O O   . HOH E 3 .   ? -2.25100  -5.32400  3.94600   1.000 30.12627 ?  669 HOH A O   1 
HETATM 2137 O O   . HOH E 3 .   ? 0.96400   -13.93000 3.21500   1.000 41.35972 ?  670 HOH A O   1 
HETATM 2138 O O   . HOH E 3 .   ? -33.210   -21.603   -7.176    1.000 43.92995 ?  671 HOH A O   1 
HETATM 2139 O O   . HOH E 3 .   ? -1.48600  -5.86400  8.21200   1.000 41.66135 ?  672 HOH A O   1 
HETATM 2140 O O   . HOH E 3 .   ? -2.99700  -9.83700  6.36900   1.000 24.21384 ?  673 HOH A O   1 
HETATM 2141 O O   . HOH E 3 .   ? -21.746   -2.474    -8.462    1.000 42.06624 ?  674 HOH A O   1 
HETATM 2142 O O   . HOH E 3 .   ? -11.13200 -1.90700  21.96800  1.000 35.20067 ?  675 HOH A O   1 
HETATM 2143 O O   . HOH E 3 .   ? -6.24400  -12.88100 31.49000  1.000 47.34354 ?  676 HOH A O   1 
HETATM 2144 O O   . HOH E 3 .   ? -4.05000  -1.96500  6.75000   1.000 27.36583 ?  677 HOH A O   1 
HETATM 2145 O O   . HOH E 3 .   ? 0.33800   -12.89200 0.43300   1.000 53.69556 ?  678 HOH A O   1 
HETATM 2146 O O   . HOH E 3 .   ? -1.58500  -7.40800  5.87600   1.000 27.65225 ?  679 HOH A O   1 
HETATM 2147 O O   . HOH E 3 .   ? -32.76000 1.52500   14.57600  1.000 48.72526 ?  680 HOH A O   1 
HETATM 2148 O O   . HOH E 3 .   ? 0.85900   -7.61200  4.75400   1.000 44.28130 ?  681 HOH A O   1 
HETATM 2149 O O   . HOH E 3 .   ? -4.45200  -14.73400 31.07600  1.000 44.77902 ?  682 HOH A O   1 
HETATM 2150 O O   . HOH E 3 .   ? 0.16000   -24.77700 10.18800  1.000 47.56035 ?  683 HOH A O   1 
HETATM 2151 O O   . HOH E 3 .   ? 1.07200   -10.95000 6.31200   1.000 47.53524 ?  684 HOH A O   1 
HETATM 2152 O O   . HOH E 3 .   ? -11.43400 -14.17000 35.65700  1.000 41.26372 ?  685 HOH A O   1 
HETATM 2153 O O   . HOH E 3 .   ? -1.07700  -3.31800  6.31100   1.000 46.66419 ?  686 HOH A O   1 
# 
