data_9EYA
# 
_entry.id   9EYA 
# 
_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   9EYA         pdb_00009eya 10.2210/pdb9eya/pdb 
WWPDB D_1292137790 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-02-12 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9EYA 
_pdbx_database_status.recvd_initial_deposition_date   2024-04-09 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
loop_
_pdbx_database_related.db_name 
_pdbx_database_related.details 
_pdbx_database_related.db_id 
_pdbx_database_related.content_type 
PDB . 9EX8 unspecified 
PDB . 9EXU unspecified 
# 
_pdbx_contact_author.id                 4 
_pdbx_contact_author.email              roberto.battistutta@unipd.it 
_pdbx_contact_author.name_first         Roberto 
_pdbx_contact_author.name_last          Battistutta 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-0193-0694 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Battistutta, R.' 1 ? 
'Fornasier, E.'   2 ? 
'Giachin, G.'     3 ? 
# 
_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            'Commun Biol' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2399-3642 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            7 
_citation.language                  ? 
_citation.page_first                1435 
_citation.page_last                 1435 
_citation.title                     'Allostery in homodimeric SARS-CoV-2 main protease.' 
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1038/s42003-024-07138-w 
_citation.pdbx_database_id_PubMed   39496839 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Fornasier, E.'   1  ?                   
primary 'Fabbian, S.'     2  ?                   
primary 'Shehi, H.'       3  ?                   
primary 'Enderle, J.'     4  ?                   
primary 'Gatto, B.'       5  0000-0001-9465-6913 
primary 'Volpin, D.'      6  ?                   
primary 'Biondi, B.'      7  ?                   
primary 'Bellanda, M.'    8  0000-0002-8187-0264 
primary 'Giachin, G.'     9  0000-0001-7550-0307 
primary 'Sosic, A.'       10 ?                   
primary 'Battistutta, R.' 11 0000-0002-0193-0694 
# 
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 'Non-structural protein 7'                  33726.410 1   ? ? ? ? 
2 polymer syn THR-SER-ALA-VAL-LEU-GLN-SER-GLY-PHE-ARG-LYS 1237.406  1   ? ? ? ? 
3 water   nat water                                       18.015    302 ? ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        nsp7 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 'polypeptide(L)' no no  
;SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRAVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGH
SMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSAGSVGFNIDYDCVSFC
YMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYE
PLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
;
;SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRAVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGH
SMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSAGSVGFNIDYDCVSFC
YMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYE
PLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
;
A ? 
2 'polypeptide(L)' no yes '(THC)SAVLQSGFRK' TSAVLQSGFRK C ? 
# 
_pdbx_entity_nonpoly.entity_id   3 
_pdbx_entity_nonpoly.name        water 
_pdbx_entity_nonpoly.comp_id     HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   SER n 
1 2   GLY n 
1 3   PHE n 
1 4   ARG n 
1 5   LYS n 
1 6   MET n 
1 7   ALA n 
1 8   PHE n 
1 9   PRO n 
1 10  SER n 
1 11  GLY n 
1 12  LYS n 
1 13  VAL n 
1 14  GLU n 
1 15  GLY n 
1 16  CYS n 
1 17  MET n 
1 18  VAL n 
1 19  GLN n 
1 20  VAL n 
1 21  THR n 
1 22  CYS n 
1 23  GLY n 
1 24  THR n 
1 25  THR n 
1 26  THR n 
1 27  LEU n 
1 28  ASN n 
1 29  GLY n 
1 30  LEU n 
1 31  TRP n 
1 32  LEU n 
1 33  ASP n 
1 34  ASP n 
1 35  VAL n 
1 36  VAL n 
1 37  TYR n 
1 38  CYS n 
1 39  PRO n 
1 40  ARG n 
1 41  ALA n 
1 42  VAL n 
1 43  ILE n 
1 44  CYS n 
1 45  THR n 
1 46  SER n 
1 47  GLU n 
1 48  ASP n 
1 49  MET n 
1 50  LEU n 
1 51  ASN n 
1 52  PRO n 
1 53  ASN n 
1 54  TYR n 
1 55  GLU n 
1 56  ASP n 
1 57  LEU n 
1 58  LEU n 
1 59  ILE n 
1 60  ARG n 
1 61  LYS n 
1 62  SER n 
1 63  ASN n 
1 64  HIS n 
1 65  ASN n 
1 66  PHE n 
1 67  LEU n 
1 68  VAL n 
1 69  GLN n 
1 70  ALA n 
1 71  GLY n 
1 72  ASN n 
1 73  VAL n 
1 74  GLN n 
1 75  LEU n 
1 76  ARG n 
1 77  VAL n 
1 78  ILE n 
1 79  GLY n 
1 80  HIS n 
1 81  SER n 
1 82  MET n 
1 83  GLN n 
1 84  ASN n 
1 85  CYS n 
1 86  VAL n 
1 87  LEU n 
1 88  LYS n 
1 89  LEU n 
1 90  LYS n 
1 91  VAL n 
1 92  ASP n 
1 93  THR n 
1 94  ALA n 
1 95  ASN n 
1 96  PRO n 
1 97  LYS n 
1 98  THR n 
1 99  PRO n 
1 100 LYS n 
1 101 TYR n 
1 102 LYS n 
1 103 PHE n 
1 104 VAL n 
1 105 ARG n 
1 106 ILE n 
1 107 GLN n 
1 108 PRO n 
1 109 GLY n 
1 110 GLN n 
1 111 THR n 
1 112 PHE n 
1 113 SER n 
1 114 VAL n 
1 115 LEU n 
1 116 ALA n 
1 117 CYS n 
1 118 TYR n 
1 119 ASN n 
1 120 GLY n 
1 121 SER n 
1 122 PRO n 
1 123 SER n 
1 124 GLY n 
1 125 VAL n 
1 126 TYR n 
1 127 GLN n 
1 128 CYS n 
1 129 ALA n 
1 130 MET n 
1 131 ARG n 
1 132 PRO n 
1 133 ASN n 
1 134 PHE n 
1 135 THR n 
1 136 ILE n 
1 137 LYS n 
1 138 GLY n 
1 139 SER n 
1 140 PHE n 
1 141 LEU n 
1 142 ASN n 
1 143 GLY n 
1 144 SER n 
1 145 ALA n 
1 146 GLY n 
1 147 SER n 
1 148 VAL n 
1 149 GLY n 
1 150 PHE n 
1 151 ASN n 
1 152 ILE n 
1 153 ASP n 
1 154 TYR n 
1 155 ASP n 
1 156 CYS n 
1 157 VAL n 
1 158 SER n 
1 159 PHE n 
1 160 CYS n 
1 161 TYR n 
1 162 MET n 
1 163 HIS n 
1 164 HIS n 
1 165 MET n 
1 166 GLU n 
1 167 LEU n 
1 168 PRO n 
1 169 THR n 
1 170 GLY n 
1 171 VAL n 
1 172 HIS n 
1 173 ALA n 
1 174 GLY n 
1 175 THR n 
1 176 ASP n 
1 177 LEU n 
1 178 GLU n 
1 179 GLY n 
1 180 ASN n 
1 181 PHE n 
1 182 TYR n 
1 183 GLY n 
1 184 PRO n 
1 185 PHE n 
1 186 VAL n 
1 187 ASP n 
1 188 ARG n 
1 189 GLN n 
1 190 THR n 
1 191 ALA n 
1 192 GLN n 
1 193 ALA n 
1 194 ALA n 
1 195 GLY n 
1 196 THR n 
1 197 ASP n 
1 198 THR n 
1 199 THR n 
1 200 ILE n 
1 201 THR n 
1 202 VAL n 
1 203 ASN n 
1 204 VAL n 
1 205 LEU n 
1 206 ALA n 
1 207 TRP n 
1 208 LEU n 
1 209 TYR n 
1 210 ALA n 
1 211 ALA n 
1 212 VAL n 
1 213 ILE n 
1 214 ASN n 
1 215 GLY n 
1 216 ASP n 
1 217 ARG n 
1 218 TRP n 
1 219 PHE n 
1 220 LEU n 
1 221 ASN n 
1 222 ARG n 
1 223 PHE n 
1 224 THR n 
1 225 THR n 
1 226 THR n 
1 227 LEU n 
1 228 ASN n 
1 229 ASP n 
1 230 PHE n 
1 231 ASN n 
1 232 LEU n 
1 233 VAL n 
1 234 ALA n 
1 235 MET n 
1 236 LYS n 
1 237 TYR n 
1 238 ASN n 
1 239 TYR n 
1 240 GLU n 
1 241 PRO n 
1 242 LEU n 
1 243 THR n 
1 244 GLN n 
1 245 ASP n 
1 246 HIS n 
1 247 VAL n 
1 248 ASP n 
1 249 ILE n 
1 250 LEU n 
1 251 GLY n 
1 252 PRO n 
1 253 LEU n 
1 254 SER n 
1 255 ALA n 
1 256 GLN n 
1 257 THR n 
1 258 GLY n 
1 259 ILE n 
1 260 ALA n 
1 261 VAL n 
1 262 LEU n 
1 263 ASP n 
1 264 MET n 
1 265 CYS n 
1 266 ALA n 
1 267 SER n 
1 268 LEU n 
1 269 LYS n 
1 270 GLU n 
1 271 LEU n 
1 272 LEU n 
1 273 GLN n 
1 274 ASN n 
1 275 GLY n 
1 276 MET n 
1 277 ASN n 
1 278 GLY n 
1 279 ARG n 
1 280 THR n 
1 281 ILE n 
1 282 LEU n 
1 283 GLY n 
1 284 SER n 
1 285 ALA n 
1 286 LEU n 
1 287 LEU n 
1 288 GLU n 
1 289 ASP n 
1 290 GLU n 
1 291 PHE n 
1 292 THR n 
1 293 PRO n 
1 294 PHE n 
1 295 ASP n 
1 296 VAL n 
1 297 VAL n 
1 298 ARG n 
1 299 GLN n 
1 300 CYS n 
1 301 SER n 
1 302 GLY n 
1 303 VAL n 
1 304 THR n 
1 305 PHE n 
1 306 GLN n 
2 1   THC n 
2 2   SER n 
2 3   ALA n 
2 4   VAL n 
2 5   LEU n 
2 6   GLN n 
2 7   SER n 
2 8   GLY n 
2 9   PHE n 
2 10  ARG n 
2 11  LYS 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                   306 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'rep, 1a-1b' 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Severe acute respiratory syndrome coronavirus 2' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     2697049 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     562 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
_pdbx_entity_src_syn.entity_id              2 
_pdbx_entity_src_syn.pdbx_src_id            1 
_pdbx_entity_src_syn.pdbx_alt_source_flag   sample 
_pdbx_entity_src_syn.pdbx_beg_seq_num       1 
_pdbx_entity_src_syn.pdbx_end_seq_num       11 
_pdbx_entity_src_syn.organism_scientific    'Severe acute respiratory syndrome coronavirus 2' 
_pdbx_entity_src_syn.organism_common_name   ? 
_pdbx_entity_src_syn.ncbi_taxonomy_id       2697049 
_pdbx_entity_src_syn.details                ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE                   ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE                  ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE                ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID'           ? 'C4 H7 N O4'     133.103 
CYS 'L-peptide linking' y CYSTEINE                  ? 'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE                 ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'           ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE                   ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE                 ? 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER                     ? 'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE                ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE                   ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE                    ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE                ? 'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE             ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE                   ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE                    ? 'C3 H7 N O3'     105.093 
THC 'L-peptide linking' n N-METHYLCARBONYLTHREONINE ? 'C6 H11 N O4'    161.156 
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   SER 1   1   1   SER SER A . n 
A 1 2   GLY 2   2   2   GLY GLY A . n 
A 1 3   PHE 3   3   3   PHE PHE A . n 
A 1 4   ARG 4   4   4   ARG ARG A . n 
A 1 5   LYS 5   5   5   LYS LYS A . n 
A 1 6   MET 6   6   6   MET MET A . n 
A 1 7   ALA 7   7   7   ALA ALA A . n 
A 1 8   PHE 8   8   8   PHE PHE A . n 
A 1 9   PRO 9   9   9   PRO PRO A . n 
A 1 10  SER 10  10  10  SER SER A . n 
A 1 11  GLY 11  11  11  GLY GLY A . n 
A 1 12  LYS 12  12  12  LYS LYS A . n 
A 1 13  VAL 13  13  13  VAL VAL A . n 
A 1 14  GLU 14  14  14  GLU GLU A . n 
A 1 15  GLY 15  15  15  GLY GLY A . n 
A 1 16  CYS 16  16  16  CYS CYS A . n 
A 1 17  MET 17  17  17  MET MET A . n 
A 1 18  VAL 18  18  18  VAL VAL A . n 
A 1 19  GLN 19  19  19  GLN GLN A . n 
A 1 20  VAL 20  20  20  VAL VAL A . n 
A 1 21  THR 21  21  21  THR THR A . n 
A 1 22  CYS 22  22  22  CYS CYS A . n 
A 1 23  GLY 23  23  23  GLY GLY A . n 
A 1 24  THR 24  24  24  THR THR A . n 
A 1 25  THR 25  25  25  THR THR A . n 
A 1 26  THR 26  26  26  THR THR A . n 
A 1 27  LEU 27  27  27  LEU LEU A . n 
A 1 28  ASN 28  28  28  ASN ASN A . n 
A 1 29  GLY 29  29  29  GLY GLY A . n 
A 1 30  LEU 30  30  30  LEU LEU A . n 
A 1 31  TRP 31  31  31  TRP TRP A . n 
A 1 32  LEU 32  32  32  LEU LEU A . n 
A 1 33  ASP 33  33  33  ASP ASP A . n 
A 1 34  ASP 34  34  34  ASP ASP A . n 
A 1 35  VAL 35  35  35  VAL VAL A . n 
A 1 36  VAL 36  36  36  VAL VAL A . n 
A 1 37  TYR 37  37  37  TYR TYR A . n 
A 1 38  CYS 38  38  38  CYS CYS A . n 
A 1 39  PRO 39  39  39  PRO PRO A . n 
A 1 40  ARG 40  40  40  ARG ARG A . n 
A 1 41  ALA 41  41  41  ALA ALA A . n 
A 1 42  VAL 42  42  42  VAL VAL A . n 
A 1 43  ILE 43  43  43  ILE ILE A . n 
A 1 44  CYS 44  44  44  CYS CYS A . n 
A 1 45  THR 45  45  45  THR THR A . n 
A 1 46  SER 46  46  46  SER SER A . n 
A 1 47  GLU 47  47  47  GLU GLU A . n 
A 1 48  ASP 48  48  48  ASP ASP A . n 
A 1 49  MET 49  49  49  MET MET A . n 
A 1 50  LEU 50  50  50  LEU LEU A . n 
A 1 51  ASN 51  51  51  ASN ASN A . n 
A 1 52  PRO 52  52  52  PRO PRO A . n 
A 1 53  ASN 53  53  53  ASN ASN A . n 
A 1 54  TYR 54  54  54  TYR TYR A . n 
A 1 55  GLU 55  55  55  GLU GLU A . n 
A 1 56  ASP 56  56  56  ASP ASP A . n 
A 1 57  LEU 57  57  57  LEU LEU A . n 
A 1 58  LEU 58  58  58  LEU LEU A . n 
A 1 59  ILE 59  59  59  ILE ILE A . n 
A 1 60  ARG 60  60  60  ARG ARG A . n 
A 1 61  LYS 61  61  61  LYS LYS A . n 
A 1 62  SER 62  62  62  SER SER A . n 
A 1 63  ASN 63  63  63  ASN ASN A . n 
A 1 64  HIS 64  64  64  HIS HIS A . n 
A 1 65  ASN 65  65  65  ASN ASN A . n 
A 1 66  PHE 66  66  66  PHE PHE A . n 
A 1 67  LEU 67  67  67  LEU LEU A . n 
A 1 68  VAL 68  68  68  VAL VAL A . n 
A 1 69  GLN 69  69  69  GLN GLN A . n 
A 1 70  ALA 70  70  70  ALA ALA A . n 
A 1 71  GLY 71  71  71  GLY GLY A . n 
A 1 72  ASN 72  72  72  ASN ASN A . n 
A 1 73  VAL 73  73  73  VAL VAL A . n 
A 1 74  GLN 74  74  74  GLN GLN A . n 
A 1 75  LEU 75  75  75  LEU LEU A . n 
A 1 76  ARG 76  76  76  ARG ARG A . n 
A 1 77  VAL 77  77  77  VAL VAL A . n 
A 1 78  ILE 78  78  78  ILE ILE A . n 
A 1 79  GLY 79  79  79  GLY GLY A . n 
A 1 80  HIS 80  80  80  HIS HIS A . n 
A 1 81  SER 81  81  81  SER SER A . n 
A 1 82  MET 82  82  82  MET MET A . n 
A 1 83  GLN 83  83  83  GLN GLN A . n 
A 1 84  ASN 84  84  84  ASN ASN A . n 
A 1 85  CYS 85  85  85  CYS CYS A . n 
A 1 86  VAL 86  86  86  VAL VAL A . n 
A 1 87  LEU 87  87  87  LEU LEU A . n 
A 1 88  LYS 88  88  88  LYS LYS A . n 
A 1 89  LEU 89  89  89  LEU LEU A . n 
A 1 90  LYS 90  90  90  LYS LYS A . n 
A 1 91  VAL 91  91  91  VAL VAL A . n 
A 1 92  ASP 92  92  92  ASP ASP A . n 
A 1 93  THR 93  93  93  THR THR A . n 
A 1 94  ALA 94  94  94  ALA ALA A . n 
A 1 95  ASN 95  95  95  ASN ASN A . n 
A 1 96  PRO 96  96  96  PRO PRO A . n 
A 1 97  LYS 97  97  97  LYS LYS A . n 
A 1 98  THR 98  98  98  THR THR A . n 
A 1 99  PRO 99  99  99  PRO PRO A . n 
A 1 100 LYS 100 100 100 LYS LYS A . n 
A 1 101 TYR 101 101 101 TYR TYR A . n 
A 1 102 LYS 102 102 102 LYS LYS A . n 
A 1 103 PHE 103 103 103 PHE PHE A . n 
A 1 104 VAL 104 104 104 VAL VAL A . n 
A 1 105 ARG 105 105 105 ARG ARG A . n 
A 1 106 ILE 106 106 106 ILE ILE A . n 
A 1 107 GLN 107 107 107 GLN GLN A . n 
A 1 108 PRO 108 108 108 PRO PRO A . n 
A 1 109 GLY 109 109 109 GLY GLY A . n 
A 1 110 GLN 110 110 110 GLN GLN A . n 
A 1 111 THR 111 111 111 THR THR A . n 
A 1 112 PHE 112 112 112 PHE PHE A . n 
A 1 113 SER 113 113 113 SER SER A . n 
A 1 114 VAL 114 114 114 VAL VAL A . n 
A 1 115 LEU 115 115 115 LEU LEU A . n 
A 1 116 ALA 116 116 116 ALA ALA A . n 
A 1 117 CYS 117 117 117 CYS CYS A . n 
A 1 118 TYR 118 118 118 TYR TYR A . n 
A 1 119 ASN 119 119 119 ASN ASN A . n 
A 1 120 GLY 120 120 120 GLY GLY A . n 
A 1 121 SER 121 121 121 SER SER A . n 
A 1 122 PRO 122 122 122 PRO PRO A . n 
A 1 123 SER 123 123 123 SER SER A . n 
A 1 124 GLY 124 124 124 GLY GLY A . n 
A 1 125 VAL 125 125 125 VAL VAL A . n 
A 1 126 TYR 126 126 126 TYR TYR A . n 
A 1 127 GLN 127 127 127 GLN GLN A . n 
A 1 128 CYS 128 128 128 CYS CYS A . n 
A 1 129 ALA 129 129 129 ALA ALA A . n 
A 1 130 MET 130 130 130 MET MET A . n 
A 1 131 ARG 131 131 131 ARG ARG A . n 
A 1 132 PRO 132 132 132 PRO PRO A . n 
A 1 133 ASN 133 133 133 ASN ASN A . n 
A 1 134 PHE 134 134 134 PHE PHE A . n 
A 1 135 THR 135 135 135 THR THR A . n 
A 1 136 ILE 136 136 136 ILE ILE A . n 
A 1 137 LYS 137 137 137 LYS LYS A . n 
A 1 138 GLY 138 138 138 GLY GLY A . n 
A 1 139 SER 139 139 139 SER SER A . n 
A 1 140 PHE 140 140 140 PHE PHE A . n 
A 1 141 LEU 141 141 141 LEU LEU A . n 
A 1 142 ASN 142 142 142 ASN ASN A . n 
A 1 143 GLY 143 143 143 GLY GLY A . n 
A 1 144 SER 144 144 144 SER SER A . n 
A 1 145 ALA 145 145 145 ALA ALA A . n 
A 1 146 GLY 146 146 146 GLY GLY A . n 
A 1 147 SER 147 147 147 SER SER A . n 
A 1 148 VAL 148 148 148 VAL VAL A . n 
A 1 149 GLY 149 149 149 GLY GLY A . n 
A 1 150 PHE 150 150 150 PHE PHE A . n 
A 1 151 ASN 151 151 151 ASN ASN A . n 
A 1 152 ILE 152 152 152 ILE ILE A . n 
A 1 153 ASP 153 153 153 ASP ASP A . n 
A 1 154 TYR 154 154 154 TYR TYR A . n 
A 1 155 ASP 155 155 155 ASP ASP A . n 
A 1 156 CYS 156 156 156 CYS CYS A . n 
A 1 157 VAL 157 157 157 VAL VAL A . n 
A 1 158 SER 158 158 158 SER SER A . n 
A 1 159 PHE 159 159 159 PHE PHE A . n 
A 1 160 CYS 160 160 160 CYS CYS A . n 
A 1 161 TYR 161 161 161 TYR TYR A . n 
A 1 162 MET 162 162 162 MET MET A . n 
A 1 163 HIS 163 163 163 HIS HIS A . n 
A 1 164 HIS 164 164 164 HIS HIS A . n 
A 1 165 MET 165 165 165 MET MET A . n 
A 1 166 GLU 166 166 166 GLU GLU A . n 
A 1 167 LEU 167 167 167 LEU LEU A . n 
A 1 168 PRO 168 168 168 PRO PRO A . n 
A 1 169 THR 169 169 169 THR THR A . n 
A 1 170 GLY 170 170 170 GLY GLY A . n 
A 1 171 VAL 171 171 171 VAL VAL A . n 
A 1 172 HIS 172 172 172 HIS HIS A . n 
A 1 173 ALA 173 173 173 ALA ALA A . n 
A 1 174 GLY 174 174 174 GLY GLY A . n 
A 1 175 THR 175 175 175 THR THR A . n 
A 1 176 ASP 176 176 176 ASP ASP A . n 
A 1 177 LEU 177 177 177 LEU LEU A . n 
A 1 178 GLU 178 178 178 GLU GLU A . n 
A 1 179 GLY 179 179 179 GLY GLY A . n 
A 1 180 ASN 180 180 180 ASN ASN A . n 
A 1 181 PHE 181 181 181 PHE PHE A . n 
A 1 182 TYR 182 182 182 TYR TYR A . n 
A 1 183 GLY 183 183 183 GLY GLY A . n 
A 1 184 PRO 184 184 184 PRO PRO A . n 
A 1 185 PHE 185 185 185 PHE PHE A . n 
A 1 186 VAL 186 186 186 VAL VAL A . n 
A 1 187 ASP 187 187 187 ASP ASP A . n 
A 1 188 ARG 188 188 188 ARG ARG A . n 
A 1 189 GLN 189 189 189 GLN GLN A . n 
A 1 190 THR 190 190 190 THR THR A . n 
A 1 191 ALA 191 191 191 ALA ALA A . n 
A 1 192 GLN 192 192 192 GLN GLN A . n 
A 1 193 ALA 193 193 193 ALA ALA A . n 
A 1 194 ALA 194 194 194 ALA ALA A . n 
A 1 195 GLY 195 195 195 GLY GLY A . n 
A 1 196 THR 196 196 196 THR THR A . n 
A 1 197 ASP 197 197 197 ASP ASP A . n 
A 1 198 THR 198 198 198 THR THR A . n 
A 1 199 THR 199 199 199 THR THR A . n 
A 1 200 ILE 200 200 200 ILE ILE A . n 
A 1 201 THR 201 201 201 THR THR A . n 
A 1 202 VAL 202 202 202 VAL VAL A . n 
A 1 203 ASN 203 203 203 ASN ASN A . n 
A 1 204 VAL 204 204 204 VAL VAL A . n 
A 1 205 LEU 205 205 205 LEU LEU A . n 
A 1 206 ALA 206 206 206 ALA ALA A . n 
A 1 207 TRP 207 207 207 TRP TRP A . n 
A 1 208 LEU 208 208 208 LEU LEU A . n 
A 1 209 TYR 209 209 209 TYR TYR A . n 
A 1 210 ALA 210 210 210 ALA ALA A . n 
A 1 211 ALA 211 211 211 ALA ALA A . n 
A 1 212 VAL 212 212 212 VAL VAL A . n 
A 1 213 ILE 213 213 213 ILE ILE A . n 
A 1 214 ASN 214 214 214 ASN ASN A . n 
A 1 215 GLY 215 215 215 GLY GLY A . n 
A 1 216 ASP 216 216 216 ASP ASP A . n 
A 1 217 ARG 217 217 217 ARG ARG A . n 
A 1 218 TRP 218 218 218 TRP TRP A . n 
A 1 219 PHE 219 219 219 PHE PHE A . n 
A 1 220 LEU 220 220 220 LEU LEU A . n 
A 1 221 ASN 221 221 221 ASN ASN A . n 
A 1 222 ARG 222 222 222 ARG ARG A . n 
A 1 223 PHE 223 223 223 PHE PHE A . n 
A 1 224 THR 224 224 224 THR THR A . n 
A 1 225 THR 225 225 225 THR THR A . n 
A 1 226 THR 226 226 226 THR THR A . n 
A 1 227 LEU 227 227 227 LEU LEU A . n 
A 1 228 ASN 228 228 228 ASN ASN A . n 
A 1 229 ASP 229 229 229 ASP ASP A . n 
A 1 230 PHE 230 230 230 PHE PHE A . n 
A 1 231 ASN 231 231 231 ASN ASN A . n 
A 1 232 LEU 232 232 232 LEU LEU A . n 
A 1 233 VAL 233 233 233 VAL VAL A . n 
A 1 234 ALA 234 234 234 ALA ALA A . n 
A 1 235 MET 235 235 235 MET MET A . n 
A 1 236 LYS 236 236 236 LYS LYS A . n 
A 1 237 TYR 237 237 237 TYR TYR A . n 
A 1 238 ASN 238 238 238 ASN ASN A . n 
A 1 239 TYR 239 239 239 TYR TYR A . n 
A 1 240 GLU 240 240 240 GLU GLU A . n 
A 1 241 PRO 241 241 241 PRO PRO A . n 
A 1 242 LEU 242 242 242 LEU LEU A . n 
A 1 243 THR 243 243 243 THR THR A . n 
A 1 244 GLN 244 244 244 GLN GLN A . n 
A 1 245 ASP 245 245 245 ASP ASP A . n 
A 1 246 HIS 246 246 246 HIS HIS A . n 
A 1 247 VAL 247 247 247 VAL VAL A . n 
A 1 248 ASP 248 248 248 ASP ASP A . n 
A 1 249 ILE 249 249 249 ILE ILE A . n 
A 1 250 LEU 250 250 250 LEU LEU A . n 
A 1 251 GLY 251 251 251 GLY GLY A . n 
A 1 252 PRO 252 252 252 PRO PRO A . n 
A 1 253 LEU 253 253 253 LEU LEU A . n 
A 1 254 SER 254 254 254 SER SER A . n 
A 1 255 ALA 255 255 255 ALA ALA A . n 
A 1 256 GLN 256 256 256 GLN GLN A . n 
A 1 257 THR 257 257 257 THR THR A . n 
A 1 258 GLY 258 258 258 GLY GLY A . n 
A 1 259 ILE 259 259 259 ILE ILE A . n 
A 1 260 ALA 260 260 260 ALA ALA A . n 
A 1 261 VAL 261 261 261 VAL VAL A . n 
A 1 262 LEU 262 262 262 LEU LEU A . n 
A 1 263 ASP 263 263 263 ASP ASP A . n 
A 1 264 MET 264 264 264 MET MET A . n 
A 1 265 CYS 265 265 265 CYS CYS A . n 
A 1 266 ALA 266 266 266 ALA ALA A . n 
A 1 267 SER 267 267 267 SER SER A . n 
A 1 268 LEU 268 268 268 LEU LEU A . n 
A 1 269 LYS 269 269 269 LYS LYS A . n 
A 1 270 GLU 270 270 270 GLU GLU A . n 
A 1 271 LEU 271 271 271 LEU LEU A . n 
A 1 272 LEU 272 272 272 LEU LEU A . n 
A 1 273 GLN 273 273 273 GLN GLN A . n 
A 1 274 ASN 274 274 274 ASN ASN A . n 
A 1 275 GLY 275 275 275 GLY GLY A . n 
A 1 276 MET 276 276 276 MET MET A . n 
A 1 277 ASN 277 277 277 ASN ASN A . n 
A 1 278 GLY 278 278 278 GLY GLY A . n 
A 1 279 ARG 279 279 279 ARG ARG A . n 
A 1 280 THR 280 280 280 THR THR A . n 
A 1 281 ILE 281 281 281 ILE ILE A . n 
A 1 282 LEU 282 282 282 LEU LEU A . n 
A 1 283 GLY 283 283 283 GLY GLY A . n 
A 1 284 SER 284 284 284 SER SER A . n 
A 1 285 ALA 285 285 285 ALA ALA A . n 
A 1 286 LEU 286 286 286 LEU LEU A . n 
A 1 287 LEU 287 287 287 LEU LEU A . n 
A 1 288 GLU 288 288 288 GLU GLU A . n 
A 1 289 ASP 289 289 289 ASP ASP A . n 
A 1 290 GLU 290 290 290 GLU GLU A . n 
A 1 291 PHE 291 291 291 PHE PHE A . n 
A 1 292 THR 292 292 292 THR THR A . n 
A 1 293 PRO 293 293 293 PRO PRO A . n 
A 1 294 PHE 294 294 294 PHE PHE A . n 
A 1 295 ASP 295 295 295 ASP ASP A . n 
A 1 296 VAL 296 296 296 VAL VAL A . n 
A 1 297 VAL 297 297 297 VAL VAL A . n 
A 1 298 ARG 298 298 298 ARG ARG A . n 
A 1 299 GLN 299 299 299 GLN GLN A . n 
A 1 300 CYS 300 300 300 CYS CYS A . n 
A 1 301 SER 301 301 301 SER SER A . n 
A 1 302 GLY 302 302 302 GLY GLY A . n 
A 1 303 VAL 303 303 303 VAL VAL A . n 
A 1 304 THR 304 304 304 THR THR A . n 
A 1 305 PHE 305 305 305 PHE PHE A . n 
A 1 306 GLN 306 306 306 GLN GLN A . n 
B 2 1   THC 1   0   0   THC THR C . n 
B 2 2   SER 2   1   1   SER SER C . n 
B 2 3   ALA 3   2   2   ALA ALA C . n 
B 2 4   VAL 4   3   3   VAL VAL C . n 
B 2 5   LEU 5   4   4   LEU LEU C . n 
B 2 6   GLN 6   5   5   GLN GLN C . n 
B 2 7   SER 7   6   6   SER SER C . n 
B 2 8   GLY 8   7   7   GLY GLY C . n 
B 2 9   PHE 9   8   8   PHE PHE C . n 
B 2 10  ARG 10  9   9   ARG ARG C . n 
B 2 11  LYS 11  10  10  LYS LYS C . 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 
C 3 HOH 1   401 102 HOH HOH A . 
C 3 HOH 2   402 296 HOH HOH A . 
C 3 HOH 3   403 149 HOH HOH A . 
C 3 HOH 4   404 52  HOH HOH A . 
C 3 HOH 5   405 195 HOH HOH A . 
C 3 HOH 6   406 213 HOH HOH A . 
C 3 HOH 7   407 14  HOH HOH A . 
C 3 HOH 8   408 56  HOH HOH A . 
C 3 HOH 9   409 244 HOH HOH A . 
C 3 HOH 10  410 188 HOH HOH A . 
C 3 HOH 11  411 86  HOH HOH A . 
C 3 HOH 12  412 176 HOH HOH A . 
C 3 HOH 13  413 108 HOH HOH A . 
C 3 HOH 14  414 24  HOH HOH A . 
C 3 HOH 15  415 261 HOH HOH A . 
C 3 HOH 16  416 110 HOH HOH A . 
C 3 HOH 17  417 45  HOH HOH A . 
C 3 HOH 18  418 139 HOH HOH A . 
C 3 HOH 19  419 163 HOH HOH A . 
C 3 HOH 20  420 135 HOH HOH A . 
C 3 HOH 21  421 90  HOH HOH A . 
C 3 HOH 22  422 278 HOH HOH A . 
C 3 HOH 23  423 287 HOH HOH A . 
C 3 HOH 24  424 179 HOH HOH A . 
C 3 HOH 25  425 249 HOH HOH A . 
C 3 HOH 26  426 253 HOH HOH A . 
C 3 HOH 27  427 38  HOH HOH A . 
C 3 HOH 28  428 126 HOH HOH A . 
C 3 HOH 29  429 167 HOH HOH A . 
C 3 HOH 30  430 171 HOH HOH A . 
C 3 HOH 31  431 252 HOH HOH A . 
C 3 HOH 32  432 209 HOH HOH A . 
C 3 HOH 33  433 241 HOH HOH A . 
C 3 HOH 34  434 275 HOH HOH A . 
C 3 HOH 35  435 26  HOH HOH A . 
C 3 HOH 36  436 61  HOH HOH A . 
C 3 HOH 37  437 70  HOH HOH A . 
C 3 HOH 38  438 44  HOH HOH A . 
C 3 HOH 39  439 251 HOH HOH A . 
C 3 HOH 40  440 57  HOH HOH A . 
C 3 HOH 41  441 260 HOH HOH A . 
C 3 HOH 42  442 214 HOH HOH A . 
C 3 HOH 43  443 13  HOH HOH A . 
C 3 HOH 44  444 6   HOH HOH A . 
C 3 HOH 45  445 141 HOH HOH A . 
C 3 HOH 46  446 266 HOH HOH A . 
C 3 HOH 47  447 21  HOH HOH A . 
C 3 HOH 48  448 12  HOH HOH A . 
C 3 HOH 49  449 4   HOH HOH A . 
C 3 HOH 50  450 140 HOH HOH A . 
C 3 HOH 51  451 100 HOH HOH A . 
C 3 HOH 52  452 10  HOH HOH A . 
C 3 HOH 53  453 170 HOH HOH A . 
C 3 HOH 54  454 39  HOH HOH A . 
C 3 HOH 55  455 183 HOH HOH A . 
C 3 HOH 56  456 162 HOH HOH A . 
C 3 HOH 57  457 63  HOH HOH A . 
C 3 HOH 58  458 156 HOH HOH A . 
C 3 HOH 59  459 22  HOH HOH A . 
C 3 HOH 60  460 204 HOH HOH A . 
C 3 HOH 61  461 269 HOH HOH A . 
C 3 HOH 62  462 7   HOH HOH A . 
C 3 HOH 63  463 74  HOH HOH A . 
C 3 HOH 64  464 178 HOH HOH A . 
C 3 HOH 65  465 190 HOH HOH A . 
C 3 HOH 66  466 259 HOH HOH A . 
C 3 HOH 67  467 136 HOH HOH A . 
C 3 HOH 68  468 240 HOH HOH A . 
C 3 HOH 69  469 87  HOH HOH A . 
C 3 HOH 70  470 233 HOH HOH A . 
C 3 HOH 71  471 114 HOH HOH A . 
C 3 HOH 72  472 64  HOH HOH A . 
C 3 HOH 73  473 134 HOH HOH A . 
C 3 HOH 74  474 73  HOH HOH A . 
C 3 HOH 75  475 3   HOH HOH A . 
C 3 HOH 76  476 91  HOH HOH A . 
C 3 HOH 77  477 255 HOH HOH A . 
C 3 HOH 78  478 93  HOH HOH A . 
C 3 HOH 79  479 137 HOH HOH A . 
C 3 HOH 80  480 97  HOH HOH A . 
C 3 HOH 81  481 42  HOH HOH A . 
C 3 HOH 82  482 228 HOH HOH A . 
C 3 HOH 83  483 67  HOH HOH A . 
C 3 HOH 84  484 92  HOH HOH A . 
C 3 HOH 85  485 54  HOH HOH A . 
C 3 HOH 86  486 128 HOH HOH A . 
C 3 HOH 87  487 119 HOH HOH A . 
C 3 HOH 88  488 9   HOH HOH A . 
C 3 HOH 89  489 33  HOH HOH A . 
C 3 HOH 90  490 124 HOH HOH A . 
C 3 HOH 91  491 206 HOH HOH A . 
C 3 HOH 92  492 112 HOH HOH A . 
C 3 HOH 93  493 50  HOH HOH A . 
C 3 HOH 94  494 146 HOH HOH A . 
C 3 HOH 95  495 11  HOH HOH A . 
C 3 HOH 96  496 32  HOH HOH A . 
C 3 HOH 97  497 79  HOH HOH A . 
C 3 HOH 98  498 34  HOH HOH A . 
C 3 HOH 99  499 211 HOH HOH A . 
C 3 HOH 100 500 111 HOH HOH A . 
C 3 HOH 101 501 203 HOH HOH A . 
C 3 HOH 102 502 77  HOH HOH A . 
C 3 HOH 103 503 122 HOH HOH A . 
C 3 HOH 104 504 95  HOH HOH A . 
C 3 HOH 105 505 116 HOH HOH A . 
C 3 HOH 106 506 154 HOH HOH A . 
C 3 HOH 107 507 264 HOH HOH A . 
C 3 HOH 108 508 235 HOH HOH A . 
C 3 HOH 109 509 75  HOH HOH A . 
C 3 HOH 110 510 59  HOH HOH A . 
C 3 HOH 111 511 36  HOH HOH A . 
C 3 HOH 112 512 19  HOH HOH A . 
C 3 HOH 113 513 5   HOH HOH A . 
C 3 HOH 114 514 219 HOH HOH A . 
C 3 HOH 115 515 89  HOH HOH A . 
C 3 HOH 116 516 23  HOH HOH A . 
C 3 HOH 117 517 43  HOH HOH A . 
C 3 HOH 118 518 105 HOH HOH A . 
C 3 HOH 119 519 150 HOH HOH A . 
C 3 HOH 120 520 181 HOH HOH A . 
C 3 HOH 121 521 30  HOH HOH A . 
C 3 HOH 122 522 15  HOH HOH A . 
C 3 HOH 123 523 72  HOH HOH A . 
C 3 HOH 124 524 151 HOH HOH A . 
C 3 HOH 125 525 83  HOH HOH A . 
C 3 HOH 126 526 71  HOH HOH A . 
C 3 HOH 127 527 286 HOH HOH A . 
C 3 HOH 128 528 107 HOH HOH A . 
C 3 HOH 129 529 46  HOH HOH A . 
C 3 HOH 130 530 104 HOH HOH A . 
C 3 HOH 131 531 133 HOH HOH A . 
C 3 HOH 132 532 265 HOH HOH A . 
C 3 HOH 133 533 41  HOH HOH A . 
C 3 HOH 134 534 239 HOH HOH A . 
C 3 HOH 135 535 17  HOH HOH A . 
C 3 HOH 136 536 225 HOH HOH A . 
C 3 HOH 137 537 164 HOH HOH A . 
C 3 HOH 138 538 84  HOH HOH A . 
C 3 HOH 139 539 215 HOH HOH A . 
C 3 HOH 140 540 143 HOH HOH A . 
C 3 HOH 141 541 8   HOH HOH A . 
C 3 HOH 142 542 182 HOH HOH A . 
C 3 HOH 143 543 88  HOH HOH A . 
C 3 HOH 144 544 37  HOH HOH A . 
C 3 HOH 145 545 48  HOH HOH A . 
C 3 HOH 146 546 85  HOH HOH A . 
C 3 HOH 147 547 283 HOH HOH A . 
C 3 HOH 148 548 290 HOH HOH A . 
C 3 HOH 149 549 96  HOH HOH A . 
C 3 HOH 150 550 245 HOH HOH A . 
C 3 HOH 151 551 51  HOH HOH A . 
C 3 HOH 152 552 298 HOH HOH A . 
C 3 HOH 153 553 106 HOH HOH A . 
C 3 HOH 154 554 68  HOH HOH A . 
C 3 HOH 155 555 1   HOH HOH A . 
C 3 HOH 156 556 152 HOH HOH A . 
C 3 HOH 157 557 78  HOH HOH A . 
C 3 HOH 158 558 58  HOH HOH A . 
C 3 HOH 159 559 127 HOH HOH A . 
C 3 HOH 160 560 198 HOH HOH A . 
C 3 HOH 161 561 115 HOH HOH A . 
C 3 HOH 162 562 273 HOH HOH A . 
C 3 HOH 163 563 131 HOH HOH A . 
C 3 HOH 164 564 62  HOH HOH A . 
C 3 HOH 165 565 18  HOH HOH A . 
C 3 HOH 166 566 40  HOH HOH A . 
C 3 HOH 167 567 276 HOH HOH A . 
C 3 HOH 168 568 281 HOH HOH A . 
C 3 HOH 169 569 169 HOH HOH A . 
C 3 HOH 170 570 292 HOH HOH A . 
C 3 HOH 171 571 35  HOH HOH A . 
C 3 HOH 172 572 20  HOH HOH A . 
C 3 HOH 173 573 271 HOH HOH A . 
C 3 HOH 174 574 113 HOH HOH A . 
C 3 HOH 175 575 295 HOH HOH A . 
C 3 HOH 176 576 66  HOH HOH A . 
C 3 HOH 177 577 69  HOH HOH A . 
C 3 HOH 178 578 99  HOH HOH A . 
C 3 HOH 179 579 138 HOH HOH A . 
C 3 HOH 180 580 31  HOH HOH A . 
C 3 HOH 181 581 191 HOH HOH A . 
C 3 HOH 182 582 47  HOH HOH A . 
C 3 HOH 183 583 76  HOH HOH A . 
C 3 HOH 184 584 145 HOH HOH A . 
C 3 HOH 185 585 238 HOH HOH A . 
C 3 HOH 186 586 223 HOH HOH A . 
C 3 HOH 187 587 148 HOH HOH A . 
C 3 HOH 188 588 101 HOH HOH A . 
C 3 HOH 189 589 237 HOH HOH A . 
C 3 HOH 190 590 279 HOH HOH A . 
C 3 HOH 191 591 125 HOH HOH A . 
C 3 HOH 192 592 142 HOH HOH A . 
C 3 HOH 193 593 177 HOH HOH A . 
C 3 HOH 194 594 199 HOH HOH A . 
C 3 HOH 195 595 55  HOH HOH A . 
C 3 HOH 196 596 94  HOH HOH A . 
C 3 HOH 197 597 267 HOH HOH A . 
C 3 HOH 198 598 301 HOH HOH A . 
C 3 HOH 199 599 268 HOH HOH A . 
C 3 HOH 200 600 172 HOH HOH A . 
C 3 HOH 201 601 28  HOH HOH A . 
C 3 HOH 202 602 16  HOH HOH A . 
C 3 HOH 203 603 274 HOH HOH A . 
C 3 HOH 204 604 208 HOH HOH A . 
C 3 HOH 205 605 200 HOH HOH A . 
C 3 HOH 206 606 246 HOH HOH A . 
C 3 HOH 207 607 217 HOH HOH A . 
C 3 HOH 208 608 232 HOH HOH A . 
C 3 HOH 209 609 221 HOH HOH A . 
C 3 HOH 210 610 132 HOH HOH A . 
C 3 HOH 211 611 285 HOH HOH A . 
C 3 HOH 212 612 194 HOH HOH A . 
C 3 HOH 213 613 196 HOH HOH A . 
C 3 HOH 214 614 2   HOH HOH A . 
C 3 HOH 215 615 282 HOH HOH A . 
C 3 HOH 216 616 27  HOH HOH A . 
C 3 HOH 217 617 166 HOH HOH A . 
C 3 HOH 218 618 144 HOH HOH A . 
C 3 HOH 219 619 175 HOH HOH A . 
C 3 HOH 220 620 158 HOH HOH A . 
C 3 HOH 221 621 60  HOH HOH A . 
C 3 HOH 222 622 193 HOH HOH A . 
C 3 HOH 223 623 258 HOH HOH A . 
C 3 HOH 224 624 254 HOH HOH A . 
C 3 HOH 225 625 121 HOH HOH A . 
C 3 HOH 226 626 220 HOH HOH A . 
C 3 HOH 227 627 224 HOH HOH A . 
C 3 HOH 228 628 222 HOH HOH A . 
C 3 HOH 229 629 205 HOH HOH A . 
C 3 HOH 230 630 257 HOH HOH A . 
C 3 HOH 231 631 197 HOH HOH A . 
C 3 HOH 232 632 165 HOH HOH A . 
C 3 HOH 233 633 234 HOH HOH A . 
C 3 HOH 234 634 277 HOH HOH A . 
C 3 HOH 235 635 216 HOH HOH A . 
C 3 HOH 236 636 297 HOH HOH A . 
C 3 HOH 237 637 117 HOH HOH A . 
C 3 HOH 238 638 226 HOH HOH A . 
C 3 HOH 239 639 202 HOH HOH A . 
C 3 HOH 240 640 153 HOH HOH A . 
C 3 HOH 241 641 120 HOH HOH A . 
C 3 HOH 242 642 263 HOH HOH A . 
C 3 HOH 243 643 155 HOH HOH A . 
C 3 HOH 244 644 247 HOH HOH A . 
C 3 HOH 245 645 207 HOH HOH A . 
C 3 HOH 246 646 174 HOH HOH A . 
C 3 HOH 247 647 109 HOH HOH A . 
C 3 HOH 248 648 227 HOH HOH A . 
C 3 HOH 249 649 25  HOH HOH A . 
C 3 HOH 250 650 129 HOH HOH A . 
C 3 HOH 251 651 289 HOH HOH A . 
C 3 HOH 252 652 250 HOH HOH A . 
C 3 HOH 253 653 81  HOH HOH A . 
C 3 HOH 254 654 184 HOH HOH A . 
C 3 HOH 255 655 159 HOH HOH A . 
C 3 HOH 256 656 161 HOH HOH A . 
C 3 HOH 257 657 243 HOH HOH A . 
C 3 HOH 258 658 168 HOH HOH A . 
C 3 HOH 259 659 212 HOH HOH A . 
C 3 HOH 260 660 160 HOH HOH A . 
C 3 HOH 261 661 288 HOH HOH A . 
C 3 HOH 262 662 299 HOH HOH A . 
C 3 HOH 263 663 248 HOH HOH A . 
C 3 HOH 264 664 173 HOH HOH A . 
C 3 HOH 265 665 210 HOH HOH A . 
C 3 HOH 266 666 284 HOH HOH A . 
C 3 HOH 267 667 256 HOH HOH A . 
C 3 HOH 268 668 294 HOH HOH A . 
C 3 HOH 269 669 192 HOH HOH A . 
C 3 HOH 270 670 242 HOH HOH A . 
C 3 HOH 271 671 98  HOH HOH A . 
C 3 HOH 272 672 291 HOH HOH A . 
C 3 HOH 273 673 130 HOH HOH A . 
C 3 HOH 274 674 293 HOH HOH A . 
C 3 HOH 275 675 49  HOH HOH A . 
C 3 HOH 276 676 272 HOH HOH A . 
C 3 HOH 277 677 201 HOH HOH A . 
C 3 HOH 278 678 53  HOH HOH A . 
C 3 HOH 279 679 280 HOH HOH A . 
C 3 HOH 280 680 80  HOH HOH A . 
C 3 HOH 281 681 186 HOH HOH A . 
C 3 HOH 282 682 82  HOH HOH A . 
C 3 HOH 283 683 185 HOH HOH A . 
C 3 HOH 284 684 187 HOH HOH A . 
C 3 HOH 285 685 147 HOH HOH A . 
C 3 HOH 286 686 189 HOH HOH A . 
C 3 HOH 287 687 180 HOH HOH A . 
C 3 HOH 288 688 123 HOH HOH A . 
C 3 HOH 289 689 262 HOH HOH A . 
C 3 HOH 290 690 270 HOH HOH A . 
C 3 HOH 291 691 29  HOH HOH A . 
C 3 HOH 292 692 229 HOH HOH A . 
C 3 HOH 293 693 218 HOH HOH A . 
D 3 HOH 1   201 231 HOH HOH C . 
D 3 HOH 2   202 103 HOH HOH C . 
D 3 HOH 3   203 302 HOH HOH C . 
D 3 HOH 4   204 300 HOH HOH C . 
D 3 HOH 5   205 65  HOH HOH C . 
D 3 HOH 6   206 236 HOH HOH C . 
D 3 HOH 7   207 157 HOH HOH C . 
D 3 HOH 8   208 230 HOH HOH C . 
D 3 HOH 9   209 118 HOH HOH C . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.20.1_4487 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .           2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .           3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .           4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   103.310 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9EYA 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     113.694 
_cell.length_a_esd                 ? 
_cell.length_b                     52.191 
_cell.length_b_esd                 ? 
_cell.length_c                     45.154 
_cell.length_c_esd                 ? 
_cell.volume                       260737.886 
_cell.volume_esd                   ? 
_cell.Z_PDB                        4 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9EYA 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                5 
_symmetry.space_group_name_Hall            'C 2y' 
_symmetry.space_group_name_H-M             'C 1 2 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9EYA 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             1.97 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          37.44 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, HANGING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              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 MMT (DL-malic acid, MES, and Tris base in molar ratio 1:2:2), pH 7.0, 25% PEG 1500' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            291 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER2 X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2022-06-04 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.8856 
_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                        'ESRF BEAMLINE ID23-1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.8856 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   ID23-1 
_diffrn_source.pdbx_synchrotron_site       ESRF 
# 
_reflns.B_iso_Wilson_estimate                          26.27 
_reflns.entry_id                                       9EYA 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.70 
_reflns.d_resolution_low                               47.20 
_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                                     26488 
_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                           93.3 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                5.5 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          11.9 
_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                                0.075 
_reflns.pdbx_Rpim_I_all                                0.031 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.998 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.068 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                0.068 
_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                                    1.70 
_reflns_shell.d_res_low                                     1.73 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           1.1 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             911 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               ? 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               1.278 
_reflns_shell.pdbx_Rpim_I_all                               0.633 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.487 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  1.103 
_reflns_shell.pdbx_Rsym_value                               1.103 
_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                               30.34 
_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                                 9EYA 
_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                            1.70 
_refine.ls_d_res_low                             47.20 
_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                     26482 
_refine.ls_number_reflns_R_free                  1269 
_refine.ls_number_reflns_R_work                  25213 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    92.98 
_refine.ls_percent_reflns_R_free                 4.79 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1600 
_refine.ls_R_factor_R_free                       0.1855 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1587 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.35 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               '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                 21.6011 
_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                            0.2270 
_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                       1.70 
_refine_hist.d_res_low                        47.20 
_refine_hist.number_atoms_solvent             302 
_refine_hist.number_atoms_total               2749 
_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        2444 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         3 
_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' ? 0.0039  ? 2515 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.7210  ? 3416 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0460  ? 387  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0055  ? 444  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 13.9211 ? 899  ? 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' 1.70 1.77  . . 109 1919 64.46 . . . . 0.3070 . . . . . . . . . . . 0.3715 
'X-RAY DIFFRACTION' 1.77 1.85  . . 120 2375 79.97 . . . . 0.2537 . . . . . . . . . . . 0.2695 
'X-RAY DIFFRACTION' 1.85 1.95  . . 145 2902 96.67 . . . . 0.2022 . . . . . . . . . . . 0.2081 
'X-RAY DIFFRACTION' 1.95 2.07  . . 134 3022 99.78 . . . . 0.1754 . . . . . . . . . . . 0.2475 
'X-RAY DIFFRACTION' 2.07 2.23  . . 149 3000 99.75 . . . . 0.1657 . . . . . . . . . . . 0.2186 
'X-RAY DIFFRACTION' 2.23 2.45  . . 137 2983 99.55 . . . . 0.1644 . . . . . . . . . . . 0.2148 
'X-RAY DIFFRACTION' 2.45 2.81  . . 174 3001 99.72 . . . . 0.1689 . . . . . . . . . . . 0.1906 
'X-RAY DIFFRACTION' 2.81 3.54  . . 149 2988 98.80 . . . . 0.1550 . . . . . . . . . . . 0.2023 
'X-RAY DIFFRACTION' 3.54 47.20 . . 152 3023 97.72 . . . . 0.1319 . . . . . . . . . . . 0.1345 
# 
_struct.entry_id                     9EYA 
_struct.title                        
'Complex of a mutant of the SARS-CoV-2 main protease Mpro with the nsp4/5 substrate peptide (soaking).' 
_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        9EYA 
_struct_keywords.text            'SARS-CoV-2, main protease, nsp5, Cys-peptidase, 3CLpro, HYDROLASE' 
_struct_keywords.pdbx_keywords   HYDROLASE 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 3 ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 UNP R1AB_SARS2 P0DTD1 ? 1 
;SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRHVICTSEDMLNPNYEDLLIRKSNHNFLVQAGNVQLRVIGH
SMQNCVLKLKVDTANPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSCGSVGFNIDYDCVSFC
YMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTITVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYE
PLTQDHVDILGPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQCSGVTFQ
;
3264 
2 PDB 9EYA       9EYA   ? 2 ? 1    
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 9EYA A 1 ? 306 ? P0DTD1 3264 ? 3569 ? 1 306 
2 2 9EYA C 1 ? 11  ? 9EYA   0    ? 10   ? 0 10  
# 
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 9EYA ALA A 41  ? UNP P0DTD1 HIS 3304 conflict 41  1 
1 9EYA ALA A 145 ? UNP P0DTD1 CYS 3408 conflict 145 2 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 1730  ? 
1 MORE         -8    ? 
1 'SSA (A^2)'  14280 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_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 SER A 10  ? GLY A 15  ? SER A 10  GLY A 15  1 ? 6  
HELX_P HELX_P2  AA2 ALA A 41  ? CYS A 44  ? ALA A 41  CYS A 44  5 ? 4  
HELX_P HELX_P3  AA3 GLU A 47  ? ASN A 51  ? GLU A 47  ASN A 51  5 ? 5  
HELX_P HELX_P4  AA4 ASN A 53  ? ARG A 60  ? ASN A 53  ARG A 60  1 ? 8  
HELX_P HELX_P5  AA5 LYS A 61  ? PHE A 66  ? LYS A 61  PHE A 66  5 ? 6  
HELX_P HELX_P6  AA6 ILE A 200 ? ASN A 214 ? ILE A 200 ASN A 214 1 ? 15 
HELX_P HELX_P7  AA7 THR A 226 ? TYR A 237 ? THR A 226 TYR A 237 1 ? 12 
HELX_P HELX_P8  AA8 THR A 243 ? LEU A 250 ? THR A 243 LEU A 250 1 ? 8  
HELX_P HELX_P9  AA9 LEU A 250 ? GLY A 258 ? LEU A 250 GLY A 258 1 ? 9  
HELX_P HELX_P10 AB1 ALA A 260 ? GLY A 275 ? ALA A 260 GLY A 275 1 ? 16 
HELX_P HELX_P11 AB2 THR A 292 ? GLY A 302 ? THR A 292 GLY A 302 1 ? 11 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
_struct_conn.id                            covale1 
_struct_conn.conn_type_id                  covale 
_struct_conn.pdbx_leaving_atom_flag        both 
_struct_conn.pdbx_PDB_id                   ? 
_struct_conn.ptnr1_label_asym_id           B 
_struct_conn.ptnr1_label_comp_id           THC 
_struct_conn.ptnr1_label_seq_id            1 
_struct_conn.ptnr1_label_atom_id           C 
_struct_conn.pdbx_ptnr1_label_alt_id       ? 
_struct_conn.pdbx_ptnr1_PDB_ins_code       ? 
_struct_conn.pdbx_ptnr1_standard_comp_id   ? 
_struct_conn.ptnr1_symmetry                1_555 
_struct_conn.ptnr2_label_asym_id           B 
_struct_conn.ptnr2_label_comp_id           SER 
_struct_conn.ptnr2_label_seq_id            2 
_struct_conn.ptnr2_label_atom_id           N 
_struct_conn.pdbx_ptnr2_label_alt_id       ? 
_struct_conn.pdbx_ptnr2_PDB_ins_code       ? 
_struct_conn.ptnr1_auth_asym_id            C 
_struct_conn.ptnr1_auth_comp_id            THC 
_struct_conn.ptnr1_auth_seq_id             0 
_struct_conn.ptnr2_auth_asym_id            C 
_struct_conn.ptnr2_auth_comp_id            SER 
_struct_conn.ptnr2_auth_seq_id             1 
_struct_conn.ptnr2_symmetry                1_555 
_struct_conn.pdbx_ptnr3_label_atom_id      ? 
_struct_conn.pdbx_ptnr3_label_seq_id       ? 
_struct_conn.pdbx_ptnr3_label_comp_id      ? 
_struct_conn.pdbx_ptnr3_label_asym_id      ? 
_struct_conn.pdbx_ptnr3_label_alt_id       ? 
_struct_conn.pdbx_ptnr3_PDB_ins_code       ? 
_struct_conn.details                       ? 
_struct_conn.pdbx_dist_value               1.329 
_struct_conn.pdbx_value_order              ? 
_struct_conn.pdbx_role                     ? 
# 
_struct_conn_type.id          covale 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
_pdbx_modification_feature.ordinal                            1 
_pdbx_modification_feature.label_comp_id                      THC 
_pdbx_modification_feature.label_asym_id                      B 
_pdbx_modification_feature.label_seq_id                       1 
_pdbx_modification_feature.label_alt_id                       ? 
_pdbx_modification_feature.modified_residue_label_comp_id     . 
_pdbx_modification_feature.modified_residue_label_asym_id     . 
_pdbx_modification_feature.modified_residue_label_seq_id      . 
_pdbx_modification_feature.modified_residue_label_alt_id      . 
_pdbx_modification_feature.auth_comp_id                       THC 
_pdbx_modification_feature.auth_asym_id                       C 
_pdbx_modification_feature.auth_seq_id                        0 
_pdbx_modification_feature.PDB_ins_code                       ? 
_pdbx_modification_feature.symmetry                           1_555 
_pdbx_modification_feature.modified_residue_auth_comp_id      . 
_pdbx_modification_feature.modified_residue_auth_asym_id      . 
_pdbx_modification_feature.modified_residue_auth_seq_id       . 
_pdbx_modification_feature.modified_residue_PDB_ins_code      . 
_pdbx_modification_feature.modified_residue_symmetry          . 
_pdbx_modification_feature.comp_id_linking_atom               . 
_pdbx_modification_feature.modified_residue_id_linking_atom   . 
_pdbx_modification_feature.modified_residue_id                THR 
_pdbx_modification_feature.ref_pcm_id                         1 
_pdbx_modification_feature.ref_comp_id                        THC 
_pdbx_modification_feature.type                               None 
_pdbx_modification_feature.category                           'Non-standard residue' 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 7 ? 
AA2 ? 5 ? 
AA3 ? 3 ? 
AA4 ? 5 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA1 5 6 ? anti-parallel 
AA1 6 7 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA2 2 3 ? anti-parallel 
AA2 3 4 ? anti-parallel 
AA2 4 5 ? anti-parallel 
AA3 1 2 ? parallel      
AA3 2 3 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA4 2 3 ? anti-parallel 
AA4 3 4 ? anti-parallel 
AA4 4 5 ? 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 VAL A 73  ? LEU A 75  ? VAL A 73  LEU A 75  
AA1 2 LEU A 67  ? ALA A 70  ? LEU A 67  ALA A 70  
AA1 3 MET A 17  ? CYS A 22  ? MET A 17  CYS A 22  
AA1 4 THR A 25  ? LEU A 32  ? THR A 25  LEU A 32  
AA1 5 VAL A 35  ? PRO A 39  ? VAL A 35  PRO A 39  
AA1 6 VAL A 86  ? VAL A 91  ? VAL A 86  VAL A 91  
AA1 7 VAL A 77  ? GLN A 83  ? VAL A 77  GLN A 83  
AA2 1 VAL A 73  ? LEU A 75  ? VAL A 73  LEU A 75  
AA2 2 LEU A 67  ? ALA A 70  ? LEU A 67  ALA A 70  
AA2 3 MET A 17  ? CYS A 22  ? MET A 17  CYS A 22  
AA2 4 THR A 25  ? LEU A 32  ? THR A 25  LEU A 32  
AA2 5 GLY B 8   ? PHE B 9   ? GLY C 7   PHE C 8   
AA3 1 LYS A 100 ? PHE A 103 ? LYS A 100 PHE A 103 
AA3 2 CYS A 156 ? LEU A 167 ? CYS A 156 LEU A 167 
AA3 3 VAL A 171 ? THR A 175 ? VAL A 171 THR A 175 
AA4 1 SER A 121 ? ALA A 129 ? SER A 121 ALA A 129 
AA4 2 THR A 111 ? TYR A 118 ? THR A 111 TYR A 118 
AA4 3 VAL A 148 ? ASP A 153 ? VAL A 148 ASP A 153 
AA4 4 CYS A 156 ? LEU A 167 ? CYS A 156 LEU A 167 
AA4 5 VAL B 4   ? LEU B 5   ? VAL C 3   LEU C 4   
# 
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 VAL A 73  ? O VAL A 73  N ALA A 70  ? N ALA A 70  
AA1 2 3 O LEU A 67  ? O LEU A 67  N THR A 21  ? N THR A 21  
AA1 3 4 N VAL A 20  ? N VAL A 20  O LEU A 27  ? O LEU A 27  
AA1 4 5 N LEU A 30  ? N LEU A 30  O TYR A 37  ? O TYR A 37  
AA1 5 6 N VAL A 36  ? N VAL A 36  O LEU A 89  ? O LEU A 89  
AA1 6 7 O LYS A 88  ? O LYS A 88  N SER A 81  ? N SER A 81  
AA2 1 2 O VAL A 73  ? O VAL A 73  N ALA A 70  ? N ALA A 70  
AA2 2 3 O LEU A 67  ? O LEU A 67  N THR A 21  ? N THR A 21  
AA2 3 4 N VAL A 20  ? N VAL A 20  O LEU A 27  ? O LEU A 27  
AA2 4 5 N THR A 26  ? N THR A 26  O GLY B 8   ? O GLY C 7   
AA3 1 2 N LYS A 100 ? N LYS A 100 O VAL A 157 ? O VAL A 157 
AA3 2 3 N LEU A 167 ? N LEU A 167 O VAL A 171 ? O VAL A 171 
AA4 1 2 O SER A 123 ? O SER A 123 N ALA A 116 ? N ALA A 116 
AA4 2 3 N SER A 113 ? N SER A 113 O PHE A 150 ? O PHE A 150 
AA4 3 4 N ASN A 151 ? N ASN A 151 O SER A 158 ? O SER A 158 
AA4 4 5 N GLU A 166 ? N GLU A 166 O VAL B 4   ? O VAL C 3   
# 
_pdbx_entry_details.entry_id                   9EYA 
_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   Y 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 1 OD1 A ASP 92  ? ? O A HOH 401 ? ? 2.18 
2 1 O   A HOH 632 ? ? O A HOH 666 ? ? 2.19 
# 
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 ASP A 33  ? ? 52.15   -130.56 
2 1 ASN A 51  ? ? -151.15 65.18   
3 1 ASN A 84  ? ? 53.62   -120.32 
4 1 TYR A 154 ? ? 56.65   -97.27  
5 1 HIS A 164 ? ? -122.90 -54.79  
6 1 HIS A 164 ? ? -122.90 -54.57  
7 1 ASN A 221 ? ? -100.71 -167.59 
8 1 GLN C 5   ? ? -94.11  48.03   
# 
loop_
_pdbx_struct_special_symmetry.id 
_pdbx_struct_special_symmetry.PDB_model_num 
_pdbx_struct_special_symmetry.auth_asym_id 
_pdbx_struct_special_symmetry.auth_comp_id 
_pdbx_struct_special_symmetry.auth_seq_id 
_pdbx_struct_special_symmetry.PDB_ins_code 
_pdbx_struct_special_symmetry.label_asym_id 
_pdbx_struct_special_symmetry.label_comp_id 
_pdbx_struct_special_symmetry.label_seq_id 
1 1 A HOH 534 ? C HOH . 
2 1 A HOH 614 ? C HOH . 
3 1 A HOH 622 ? C HOH . 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z           
2 -x,y,-z         
3 x+1/2,y+1/2,z   
4 -x+1/2,y+1/2,-z 
# 
_pdbx_refine_tls.id               1 
_pdbx_refine_tls.pdbx_refine_id   'X-RAY DIFFRACTION' 
_pdbx_refine_tls.details          ? 
_pdbx_refine_tls.method           refined 
_pdbx_refine_tls.origin_x         -17.3189982213 
_pdbx_refine_tls.origin_y         0.0542519997211 
_pdbx_refine_tls.origin_z         16.4579638244 
_pdbx_refine_tls.T[1][1]          0.183884564156 
_pdbx_refine_tls.T[1][1]_esd      ? 
_pdbx_refine_tls.T[1][2]          0.00212224931005 
_pdbx_refine_tls.T[1][2]_esd      ? 
_pdbx_refine_tls.T[1][3]          0.000475211831844 
_pdbx_refine_tls.T[1][3]_esd      ? 
_pdbx_refine_tls.T[2][2]          0.197866665072 
_pdbx_refine_tls.T[2][2]_esd      ? 
_pdbx_refine_tls.T[2][3]          0.00923168595464 
_pdbx_refine_tls.T[2][3]_esd      ? 
_pdbx_refine_tls.T[3][3]          0.192212742611 
_pdbx_refine_tls.T[3][3]_esd      ? 
_pdbx_refine_tls.L[1][1]          0.246493737099 
_pdbx_refine_tls.L[1][1]_esd      ? 
_pdbx_refine_tls.L[1][2]          0.161553483587 
_pdbx_refine_tls.L[1][2]_esd      ? 
_pdbx_refine_tls.L[1][3]          0.0862728638581 
_pdbx_refine_tls.L[1][3]_esd      ? 
_pdbx_refine_tls.L[2][2]          0.707394571266 
_pdbx_refine_tls.L[2][2]_esd      ? 
_pdbx_refine_tls.L[2][3]          0.494692666742 
_pdbx_refine_tls.L[2][3]_esd      ? 
_pdbx_refine_tls.L[3][3]          0.537386743063 
_pdbx_refine_tls.L[3][3]_esd      ? 
_pdbx_refine_tls.S[1][1]          0.00459958526805 
_pdbx_refine_tls.S[1][1]_esd      ? 
_pdbx_refine_tls.S[1][2]          0.00984816008899 
_pdbx_refine_tls.S[1][2]_esd      ? 
_pdbx_refine_tls.S[1][3]          -0.00507594854355 
_pdbx_refine_tls.S[1][3]_esd      ? 
_pdbx_refine_tls.S[2][1]          -0.017570882976 
_pdbx_refine_tls.S[2][1]_esd      ? 
_pdbx_refine_tls.S[2][2]          0.00438537328178 
_pdbx_refine_tls.S[2][2]_esd      ? 
_pdbx_refine_tls.S[2][3]          -0.00743278558869 
_pdbx_refine_tls.S[2][3]_esd      ? 
_pdbx_refine_tls.S[3][1]          -0.0129387868718 
_pdbx_refine_tls.S[3][1]_esd      ? 
_pdbx_refine_tls.S[3][2]          -0.00941369105414 
_pdbx_refine_tls.S[3][2]_esd      ? 
_pdbx_refine_tls.S[3][3]          6.38970732024e-05 
_pdbx_refine_tls.S[3][3]_esd      ? 
# 
_pdbx_refine_tls_group.id                  1 
_pdbx_refine_tls_group.pdbx_refine_id      'X-RAY DIFFRACTION' 
_pdbx_refine_tls_group.refine_tls_id       1 
_pdbx_refine_tls_group.beg_label_asym_id   A 
_pdbx_refine_tls_group.beg_label_seq_id    1 
_pdbx_refine_tls_group.beg_auth_asym_id    A 
_pdbx_refine_tls_group.beg_auth_seq_id     1 
_pdbx_refine_tls_group.beg_PDB_ins_code    ? 
_pdbx_refine_tls_group.end_label_asym_id   D 
_pdbx_refine_tls_group.end_label_seq_id    ? 
_pdbx_refine_tls_group.end_auth_asym_id    S 
_pdbx_refine_tls_group.end_auth_seq_id     302 
_pdbx_refine_tls_group.end_PDB_ins_code    ? 
_pdbx_refine_tls_group.selection           ? 
_pdbx_refine_tls_group.selection_details   all 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N N N 1   
ALA CA   C N S 2   
ALA C    C N N 3   
ALA O    O N N 4   
ALA CB   C N N 5   
ALA OXT  O N N 6   
ALA H    H N N 7   
ALA H2   H N N 8   
ALA HA   H N N 9   
ALA HB1  H N N 10  
ALA HB2  H N N 11  
ALA HB3  H N N 12  
ALA HXT  H N N 13  
ARG N    N N N 14  
ARG CA   C N S 15  
ARG C    C N N 16  
ARG O    O N N 17  
ARG CB   C N N 18  
ARG CG   C N N 19  
ARG CD   C N N 20  
ARG NE   N N N 21  
ARG CZ   C N N 22  
ARG NH1  N N N 23  
ARG NH2  N N N 24  
ARG OXT  O N N 25  
ARG H    H N N 26  
ARG H2   H N N 27  
ARG HA   H N N 28  
ARG HB2  H N N 29  
ARG HB3  H N N 30  
ARG HG2  H N N 31  
ARG HG3  H N N 32  
ARG HD2  H N N 33  
ARG HD3  H N N 34  
ARG HE   H N N 35  
ARG HH11 H N N 36  
ARG HH12 H N N 37  
ARG HH21 H N N 38  
ARG HH22 H N N 39  
ARG HXT  H N N 40  
ASN N    N N N 41  
ASN CA   C N S 42  
ASN C    C N N 43  
ASN O    O N N 44  
ASN CB   C N N 45  
ASN CG   C N N 46  
ASN OD1  O N N 47  
ASN ND2  N N N 48  
ASN OXT  O N N 49  
ASN H    H N N 50  
ASN H2   H N N 51  
ASN HA   H N N 52  
ASN HB2  H N N 53  
ASN HB3  H N N 54  
ASN HD21 H N N 55  
ASN HD22 H N N 56  
ASN HXT  H N N 57  
ASP N    N N N 58  
ASP CA   C N S 59  
ASP C    C N N 60  
ASP O    O N N 61  
ASP CB   C N N 62  
ASP CG   C N N 63  
ASP OD1  O N N 64  
ASP OD2  O N N 65  
ASP OXT  O N N 66  
ASP H    H N N 67  
ASP H2   H N N 68  
ASP HA   H N N 69  
ASP HB2  H N N 70  
ASP HB3  H N N 71  
ASP HD2  H N N 72  
ASP HXT  H N N 73  
CYS N    N N N 74  
CYS CA   C N R 75  
CYS C    C N N 76  
CYS O    O N N 77  
CYS CB   C N N 78  
CYS SG   S N N 79  
CYS OXT  O N N 80  
CYS H    H N N 81  
CYS H2   H N N 82  
CYS HA   H N N 83  
CYS HB2  H N N 84  
CYS HB3  H N N 85  
CYS HG   H N N 86  
CYS HXT  H N N 87  
GLN N    N N N 88  
GLN CA   C N S 89  
GLN C    C N N 90  
GLN O    O N N 91  
GLN CB   C N N 92  
GLN CG   C N N 93  
GLN CD   C N N 94  
GLN OE1  O N N 95  
GLN NE2  N N N 96  
GLN OXT  O N N 97  
GLN H    H N N 98  
GLN H2   H N N 99  
GLN HA   H N N 100 
GLN HB2  H N N 101 
GLN HB3  H N N 102 
GLN HG2  H N N 103 
GLN HG3  H N N 104 
GLN HE21 H N N 105 
GLN HE22 H N N 106 
GLN HXT  H N N 107 
GLU N    N N N 108 
GLU CA   C N S 109 
GLU C    C N N 110 
GLU O    O N N 111 
GLU CB   C N N 112 
GLU CG   C N N 113 
GLU CD   C N N 114 
GLU OE1  O N N 115 
GLU OE2  O N N 116 
GLU OXT  O N N 117 
GLU H    H N N 118 
GLU H2   H N N 119 
GLU HA   H N N 120 
GLU HB2  H N N 121 
GLU HB3  H N N 122 
GLU HG2  H N N 123 
GLU HG3  H N N 124 
GLU HE2  H N N 125 
GLU HXT  H N N 126 
GLY N    N N N 127 
GLY CA   C N N 128 
GLY C    C N N 129 
GLY O    O N N 130 
GLY OXT  O N N 131 
GLY H    H N N 132 
GLY H2   H N N 133 
GLY HA2  H N N 134 
GLY HA3  H N N 135 
GLY HXT  H N N 136 
HIS N    N N N 137 
HIS CA   C N S 138 
HIS C    C N N 139 
HIS O    O N N 140 
HIS CB   C N N 141 
HIS CG   C Y N 142 
HIS ND1  N Y N 143 
HIS CD2  C Y N 144 
HIS CE1  C Y N 145 
HIS NE2  N Y N 146 
HIS OXT  O N N 147 
HIS H    H N N 148 
HIS H2   H N N 149 
HIS HA   H N N 150 
HIS HB2  H N N 151 
HIS HB3  H N N 152 
HIS HD1  H N N 153 
HIS HD2  H N N 154 
HIS HE1  H N N 155 
HIS HE2  H N N 156 
HIS HXT  H N N 157 
HOH O    O N N 158 
HOH H1   H N N 159 
HOH H2   H N N 160 
ILE N    N N N 161 
ILE CA   C N S 162 
ILE C    C N N 163 
ILE O    O N N 164 
ILE CB   C N S 165 
ILE CG1  C N N 166 
ILE CG2  C N N 167 
ILE CD1  C N N 168 
ILE OXT  O N N 169 
ILE H    H N N 170 
ILE H2   H N N 171 
ILE HA   H N N 172 
ILE HB   H N N 173 
ILE HG12 H N N 174 
ILE HG13 H N N 175 
ILE HG21 H N N 176 
ILE HG22 H N N 177 
ILE HG23 H N N 178 
ILE HD11 H N N 179 
ILE HD12 H N N 180 
ILE HD13 H N N 181 
ILE HXT  H N N 182 
LEU N    N N N 183 
LEU CA   C N S 184 
LEU C    C N N 185 
LEU O    O N N 186 
LEU CB   C N N 187 
LEU CG   C N N 188 
LEU CD1  C N N 189 
LEU CD2  C N N 190 
LEU OXT  O N N 191 
LEU H    H N N 192 
LEU H2   H N N 193 
LEU HA   H N N 194 
LEU HB2  H N N 195 
LEU HB3  H N N 196 
LEU HG   H N N 197 
LEU HD11 H N N 198 
LEU HD12 H N N 199 
LEU HD13 H N N 200 
LEU HD21 H N N 201 
LEU HD22 H N N 202 
LEU HD23 H N N 203 
LEU HXT  H N N 204 
LYS N    N N N 205 
LYS CA   C N S 206 
LYS C    C N N 207 
LYS O    O N N 208 
LYS CB   C N N 209 
LYS CG   C N N 210 
LYS CD   C N N 211 
LYS CE   C N N 212 
LYS NZ   N N N 213 
LYS OXT  O N N 214 
LYS H    H N N 215 
LYS H2   H N N 216 
LYS HA   H N N 217 
LYS HB2  H N N 218 
LYS HB3  H N N 219 
LYS HG2  H N N 220 
LYS HG3  H N N 221 
LYS HD2  H N N 222 
LYS HD3  H N N 223 
LYS HE2  H N N 224 
LYS HE3  H N N 225 
LYS HZ1  H N N 226 
LYS HZ2  H N N 227 
LYS HZ3  H N N 228 
LYS HXT  H N N 229 
MET N    N N N 230 
MET CA   C N S 231 
MET C    C N N 232 
MET O    O N N 233 
MET CB   C N N 234 
MET CG   C N N 235 
MET SD   S N N 236 
MET CE   C N N 237 
MET OXT  O N N 238 
MET H    H N N 239 
MET H2   H N N 240 
MET HA   H N N 241 
MET HB2  H N N 242 
MET HB3  H N N 243 
MET HG2  H N N 244 
MET HG3  H N N 245 
MET HE1  H N N 246 
MET HE2  H N N 247 
MET HE3  H N N 248 
MET HXT  H N N 249 
PHE N    N N N 250 
PHE CA   C N S 251 
PHE C    C N N 252 
PHE O    O N N 253 
PHE CB   C N N 254 
PHE CG   C Y N 255 
PHE CD1  C Y N 256 
PHE CD2  C Y N 257 
PHE CE1  C Y N 258 
PHE CE2  C Y N 259 
PHE CZ   C Y N 260 
PHE OXT  O N N 261 
PHE H    H N N 262 
PHE H2   H N N 263 
PHE HA   H N N 264 
PHE HB2  H N N 265 
PHE HB3  H N N 266 
PHE HD1  H N N 267 
PHE HD2  H N N 268 
PHE HE1  H N N 269 
PHE HE2  H N N 270 
PHE HZ   H N N 271 
PHE HXT  H N N 272 
PRO N    N N N 273 
PRO CA   C N S 274 
PRO C    C N N 275 
PRO O    O N N 276 
PRO CB   C N N 277 
PRO CG   C N N 278 
PRO CD   C N N 279 
PRO OXT  O N N 280 
PRO H    H N N 281 
PRO HA   H N N 282 
PRO HB2  H N N 283 
PRO HB3  H N N 284 
PRO HG2  H N N 285 
PRO HG3  H N N 286 
PRO HD2  H N N 287 
PRO HD3  H N N 288 
PRO HXT  H N N 289 
SER N    N N N 290 
SER CA   C N S 291 
SER C    C N N 292 
SER O    O N N 293 
SER CB   C N N 294 
SER OG   O N N 295 
SER OXT  O N N 296 
SER H    H N N 297 
SER H2   H N N 298 
SER HA   H N N 299 
SER HB2  H N N 300 
SER HB3  H N N 301 
SER HG   H N N 302 
SER HXT  H N N 303 
THC N1   N N N 304 
THC CN   C N N 305 
THC ON   O N N 306 
THC CM   C N N 307 
THC CA   C N S 308 
THC CB   C N R 309 
THC OG1  O N N 310 
THC CG2  C N N 311 
THC C    C N N 312 
THC O    O N N 313 
THC OXT  O N N 314 
THC HN   H N N 315 
THC HM1  H N N 316 
THC HM2  H N N 317 
THC HM3  H N N 318 
THC HA   H N N 319 
THC HB   H N N 320 
THC HG1  H N N 321 
THC HG21 H N N 322 
THC HG22 H N N 323 
THC HG23 H N N 324 
THC HXT  H N N 325 
THR N    N N N 326 
THR CA   C N S 327 
THR C    C N N 328 
THR O    O N N 329 
THR CB   C N R 330 
THR OG1  O N N 331 
THR CG2  C N N 332 
THR OXT  O N N 333 
THR H    H N N 334 
THR H2   H N N 335 
THR HA   H N N 336 
THR HB   H N N 337 
THR HG1  H N N 338 
THR HG21 H N N 339 
THR HG22 H N N 340 
THR HG23 H N N 341 
THR HXT  H N N 342 
TRP N    N N N 343 
TRP CA   C N S 344 
TRP C    C N N 345 
TRP O    O N N 346 
TRP CB   C N N 347 
TRP CG   C Y N 348 
TRP CD1  C Y N 349 
TRP CD2  C Y N 350 
TRP NE1  N Y N 351 
TRP CE2  C Y N 352 
TRP CE3  C Y N 353 
TRP CZ2  C Y N 354 
TRP CZ3  C Y N 355 
TRP CH2  C Y N 356 
TRP OXT  O N N 357 
TRP H    H N N 358 
TRP H2   H N N 359 
TRP HA   H N N 360 
TRP HB2  H N N 361 
TRP HB3  H N N 362 
TRP HD1  H N N 363 
TRP HE1  H N N 364 
TRP HE3  H N N 365 
TRP HZ2  H N N 366 
TRP HZ3  H N N 367 
TRP HH2  H N N 368 
TRP HXT  H N N 369 
TYR N    N N N 370 
TYR CA   C N S 371 
TYR C    C N N 372 
TYR O    O N N 373 
TYR CB   C N N 374 
TYR CG   C Y N 375 
TYR CD1  C Y N 376 
TYR CD2  C Y N 377 
TYR CE1  C Y N 378 
TYR CE2  C Y N 379 
TYR CZ   C Y N 380 
TYR OH   O N N 381 
TYR OXT  O N N 382 
TYR H    H N N 383 
TYR H2   H N N 384 
TYR HA   H N N 385 
TYR HB2  H N N 386 
TYR HB3  H N N 387 
TYR HD1  H N N 388 
TYR HD2  H N N 389 
TYR HE1  H N N 390 
TYR HE2  H N N 391 
TYR HH   H N N 392 
TYR HXT  H N N 393 
VAL N    N N N 394 
VAL CA   C N S 395 
VAL C    C N N 396 
VAL O    O N N 397 
VAL CB   C N N 398 
VAL CG1  C N N 399 
VAL CG2  C N N 400 
VAL OXT  O N N 401 
VAL H    H N N 402 
VAL H2   H N N 403 
VAL HA   H N N 404 
VAL HB   H N N 405 
VAL HG11 H N N 406 
VAL HG12 H N N 407 
VAL HG13 H N N 408 
VAL HG21 H N N 409 
VAL HG22 H N N 410 
VAL HG23 H N N 411 
VAL HXT  H N N 412 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
HIS N   CA   sing N N 129 
HIS N   H    sing N N 130 
HIS N   H2   sing N N 131 
HIS CA  C    sing N N 132 
HIS CA  CB   sing N N 133 
HIS CA  HA   sing N N 134 
HIS C   O    doub N N 135 
HIS C   OXT  sing N N 136 
HIS CB  CG   sing N N 137 
HIS CB  HB2  sing N N 138 
HIS CB  HB3  sing N N 139 
HIS CG  ND1  sing Y N 140 
HIS CG  CD2  doub Y N 141 
HIS ND1 CE1  doub Y N 142 
HIS ND1 HD1  sing N N 143 
HIS CD2 NE2  sing Y N 144 
HIS CD2 HD2  sing N N 145 
HIS CE1 NE2  sing Y N 146 
HIS CE1 HE1  sing N N 147 
HIS NE2 HE2  sing N N 148 
HIS OXT HXT  sing N N 149 
HOH O   H1   sing N N 150 
HOH O   H2   sing N N 151 
ILE N   CA   sing N N 152 
ILE N   H    sing N N 153 
ILE N   H2   sing N N 154 
ILE CA  C    sing N N 155 
ILE CA  CB   sing N N 156 
ILE CA  HA   sing N N 157 
ILE C   O    doub N N 158 
ILE C   OXT  sing N N 159 
ILE CB  CG1  sing N N 160 
ILE CB  CG2  sing N N 161 
ILE CB  HB   sing N N 162 
ILE CG1 CD1  sing N N 163 
ILE CG1 HG12 sing N N 164 
ILE CG1 HG13 sing N N 165 
ILE CG2 HG21 sing N N 166 
ILE CG2 HG22 sing N N 167 
ILE CG2 HG23 sing N N 168 
ILE CD1 HD11 sing N N 169 
ILE CD1 HD12 sing N N 170 
ILE CD1 HD13 sing N N 171 
ILE OXT HXT  sing N N 172 
LEU N   CA   sing N N 173 
LEU N   H    sing N N 174 
LEU N   H2   sing N N 175 
LEU CA  C    sing N N 176 
LEU CA  CB   sing N N 177 
LEU CA  HA   sing N N 178 
LEU C   O    doub N N 179 
LEU C   OXT  sing N N 180 
LEU CB  CG   sing N N 181 
LEU CB  HB2  sing N N 182 
LEU CB  HB3  sing N N 183 
LEU CG  CD1  sing N N 184 
LEU CG  CD2  sing N N 185 
LEU CG  HG   sing N N 186 
LEU CD1 HD11 sing N N 187 
LEU CD1 HD12 sing N N 188 
LEU CD1 HD13 sing N N 189 
LEU CD2 HD21 sing N N 190 
LEU CD2 HD22 sing N N 191 
LEU CD2 HD23 sing N N 192 
LEU OXT HXT  sing N N 193 
LYS N   CA   sing N N 194 
LYS N   H    sing N N 195 
LYS N   H2   sing N N 196 
LYS CA  C    sing N N 197 
LYS CA  CB   sing N N 198 
LYS CA  HA   sing N N 199 
LYS C   O    doub N N 200 
LYS C   OXT  sing N N 201 
LYS CB  CG   sing N N 202 
LYS CB  HB2  sing N N 203 
LYS CB  HB3  sing N N 204 
LYS CG  CD   sing N N 205 
LYS CG  HG2  sing N N 206 
LYS CG  HG3  sing N N 207 
LYS CD  CE   sing N N 208 
LYS CD  HD2  sing N N 209 
LYS CD  HD3  sing N N 210 
LYS CE  NZ   sing N N 211 
LYS CE  HE2  sing N N 212 
LYS CE  HE3  sing N N 213 
LYS NZ  HZ1  sing N N 214 
LYS NZ  HZ2  sing N N 215 
LYS NZ  HZ3  sing N N 216 
LYS OXT HXT  sing N N 217 
MET N   CA   sing N N 218 
MET N   H    sing N N 219 
MET N   H2   sing N N 220 
MET CA  C    sing N N 221 
MET CA  CB   sing N N 222 
MET CA  HA   sing N N 223 
MET C   O    doub N N 224 
MET C   OXT  sing N N 225 
MET CB  CG   sing N N 226 
MET CB  HB2  sing N N 227 
MET CB  HB3  sing N N 228 
MET CG  SD   sing N N 229 
MET CG  HG2  sing N N 230 
MET CG  HG3  sing N N 231 
MET SD  CE   sing N N 232 
MET CE  HE1  sing N N 233 
MET CE  HE2  sing N N 234 
MET CE  HE3  sing N N 235 
MET OXT HXT  sing N N 236 
PHE N   CA   sing N N 237 
PHE N   H    sing N N 238 
PHE N   H2   sing N N 239 
PHE CA  C    sing N N 240 
PHE CA  CB   sing N N 241 
PHE CA  HA   sing N N 242 
PHE C   O    doub N N 243 
PHE C   OXT  sing N N 244 
PHE CB  CG   sing N N 245 
PHE CB  HB2  sing N N 246 
PHE CB  HB3  sing N N 247 
PHE CG  CD1  doub Y N 248 
PHE CG  CD2  sing Y N 249 
PHE CD1 CE1  sing Y N 250 
PHE CD1 HD1  sing N N 251 
PHE CD2 CE2  doub Y N 252 
PHE CD2 HD2  sing N N 253 
PHE CE1 CZ   doub Y N 254 
PHE CE1 HE1  sing N N 255 
PHE CE2 CZ   sing Y N 256 
PHE CE2 HE2  sing N N 257 
PHE CZ  HZ   sing N N 258 
PHE OXT HXT  sing N N 259 
PRO N   CA   sing N N 260 
PRO N   CD   sing N N 261 
PRO N   H    sing N N 262 
PRO CA  C    sing N N 263 
PRO CA  CB   sing N N 264 
PRO CA  HA   sing N N 265 
PRO C   O    doub N N 266 
PRO C   OXT  sing N N 267 
PRO CB  CG   sing N N 268 
PRO CB  HB2  sing N N 269 
PRO CB  HB3  sing N N 270 
PRO CG  CD   sing N N 271 
PRO CG  HG2  sing N N 272 
PRO CG  HG3  sing N N 273 
PRO CD  HD2  sing N N 274 
PRO CD  HD3  sing N N 275 
PRO OXT HXT  sing N N 276 
SER N   CA   sing N N 277 
SER N   H    sing N N 278 
SER N   H2   sing N N 279 
SER CA  C    sing N N 280 
SER CA  CB   sing N N 281 
SER CA  HA   sing N N 282 
SER C   O    doub N N 283 
SER C   OXT  sing N N 284 
SER CB  OG   sing N N 285 
SER CB  HB2  sing N N 286 
SER CB  HB3  sing N N 287 
SER OG  HG   sing N N 288 
SER OXT HXT  sing N N 289 
THC N1  CN   sing N N 290 
THC N1  CA   sing N N 291 
THC N1  HN   sing N N 292 
THC CN  ON   doub N N 293 
THC CN  CM   sing N N 294 
THC CM  HM1  sing N N 295 
THC CM  HM2  sing N N 296 
THC CM  HM3  sing N N 297 
THC CA  CB   sing N N 298 
THC CA  C    sing N N 299 
THC CA  HA   sing N N 300 
THC CB  OG1  sing N N 301 
THC CB  CG2  sing N N 302 
THC CB  HB   sing N N 303 
THC OG1 HG1  sing N N 304 
THC CG2 HG21 sing N N 305 
THC CG2 HG22 sing N N 306 
THC CG2 HG23 sing N N 307 
THC C   O    doub N N 308 
THC C   OXT  sing N N 309 
THC OXT HXT  sing N N 310 
THR N   CA   sing N N 311 
THR N   H    sing N N 312 
THR N   H2   sing N N 313 
THR CA  C    sing N N 314 
THR CA  CB   sing N N 315 
THR CA  HA   sing N N 316 
THR C   O    doub N N 317 
THR C   OXT  sing N N 318 
THR CB  OG1  sing N N 319 
THR CB  CG2  sing N N 320 
THR CB  HB   sing N N 321 
THR OG1 HG1  sing N N 322 
THR CG2 HG21 sing N N 323 
THR CG2 HG22 sing N N 324 
THR CG2 HG23 sing N N 325 
THR OXT HXT  sing N N 326 
TRP N   CA   sing N N 327 
TRP N   H    sing N N 328 
TRP N   H2   sing N N 329 
TRP CA  C    sing N N 330 
TRP CA  CB   sing N N 331 
TRP CA  HA   sing N N 332 
TRP C   O    doub N N 333 
TRP C   OXT  sing N N 334 
TRP CB  CG   sing N N 335 
TRP CB  HB2  sing N N 336 
TRP CB  HB3  sing N N 337 
TRP CG  CD1  doub Y N 338 
TRP CG  CD2  sing Y N 339 
TRP CD1 NE1  sing Y N 340 
TRP CD1 HD1  sing N N 341 
TRP CD2 CE2  doub Y N 342 
TRP CD2 CE3  sing Y N 343 
TRP NE1 CE2  sing Y N 344 
TRP NE1 HE1  sing N N 345 
TRP CE2 CZ2  sing Y N 346 
TRP CE3 CZ3  doub Y N 347 
TRP CE3 HE3  sing N N 348 
TRP CZ2 CH2  doub Y N 349 
TRP CZ2 HZ2  sing N N 350 
TRP CZ3 CH2  sing Y N 351 
TRP CZ3 HZ3  sing N N 352 
TRP CH2 HH2  sing N N 353 
TRP OXT HXT  sing N N 354 
TYR N   CA   sing N N 355 
TYR N   H    sing N N 356 
TYR N   H2   sing N N 357 
TYR CA  C    sing N N 358 
TYR CA  CB   sing N N 359 
TYR CA  HA   sing N N 360 
TYR C   O    doub N N 361 
TYR C   OXT  sing N N 362 
TYR CB  CG   sing N N 363 
TYR CB  HB2  sing N N 364 
TYR CB  HB3  sing N N 365 
TYR CG  CD1  doub Y N 366 
TYR CG  CD2  sing Y N 367 
TYR CD1 CE1  sing Y N 368 
TYR CD1 HD1  sing N N 369 
TYR CD2 CE2  doub Y N 370 
TYR CD2 HD2  sing N N 371 
TYR CE1 CZ   doub Y N 372 
TYR CE1 HE1  sing N N 373 
TYR CE2 CZ   sing Y N 374 
TYR CE2 HE2  sing N N 375 
TYR CZ  OH   sing N N 376 
TYR OH  HH   sing N N 377 
TYR OXT HXT  sing N N 378 
VAL N   CA   sing N N 379 
VAL N   H    sing N N 380 
VAL N   H2   sing N N 381 
VAL CA  C    sing N N 382 
VAL CA  CB   sing N N 383 
VAL CA  HA   sing N N 384 
VAL C   O    doub N N 385 
VAL C   OXT  sing N N 386 
VAL CB  CG1  sing N N 387 
VAL CB  CG2  sing N N 388 
VAL CB  HB   sing N N 389 
VAL CG1 HG11 sing N N 390 
VAL CG1 HG12 sing N N 391 
VAL CG1 HG13 sing N N 392 
VAL CG2 HG21 sing N N 393 
VAL CG2 HG22 sing N N 394 
VAL CG2 HG23 sing N N 395 
VAL OXT HXT  sing N N 396 
# 
_pdbx_audit_support.funding_organization   'Not funded' 
_pdbx_audit_support.country                ? 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   7NIJ 
_pdbx_initial_refinement_model.details          ? 
# 
_space_group.name_H-M_alt     'C 1 2 1' 
_space_group.name_Hall        'C 2y' 
_space_group.IT_number        5 
_space_group.crystal_system   monoclinic 
_space_group.id               1 
# 
_atom_sites.entry_id                    9EYA 
_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]   0.008796 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.002081 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.019160 
_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]   0.022758 
_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.
;
? 
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   . SER A 1 1   ? -2.75381  4.29587   38.70224  1.000 28.80300 ? 1   SER A N   1 
ATOM   2    C CA  . SER A 1 1   ? -3.28166  5.42665   37.95353  1.000 28.01978 ? 1   SER A CA  1 
ATOM   3    C C   . SER A 1 1   ? -2.72334  5.48406   36.53285  1.000 31.25198 ? 1   SER A C   1 
ATOM   4    O O   . SER A 1 1   ? -2.09541  4.53308   36.05441  1.000 26.48757 ? 1   SER A O   1 
ATOM   5    C CB  . SER A 1 1   ? -3.00309  6.74341   38.68986  1.000 43.93073 ? 1   SER A CB  1 
ATOM   6    O OG  . SER A 1 1   ? -1.63536  6.88388   39.01798  1.000 46.96478 ? 1   SER A OG  1 
ATOM   7    N N   . GLY A 1 2   ? -2.94124  6.61661   35.87325  1.000 30.49093 ? 2   GLY A N   1 
ATOM   8    C CA  . GLY A 1 2   ? -2.83570  6.69143   34.43447  1.000 27.91798 ? 2   GLY A CA  1 
ATOM   9    C C   . GLY A 1 2   ? -4.15093  6.31017   33.77958  1.000 24.35672 ? 2   GLY A C   1 
ATOM   10   O O   . GLY A 1 2   ? -5.03752  5.72235   34.39411  1.000 31.22855 ? 2   GLY A O   1 
ATOM   11   N N   . PHE A 1 3   ? -4.28242  6.66587   32.50630  1.000 24.94425 ? 3   PHE A N   1 
ATOM   12   C CA  . PHE A 1 3   ? -5.53493  6.39784   31.80393  1.000 27.42576 ? 3   PHE A CA  1 
ATOM   13   C C   . PHE A 1 3   ? -5.25019  6.33038   30.31519  1.000 25.95012 ? 3   PHE A C   1 
ATOM   14   O O   . PHE A 1 3   ? -4.79095  7.31422   29.72548  1.000 28.07425 ? 3   PHE A O   1 
ATOM   15   C CB  . PHE A 1 3   ? -6.58697  7.46874   32.11614  1.000 30.98580 ? 3   PHE A CB  1 
ATOM   16   C CG  . PHE A 1 3   ? -7.99777  7.00098   31.90472  1.000 22.83873 ? 3   PHE A CG  1 
ATOM   17   C CD1 . PHE A 1 3   ? -8.61610  6.18701   32.83897  1.000 25.38818 ? 3   PHE A CD1 1 
ATOM   18   C CD2 . PHE A 1 3   ? -8.69956  7.35899   30.76437  1.000 28.85311 ? 3   PHE A CD2 1 
ATOM   19   C CE1 . PHE A 1 3   ? -9.91000  5.74414   32.64987  1.000 26.11217 ? 3   PHE A CE1 1 
ATOM   20   C CE2 . PHE A 1 3   ? -9.99472  6.91663   30.56654  1.000 30.00253 ? 3   PHE A CE2 1 
ATOM   21   C CZ  . PHE A 1 3   ? -10.59999 6.10605   31.50913  1.000 26.13512 ? 3   PHE A CZ  1 
ATOM   22   N N   . ARG A 1 4   ? -5.52739  5.18012   29.71168  1.000 24.14991 ? 4   ARG A N   1 
ATOM   23   C CA  . ARG A 1 4   ? -5.18344  4.91261   28.32375  1.000 23.25333 ? 4   ARG A CA  1 
ATOM   24   C C   . ARG A 1 4   ? -6.41594  4.44889   27.56301  1.000 22.73273 ? 4   ARG A C   1 
ATOM   25   O O   . ARG A 1 4   ? -7.32190  3.84149   28.13549  1.000 24.76182 ? 4   ARG A O   1 
ATOM   26   C CB  . ARG A 1 4   ? -4.09868  3.83547   28.22146  1.000 29.46750 ? 4   ARG A CB  1 
ATOM   27   C CG  . ARG A 1 4   ? -2.69565  4.32139   28.52381  1.000 34.43268 ? 4   ARG A CG  1 
ATOM   28   C CD  . ARG A 1 4   ? -2.19837  5.19402   27.38793  1.000 42.61102 ? 4   ARG A CD  1 
ATOM   29   N NE  . ARG A 1 4   ? -0.75499  5.39254   27.42853  1.000 50.89276 ? 4   ARG A NE  1 
ATOM   30   C CZ  . ARG A 1 4   ? -0.06059  6.00395   26.47793  1.000 50.54336 ? 4   ARG A CZ  1 
ATOM   31   N NH1 . ARG A 1 4   ? -0.64556  6.46102   25.38194  1.000 50.95324 ? 4   ARG A NH1 1 
ATOM   32   N NH2 . ARG A 1 4   ? 1.25358   6.16023   26.62987  1.000 35.09365 ? 4   ARG A NH2 1 
ATOM   33   N N   . LYS A 1 5   ? -6.43429  4.72067   26.26061  1.000 26.62148 ? 5   LYS A N   1 
ATOM   34   C CA  . LYS A 1 5   ? -7.44599  4.12859   25.39044  1.000 26.39805 ? 5   LYS A CA  1 
ATOM   35   C C   . LYS A 1 5   ? -7.13689  2.63882   25.29116  1.000 30.40201 ? 5   LYS A C   1 
ATOM   36   O O   . LYS A 1 5   ? -6.20827  2.22109   24.59602  1.000 33.40922 ? 5   LYS A O   1 
ATOM   37   C CB  . LYS A 1 5   ? -7.45278  4.80781   24.02533  1.000 29.55792 ? 5   LYS A CB  1 
ATOM   38   C CG  . LYS A 1 5   ? -8.61087  4.39887   23.12931  1.000 34.23094 ? 5   LYS A CG  1 
ATOM   39   C CD  . LYS A 1 5   ? -9.96335  4.72786   23.73487  1.000 31.39909 ? 5   LYS A CD  1 
ATOM   40   C CE  . LYS A 1 5   ? -10.20993 6.23598   23.76403  1.000 37.65188 ? 5   LYS A CE  1 
ATOM   41   N NZ  . LYS A 1 5   ? -10.19895 6.86241   22.41328  1.000 36.34699 ? 5   LYS A NZ  1 
ATOM   42   N N   . MET A 1 6   ? -7.90903  1.83474   26.00884  1.000 25.09105 ? 6   MET A N   1 
ATOM   43   C CA  . MET A 1 6   ? -7.58012  0.44574   26.28088  1.000 26.15835 ? 6   MET A CA  1 
ATOM   44   C C   . MET A 1 6   ? -8.52884  -0.46476  25.51692  1.000 26.12672 ? 6   MET A C   1 
ATOM   45   O O   . MET A 1 6   ? -9.75023  -0.32118  25.62571  1.000 29.97298 ? 6   MET A O   1 
ATOM   46   C CB  . MET A 1 6   ? -7.67305  0.17972   27.78130  1.000 26.59746 ? 6   MET A CB  1 
ATOM   47   C CG  . MET A 1 6   ? -7.18118  -1.16632  28.22311  1.000 35.32886 ? 6   MET A CG  1 
ATOM   48   S SD  . MET A 1 6   ? -7.18753  -1.21129  30.02640  1.000 38.15357 ? 6   MET A SD  1 
ATOM   49   C CE  . MET A 1 6   ? -6.05521  0.11822   30.40095  1.000 34.32149 ? 6   MET A CE  1 
ATOM   50   N N   . ALA A 1 7   ? -7.96807  -1.38427  24.73824  1.000 26.75143 ? 7   ALA A N   1 
ATOM   51   C CA  . ALA A 1 7   ? -8.76510  -2.35956  24.01118  1.000 26.62915 ? 7   ALA A CA  1 
ATOM   52   C C   . ALA A 1 7   ? -8.89363  -3.63504  24.82973  1.000 23.52445 ? 7   ALA A C   1 
ATOM   53   O O   . ALA A 1 7   ? -8.11902  -3.88611  25.75527  1.000 25.08077 ? 7   ALA A O   1 
ATOM   54   C CB  . ALA A 1 7   ? -8.14049  -2.66913  22.64869  1.000 24.18619 ? 7   ALA A CB  1 
ATOM   55   N N   . PHE A 1 8   ? -9.89694  -4.43748  24.48844  1.000 25.00128 ? 8   PHE A N   1 
ATOM   56   C CA  . PHE A 1 8   ? -10.01816 -5.75047  25.09281  1.000 25.59946 ? 8   PHE A CA  1 
ATOM   57   C C   . PHE A 1 8   ? -8.88032  -6.65021  24.61584  1.000 25.59639 ? 8   PHE A C   1 
ATOM   58   O O   . PHE A 1 8   ? -8.37153  -6.48331  23.50299  1.000 26.02943 ? 8   PHE A O   1 
ATOM   59   C CB  . PHE A 1 8   ? -11.35797 -6.39097  24.73668  1.000 23.18055 ? 8   PHE A CB  1 
ATOM   60   C CG  . PHE A 1 8   ? -12.53983 -5.71741  25.37003  1.000 24.95750 ? 8   PHE A CG  1 
ATOM   61   C CD1 . PHE A 1 8   ? -12.92784 -6.03908  26.65980  1.000 32.48555 ? 8   PHE A CD1 1 
ATOM   62   C CD2 . PHE A 1 8   ? -13.26792 -4.76350  24.67577  1.000 31.85268 ? 8   PHE A CD2 1 
ATOM   63   C CE1 . PHE A 1 8   ? -14.02037 -5.41606  27.24356  1.000 29.36536 ? 8   PHE A CE1 1 
ATOM   64   C CE2 . PHE A 1 8   ? -14.35756 -4.14225  25.25846  1.000 30.95693 ? 8   PHE A CE2 1 
ATOM   65   C CZ  . PHE A 1 8   ? -14.73363 -4.47135  26.54186  1.000 30.23733 ? 8   PHE A CZ  1 
ATOM   66   N N   . PRO A 1 9   ? -8.45350  -7.60384  25.44142  1.000 28.06399 ? 9   PRO A N   1 
ATOM   67   C CA  . PRO A 1 9   ? -7.55094  -8.64464  24.93767  1.000 25.60247 ? 9   PRO A CA  1 
ATOM   68   C C   . PRO A 1 9   ? -8.20384  -9.36215  23.76448  1.000 27.89228 ? 9   PRO A C   1 
ATOM   69   O O   . PRO A 1 9   ? -9.39256  -9.68645  23.79566  1.000 27.72694 ? 9   PRO A O   1 
ATOM   70   C CB  . PRO A 1 9   ? -7.35501  -9.57019  26.14550  1.000 28.86140 ? 9   PRO A CB  1 
ATOM   71   C CG  . PRO A 1 9   ? -8.51267  -9.28810  27.04714  1.000 34.40840 ? 9   PRO A CG  1 
ATOM   72   C CD  . PRO A 1 9   ? -8.86141  -7.84390  26.83664  1.000 28.60702 ? 9   PRO A CD  1 
ATOM   73   N N   . SER A 1 10  ? -7.42676  -9.57346  22.70876  1.000 25.55129 ? 10  SER A N   1 
ATOM   74   C CA  . SER A 1 10  ? -7.98197  -9.98491  21.42629  1.000 26.98493 ? 10  SER A CA  1 
ATOM   75   C C   . SER A 1 10  ? -7.85012  -11.47656 21.15571  1.000 25.64836 ? 10  SER A C   1 
ATOM   76   O O   . SER A 1 10  ? -8.28333  -11.93143 20.09445  1.000 28.47929 ? 10  SER A O   1 
ATOM   77   C CB  . SER A 1 10  ? -7.31631  -9.19567  20.29284  1.000 26.66069 ? 10  SER A CB  1 
ATOM   78   O OG  . SER A 1 10  ? -5.91651  -9.40565  20.28532  1.000 26.86668 ? 10  SER A OG  1 
ATOM   79   N N   . GLY A 1 11  ? -7.29071  -12.24732 22.09402  1.000 25.65643 ? 11  GLY A N   1 
ATOM   80   C CA  . GLY A 1 11  ? -7.00443  -13.65002 21.82341  1.000 28.09033 ? 11  GLY A CA  1 
ATOM   81   C C   . GLY A 1 11  ? -8.22567  -14.44562 21.39528  1.000 28.43434 ? 11  GLY A C   1 
ATOM   82   O O   . GLY A 1 11  ? -8.15555  -15.25317 20.46614  1.000 29.73364 ? 11  GLY A O   1 
ATOM   83   N N   . LYS A 1 12  ? -9.36165  -14.22500 22.06025  1.000 25.71576 ? 12  LYS A N   1 
ATOM   84   C CA  . LYS A 1 12  ? -10.56561 -14.99018 21.74701  1.000 27.74455 ? 12  LYS A CA  1 
ATOM   85   C C   . LYS A 1 12  ? -11.02904 -14.73779 20.31597  1.000 29.16598 ? 12  LYS A C   1 
ATOM   86   O O   . LYS A 1 12  ? -11.52773 -15.64987 19.64692  1.000 26.97795 ? 12  LYS A O   1 
ATOM   87   C CB  . LYS A 1 12  ? -11.67173 -14.64792 22.74695  1.000 25.36960 ? 12  LYS A CB  1 
ATOM   88   C CG  . LYS A 1 12  ? -11.45193 -15.23488 24.13778  1.000 30.88349 ? 12  LYS A CG  1 
ATOM   89   C CD  . LYS A 1 12  ? -12.43924 -14.66027 25.14262  1.000 35.78175 ? 12  LYS A CD  1 
ATOM   90   C CE  . LYS A 1 12  ? -12.57506 -15.54632 26.37744  1.000 45.90748 ? 12  LYS A CE  1 
ATOM   91   N NZ  . LYS A 1 12  ? -11.27417 -15.78111 27.06250  1.000 53.30052 ? 12  LYS A NZ  1 
ATOM   92   N N   . VAL A 1 13  ? -10.84619 -13.51277 19.82232  1.000 27.21215 ? 13  VAL A N   1 
ATOM   93   C CA  . VAL A 1 13  ? -11.27192 -13.17702 18.46748  1.000 21.89718 ? 13  VAL A CA  1 
ATOM   94   C C   . VAL A 1 13  ? -10.22751 -13.60483 17.43724  1.000 28.25324 ? 13  VAL A C   1 
ATOM   95   O O   . VAL A 1 13  ? -10.57806 -14.01061 16.32294  1.000 23.46442 ? 13  VAL A O   1 
ATOM   96   C CB  . VAL A 1 13  ? -11.58247 -11.67138 18.38446  1.000 22.56541 ? 13  VAL A CB  1 
ATOM   97   C CG1 . VAL A 1 13  ? -12.02294 -11.28972 16.97947  1.000 21.87532 ? 13  VAL A CG1 1 
ATOM   98   C CG2 . VAL A 1 13  ? -12.64017 -11.31133 19.41091  1.000 22.76189 ? 13  VAL A CG2 1 
ATOM   99   N N   . GLU A 1 14  ? -8.93534  -13.52337 17.78772  1.000 22.38519 ? 14  GLU A N   1 
ATOM   100  C CA  . GLU A 1 14  ? -7.87291  -13.90029 16.85306  1.000 23.85414 ? 14  GLU A CA  1 
ATOM   101  C C   . GLU A 1 14  ? -8.06875  -15.31210 16.31020  1.000 25.52771 ? 14  GLU A C   1 
ATOM   102  O O   . GLU A 1 14  ? -7.83870  -15.56895 15.12195  1.000 24.69602 ? 14  GLU A O   1 
ATOM   103  C CB  . GLU A 1 14  ? -6.50543  -13.80299 17.53387  1.000 28.08752 ? 14  GLU A CB  1 
ATOM   104  C CG  . GLU A 1 14  ? -6.03184  -12.39199 17.81574  1.000 25.44775 ? 14  GLU A CG  1 
ATOM   105  C CD  . GLU A 1 14  ? -4.76084  -12.37249 18.64482  1.000 28.10171 ? 14  GLU A CD  1 
ATOM   106  O OE1 . GLU A 1 14  ? -3.82177  -13.12682 18.31679  1.000 32.41002 ? 14  GLU A OE1 1 
ATOM   107  O OE2 . GLU A 1 14  ? -4.70865  -11.61257 19.63025  1.000 29.80649 ? 14  GLU A OE2 1 
ATOM   108  N N   . GLY A 1 15  ? -8.49138  -16.24129 17.16737  1.000 24.57964 ? 15  GLY A N   1 
ATOM   109  C CA  . GLY A 1 15  ? -8.72129  -17.61211 16.75418  1.000 25.21133 ? 15  GLY A CA  1 
ATOM   110  C C   . GLY A 1 15  ? -9.93318  -17.82594 15.87694  1.000 21.90862 ? 15  GLY A C   1 
ATOM   111  O O   . GLY A 1 15  ? -10.17100 -18.95773 15.44677  1.000 27.17961 ? 15  GLY A O   1 
ATOM   112  N N   . CYS A 1 16  ? -10.70834 -16.77828 15.60259  1.000 20.94031 ? 16  CYS A N   1 
ATOM   113  C CA  . CYS A 1 16  ? -11.88156 -16.86783 14.74134  1.000 24.30728 ? 16  CYS A CA  1 
ATOM   114  C C   . CYS A 1 16  ? -11.66917 -16.26634 13.35946  1.000 22.67049 ? 16  CYS A C   1 
ATOM   115  O O   . CYS A 1 16  ? -12.56257 -16.36872 12.51744  1.000 22.82877 ? 16  CYS A O   1 
ATOM   116  C CB  . CYS A 1 16  ? -13.08249 -16.17947 15.40397  1.000 20.20676 ? 16  CYS A CB  1 
ATOM   117  S SG  . CYS A 1 16  ? -13.51267 -16.82340 17.03885  1.000 29.42385 ? 16  CYS A SG  1 
ATOM   118  N N   . MET A 1 17  ? -10.53025 -15.63252 13.10101  1.000 24.65981 ? 17  MET A N   1 
ATOM   119  C CA  . MET A 1 17  ? -10.34094 -14.94057 11.83400  1.000 24.91360 ? 17  MET A CA  1 
ATOM   120  C C   . MET A 1 17  ? -9.86250  -15.90790 10.75823  1.000 24.89699 ? 17  MET A C   1 
ATOM   121  O O   . MET A 1 17  ? -8.94899  -16.71018 10.98560  1.000 24.81003 ? 17  MET A O   1 
ATOM   122  C CB  . MET A 1 17  ? -9.35044  -13.78829 11.99678  1.000 25.52462 ? 17  MET A CB  1 
ATOM   123  C CG  . MET A 1 17  ? -9.78708  -12.73233 13.00574  1.000 22.55152 ? 17  MET A CG  1 
ATOM   124  S SD  . MET A 1 17  ? -11.49129 -12.16521 12.79592  1.000 25.01009 ? 17  MET A SD  1 
ATOM   125  C CE  . MET A 1 17  ? -11.45042 -11.55042 11.10970  1.000 25.09661 ? 17  MET A CE  1 
ATOM   126  N N   . VAL A 1 18  ? -10.49588 -15.83748 9.58759   1.000 20.93752 ? 18  VAL A N   1 
ATOM   127  C CA  . VAL A 1 18  ? -10.09002 -16.59025 8.41080   1.000 23.34958 ? 18  VAL A CA  1 
ATOM   128  C C   . VAL A 1 18  ? -10.07270 -15.64583 7.21504   1.000 21.13839 ? 18  VAL A C   1 
ATOM   129  O O   . VAL A 1 18  ? -10.48921 -14.48904 7.29373   1.000 21.70715 ? 18  VAL A O   1 
ATOM   130  C CB  . VAL A 1 18  ? -11.00884 -17.79936 8.12477   1.000 21.40528 ? 18  VAL A CB  1 
ATOM   131  C CG1 . VAL A 1 18  ? -11.04964 -18.75020 9.31629   1.000 22.59379 ? 18  VAL A CG1 1 
ATOM   132  C CG2 . VAL A 1 18  ? -12.41042 -17.32820 7.75001   1.000 23.62168 ? 18  VAL A CG2 1 
ATOM   133  N N   . GLN A 1 19  ? -9.56810  -16.16272 6.10198   1.000 22.29898 ? 19  GLN A N   1 
ATOM   134  C CA  . GLN A 1 19  ? -9.54253  -15.45433 4.83683   1.000 24.04788 ? 19  GLN A CA  1 
ATOM   135  C C   . GLN A 1 19  ? -10.61868 -16.03238 3.92789   1.000 21.14603 ? 19  GLN A C   1 
ATOM   136  O O   . GLN A 1 19  ? -10.79369 -17.25108 3.86481   1.000 22.48325 ? 19  GLN A O   1 
ATOM   137  C CB  . GLN A 1 19  ? -8.16214  -15.58116 4.18953   1.000 25.21109 ? 19  GLN A CB  1 
ATOM   138  C CG  . GLN A 1 19  ? -8.03677  -14.90972 2.85205   1.000 27.11786 ? 19  GLN A CG  1 
ATOM   139  C CD  . GLN A 1 19  ? -6.69920  -15.18506 2.19130   1.000 30.67727 ? 19  GLN A CD  1 
ATOM   140  O OE1 . GLN A 1 19  ? -5.82627  -14.32187 2.15114   1.000 37.50267 ? 19  GLN A OE1 1 
ATOM   141  N NE2 . GLN A 1 19  ? -6.53524  -16.39294 1.66732   1.000 41.46223 ? 19  GLN A NE2 1 
ATOM   142  N N   . VAL A 1 20  ? -11.36534 -15.15379 3.25864   1.000 21.92075 ? 20  VAL A N   1 
ATOM   143  C CA  . VAL A 1 20  ? -12.38930 -15.55015 2.29767   1.000 24.62437 ? 20  VAL A CA  1 
ATOM   144  C C   . VAL A 1 20  ? -12.05309 -14.91587 0.95842   1.000 23.69517 ? 20  VAL A C   1 
ATOM   145  O O   . VAL A 1 20  ? -11.89484 -13.69361 0.86738   1.000 23.35245 ? 20  VAL A O   1 
ATOM   146  C CB  . VAL A 1 20  ? -13.80625 -15.13716 2.74095   1.000 22.43526 ? 20  VAL A CB  1 
ATOM   147  C CG1 . VAL A 1 20  ? -14.84028 -15.67794 1.75542   1.000 20.80414 ? 20  VAL A CG1 1 
ATOM   148  C CG2 . VAL A 1 20  ? -14.10469 -15.62850 4.15032   1.000 23.00009 ? 20  VAL A CG2 1 
ATOM   149  N N   . THR A 1 21  ? -11.95256 -15.74314 -0.07249  1.000 26.48392 ? 21  THR A N   1 
ATOM   150  C CA  . THR A 1 21  ? -11.67290 -15.29801 -1.42817  1.000 25.38609 ? 21  THR A CA  1 
ATOM   151  C C   . THR A 1 21  ? -12.78738 -15.76475 -2.35076  1.000 27.80231 ? 21  THR A C   1 
ATOM   152  O O   . THR A 1 21  ? -13.24643 -16.90783 -2.25799  1.000 23.55931 ? 21  THR A O   1 
ATOM   153  C CB  . THR A 1 21  ? -10.32992 -15.84409 -1.92342  1.000 25.31137 ? 21  THR A CB  1 
ATOM   154  O OG1 . THR A 1 21  ? -9.27713  -15.33858 -1.09331  1.000 27.80139 ? 21  THR A OG1 1 
ATOM   155  C CG2 . THR A 1 21  ? -10.08928 -15.44691 -3.36188  1.000 27.41275 ? 21  THR A CG2 1 
ATOM   156  N N   . CYS A 1 22  ? -13.22049 -14.87568 -3.23986  1.000 23.28893 ? 22  CYS A N   1 
ATOM   157  C CA  . CYS A 1 22  ? -14.21115 -15.21786 -4.24911  1.000 21.01117 ? 22  CYS A CA  1 
ATOM   158  C C   . CYS A 1 22  ? -13.84995 -14.46448 -5.51877  1.000 29.62281 ? 22  CYS A C   1 
ATOM   159  O O   . CYS A 1 22  ? -13.62412 -13.25177 -5.47836  1.000 30.52181 ? 22  CYS A O   1 
ATOM   160  C CB  . CYS A 1 22  ? -15.63398 -14.88096 -3.77026  1.000 20.70094 ? 22  CYS A CB  1 
ATOM   161  S SG  . CYS A 1 22  ? -16.96229 -15.43928 -4.87101  1.000 34.87569 ? 22  CYS A SG  1 
ATOM   162  N N   . GLY A 1 23  ? -13.75856 -15.18712 -6.63357  1.000 37.36600 ? 23  GLY A N   1 
ATOM   163  C CA  . GLY A 1 23  ? -13.38524 -14.57966 -7.89767  1.000 32.23468 ? 23  GLY A CA  1 
ATOM   164  C C   . GLY A 1 23  ? -12.01346 -13.93707 -7.85836  1.000 35.17219 ? 23  GLY A C   1 
ATOM   165  O O   . GLY A 1 23  ? -10.99916 -14.62856 -7.74164  1.000 38.81567 ? 23  GLY A O   1 
ATOM   166  N N   . THR A 1 24  ? -11.97179 -12.60665 -7.94110  1.000 34.73525 ? 24  THR A N   1 
ATOM   167  C CA  . THR A 1 24  ? -10.72757 -11.84952 -7.88146  1.000 36.74379 ? 24  THR A CA  1 
ATOM   168  C C   . THR A 1 24  ? -10.61730 -11.01757 -6.60805  1.000 37.29111 ? 24  THR A C   1 
ATOM   169  O O   . THR A 1 24  ? -9.80832  -10.08597 -6.54883  1.000 34.97325 ? 24  THR A O   1 
ATOM   170  C CB  . THR A 1 24  ? -10.60624 -10.94207 -9.10609  1.000 45.26090 ? 24  THR A CB  1 
ATOM   171  O OG1 . THR A 1 24  ? -11.70631 -10.02259 -9.12125  1.000 52.11127 ? 24  THR A OG1 1 
ATOM   172  C CG2 . THR A 1 24  ? -10.62238 -11.76673 -10.38904 1.000 47.11891 ? 24  THR A CG2 1 
ATOM   173  N N   . THR A 1 25  ? -11.40693 -11.33861 -5.58641  1.000 28.50330 ? 25  THR A N   1 
ATOM   174  C CA  . THR A 1 25  ? -11.56397 -10.48596 -4.41517  1.000 25.30612 ? 25  THR A CA  1 
ATOM   175  C C   . THR A 1 25  ? -11.31043 -11.29117 -3.14804  1.000 24.13995 ? 25  THR A C   1 
ATOM   176  O O   . THR A 1 25  ? -11.73475 -12.44441 -3.04209  1.000 25.33868 ? 25  THR A O   1 
ATOM   177  C CB  . THR A 1 25  ? -12.97525 -9.87988  -4.39988  1.000 28.82982 ? 25  THR A CB  1 
ATOM   178  O OG1 . THR A 1 25  ? -13.17828 -9.12436  -5.60225  1.000 31.06466 ? 25  THR A OG1 1 
ATOM   179  C CG2 . THR A 1 25  ? -13.18550 -8.98216  -3.20053  1.000 26.12202 ? 25  THR A CG2 1 
ATOM   180  N N   A THR A 1 26  ? -10.62470 -10.67616 -2.18529  0.606 23.58833 ? 26  THR A N   1 
ATOM   181  N N   B THR A 1 26  ? -10.60322 -10.68318 -2.19499  0.394 23.64352 ? 26  THR A N   1 
ATOM   182  C CA  A THR A 1 26  ? -10.30466 -11.31651 -0.91662  0.606 23.91680 ? 26  THR A CA  1 
ATOM   183  C CA  B THR A 1 26  ? -10.31919 -11.30863 -0.91143  0.394 23.96145 ? 26  THR A CA  1 
ATOM   184  C C   A THR A 1 26  ? -10.61644 -10.35967 0.22445   0.606 24.89790 ? 26  THR A C   1 
ATOM   185  C C   B THR A 1 26  ? -10.66450 -10.34572 0.21332   0.394 24.88897 ? 26  THR A C   1 
ATOM   186  O O   A THR A 1 26  ? -10.43622 -9.14505  0.08869   0.606 26.23691 ? 26  THR A O   1 
ATOM   187  O O   B THR A 1 26  ? -10.54330 -9.12591  0.06531   0.394 26.16833 ? 26  THR A O   1 
ATOM   188  C CB  A THR A 1 26  ? -8.82617  -11.73467 -0.86664  0.606 25.79022 ? 26  THR A CB  1 
ATOM   189  C CB  B THR A 1 26  ? -8.84265  -11.72156 -0.78142  0.394 25.80444 ? 26  THR A CB  1 
ATOM   190  O OG1 A THR A 1 26  ? -8.54220  -12.61398 -1.96112  0.606 34.36363 ? 26  THR A OG1 1 
ATOM   191  O OG1 B THR A 1 26  ? -8.02301  -10.55235 -0.67583  0.394 29.40978 ? 26  THR A OG1 1 
ATOM   192  C CG2 A THR A 1 26  ? -8.51473  -12.45757 0.41991   0.606 25.51758 ? 26  THR A CG2 1 
ATOM   193  C CG2 B THR A 1 26  ? -8.40341  -12.51564 -1.98827  0.394 33.92030 ? 26  THR A CG2 1 
ATOM   194  N N   . LEU A 1 27  ? -11.10028 -10.90807 1.33558   1.000 21.73536 ? 27  LEU A N   1 
ATOM   195  C CA  . LEU A 1 27  ? -11.30043 -10.15168 2.57158   1.000 19.76407 ? 27  LEU A CA  1 
ATOM   196  C C   . LEU A 1 27  ? -11.28389 -11.14294 3.73673   1.000 22.12963 ? 27  LEU A C   1 
ATOM   197  O O   . LEU A 1 27  ? -10.90946 -12.30895 3.57222   1.000 21.84729 ? 27  LEU A O   1 
ATOM   198  C CB  . LEU A 1 27  ? -12.58376 -9.31265  2.51669   1.000 20.65762 ? 27  LEU A CB  1 
ATOM   199  C CG  . LEU A 1 27  ? -13.86905 -9.89881  1.91567   1.000 21.13886 ? 27  LEU A CG  1 
ATOM   200  C CD1 . LEU A 1 27  ? -14.34610 -11.13965 2.65259   1.000 19.43712 ? 27  LEU A CD1 1 
ATOM   201  C CD2 . LEU A 1 27  ? -14.96021 -8.82894  1.91080   1.000 21.90488 ? 27  LEU A CD2 1 
ATOM   202  N N   . ASN A 1 28  ? -11.70759 -10.68544 4.91304   1.000 22.91026 ? 28  ASN A N   1 
ATOM   203  C CA  . ASN A 1 28  ? -11.67572 -11.48632 6.13039   1.000 18.50922 ? 28  ASN A CA  1 
ATOM   204  C C   . ASN A 1 28  ? -13.05427 -12.03605 6.46214   1.000 18.73553 ? 28  ASN A C   1 
ATOM   205  O O   . ASN A 1 28  ? -14.08083 -11.41076 6.18350   1.000 19.99592 ? 28  ASN A O   1 
ATOM   206  C CB  . ASN A 1 28  ? -11.18194 -10.66602 7.32516   1.000 20.35797 ? 28  ASN A CB  1 
ATOM   207  C CG  . ASN A 1 28  ? -9.85389  -9.99991  7.06215   1.000 23.19241 ? 28  ASN A CG  1 
ATOM   208  O OD1 . ASN A 1 28  ? -8.80513  -10.64019 7.13016   1.000 24.60172 ? 28  ASN A OD1 1 
ATOM   209  N ND2 . ASN A 1 28  ? -9.89042  -8.70439  6.75943   1.000 21.23035 ? 28  ASN A ND2 1 
ATOM   210  N N   . GLY A 1 29  ? -13.06399 -13.19925 7.10537   1.000 20.87353 ? 29  GLY A N   1 
ATOM   211  C CA  . GLY A 1 29  ? -14.28845 -13.76343 7.61849   1.000 21.42936 ? 29  GLY A CA  1 
ATOM   212  C C   . GLY A 1 29  ? -14.14340 -14.12526 9.08359   1.000 22.90345 ? 29  GLY A C   1 
ATOM   213  O O   . GLY A 1 29  ? -13.04059 -14.23602 9.61864   1.000 21.61129 ? 29  GLY A O   1 
ATOM   214  N N   . LEU A 1 30  ? -15.29170 -14.30011 9.72618   1.000 20.17947 ? 30  LEU A N   1 
ATOM   215  C CA  . LEU A 1 30  ? -15.37670 -14.63542 11.14014  1.000 22.75038 ? 30  LEU A CA  1 
ATOM   216  C C   . LEU A 1 30  ? -15.93919 -16.04686 11.27005  1.000 23.40863 ? 30  LEU A C   1 
ATOM   217  O O   . LEU A 1 30  ? -17.08885 -16.29470 10.89012  1.000 21.94054 ? 30  LEU A O   1 
ATOM   218  C CB  . LEU A 1 30  ? -16.25941 -13.63034 11.87820  1.000 21.11148 ? 30  LEU A CB  1 
ATOM   219  C CG  . LEU A 1 30  ? -16.38656 -13.82464 13.38934  1.000 21.90982 ? 30  LEU A CG  1 
ATOM   220  C CD1 . LEU A 1 30  ? -15.08917 -13.45439 14.09333  1.000 21.70559 ? 30  LEU A CD1 1 
ATOM   221  C CD2 . LEU A 1 30  ? -17.53571 -12.99179 13.93047  1.000 23.42877 ? 30  LEU A CD2 1 
ATOM   222  N N   . TRP A 1 31  ? -15.13507 -16.96003 11.82250  1.000 21.76414 ? 31  TRP A N   1 
ATOM   223  C CA  . TRP A 1 31  ? -15.45399 -18.38782 11.87242  1.000 19.79355 ? 31  TRP A CA  1 
ATOM   224  C C   . TRP A 1 31  ? -15.92571 -18.73623 13.28277  1.000 20.12694 ? 31  TRP A C   1 
ATOM   225  O O   . TRP A 1 31  ? -15.12206 -18.79980 14.22214  1.000 23.03964 ? 31  TRP A O   1 
ATOM   226  C CB  . TRP A 1 31  ? -14.22397 -19.20078 11.47321  1.000 19.36275 ? 31  TRP A CB  1 
ATOM   227  C CG  . TRP A 1 31  ? -14.38044 -20.69849 11.42280  1.000 23.03549 ? 31  TRP A CG  1 
ATOM   228  C CD1 . TRP A 1 31  ? -15.53897 -21.41338 11.31398  1.000 21.43416 ? 31  TRP A CD1 1 
ATOM   229  C CD2 . TRP A 1 31  ? -13.31713 -21.66127 11.47368  1.000 21.72325 ? 31  TRP A CD2 1 
ATOM   230  N NE1 . TRP A 1 31  ? -15.25959 -22.76392 11.29964  1.000 23.36591 ? 31  TRP A NE1 1 
ATOM   231  C CE2 . TRP A 1 31  ? -13.90339 -22.93960 11.38813  1.000 24.48065 ? 31  TRP A CE2 1 
ATOM   232  C CE3 . TRP A 1 31  ? -11.92556 -21.56242 11.58481  1.000 22.23149 ? 31  TRP A CE3 1 
ATOM   233  C CZ2 . TRP A 1 31  ? -13.14528 -24.11524 11.41663  1.000 26.38578 ? 31  TRP A CZ2 1 
ATOM   234  C CZ3 . TRP A 1 31  ? -11.17449 -22.72943 11.60655  1.000 23.20592 ? 31  TRP A CZ3 1 
ATOM   235  C CH2 . TRP A 1 31  ? -11.78688 -23.98718 11.52187  1.000 26.85205 ? 31  TRP A CH2 1 
ATOM   236  N N   . LEU A 1 32  ? -17.22961 -18.93879 13.43631  1.000 20.57839 ? 32  LEU A N   1 
ATOM   237  C CA  . LEU A 1 32  ? -17.82026 -19.30978 14.71592  1.000 23.09141 ? 32  LEU A CA  1 
ATOM   238  C C   . LEU A 1 32  ? -18.64584 -20.56567 14.51130  1.000 20.60465 ? 32  LEU A C   1 
ATOM   239  O O   . LEU A 1 32  ? -19.50856 -20.60048 13.62832  1.000 21.93129 ? 32  LEU A O   1 
ATOM   240  C CB  . LEU A 1 32  ? -18.70169 -18.19597 15.26926  1.000 22.19680 ? 32  LEU A CB  1 
ATOM   241  C CG  . LEU A 1 32  ? -17.99415 -16.86426 15.51579  1.000 21.74785 ? 32  LEU A CG  1 
ATOM   242  C CD1 . LEU A 1 32  ? -19.02364 -15.77416 15.65660  1.000 22.11269 ? 32  LEU A CD1 1 
ATOM   243  C CD2 . LEU A 1 32  ? -17.09955 -16.94780 16.73978  1.000 21.97165 ? 32  LEU A CD2 1 
ATOM   244  N N   . ASP A 1 33  ? -18.38904 -21.58625 15.32966  1.000 24.63005 ? 33  ASP A N   1 
ATOM   245  C CA  . ASP A 1 33  ? -18.98530 -22.91541 15.14091  1.000 29.37253 ? 33  ASP A CA  1 
ATOM   246  C C   . ASP A 1 33  ? -18.70520 -23.32248 13.69341  1.000 28.40953 ? 33  ASP A C   1 
ATOM   247  O O   . ASP A 1 33  ? -17.55588 -23.19727 13.24524  1.000 22.47241 ? 33  ASP A O   1 
ATOM   248  C CB  . ASP A 1 33  ? -20.45151 -22.88415 15.54838  1.000 26.77643 ? 33  ASP A CB  1 
ATOM   249  C CG  . ASP A 1 33  ? -20.64543 -22.41575 16.97496  1.000 39.29883 ? 33  ASP A CG  1 
ATOM   250  O OD1 . ASP A 1 33  ? -19.80857 -22.77738 17.82859  1.000 34.03303 ? 33  ASP A OD1 1 
ATOM   251  O OD2 . ASP A 1 33  ? -21.62434 -21.67976 17.23936  1.000 34.89952 ? 33  ASP A OD2 1 
ATOM   252  N N   . ASP A 1 34  ? -19.70274 -23.77524 12.93096  1.000 23.65070 ? 34  ASP A N   1 
ATOM   253  C CA  . ASP A 1 34  ? -19.49416 -24.21785 11.55805  1.000 23.17513 ? 34  ASP A CA  1 
ATOM   254  C C   . ASP A 1 34  ? -19.96382 -23.19020 10.53105  1.000 24.43931 ? 34  ASP A C   1 
ATOM   255  O O   . ASP A 1 34  ? -20.37694 -23.56233 9.42626   1.000 24.88888 ? 34  ASP A O   1 
ATOM   256  C CB  . ASP A 1 34  ? -20.19225 -25.55877 11.32149  1.000 23.47036 ? 34  ASP A CB  1 
ATOM   257  C CG  . ASP A 1 34  ? -21.69984 -25.48084 11.48826  1.000 29.64864 ? 34  ASP A CG  1 
ATOM   258  O OD1 . ASP A 1 34  ? -22.20954 -24.46570 12.01095  1.000 33.07005 ? 34  ASP A OD1 1 
ATOM   259  O OD2 . ASP A 1 34  ? -22.38064 -26.44797 11.08810  1.000 32.79584 ? 34  ASP A OD2 1 
ATOM   260  N N   . VAL A 1 35  ? -19.90953 -21.90316 10.86679  1.000 22.86987 ? 35  VAL A N   1 
ATOM   261  C CA  . VAL A 1 35  ? -20.33826 -20.84366 9.96162   1.000 19.36952 ? 35  VAL A CA  1 
ATOM   262  C C   . VAL A 1 35  ? -19.23800 -19.79540 9.86449   1.000 21.45079 ? 35  VAL A C   1 
ATOM   263  O O   . VAL A 1 35  ? -18.64765 -19.40454 10.87965  1.000 21.81074 ? 35  VAL A O   1 
ATOM   264  C CB  . VAL A 1 35  ? -21.66284 -20.19084 10.41704  1.000 21.75765 ? 35  VAL A CB  1 
ATOM   265  C CG1 . VAL A 1 35  ? -22.03936 -19.05866 9.46241   1.000 20.97022 ? 35  VAL A CG1 1 
ATOM   266  C CG2 . VAL A 1 35  ? -22.78143 -21.22717 10.47786  1.000 24.35280 ? 35  VAL A CG2 1 
ATOM   267  N N   . VAL A 1 36  ? -18.96526 -19.33730 8.64363   1.000 20.64618 ? 36  VAL A N   1 
ATOM   268  C CA  . VAL A 1 36  ? -18.05744 -18.22061 8.39921   1.000 19.43235 ? 36  VAL A CA  1 
ATOM   269  C C   . VAL A 1 36  ? -18.89604 -17.03817 7.92762   1.000 21.74973 ? 36  VAL A C   1 
ATOM   270  O O   . VAL A 1 36  ? -19.63286 -17.14630 6.93921   1.000 20.94337 ? 36  VAL A O   1 
ATOM   271  C CB  . VAL A 1 36  ? -16.97132 -18.58131 7.37385   1.000 21.32144 ? 36  VAL A CB  1 
ATOM   272  C CG1 . VAL A 1 36  ? -16.11238 -17.36608 7.05110   1.000 21.56216 ? 36  VAL A CG1 1 
ATOM   273  C CG2 . VAL A 1 36  ? -16.10661 -19.71924 7.89626   1.000 22.73259 ? 36  VAL A CG2 1 
ATOM   274  N N   . TYR A 1 37  ? -18.80353 -15.92257 8.64849   1.000 19.77009 ? 37  TYR A N   1 
ATOM   275  C CA  . TYR A 1 37  ? -19.50428 -14.68760 8.31611   1.000 21.61511 ? 37  TYR A CA  1 
ATOM   276  C C   . TYR A 1 37  ? -18.53694 -13.73686 7.62195   1.000 21.09401 ? 37  TYR A C   1 
ATOM   277  O O   . TYR A 1 37  ? -17.39294 -13.58471 8.05775   1.000 22.22225 ? 37  TYR A O   1 
ATOM   278  C CB  . TYR A 1 37  ? -20.06715 -14.01636 9.57801   1.000 19.00139 ? 37  TYR A CB  1 
ATOM   279  C CG  . TYR A 1 37  ? -20.96043 -14.90270 10.41974  1.000 24.55017 ? 37  TYR A CG  1 
ATOM   280  C CD1 . TYR A 1 37  ? -20.42261 -15.86291 11.26901  1.000 23.48825 ? 37  TYR A CD1 1 
ATOM   281  C CD2 . TYR A 1 37  ? -22.34231 -14.77150 10.36988  1.000 21.16089 ? 37  TYR A CD2 1 
ATOM   282  C CE1 . TYR A 1 37  ? -21.24185 -16.67383 12.03329  1.000 25.05772 ? 37  TYR A CE1 1 
ATOM   283  C CE2 . TYR A 1 37  ? -23.16585 -15.57326 11.12998  1.000 23.08577 ? 37  TYR A CE2 1 
ATOM   284  C CZ  . TYR A 1 37  ? -22.61132 -16.51848 11.96073  1.000 25.72401 ? 37  TYR A CZ  1 
ATOM   285  O OH  . TYR A 1 37  ? -23.43185 -17.32087 12.71435  1.000 29.35295 ? 37  TYR A OH  1 
ATOM   286  N N   . CYS A 1 38  ? -18.98586 -13.09674 6.54426   1.000 19.80452 ? 38  CYS A N   1 
ATOM   287  C CA  . CYS A 1 38  ? -18.12364 -12.14841 5.84763   1.000 18.58222 ? 38  CYS A CA  1 
ATOM   288  C C   . CYS A 1 38  ? -18.99514 -11.17848 5.05812   1.000 19.45373 ? 38  CYS A C   1 
ATOM   289  O O   . CYS A 1 38  ? -20.17127 -11.46835 4.79403   1.000 20.81318 ? 38  CYS A O   1 
ATOM   290  C CB  . CYS A 1 38  ? -17.12950 -12.87460 4.92234   1.000 18.02787 ? 38  CYS A CB  1 
ATOM   291  S SG  . CYS A 1 38  ? -17.83860 -13.53274 3.39607   1.000 22.04043 ? 38  CYS A SG  1 
ATOM   292  N N   . PRO A 1 39  ? -18.45815 -10.01482 4.67851   1.000 20.16108 ? 39  PRO A N   1 
ATOM   293  C CA  . PRO A 1 39  ? -19.25146 -9.06963  3.87994   1.000 18.42181 ? 39  PRO A CA  1 
ATOM   294  C C   . PRO A 1 39  ? -19.59593 -9.65571  2.51805   1.000 19.34331 ? 39  PRO A C   1 
ATOM   295  O O   . PRO A 1 39  ? -18.77832 -10.33154 1.88305   1.000 19.58309 ? 39  PRO A O   1 
ATOM   296  C CB  . PRO A 1 39  ? -18.33030 -7.84734  3.74881   1.000 18.38079 ? 39  PRO A CB  1 
ATOM   297  C CG  . PRO A 1 39  ? -17.36251 -7.96070  4.90750   1.000 18.60771 ? 39  PRO A CG  1 
ATOM   298  C CD  . PRO A 1 39  ? -17.15765 -9.44536  5.08324   1.000 22.48745 ? 39  PRO A CD  1 
ATOM   299  N N   . ARG A 1 40  ? -20.82959 -9.40096  2.07221   1.000 19.87881 ? 40  ARG A N   1 
ATOM   300  C CA  . ARG A 1 40  ? -21.24971 -9.92551  0.77926   1.000 22.54088 ? 40  ARG A CA  1 
ATOM   301  C C   . ARG A 1 40  ? -20.48873 -9.28992  -0.38034  1.000 22.62582 ? 40  ARG A C   1 
ATOM   302  O O   . ARG A 1 40  ? -20.49628 -9.83822  -1.48422  1.000 22.21046 ? 40  ARG A O   1 
ATOM   303  C CB  . ARG A 1 40  ? -22.75775 -9.74192  0.59665   1.000 22.84492 ? 40  ARG A CB  1 
ATOM   304  C CG  . ARG A 1 40  ? -23.22671 -8.29987  0.57088   1.000 18.41927 ? 40  ARG A CG  1 
ATOM   305  C CD  . ARG A 1 40  ? -24.71393 -8.24513  0.24985   1.000 21.83299 ? 40  ARG A CD  1 
ATOM   306  N NE  . ARG A 1 40  ? -25.22338 -6.87747  0.22928   1.000 19.24175 ? 40  ARG A NE  1 
ATOM   307  C CZ  . ARG A 1 40  ? -26.46003 -6.54871  -0.11803  1.000 25.72160 ? 40  ARG A CZ  1 
ATOM   308  N NH1 . ARG A 1 40  ? -27.34223 -7.46729  -0.48151  1.000 20.57004 ? 40  ARG A NH1 1 
ATOM   309  N NH2 . ARG A 1 40  ? -26.81587 -5.26460  -0.11488  1.000 21.55669 ? 40  ARG A NH2 1 
ATOM   310  N N   . ALA A 1 41  ? -19.81615 -8.16032  -0.15688  1.000 22.69338 ? 41  ALA A N   1 
ATOM   311  C CA  . ALA A 1 41  ? -19.04783 -7.53831  -1.22582  1.000 25.27502 ? 41  ALA A CA  1 
ATOM   312  C C   . ALA A 1 41  ? -17.85922 -8.37843  -1.67612  1.000 23.51642 ? 41  ALA A C   1 
ATOM   313  O O   . ALA A 1 41  ? -17.20040 -8.01672  -2.65950  1.000 23.19255 ? 41  ALA A O   1 
ATOM   314  C CB  . ALA A 1 41  ? -18.56387 -6.16574  -0.78369  1.000 32.29354 ? 41  ALA A CB  1 
ATOM   315  N N   . VAL A 1 42  ? -17.57373 -9.49117  -0.99954  1.000 20.08339 ? 42  VAL A N   1 
ATOM   316  C CA  . VAL A 1 42  ? -16.56242 -10.41106 -1.50832  1.000 19.94730 ? 42  VAL A CA  1 
ATOM   317  C C   . VAL A 1 42  ? -16.91615 -10.93550 -2.90267  1.000 23.07017 ? 42  VAL A C   1 
ATOM   318  O O   . VAL A 1 42  ? -16.02433 -11.34746 -3.64987  1.000 24.20646 ? 42  VAL A O   1 
ATOM   319  C CB  . VAL A 1 42  ? -16.35558 -11.57319 -0.51647  1.000 20.58613 ? 42  VAL A CB  1 
ATOM   320  C CG1 . VAL A 1 42  ? -17.52137 -12.54650 -0.57418  1.000 21.24506 ? 42  VAL A CG1 1 
ATOM   321  C CG2 . VAL A 1 42  ? -15.03176 -12.28189 -0.80558  1.000 20.67186 ? 42  VAL A CG2 1 
ATOM   322  N N   . ILE A 1 43  ? -18.19840 -10.91871 -3.28777  1.000 24.72218 ? 43  ILE A N   1 
ATOM   323  C CA  . ILE A 1 43  ? -18.58770 -11.43414 -4.59804  1.000 24.36954 ? 43  ILE A CA  1 
ATOM   324  C C   . ILE A 1 43  ? -18.49719 -10.38360 -5.69793  1.000 28.30228 ? 43  ILE A C   1 
ATOM   325  O O   . ILE A 1 43  ? -18.78691 -10.69341 -6.86298  1.000 28.29843 ? 43  ILE A O   1 
ATOM   326  C CB  . ILE A 1 43  ? -20.01059 -12.04163 -4.57412  1.000 25.19608 ? 43  ILE A CB  1 
ATOM   327  C CG1 . ILE A 1 43  ? -21.07127 -10.95913 -4.36874  1.000 22.60039 ? 43  ILE A CG1 1 
ATOM   328  C CG2 . ILE A 1 43  ? -20.12208 -13.12571 -3.50048  1.000 22.39437 ? 43  ILE A CG2 1 
ATOM   329  C CD1 . ILE A 1 43  ? -22.47886 -11.49954 -4.30234  1.000 27.14469 ? 43  ILE A CD1 1 
ATOM   330  N N   . CYS A 1 44  ? -18.07487 -9.16443  -5.37942  1.000 25.30647 ? 44  CYS A N   1 
ATOM   331  C CA  . CYS A 1 44  ? -18.01665 -8.07926  -6.34926  1.000 27.08018 ? 44  CYS A CA  1 
ATOM   332  C C   . CYS A 1 44  ? -16.61977 -7.90753  -6.92516  1.000 34.01444 ? 44  CYS A C   1 
ATOM   333  O O   . CYS A 1 44  ? -15.62194 -7.98173  -6.20251  1.000 37.57603 ? 44  CYS A O   1 
ATOM   334  C CB  . CYS A 1 44  ? -18.44411 -6.76085  -5.71156  1.000 33.34253 ? 44  CYS A CB  1 
ATOM   335  S SG  . CYS A 1 44  ? -20.17978 -6.67972  -5.33217  1.000 37.37037 ? 44  CYS A SG  1 
ATOM   336  N N   . THR A 1 45  ? -16.56108 -7.65806  -8.22857  1.000 35.37817 ? 45  THR A N   1 
ATOM   337  C CA  . THR A 1 45  ? -15.38214 -7.05982  -8.82894  1.000 40.20456 ? 45  THR A CA  1 
ATOM   338  C C   . THR A 1 45  ? -15.41181 -5.55109  -8.60291  1.000 39.80767 ? 45  THR A C   1 
ATOM   339  O O   . THR A 1 45  ? -16.39169 -4.99352  -8.10062  1.000 43.79016 ? 45  THR A O   1 
ATOM   340  C CB  . THR A 1 45  ? -15.31673 -7.36793  -10.32140 1.000 40.14272 ? 45  THR A CB  1 
ATOM   341  O OG1 . THR A 1 45  ? -16.37663 -6.67949  -10.99426 1.000 45.25142 ? 45  THR A OG1 1 
ATOM   342  C CG2 . THR A 1 45  ? -15.45556 -8.86184  -10.56381 1.000 36.97893 ? 45  THR A CG2 1 
ATOM   343  N N   . SER A 1 46  ? -14.32256 -4.88032  -8.98502  1.000 45.82955 ? 46  SER A N   1 
ATOM   344  C CA  . SER A 1 46  ? -14.26025 -3.43256  -8.80027  1.000 49.53817 ? 46  SER A CA  1 
ATOM   345  C C   . SER A 1 46  ? -15.35286 -2.72403  -9.59384  1.000 53.68589 ? 46  SER A C   1 
ATOM   346  O O   . SER A 1 46  ? -15.93788 -1.74260  -9.11755  1.000 55.40426 ? 46  SER A O   1 
ATOM   347  C CB  . SER A 1 46  ? -12.88033 -2.90489  -9.19416  1.000 54.78661 ? 46  SER A CB  1 
ATOM   348  O OG  . SER A 1 46  ? -11.88656 -3.36374  -8.29417  1.000 57.58090 ? 46  SER A OG  1 
ATOM   349  N N   . GLU A 1 47  ? -15.65449 -3.21381  -10.80030 1.000 40.49689 ? 47  GLU A N   1 
ATOM   350  C CA  . GLU A 1 47  ? -16.69129 -2.57517  -11.60711 1.000 52.28278 ? 47  GLU A CA  1 
ATOM   351  C C   . GLU A 1 47  ? -18.08309 -2.87942  -11.06740 1.000 42.70795 ? 47  GLU A C   1 
ATOM   352  O O   . GLU A 1 47  ? -18.97407 -2.02332  -11.12648 1.000 44.09111 ? 47  GLU A O   1 
ATOM   353  C CB  . GLU A 1 47  ? -16.56849 -3.00400  -13.06843 1.000 54.61761 ? 47  GLU A CB  1 
ATOM   354  C CG  . GLU A 1 47  ? -15.53090 -2.20092  -13.84536 1.000 69.39250 ? 47  GLU A CG  1 
ATOM   355  C CD  . GLU A 1 47  ? -15.46391 -2.57653  -15.31577 1.000 88.01867 ? 47  GLU A CD  1 
ATOM   356  O OE1 . GLU A 1 47  ? -16.07004 -3.60116  -15.69918 1.000 85.20145 ? 47  GLU A OE1 1 
ATOM   357  O OE2 . GLU A 1 47  ? -14.80379 -1.84371  -16.08783 1.000 77.02622 ? 47  GLU A OE2 1 
ATOM   358  N N   . ASP A 1 48  ? -18.28783 -4.08971  -10.53485 1.000 36.47448 ? 48  ASP A N   1 
ATOM   359  C CA  . ASP A 1 48  ? -19.54538 -4.41253  -9.86498  1.000 41.59721 ? 48  ASP A CA  1 
ATOM   360  C C   . ASP A 1 48  ? -19.90382 -3.38278  -8.80472  1.000 37.32580 ? 48  ASP A C   1 
ATOM   361  O O   . ASP A 1 48  ? -21.08729 -3.09456  -8.59015  1.000 37.71289 ? 48  ASP A O   1 
ATOM   362  C CB  . ASP A 1 48  ? -19.46650 -5.79351  -9.20114  1.000 32.27272 ? 48  ASP A CB  1 
ATOM   363  C CG  . ASP A 1 48  ? -19.45807 -6.93281  -10.20250 1.000 44.11295 ? 48  ASP A CG  1 
ATOM   364  O OD1 . ASP A 1 48  ? -19.98114 -6.75163  -11.32417 1.000 45.07352 ? 48  ASP A OD1 1 
ATOM   365  O OD2 . ASP A 1 48  ? -18.93513 -8.01527  -9.85848  1.000 42.16939 ? 48  ASP A OD2 1 
ATOM   366  N N   . MET A 1 49  ? -18.89632 -2.80871  -8.14278  1.000 43.66903 ? 49  MET A N   1 
ATOM   367  C CA  . MET A 1 49  ? -19.13440 -2.05284  -6.92021  1.000 40.44221 ? 49  MET A CA  1 
ATOM   368  C C   . MET A 1 49  ? -19.86404 -0.73606  -7.14852  1.000 29.91760 ? 49  MET A C   1 
ATOM   369  O O   . MET A 1 49  ? -20.43950 -0.19730  -6.19912  1.000 30.12946 ? 49  MET A O   1 
ATOM   370  C CB  . MET A 1 49  ? -17.81215 -1.79427  -6.19843  1.000 40.25494 ? 49  MET A CB  1 
ATOM   371  C CG  . MET A 1 49  ? -17.31381 -2.97984  -5.38119  1.000 39.30201 ? 49  MET A CG  1 
ATOM   372  S SD  . MET A 1 49  ? -18.55888 -3.58429  -4.21449  1.000 63.47129 ? 49  MET A SD  1 
ATOM   373  C CE  . MET A 1 49  ? -19.19583 -2.04770  -3.54251  1.000 44.17123 ? 49  MET A CE  1 
ATOM   374  N N   . LEU A 1 50  ? -19.85964 -0.20471  -8.36862  1.000 28.52444 ? 50  LEU A N   1 
ATOM   375  C CA  . LEU A 1 50  ? -20.60679 1.02141   -8.62598  1.000 29.39323 ? 50  LEU A CA  1 
ATOM   376  C C   . LEU A 1 50  ? -22.11033 0.79958   -8.48037  1.000 38.52879 ? 50  LEU A C   1 
ATOM   377  O O   . LEU A 1 50  ? -22.82117 1.65741   -7.94223  1.000 40.79235 ? 50  LEU A O   1 
ATOM   378  C CB  . LEU A 1 50  ? -20.27934 1.56173   -10.01820 1.000 37.12047 ? 50  LEU A CB  1 
ATOM   379  C CG  . LEU A 1 50  ? -18.96123 2.31847   -10.23329 1.000 44.24997 ? 50  LEU A CG  1 
ATOM   380  C CD1 . LEU A 1 50  ? -18.74186 3.38775   -9.15434  1.000 36.70953 ? 50  LEU A CD1 1 
ATOM   381  C CD2 . LEU A 1 50  ? -17.76944 1.37293   -10.32003 1.000 50.08375 ? 50  LEU A CD2 1 
ATOM   382  N N   . ASN A 1 51  ? -22.61140 -0.34450  -8.94007  1.000 33.60389 ? 51  ASN A N   1 
ATOM   383  C CA  . ASN A 1 51  ? -24.04609 -0.60309  -8.93098  1.000 36.92827 ? 51  ASN A CA  1 
ATOM   384  C C   . ASN A 1 51  ? -24.32705 -2.09832  -8.80964  1.000 29.46839 ? 51  ASN A C   1 
ATOM   385  O O   . ASN A 1 51  ? -24.87947 -2.70063  -9.73834  1.000 33.00212 ? 51  ASN A O   1 
ATOM   386  C CB  . ASN A 1 51  ? -24.68418 -0.04035  -10.20521 1.000 40.87417 ? 51  ASN A CB  1 
ATOM   387  C CG  . ASN A 1 51  ? -26.20256 -0.08563  -10.17393 1.000 45.49175 ? 51  ASN A CG  1 
ATOM   388  O OD1 . ASN A 1 51  ? -26.81839 -0.07540  -9.10454  1.000 50.77716 ? 51  ASN A OD1 1 
ATOM   389  N ND2 . ASN A 1 51  ? -26.81425 -0.13591  -11.35374 1.000 41.94805 ? 51  ASN A ND2 1 
ATOM   390  N N   . PRO A 1 52  ? -23.97405 -2.73149  -7.69320  1.000 24.05919 ? 52  PRO A N   1 
ATOM   391  C CA  . PRO A 1 52  ? -24.10784 -4.18950  -7.60621  1.000 26.90774 ? 52  PRO A CA  1 
ATOM   392  C C   . PRO A 1 52  ? -25.54747 -4.61219  -7.36606  1.000 29.65961 ? 52  PRO A C   1 
ATOM   393  O O   . PRO A 1 52  ? -26.28254 -3.98827  -6.59654  1.000 33.80621 ? 52  PRO A O   1 
ATOM   394  C CB  . PRO A 1 52  ? -23.21954 -4.55010  -6.41021  1.000 25.01207 ? 52  PRO A CB  1 
ATOM   395  C CG  . PRO A 1 52  ? -23.29585 -3.34293  -5.53692  1.000 27.83720 ? 52  PRO A CG  1 
ATOM   396  C CD  . PRO A 1 52  ? -23.39229 -2.15751  -6.46565  1.000 31.94888 ? 52  PRO A CD  1 
ATOM   397  N N   . ASN A 1 53  ? -25.95348 -5.67364  -8.05269  1.000 24.78847 ? 53  ASN A N   1 
ATOM   398  C CA  . ASN A 1 53  ? -27.20307 -6.36957  -7.75710  1.000 28.35210 ? 53  ASN A CA  1 
ATOM   399  C C   . ASN A 1 53  ? -26.76888 -7.68171  -7.11333  1.000 27.08169 ? 53  ASN A C   1 
ATOM   400  O O   . ASN A 1 53  ? -26.45087 -8.65084  -7.80204  1.000 25.95675 ? 53  ASN A O   1 
ATOM   401  C CB  . ASN A 1 53  ? -28.05511 -6.58443  -9.01006  1.000 26.97905 ? 53  ASN A CB  1 
ATOM   402  C CG  . ASN A 1 53  ? -29.42771 -7.16112  -8.69381  1.000 29.66542 ? 53  ASN A CG  1 
ATOM   403  O OD1 . ASN A 1 53  ? -29.55906 -8.07009  -7.87636  1.000 29.51684 ? 53  ASN A OD1 1 
ATOM   404  N ND2 . ASN A 1 53  ? -30.45846 -6.62654  -9.33689  1.000 30.50267 ? 53  ASN A ND2 1 
ATOM   405  N N   . TYR A 1 54  ? -26.72954 -7.69194  -5.77814  1.000 25.16524 ? 54  TYR A N   1 
ATOM   406  C CA  . TYR A 1 54  ? -26.09148 -8.79290  -5.06766  1.000 24.47706 ? 54  TYR A CA  1 
ATOM   407  C C   . TYR A 1 54  ? -26.82809 -10.10718 -5.28220  1.000 24.89647 ? 54  TYR A C   1 
ATOM   408  O O   . TYR A 1 54  ? -26.19217 -11.15508 -5.43914  1.000 26.51490 ? 54  TYR A O   1 
ATOM   409  C CB  . TYR A 1 54  ? -25.98892 -8.46651  -3.57787  1.000 26.86378 ? 54  TYR A CB  1 
ATOM   410  C CG  . TYR A 1 54  ? -24.87996 -7.48919  -3.27355  1.000 23.87442 ? 54  TYR A CG  1 
ATOM   411  C CD1 . TYR A 1 54  ? -23.56383 -7.91446  -3.19579  1.000 22.08675 ? 54  TYR A CD1 1 
ATOM   412  C CD2 . TYR A 1 54  ? -25.14592 -6.13973  -3.07565  1.000 23.40434 ? 54  TYR A CD2 1 
ATOM   413  C CE1 . TYR A 1 54  ? -22.54070 -7.02599  -2.91855  1.000 24.47751 ? 54  TYR A CE1 1 
ATOM   414  C CE2 . TYR A 1 54  ? -24.12824 -5.24550  -2.79325  1.000 23.65228 ? 54  TYR A CE2 1 
ATOM   415  C CZ  . TYR A 1 54  ? -22.82717 -5.69400  -2.71877  1.000 21.40346 ? 54  TYR A CZ  1 
ATOM   416  O OH  . TYR A 1 54  ? -21.80140 -4.80549  -2.44495  1.000 24.85712 ? 54  TYR A OH  1 
ATOM   417  N N   . GLU A 1 55  ? -28.16306 -10.07513 -5.28946  1.000 23.21840 ? 55  GLU A N   1 
ATOM   418  C CA  . GLU A 1 55  ? -28.91912 -11.29414 -5.55835  1.000 26.67420 ? 55  GLU A CA  1 
ATOM   419  C C   . GLU A 1 55  ? -28.56965 -11.86884 -6.92847  1.000 25.76536 ? 55  GLU A C   1 
ATOM   420  O O   . GLU A 1 55  ? -28.39415 -13.08714 -7.07074  1.000 27.54948 ? 55  GLU A O   1 
ATOM   421  C CB  . GLU A 1 55  ? -30.41836 -11.01638 -5.44940  1.000 29.78685 ? 55  GLU A CB  1 
ATOM   422  C CG  . GLU A 1 55  ? -31.25840 -12.25879 -5.18608  1.000 41.45324 ? 55  GLU A CG  1 
ATOM   423  C CD  . GLU A 1 55  ? -31.10228 -12.78544 -3.76725  1.000 46.59441 ? 55  GLU A CD  1 
ATOM   424  O OE1 . GLU A 1 55  ? -31.52750 -12.08714 -2.81869  1.000 43.30254 ? 55  GLU A OE1 1 
ATOM   425  O OE2 . GLU A 1 55  ? -30.54711 -13.89329 -3.60292  1.000 38.10666 ? 55  GLU A OE2 1 
ATOM   426  N N   . ASP A 1 56  ? -28.44494 -11.00612 -7.94707  1.000 25.15105 ? 56  ASP A N   1 
ATOM   427  C CA  . ASP A 1 56  ? -28.08833 -11.48466 -9.28358  1.000 28.27802 ? 56  ASP A CA  1 
ATOM   428  C C   . ASP A 1 56  ? -26.65325 -11.99072 -9.32654  1.000 28.61221 ? 56  ASP A C   1 
ATOM   429  O O   . ASP A 1 56  ? -26.36970 -13.01753 -9.95276  1.000 24.92434 ? 56  ASP A O   1 
ATOM   430  C CB  . ASP A 1 56  ? -28.28067 -10.37867 -10.32543 1.000 29.01319 ? 56  ASP A CB  1 
ATOM   431  C CG  . ASP A 1 56  ? -29.74166 -10.12553 -10.65688 1.000 36.96909 ? 56  ASP A CG  1 
ATOM   432  O OD1 . ASP A 1 56  ? -30.58004 -11.01383 -10.38973 1.000 37.21591 ? 56  ASP A OD1 1 
ATOM   433  O OD2 . ASP A 1 56  ? -30.04981 -9.03852  -11.19913 1.000 34.86724 ? 56  ASP A OD2 1 
ATOM   434  N N   . LEU A 1 57  ? -25.73168 -11.27503 -8.67910  1.000 29.54627 ? 57  LEU A N   1 
ATOM   435  C CA  . LEU A 1 57  ? -24.34291 -11.72191 -8.64001  1.000 30.98518 ? 57  LEU A CA  1 
ATOM   436  C C   . LEU A 1 57  ? -24.21753 -13.07572 -7.95247  1.000 33.54164 ? 57  LEU A C   1 
ATOM   437  O O   . LEU A 1 57  ? -23.38737 -13.90714 -8.34270  1.000 31.76990 ? 57  LEU A O   1 
ATOM   438  C CB  . LEU A 1 57  ? -23.48030 -10.67433 -7.93610  1.000 27.80536 ? 57  LEU A CB  1 
ATOM   439  C CG  . LEU A 1 57  ? -23.32598 -9.34283  -8.67776  1.000 28.78363 ? 57  LEU A CG  1 
ATOM   440  C CD1 . LEU A 1 57  ? -22.66955 -8.28702  -7.78365  1.000 32.64854 ? 57  LEU A CD1 1 
ATOM   441  C CD2 . LEU A 1 57  ? -22.53039 -9.54013  -9.96001  1.000 30.00333 ? 57  LEU A CD2 1 
ATOM   442  N N   . LEU A 1 58  ? -25.04923 -13.32048 -6.93839  1.000 28.83843 ? 58  LEU A N   1 
ATOM   443  C CA  . LEU A 1 58  ? -24.97427 -14.55391 -6.16348  1.000 30.73717 ? 58  LEU A CA  1 
ATOM   444  C C   . LEU A 1 58  ? -25.44869 -15.77009 -6.95177  1.000 33.47593 ? 58  LEU A C   1 
ATOM   445  O O   . LEU A 1 58  ? -25.05856 -16.89613 -6.62299  1.000 37.27604 ? 58  LEU A O   1 
ATOM   446  C CB  . LEU A 1 58  ? -25.79891 -14.39238 -4.88497  1.000 31.86001 ? 58  LEU A CB  1 
ATOM   447  C CG  . LEU A 1 58  ? -25.42247 -15.18115 -3.63117  1.000 41.57961 ? 58  LEU A CG  1 
ATOM   448  C CD1 . LEU A 1 58  ? -23.91718 -15.21924 -3.42743  1.000 27.51269 ? 58  LEU A CD1 1 
ATOM   449  C CD2 . LEU A 1 58  ? -26.10435 -14.55319 -2.42866  1.000 34.71224 ? 58  LEU A CD2 1 
ATOM   450  N N   . ILE A 1 59  ? -26.26913 -15.56551 -7.98692  1.000 28.77703 ? 59  ILE A N   1 
ATOM   451  C CA  . ILE A 1 59  ? -26.78415 -16.67835 -8.78135  1.000 28.23893 ? 59  ILE A CA  1 
ATOM   452  C C   . ILE A 1 59  ? -25.64147 -17.48633 -9.38461  1.000 36.57212 ? 59  ILE A C   1 
ATOM   453  O O   . ILE A 1 59  ? -25.71613 -18.71663 -9.48477  1.000 39.45836 ? 59  ILE A O   1 
ATOM   454  C CB  . ILE A 1 59  ? -27.74123 -16.14968 -9.86706  1.000 27.56141 ? 59  ILE A CB  1 
ATOM   455  C CG1 . ILE A 1 59  ? -29.02809 -15.62316 -9.23038  1.000 25.81511 ? 59  ILE A CG1 1 
ATOM   456  C CG2 . ILE A 1 59  ? -28.04175 -17.22095 -10.90483 1.000 30.42506 ? 59  ILE A CG2 1 
ATOM   457  C CD1 . ILE A 1 59  ? -29.95314 -14.95052 -10.22145 1.000 32.52628 ? 59  ILE A CD1 1 
ATOM   458  N N   . ARG A 1 60  ? -24.56161 -16.81599 -9.77630  1.000 34.23029 ? 60  ARG A N   1 
ATOM   459  C CA  . ARG A 1 60  ? -23.43377 -17.47229 -10.42235 1.000 42.94684 ? 60  ARG A CA  1 
ATOM   460  C C   . ARG A 1 60  ? -22.38991 -17.99061 -9.43440  1.000 37.58483 ? 60  ARG A C   1 
ATOM   461  O O   . ARG A 1 60  ? -21.30482 -18.40049 -9.86342  1.000 38.15244 ? 60  ARG A O   1 
ATOM   462  C CB  . ARG A 1 60  ? -22.77878 -16.51601 -11.42551 1.000 48.75343 ? 60  ARG A CB  1 
ATOM   463  C CG  . ARG A 1 60  ? -23.62814 -16.23889 -12.66563 1.000 57.30795 ? 60  ARG A CG  1 
ATOM   464  C CD  . ARG A 1 60  ? -24.09918 -14.79315 -12.72558 1.000 61.85268 ? 60  ARG A CD  1 
ATOM   465  N NE  . ARG A 1 60  ? -22.98117 -13.85713 -12.74869 1.000 73.20331 ? 60  ARG A NE  1 
ATOM   466  C CZ  . ARG A 1 60  ? -23.10599 -12.53759 -12.81147 1.000 69.24778 ? 60  ARG A CZ  1 
ATOM   467  N NH1 . ARG A 1 60  ? -24.29493 -11.95505 -12.86930 1.000 56.66855 ? 60  ARG A NH1 1 
ATOM   468  N NH2 . ARG A 1 60  ? -22.01057 -11.78257 -12.81524 1.000 58.21181 ? 60  ARG A NH2 1 
ATOM   469  N N   . LYS A 1 61  ? -22.68925 -17.99025 -8.13475  1.000 33.35238 ? 61  LYS A N   1 
ATOM   470  C CA  . LYS A 1 61  ? -21.76192 -18.45194 -7.10858  1.000 29.08637 ? 61  LYS A CA  1 
ATOM   471  C C   . LYS A 1 61  ? -22.28141 -19.73816 -6.48531  1.000 32.53240 ? 61  LYS A C   1 
ATOM   472  O O   . LYS A 1 61  ? -23.43616 -19.80267 -6.05174  1.000 33.78088 ? 61  LYS A O   1 
ATOM   473  C CB  . LYS A 1 61  ? -21.56301 -17.40091 -6.01324  1.000 27.04020 ? 61  LYS A CB  1 
ATOM   474  C CG  . LYS A 1 61  ? -21.03419 -16.05567 -6.49711  1.000 28.57934 ? 61  LYS A CG  1 
ATOM   475  C CD  . LYS A 1 61  ? -19.67695 -16.17955 -7.16739  1.000 31.82643 ? 61  LYS A CD  1 
ATOM   476  C CE  . LYS A 1 61  ? -19.16179 -14.80659 -7.59124  1.000 36.99311 ? 61  LYS A CE  1 
ATOM   477  N NZ  . LYS A 1 61  ? -17.96714 -14.88849 -8.47851  1.000 40.63228 ? 61  LYS A NZ  1 
ATOM   478  N N   . SER A 1 62  ? -21.42691 -20.75004 -6.43411  1.000 27.22436 ? 62  SER A N   1 
ATOM   479  C CA  . SER A 1 62  ? -21.70755 -21.99062 -5.72949  1.000 26.05091 ? 62  SER A CA  1 
ATOM   480  C C   . SER A 1 62  ? -20.81354 -22.08174 -4.50011  1.000 23.30976 ? 62  SER A C   1 
ATOM   481  O O   . SER A 1 62  ? -19.90112 -21.27366 -4.31006  1.000 25.89857 ? 62  SER A O   1 
ATOM   482  C CB  . SER A 1 62  ? -21.48261 -23.20218 -6.63995  1.000 29.14772 ? 62  SER A CB  1 
ATOM   483  O OG  . SER A 1 62  ? -22.27179 -23.11373 -7.81137  1.000 34.32484 ? 62  SER A OG  1 
ATOM   484  N N   . ASN A 1 63  ? -21.08540 -23.09221 -3.66897  1.000 24.26041 ? 63  ASN A N   1 
ATOM   485  C CA  . ASN A 1 63  ? -20.27214 -23.33140 -2.47611  1.000 27.82375 ? 63  ASN A CA  1 
ATOM   486  C C   . ASN A 1 63  ? -18.77996 -23.32132 -2.79484  1.000 25.38751 ? 63  ASN A C   1 
ATOM   487  O O   . ASN A 1 63  ? -17.98121 -22.71395 -2.07232  1.000 23.74524 ? 63  ASN A O   1 
ATOM   488  C CB  . ASN A 1 63  ? -20.65510 -24.66746 -1.84114  1.000 25.26067 ? 63  ASN A CB  1 
ATOM   489  C CG  . ASN A 1 63  ? -22.04351 -24.65805 -1.24513  1.000 27.41437 ? 63  ASN A CG  1 
ATOM   490  O OD1 . ASN A 1 63  ? -22.55765 -23.61354 -0.84873  1.000 25.73110 ? 63  ASN A OD1 1 
ATOM   491  N ND2 . ASN A 1 63  ? -22.65758 -25.83302 -1.16838  1.000 24.92256 ? 63  ASN A ND2 1 
ATOM   492  N N   . HIS A 1 64  ? -18.38185 -23.99728 -3.87740  1.000 26.37014 ? 64  HIS A N   1 
ATOM   493  C CA  . HIS A 1 64  ? -16.95810 -24.13889 -4.17445  1.000 24.68964 ? 64  HIS A CA  1 
ATOM   494  C C   . HIS A 1 64  ? -16.32304 -22.85666 -4.70683  1.000 28.07800 ? 64  HIS A C   1 
ATOM   495  O O   . HIS A 1 64  ? -15.09461 -22.80377 -4.83296  1.000 27.21129 ? 64  HIS A O   1 
ATOM   496  C CB  . HIS A 1 64  ? -16.73679 -25.29247 -5.16318  1.000 27.65472 ? 64  HIS A CB  1 
ATOM   497  C CG  . HIS A 1 64  ? -17.21421 -25.00399 -6.55280  1.000 27.54584 ? 64  HIS A CG  1 
ATOM   498  N ND1 . HIS A 1 64  ? -18.50667 -25.25012 -6.96271  1.000 28.77656 ? 64  HIS A ND1 1 
ATOM   499  C CD2 . HIS A 1 64  ? -16.56913 -24.49092 -7.62714  1.000 28.27815 ? 64  HIS A CD2 1 
ATOM   500  C CE1 . HIS A 1 64  ? -18.63631 -24.90135 -8.22961  1.000 32.82908 ? 64  HIS A CE1 1 
ATOM   501  N NE2 . HIS A 1 64  ? -17.47610 -24.43522 -8.65548  1.000 27.73827 ? 64  HIS A NE2 1 
ATOM   502  N N   . ASN A 1 65  ? -17.11192 -21.82451 -5.01108  1.000 26.04046 ? 65  ASN A N   1 
ATOM   503  C CA  . ASN A 1 65  ? -16.54080 -20.54550 -5.41527  1.000 29.41867 ? 65  ASN A CA  1 
ATOM   504  C C   . ASN A 1 65  ? -16.04071 -19.72409 -4.23501  1.000 27.60688 ? 65  ASN A C   1 
ATOM   505  O O   . ASN A 1 65  ? -15.31549 -18.74739 -4.44475  1.000 25.79011 ? 65  ASN A O   1 
ATOM   506  C CB  . ASN A 1 65  ? -17.56067 -19.71979 -6.20360  1.000 25.47818 ? 65  ASN A CB  1 
ATOM   507  C CG  . ASN A 1 65  ? -17.92140 -20.35054 -7.52291  1.000 30.07365 ? 65  ASN A CG  1 
ATOM   508  O OD1 . ASN A 1 65  ? -19.09544 -20.58127 -7.80854  1.000 27.90082 ? 65  ASN A OD1 1 
ATOM   509  N ND2 . ASN A 1 65  ? -16.91089 -20.63713 -8.34196  1.000 29.96360 ? 65  ASN A ND2 1 
ATOM   510  N N   . PHE A 1 66  ? -16.40138 -20.09113 -3.00909  1.000 23.68155 ? 66  PHE A N   1 
ATOM   511  C CA  . PHE A 1 66  ? -15.93193 -19.39780 -1.81407  1.000 23.76965 ? 66  PHE A CA  1 
ATOM   512  C C   . PHE A 1 66  ? -14.75912 -20.17641 -1.22935  1.000 28.71807 ? 66  PHE A C   1 
ATOM   513  O O   . PHE A 1 66  ? -14.94161 -21.26156 -0.66940  1.000 29.00999 ? 66  PHE A O   1 
ATOM   514  C CB  . PHE A 1 66  ? -17.06096 -19.24373 -0.79873  1.000 22.98364 ? 66  PHE A CB  1 
ATOM   515  C CG  . PHE A 1 66  ? -18.23008 -18.46091 -1.31994  1.000 25.94910 ? 66  PHE A CG  1 
ATOM   516  C CD1 . PHE A 1 66  ? -18.21998 -17.07802 -1.28186  1.000 24.20848 ? 66  PHE A CD1 1 
ATOM   517  C CD2 . PHE A 1 66  ? -19.33221 -19.10289 -1.85899  1.000 26.01745 ? 66  PHE A CD2 1 
ATOM   518  C CE1 . PHE A 1 66  ? -19.29131 -16.34874 -1.76458  1.000 22.20395 ? 66  PHE A CE1 1 
ATOM   519  C CE2 . PHE A 1 66  ? -20.41035 -18.37183 -2.34381  1.000 29.32050 ? 66  PHE A CE2 1 
ATOM   520  C CZ  . PHE A 1 66  ? -20.38280 -16.99087 -2.29128  1.000 24.65204 ? 66  PHE A CZ  1 
ATOM   521  N N   . LEU A 1 67  ? -13.55894 -19.62142 -1.36613  1.000 21.86116 ? 67  LEU A N   1 
ATOM   522  C CA  . LEU A 1 67  ? -12.33929 -20.24925 -0.87330  1.000 23.17172 ? 67  LEU A CA  1 
ATOM   523  C C   . LEU A 1 67  ? -12.07087 -19.70836 0.52385   1.000 27.89728 ? 67  LEU A C   1 
ATOM   524  O O   . LEU A 1 67  ? -11.73474 -18.52965 0.68776   1.000 23.10890 ? 67  LEU A O   1 
ATOM   525  C CB  . LEU A 1 67  ? -11.16229 -19.97340 -1.80898  1.000 27.59105 ? 67  LEU A CB  1 
ATOM   526  C CG  . LEU A 1 67  ? -11.29209 -20.40088 -3.27619  1.000 36.74672 ? 67  LEU A CG  1 
ATOM   527  C CD1 . LEU A 1 67  ? -12.07823 -21.70135 -3.39761  1.000 43.36035 ? 67  LEU A CD1 1 
ATOM   528  C CD2 . LEU A 1 67  ? -11.89643 -19.31012 -4.16037  1.000 43.33523 ? 67  LEU A CD2 1 
ATOM   529  N N   . VAL A 1 68  ? -12.23009 -20.55939 1.53213   1.000 23.31945 ? 68  VAL A N   1 
ATOM   530  C CA  . VAL A 1 68  ? -12.06499 -20.16038 2.92251   1.000 20.36505 ? 68  VAL A CA  1 
ATOM   531  C C   . VAL A 1 68  ? -10.79416 -20.79891 3.45032   1.000 30.40097 ? 68  VAL A C   1 
ATOM   532  O O   . VAL A 1 68  ? -10.61129 -22.01673 3.33995   1.000 24.90603 ? 68  VAL A O   1 
ATOM   533  C CB  . VAL A 1 68  ? -13.28218 -20.55564 3.77241   1.000 23.61832 ? 68  VAL A CB  1 
ATOM   534  C CG1 . VAL A 1 68  ? -13.11519 -20.02788 5.18505   1.000 23.86497 ? 68  VAL A CG1 1 
ATOM   535  C CG2 . VAL A 1 68  ? -14.56283 -20.02520 3.12900   1.000 19.70205 ? 68  VAL A CG2 1 
ATOM   536  N N   . GLN A 1 69  ? -9.92299  -19.97959 4.02868   1.000 28.06833 ? 69  GLN A N   1 
ATOM   537  C CA  . GLN A 1 69  ? -8.60111  -20.41643 4.45238   1.000 33.41578 ? 69  GLN A CA  1 
ATOM   538  C C   . GLN A 1 69  ? -8.38486  -20.01036 5.90317   1.000 34.06895 ? 69  GLN A C   1 
ATOM   539  O O   . GLN A 1 69  ? -8.46378  -18.82362 6.23583   1.000 26.11677 ? 69  GLN A O   1 
ATOM   540  C CB  . GLN A 1 69  ? -7.53609  -19.80810 3.54014   1.000 33.39397 ? 69  GLN A CB  1 
ATOM   541  C CG  . GLN A 1 69  ? -6.16844  -20.41456 3.65414   1.000 45.35987 ? 69  GLN A CG  1 
ATOM   542  C CD  . GLN A 1 69  ? -5.27680  -20.00573 2.50212   1.000 55.07290 ? 69  GLN A CD  1 
ATOM   543  O OE1 . GLN A 1 69  ? -5.74756  -19.81339 1.37934   1.000 50.78895 ? 69  GLN A OE1 1 
ATOM   544  N NE2 . GLN A 1 69  ? -3.98320  -19.86136 2.77368   1.000 59.26485 ? 69  GLN A NE2 1 
ATOM   545  N N   . ALA A 1 70  ? -8.12947  -20.99629 6.76460   1.000 29.13089 ? 70  ALA A N   1 
ATOM   546  C CA  . ALA A 1 70  ? -7.79915  -20.77814 8.17070   1.000 35.90623 ? 70  ALA A CA  1 
ATOM   547  C C   . ALA A 1 70  ? -6.34459  -21.20022 8.33890   1.000 38.89375 ? 70  ALA A C   1 
ATOM   548  O O   . ALA A 1 70  ? -6.03902  -22.39451 8.39270   1.000 36.44446 ? 70  ALA A O   1 
ATOM   549  C CB  . ALA A 1 70  ? -8.72865  -21.56582 9.08966   1.000 36.57707 ? 70  ALA A CB  1 
ATOM   550  N N   . GLY A 1 71  ? -5.45001  -20.22155 8.40794   1.000 43.44489 ? 71  GLY A N   1 
ATOM   551  C CA  . GLY A 1 71  ? -4.03606  -20.54953 8.34829   1.000 44.14084 ? 71  GLY A CA  1 
ATOM   552  C C   . GLY A 1 71  ? -3.70765  -21.11723 6.98317   1.000 46.46413 ? 71  GLY A C   1 
ATOM   553  O O   . GLY A 1 71  ? -4.04049  -20.53404 5.94713   1.000 51.38983 ? 71  GLY A O   1 
ATOM   554  N N   . ASN A 1 72  ? -3.06063  -22.28118 6.96741   1.000 54.83091 ? 72  ASN A N   1 
ATOM   555  C CA  . ASN A 1 72  ? -2.73726  -22.97437 5.72835   1.000 59.79247 ? 72  ASN A CA  1 
ATOM   556  C C   . ASN A 1 72  ? -3.70247  -24.11526 5.42843   1.000 59.25263 ? 72  ASN A C   1 
ATOM   557  O O   . ASN A 1 72  ? -3.36892  -25.01206 4.64639   1.000 64.63005 ? 72  ASN A O   1 
ATOM   558  C CB  . ASN A 1 72  ? -1.30115  -23.49616 5.77439   1.000 78.51808 ? 72  ASN A CB  1 
ATOM   559  C CG  . ASN A 1 72  ? -0.28218  -22.41246 5.49791   1.000 90.35093 ? 72  ASN A CG  1 
ATOM   560  O OD1 . ASN A 1 72  ? 0.17279   -21.72239 6.41064   1.000 96.33076 ? 72  ASN A OD1 1 
ATOM   561  N ND2 . ASN A 1 72  ? 0.08127   -22.25438 4.22970   1.000 91.32372 ? 72  ASN A ND2 1 
ATOM   562  N N   . VAL A 1 73  ? -4.88762  -24.10011 6.03247   1.000 48.06266 ? 73  VAL A N   1 
ATOM   563  C CA  . VAL A 1 73  ? -5.89172  -25.14018 5.84729   1.000 40.20537 ? 73  VAL A CA  1 
ATOM   564  C C   . VAL A 1 73  ? -7.08215  -24.53086 5.12408   1.000 41.39605 ? 73  VAL A C   1 
ATOM   565  O O   . VAL A 1 73  ? -7.53270  -23.43463 5.47626   1.000 39.72197 ? 73  VAL A O   1 
ATOM   566  C CB  . VAL A 1 73  ? -6.31992  -25.75528 7.19213   1.000 39.26373 ? 73  VAL A CB  1 
ATOM   567  C CG1 . VAL A 1 73  ? -7.63153  -26.49787 7.05014   1.000 42.15106 ? 73  VAL A CG1 1 
ATOM   568  C CG2 . VAL A 1 73  ? -5.25735  -26.69887 7.69485   1.000 46.59885 ? 73  VAL A CG2 1 
ATOM   569  N N   . GLN A 1 74  ? -7.58291  -25.23223 4.10931   1.000 35.99380 ? 74  GLN A N   1 
ATOM   570  C CA  . GLN A 1 74  ? -8.81911  -24.84563 3.44671   1.000 41.14518 ? 74  GLN A CA  1 
ATOM   571  C C   . GLN A 1 74  ? -9.99801  -25.50029 4.14799   1.000 38.50864 ? 74  GLN A C   1 
ATOM   572  O O   . GLN A 1 74  ? -10.00901 -26.71711 4.35821   1.000 47.47259 ? 74  GLN A O   1 
ATOM   573  C CB  . GLN A 1 74  ? -8.80456  -25.24527 1.97423   1.000 38.44651 ? 74  GLN A CB  1 
ATOM   574  C CG  . GLN A 1 74  ? -7.78453  -24.49945 1.17048   1.000 50.47313 ? 74  GLN A CG  1 
ATOM   575  C CD  . GLN A 1 74  ? -8.18615  -23.05996 0.88147   1.000 56.57889 ? 74  GLN A CD  1 
ATOM   576  O OE1 . GLN A 1 74  ? -7.48630  -22.12292 1.26690   1.000 60.95455 ? 74  GLN A OE1 1 
ATOM   577  N NE2 . GLN A 1 74  ? -9.30659  -22.87905 0.18322   1.000 40.93988 ? 74  GLN A NE2 1 
ATOM   578  N N   . LEU A 1 75  ? -10.97624 -24.68920 4.52058   1.000 27.36254 ? 75  LEU A N   1 
ATOM   579  C CA  . LEU A 1 75  ? -12.24010 -25.21335 5.00251   1.000 26.82202 ? 75  LEU A CA  1 
ATOM   580  C C   . LEU A 1 75  ? -13.12016 -25.57471 3.81768   1.000 32.88666 ? 75  LEU A C   1 
ATOM   581  O O   . LEU A 1 75  ? -13.01047 -24.99281 2.73547   1.000 38.27908 ? 75  LEU A O   1 
ATOM   582  C CB  . LEU A 1 75  ? -12.94476 -24.18996 5.89264   1.000 25.83344 ? 75  LEU A CB  1 
ATOM   583  C CG  . LEU A 1 75  ? -12.13849 -23.70826 7.09693   1.000 32.70636 ? 75  LEU A CG  1 
ATOM   584  C CD1 . LEU A 1 75  ? -12.96678 -22.75434 7.94899   1.000 25.09858 ? 75  LEU A CD1 1 
ATOM   585  C CD2 . LEU A 1 75  ? -11.64419 -24.90093 7.91719   1.000 28.55939 ? 75  LEU A CD2 1 
ATOM   586  N N   . ARG A 1 76  ? -13.98627 -26.55760 4.02324   1.000 28.74811 ? 76  ARG A N   1 
ATOM   587  C CA  . ARG A 1 76  ? -14.88098 -27.03915 2.98203   1.000 28.91005 ? 76  ARG A CA  1 
ATOM   588  C C   . ARG A 1 76  ? -16.23412 -26.35675 3.14793   1.000 25.07712 ? 76  ARG A C   1 
ATOM   589  O O   . ARG A 1 76  ? -16.88908 -26.51725 4.18152   1.000 27.81638 ? 76  ARG A O   1 
ATOM   590  C CB  . ARG A 1 76  ? -15.01718 -28.56064 3.05839   1.000 24.45935 ? 76  ARG A CB  1 
ATOM   591  C CG  . ARG A 1 76  ? -15.84232 -29.18096 1.94483   1.000 28.39252 ? 76  ARG A CG  1 
ATOM   592  C CD  . ARG A 1 76  ? -15.76285 -30.69913 1.99693   1.000 35.04366 ? 76  ARG A CD  1 
ATOM   593  N NE  . ARG A 1 76  ? -14.38071 -31.15444 1.92116   1.000 37.38629 ? 76  ARG A NE  1 
ATOM   594  C CZ  . ARG A 1 76  ? -13.70052 -31.28926 0.79144   1.000 37.97603 ? 76  ARG A CZ  1 
ATOM   595  N NH1 . ARG A 1 76  ? -14.26021 -31.05166 -0.38402  1.000 32.17909 ? 76  ARG A NH1 1 
ATOM   596  N NH2 . ARG A 1 76  ? -12.42578 -31.66608 0.84276   1.000 39.24256 ? 76  ARG A NH2 1 
ATOM   597  N N   . VAL A 1 77  ? -16.64612 -25.59682 2.13948   1.000 24.04198 ? 77  VAL A N   1 
ATOM   598  C CA  . VAL A 1 77  ? -17.92011 -24.88546 2.17641   1.000 26.57669 ? 77  VAL A CA  1 
ATOM   599  C C   . VAL A 1 77  ? -19.01508 -25.83504 1.70770   1.000 26.34442 ? 77  VAL A C   1 
ATOM   600  O O   . VAL A 1 77  ? -18.98609 -26.31453 0.56776   1.000 25.46014 ? 77  VAL A O   1 
ATOM   601  C CB  . VAL A 1 77  ? -17.87035 -23.61878 1.31193   1.000 22.60551 ? 77  VAL A CB  1 
ATOM   602  C CG1 . VAL A 1 77  ? -19.22864 -22.93875 1.27763   1.000 22.34453 ? 77  VAL A CG1 1 
ATOM   603  C CG2 . VAL A 1 77  ? -16.80618 -22.67526 1.84551   1.000 23.37502 ? 77  VAL A CG2 1 
ATOM   604  N N   . ILE A 1 78  ? -19.97360 -26.11862 2.59180   1.000 26.75480 ? 78  ILE A N   1 
ATOM   605  C CA  . ILE A 1 78  ? -21.07059 -27.03667 2.29985   1.000 27.12112 ? 78  ILE A CA  1 
ATOM   606  C C   . ILE A 1 78  ? -22.40661 -26.32672 2.18577   1.000 28.89722 ? 78  ILE A C   1 
ATOM   607  O O   . ILE A 1 78  ? -23.43657 -26.99060 1.98383   1.000 27.51230 ? 78  ILE A O   1 
ATOM   608  C CB  . ILE A 1 78  ? -21.14977 -28.16111 3.34933   1.000 25.69161 ? 78  ILE A CB  1 
ATOM   609  C CG1 . ILE A 1 78  ? -21.39749 -27.58049 4.74010   1.000 26.35612 ? 78  ILE A CG1 1 
ATOM   610  C CG2 . ILE A 1 78  ? -19.86948 -28.97269 3.34581   1.000 27.53898 ? 78  ILE A CG2 1 
ATOM   611  C CD1 . ILE A 1 78  ? -21.70818 -28.63205 5.78689   1.000 27.94466 ? 78  ILE A CD1 1 
ATOM   612  N N   . GLY A 1 79  ? -22.42645 -25.00416 2.31175   1.000 24.08309 ? 79  GLY A N   1 
ATOM   613  C CA  . GLY A 1 79  ? -23.63648 -24.22706 2.12305   1.000 23.92550 ? 79  GLY A CA  1 
ATOM   614  C C   . GLY A 1 79  ? -23.31696 -22.75191 2.19386   1.000 25.25473 ? 79  GLY A C   1 
ATOM   615  O O   . GLY A 1 79  ? -22.29441 -22.34618 2.75150   1.000 22.34431 ? 79  GLY A O   1 
ATOM   616  N N   . HIS A 1 80  ? -24.19904 -21.94736 1.60958   1.000 22.78849 ? 80  HIS A N   1 
ATOM   617  C CA  . HIS A 1 80  ? -24.03341 -20.50830 1.75148   1.000 25.27034 ? 80  HIS A CA  1 
ATOM   618  C C   . HIS A 1 80  ? -25.38261 -19.81930 1.63929   1.000 24.55491 ? 80  HIS A C   1 
ATOM   619  O O   . HIS A 1 80  ? -26.30587 -20.31792 0.98804   1.000 25.73987 ? 80  HIS A O   1 
ATOM   620  C CB  . HIS A 1 80  ? -23.04989 -19.93878 0.71905   1.000 25.49712 ? 80  HIS A CB  1 
ATOM   621  C CG  . HIS A 1 80  ? -23.53535 -20.00423 -0.69547  1.000 29.50405 ? 80  HIS A CG  1 
ATOM   622  N ND1 . HIS A 1 80  ? -23.40669 -21.13347 -1.47457  1.000 26.28576 ? 80  HIS A ND1 1 
ATOM   623  C CD2 . HIS A 1 80  ? -24.12755 -19.07170 -1.48084  1.000 28.62156 ? 80  HIS A CD2 1 
ATOM   624  C CE1 . HIS A 1 80  ? -23.90634 -20.89828 -2.67563  1.000 28.36090 ? 80  HIS A CE1 1 
ATOM   625  N NE2 . HIS A 1 80  ? -24.34540 -19.65312 -2.70733  1.000 28.02297 ? 80  HIS A NE2 1 
ATOM   626  N N   . SER A 1 81  ? -25.47977 -18.66117 2.28359   1.000 21.54209 ? 81  SER A N   1 
ATOM   627  C CA  . SER A 1 81  ? -26.68059 -17.85092 2.21558   1.000 22.38544 ? 81  SER A CA  1 
ATOM   628  C C   . SER A 1 81  ? -26.29426 -16.39803 2.43574   1.000 25.04778 ? 81  SER A C   1 
ATOM   629  O O   . SER A 1 81  ? -25.25464 -16.08784 3.02742   1.000 25.50415 ? 81  SER A O   1 
ATOM   630  C CB  . SER A 1 81  ? -27.71785 -18.29239 3.25008   1.000 26.90623 ? 81  SER A CB  1 
ATOM   631  O OG  . SER A 1 81  ? -27.19256 -18.19858 4.56159   1.000 27.19517 ? 81  SER A OG  1 
ATOM   632  N N   . MET A 1 82  ? -27.14384 -15.50798 1.95315   1.000 23.04156 ? 82  MET A N   1 
ATOM   633  C CA  . MET A 1 82  ? -26.97085 -14.08180 2.17000   1.000 21.56591 ? 82  MET A CA  1 
ATOM   634  C C   . MET A 1 82  ? -28.02583 -13.60615 3.15477   1.000 22.20178 ? 82  MET A C   1 
ATOM   635  O O   . MET A 1 82  ? -29.22094 -13.84564 2.95197   1.000 26.07122 ? 82  MET A O   1 
ATOM   636  C CB  . MET A 1 82  ? -27.07616 -13.31588 0.85287   1.000 25.30459 ? 82  MET A CB  1 
ATOM   637  C CG  . MET A 1 82  ? -27.06823 -11.81916 1.02392   1.000 22.07485 ? 82  MET A CG  1 
ATOM   638  S SD  . MET A 1 82  ? -26.86906 -10.97551 -0.55196  1.000 27.23857 ? 82  MET A SD  1 
ATOM   639  C CE  . MET A 1 82  ? -28.38739 -11.42044 -1.39799  1.000 31.39983 ? 82  MET A CE  1 
ATOM   640  N N   . GLN A 1 83  ? -27.58402 -12.96450 4.23238   1.000 20.26289 ? 83  GLN A N   1 
ATOM   641  C CA  . GLN A 1 83  ? -28.48616 -12.33763 5.19221   1.000 21.48356 ? 83  GLN A CA  1 
ATOM   642  C C   . GLN A 1 83  ? -28.15570 -10.85363 5.22916   1.000 23.31048 ? 83  GLN A C   1 
ATOM   643  O O   . GLN A 1 83  ? -27.09846 -10.46518 5.73480   1.000 21.23400 ? 83  GLN A O   1 
ATOM   644  C CB  . GLN A 1 83  ? -28.35924 -12.95666 6.58084   1.000 24.61788 ? 83  GLN A CB  1 
ATOM   645  C CG  . GLN A 1 83  ? -29.33688 -12.35026 7.57993   1.000 24.75847 ? 83  GLN A CG  1 
ATOM   646  C CD  . GLN A 1 83  ? -29.19427 -12.93038 8.97234   1.000 30.25942 ? 83  GLN A CD  1 
ATOM   647  O OE1 . GLN A 1 83  ? -28.16398 -13.51153 9.31716   1.000 33.72885 ? 83  GLN A OE1 1 
ATOM   648  N NE2 . GLN A 1 83  ? -30.23037 -12.76829 9.78476   1.000 33.04084 ? 83  GLN A NE2 1 
ATOM   649  N N   . ASN A 1 84  ? -29.05412 -10.03097 4.69019   1.000 22.50781 ? 84  ASN A N   1 
ATOM   650  C CA  . ASN A 1 84  ? -28.79356 -8.60114  4.57796   1.000 21.80629 ? 84  ASN A CA  1 
ATOM   651  C C   . ASN A 1 84  ? -27.46328 -8.39828  3.85646   1.000 21.63779 ? 84  ASN A C   1 
ATOM   652  O O   . ASN A 1 84  ? -27.30371 -8.87273  2.72722   1.000 19.61143 ? 84  ASN A O   1 
ATOM   653  C CB  . ASN A 1 84  ? -28.83722 -7.95431  5.96395   1.000 21.23040 ? 84  ASN A CB  1 
ATOM   654  C CG  . ASN A 1 84  ? -30.16262 -8.20248  6.66328   1.000 23.97491 ? 84  ASN A CG  1 
ATOM   655  O OD1 . ASN A 1 84  ? -31.22602 -7.92434  6.10537   1.000 26.87851 ? 84  ASN A OD1 1 
ATOM   656  N ND2 . ASN A 1 84  ? -30.11184 -8.77323  7.86013   1.000 24.81841 ? 84  ASN A ND2 1 
ATOM   657  N N   . CYS A 1 85  ? -26.48631 -7.74769  4.48514   1.000 22.32463 ? 85  CYS A N   1 
ATOM   658  C CA  . CYS A 1 85  ? -25.23825 -7.44843  3.79731   1.000 18.72106 ? 85  CYS A CA  1 
ATOM   659  C C   . CYS A 1 85  ? -24.09687 -8.39224  4.15648   1.000 21.01031 ? 85  CYS A C   1 
ATOM   660  O O   . CYS A 1 85  ? -22.94935 -8.09584  3.81869   1.000 19.42744 ? 85  CYS A O   1 
ATOM   661  C CB  . CYS A 1 85  ? -24.81142 -6.00750  4.06781   1.000 19.84671 ? 85  CYS A CB  1 
ATOM   662  S SG  . CYS A 1 85  ? -25.98303 -4.82641  3.40000   1.000 22.93760 ? 85  CYS A SG  1 
ATOM   663  N N   . VAL A 1 86  ? -24.36668 -9.51769  4.81429   1.000 18.99726 ? 86  VAL A N   1 
ATOM   664  C CA  . VAL A 1 86  ? -23.30265 -10.47970 5.07559   1.000 19.03061 ? 86  VAL A CA  1 
ATOM   665  C C   . VAL A 1 86  ? -23.64121 -11.80255 4.41143   1.000 22.00403 ? 86  VAL A C   1 
ATOM   666  O O   . VAL A 1 86  ? -24.80184 -12.12365 4.14829   1.000 24.30081 ? 86  VAL A O   1 
ATOM   667  C CB  . VAL A 1 86  ? -23.01615 -10.69013 6.58037   1.000 21.32956 ? 86  VAL A CB  1 
ATOM   668  C CG1 . VAL A 1 86  ? -22.53213 -9.39068  7.21323   1.000 24.53694 ? 86  VAL A CG1 1 
ATOM   669  C CG2 . VAL A 1 86  ? -24.23272 -11.25696 7.31280   1.000 23.77751 ? 86  VAL A CG2 1 
ATOM   670  N N   . LEU A 1 87  ? -22.59514 -12.56061 4.11240   1.000 20.94309 ? 87  LEU A N   1 
ATOM   671  C CA  . LEU A 1 87  ? -22.73786 -13.94620 3.70118   1.000 20.92843 ? 87  LEU A CA  1 
ATOM   672  C C   . LEU A 1 87  ? -22.45671 -14.84205 4.89518   1.000 21.39664 ? 87  LEU A C   1 
ATOM   673  O O   . LEU A 1 87  ? -21.59169 -14.54142 5.72325   1.000 21.15611 ? 87  LEU A O   1 
ATOM   674  C CB  . LEU A 1 87  ? -21.78587 -14.29830 2.55774   1.000 20.84435 ? 87  LEU A CB  1 
ATOM   675  C CG  . LEU A 1 87  ? -21.96141 -13.51633 1.26254   1.000 25.09399 ? 87  LEU A CG  1 
ATOM   676  C CD1 . LEU A 1 87  ? -20.91884 -13.95176 0.24779   1.000 27.30648 ? 87  LEU A CD1 1 
ATOM   677  C CD2 . LEU A 1 87  ? -23.35682 -13.73101 0.73395   1.000 25.44290 ? 87  LEU A CD2 1 
ATOM   678  N N   . LYS A 1 88  ? -23.19755 -15.93289 4.98502   1.000 22.95871 ? 88  LYS A N   1 
ATOM   679  C CA  . LYS A 1 88  ? -22.95713 -16.96472 5.98350   1.000 20.48781 ? 88  LYS A CA  1 
ATOM   680  C C   . LYS A 1 88  ? -22.54339 -18.21603 5.22435   1.000 23.76623 ? 88  LYS A C   1 
ATOM   681  O O   . LYS A 1 88  ? -23.33442 -18.77880 4.46032   1.000 24.78997 ? 88  LYS A O   1 
ATOM   682  C CB  . LYS A 1 88  ? -24.19508 -17.18679 6.84991   1.000 23.75418 ? 88  LYS A CB  1 
ATOM   683  C CG  . LYS A 1 88  ? -24.65076 -15.89854 7.53707   1.000 24.71167 ? 88  LYS A CG  1 
ATOM   684  C CD  . LYS A 1 88  ? -25.63823 -16.14019 8.67202   1.000 34.48182 ? 88  LYS A CD  1 
ATOM   685  C CE  . LYS A 1 88  ? -26.85510 -16.87714 8.19563   1.000 35.25491 ? 88  LYS A CE  1 
ATOM   686  N NZ  . LYS A 1 88  ? -28.04870 -16.61315 9.04358   1.000 34.89708 ? 88  LYS A NZ  1 
ATOM   687  N N   . LEU A 1 89  ? -21.29305 -18.61952 5.39974   1.000 20.92074 ? 89  LEU A N   1 
ATOM   688  C CA  . LEU A 1 89  ? -20.72035 -19.74389 4.67325   1.000 21.41479 ? 89  LEU A CA  1 
ATOM   689  C C   . LEU A 1 89  ? -20.65591 -20.91798 5.63799   1.000 22.70251 ? 89  LEU A C   1 
ATOM   690  O O   . LEU A 1 89  ? -19.82877 -20.92783 6.55352   1.000 24.77816 ? 89  LEU A O   1 
ATOM   691  C CB  . LEU A 1 89  ? -19.33806 -19.39821 4.12218   1.000 23.15812 ? 89  LEU A CB  1 
ATOM   692  C CG  . LEU A 1 89  ? -19.23687 -18.12108 3.28500   1.000 23.97574 ? 89  LEU A CG  1 
ATOM   693  C CD1 . LEU A 1 89  ? -17.80221 -17.89567 2.80106   1.000 22.39699 ? 89  LEU A CD1 1 
ATOM   694  C CD2 . LEU A 1 89  ? -20.20021 -18.16469 2.09740   1.000 21.64009 ? 89  LEU A CD2 1 
ATOM   695  N N   . LYS A 1 90  ? -21.54579 -21.88581 5.44777   1.000 21.28057 ? 90  LYS A N   1 
ATOM   696  C CA  . LYS A 1 90  ? -21.53323 -23.09422 6.25984   1.000 22.54286 ? 90  LYS A CA  1 
ATOM   697  C C   . LYS A 1 90  ? -20.34824 -23.96324 5.86310   1.000 22.90296 ? 90  LYS A C   1 
ATOM   698  O O   . LYS A 1 90  ? -20.19449 -24.31624 4.68906   1.000 21.88318 ? 90  LYS A O   1 
ATOM   699  C CB  . LYS A 1 90  ? -22.83973 -23.85822 6.08210   1.000 22.05259 ? 90  LYS A CB  1 
ATOM   700  C CG  . LYS A 1 90  ? -22.93718 -25.12720 6.90471   1.000 26.54500 ? 90  LYS A CG  1 
ATOM   701  C CD  . LYS A 1 90  ? -23.48322 -24.85643 8.29133   1.000 37.76815 ? 90  LYS A CD  1 
ATOM   702  C CE  . LYS A 1 90  ? -24.69495 -25.73189 8.55401   1.000 45.70835 ? 90  LYS A CE  1 
ATOM   703  N NZ  . LYS A 1 90  ? -24.51305 -27.08536 7.95156   1.000 51.06234 ? 90  LYS A NZ  1 
ATOM   704  N N   . VAL A 1 91  ? -19.51223 -24.30792 6.83949   1.000 22.98850 ? 91  VAL A N   1 
ATOM   705  C CA  . VAL A 1 91  ? -18.35702 -25.16083 6.60787   1.000 23.14340 ? 91  VAL A CA  1 
ATOM   706  C C   . VAL A 1 91  ? -18.56450 -26.47321 7.35460   1.000 24.32052 ? 91  VAL A C   1 
ATOM   707  O O   . VAL A 1 91  ? -19.40746 -26.58917 8.24986   1.000 26.74765 ? 91  VAL A O   1 
ATOM   708  C CB  . VAL A 1 91  ? -17.03608 -24.47830 7.02338   1.000 24.70638 ? 91  VAL A CB  1 
ATOM   709  C CG1 . VAL A 1 91  ? -16.75421 -23.26389 6.11496   1.000 24.28219 ? 91  VAL A CG1 1 
ATOM   710  C CG2 . VAL A 1 91  ? -17.08938 -24.05314 8.47170   1.000 24.49968 ? 91  VAL A CG2 1 
ATOM   711  N N   . ASP A 1 92  ? -17.79549 -27.48344 6.96929   1.000 28.06127 ? 92  ASP A N   1 
ATOM   712  C CA  . ASP A 1 92  ? -18.00873 -28.81390 7.52569   1.000 29.21255 ? 92  ASP A CA  1 
ATOM   713  C C   . ASP A 1 92  ? -17.20254 -29.06204 8.79826   1.000 28.03062 ? 92  ASP A C   1 
ATOM   714  O O   . ASP A 1 92  ? -17.21390 -30.18452 9.31498   1.000 41.48188 ? 92  ASP A O   1 
ATOM   715  C CB  . ASP A 1 92  ? -17.70991 -29.88706 6.46808   1.000 32.71917 ? 92  ASP A CB  1 
ATOM   716  C CG  . ASP A 1 92  ? -16.22824 -30.17243 6.30098   1.000 35.72979 ? 92  ASP A CG  1 
ATOM   717  O OD1 . ASP A 1 92  ? -15.38681 -29.32940 6.67491   1.000 39.64986 ? 92  ASP A OD1 1 
ATOM   718  O OD2 . ASP A 1 92  ? -15.90584 -31.25844 5.76945   1.000 43.97322 ? 92  ASP A OD2 1 
ATOM   719  N N   . THR A 1 93  ? -16.51550 -28.04381 9.31486   1.000 26.19083 ? 93  THR A N   1 
ATOM   720  C CA  . THR A 1 93  ? -15.72089 -28.15680 10.53170  1.000 30.38249 ? 93  THR A CA  1 
ATOM   721  C C   . THR A 1 93  ? -16.10625 -27.02829 11.47438  1.000 28.21208 ? 93  THR A C   1 
ATOM   722  O O   . THR A 1 93  ? -16.06230 -25.85638 11.08926  1.000 28.65711 ? 93  THR A O   1 
ATOM   723  C CB  . THR A 1 93  ? -14.21670 -28.08707 10.23042  1.000 29.50163 ? 93  THR A CB  1 
ATOM   724  O OG1 . THR A 1 93  ? -13.86622 -29.10489 9.28926   1.000 33.51088 ? 93  THR A OG1 1 
ATOM   725  C CG2 . THR A 1 93  ? -13.39185 -28.27145 11.50982  1.000 28.56021 ? 93  THR A CG2 1 
ATOM   726  N N   . ALA A 1 94  ? -16.47971 -27.37695 12.70295  1.000 24.48614 ? 94  ALA A N   1 
ATOM   727  C CA  . ALA A 1 94  ? -16.70192 -26.35714 13.71907  1.000 28.16413 ? 94  ALA A CA  1 
ATOM   728  C C   . ALA A 1 94  ? -15.36359 -25.78366 14.16437  1.000 23.61461 ? 94  ALA A C   1 
ATOM   729  O O   . ALA A 1 94  ? -14.39542 -26.51947 14.35481  1.000 24.23658 ? 94  ALA A O   1 
ATOM   730  C CB  . ALA A 1 94  ? -17.45160 -26.94558 14.91503  1.000 28.98891 ? 94  ALA A CB  1 
ATOM   731  N N   . ASN A 1 95  ? -15.29880 -24.45802 14.29991  1.000 24.58918 ? 95  ASN A N   1 
ATOM   732  C CA  . ASN A 1 95  ? -14.06578 -23.83850 14.76950  1.000 26.65252 ? 95  ASN A CA  1 
ATOM   733  C C   . ASN A 1 95  ? -13.77875 -24.31460 16.18924  1.000 25.26267 ? 95  ASN A C   1 
ATOM   734  O O   . ASN A 1 95  ? -14.53554 -23.99989 17.11537  1.000 23.54382 ? 95  ASN A O   1 
ATOM   735  C CB  . ASN A 1 95  ? -14.16659 -22.30878 14.70557  1.000 21.11695 ? 95  ASN A CB  1 
ATOM   736  C CG  . ASN A 1 95  ? -12.87919 -21.61428 15.12786  1.000 23.78660 ? 95  ASN A CG  1 
ATOM   737  O OD1 . ASN A 1 95  ? -11.89639 -22.25791 15.49819  1.000 24.68921 ? 95  ASN A OD1 1 
ATOM   738  N ND2 . ASN A 1 95  ? -12.87729 -20.29104 15.05616  1.000 23.60177 ? 95  ASN A ND2 1 
ATOM   739  N N   . PRO A 1 96  ? -12.70534 -25.08212 16.40046  1.000 26.97475 ? 96  PRO A N   1 
ATOM   740  C CA  . PRO A 1 96  ? -12.41506 -25.57128 17.75917  1.000 29.46614 ? 96  PRO A CA  1 
ATOM   741  C C   . PRO A 1 96  ? -12.05635 -24.46730 18.73230  1.000 30.93523 ? 96  PRO A C   1 
ATOM   742  O O   . PRO A 1 96  ? -12.07603 -24.70447 19.94670  1.000 30.08355 ? 96  PRO A O   1 
ATOM   743  C CB  . PRO A 1 96  ? -11.23614 -26.53157 17.54504  1.000 28.28881 ? 96  PRO A CB  1 
ATOM   744  C CG  . PRO A 1 96  ? -10.57057 -26.03824 16.30239  1.000 29.03175 ? 96  PRO A CG  1 
ATOM   745  C CD  . PRO A 1 96  ? -11.68401 -25.50829 15.42476  1.000 25.67593 ? 96  PRO A CD  1 
ATOM   746  N N   . LYS A 1 97  ? -11.72397 -23.27211 18.23970  1.000 26.87469 ? 97  LYS A N   1 
ATOM   747  C CA  . LYS A 1 97  ? -11.40399 -22.12616 19.07804  1.000 26.09303 ? 97  LYS A CA  1 
ATOM   748  C C   . LYS A 1 97  ? -12.59215 -21.19468 19.28138  1.000 31.22316 ? 97  LYS A C   1 
ATOM   749  O O   . LYS A 1 97  ? -12.40390 -20.07497 19.76401  1.000 28.47588 ? 97  LYS A O   1 
ATOM   750  C CB  . LYS A 1 97  ? -10.24837 -21.32522 18.47485  1.000 31.15022 ? 97  LYS A CB  1 
ATOM   751  C CG  . LYS A 1 97  ? -8.96410  -22.08235 18.22597  1.000 27.28056 ? 97  LYS A CG  1 
ATOM   752  C CD  . LYS A 1 97  ? -8.00251  -21.17598 17.46029  1.000 36.29094 ? 97  LYS A CD  1 
ATOM   753  C CE  . LYS A 1 97  ? -6.66500  -21.84145 17.18579  1.000 43.77144 ? 97  LYS A CE  1 
ATOM   754  N NZ  . LYS A 1 97  ? -5.74303  -21.73658 18.34904  1.000 55.65382 ? 97  LYS A NZ  1 
ATOM   755  N N   . THR A 1 98  ? -13.79809 -21.60659 18.89761  1.000 26.88621 ? 98  THR A N   1 
ATOM   756  C CA  . THR A 1 98  ? -14.95982 -20.74159 19.07283  1.000 25.00529 ? 98  THR A CA  1 
ATOM   757  C C   . THR A 1 98  ? -15.12439 -20.37254 20.54297  1.000 27.01093 ? 98  THR A C   1 
ATOM   758  O O   . THR A 1 98  ? -15.22222 -21.27155 21.39310  1.000 29.28920 ? 98  THR A O   1 
ATOM   759  C CB  . THR A 1 98  ? -16.23638 -21.41650 18.57658  1.000 25.92502 ? 98  THR A CB  1 
ATOM   760  O OG1 . THR A 1 98  ? -16.08676 -21.79521 17.20279  1.000 25.00268 ? 98  THR A OG1 1 
ATOM   761  C CG2 . THR A 1 98  ? -17.42506 -20.46757 18.72008  1.000 28.40194 ? 98  THR A CG2 1 
ATOM   762  N N   . PRO A 1 99  ? -15.14375 -19.09205 20.88912  1.000 24.54479 ? 99  PRO A N   1 
ATOM   763  C CA  . PRO A 1 99  ? -15.42378 -18.70077 22.26988  1.000 28.25336 ? 99  PRO A CA  1 
ATOM   764  C C   . PRO A 1 99  ? -16.92274 -18.68885 22.53108  1.000 27.85413 ? 99  PRO A C   1 
ATOM   765  O O   . PRO A 1 99  ? -17.74491 -18.78035 21.61790  1.000 25.42232 ? 99  PRO A O   1 
ATOM   766  C CB  . PRO A 1 99  ? -14.84339 -17.28548 22.34942  1.000 30.24992 ? 99  PRO A CB  1 
ATOM   767  C CG  . PRO A 1 99  ? -15.06652 -16.74545 20.96113  1.000 27.06538 ? 99  PRO A CG  1 
ATOM   768  C CD  . PRO A 1 99  ? -14.81834 -17.93070 20.04148  1.000 24.28889 ? 99  PRO A CD  1 
ATOM   769  N N   . LYS A 1 100 ? -17.27047 -18.56252 23.80881  1.000 26.34474 ? 100 LYS A N   1 
ATOM   770  C CA  . LYS A 1 100 ? -18.63586 -18.19005 24.14875  1.000 31.05066 ? 100 LYS A CA  1 
ATOM   771  C C   . LYS A 1 100 ? -18.91615 -16.81507 23.56047  1.000 24.29677 ? 100 LYS A C   1 
ATOM   772  O O   . LYS A 1 100 ? -18.11341 -15.89014 23.71415  1.000 25.25209 ? 100 LYS A O   1 
ATOM   773  C CB  . LYS A 1 100 ? -18.82828 -18.18879 25.66371  1.000 31.81818 ? 100 LYS A CB  1 
ATOM   774  C CG  . LYS A 1 100 ? -18.53051 -19.53808 26.30727  1.000 33.75945 ? 100 LYS A CG  1 
ATOM   775  C CD  . LYS A 1 100 ? -18.51851 -19.43597 27.82239  1.000 40.72772 ? 100 LYS A CD  1 
ATOM   776  C CE  . LYS A 1 100 ? -19.84086 -18.89645 28.34304  1.000 36.53247 ? 100 LYS A CE  1 
ATOM   777  N NZ  . LYS A 1 100 ? -19.88233 -18.89900 29.83403  1.000 52.08217 ? 100 LYS A NZ  1 
ATOM   778  N N   . TYR A 1 101 ? -20.03218 -16.68132 22.85063  1.000 23.18834 ? 101 TYR A N   1 
ATOM   779  C CA  . TYR A 1 101 ? -20.21832 -15.46802 22.07415  1.000 29.19433 ? 101 TYR A CA  1 
ATOM   780  C C   . TYR A 1 101 ? -21.69425 -15.14554 21.91984  1.000 28.46981 ? 101 TYR A C   1 
ATOM   781  O O   . TYR A 1 101 ? -22.56632 -16.00985 22.04800  1.000 23.83597 ? 101 TYR A O   1 
ATOM   782  C CB  . TYR A 1 101 ? -19.55089 -15.56748 20.69220  1.000 24.65509 ? 101 TYR A CB  1 
ATOM   783  C CG  . TYR A 1 101 ? -20.29092 -16.43106 19.69493  1.000 25.92100 ? 101 TYR A CG  1 
ATOM   784  C CD1 . TYR A 1 101 ? -21.23524 -15.88416 18.82930  1.000 26.64326 ? 101 TYR A CD1 1 
ATOM   785  C CD2 . TYR A 1 101 ? -20.03272 -17.79048 19.60947  1.000 24.88947 ? 101 TYR A CD2 1 
ATOM   786  C CE1 . TYR A 1 101 ? -21.91524 -16.68505 17.91375  1.000 24.11314 ? 101 TYR A CE1 1 
ATOM   787  C CE2 . TYR A 1 101 ? -20.69918 -18.59472 18.69986  1.000 25.98232 ? 101 TYR A CE2 1 
ATOM   788  C CZ  . TYR A 1 101 ? -21.63541 -18.03758 17.85842  1.000 26.90787 ? 101 TYR A CZ  1 
ATOM   789  O OH  . TYR A 1 101 ? -22.28774 -18.84570 16.96579  1.000 31.80842 ? 101 TYR A OH  1 
ATOM   790  N N   . LYS A 1 102 ? -21.94726 -13.87007 21.63881  1.000 26.10254 ? 102 LYS A N   1 
ATOM   791  C CA  . LYS A 1 102 ? -23.26155 -13.35194 21.29559  1.000 27.87490 ? 102 LYS A CA  1 
ATOM   792  C C   . LYS A 1 102 ? -23.09380 -12.35940 20.15828  1.000 28.67856 ? 102 LYS A C   1 
ATOM   793  O O   . LYS A 1 102 ? -22.00815 -11.81532 19.94767  1.000 25.22550 ? 102 LYS A O   1 
ATOM   794  C CB  . LYS A 1 102 ? -23.93403 -12.64129 22.47667  1.000 27.01049 ? 102 LYS A CB  1 
ATOM   795  C CG  . LYS A 1 102 ? -24.11667 -13.47739 23.71311  1.000 41.74425 ? 102 LYS A CG  1 
ATOM   796  C CD  . LYS A 1 102 ? -24.23166 -12.58202 24.94162  1.000 43.19212 ? 102 LYS A CD  1 
ATOM   797  C CE  . LYS A 1 102 ? -25.03881 -11.32861 24.65513  1.000 40.66241 ? 102 LYS A CE  1 
ATOM   798  N NZ  . LYS A 1 102 ? -24.24707 -10.08268 24.90037  1.000 47.27805 ? 102 LYS A NZ  1 
ATOM   799  N N   . PHE A 1 103 ? -24.18301 -12.12832 19.42452  1.000 21.76856 ? 103 PHE A N   1 
ATOM   800  C CA  . PHE A 1 103 ? -24.27254 -11.02991 18.46990  1.000 25.98368 ? 103 PHE A CA  1 
ATOM   801  C C   . PHE A 1 103 ? -25.12477 -9.92840  19.08162  1.000 27.81577 ? 103 PHE A C   1 
ATOM   802  O O   . PHE A 1 103 ? -26.23318 -10.19029 19.56035  1.000 29.32125 ? 103 PHE A O   1 
ATOM   803  C CB  . PHE A 1 103 ? -24.89002 -11.47770 17.14206  1.000 22.37418 ? 103 PHE A CB  1 
ATOM   804  C CG  . PHE A 1 103 ? -24.02394 -12.41196 16.33860  1.000 22.77709 ? 103 PHE A CG  1 
ATOM   805  C CD1 . PHE A 1 103 ? -22.67944 -12.56542 16.62829  1.000 23.63159 ? 103 PHE A CD1 1 
ATOM   806  C CD2 . PHE A 1 103 ? -24.56438 -13.13295 15.27985  1.000 25.50159 ? 103 PHE A CD2 1 
ATOM   807  C CE1 . PHE A 1 103 ? -21.88648 -13.42667 15.88117  1.000 24.75951 ? 103 PHE A CE1 1 
ATOM   808  C CE2 . PHE A 1 103 ? -23.77868 -13.98978 14.53056  1.000 22.18580 ? 103 PHE A CE2 1 
ATOM   809  C CZ  . PHE A 1 103 ? -22.43880 -14.13906 14.82911  1.000 22.79035 ? 103 PHE A CZ  1 
ATOM   810  N N   . VAL A 1 104 ? -24.60858 -8.70642  19.08650  1.000 22.30944 ? 104 VAL A N   1 
ATOM   811  C CA  . VAL A 1 104 ? -25.36158 -7.58388  19.62997  1.000 24.60467 ? 104 VAL A CA  1 
ATOM   812  C C   . VAL A 1 104 ? -25.29856 -6.42864  18.64804  1.000 28.10121 ? 104 VAL A C   1 
ATOM   813  O O   . VAL A 1 104 ? -24.29963 -6.22871  17.95195  1.000 25.30455 ? 104 VAL A O   1 
ATOM   814  C CB  . VAL A 1 104 ? -24.85689 -7.13902  21.02506  1.000 29.01280 ? 104 VAL A CB  1 
ATOM   815  C CG1 . VAL A 1 104 ? -24.83691 -8.31513  21.99009  1.000 28.69080 ? 104 VAL A CG1 1 
ATOM   816  C CG2 . VAL A 1 104 ? -23.48867 -6.48095  20.93832  1.000 36.22339 ? 104 VAL A CG2 1 
ATOM   817  N N   . ARG A 1 105 ? -26.38344 -5.67070  18.58404  1.000 24.27580 ? 105 ARG A N   1 
ATOM   818  C CA  . ARG A 1 105 ? -26.40648 -4.42774  17.82937  1.000 25.24244 ? 105 ARG A CA  1 
ATOM   819  C C   . ARG A 1 105 ? -26.25037 -3.29840  18.83909  1.000 24.83329 ? 105 ARG A C   1 
ATOM   820  O O   . ARG A 1 105 ? -27.13150 -3.08154  19.67584  1.000 26.45156 ? 105 ARG A O   1 
ATOM   821  C CB  . ARG A 1 105 ? -27.69273 -4.29152  17.01624  1.000 25.26687 ? 105 ARG A CB  1 
ATOM   822  C CG  . ARG A 1 105 ? -27.66483 -3.11354  16.07246  1.000 25.38806 ? 105 ARG A CG  1 
ATOM   823  C CD  . ARG A 1 105 ? -28.87841 -3.08271  15.16131  1.000 25.97725 ? 105 ARG A CD  1 
ATOM   824  N NE  . ARG A 1 105 ? -28.88080 -1.88340  14.33206  1.000 23.51127 ? 105 ARG A NE  1 
ATOM   825  C CZ  . ARG A 1 105 ? -28.21536 -1.76729  13.19069  1.000 27.66709 ? 105 ARG A CZ  1 
ATOM   826  N NH1 . ARG A 1 105 ? -27.49662 -2.76821  12.70336  1.000 25.16438 ? 105 ARG A NH1 1 
ATOM   827  N NH2 . ARG A 1 105 ? -28.27231 -0.62071  12.52125  1.000 26.97677 ? 105 ARG A NH2 1 
ATOM   828  N N   . ILE A 1 106 ? -25.12374 -2.59420  18.77706  1.000 23.08402 ? 106 ILE A N   1 
ATOM   829  C CA  . ILE A 1 106 ? -24.83412 -1.59021  19.79142  1.000 25.22591 ? 106 ILE A CA  1 
ATOM   830  C C   . ILE A 1 106 ? -25.53729 -0.28069  19.45524  1.000 27.06427 ? 106 ILE A C   1 
ATOM   831  O O   . ILE A 1 106 ? -25.87681 0.00986   18.30343  1.000 30.22266 ? 106 ILE A O   1 
ATOM   832  C CB  . ILE A 1 106 ? -23.32044 -1.36824  19.96600  1.000 27.85616 ? 106 ILE A CB  1 
ATOM   833  C CG1 . ILE A 1 106 ? -22.66937 -1.05978  18.62103  1.000 28.90814 ? 106 ILE A CG1 1 
ATOM   834  C CG2 . ILE A 1 106 ? -22.67456 -2.54685  20.68706  1.000 34.31775 ? 106 ILE A CG2 1 
ATOM   835  C CD1 . ILE A 1 106 ? -21.36850 -0.31443  18.74592  1.000 36.07709 ? 106 ILE A CD1 1 
ATOM   836  N N   . GLN A 1 107 ? -25.75053 0.51779   20.48984  1.000 29.13434 ? 107 GLN A N   1 
ATOM   837  C CA  . GLN A 1 107 ? -26.27500 1.86508   20.37129  1.000 28.47872 ? 107 GLN A CA  1 
ATOM   838  C C   . GLN A 1 107 ? -25.14603 2.83834   20.04714  1.000 29.31908 ? 107 GLN A C   1 
ATOM   839  O O   . GLN A 1 107 ? -23.99993 2.62076   20.44747  1.000 27.27247 ? 107 GLN A O   1 
ATOM   840  C CB  . GLN A 1 107 ? -26.94788 2.28716   21.67447  1.000 31.00943 ? 107 GLN A CB  1 
ATOM   841  C CG  . GLN A 1 107 ? -28.07976 1.37543   22.11685  1.000 36.01912 ? 107 GLN A CG  1 
ATOM   842  C CD  . GLN A 1 107 ? -29.28802 1.49422   21.21612  1.000 43.00208 ? 107 GLN A CD  1 
ATOM   843  O OE1 . GLN A 1 107 ? -29.71673 2.59899   20.87948  1.000 48.52257 ? 107 GLN A OE1 1 
ATOM   844  N NE2 . GLN A 1 107 ? -29.84046 0.35628   20.81035  1.000 55.01142 ? 107 GLN A NE2 1 
ATOM   845  N N   . PRO A 1 108 ? -25.44254 3.91655   19.32344  1.000 26.04836 ? 108 PRO A N   1 
ATOM   846  C CA  . PRO A 1 108 ? -24.46083 4.99884   19.19328  1.000 23.51652 ? 108 PRO A CA  1 
ATOM   847  C C   . PRO A 1 108 ? -24.04701 5.51675   20.56401  1.000 29.99293 ? 108 PRO A C   1 
ATOM   848  O O   . PRO A 1 108 ? -24.85434 5.59286   21.49500  1.000 26.99043 ? 108 PRO A O   1 
ATOM   849  C CB  . PRO A 1 108 ? -25.20449 6.06559   18.37711  1.000 32.96451 ? 108 PRO A CB  1 
ATOM   850  C CG  . PRO A 1 108 ? -26.65449 5.65583   18.41875  1.000 36.36341 ? 108 PRO A CG  1 
ATOM   851  C CD  . PRO A 1 108 ? -26.65972 4.17681   18.53994  1.000 31.36004 ? 108 PRO A CD  1 
ATOM   852  N N   . GLY A 1 109 ? -22.76902 5.86130   20.68186  1.000 23.58815 ? 109 GLY A N   1 
ATOM   853  C CA  . GLY A 1 109 ? -22.17693 6.21879   21.94796  1.000 27.74843 ? 109 GLY A CA  1 
ATOM   854  C C   . GLY A 1 109 ? -21.47038 5.08196   22.65797  1.000 28.91944 ? 109 GLY A C   1 
ATOM   855  O O   . GLY A 1 109 ? -20.63194 5.34108   23.52779  1.000 30.77018 ? 109 GLY A O   1 
ATOM   856  N N   . GLN A 1 110 ? -21.78701 3.83347   22.31709  1.000 25.12379 ? 110 GLN A N   1 
ATOM   857  C CA  . GLN A 1 110 ? -21.11033 2.68317   22.89480  1.000 24.07877 ? 110 GLN A CA  1 
ATOM   858  C C   . GLN A 1 110 ? -19.78632 2.42591   22.18170  1.000 25.38257 ? 110 GLN A C   1 
ATOM   859  O O   . GLN A 1 110 ? -19.58069 2.80843   21.02698  1.000 25.64995 ? 110 GLN A O   1 
ATOM   860  C CB  . GLN A 1 110 ? -21.99506 1.43604   22.82237  1.000 26.39241 ? 110 GLN A CB  1 
ATOM   861  C CG  . GLN A 1 110 ? -23.24023 1.51611   23.69367  1.000 34.45680 ? 110 GLN A CG  1 
ATOM   862  C CD  . GLN A 1 110 ? -22.91535 1.78321   25.15270  1.000 45.02969 ? 110 GLN A CD  1 
ATOM   863  O OE1 . GLN A 1 110 ? -22.29199 0.95659   25.82776  1.000 43.99371 ? 110 GLN A OE1 1 
ATOM   864  N NE2 . GLN A 1 110 ? -23.33504 2.94460   25.64797  1.000 41.28322 ? 110 GLN A NE2 1 
ATOM   865  N N   . THR A 1 111 ? -18.88145 1.76146   22.89195  1.000 27.77507 ? 111 THR A N   1 
ATOM   866  C CA  . THR A 1 111 ? -17.52625 1.53217   22.42267  1.000 25.12153 ? 111 THR A CA  1 
ATOM   867  C C   . THR A 1 111 ? -17.27180 0.04093   22.25836  1.000 21.48959 ? 111 THR A C   1 
ATOM   868  O O   . THR A 1 111 ? -17.98433 -0.79816  22.81475  1.000 24.12792 ? 111 THR A O   1 
ATOM   869  C CB  . THR A 1 111 ? -16.50262 2.11257   23.40202  1.000 19.83708 ? 111 THR A CB  1 
ATOM   870  O OG1 . THR A 1 111 ? -16.71022 1.51708   24.68861  1.000 24.78206 ? 111 THR A OG1 1 
ATOM   871  C CG2 . THR A 1 111 ? -16.66196 3.63378   23.50412  1.000 22.32343 ? 111 THR A CG2 1 
ATOM   872  N N   . PHE A 1 112 ? -16.22718 -0.27774  21.49891  1.000 24.54733 ? 112 PHE A N   1 
ATOM   873  C CA  . PHE A 1 112 ? -15.83095 -1.66114  21.27265  1.000 25.25800 ? 112 PHE A CA  1 
ATOM   874  C C   . PHE A 1 112 ? -14.39466 -1.67190  20.76729  1.000 22.28265 ? 112 PHE A C   1 
ATOM   875  O O   . PHE A 1 112 ? -13.85197 -0.64396  20.36109  1.000 24.68102 ? 112 PHE A O   1 
ATOM   876  C CB  . PHE A 1 112 ? -16.77060 -2.36231  20.28036  1.000 26.48913 ? 112 PHE A CB  1 
ATOM   877  C CG  . PHE A 1 112 ? -16.92105 -1.64068  18.96162  1.000 27.56807 ? 112 PHE A CG  1 
ATOM   878  C CD1 . PHE A 1 112 ? -16.07074 -1.91257  17.89853  1.000 25.34440 ? 112 PHE A CD1 1 
ATOM   879  C CD2 . PHE A 1 112 ? -17.91910 -0.69492  18.78549  1.000 31.73338 ? 112 PHE A CD2 1 
ATOM   880  C CE1 . PHE A 1 112 ? -16.20669 -1.24825  16.68984  1.000 26.45111 ? 112 PHE A CE1 1 
ATOM   881  C CE2 . PHE A 1 112 ? -18.06234 -0.02546  17.57821  1.000 29.64260 ? 112 PHE A CE2 1 
ATOM   882  C CZ  . PHE A 1 112 ? -17.20776 -0.30555  16.52988  1.000 31.73833 ? 112 PHE A CZ  1 
ATOM   883  N N   . SER A 1 113 ? -13.78371 -2.85389  20.79725  1.000 20.97085 ? 113 SER A N   1 
ATOM   884  C CA  . SER A 1 113 ? -12.44346 -3.05455  20.25988  1.000 20.96321 ? 113 SER A CA  1 
ATOM   885  C C   . SER A 1 113 ? -12.52974 -3.60972  18.84710  1.000 23.94081 ? 113 SER A C   1 
ATOM   886  O O   . SER A 1 113 ? -13.35639 -4.48038  18.56636  1.000 22.77875 ? 113 SER A O   1 
ATOM   887  C CB  . SER A 1 113 ? -11.63973 -4.01876  21.13153  1.000 22.45484 ? 113 SER A CB  1 
ATOM   888  O OG  . SER A 1 113 ? -11.44852 -3.48536  22.42153  1.000 24.42634 ? 113 SER A OG  1 
ATOM   889  N N   . VAL A 1 114 ? -11.66305 -3.11610  17.96627  1.000 22.91816 ? 114 VAL A N   1 
ATOM   890  C CA  . VAL A 1 114 ? -11.55056 -3.60759  16.59725  1.000 20.05932 ? 114 VAL A CA  1 
ATOM   891  C C   . VAL A 1 114 ? -10.27110 -4.42289  16.48648  1.000 21.66787 ? 114 VAL A C   1 
ATOM   892  O O   . VAL A 1 114 ? -9.20645  -3.96891  16.91220  1.000 22.30221 ? 114 VAL A O   1 
ATOM   893  C CB  . VAL A 1 114 ? -11.54113 -2.44864  15.58415  1.000 22.82653 ? 114 VAL A CB  1 
ATOM   894  C CG1 . VAL A 1 114 ? -11.11694 -2.94112  14.20424  1.000 21.32773 ? 114 VAL A CG1 1 
ATOM   895  C CG2 . VAL A 1 114 ? -12.90211 -1.78686  15.52673  1.000 25.87483 ? 114 VAL A CG2 1 
ATOM   896  N N   . LEU A 1 115 ? -10.36708 -5.61949  15.91535  1.000 22.15792 ? 115 LEU A N   1 
ATOM   897  C CA  . LEU A 1 115 ? -9.18119  -6.38839  15.54657  1.000 20.78808 ? 115 LEU A CA  1 
ATOM   898  C C   . LEU A 1 115 ? -9.02348  -6.24935  14.03638  1.000 21.08243 ? 115 LEU A C   1 
ATOM   899  O O   . LEU A 1 115 ? -9.70086  -6.93464  13.26477  1.000 21.12954 ? 115 LEU A O   1 
ATOM   900  C CB  . LEU A 1 115 ? -9.29998  -7.84680  15.98163  1.000 23.31038 ? 115 LEU A CB  1 
ATOM   901  C CG  . LEU A 1 115 ? -8.10139  -8.72885  15.62074  1.000 21.93073 ? 115 LEU A CG  1 
ATOM   902  C CD1 . LEU A 1 115 ? -6.87756  -8.33492  16.44010  1.000 24.52777 ? 115 LEU A CD1 1 
ATOM   903  C CD2 . LEU A 1 115 ? -8.43315  -10.19979 15.83517  1.000 21.12335 ? 115 LEU A CD2 1 
ATOM   904  N N   . ALA A 1 116 ? -8.14671  -5.33794  13.61560  1.000 23.57383 ? 116 ALA A N   1 
ATOM   905  C CA  . ALA A 1 116 ? -7.92936  -5.08187  12.19407  1.000 23.09305 ? 116 ALA A CA  1 
ATOM   906  C C   . ALA A 1 116 ? -7.11497  -6.22147  11.59851  1.000 23.41320 ? 116 ALA A C   1 
ATOM   907  O O   . ALA A 1 116 ? -6.02597  -6.53225  12.09191  1.000 26.29828 ? 116 ALA A O   1 
ATOM   908  C CB  . ALA A 1 116 ? -7.21830  -3.74470  11.99284  1.000 23.66390 ? 116 ALA A CB  1 
ATOM   909  N N   . CYS A 1 117 ? -7.64398  -6.85196  10.55121  1.000 21.08569 ? 117 CYS A N   1 
ATOM   910  C CA  . CYS A 1 117 ? -7.01216  -8.00863  9.93265   1.000 19.86761 ? 117 CYS A CA  1 
ATOM   911  C C   . CYS A 1 117 ? -6.83710  -7.79684  8.43651   1.000 22.40474 ? 117 CYS A C   1 
ATOM   912  O O   . CYS A 1 117 ? -7.55864  -7.02403  7.80379   1.000 21.68108 ? 117 CYS A O   1 
ATOM   913  C CB  . CYS A 1 117 ? -7.82656  -9.28796  10.15896  1.000 24.21091 ? 117 CYS A CB  1 
ATOM   914  S SG  . CYS A 1 117 ? -8.02412  -9.73153  11.87759  1.000 27.69416 ? 117 CYS A SG  1 
ATOM   915  N N   . TYR A 1 118 ? -5.85913  -8.50701  7.87617   1.000 22.42408 ? 118 TYR A N   1 
ATOM   916  C CA  . TYR A 1 118 ? -5.65461  -8.57357  6.43475   1.000 22.26486 ? 118 TYR A CA  1 
ATOM   917  C C   . TYR A 1 118 ? -5.33127  -10.01772 6.10669   1.000 24.34753 ? 118 TYR A C   1 
ATOM   918  O O   . TYR A 1 118 ? -4.54860  -10.64459 6.82354   1.000 22.68997 ? 118 TYR A O   1 
ATOM   919  C CB  . TYR A 1 118 ? -4.53419  -7.62551  5.97135   1.000 22.49753 ? 118 TYR A CB  1 
ATOM   920  C CG  . TYR A 1 118 ? -4.88675  -6.20006  6.30075   1.000 21.04852 ? 118 TYR A CG  1 
ATOM   921  C CD1 . TYR A 1 118 ? -5.64373  -5.43337  5.42268   1.000 22.99676 ? 118 TYR A CD1 1 
ATOM   922  C CD2 . TYR A 1 118 ? -4.53396  -5.64690  7.52205   1.000 26.28488 ? 118 TYR A CD2 1 
ATOM   923  C CE1 . TYR A 1 118 ? -6.00897  -4.15342  5.73738   1.000 18.72209 ? 118 TYR A CE1 1 
ATOM   924  C CE2 . TYR A 1 118 ? -4.89621  -4.36360  7.84912   1.000 23.99617 ? 118 TYR A CE2 1 
ATOM   925  C CZ  . TYR A 1 118 ? -5.63015  -3.62002  6.95066   1.000 21.97825 ? 118 TYR A CZ  1 
ATOM   926  O OH  . TYR A 1 118 ? -5.99645  -2.34712  7.27776   1.000 23.77712 ? 118 TYR A OH  1 
ATOM   927  N N   . ASN A 1 119 ? -5.97370  -10.55497 5.06573   1.000 22.10658 ? 119 ASN A N   1 
ATOM   928  C CA  . ASN A 1 119 ? -5.74836  -11.94022 4.63715   1.000 25.18765 ? 119 ASN A CA  1 
ATOM   929  C C   . ASN A 1 119 ? -5.95031  -12.91968 5.79163   1.000 24.82851 ? 119 ASN A C   1 
ATOM   930  O O   . ASN A 1 119 ? -5.24883  -13.93122 5.90992   1.000 24.11860 ? 119 ASN A O   1 
ATOM   931  C CB  . ASN A 1 119 ? -4.35483  -12.11228 4.02037   1.000 29.74920 ? 119 ASN A CB  1 
ATOM   932  C CG  . ASN A 1 119 ? -4.09958  -11.14928 2.87662   1.000 32.92704 ? 119 ASN A CG  1 
ATOM   933  O OD1 . ASN A 1 119 ? -3.40803  -10.14488 3.04095   1.000 40.12088 ? 119 ASN A OD1 1 
ATOM   934  N ND2 . ASN A 1 119 ? -4.66249  -11.44761 1.71395   1.000 34.98224 ? 119 ASN A ND2 1 
ATOM   935  N N   . GLY A 1 120 ? -6.90535  -12.61689 6.66371   1.000 22.03707 ? 120 GLY A N   1 
ATOM   936  C CA  . GLY A 1 120 ? -7.22442  -13.49522 7.76296   1.000 25.30588 ? 120 GLY A CA  1 
ATOM   937  C C   . GLY A 1 120 ? -6.27674  -13.42198 8.93731   1.000 28.09541 ? 120 GLY A C   1 
ATOM   938  O O   . GLY A 1 120 ? -6.43881  -14.19829 9.88705   1.000 30.97545 ? 120 GLY A O   1 
ATOM   939  N N   . SER A 1 121 ? -5.30448  -12.51144 8.91153   1.000 24.55673 ? 121 SER A N   1 
ATOM   940  C CA  . SER A 1 121 ? -4.31657  -12.38554 9.96783   1.000 27.70836 ? 121 SER A CA  1 
ATOM   941  C C   . SER A 1 121 ? -4.39361  -11.01092 10.61830  1.000 26.45436 ? 121 SER A C   1 
ATOM   942  O O   . SER A 1 121 ? -4.57543  -10.00671 9.92200   1.000 26.27273 ? 121 SER A O   1 
ATOM   943  C CB  . SER A 1 121 ? -2.90364  -12.61310 9.42262   1.000 28.40931 ? 121 SER A CB  1 
ATOM   944  O OG  . SER A 1 121 ? -2.75982  -13.95252 8.99072   1.000 38.02965 ? 121 SER A OG  1 
ATOM   945  N N   . PRO A 1 122 ? -4.24732  -10.93387 11.94095  1.000 32.14098 ? 122 PRO A N   1 
ATOM   946  C CA  . PRO A 1 122 ? -4.40859  -9.65171  12.63848  1.000 29.33499 ? 122 PRO A CA  1 
ATOM   947  C C   . PRO A 1 122 ? -3.23255  -8.71356  12.42090  1.000 32.29353 ? 122 PRO A C   1 
ATOM   948  O O   . PRO A 1 122 ? -2.06968  -9.12448  12.42234  1.000 34.04768 ? 122 PRO A O   1 
ATOM   949  C CB  . PRO A 1 122 ? -4.50802  -10.06289 14.11410  1.000 32.98809 ? 122 PRO A CB  1 
ATOM   950  C CG  . PRO A 1 122 ? -4.78005  -11.53510 14.10503  1.000 44.32289 ? 122 PRO A CG  1 
ATOM   951  C CD  . PRO A 1 122 ? -4.09627  -12.05516 12.88211  1.000 38.95369 ? 122 PRO A CD  1 
ATOM   952  N N   . SER A 1 123 ? -3.55524  -7.43490  12.23260  1.000 24.06696 ? 123 SER A N   1 
ATOM   953  C CA  . SER A 1 123 ? -2.56734  -6.36827  12.18386  1.000 28.34243 ? 123 SER A CA  1 
ATOM   954  C C   . SER A 1 123 ? -2.46193  -5.61058  13.49921  1.000 31.36559 ? 123 SER A C   1 
ATOM   955  O O   . SER A 1 123 ? -1.36871  -5.15630  13.85358  1.000 30.59228 ? 123 SER A O   1 
ATOM   956  C CB  . SER A 1 123 ? -2.90461  -5.38643  11.04972  1.000 28.61474 ? 123 SER A CB  1 
ATOM   957  O OG  . SER A 1 123 ? -2.01859  -4.27519  11.02230  1.000 37.44320 ? 123 SER A OG  1 
ATOM   958  N N   . GLY A 1 124 ? -3.56093  -5.47567  14.23443  1.000 25.69411 ? 124 GLY A N   1 
ATOM   959  C CA  . GLY A 1 124 ? -3.52545  -4.76251  15.49886  1.000 21.78141 ? 124 GLY A CA  1 
ATOM   960  C C   . GLY A 1 124 ? -4.91877  -4.62092  16.06959  1.000 26.56857 ? 124 GLY A C   1 
ATOM   961  O O   . GLY A 1 124 ? -5.91664  -4.97630  15.43677  1.000 23.87375 ? 124 GLY A O   1 
ATOM   962  N N   . VAL A 1 125 ? -4.97420  -4.09375  17.29023  1.000 22.37270 ? 125 VAL A N   1 
ATOM   963  C CA  . VAL A 1 125 ? -6.23374  -3.92755  18.00194  1.000 23.16172 ? 125 VAL A CA  1 
ATOM   964  C C   . VAL A 1 125 ? -6.30736  -2.50851  18.55611  1.000 26.98230 ? 125 VAL A C   1 
ATOM   965  O O   . VAL A 1 125 ? -5.30238  -1.95369  19.01698  1.000 24.65151 ? 125 VAL A O   1 
ATOM   966  C CB  . VAL A 1 125 ? -6.39062  -4.99559  19.11213  1.000 24.45338 ? 125 VAL A CB  1 
ATOM   967  C CG1 . VAL A 1 125 ? -5.30420  -4.85840  20.15835  1.000 31.78561 ? 125 VAL A CG1 1 
ATOM   968  C CG2 . VAL A 1 125 ? -7.77185  -4.93603  19.74730  1.000 26.94077 ? 125 VAL A CG2 1 
ATOM   969  N N   . TYR A 1 126 ? -7.49168  -1.90358  18.46847  1.000 21.13340 ? 126 TYR A N   1 
ATOM   970  C CA  . TYR A 1 126 ? -7.69752  -0.56137  18.98930  1.000 23.63793 ? 126 TYR A CA  1 
ATOM   971  C C   . TYR A 1 126 ? -9.16129  -0.39226  19.36493  1.000 23.94103 ? 126 TYR A C   1 
ATOM   972  O O   . TYR A 1 126 ? -10.02915 -1.15198  18.93142  1.000 23.00546 ? 126 TYR A O   1 
ATOM   973  C CB  . TYR A 1 126 ? -7.26895  0.51724   17.98494  1.000 23.97507 ? 126 TYR A CB  1 
ATOM   974  C CG  . TYR A 1 126 ? -7.86818  0.35610   16.60500  1.000 22.53225 ? 126 TYR A CG  1 
ATOM   975  C CD1 . TYR A 1 126 ? -9.11718  0.87741   16.29972  1.000 26.01466 ? 126 TYR A CD1 1 
ATOM   976  C CD2 . TYR A 1 126 ? -7.17713  -0.31020  15.60779  1.000 28.79126 ? 126 TYR A CD2 1 
ATOM   977  C CE1 . TYR A 1 126 ? -9.66609  0.72674   15.03332  1.000 24.89774 ? 126 TYR A CE1 1 
ATOM   978  C CE2 . TYR A 1 126 ? -7.71239  -0.46066  14.34254  1.000 30.26139 ? 126 TYR A CE2 1 
ATOM   979  C CZ  . TYR A 1 126 ? -8.95197  0.06057   14.06166  1.000 25.42003 ? 126 TYR A CZ  1 
ATOM   980  O OH  . TYR A 1 126 ? -9.47557  -0.09775  12.80035  1.000 28.79501 ? 126 TYR A OH  1 
ATOM   981  N N   . GLN A 1 127 ? -9.42090  0.61742   20.18318  1.000 24.64223 ? 127 GLN A N   1 
ATOM   982  C CA  . GLN A 1 127 ? -10.76036 0.89421   20.67565  1.000 24.66289 ? 127 GLN A CA  1 
ATOM   983  C C   . GLN A 1 127 ? -11.44260 1.91898   19.77813  1.000 27.61851 ? 127 GLN A C   1 
ATOM   984  O O   . GLN A 1 127 ? -10.80578 2.86099   19.30175  1.000 31.98050 ? 127 GLN A O   1 
ATOM   985  C CB  . GLN A 1 127 ? -10.69557 1.40352   22.11942  1.000 30.23385 ? 127 GLN A CB  1 
ATOM   986  C CG  . GLN A 1 127 ? -12.02518 1.42573   22.84155  1.000 34.21780 ? 127 GLN A CG  1 
ATOM   987  C CD  . GLN A 1 127 ? -12.43590 0.06225   23.36913  1.000 31.48169 ? 127 GLN A CD  1 
ATOM   988  O OE1 . GLN A 1 127 ? -11.85562 -0.96416  23.00892  1.000 32.15481 ? 127 GLN A OE1 1 
ATOM   989  N NE2 . GLN A 1 127 ? -13.44753 0.04561   24.22544  1.000 33.99443 ? 127 GLN A NE2 1 
ATOM   990  N N   . CYS A 1 128 ? -12.74039 1.71946   19.54423  1.000 24.58666 ? 128 CYS A N   1 
ATOM   991  C CA  . CYS A 1 128 ? -13.56264 2.60183   18.72761  1.000 25.55188 ? 128 CYS A CA  1 
ATOM   992  C C   . CYS A 1 128 ? -14.87166 2.90199   19.44277  1.000 27.52666 ? 128 CYS A C   1 
ATOM   993  O O   . CYS A 1 128 ? -15.25019 2.23065   20.40185  1.000 25.45651 ? 128 CYS A O   1 
ATOM   994  C CB  . CYS A 1 128 ? -13.89193 1.98197   17.35718  1.000 24.20017 ? 128 CYS A CB  1 
ATOM   995  S SG  . CYS A 1 128 ? -12.58528 2.09931   16.16471  1.000 38.01771 ? 128 CYS A SG  1 
ATOM   996  N N   . ALA A 1 129 ? -15.58110 3.90642   18.93875  1.000 27.77321 ? 129 ALA A N   1 
ATOM   997  C CA  . ALA A 1 129 ? -16.94097 4.18674   19.36879  1.000 26.73059 ? 129 ALA A CA  1 
ATOM   998  C C   . ALA A 1 129 ? -17.84968 4.23341   18.14873  1.000 25.23917 ? 129 ALA A C   1 
ATOM   999  O O   . ALA A 1 129 ? -17.44793 4.70774   17.08240  1.000 26.89333 ? 129 ALA A O   1 
ATOM   1000 C CB  . ALA A 1 129 ? -17.02679 5.50654   20.13834  1.000 27.52334 ? 129 ALA A CB  1 
ATOM   1001 N N   . MET A 1 130 ? -19.06591 3.71819   18.30263  1.000 23.50321 ? 130 MET A N   1 
ATOM   1002 C CA  . MET A 1 130 ? -20.11437 3.96473   17.31878  1.000 22.79329 ? 130 MET A CA  1 
ATOM   1003 C C   . MET A 1 130 ? -20.56458 5.41268   17.46113  1.000 25.71364 ? 130 MET A C   1 
ATOM   1004 O O   . MET A 1 130 ? -21.20177 5.76955   18.45626  1.000 30.06899 ? 130 MET A O   1 
ATOM   1005 C CB  . MET A 1 130 ? -21.27410 2.99731   17.53564  1.000 25.89474 ? 130 MET A CB  1 
ATOM   1006 C CG  . MET A 1 130 ? -22.43435 3.14985   16.55234  1.000 26.28960 ? 130 MET A CG  1 
ATOM   1007 S SD  . MET A 1 130 ? -21.92917 2.97180   14.83450  1.000 25.40616 ? 130 MET A SD  1 
ATOM   1008 C CE  . MET A 1 130 ? -21.15041 1.35316   14.85958  1.000 25.55325 ? 130 MET A CE  1 
ATOM   1009 N N   . ARG A 1 131 ? -20.20767 6.25503   16.48973  1.000 24.77218 ? 131 ARG A N   1 
ATOM   1010 C CA  . ARG A 1 131 ? -20.50373 7.67966   16.57463  1.000 23.02390 ? 131 ARG A CA  1 
ATOM   1011 C C   . ARG A 1 131 ? -22.00907 7.92436   16.46286  1.000 24.53955 ? 131 ARG A C   1 
ATOM   1012 O O   . ARG A 1 131 ? -22.75157 7.08687   15.94290  1.000 23.07930 ? 131 ARG A O   1 
ATOM   1013 C CB  . ARG A 1 131 ? -19.78773 8.45488   15.46629  1.000 27.84308 ? 131 ARG A CB  1 
ATOM   1014 C CG  . ARG A 1 131 ? -18.29700 8.19663   15.30770  1.000 32.97916 ? 131 ARG A CG  1 
ATOM   1015 C CD  . ARG A 1 131 ? -17.48910 8.66366   16.49279  1.000 25.97186 ? 131 ARG A CD  1 
ATOM   1016 N NE  . ARG A 1 131 ? -17.82459 10.02200  16.90211  1.000 23.66505 ? 131 ARG A NE  1 
ATOM   1017 C CZ  . ARG A 1 131 ? -17.41526 10.56003  18.04187  1.000 30.17489 ? 131 ARG A CZ  1 
ATOM   1018 N NH1 . ARG A 1 131 ? -16.60955 9.90500   18.85895  1.000 22.41513 ? 131 ARG A NH1 1 
ATOM   1019 N NH2 . ARG A 1 131 ? -17.83400 11.77770  18.37560  1.000 27.55114 ? 131 ARG A NH2 1 
ATOM   1020 N N   . PRO A 1 132 ? -22.48289 9.07714   16.94182  1.000 24.36420 ? 132 PRO A N   1 
ATOM   1021 C CA  . PRO A 1 132 ? -23.90640 9.41079   16.75921  1.000 24.06484 ? 132 PRO A CA  1 
ATOM   1022 C C   . PRO A 1 132 ? -24.35348 9.43786   15.30446  1.000 28.99814 ? 132 PRO A C   1 
ATOM   1023 O O   . PRO A 1 132 ? -25.54107 9.21178   15.03093  1.000 24.82541 ? 132 PRO A O   1 
ATOM   1024 C CB  . PRO A 1 132 ? -24.02270 10.79067  17.42049  1.000 25.04885 ? 132 PRO A CB  1 
ATOM   1025 C CG  . PRO A 1 132 ? -22.95847 10.76777  18.49362  1.000 27.95179 ? 132 PRO A CG  1 
ATOM   1026 C CD  . PRO A 1 132 ? -21.80856 9.99812   17.87789  1.000 28.45979 ? 132 PRO A CD  1 
ATOM   1027 N N   . ASN A 1 133 ? -23.45439 9.70795   14.35625  1.000 25.13589 ? 133 ASN A N   1 
ATOM   1028 C CA  . ASN A 1 133 ? -23.81175 9.62782   12.94541  1.000 22.85581 ? 133 ASN A CA  1 
ATOM   1029 C C   . ASN A 1 133 ? -23.62245 8.22661   12.37577  1.000 24.32587 ? 133 ASN A C   1 
ATOM   1030 O O   . ASN A 1 133 ? -23.69837 8.05552   11.15550  1.000 26.28435 ? 133 ASN A O   1 
ATOM   1031 C CB  . ASN A 1 133 ? -23.01484 10.64553  12.11611  1.000 27.50301 ? 133 ASN A CB  1 
ATOM   1032 C CG  . ASN A 1 133 ? -21.51247 10.40407  12.15178  1.000 25.55662 ? 133 ASN A CG  1 
ATOM   1033 O OD1 . ASN A 1 133 ? -21.04611 9.38247   12.63828  1.000 27.48010 ? 133 ASN A OD1 1 
ATOM   1034 N ND2 . ASN A 1 133 ? -20.74830 11.35912  11.62787  1.000 27.23544 ? 133 ASN A ND2 1 
ATOM   1035 N N   . PHE A 1 134 ? -23.34793 7.23888   13.23170  1.000 22.00757 ? 134 PHE A N   1 
ATOM   1036 C CA  . PHE A 1 134 ? -23.27681 5.81746   12.88496  1.000 22.74710 ? 134 PHE A CA  1 
ATOM   1037 C C   . PHE A 1 134 ? -22.05937 5.45106   12.04787  1.000 25.45279 ? 134 PHE A C   1 
ATOM   1038 O O   . PHE A 1 134 ? -22.05493 4.40531   11.38020  1.000 27.04912 ? 134 PHE A O   1 
ATOM   1039 C CB  . PHE A 1 134 ? -24.54729 5.35010   12.17453  1.000 23.23378 ? 134 PHE A CB  1 
ATOM   1040 C CG  . PHE A 1 134 ? -25.75942 5.39779   13.04165  1.000 23.98541 ? 134 PHE A CG  1 
ATOM   1041 C CD1 . PHE A 1 134 ? -25.98039 4.41818   13.99286  1.000 28.63624 ? 134 PHE A CD1 1 
ATOM   1042 C CD2 . PHE A 1 134 ? -26.66940 6.43429   12.92446  1.000 28.76865 ? 134 PHE A CD2 1 
ATOM   1043 C CE1 . PHE A 1 134 ? -27.09954 4.46333   14.80526  1.000 34.83803 ? 134 PHE A CE1 1 
ATOM   1044 C CE2 . PHE A 1 134 ? -27.78911 6.48226   13.73061  1.000 34.57712 ? 134 PHE A CE2 1 
ATOM   1045 C CZ  . PHE A 1 134 ? -28.00204 5.49553   14.67436  1.000 32.14445 ? 134 PHE A CZ  1 
ATOM   1046 N N   . THR A 1 135 ? -21.03049 6.28462   12.05598  1.000 25.75881 ? 135 THR A N   1 
ATOM   1047 C CA  . THR A 1 135 ? -19.72169 5.90726   11.55183  1.000 22.04642 ? 135 THR A CA  1 
ATOM   1048 C C   . THR A 1 135 ? -18.84041 5.51602   12.72938  1.000 23.57129 ? 135 THR A C   1 
ATOM   1049 O O   . THR A 1 135 ? -19.20816 5.68846   13.89083  1.000 22.41786 ? 135 THR A O   1 
ATOM   1050 C CB  . THR A 1 135 ? -19.07988 7.06011   10.77165  1.000 22.64602 ? 135 THR A CB  1 
ATOM   1051 O OG1 . THR A 1 135 ? -18.81235 8.15140   11.66736  1.000 26.61532 ? 135 THR A OG1 1 
ATOM   1052 C CG2 . THR A 1 135 ? -20.00006 7.54241   9.66384   1.000 24.08222 ? 135 THR A CG2 1 
ATOM   1053 N N   . ILE A 1 136 ? -17.66678 4.97320   12.41936  1.000 25.05071 ? 136 ILE A N   1 
ATOM   1054 C CA  . ILE A 1 136 ? -16.60763 4.80957   13.40517  1.000 22.76606 ? 136 ILE A CA  1 
ATOM   1055 C C   . ILE A 1 136 ? -15.34611 5.42035   12.81865  1.000 24.37542 ? 136 ILE A C   1 
ATOM   1056 O O   . ILE A 1 136 ? -15.16192 5.46101   11.59897  1.000 24.83211 ? 136 ILE A O   1 
ATOM   1057 C CB  . ILE A 1 136 ? -16.35888 3.33184   13.81300  1.000 21.08755 ? 136 ILE A CB  1 
ATOM   1058 C CG1 . ILE A 1 136 ? -15.70159 2.54681   12.67687  1.000 23.75218 ? 136 ILE A CG1 1 
ATOM   1059 C CG2 . ILE A 1 136 ? -17.66481 2.65221   14.23589  1.000 26.88908 ? 136 ILE A CG2 1 
ATOM   1060 C CD1 . ILE A 1 136 ? -15.22256 1.16757   13.08827  1.000 26.99435 ? 136 ILE A CD1 1 
ATOM   1061 N N   . LYS A 1 137 ? -14.47762 5.90770   13.69426  1.000 24.23539 ? 137 LYS A N   1 
ATOM   1062 C CA  . LYS A 1 137 ? -13.20453 6.48353   13.27342  1.000 26.62606 ? 137 LYS A CA  1 
ATOM   1063 C C   . LYS A 1 137 ? -12.15059 5.40921   13.50115  1.000 27.46473 ? 137 LYS A C   1 
ATOM   1064 O O   . LYS A 1 137 ? -11.51165 5.34288   14.55127  1.000 30.08553 ? 137 LYS A O   1 
ATOM   1065 C CB  . LYS A 1 137 ? -12.90782 7.77075   14.03188  1.000 33.88966 ? 137 LYS A CB  1 
ATOM   1066 C CG  . LYS A 1 137 ? -14.05488 8.76735   14.00051  1.000 33.25266 ? 137 LYS A CG  1 
ATOM   1067 C CD  . LYS A 1 137 ? -13.66994 10.07898  14.67200  1.000 36.56541 ? 137 LYS A CD  1 
ATOM   1068 C CE  . LYS A 1 137 ? -12.95794 11.01631  13.70831  1.000 56.55520 ? 137 LYS A CE  1 
ATOM   1069 N NZ  . LYS A 1 137 ? -13.88172 12.05676  13.16769  1.000 64.46928 ? 137 LYS A NZ  1 
ATOM   1070 N N   . GLY A 1 138 ? -11.99998 4.53180   12.50992  1.000 24.87356 ? 138 GLY A N   1 
ATOM   1071 C CA  . GLY A 1 138 ? -11.09782 3.40909   12.60475  1.000 25.91522 ? 138 GLY A CA  1 
ATOM   1072 C C   . GLY A 1 138 ? -9.80571  3.65190   11.84877  1.000 26.75924 ? 138 GLY A C   1 
ATOM   1073 O O   . GLY A 1 138 ? -9.44808  4.77664   11.49727  1.000 27.13942 ? 138 GLY A O   1 
ATOM   1074 N N   . SER A 1 139 ? -9.09036  2.55709   11.61654  1.000 23.52568 ? 139 SER A N   1 
ATOM   1075 C CA  . SER A 1 139 ? -7.86947  2.55380   10.81533  1.000 24.52869 ? 139 SER A CA  1 
ATOM   1076 C C   . SER A 1 139 ? -7.94225  1.29392   9.96222   1.000 23.88136 ? 139 SER A C   1 
ATOM   1077 O O   . SER A 1 139 ? -7.69921  0.18796   10.45880  1.000 22.74136 ? 139 SER A O   1 
ATOM   1078 C CB  . SER A 1 139 ? -6.61985  2.57266   11.68730  1.000 23.73650 ? 139 SER A CB  1 
ATOM   1079 O OG  . SER A 1 139 ? -5.45406  2.55098   10.88180  1.000 23.78301 ? 139 SER A OG  1 
ATOM   1080 N N   . PHE A 1 140 ? -8.30657  1.46300   8.69403   1.000 23.52005 ? 140 PHE A N   1 
ATOM   1081 C CA  . PHE A 1 140 ? -8.58334  0.34242   7.80965   1.000 22.54652 ? 140 PHE A CA  1 
ATOM   1082 C C   . PHE A 1 140 ? -8.02418  0.63366   6.42540   1.000 22.78445 ? 140 PHE A C   1 
ATOM   1083 O O   . PHE A 1 140 ? -8.14601  1.75498   5.92069   1.000 23.51293 ? 140 PHE A O   1 
ATOM   1084 C CB  . PHE A 1 140 ? -10.08905 0.08052   7.68044   1.000 19.92541 ? 140 PHE A CB  1 
ATOM   1085 C CG  . PHE A 1 140 ? -10.76468 -0.39001  8.94152   1.000 20.57796 ? 140 PHE A CG  1 
ATOM   1086 C CD1 . PHE A 1 140 ? -10.52798 -1.65832  9.44498   1.000 22.25748 ? 140 PHE A CD1 1 
ATOM   1087 C CD2 . PHE A 1 140 ? -11.70411 0.41151   9.57382   1.000 22.61638 ? 140 PHE A CD2 1 
ATOM   1088 C CE1 . PHE A 1 140 ? -11.18639 -2.10173  10.57413  1.000 25.44932 ? 140 PHE A CE1 1 
ATOM   1089 C CE2 . PHE A 1 140 ? -12.35879 -0.02405  10.71062  1.000 23.66786 ? 140 PHE A CE2 1 
ATOM   1090 C CZ  . PHE A 1 140 ? -12.10676 -1.28458  11.20610  1.000 26.70405 ? 140 PHE A CZ  1 
ATOM   1091 N N   . LEU A 1 141 ? -7.43913  -0.38847  5.81061   1.000 21.53781 ? 141 LEU A N   1 
ATOM   1092 C CA  . LEU A 1 141 ? -6.92691  -0.34746  4.44933   1.000 22.82517 ? 141 LEU A CA  1 
ATOM   1093 C C   . LEU A 1 141 ? -7.70638  -1.33028  3.58897   1.000 21.44902 ? 141 LEU A C   1 
ATOM   1094 O O   . LEU A 1 141 ? -8.53216  -2.09614  4.08457   1.000 22.60058 ? 141 LEU A O   1 
ATOM   1095 C CB  . LEU A 1 141 ? -5.43631  -0.70137  4.40713   1.000 21.90303 ? 141 LEU A CB  1 
ATOM   1096 C CG  . LEU A 1 141 ? -4.53763  0.12128   5.31754   1.000 21.36845 ? 141 LEU A CG  1 
ATOM   1097 C CD1 . LEU A 1 141 ? -3.16090  -0.52872  5.38719   1.000 29.35824 ? 141 LEU A CD1 1 
ATOM   1098 C CD2 . LEU A 1 141 ? -4.44861  1.56354   4.80309   1.000 25.13327 ? 141 LEU A CD2 1 
ATOM   1099 N N   . ASN A 1 142 ? -7.41809  -1.31348  2.28853   1.000 24.14760 ? 142 ASN A N   1 
ATOM   1100 C CA  . ASN A 1 142 ? -7.95936  -2.33173  1.39818   1.000 22.33132 ? 142 ASN A CA  1 
ATOM   1101 C C   . ASN A 1 142 ? -7.56367  -3.71197  1.90030   1.000 24.88301 ? 142 ASN A C   1 
ATOM   1102 O O   . ASN A 1 142 ? -6.40316  -3.94827  2.24952   1.000 23.54128 ? 142 ASN A O   1 
ATOM   1103 C CB  . ASN A 1 142 ? -7.45681  -2.12252  -0.02937  1.000 24.92466 ? 142 ASN A CB  1 
ATOM   1104 C CG  . ASN A 1 142 ? -8.17530  -0.99178  -0.73562  1.000 37.86879 ? 142 ASN A CG  1 
ATOM   1105 O OD1 . ASN A 1 142 ? -9.28936  -0.62455  -0.36467  1.000 34.44794 ? 142 ASN A OD1 1 
ATOM   1106 N ND2 . ASN A 1 142 ? -7.54382  -0.43519  -1.75835  1.000 42.07702 ? 142 ASN A ND2 1 
ATOM   1107 N N   . GLY A 1 143 ? -8.54164  -4.61309  1.96055   1.000 22.70371 ? 143 GLY A N   1 
ATOM   1108 C CA  . GLY A 1 143 ? -8.36093  -5.93312  2.52268   1.000 24.98521 ? 143 GLY A CA  1 
ATOM   1109 C C   . GLY A 1 143 ? -8.83979  -6.07727  3.95293   1.000 21.08740 ? 143 GLY A C   1 
ATOM   1110 O O   . GLY A 1 143 ? -8.91173  -7.20625  4.44976   1.000 22.26259 ? 143 GLY A O   1 
ATOM   1111 N N   . SER A 1 144 ? -9.18374  -4.97184  4.62252   1.000 20.55839 ? 144 SER A N   1 
ATOM   1112 C CA  . SER A 1 144 ? -9.59592  -5.02961  6.02072   1.000 22.38421 ? 144 SER A CA  1 
ATOM   1113 C C   . SER A 1 144 ? -11.06428 -5.38559  6.20374   1.000 19.19220 ? 144 SER A C   1 
ATOM   1114 O O   . SER A 1 144 ? -11.46148 -5.72812  7.32177   1.000 20.72076 ? 144 SER A O   1 
ATOM   1115 C CB  . SER A 1 144 ? -9.33516  -3.69334  6.71306   1.000 18.17934 ? 144 SER A CB  1 
ATOM   1116 O OG  . SER A 1 144 ? -10.08711 -2.67207  6.08105   1.000 22.27424 ? 144 SER A OG  1 
ATOM   1117 N N   . ALA A 1 145 ? -11.87986 -5.29423  5.15331   1.000 20.50797 ? 145 ALA A N   1 
ATOM   1118 C CA  . ALA A 1 145 ? -13.28705 -5.65068  5.28346   1.000 21.82038 ? 145 ALA A CA  1 
ATOM   1119 C C   . ALA A 1 145 ? -13.43017 -7.04808  5.87689   1.000 21.20592 ? 145 ALA A C   1 
ATOM   1120 O O   . ALA A 1 145 ? -12.65389 -7.95803  5.57207   1.000 19.08745 ? 145 ALA A O   1 
ATOM   1121 C CB  . ALA A 1 145 ? -13.98828 -5.57085  3.92255   1.000 20.65985 ? 145 ALA A CB  1 
ATOM   1122 N N   . GLY A 1 146 ? -14.41383 -7.20461  6.75779   1.000 18.97305 ? 146 GLY A N   1 
ATOM   1123 C CA  . GLY A 1 146 ? -14.57753 -8.43657  7.49669   1.000 23.06912 ? 146 GLY A CA  1 
ATOM   1124 C C   . GLY A 1 146 ? -13.91437 -8.45093  8.85612   1.000 21.02586 ? 146 GLY A C   1 
ATOM   1125 O O   . GLY A 1 146 ? -14.20609 -9.34853  9.65686   1.000 20.17773 ? 146 GLY A O   1 
ATOM   1126 N N   . SER A 1 147 ? -13.01216 -7.51056  9.13354   1.000 21.41088 ? 147 SER A N   1 
ATOM   1127 C CA  . SER A 1 147 ? -12.56027 -7.31746  10.50374  1.000 17.89891 ? 147 SER A CA  1 
ATOM   1128 C C   . SER A 1 147 ? -13.76459 -6.98899  11.37944  1.000 22.17747 ? 147 SER A C   1 
ATOM   1129 O O   . SER A 1 147 ? -14.74557 -6.38592  10.92506  1.000 20.70031 ? 147 SER A O   1 
ATOM   1130 C CB  . SER A 1 147 ? -11.53411 -6.18678  10.59256  1.000 18.94029 ? 147 SER A CB  1 
ATOM   1131 O OG  . SER A 1 147 ? -10.45294 -6.36792  9.69982   1.000 20.31361 ? 147 SER A OG  1 
ATOM   1132 N N   . VAL A 1 148 ? -13.69663 -7.38697  12.64738  1.000 21.84451 ? 148 VAL A N   1 
ATOM   1133 C CA  . VAL A 1 148 ? -14.86632 -7.28148  13.50765  1.000 19.45227 ? 148 VAL A CA  1 
ATOM   1134 C C   . VAL A 1 148 ? -14.55676 -6.44230  14.74035  1.000 21.02675 ? 148 VAL A C   1 
ATOM   1135 O O   . VAL A 1 148 ? -13.40359 -6.27635  15.15126  1.000 23.44962 ? 148 VAL A O   1 
ATOM   1136 C CB  . VAL A 1 148 ? -15.42522 -8.66108  13.92252  1.000 23.63383 ? 148 VAL A CB  1 
ATOM   1137 C CG1 . VAL A 1 148 ? -15.82395 -9.47147  12.69137  1.000 20.71623 ? 148 VAL A CG1 1 
ATOM   1138 C CG2 . VAL A 1 148 ? -14.43087 -9.41816  14.78240  1.000 18.11682 ? 148 VAL A CG2 1 
ATOM   1139 N N   . GLY A 1 149 ? -15.62149 -5.89143  15.31579  1.000 19.19566 ? 149 GLY A N   1 
ATOM   1140 C CA  . GLY A 1 149 ? -15.54071 -5.16134  16.56451  1.000 22.70211 ? 149 GLY A CA  1 
ATOM   1141 C C   . GLY A 1 149 ? -16.29412 -5.93784  17.62380  1.000 22.02301 ? 149 GLY A C   1 
ATOM   1142 O O   . GLY A 1 149 ? -17.23573 -6.66913  17.31927  1.000 23.21597 ? 149 GLY A O   1 
ATOM   1143 N N   . PHE A 1 150 ? -15.86215 -5.79226  18.87515  1.000 23.63920 ? 150 PHE A N   1 
ATOM   1144 C CA  . PHE A 1 150 ? -16.36222 -6.69162  19.90276  1.000 21.19894 ? 150 PHE A CA  1 
ATOM   1145 C C   . PHE A 1 150 ? -16.15728 -6.09658  21.29004  1.000 25.06543 ? 150 PHE A C   1 
ATOM   1146 O O   . PHE A 1 150 ? -15.30966 -5.22635  21.50450  1.000 22.44780 ? 150 PHE A O   1 
ATOM   1147 C CB  . PHE A 1 150 ? -15.67372 -8.05882  19.80804  1.000 22.00424 ? 150 PHE A CB  1 
ATOM   1148 C CG  . PHE A 1 150 ? -14.18958 -7.99777  20.03897  1.000 22.71233 ? 150 PHE A CG  1 
ATOM   1149 C CD1 . PHE A 1 150 ? -13.32697 -7.64897  19.00788  1.000 23.95228 ? 150 PHE A CD1 1 
ATOM   1150 C CD2 . PHE A 1 150 ? -13.65923 -8.26643  21.29146  1.000 25.05425 ? 150 PHE A CD2 1 
ATOM   1151 C CE1 . PHE A 1 150 ? -11.96466 -7.57607  19.22615  1.000 26.11963 ? 150 PHE A CE1 1 
ATOM   1152 C CE2 . PHE A 1 150 ? -12.29685 -8.19847  21.51307  1.000 23.95406 ? 150 PHE A CE2 1 
ATOM   1153 C CZ  . PHE A 1 150 ? -11.45084 -7.85276  20.47990  1.000 24.03368 ? 150 PHE A CZ  1 
ATOM   1154 N N   . ASN A 1 151 ? -16.96456 -6.58473  22.22597  1.000 26.57317 ? 151 ASN A N   1 
ATOM   1155 C CA  . ASN A 1 151 ? -16.78912 -6.37635  23.65307  1.000 28.20635 ? 151 ASN A CA  1 
ATOM   1156 C C   . ASN A 1 151 ? -16.67571 -7.73872  24.32373  1.000 27.88510 ? 151 ASN A C   1 
ATOM   1157 O O   . ASN A 1 151 ? -17.09865 -8.75870  23.77306  1.000 26.67625 ? 151 ASN A O   1 
ATOM   1158 C CB  . ASN A 1 151 ? -17.96310 -5.59580  24.26712  1.000 27.07276 ? 151 ASN A CB  1 
ATOM   1159 C CG  . ASN A 1 151 ? -17.93518 -4.11651  23.92158  1.000 30.05394 ? 151 ASN A CG  1 
ATOM   1160 O OD1 . ASN A 1 151 ? -17.27956 -3.32683  24.59607  1.000 39.09505 ? 151 ASN A OD1 1 
ATOM   1161 N ND2 . ASN A 1 151 ? -18.66234 -3.73388  22.88291  1.000 24.41655 ? 151 ASN A ND2 1 
ATOM   1162 N N   . ILE A 1 152 ? -16.09770 -7.75732  25.52088  1.000 24.96137 ? 152 ILE A N   1 
ATOM   1163 C CA  . ILE A 1 152 ? -16.04452 -8.96709  26.33155  1.000 28.97573 ? 152 ILE A CA  1 
ATOM   1164 C C   . ILE A 1 152 ? -16.63529 -8.66200  27.69970  1.000 29.60818 ? 152 ILE A C   1 
ATOM   1165 O O   . ILE A 1 152 ? -16.33322 -7.62587  28.29834  1.000 30.30794 ? 152 ILE A O   1 
ATOM   1166 C CB  . ILE A 1 152 ? -14.60930 -9.51077  26.47551  1.000 32.27071 ? 152 ILE A CB  1 
ATOM   1167 C CG1 . ILE A 1 152 ? -13.93706 -9.62729  25.10878  1.000 31.64193 ? 152 ILE A CG1 1 
ATOM   1168 C CG2 . ILE A 1 152 ? -14.62944 -10.86845 27.16147  1.000 32.53252 ? 152 ILE A CG2 1 
ATOM   1169 C CD1 . ILE A 1 152 ? -12.51888 -10.14156 25.17054  1.000 35.50776 ? 152 ILE A CD1 1 
ATOM   1170 N N   . ASP A 1 153 ? -17.48479 -9.56081  28.18823  1.000 33.02676 ? 153 ASP A N   1 
ATOM   1171 C CA  . ASP A 1 153 ? -17.97947 -9.51239  29.55939  1.000 35.96722 ? 153 ASP A CA  1 
ATOM   1172 C C   . ASP A 1 153 ? -17.69618 -10.86562 30.19220  1.000 38.65804 ? 153 ASP A C   1 
ATOM   1173 O O   . ASP A 1 153 ? -18.22153 -11.88676 29.73470  1.000 34.45012 ? 153 ASP A O   1 
ATOM   1174 C CB  . ASP A 1 153 ? -19.47667 -9.18083  29.60958  1.000 49.43258 ? 153 ASP A CB  1 
ATOM   1175 C CG  . ASP A 1 153 ? -19.95978 -8.82991  31.01339  1.000 56.37104 ? 153 ASP A CG  1 
ATOM   1176 O OD1 . ASP A 1 153 ? -19.16824 -8.94706  31.97138  1.000 54.49503 ? 153 ASP A OD1 1 
ATOM   1177 O OD2 . ASP A 1 153 ? -21.13732 -8.43035  31.15832  1.000 64.06686 ? 153 ASP A OD2 1 
ATOM   1178 N N   . TYR A 1 154 ? -16.85546 -10.86982 31.22786  1.000 34.14346 ? 154 TYR A N   1 
ATOM   1179 C CA  . TYR A 1 154 ? -16.39617 -12.09540 31.87136  1.000 35.19664 ? 154 TYR A CA  1 
ATOM   1180 C C   . TYR A 1 154 ? -15.73037 -13.02054 30.85531  1.000 40.55269 ? 154 TYR A C   1 
ATOM   1181 O O   . TYR A 1 154 ? -14.55168 -12.84082 30.53444  1.000 41.89232 ? 154 TYR A O   1 
ATOM   1182 C CB  . TYR A 1 154 ? -17.55224 -12.80018 32.58991  1.000 37.23770 ? 154 TYR A CB  1 
ATOM   1183 C CG  . TYR A 1 154 ? -17.10316 -13.94544 33.47029  1.000 44.64229 ? 154 TYR A CG  1 
ATOM   1184 C CD1 . TYR A 1 154 ? -16.13590 -13.75219 34.44936  1.000 42.37249 ? 154 TYR A CD1 1 
ATOM   1185 C CD2 . TYR A 1 154 ? -17.64661 -15.21847 33.32618  1.000 44.29199 ? 154 TYR A CD2 1 
ATOM   1186 C CE1 . TYR A 1 154 ? -15.71643 -14.79456 35.25571  1.000 47.58669 ? 154 TYR A CE1 1 
ATOM   1187 C CE2 . TYR A 1 154 ? -17.23544 -16.26524 34.13118  1.000 39.81849 ? 154 TYR A CE2 1 
ATOM   1188 C CZ  . TYR A 1 154 ? -16.26770 -16.04750 35.09108  1.000 47.59445 ? 154 TYR A CZ  1 
ATOM   1189 O OH  . TYR A 1 154 ? -15.85372 -17.08178 35.89730  1.000 49.44474 ? 154 TYR A OH  1 
ATOM   1190 N N   . ASP A 1 155 ? -16.46805 -14.00089 30.32927  1.000 33.92159 ? 155 ASP A N   1 
ATOM   1191 C CA  . ASP A 1 155 ? -15.90078 -14.97734 29.40339  1.000 35.81053 ? 155 ASP A CA  1 
ATOM   1192 C C   . ASP A 1 155 ? -16.61098 -15.00658 28.05475  1.000 37.97124 ? 155 ASP A C   1 
ATOM   1193 O O   . ASP A 1 155 ? -16.36024 -15.91508 27.25180  1.000 37.39591 ? 155 ASP A O   1 
ATOM   1194 C CB  . ASP A 1 155 ? -15.92860 -16.37650 30.02668  1.000 39.65456 ? 155 ASP A CB  1 
ATOM   1195 C CG  . ASP A 1 155 ? -17.34290 -16.85592 30.33011  1.000 46.96808 ? 155 ASP A CG  1 
ATOM   1196 O OD1 . ASP A 1 155 ? -18.29631 -16.05230 30.21353  1.000 38.46092 ? 155 ASP A OD1 1 
ATOM   1197 O OD2 . ASP A 1 155 ? -17.50045 -18.04243 30.68793  1.000 50.35653 ? 155 ASP A OD2 1 
ATOM   1198 N N   . CYS A 1 156 ? -17.48304 -14.04181 27.78135  1.000 29.35559 ? 156 CYS A N   1 
ATOM   1199 C CA  . CYS A 1 156 ? -18.35137 -14.07195 26.61265  1.000 25.06324 ? 156 CYS A CA  1 
ATOM   1200 C C   . CYS A 1 156 ? -18.03012 -12.89153 25.70380  1.000 30.02041 ? 156 CYS A C   1 
ATOM   1201 O O   . CYS A 1 156 ? -18.03786 -11.73917 26.15260  1.000 29.30866 ? 156 CYS A O   1 
ATOM   1202 C CB  . CYS A 1 156 ? -19.81611 -14.04533 27.04644  1.000 32.14418 ? 156 CYS A CB  1 
ATOM   1203 S SG  . CYS A 1 156 ? -20.97320 -14.00438 25.68015  1.000 35.93669 ? 156 CYS A SG  1 
ATOM   1204 N N   . VAL A 1 157 ? -17.75822 -13.18141 24.43170  1.000 26.25846 ? 157 VAL A N   1 
ATOM   1205 C CA  . VAL A 1 157 ? -17.47517 -12.15602 23.42867  1.000 28.01100 ? 157 VAL A CA  1 
ATOM   1206 C C   . VAL A 1 157 ? -18.78231 -11.72277 22.77839  1.000 24.16838 ? 157 VAL A C   1 
ATOM   1207 O O   . VAL A 1 157 ? -19.49653 -12.54503 22.19771  1.000 23.55162 ? 157 VAL A O   1 
ATOM   1208 C CB  . VAL A 1 157 ? -16.49242 -12.67093 22.36444  1.000 22.87708 ? 157 VAL A CB  1 
ATOM   1209 C CG1 . VAL A 1 157 ? -16.19750 -11.57641 21.32301  1.000 21.95807 ? 157 VAL A CG1 1 
ATOM   1210 C CG2 . VAL A 1 157 ? -15.21039 -13.16837 23.01850  1.000 25.60920 ? 157 VAL A CG2 1 
ATOM   1211 N N   . SER A 1 158 ? -19.08423 -10.43025 22.85214  1.000 24.23880 ? 158 SER A N   1 
ATOM   1212 C CA  . SER A 1 158 ? -20.21174 -9.84682  22.13708  1.000 26.64369 ? 158 SER A CA  1 
ATOM   1213 C C   . SER A 1 158 ? -19.67291 -9.19348  20.87314  1.000 23.44477 ? 158 SER A C   1 
ATOM   1214 O O   . SER A 1 158 ? -18.99684 -8.16294  20.93941  1.000 22.00844 ? 158 SER A O   1 
ATOM   1215 C CB  . SER A 1 158 ? -20.95565 -8.83330  23.00215  1.000 27.94607 ? 158 SER A CB  1 
ATOM   1216 O OG  . SER A 1 158 ? -21.73602 -9.49660  23.97396  1.000 31.39157 ? 158 SER A OG  1 
ATOM   1217 N N   . PHE A 1 159 ? -19.94631 -9.80765  19.72724  1.000 19.85529 ? 159 PHE A N   1 
ATOM   1218 C CA  . PHE A 1 159 ? -19.59956 -9.19901  18.45232  1.000 21.07528 ? 159 PHE A CA  1 
ATOM   1219 C C   . PHE A 1 159 ? -20.66687 -8.18078  18.08694  1.000 27.34155 ? 159 PHE A C   1 
ATOM   1220 O O   . PHE A 1 159 ? -21.86431 -8.47312  18.16541  1.000 25.50151 ? 159 PHE A O   1 
ATOM   1221 C CB  . PHE A 1 159 ? -19.49047 -10.25860 17.35831  1.000 21.55143 ? 159 PHE A CB  1 
ATOM   1222 C CG  . PHE A 1 159 ? -18.38643 -11.24828 17.57668  1.000 19.77786 ? 159 PHE A CG  1 
ATOM   1223 C CD1 . PHE A 1 159 ? -17.08608 -10.93744 17.21426  1.000 22.18974 ? 159 PHE A CD1 1 
ATOM   1224 C CD2 . PHE A 1 159 ? -18.64956 -12.50038 18.11424  1.000 20.42406 ? 159 PHE A CD2 1 
ATOM   1225 C CE1 . PHE A 1 159 ? -16.06340 -11.84800 17.40039  1.000 21.26202 ? 159 PHE A CE1 1 
ATOM   1226 C CE2 . PHE A 1 159 ? -17.63032 -13.41947 18.30698  1.000 22.55925 ? 159 PHE A CE2 1 
ATOM   1227 C CZ  . PHE A 1 159 ? -16.33553 -13.09311 17.94616  1.000 23.28005 ? 159 PHE A CZ  1 
ATOM   1228 N N   . CYS A 1 160 ? -20.23511 -6.98223  17.69544  1.000 23.49108 ? 160 CYS A N   1 
ATOM   1229 C CA  . CYS A 1 160 ? -21.16925 -5.91773  17.37155  1.000 22.11958 ? 160 CYS A CA  1 
ATOM   1230 C C   . CYS A 1 160 ? -20.90674 -5.23993  16.03819  1.000 21.27328 ? 160 CYS A C   1 
ATOM   1231 O O   . CYS A 1 160 ? -21.77884 -4.49947  15.57036  1.000 25.62511 ? 160 CYS A O   1 
ATOM   1232 C CB  . CYS A 1 160 ? -21.17105 -4.84699  18.47307  1.000 25.82335 ? 160 CYS A CB  1 
ATOM   1233 S SG  . CYS A 1 160 ? -19.56063 -4.09204  18.80272  1.000 27.74560 ? 160 CYS A SG  1 
ATOM   1234 N N   . TYR A 1 161 ? -19.76258 -5.47405  15.40070  1.000 21.39985 ? 161 TYR A N   1 
ATOM   1235 C CA  . TYR A 1 161 ? -19.41501 -4.72757  14.20031  1.000 21.52036 ? 161 TYR A CA  1 
ATOM   1236 C C   . TYR A 1 161 ? -18.62372 -5.62175  13.25904  1.000 19.78705 ? 161 TYR A C   1 
ATOM   1237 O O   . TYR A 1 161 ? -17.76291 -6.38589  13.69803  1.000 21.69945 ? 161 TYR A O   1 
ATOM   1238 C CB  . TYR A 1 161 ? -18.60553 -3.46747  14.55706  1.000 21.49900 ? 161 TYR A CB  1 
ATOM   1239 C CG  . TYR A 1 161 ? -18.13579 -2.64987  13.36950  1.000 21.76460 ? 161 TYR A CG  1 
ATOM   1240 C CD1 . TYR A 1 161 ? -18.97539 -1.71570  12.77378  1.000 22.83160 ? 161 TYR A CD1 1 
ATOM   1241 C CD2 . TYR A 1 161 ? -16.84734 -2.79942  12.85555  1.000 21.67823 ? 161 TYR A CD2 1 
ATOM   1242 C CE1 . TYR A 1 161 ? -18.55673 -0.95916  11.69566  1.000 21.45678 ? 161 TYR A CE1 1 
ATOM   1243 C CE2 . TYR A 1 161 ? -16.41656 -2.04772  11.77768  1.000 17.22601 ? 161 TYR A CE2 1 
ATOM   1244 C CZ  . TYR A 1 161 ? -17.28114 -1.13142  11.19489  1.000 18.77902 ? 161 TYR A CZ  1 
ATOM   1245 O OH  . TYR A 1 161 ? -16.88353 -0.36817  10.12449  1.000 21.96824 ? 161 TYR A OH  1 
ATOM   1246 N N   . MET A 1 162 ? -18.93669 -5.53636  11.96945  1.000 20.32710 ? 162 MET A N   1 
ATOM   1247 C CA  . MET A 1 162 ? -18.09908 -6.10626  10.92245  1.000 21.17062 ? 162 MET A CA  1 
ATOM   1248 C C   . MET A 1 162 ? -17.80230 -5.01409  9.90961   1.000 20.72459 ? 162 MET A C   1 
ATOM   1249 O O   . MET A 1 162 ? -18.71833 -4.32473  9.44671   1.000 18.72623 ? 162 MET A O   1 
ATOM   1250 C CB  . MET A 1 162 ? -18.76105 -7.30424  10.23654  1.000 19.11411 ? 162 MET A CB  1 
ATOM   1251 C CG  . MET A 1 162 ? -17.94947 -7.82693  9.05679   1.000 19.22532 ? 162 MET A CG  1 
ATOM   1252 S SD  . MET A 1 162 ? -18.47795 -9.44413  8.45941   1.000 25.68813 ? 162 MET A SD  1 
ATOM   1253 C CE  . MET A 1 162 ? -17.61227 -10.53259 9.59554   1.000 27.78103 ? 162 MET A CE  1 
ATOM   1254 N N   . HIS A 1 163 ? -16.53212 -4.85307  9.56488   1.000 21.34002 ? 163 HIS A N   1 
ATOM   1255 C CA  . HIS A 1 163 ? -16.14288 -3.71556  8.74751   1.000 21.57630 ? 163 HIS A CA  1 
ATOM   1256 C C   . HIS A 1 163 ? -16.46171 -3.94745  7.27699   1.000 19.90563 ? 163 HIS A C   1 
ATOM   1257 O O   . HIS A 1 163 ? -16.25378 -5.04038  6.74048   1.000 21.30666 ? 163 HIS A O   1 
ATOM   1258 C CB  . HIS A 1 163 ? -14.65599 -3.41037  8.90244   1.000 21.58647 ? 163 HIS A CB  1 
ATOM   1259 C CG  . HIS A 1 163 ? -14.22492 -2.23558  8.09043   1.000 19.66573 ? 163 HIS A CG  1 
ATOM   1260 N ND1 . HIS A 1 163 ? -14.80979 -0.99448  8.22353   1.000 20.89079 ? 163 HIS A ND1 1 
ATOM   1261 C CD2 . HIS A 1 163 ? -13.31561 -2.12097  7.09407   1.000 19.66946 ? 163 HIS A CD2 1 
ATOM   1262 C CE1 . HIS A 1 163 ? -14.26564 -0.16094  7.35626   1.000 21.30343 ? 163 HIS A CE1 1 
ATOM   1263 N NE2 . HIS A 1 163 ? -13.35703 -0.81877  6.65905   1.000 19.19093 ? 163 HIS A NE2 1 
ATOM   1264 N N   . HIS A 1 164 ? -16.95407 -2.89545  6.62091   1.000 20.59285 ? 164 HIS A N   1 
ATOM   1265 C CA  . HIS A 1 164 ? -17.21574 -2.94339  5.19157   1.000 19.21896 ? 164 HIS A CA  1 
ATOM   1266 C C   . HIS A 1 164 ? -16.48270 -1.87086  4.40120   1.000 19.19389 ? 164 HIS A C   1 
ATOM   1267 O O   . HIS A 1 164 ? -15.76468 -2.20532  3.45462   1.000 22.64500 ? 164 HIS A O   1 
ATOM   1268 C CB  . HIS A 1 164 ? -18.72034 -2.84614  4.90457   1.000 16.46177 ? 164 HIS A CB  1 
ATOM   1269 C CG  . HIS A 1 164 ? -19.48737 -4.06705  5.30018   1.000 18.48345 ? 164 HIS A CG  1 
ATOM   1270 N ND1 . HIS A 1 164 ? -20.15307 -4.85827  4.39001   1.000 18.99325 ? 164 HIS A ND1 1 
ATOM   1271 C CD2 . HIS A 1 164 ? -19.70175 -4.62666  6.51353   1.000 19.43676 ? 164 HIS A CD2 1 
ATOM   1272 C CE1 . HIS A 1 164 ? -20.75222 -5.84850  5.02675   1.000 18.70783 ? 164 HIS A CE1 1 
ATOM   1273 N NE2 . HIS A 1 164 ? -20.48982 -5.73416  6.31648   1.000 22.32450 ? 164 HIS A NE2 1 
ATOM   1274 N N   A MET A 1 165 ? -16.63479 -0.59569  4.74735   0.489 21.01574 ? 165 MET A N   1 
ATOM   1275 N N   B MET A 1 165 ? -16.63065 -0.59609  4.74915   0.511 21.37797 ? 165 MET A N   1 
ATOM   1276 C CA  A MET A 1 165 ? -16.22306 0.43216   3.80258   0.489 22.31992 ? 165 MET A CA  1 
ATOM   1277 C CA  B MET A 1 165 ? -16.22691 0.43330   3.80236   0.511 22.31966 ? 165 MET A CA  1 
ATOM   1278 C C   A MET A 1 165 ? -15.72586 1.69005   4.50057   0.489 21.66250 ? 165 MET A C   1 
ATOM   1279 C C   B MET A 1 165 ? -15.72922 1.69204   4.49949   0.511 21.66809 ? 165 MET A C   1 
ATOM   1280 O O   A MET A 1 165 ? -15.89196 1.88157   5.70905   0.489 19.49799 ? 165 MET A O   1 
ATOM   1281 O O   B MET A 1 165 ? -15.89939 1.88599   5.70698   0.511 19.33729 ? 165 MET A O   1 
ATOM   1282 C CB  A MET A 1 165 ? -17.36714 0.77830   2.85392   0.489 25.51458 ? 165 MET A CB  1 
ATOM   1283 C CB  B MET A 1 165 ? -17.37923 0.77413   2.86038   0.511 25.50753 ? 165 MET A CB  1 
ATOM   1284 C CG  A MET A 1 165 ? -18.60550 1.28589   3.53430   0.489 25.90505 ? 165 MET A CG  1 
ATOM   1285 C CG  B MET A 1 165 ? -18.70865 0.88257   3.54865   0.511 26.64738 ? 165 MET A CG  1 
ATOM   1286 S SD  A MET A 1 165 ? -20.03736 0.99368   2.48100   0.489 35.00099 ? 165 MET A SD  1 
ATOM   1287 S SD  B MET A 1 165 ? -20.00660 1.15997   2.34170   0.511 35.02095 ? 165 MET A SD  1 
ATOM   1288 C CE  A MET A 1 165 ? -19.27019 0.76811   0.87691   0.489 31.39666 ? 165 MET A CE  1 
ATOM   1289 C CE  B MET A 1 165 ? -20.82880 2.56181   3.08965   0.511 23.67590 ? 165 MET A CE  1 
ATOM   1290 N N   . GLU A 1 166 ? -15.11882 2.55737   3.69272   1.000 20.95118 ? 166 GLU A N   1 
ATOM   1291 C CA  . GLU A 1 166 ? -14.55897 3.82208   4.13200   1.000 20.34574 ? 166 GLU A CA  1 
ATOM   1292 C C   . GLU A 1 166 ? -15.31166 4.96119   3.45876   1.000 25.89042 ? 166 GLU A C   1 
ATOM   1293 O O   . GLU A 1 166 ? -15.64547 4.87733   2.27015   1.000 26.96552 ? 166 GLU A O   1 
ATOM   1294 C CB  . GLU A 1 166 ? -13.07544 3.88606   3.78011   1.000 27.91183 ? 166 GLU A CB  1 
ATOM   1295 C CG  . GLU A 1 166 ? -12.32240 5.03427   4.40158   1.000 29.83841 ? 166 GLU A CG  1 
ATOM   1296 C CD  . GLU A 1 166 ? -10.83077 4.88778   4.19564   1.000 32.38631 ? 166 GLU A CD  1 
ATOM   1297 O OE1 . GLU A 1 166 ? -10.33885 5.30034   3.12228   1.000 37.71977 ? 166 GLU A OE1 1 
ATOM   1298 O OE2 . GLU A 1 166 ? -10.15630 4.34911   5.10086   1.000 26.77863 ? 166 GLU A OE2 1 
ATOM   1299 N N   . LEU A 1 167 ? -15.57554 6.01307   4.22455   1.000 26.71091 ? 167 LEU A N   1 
ATOM   1300 C CA  . LEU A 1 167 ? -16.30127 7.20788   3.81041   1.000 28.23073 ? 167 LEU A CA  1 
ATOM   1301 C C   . LEU A 1 167 ? -15.38602 8.42859   3.80838   1.000 37.71877 ? 167 LEU A C   1 
ATOM   1302 O O   . LEU A 1 167 ? -14.31309 8.41338   4.42243   1.000 32.55789 ? 167 LEU A O   1 
ATOM   1303 C CB  . LEU A 1 167 ? -17.48189 7.46279   4.75708   1.000 27.11565 ? 167 LEU A CB  1 
ATOM   1304 C CG  . LEU A 1 167 ? -18.52911 6.35698   4.83930   1.000 29.98229 ? 167 LEU A CG  1 
ATOM   1305 C CD1 . LEU A 1 167 ? -19.40585 6.57227   6.05603   1.000 32.46413 ? 167 LEU A CD1 1 
ATOM   1306 C CD2 . LEU A 1 167 ? -19.36731 6.32708   3.57063   1.000 31.34749 ? 167 LEU A CD2 1 
ATOM   1307 N N   . PRO A 1 168 ? -15.77836 9.50800   3.12462   1.000 34.20710 ? 168 PRO A N   1 
ATOM   1308 C CA  . PRO A 1 168 ? -14.97549 10.73693  3.16795   1.000 34.52213 ? 168 PRO A CA  1 
ATOM   1309 C C   . PRO A 1 168 ? -14.84077 11.26754  4.58543   1.000 40.07225 ? 168 PRO A C   1 
ATOM   1310 O O   . PRO A 1 168 ? -15.72341 11.08502  5.42753   1.000 35.58181 ? 168 PRO A O   1 
ATOM   1311 C CB  . PRO A 1 168 ? -15.75956 11.71170  2.27839   1.000 38.45533 ? 168 PRO A CB  1 
ATOM   1312 C CG  . PRO A 1 168 ? -17.12435 11.09376  2.10807   1.000 38.85254 ? 168 PRO A CG  1 
ATOM   1313 C CD  . PRO A 1 168 ? -16.89735 9.61748   2.17309   1.000 36.43142 ? 168 PRO A CD  1 
ATOM   1314 N N   . THR A 1 169 ? -13.72181 11.95380  4.82168   1.000 46.62874 ? 169 THR A N   1 
ATOM   1315 C CA  . THR A 1 169 ? -13.17585 12.37454  6.11763   1.000 55.30077 ? 169 THR A CA  1 
ATOM   1316 C C   . THR A 1 169 ? -12.46046 11.20559  6.78025   1.000 45.41770 ? 169 THR A C   1 
ATOM   1317 O O   . THR A 1 169 ? -12.07367 11.31225  7.95303   1.000 42.08566 ? 169 THR A O   1 
ATOM   1318 C CB  . THR A 1 169 ? -14.20735 12.96208  7.09641   1.000 55.70453 ? 169 THR A CB  1 
ATOM   1319 O OG1 . THR A 1 169 ? -15.14969 11.95503  7.48848   1.000 54.76724 ? 169 THR A OG1 1 
ATOM   1320 C CG2 . THR A 1 169 ? -14.95440 14.13050  6.46538   1.000 60.16116 ? 169 THR A CG2 1 
ATOM   1321 N N   . GLY A 1 170 ? -12.26553 10.09867  6.06981   1.000 43.25972 ? 170 GLY A N   1 
ATOM   1322 C CA  . GLY A 1 170 ? -11.51077 8.98239   6.61923   1.000 32.59697 ? 170 GLY A CA  1 
ATOM   1323 C C   . GLY A 1 170 ? -12.18571 8.27890   7.77665   1.000 35.95369 ? 170 GLY A C   1 
ATOM   1324 O O   . GLY A 1 170 ? -11.51356 7.88835   8.74162   1.000 34.55270 ? 170 GLY A O   1 
ATOM   1325 N N   . VAL A 1 171 ? -13.50844 8.12312   7.71276   1.000 26.16705 ? 171 VAL A N   1 
ATOM   1326 C CA  . VAL A 1 171 ? -14.23653 7.36300   8.72054   1.000 21.69021 ? 171 VAL A CA  1 
ATOM   1327 C C   . VAL A 1 171 ? -14.84797 6.13950   8.05364   1.000 20.28345 ? 171 VAL A C   1 
ATOM   1328 O O   . VAL A 1 171 ? -14.76929 5.97568   6.83186   1.000 23.20925 ? 171 VAL A O   1 
ATOM   1329 C CB  . VAL A 1 171 ? -15.30921 8.21316   9.42568   1.000 28.20915 ? 171 VAL A CB  1 
ATOM   1330 C CG1 . VAL A 1 171 ? -14.66068 9.42246   10.10514  1.000 32.36122 ? 171 VAL A CG1 1 
ATOM   1331 C CG2 . VAL A 1 171 ? -16.39096 8.63576   8.45012   1.000 25.49240 ? 171 VAL A CG2 1 
ATOM   1332 N N   . HIS A 1 172 ? -15.47244 5.27522   8.84298   1.000 21.77318 ? 172 HIS A N   1 
ATOM   1333 C CA  . HIS A 1 172 ? -15.73992 3.92629   8.36816   1.000 22.67653 ? 172 HIS A CA  1 
ATOM   1334 C C   . HIS A 1 172 ? -17.15347 3.50059   8.72508   1.000 22.06789 ? 172 HIS A C   1 
ATOM   1335 O O   . HIS A 1 172 ? -17.75217 4.00344   9.67855   1.000 22.50777 ? 172 HIS A O   1 
ATOM   1336 C CB  . HIS A 1 172 ? -14.69767 2.96379   8.94058   1.000 21.82289 ? 172 HIS A CB  1 
ATOM   1337 C CG  . HIS A 1 172 ? -13.29544 3.35658   8.59802   1.000 20.20507 ? 172 HIS A CG  1 
ATOM   1338 N ND1 . HIS A 1 172 ? -12.46796 4.01963   9.48052   1.000 21.06003 ? 172 HIS A ND1 1 
ATOM   1339 C CD2 . HIS A 1 172 ? -12.59015 3.22091   7.45005   1.000 21.44235 ? 172 HIS A CD2 1 
ATOM   1340 C CE1 . HIS A 1 172 ? -11.30617 4.25616   8.89635   1.000 20.66759 ? 172 HIS A CE1 1 
ATOM   1341 N NE2 . HIS A 1 172 ? -11.35353 3.77924   7.66515   1.000 25.04170 ? 172 HIS A NE2 1 
ATOM   1342 N N   . ALA A 1 173 ? -17.67974 2.56880   7.93314   1.000 21.25982 ? 173 ALA A N   1 
ATOM   1343 C CA  . ALA A 1 173 ? -19.04490 2.09964   8.08117   1.000 19.39375 ? 173 ALA A CA  1 
ATOM   1344 C C   . ALA A 1 173 ? -19.07115 0.59393   7.91216   1.000 20.65280 ? 173 ALA A C   1 
ATOM   1345 O O   . ALA A 1 173 ? -18.26903 0.02191   7.17088   1.000 20.57848 ? 173 ALA A O   1 
ATOM   1346 C CB  . ALA A 1 173 ? -19.98212 2.74989   7.05874   1.000 22.83547 ? 173 ALA A CB  1 
ATOM   1347 N N   . GLY A 1 174 ? -20.00385 -0.03896  8.60719   1.000 18.65329 ? 174 GLY A N   1 
ATOM   1348 C CA  . GLY A 1 174 ? -20.11413 -1.47694  8.54166   1.000 17.46358 ? 174 GLY A CA  1 
ATOM   1349 C C   . GLY A 1 174 ? -21.40792 -1.91379  9.18189   1.000 20.13964 ? 174 GLY A C   1 
ATOM   1350 O O   . GLY A 1 174 ? -22.27882 -1.09623  9.48082   1.000 18.84366 ? 174 GLY A O   1 
ATOM   1351 N N   . THR A 1 175 ? -21.51295 -3.21837  9.41445   1.000 21.52198 ? 175 THR A N   1 
ATOM   1352 C CA  . THR A 1 175 ? -22.77547 -3.83587  9.79594   1.000 17.45326 ? 175 THR A CA  1 
ATOM   1353 C C   . THR A 1 175 ? -22.65843 -4.50490  11.16031  1.000 22.21671 ? 175 THR A C   1 
ATOM   1354 O O   . THR A 1 175 ? -21.56354 -4.72832  11.68659  1.000 20.32684 ? 175 THR A O   1 
ATOM   1355 C CB  . THR A 1 175 ? -23.20389 -4.88210  8.75607   1.000 17.86994 ? 175 THR A CB  1 
ATOM   1356 O OG1 . THR A 1 175 ? -22.24520 -5.94806  8.73127   1.000 20.86958 ? 175 THR A OG1 1 
ATOM   1357 C CG2 . THR A 1 175 ? -23.29638 -4.26844  7.37198   1.000 15.96647 ? 175 THR A CG2 1 
ATOM   1358 N N   . ASP A 1 176 ? -23.80855 -4.84386  11.73300  1.000 18.75309 ? 176 ASP A N   1 
ATOM   1359 C CA  . ASP A 1 176 ? -23.77780 -5.81089  12.81661  1.000 22.49396 ? 176 ASP A CA  1 
ATOM   1360 C C   . ASP A 1 176 ? -23.57734 -7.20529  12.21756  1.000 22.36868 ? 176 ASP A C   1 
ATOM   1361 O O   . ASP A 1 176 ? -23.46322 -7.37537  10.99716  1.000 20.70365 ? 176 ASP A O   1 
ATOM   1362 C CB  . ASP A 1 176 ? -25.03535 -5.69668  13.68452  1.000 19.68853 ? 176 ASP A CB  1 
ATOM   1363 C CG  . ASP A 1 176 ? -26.32063 -5.98459  12.92661  1.000 25.23843 ? 176 ASP A CG  1 
ATOM   1364 O OD1 . ASP A 1 176 ? -26.27650 -6.64126  11.87011  1.000 24.45377 ? 176 ASP A OD1 1 
ATOM   1365 O OD2 . ASP A 1 176 ? -27.39200 -5.54796  13.40273  1.000 25.80161 ? 176 ASP A OD2 1 
ATOM   1366 N N   . LEU A 1 177 ? -23.52498 -8.22303  13.06981  1.000 18.90229 ? 177 LEU A N   1 
ATOM   1367 C CA  . LEU A 1 177 ? -23.27460 -9.56932  12.56873  1.000 19.61767 ? 177 LEU A CA  1 
ATOM   1368 C C   . LEU A 1 177 ? -24.51413 -10.20865 11.95524  1.000 29.26780 ? 177 LEU A C   1 
ATOM   1369 O O   . LEU A 1 177 ? -24.43154 -11.34275 11.46867  1.000 25.82615 ? 177 LEU A O   1 
ATOM   1370 C CB  . LEU A 1 177 ? -22.70480 -10.45067 13.68436  1.000 20.02896 ? 177 LEU A CB  1 
ATOM   1371 C CG  . LEU A 1 177 ? -21.17331 -10.46369 13.78171  1.000 27.46675 ? 177 LEU A CG  1 
ATOM   1372 C CD1 . LEU A 1 177 ? -20.58181 -11.08779 12.53610  1.000 25.54808 ? 177 LEU A CD1 1 
ATOM   1373 C CD2 . LEU A 1 177 ? -20.59830 -9.07220  13.99545  1.000 24.71566 ? 177 LEU A CD2 1 
ATOM   1374 N N   . GLU A 1 178 ? -25.65374 -9.51703  11.96912  1.000 21.65075 ? 178 GLU A N   1 
ATOM   1375 C CA  . GLU A 1 178 ? -26.80760 -9.90645  11.17138  1.000 27.33252 ? 178 GLU A CA  1 
ATOM   1376 C C   . GLU A 1 178 ? -26.79428 -9.25565  9.79614   1.000 22.56710 ? 178 GLU A C   1 
ATOM   1377 O O   . GLU A 1 178 ? -27.71785 -9.47928  9.00616   1.000 25.68730 ? 178 GLU A O   1 
ATOM   1378 C CB  . GLU A 1 178 ? -28.10434 -9.55705  11.90915  1.000 25.99524 ? 178 GLU A CB  1 
ATOM   1379 C CG  . GLU A 1 178 ? -28.27217 -10.33060 13.20809  1.000 31.42729 ? 178 GLU A CG  1 
ATOM   1380 C CD  . GLU A 1 178 ? -29.57491 -10.02253 13.92258  1.000 50.60595 ? 178 GLU A CD  1 
ATOM   1381 O OE1 . GLU A 1 178 ? -30.32120 -9.12847  13.46400  1.000 45.91318 ? 178 GLU A OE1 1 
ATOM   1382 O OE2 . GLU A 1 178 ? -29.85071 -10.68251 14.94734  1.000 56.46580 ? 178 GLU A OE2 1 
ATOM   1383 N N   . GLY A 1 179 ? -25.76389 -8.47077  9.48962   1.000 21.77836 ? 179 GLY A N   1 
ATOM   1384 C CA  . GLY A 1 179 ? -25.61620 -7.88766  8.17561   1.000 23.40821 ? 179 GLY A CA  1 
ATOM   1385 C C   . GLY A 1 179 ? -26.32703 -6.57399  7.95956   1.000 18.32855 ? 179 GLY A C   1 
ATOM   1386 O O   . GLY A 1 179 ? -26.32538 -6.07439  6.83321   1.000 20.64852 ? 179 GLY A O   1 
ATOM   1387 N N   . ASN A 1 180 ? -26.92787 -5.99259  8.99261   1.000 21.54495 ? 180 ASN A N   1 
ATOM   1388 C CA  . ASN A 1 180 ? -27.60201 -4.70657  8.85938   1.000 23.73440 ? 180 ASN A CA  1 
ATOM   1389 C C   . ASN A 1 180 ? -26.62292 -3.57538  9.13997   1.000 21.48493 ? 180 ASN A C   1 
ATOM   1390 O O   . ASN A 1 180 ? -25.99935 -3.53875  10.20477  1.000 20.31723 ? 180 ASN A O   1 
ATOM   1391 C CB  . ASN A 1 180 ? -28.79247 -4.62311  9.81303   1.000 23.74339 ? 180 ASN A CB  1 
ATOM   1392 C CG  . ASN A 1 180 ? -29.94130 -5.48952  9.36735   1.000 28.01550 ? 180 ASN A CG  1 
ATOM   1393 O OD1 . ASN A 1 180 ? -30.35818 -5.43220  8.21051   1.000 28.94482 ? 180 ASN A OD1 1 
ATOM   1394 N ND2 . ASN A 1 180 ? -30.45148 -6.31160  10.27383  1.000 25.46612 ? 180 ASN A ND2 1 
ATOM   1395 N N   . PHE A 1 181 ? -26.49063 -2.65666  8.18551   1.000 20.87441 ? 181 PHE A N   1 
ATOM   1396 C CA  . PHE A 1 181 ? -25.58589 -1.53503  8.38656   1.000 21.78897 ? 181 PHE A CA  1 
ATOM   1397 C C   . PHE A 1 181 ? -25.99653 -0.72379  9.60606   1.000 23.89006 ? 181 PHE A C   1 
ATOM   1398 O O   . PHE A 1 181 ? -27.18054 -0.58988  9.92163   1.000 21.01386 ? 181 PHE A O   1 
ATOM   1399 C CB  . PHE A 1 181 ? -25.54711 -0.63775  7.14403   1.000 20.27952 ? 181 PHE A CB  1 
ATOM   1400 C CG  . PHE A 1 181 ? -24.40224 -0.94906  6.22714   1.000 22.04164 ? 181 PHE A CG  1 
ATOM   1401 C CD1 . PHE A 1 181 ? -23.16250 -0.35404  6.42380   1.000 21.20000 ? 181 PHE A CD1 1 
ATOM   1402 C CD2 . PHE A 1 181 ? -24.55064 -1.85860  5.18441   1.000 21.36530 ? 181 PHE A CD2 1 
ATOM   1403 C CE1 . PHE A 1 181 ? -22.08856 -0.65417  5.58572   1.000 21.35386 ? 181 PHE A CE1 1 
ATOM   1404 C CE2 . PHE A 1 181 ? -23.48014 -2.16426  4.34995   1.000 19.73011 ? 181 PHE A CE2 1 
ATOM   1405 C CZ  . PHE A 1 181 ? -22.24915 -1.55845  4.54794   1.000 19.51840 ? 181 PHE A CZ  1 
ATOM   1406 N N   . TYR A 1 182 ? -25.00307 -0.22435  10.32402  1.000 19.58120 ? 182 TYR A N   1 
ATOM   1407 C CA  . TYR A 1 182 ? -25.25069 0.88521   11.22407  1.000 21.73477 ? 182 TYR A CA  1 
ATOM   1408 C C   . TYR A 1 182 ? -25.45004 2.13896   10.38807  1.000 21.59571 ? 182 TYR A C   1 
ATOM   1409 O O   . TYR A 1 182 ? -24.69665 2.39126   9.44376   1.000 23.63403 ? 182 TYR A O   1 
ATOM   1410 C CB  . TYR A 1 182 ? -24.08686 1.05314   12.19361  1.000 23.47043 ? 182 TYR A CB  1 
ATOM   1411 C CG  . TYR A 1 182 ? -24.01370 -0.05051  13.21950  1.000 22.82164 ? 182 TYR A CG  1 
ATOM   1412 C CD1 . TYR A 1 182 ? -24.80312 -0.00950  14.36011  1.000 24.28513 ? 182 TYR A CD1 1 
ATOM   1413 C CD2 . TYR A 1 182 ? -23.16185 -1.13877  13.04748  1.000 22.96752 ? 182 TYR A CD2 1 
ATOM   1414 C CE1 . TYR A 1 182 ? -24.74372 -1.01355  15.30799  1.000 23.77261 ? 182 TYR A CE1 1 
ATOM   1415 C CE2 . TYR A 1 182 ? -23.09723 -2.14870  13.98811  1.000 24.46019 ? 182 TYR A CE2 1 
ATOM   1416 C CZ  . TYR A 1 182 ? -23.88995 -2.08096  15.11958  1.000 25.77236 ? 182 TYR A CZ  1 
ATOM   1417 O OH  . TYR A 1 182 ? -23.83655 -3.08377  16.06003  1.000 22.92760 ? 182 TYR A OH  1 
ATOM   1418 N N   . GLY A 1 183 ? -26.48948 2.90194   10.70258  1.000 23.70427 ? 183 GLY A N   1 
ATOM   1419 C CA  . GLY A 1 183 ? -26.78436 4.10619   9.96326   1.000 21.19908 ? 183 GLY A CA  1 
ATOM   1420 C C   . GLY A 1 183 ? -27.37449 3.83764   8.59593   1.000 26.85158 ? 183 GLY A C   1 
ATOM   1421 O O   . GLY A 1 183 ? -27.80651 2.72437   8.28106   1.000 26.89804 ? 183 GLY A O   1 
ATOM   1422 N N   . PRO A 1 184 ? -27.39885 4.86750   7.75178   1.000 24.17803 ? 184 PRO A N   1 
ATOM   1423 C CA  . PRO A 1 184 ? -28.06073 4.77226   6.44346   1.000 25.81145 ? 184 PRO A CA  1 
ATOM   1424 C C   . PRO A 1 184 ? -27.19464 4.21106   5.32322   1.000 25.99515 ? 184 PRO A C   1 
ATOM   1425 O O   . PRO A 1 184 ? -27.62437 4.23339   4.16756   1.000 27.88622 ? 184 PRO A O   1 
ATOM   1426 C CB  . PRO A 1 184 ? -28.40481 6.24079   6.16072   1.000 25.85345 ? 184 PRO A CB  1 
ATOM   1427 C CG  . PRO A 1 184 ? -27.26785 6.98348   6.76311   1.000 30.40060 ? 184 PRO A CG  1 
ATOM   1428 C CD  . PRO A 1 184 ? -26.88488 6.22341   8.01224   1.000 29.12995 ? 184 PRO A CD  1 
ATOM   1429 N N   . PHE A 1 185 ? -26.00936 3.70134   5.62486   1.000 25.92395 ? 185 PHE A N   1 
ATOM   1430 C CA  . PHE A 1 185 ? -25.04668 3.40230   4.57910   1.000 24.93378 ? 185 PHE A CA  1 
ATOM   1431 C C   . PHE A 1 185 ? -25.36471 2.09695   3.86499   1.000 22.88470 ? 185 PHE A C   1 
ATOM   1432 O O   . PHE A 1 185 ? -25.99505 1.19312   4.41835   1.000 22.53444 ? 185 PHE A O   1 
ATOM   1433 C CB  . PHE A 1 185 ? -23.64607 3.37126   5.17669   1.000 25.91299 ? 185 PHE A CB  1 
ATOM   1434 C CG  . PHE A 1 185 ? -23.30443 4.63642   5.89713   1.000 21.43139 ? 185 PHE A CG  1 
ATOM   1435 C CD1 . PHE A 1 185 ? -23.15671 5.82258   5.19011   1.000 24.83496 ? 185 PHE A CD1 1 
ATOM   1436 C CD2 . PHE A 1 185 ? -23.18443 4.65786   7.27958   1.000 22.93990 ? 185 PHE A CD2 1 
ATOM   1437 C CE1 . PHE A 1 185 ? -22.86892 7.00452   5.84812   1.000 31.00413 ? 185 PHE A CE1 1 
ATOM   1438 C CE2 . PHE A 1 185 ? -22.89220 5.84489   7.94647   1.000 23.16212 ? 185 PHE A CE2 1 
ATOM   1439 C CZ  . PHE A 1 185 ? -22.73453 7.01537   7.22768   1.000 27.03708 ? 185 PHE A CZ  1 
ATOM   1440 N N   . VAL A 1 186 ? -24.91505 2.01545   2.61260   1.000 23.49092 ? 186 VAL A N   1 
ATOM   1441 C CA  . VAL A 1 186 ? -25.12603 0.85520   1.75914   1.000 23.63615 ? 186 VAL A CA  1 
ATOM   1442 C C   . VAL A 1 186 ? -23.79510 0.42935   1.15512   1.000 24.22387 ? 186 VAL A C   1 
ATOM   1443 O O   . VAL A 1 186 ? -22.90692 1.25532   0.91469   1.000 24.26157 ? 186 VAL A O   1 
ATOM   1444 C CB  . VAL A 1 186 ? -26.16089 1.15229   0.65733   1.000 22.96802 ? 186 VAL A CB  1 
ATOM   1445 C CG1 . VAL A 1 186 ? -27.53352 1.35455   1.27619   1.000 27.13198 ? 186 VAL A CG1 1 
ATOM   1446 C CG2 . VAL A 1 186 ? -25.75246 2.39600   -0.14883  1.000 30.29218 ? 186 VAL A CG2 1 
ATOM   1447 N N   . ASP A 1 187 ? -23.66078 -0.87740  0.90630   1.000 23.38104 ? 187 ASP A N   1 
ATOM   1448 C CA  . ASP A 1 187 ? -22.41145 -1.43919  0.38854   1.000 20.95053 ? 187 ASP A CA  1 
ATOM   1449 C C   . ASP A 1 187 ? -22.37349 -1.29765  -1.13579  1.000 24.37146 ? 187 ASP A C   1 
ATOM   1450 O O   . ASP A 1 187 ? -22.48772 -2.25351  -1.90642  1.000 26.01408 ? 187 ASP A O   1 
ATOM   1451 C CB  . ASP A 1 187 ? -22.22292 -2.88387  0.84824   1.000 21.24844 ? 187 ASP A CB  1 
ATOM   1452 C CG  . ASP A 1 187 ? -23.42828 -3.77144  0.58365   1.000 21.92182 ? 187 ASP A CG  1 
ATOM   1453 O OD1 . ASP A 1 187 ? -24.50559 -3.27078  0.19684   1.000 25.43552 ? 187 ASP A OD1 1 
ATOM   1454 O OD2 . ASP A 1 187 ? -23.28267 -4.99617  0.77869   1.000 22.26011 ? 187 ASP A OD2 1 
ATOM   1455 N N   . ARG A 1 188 ? -22.18573 -0.05484  -1.56729  1.000 24.34894 ? 188 ARG A N   1 
ATOM   1456 C CA  . ARG A 1 188 ? -21.98233 0.24210   -2.97364  1.000 22.18781 ? 188 ARG A CA  1 
ATOM   1457 C C   . ARG A 1 188 ? -21.15062 1.50803   -3.07050  1.000 27.68971 ? 188 ARG A C   1 
ATOM   1458 O O   . ARG A 1 188 ? -21.12377 2.32810   -2.14909  1.000 23.14083 ? 188 ARG A O   1 
ATOM   1459 C CB  . ARG A 1 188 ? -23.30909 0.39658   -3.72962  1.000 26.01157 ? 188 ARG A CB  1 
ATOM   1460 C CG  . ARG A 1 188 ? -24.19609 1.50713   -3.22314  1.000 35.19048 ? 188 ARG A CG  1 
ATOM   1461 C CD  . ARG A 1 188 ? -25.59579 1.42393   -3.82814  1.000 42.35994 ? 188 ARG A CD  1 
ATOM   1462 N NE  . ARG A 1 188 ? -26.14441 0.07588   -3.74306  1.000 42.20278 ? 188 ARG A NE  1 
ATOM   1463 C CZ  . ARG A 1 188 ? -26.59162 -0.62353  -4.77856  1.000 45.70249 ? 188 ARG A CZ  1 
ATOM   1464 N NH1 . ARG A 1 188 ? -26.63327 -0.10801  -5.99735  1.000 49.21501 ? 188 ARG A NH1 1 
ATOM   1465 N NH2 . ARG A 1 188 ? -27.01549 -1.86988  -4.58500  1.000 38.41859 ? 188 ARG A NH2 1 
ATOM   1466 N N   . GLN A 1 189 ? -20.46849 1.65224   -4.20498  1.000 26.71194 ? 189 GLN A N   1 
ATOM   1467 C CA  . GLN A 1 189 ? -19.53959 2.76101   -4.42291  1.000 29.29542 ? 189 GLN A CA  1 
ATOM   1468 C C   . GLN A 1 189 ? -20.29204 3.95626   -5.01017  1.000 26.30643 ? 189 GLN A C   1 
ATOM   1469 O O   . GLN A 1 189 ? -20.17647 4.30478   -6.18766  1.000 31.91548 ? 189 GLN A O   1 
ATOM   1470 C CB  . GLN A 1 189 ? -18.39375 2.31019   -5.31666  1.000 28.64349 ? 189 GLN A CB  1 
ATOM   1471 C CG  . GLN A 1 189 ? -17.28061 3.32023   -5.47413  1.000 25.79554 ? 189 GLN A CG  1 
ATOM   1472 C CD  . GLN A 1 189 ? -16.06831 2.71543   -6.13900  1.000 27.53058 ? 189 GLN A CD  1 
ATOM   1473 O OE1 . GLN A 1 189 ? -15.65050 1.60880   -5.79700  1.000 30.62248 ? 189 GLN A OE1 1 
ATOM   1474 N NE2 . GLN A 1 189 ? -15.50732 3.42641   -7.10920  1.000 26.66813 ? 189 GLN A NE2 1 
ATOM   1475 N N   . THR A 1 190 ? -21.08391 4.58589   -4.14789  1.000 24.81587 ? 190 THR A N   1 
ATOM   1476 C CA  . THR A 1 190 ? -21.86535 5.76633   -4.48058  1.000 26.72778 ? 190 THR A CA  1 
ATOM   1477 C C   . THR A 1 190 ? -21.51797 6.88822   -3.51434  1.000 26.85090 ? 190 THR A C   1 
ATOM   1478 O O   . THR A 1 190 ? -20.92689 6.66748   -2.45201  1.000 26.74106 ? 190 THR A O   1 
ATOM   1479 C CB  . THR A 1 190 ? -23.37155 5.48734   -4.40643  1.000 32.06075 ? 190 THR A CB  1 
ATOM   1480 O OG1 . THR A 1 190 ? -23.68482 4.98044   -3.10163  1.000 30.47835 ? 190 THR A OG1 1 
ATOM   1481 C CG2 . THR A 1 190 ? -23.79300 4.47426   -5.46242  1.000 32.52589 ? 190 THR A CG2 1 
ATOM   1482 N N   . ALA A 1 191 ? -21.91142 8.10378   -3.89355  1.000 29.14355 ? 191 ALA A N   1 
ATOM   1483 C CA  . ALA A 1 191 ? -21.69028 9.27034   -3.05310  1.000 28.41901 ? 191 ALA A CA  1 
ATOM   1484 C C   . ALA A 1 191 ? -22.44754 9.11304   -1.74173  1.000 32.78095 ? 191 ALA A C   1 
ATOM   1485 O O   . ALA A 1 191 ? -23.68244 9.15693   -1.71426  1.000 34.11248 ? 191 ALA A O   1 
ATOM   1486 C CB  . ALA A 1 191 ? -22.11962 10.55181  -3.77698  1.000 29.83175 ? 191 ALA A CB  1 
ATOM   1487 N N   . GLN A 1 192 ? -21.71596 8.90383   -0.65582  1.000 27.13106 ? 192 GLN A N   1 
ATOM   1488 C CA  . GLN A 1 192 ? -22.29788 8.78660   0.66715   1.000 26.03429 ? 192 GLN A CA  1 
ATOM   1489 C C   . GLN A 1 192 ? -21.48455 9.65761   1.60353   1.000 35.70877 ? 192 GLN A C   1 
ATOM   1490 O O   . GLN A 1 192 ? -20.25636 9.72651   1.49223   1.000 32.41887 ? 192 GLN A O   1 
ATOM   1491 C CB  . GLN A 1 192 ? -22.31568 7.33246   1.15595   1.000 25.15019 ? 192 GLN A CB  1 
ATOM   1492 C CG  . GLN A 1 192 ? -23.12218 6.39822   0.26432   1.000 24.75314 ? 192 GLN A CG  1 
ATOM   1493 C CD  . GLN A 1 192 ? -23.08970 4.96314   0.74710   1.000 30.57615 ? 192 GLN A CD  1 
ATOM   1494 O OE1 . GLN A 1 192 ? -23.64990 4.63761   1.79357   1.000 26.59804 ? 192 GLN A OE1 1 
ATOM   1495 N NE2 . GLN A 1 192 ? -22.42856 4.09386   -0.01482  1.000 23.99140 ? 192 GLN A NE2 1 
ATOM   1496 N N   . ALA A 1 193 ? -22.17337 10.34280  2.50234   1.000 31.79841 ? 193 ALA A N   1 
ATOM   1497 C CA  . ALA A 1 193 ? -21.52548 11.29803  3.38305   1.000 32.09090 ? 193 ALA A CA  1 
ATOM   1498 C C   . ALA A 1 193 ? -22.05297 11.10059  4.79055   1.000 33.76736 ? 193 ALA A C   1 
ATOM   1499 O O   . ALA A 1 193 ? -23.25312 10.89146  4.98615   1.000 37.12180 ? 193 ALA A O   1 
ATOM   1500 C CB  . ALA A 1 193 ? -21.76972 12.73895  2.92327   1.000 34.63483 ? 193 ALA A CB  1 
ATOM   1501 N N   . ALA A 1 194 ? -21.14922 11.14646  5.76289   1.000 30.71852 ? 194 ALA A N   1 
ATOM   1502 C CA  . ALA A 1 194 ? -21.56240 11.09886  7.15330   1.000 33.55739 ? 194 ALA A CA  1 
ATOM   1503 C C   . ALA A 1 194 ? -22.31425 12.37191  7.51932   1.000 36.53778 ? 194 ALA A C   1 
ATOM   1504 O O   . ALA A 1 194 ? -22.04843 13.45252  6.98679   1.000 31.53789 ? 194 ALA A O   1 
ATOM   1505 C CB  . ALA A 1 194 ? -20.34951 10.92796  8.06794   1.000 31.18605 ? 194 ALA A CB  1 
ATOM   1506 N N   . GLY A 1 195 ? -23.26367 12.23704  8.43667   1.000 32.50208 ? 195 GLY A N   1 
ATOM   1507 C CA  . GLY A 1 195 ? -23.91030 13.39758  9.00324   1.000 34.81744 ? 195 GLY A CA  1 
ATOM   1508 C C   . GLY A 1 195 ? -22.96893 14.13053  9.94464   1.000 30.74108 ? 195 GLY A C   1 
ATOM   1509 O O   . GLY A 1 195 ? -21.76587 13.87674  10.00813  1.000 26.23494 ? 195 GLY A O   1 
ATOM   1510 N N   . THR A 1 196 ? -23.55021 15.06046  10.69936  1.000 26.98618 ? 196 THR A N   1 
ATOM   1511 C CA  . THR A 1 196 ? -22.78707 15.84233  11.66503  1.000 25.46971 ? 196 THR A CA  1 
ATOM   1512 C C   . THR A 1 196 ? -22.07630 14.93417  12.65545  1.000 30.38169 ? 196 THR A C   1 
ATOM   1513 O O   . THR A 1 196 ? -22.68806 14.03503  13.23798  1.000 30.18637 ? 196 THR A O   1 
ATOM   1514 C CB  . THR A 1 196 ? -23.71532 16.79436  12.41719  1.000 27.79720 ? 196 THR A CB  1 
ATOM   1515 O OG1 . THR A 1 196 ? -24.38117 17.64372  11.47822  1.000 28.98341 ? 196 THR A OG1 1 
ATOM   1516 C CG2 . THR A 1 196 ? -22.92967 17.64060  13.41396  1.000 27.06673 ? 196 THR A CG2 1 
ATOM   1517 N N   . ASP A 1 197 ? -20.78080 15.16532  12.84908  1.000 26.76252 ? 197 ASP A N   1 
ATOM   1518 C CA  . ASP A 1 197 ? -20.05492 14.39235  13.85592  1.000 28.92672 ? 197 ASP A CA  1 
ATOM   1519 C C   . ASP A 1 197 ? -20.34256 15.00422  15.21653  1.000 32.36167 ? 197 ASP A C   1 
ATOM   1520 O O   . ASP A 1 197 ? -19.69999 15.96001  15.65135  1.000 36.54145 ? 197 ASP A O   1 
ATOM   1521 C CB  . ASP A 1 197 ? -18.56415 14.34798  13.57603  1.000 38.18693 ? 197 ASP A CB  1 
ATOM   1522 C CG  . ASP A 1 197 ? -17.85462 13.29908  14.42568  1.000 46.31129 ? 197 ASP A CG  1 
ATOM   1523 O OD1 . ASP A 1 197 ? -18.48899 12.26203  14.76884  1.000 35.26344 ? 197 ASP A OD1 1 
ATOM   1524 O OD2 . ASP A 1 197 ? -16.67351 13.52177  14.76491  1.000 46.82905 ? 197 ASP A OD2 1 
ATOM   1525 N N   . THR A 1 198 ? -21.33271 14.43781  15.88445  1.000 27.90369 ? 198 THR A N   1 
ATOM   1526 C CA  . THR A 1 198 ? -21.78538 14.90722  17.17882  1.000 25.34314 ? 198 THR A CA  1 
ATOM   1527 C C   . THR A 1 198 ? -20.93172 14.28150  18.27597  1.000 27.34746 ? 198 THR A C   1 
ATOM   1528 O O   . THR A 1 198 ? -20.51994 13.12479  18.16971  1.000 31.18460 ? 198 THR A O   1 
ATOM   1529 C CB  . THR A 1 198 ? -23.26241 14.55053  17.34398  1.000 28.13202 ? 198 THR A CB  1 
ATOM   1530 O OG1 . THR A 1 198 ? -24.01760 15.22623  16.32306  1.000 33.01452 ? 198 THR A OG1 1 
ATOM   1531 C CG2 . THR A 1 198 ? -23.78944 14.94452  18.70754  1.000 30.77387 ? 198 THR A CG2 1 
ATOM   1532 N N   . THR A 1 199 ? -20.64905 15.06153  19.31545  1.000 25.58515 ? 199 THR A N   1 
ATOM   1533 C CA  . THR A 1 199 ? -19.83834 14.60362  20.43720  1.000 23.13233 ? 199 THR A CA  1 
ATOM   1534 C C   . THR A 1 199 ? -20.70506 13.89165  21.46703  1.000 22.72115 ? 199 THR A C   1 
ATOM   1535 O O   . THR A 1 199 ? -21.80614 14.34857  21.79466  1.000 24.08456 ? 199 THR A O   1 
ATOM   1536 C CB  . THR A 1 199 ? -19.11472 15.78703  21.08241  1.000 27.31897 ? 199 THR A CB  1 
ATOM   1537 O OG1 . THR A 1 199 ? -18.21501 16.36660  20.13223  1.000 27.23607 ? 199 THR A OG1 1 
ATOM   1538 C CG2 . THR A 1 199 ? -18.32581 15.34477  22.31031  1.000 29.51128 ? 199 THR A CG2 1 
ATOM   1539 N N   . ILE A 1 200 ? -20.20462 12.75742  21.96882  1.000 23.06417 ? 200 ILE A N   1 
ATOM   1540 C CA  . ILE A 1 200 ? -20.95217 11.93119  22.90873  1.000 20.81754 ? 200 ILE A CA  1 
ATOM   1541 C C   . ILE A 1 200 ? -20.80032 12.50753  24.31333  1.000 22.97451 ? 200 ILE A C   1 
ATOM   1542 O O   . ILE A 1 200 ? -19.84542 12.18605  25.03208  1.000 21.78689 ? 200 ILE A O   1 
ATOM   1543 C CB  . ILE A 1 200 ? -20.48461 10.46588  22.84929  1.000 21.83257 ? 200 ILE A CB  1 
ATOM   1544 C CG1 . ILE A 1 200 ? -20.51770 9.95672   21.39855  1.000 23.05194 ? 200 ILE A CG1 1 
ATOM   1545 C CG2 . ILE A 1 200 ? -21.35349 9.60820   23.74483  1.000 23.92323 ? 200 ILE A CG2 1 
ATOM   1546 C CD1 . ILE A 1 200 ? -19.56884 8.78843   21.14694  1.000 25.51064 ? 200 ILE A CD1 1 
ATOM   1547 N N   . THR A 1 201 ? -21.77239 13.33140  24.71706  1.000 20.72175 ? 201 THR A N   1 
ATOM   1548 C CA  . THR A 1 201 ? -21.66548 14.13483  25.93470  1.000 21.88817 ? 201 THR A CA  1 
ATOM   1549 C C   . THR A 1 201 ? -21.45607 13.27911  27.17898  1.000 20.93086 ? 201 THR A C   1 
ATOM   1550 O O   . THR A 1 201 ? -20.63276 13.61375  28.04199  1.000 20.43240 ? 201 THR A O   1 
ATOM   1551 C CB  . THR A 1 201 ? -22.92753 14.98075  26.08751  1.000 23.52645 ? 201 THR A CB  1 
ATOM   1552 O OG1 . THR A 1 201 ? -23.16035 15.69623  24.86850  1.000 24.04774 ? 201 THR A OG1 1 
ATOM   1553 C CG2 . THR A 1 201 ? -22.79271 15.96169  27.24439  1.000 20.63418 ? 201 THR A CG2 1 
ATOM   1554 N N   . VAL A 1 202 ? -22.20577 12.18327  27.30333  1.000 19.58636 ? 202 VAL A N   1 
ATOM   1555 C CA  . VAL A 1 202 ? -22.09779 11.36179  28.50234  1.000 19.81122 ? 202 VAL A CA  1 
ATOM   1556 C C   . VAL A 1 202 ? -20.70650 10.75216  28.60990  1.000 21.68088 ? 202 VAL A C   1 
ATOM   1557 O O   . VAL A 1 202 ? -20.19588 10.54243  29.71790  1.000 19.32816 ? 202 VAL A O   1 
ATOM   1558 C CB  . VAL A 1 202 ? -23.20172 10.28552  28.50687  1.000 24.85155 ? 202 VAL A CB  1 
ATOM   1559 C CG1 . VAL A 1 202 ? -23.04072 9.33901   27.31371  1.000 26.58570 ? 202 VAL A CG1 1 
ATOM   1560 C CG2 . VAL A 1 202 ? -23.21215 9.53186   29.82968  1.000 22.84613 ? 202 VAL A CG2 1 
ATOM   1561 N N   . ASN A 1 203 ? -20.05689 10.49317  27.47146  1.000 21.30978 ? 203 ASN A N   1 
ATOM   1562 C CA  . ASN A 1 203 ? -18.70846 9.92867   27.49349  1.000 19.51522 ? 203 ASN A CA  1 
ATOM   1563 C C   . ASN A 1 203 ? -17.66804 10.96518  27.90362  1.000 20.94660 ? 203 ASN A C   1 
ATOM   1564 O O   . ASN A 1 203 ? -16.72386 10.64208  28.63620  1.000 18.55208 ? 203 ASN A O   1 
ATOM   1565 C CB  . ASN A 1 203 ? -18.35733 9.34792   26.12603  1.000 19.86456 ? 203 ASN A CB  1 
ATOM   1566 C CG  . ASN A 1 203 ? -19.09542 8.06717   25.83493  1.000 19.50639 ? 203 ASN A CG  1 
ATOM   1567 O OD1 . ASN A 1 203 ? -19.94672 7.63392   26.61251  1.000 20.22901 ? 203 ASN A OD1 1 
ATOM   1568 N ND2 . ASN A 1 203 ? -18.77666 7.45087   24.70643  1.000 24.38590 ? 203 ASN A ND2 1 
ATOM   1569 N N   . VAL A 1 204 ? -17.80390 12.20565  27.42327  1.000 20.87301 ? 204 VAL A N   1 
ATOM   1570 C CA  . VAL A 1 204 ? -16.91061 13.27244  27.88003  1.000 21.97760 ? 204 VAL A CA  1 
ATOM   1571 C C   . VAL A 1 204 ? -16.99254 13.41108  29.39126  1.000 23.22114 ? 204 VAL A C   1 
ATOM   1572 O O   . VAL A 1 204 ? -15.96845 13.52438  30.07875  1.000 18.80299 ? 204 VAL A O   1 
ATOM   1573 C CB  . VAL A 1 204 ? -17.24345 14.60389  27.18080  1.000 18.85813 ? 204 VAL A CB  1 
ATOM   1574 C CG1 . VAL A 1 204 ? -16.35835 15.72806  27.71733  1.000 21.65698 ? 204 VAL A CG1 1 
ATOM   1575 C CG2 . VAL A 1 204 ? -17.08265 14.47697  25.67643  1.000 23.57413 ? 204 VAL A CG2 1 
ATOM   1576 N N   . LEU A 1 205 ? -18.21509 13.39732  29.93269  1.000 22.23258 ? 205 LEU A N   1 
ATOM   1577 C CA  . LEU A 1 205 ? -18.38172 13.49340  31.37708  1.000 22.32746 ? 205 LEU A CA  1 
ATOM   1578 C C   . LEU A 1 205 ? -17.72593 12.31514  32.08651  1.000 18.95352 ? 205 LEU A C   1 
ATOM   1579 O O   . LEU A 1 205 ? -17.06889 12.49385  33.11672  1.000 19.83990 ? 205 LEU A O   1 
ATOM   1580 C CB  . LEU A 1 205 ? -19.86636 13.58055  31.72879  1.000 19.12066 ? 205 LEU A CB  1 
ATOM   1581 C CG  . LEU A 1 205 ? -20.56258 14.88369  31.31781  1.000 19.19754 ? 205 LEU A CG  1 
ATOM   1582 C CD1 . LEU A 1 205 ? -22.06315 14.74576  31.47604  1.000 20.90879 ? 205 LEU A CD1 1 
ATOM   1583 C CD2 . LEU A 1 205 ? -20.04250 16.05959  32.14162  1.000 22.54891 ? 205 LEU A CD2 1 
ATOM   1584 N N   . ALA A 1 206 ? -17.89346 11.09942  31.55417  1.000 19.73383 ? 206 ALA A N   1 
ATOM   1585 C CA  . ALA A 1 206 ? -17.23481 9.94619   32.15725  1.000 20.96089 ? 206 ALA A CA  1 
ATOM   1586 C C   . ALA A 1 206 ? -15.72676 10.15134  32.20845  1.000 20.29579 ? 206 ALA A C   1 
ATOM   1587 O O   . ALA A 1 206 ? -15.07908 9.86156   33.22296  1.000 19.14958 ? 206 ALA A O   1 
ATOM   1588 C CB  . ALA A 1 206 ? -17.58375 8.67508   31.37672  1.000 19.53342 ? 206 ALA A CB  1 
ATOM   1589 N N   . TRP A 1 207 ? -15.15886 10.67900  31.12743  1.000 19.66360 ? 207 TRP A N   1 
ATOM   1590 C CA  . TRP A 1 207 ? -13.72033 10.88583  31.05285  1.000 22.29028 ? 207 TRP A CA  1 
ATOM   1591 C C   . TRP A 1 207 ? -13.26496 12.00752  31.98581  1.000 22.31099 ? 207 TRP A C   1 
ATOM   1592 O O   . TRP A 1 207 ? -12.16292 11.93947  32.54275  1.000 21.48936 ? 207 TRP A O   1 
ATOM   1593 C CB  . TRP A 1 207 ? -13.35668 11.14397  29.59033  1.000 22.65415 ? 207 TRP A CB  1 
ATOM   1594 C CG  . TRP A 1 207 ? -11.98615 11.64423  29.30144  1.000 21.65904 ? 207 TRP A CG  1 
ATOM   1595 C CD1 . TRP A 1 207 ? -10.83949 10.91130  29.20423  1.000 24.10472 ? 207 TRP A CD1 1 
ATOM   1596 C CD2 . TRP A 1 207 ? -11.62921 12.99440  29.01102  1.000 21.04426 ? 207 TRP A CD2 1 
ATOM   1597 N NE1 . TRP A 1 207 ? -9.78116  11.73465  28.89245  1.000 23.97570 ? 207 TRP A NE1 1 
ATOM   1598 C CE2 . TRP A 1 207 ? -10.24331 13.01855  28.76674  1.000 24.15906 ? 207 TRP A CE2 1 
ATOM   1599 C CE3 . TRP A 1 207 ? -12.34918 14.19096  28.94239  1.000 26.75881 ? 207 TRP A CE3 1 
ATOM   1600 C CZ2 . TRP A 1 207 ? -9.56148  14.19441  28.45970  1.000 27.26212 ? 207 TRP A CZ2 1 
ATOM   1601 C CZ3 . TRP A 1 207 ? -11.67299 15.35553  28.63666  1.000 28.85995 ? 207 TRP A CZ3 1 
ATOM   1602 C CH2 . TRP A 1 207 ? -10.29355 15.34828  28.39580  1.000 26.69345 ? 207 TRP A CH2 1 
ATOM   1603 N N   . LEU A 1 208 ? -14.10514 13.02188  32.20231  1.000 21.05811 ? 208 LEU A N   1 
ATOM   1604 C CA  . LEU A 1 208 ? -13.78580 14.03380  33.20658  1.000 19.42817 ? 208 LEU A CA  1 
ATOM   1605 C C   . LEU A 1 208 ? -13.76979 13.43048  34.60859  1.000 22.46535 ? 208 LEU A C   1 
ATOM   1606 O O   . LEU A 1 208 ? -12.95182 13.82357  35.45042  1.000 21.13246 ? 208 LEU A O   1 
ATOM   1607 C CB  . LEU A 1 208 ? -14.78354 15.19014  33.12193  1.000 20.45004 ? 208 LEU A CB  1 
ATOM   1608 C CG  . LEU A 1 208 ? -14.65760 16.12958  31.91724  1.000 21.61098 ? 208 LEU A CG  1 
ATOM   1609 C CD1 . LEU A 1 208 ? -15.75481 17.18749  31.94810  1.000 22.38701 ? 208 LEU A CD1 1 
ATOM   1610 C CD2 . LEU A 1 208 ? -13.27790 16.79019  31.86984  1.000 21.25997 ? 208 LEU A CD2 1 
ATOM   1611 N N   . TYR A 1 209 ? -14.67006 12.47796  34.88206  1.000 20.77268 ? 209 TYR A N   1 
ATOM   1612 C CA  . TYR A 1 209 ? -14.60110 11.74840  36.14361  1.000 20.41963 ? 209 TYR A CA  1 
ATOM   1613 C C   . TYR A 1 209 ? -13.31399 10.93888  36.23486  1.000 21.36887 ? 209 TYR A C   1 
ATOM   1614 O O   . TYR A 1 209 ? -12.66648 10.90450  37.28851  1.000 20.89870 ? 209 TYR A O   1 
ATOM   1615 C CB  . TYR A 1 209 ? -15.81677 10.83597  36.30097  1.000 19.40345 ? 209 TYR A CB  1 
ATOM   1616 C CG  . TYR A 1 209 ? -17.06221 11.55298  36.77810  1.000 19.41381 ? 209 TYR A CG  1 
ATOM   1617 C CD1 . TYR A 1 209 ? -17.16980 11.99828  38.09184  1.000 22.31948 ? 209 TYR A CD1 1 
ATOM   1618 C CD2 . TYR A 1 209 ? -18.12916 11.77753  35.91760  1.000 21.92689 ? 209 TYR A CD2 1 
ATOM   1619 C CE1 . TYR A 1 209 ? -18.30432 12.64786  38.53483  1.000 20.63118 ? 209 TYR A CE1 1 
ATOM   1620 C CE2 . TYR A 1 209 ? -19.27059 12.42649  36.34858  1.000 22.01838 ? 209 TYR A CE2 1 
ATOM   1621 C CZ  . TYR A 1 209 ? -19.35082 12.85871  37.65781  1.000 23.41306 ? 209 TYR A CZ  1 
ATOM   1622 O OH  . TYR A 1 209 ? -20.48246 13.50396  38.08675  1.000 25.46530 ? 209 TYR A OH  1 
ATOM   1623 N N   . ALA A 1 210 ? -12.91978 10.29309  35.13529  1.000 20.86685 ? 210 ALA A N   1 
ATOM   1624 C CA  . ALA A 1 210 ? -11.65158 9.57160   35.12358  1.000 18.94093 ? 210 ALA A CA  1 
ATOM   1625 C C   . ALA A 1 210 ? -10.49405 10.50288  35.44683  1.000 17.68414 ? 210 ALA A C   1 
ATOM   1626 O O   . ALA A 1 210 ? -9.54971  10.11487  36.14513  1.000 24.51068 ? 210 ALA A O   1 
ATOM   1627 C CB  . ALA A 1 210 ? -11.43823 8.90336   33.76577  1.000 19.93973 ? 210 ALA A CB  1 
ATOM   1628 N N   . ALA A 1 211 ? -10.55849 11.74403  34.96438  1.000 18.36880 ? 211 ALA A N   1 
ATOM   1629 C CA  . ALA A 1 211 ? -9.49524  12.69818  35.25816  1.000 18.23616 ? 211 ALA A CA  1 
ATOM   1630 C C   . ALA A 1 211 ? -9.45098  13.03446  36.74102  1.000 21.57009 ? 211 ALA A C   1 
ATOM   1631 O O   . ALA A 1 211 ? -8.36973  13.09784  37.33832  1.000 25.11838 ? 211 ALA A O   1 
ATOM   1632 C CB  . ALA A 1 211 ? -9.68656  13.96430  34.42511  1.000 23.18523 ? 211 ALA A CB  1 
ATOM   1633 N N   . VAL A 1 212 ? -10.61795 13.25638  37.34847  1.000 21.44357 ? 212 VAL A N   1 
ATOM   1634 C CA  . VAL A 1 212 ? -10.67989 13.53734  38.77924  1.000 22.45996 ? 212 VAL A CA  1 
ATOM   1635 C C   . VAL A 1 212 ? -10.10420 12.37251  39.57292  1.000 25.41879 ? 212 VAL A C   1 
ATOM   1636 O O   . VAL A 1 212 ? -9.29235  12.56356  40.48827  1.000 25.63600 ? 212 VAL A O   1 
ATOM   1637 C CB  . VAL A 1 212 ? -12.12810 13.84851  39.19889  1.000 21.47831 ? 212 VAL A CB  1 
ATOM   1638 C CG1 . VAL A 1 212 ? -12.23728 13.92079  40.71599  1.000 25.52717 ? 212 VAL A CG1 1 
ATOM   1639 C CG2 . VAL A 1 212 ? -12.58193 15.15189  38.55925  1.000 23.95045 ? 212 VAL A CG2 1 
ATOM   1640 N N   . ILE A 1 213 ? -10.51340 11.14713  39.22840  1.000 22.78797 ? 213 ILE A N   1 
ATOM   1641 C CA  . ILE A 1 213 ? -10.02422 9.95690   39.92380  1.000 24.53037 ? 213 ILE A CA  1 
ATOM   1642 C C   . ILE A 1 213 ? -8.50358  9.88672   39.87168  1.000 28.57232 ? 213 ILE A C   1 
ATOM   1643 O O   . ILE A 1 213 ? -7.85729  9.44250   40.83044  1.000 29.75445 ? 213 ILE A O   1 
ATOM   1644 C CB  . ILE A 1 213 ? -10.67559 8.69577   39.31925  1.000 26.73919 ? 213 ILE A CB  1 
ATOM   1645 C CG1 . ILE A 1 213 ? -12.16688 8.63873   39.67049  1.000 23.42883 ? 213 ILE A CG1 1 
ATOM   1646 C CG2 . ILE A 1 213 ? -9.96516  7.43523   39.78321  1.000 28.76970 ? 213 ILE A CG2 1 
ATOM   1647 C CD1 . ILE A 1 213 ? -12.94075 7.56504   38.91316  1.000 22.70402 ? 213 ILE A CD1 1 
ATOM   1648 N N   . ASN A 1 214 ? -7.90674  10.35662  38.77935  1.000 30.84353 ? 214 ASN A N   1 
ATOM   1649 C CA  . ASN A 1 214 ? -6.45934  10.35187  38.60904  1.000 30.24082 ? 214 ASN A CA  1 
ATOM   1650 C C   . ASN A 1 214 ? -5.77959  11.60320  39.15180  1.000 32.88706 ? 214 ASN A C   1 
ATOM   1651 O O   . ASN A 1 214 ? -4.55857  11.72952  39.01962  1.000 39.39499 ? 214 ASN A O   1 
ATOM   1652 C CB  . ASN A 1 214 ? -6.11324  10.17672  37.12854  1.000 30.55905 ? 214 ASN A CB  1 
ATOM   1653 C CG  . ASN A 1 214 ? -6.09946  8.72673   36.70683  1.000 36.40501 ? 214 ASN A CG  1 
ATOM   1654 O OD1 . ASN A 1 214 ? -5.03369  8.13292   36.54074  1.000 42.57652 ? 214 ASN A OD1 1 
ATOM   1655 N ND2 . ASN A 1 214 ? -7.28201  8.13956   36.54573  1.000 38.27413 ? 214 ASN A ND2 1 
ATOM   1656 N N   . GLY A 1 215 ? -6.52423  12.52530  39.75483  1.000 25.73212 ? 215 GLY A N   1 
ATOM   1657 C CA  . GLY A 1 215 ? -5.92817  13.70777  40.34232  1.000 30.49769 ? 215 GLY A CA  1 
ATOM   1658 C C   . GLY A 1 215 ? -5.81122  14.90858  39.43170  1.000 25.25957 ? 215 GLY A C   1 
ATOM   1659 O O   . GLY A 1 215 ? -5.18467  15.90068  39.82335  1.000 27.93808 ? 215 GLY A O   1 
ATOM   1660 N N   . ASP A 1 216 ? -6.39840  14.85832  38.23903  1.000 25.52850 ? 216 ASP A N   1 
ATOM   1661 C CA  . ASP A 1 216 ? -6.38496  15.97688  37.29397  1.000 30.84795 ? 216 ASP A CA  1 
ATOM   1662 C C   . ASP A 1 216 ? -7.63786  16.80417  37.55664  1.000 30.84246 ? 216 ASP A C   1 
ATOM   1663 O O   . ASP A 1 216 ? -8.70947  16.52689  37.01954  1.000 41.76966 ? 216 ASP A O   1 
ATOM   1664 C CB  . ASP A 1 216 ? -6.33564  15.45737  35.86215  1.000 34.46491 ? 216 ASP A CB  1 
ATOM   1665 C CG  . ASP A 1 216 ? -5.22267  16.08202  35.04594  1.000 47.08289 ? 216 ASP A CG  1 
ATOM   1666 O OD1 . ASP A 1 216 ? -4.62124  17.07566  35.51129  1.000 48.72733 ? 216 ASP A OD1 1 
ATOM   1667 O OD2 . ASP A 1 216 ? -4.95229  15.57377  33.93360  1.000 40.45420 ? 216 ASP A OD2 1 
ATOM   1668 N N   . ARG A 1 217 ? -7.50845  17.83155  38.40042  1.000 27.30533 ? 217 ARG A N   1 
ATOM   1669 C CA  . ARG A 1 217 ? -8.66464  18.51743  38.96799  1.000 28.14551 ? 217 ARG A CA  1 
ATOM   1670 C C   . ARG A 1 217 ? -8.78959  19.99097  38.59918  1.000 31.89004 ? 217 ARG A C   1 
ATOM   1671 O O   . ARG A 1 217 ? -9.71909  20.64640  39.08517  1.000 29.01960 ? 217 ARG A O   1 
ATOM   1672 C CB  . ARG A 1 217 ? -8.64692  18.40858  40.50275  1.000 34.77104 ? 217 ARG A CB  1 
ATOM   1673 C CG  . ARG A 1 217 ? -9.04296  17.04582  41.06201  1.000 39.97876 ? 217 ARG A CG  1 
ATOM   1674 C CD  . ARG A 1 217 ? -8.92111  17.01004  42.59374  1.000 38.33703 ? 217 ARG A CD  1 
ATOM   1675 N NE  . ARG A 1 217 ? -7.53949  17.14981  43.04368  1.000 40.23002 ? 217 ARG A NE  1 
ATOM   1676 C CZ  . ARG A 1 217 ? -7.00326  18.26795  43.52048  1.000 45.80175 ? 217 ARG A CZ  1 
ATOM   1677 N NH1 . ARG A 1 217 ? -7.71582  19.37412  43.66402  1.000 46.35136 ? 217 ARG A NH1 1 
ATOM   1678 N NH2 . ARG A 1 217 ? -5.71831  18.27604  43.86459  1.000 39.23600 ? 217 ARG A NH2 1 
ATOM   1679 N N   . TRP A 1 218 ? -7.90195  20.53454  37.75807  1.000 27.96576 ? 218 TRP A N   1 
ATOM   1680 C CA  . TRP A 1 218 ? -7.86781  21.98265  37.56684  1.000 31.50515 ? 218 TRP A CA  1 
ATOM   1681 C C   . TRP A 1 218 ? -9.16602  22.51894  36.97965  1.000 27.13261 ? 218 TRP A C   1 
ATOM   1682 O O   . TRP A 1 218 ? -9.50791  23.68815  37.19806  1.000 28.46242 ? 218 TRP A O   1 
ATOM   1683 C CB  . TRP A 1 218 ? -6.68952  22.37501  36.67448  1.000 32.20561 ? 218 TRP A CB  1 
ATOM   1684 C CG  . TRP A 1 218 ? -6.74167  21.82672  35.26636  1.000 30.35440 ? 218 TRP A CG  1 
ATOM   1685 C CD1 . TRP A 1 218 ? -6.09208  20.72513  34.79315  1.000 27.30695 ? 218 TRP A CD1 1 
ATOM   1686 C CD2 . TRP A 1 218 ? -7.45305  22.38097  34.14906  1.000 30.76419 ? 218 TRP A CD2 1 
ATOM   1687 N NE1 . TRP A 1 218 ? -6.36158  20.55171  33.45901  1.000 27.24867 ? 218 TRP A NE1 1 
ATOM   1688 C CE2 . TRP A 1 218 ? -7.19647  21.55309  33.03939  1.000 29.38463 ? 218 TRP A CE2 1 
ATOM   1689 C CE3 . TRP A 1 218 ? -8.28380  23.49289  33.98234  1.000 27.12714 ? 218 TRP A CE3 1 
ATOM   1690 C CZ2 . TRP A 1 218 ? -7.74510  21.79809  31.78182  1.000 31.44060 ? 218 TRP A CZ2 1 
ATOM   1691 C CZ3 . TRP A 1 218 ? -8.82982  23.73446  32.73399  1.000 25.81240 ? 218 TRP A CZ3 1 
ATOM   1692 C CH2 . TRP A 1 218 ? -8.55507  22.89294  31.64934  1.000 30.62215 ? 218 TRP A CH2 1 
ATOM   1693 N N   . PHE A 1 219 ? -9.90131  21.68986  36.24185  1.000 26.05295 ? 219 PHE A N   1 
ATOM   1694 C CA  . PHE A 1 219 ? -11.09420 22.13823  35.53815  1.000 23.51286 ? 219 PHE A CA  1 
ATOM   1695 C C   . PHE A 1 219 ? -12.34544 22.12684  36.40368  1.000 23.52344 ? 219 PHE A C   1 
ATOM   1696 O O   . PHE A 1 219 ? -13.39099 22.61220  35.95895  1.000 31.47687 ? 219 PHE A O   1 
ATOM   1697 C CB  . PHE A 1 219 ? -11.31796 21.26845  34.29870  1.000 25.29940 ? 219 PHE A CB  1 
ATOM   1698 C CG  . PHE A 1 219 ? -11.42362 19.80975  34.61187  1.000 22.47077 ? 219 PHE A CG  1 
ATOM   1699 C CD1 . PHE A 1 219 ? -12.63370 19.25849  35.00319  1.000 26.80807 ? 219 PHE A CD1 1 
ATOM   1700 C CD2 . PHE A 1 219 ? -10.30842 18.99313  34.54558  1.000 24.19857 ? 219 PHE A CD2 1 
ATOM   1701 C CE1 . PHE A 1 219 ? -12.73002 17.91099  35.32182  1.000 25.78693 ? 219 PHE A CE1 1 
ATOM   1702 C CE2 . PHE A 1 219 ? -10.40136 17.64644  34.84723  1.000 27.43444 ? 219 PHE A CE2 1 
ATOM   1703 C CZ  . PHE A 1 219 ? -11.61365 17.10523  35.23929  1.000 24.43004 ? 219 PHE A CZ  1 
ATOM   1704 N N   . LEU A 1 220 ? -12.28209 21.57215  37.60999  1.000 27.83123 ? 220 LEU A N   1 
ATOM   1705 C CA  . LEU A 1 220 ? -13.41681 21.65881  38.52068  1.000 25.78384 ? 220 LEU A CA  1 
ATOM   1706 C C   . LEU A 1 220 ? -13.63174 23.11695  38.89994  1.000 33.23098 ? 220 LEU A C   1 
ATOM   1707 O O   . LEU A 1 220 ? -12.75758 23.74288  39.50559  1.000 36.89157 ? 220 LEU A O   1 
ATOM   1708 C CB  . LEU A 1 220 ? -13.17944 20.80419  39.76427  1.000 28.68465 ? 220 LEU A CB  1 
ATOM   1709 C CG  . LEU A 1 220 ? -12.97110 19.30566  39.53547  1.000 28.82733 ? 220 LEU A CG  1 
ATOM   1710 C CD1 . LEU A 1 220 ? -12.67550 18.59089  40.85197  1.000 30.49418 ? 220 LEU A CD1 1 
ATOM   1711 C CD2 . LEU A 1 220 ? -14.18566 18.69715  38.84636  1.000 28.04831 ? 220 LEU A CD2 1 
ATOM   1712 N N   . ASN A 1 221 ? -14.76804 23.67426  38.51591  1.000 40.69636 ? 221 ASN A N   1 
ATOM   1713 C CA  . ASN A 1 221 ? -15.03544 25.05319  38.86618  1.000 40.14518 ? 221 ASN A CA  1 
ATOM   1714 C C   . ASN A 1 221 ? -15.97740 25.10215  40.06256  1.000 38.66031 ? 221 ASN A C   1 
ATOM   1715 O O   . ASN A 1 221 ? -16.23666 24.09985  40.73321  1.000 40.15770 ? 221 ASN A O   1 
ATOM   1716 C CB  . ASN A 1 221 ? -15.57613 25.82730  37.65947  1.000 36.48715 ? 221 ASN A CB  1 
ATOM   1717 C CG  . ASN A 1 221 ? -16.90434 25.29424  37.15518  1.000 29.01709 ? 221 ASN A CG  1 
ATOM   1718 O OD1 . ASN A 1 221 ? -17.66645 24.66152  37.88413  1.000 39.06445 ? 221 ASN A OD1 1 
ATOM   1719 N ND2 . ASN A 1 221 ? -17.19055 25.56087  35.89524  1.000 39.08183 ? 221 ASN A ND2 1 
ATOM   1720 N N   . ARG A 1 222 ? -16.50496 26.28905  40.32619  1.000 41.97015 ? 222 ARG A N   1 
ATOM   1721 C CA  . ARG A 1 222 ? -17.29700 26.56254  41.51335  1.000 50.24352 ? 222 ARG A CA  1 
ATOM   1722 C C   . ARG A 1 222 ? -18.79041 26.59595  41.21299  1.000 48.87260 ? 222 ARG A C   1 
ATOM   1723 O O   . ARG A 1 222 ? -19.56281 27.21006  41.95741  1.000 56.41248 ? 222 ARG A O   1 
ATOM   1724 C CB  . ARG A 1 222 ? -16.82223 27.87922  42.12265  1.000 45.19619 ? 222 ARG A CB  1 
ATOM   1725 C CG  . ARG A 1 222 ? -15.40493 27.79397  42.65947  1.000 58.27126 ? 222 ARG A CG  1 
ATOM   1726 C CD  . ARG A 1 222 ? -14.94694 29.08828  43.30606  1.000 65.00936 ? 222 ARG A CD  1 
ATOM   1727 N NE  . ARG A 1 222 ? -13.87847 28.84094  44.26647  1.000 61.19245 ? 222 ARG A NE  1 
ATOM   1728 C CZ  . ARG A 1 222 ? -14.06953 28.66357  45.56703  1.000 67.58670 ? 222 ARG A CZ  1 
ATOM   1729 N NH1 . ARG A 1 222 ? -15.27579 28.74208  46.10641  1.000 58.60400 ? 222 ARG A NH1 1 
ATOM   1730 N NH2 . ARG A 1 222 ? -13.02406 28.40375  46.34711  1.000 75.04361 ? 222 ARG A NH2 1 
ATOM   1731 N N   . PHE A 1 223 ? -19.21360 25.92205  40.14555  1.000 35.41635 ? 223 PHE A N   1 
ATOM   1732 C CA  . PHE A 1 223 ? -20.54045 26.10201  39.58656  1.000 36.33941 ? 223 PHE A CA  1 
ATOM   1733 C C   . PHE A 1 223 ? -21.30615 24.78668  39.53064  1.000 34.47626 ? 223 PHE A C   1 
ATOM   1734 O O   . PHE A 1 223 ? -20.74129 23.69220  39.63409  1.000 27.65205 ? 223 PHE A O   1 
ATOM   1735 C CB  . PHE A 1 223 ? -20.46960 26.68478  38.16649  1.000 36.57086 ? 223 PHE A CB  1 
ATOM   1736 C CG  . PHE A 1 223 ? -19.78081 28.01833  38.07961  1.000 55.87397 ? 223 PHE A CG  1 
ATOM   1737 C CD1 . PHE A 1 223 ? -18.39963 28.09909  37.99268  1.000 54.28886 ? 223 PHE A CD1 1 
ATOM   1738 C CD2 . PHE A 1 223 ? -20.51585 29.19062  38.05588  1.000 58.67357 ? 223 PHE A CD2 1 
ATOM   1739 C CE1 . PHE A 1 223 ? -17.76409 29.32405  37.90376  1.000 58.30917 ? 223 PHE A CE1 1 
ATOM   1740 C CE2 . PHE A 1 223 ? -19.88562 30.41873  37.96751  1.000 63.36739 ? 223 PHE A CE2 1 
ATOM   1741 C CZ  . PHE A 1 223 ? -18.50734 30.48404  37.89207  1.000 62.55496 ? 223 PHE A CZ  1 
ATOM   1742 N N   . THR A 1 224 ? -22.61590 24.92122  39.36215  1.000 24.12563 ? 224 THR A N   1 
ATOM   1743 C CA  . THR A 1 224 ? -23.47914 23.83795  38.91908  1.000 22.49512 ? 224 THR A CA  1 
ATOM   1744 C C   . THR A 1 224 ? -24.38818 24.39561  37.83162  1.000 24.15611 ? 224 THR A C   1 
ATOM   1745 O O   . THR A 1 224 ? -24.34420 25.58526  37.51034  1.000 27.87619 ? 224 THR A O   1 
ATOM   1746 C CB  . THR A 1 224 ? -24.27820 23.23376  40.08016  1.000 27.65887 ? 224 THR A CB  1 
ATOM   1747 O OG1 . THR A 1 224 ? -24.77940 21.95067  39.68506  1.000 23.63487 ? 224 THR A OG1 1 
ATOM   1748 C CG2 . THR A 1 224 ? -25.44141 24.13892  40.47352  1.000 27.99535 ? 224 THR A CG2 1 
ATOM   1749 N N   . THR A 1 225 ? -25.20222 23.53344  37.23923  1.000 20.48631 ? 225 THR A N   1 
ATOM   1750 C CA  . THR A 1 225 ? -26.10831 23.96745  36.18709  1.000 27.08473 ? 225 THR A CA  1 
ATOM   1751 C C   . THR A 1 225 ? -27.32680 23.05443  36.20754  1.000 25.67617 ? 225 THR A C   1 
ATOM   1752 O O   . THR A 1 225 ? -27.49876 22.23640  37.11663  1.000 25.42033 ? 225 THR A O   1 
ATOM   1753 C CB  . THR A 1 225 ? -25.39530 23.97903  34.82549  1.000 28.33359 ? 225 THR A CB  1 
ATOM   1754 O OG1 . THR A 1 225 ? -26.24047 24.58958  33.84143  1.000 27.88539 ? 225 THR A OG1 1 
ATOM   1755 C CG2 . THR A 1 225 ? -25.03308 22.55877  34.37554  1.000 26.02884 ? 225 THR A CG2 1 
ATOM   1756 N N   . THR A 1 226 ? -28.19045 23.20811  35.21310  1.000 25.75080 ? 226 THR A N   1 
ATOM   1757 C CA  . THR A 1 226 ? -29.32758 22.32317  35.04165  1.000 22.34225 ? 226 THR A CA  1 
ATOM   1758 C C   . THR A 1 226 ? -29.16467 21.58278  33.72578  1.000 25.37436 ? 226 THR A C   1 
ATOM   1759 O O   . THR A 1 226 ? -28.39084 21.99089  32.85825  1.000 25.18594 ? 226 THR A O   1 
ATOM   1760 C CB  . THR A 1 226 ? -30.65916 23.08632  35.04488  1.000 28.92391 ? 226 THR A CB  1 
ATOM   1761 O OG1 . THR A 1 226 ? -30.70568 23.96495  33.91406  1.000 28.36840 ? 226 THR A OG1 1 
ATOM   1762 C CG2 . THR A 1 226 ? -30.81509 23.89779  36.32754  1.000 31.64003 ? 226 THR A CG2 1 
ATOM   1763 N N   . LEU A 1 227 ? -29.89860 20.47856  33.59286  1.000 23.18554 ? 227 LEU A N   1 
ATOM   1764 C CA  . LEU A 1 227 ? -29.89429 19.73223  32.33929  1.000 27.41119 ? 227 LEU A CA  1 
ATOM   1765 C C   . LEU A 1 227 ? -30.30453 20.62301  31.17305  1.000 29.41625 ? 227 LEU A C   1 
ATOM   1766 O O   . LEU A 1 227 ? -29.65232 20.63317  30.12105  1.000 25.40546 ? 227 LEU A O   1 
ATOM   1767 C CB  . LEU A 1 227 ? -30.82720 18.52794  32.45758  1.000 29.95786 ? 227 LEU A CB  1 
ATOM   1768 C CG  . LEU A 1 227 ? -30.37175 17.21241  31.83942  1.000 37.90469 ? 227 LEU A CG  1 
ATOM   1769 C CD1 . LEU A 1 227 ? -28.93876 16.91003  32.24464  1.000 31.35058 ? 227 LEU A CD1 1 
ATOM   1770 C CD2 . LEU A 1 227 ? -31.30652 16.08297  32.25769  1.000 32.20363 ? 227 LEU A CD2 1 
ATOM   1771 N N   . ASN A 1 228 ? -31.37894 21.39582  31.35053  1.000 25.09006 ? 228 ASN A N   1 
ATOM   1772 C CA  . ASN A 1 228 ? -31.86739 22.23612  30.26153  1.000 27.83342 ? 228 ASN A CA  1 
ATOM   1773 C C   . ASN A 1 228 ? -30.88187 23.35019  29.92218  1.000 25.16845 ? 228 ASN A C   1 
ATOM   1774 O O   . ASN A 1 228 ? -30.65677 23.64341  28.74312  1.000 27.67860 ? 228 ASN A O   1 
ATOM   1775 C CB  . ASN A 1 228 ? -33.24194 22.80732  30.61200  1.000 30.20070 ? 228 ASN A CB  1 
ATOM   1776 C CG  . ASN A 1 228 ? -34.35223 21.76918  30.48814  1.000 36.06057 ? 228 ASN A CG  1 
ATOM   1777 O OD1 . ASN A 1 228 ? -34.17467 20.72653  29.85438  1.000 38.10191 ? 228 ASN A OD1 1 
ATOM   1778 N ND2 . ASN A 1 228 ? -35.50349 22.05405  31.08630  1.000 28.24743 ? 228 ASN A ND2 1 
ATOM   1779 N N   . ASP A 1 229 ? -30.26713 23.97050  30.93183  1.000 29.63587 ? 229 ASP A N   1 
ATOM   1780 C CA  . ASP A 1 229 ? -29.31862 25.04418  30.64817  1.000 28.60668 ? 229 ASP A CA  1 
ATOM   1781 C C   . ASP A 1 229 ? -28.03345 24.50567  30.03076  1.000 29.29545 ? 229 ASP A C   1 
ATOM   1782 O O   . ASP A 1 229 ? -27.45990 25.13894  29.13948  1.000 30.64097 ? 229 ASP A O   1 
ATOM   1783 C CB  . ASP A 1 229 ? -29.01345 25.84143  31.91504  1.000 32.71372 ? 229 ASP A CB  1 
ATOM   1784 C CG  . ASP A 1 229 ? -29.94708 27.02713  32.09531  1.000 42.44082 ? 229 ASP A CG  1 
ATOM   1785 O OD1 . ASP A 1 229 ? -30.97850 27.09160  31.39143  1.000 46.47848 ? 229 ASP A OD1 1 
ATOM   1786 O OD2 . ASP A 1 229 ? -29.64265 27.90436  32.92969  1.000 50.18879 ? 229 ASP A OD2 1 
ATOM   1787 N N   . PHE A 1 230 ? -27.56140 23.34323  30.48809  1.000 22.46203 ? 230 PHE A N   1 
ATOM   1788 C CA  . PHE A 1 230 ? -26.36987 22.75575  29.88393  1.000 24.09832 ? 230 PHE A CA  1 
ATOM   1789 C C   . PHE A 1 230 ? -26.60554 22.43718  28.41362  1.000 24.50451 ? 230 PHE A C   1 
ATOM   1790 O O   . PHE A 1 230 ? -25.76390 22.73278  27.55774  1.000 23.69562 ? 230 PHE A O   1 
ATOM   1791 C CB  . PHE A 1 230 ? -25.94967 21.48424  30.62782  1.000 24.13230 ? 230 PHE A CB  1 
ATOM   1792 C CG  . PHE A 1 230 ? -24.84232 20.73711  29.93728  1.000 27.11791 ? 230 PHE A CG  1 
ATOM   1793 C CD1 . PHE A 1 230 ? -23.52011 21.08124  30.15898  1.000 23.71279 ? 230 PHE A CD1 1 
ATOM   1794 C CD2 . PHE A 1 230 ? -25.12278 19.71376  29.04203  1.000 25.93089 ? 230 PHE A CD2 1 
ATOM   1795 C CE1 . PHE A 1 230 ? -22.50219 20.41959  29.51150  1.000 26.20689 ? 230 PHE A CE1 1 
ATOM   1796 C CE2 . PHE A 1 230 ? -24.10710 19.05061  28.38902  1.000 26.71551 ? 230 PHE A CE2 1 
ATOM   1797 C CZ  . PHE A 1 230 ? -22.79353 19.40287  28.62473  1.000 27.36634 ? 230 PHE A CZ  1 
ATOM   1798 N N   . ASN A 1 231 ? -27.73800 21.80134  28.10798  1.000 22.95023 ? 231 ASN A N   1 
ATOM   1799 C CA  . ASN A 1 231 ? -28.02028 21.41969  26.72799  1.000 27.13350 ? 231 ASN A CA  1 
ATOM   1800 C C   . ASN A 1 231 ? -28.15164 22.63734  25.82377  1.000 23.98874 ? 231 ASN A C   1 
ATOM   1801 O O   . ASN A 1 231 ? -27.82999 22.56115  24.63244  1.000 31.67694 ? 231 ASN A O   1 
ATOM   1802 C CB  . ASN A 1 231 ? -29.28489 20.56257  26.67263  1.000 23.05472 ? 231 ASN A CB  1 
ATOM   1803 C CG  . ASN A 1 231 ? -29.05544 19.15641  27.20164  1.000 26.91980 ? 231 ASN A CG  1 
ATOM   1804 O OD1 . ASN A 1 231 ? -27.94427 18.63393  27.13739  1.000 25.27504 ? 231 ASN A OD1 1 
ATOM   1805 N ND2 . ASN A 1 231 ? -30.10898 18.53393  27.71374  1.000 27.42074 ? 231 ASN A ND2 1 
ATOM   1806 N N   . LEU A 1 232 ? -28.62703 23.75833  26.36942  1.000 27.54196 ? 232 LEU A N   1 
ATOM   1807 C CA  . LEU A 1 232 ? -28.69853 24.99790  25.60280  1.000 26.71352 ? 232 LEU A CA  1 
ATOM   1808 C C   . LEU A 1 232 ? -27.31820 25.42412  25.12264  1.000 39.49815 ? 232 LEU A C   1 
ATOM   1809 O O   . LEU A 1 232 ? -27.14101 25.79413  23.95487  1.000 35.97452 ? 232 LEU A O   1 
ATOM   1810 C CB  . LEU A 1 232 ? -29.33117 26.09148  26.46143  1.000 33.66115 ? 232 LEU A CB  1 
ATOM   1811 C CG  . LEU A 1 232 ? -30.50476 26.88350  25.89514  1.000 41.59940 ? 232 LEU A CG  1 
ATOM   1812 C CD1 . LEU A 1 232 ? -31.57673 25.95372  25.33827  1.000 43.53388 ? 232 LEU A CD1 1 
ATOM   1813 C CD2 . LEU A 1 232 ? -31.07380 27.77766  26.98315  1.000 49.39881 ? 232 LEU A CD2 1 
ATOM   1814 N N   . VAL A 1 233 ? -26.32330 25.36317  26.00896  1.000 33.84969 ? 233 VAL A N   1 
ATOM   1815 C CA  . VAL A 1 233 ? -24.96928 25.75366  25.63627  1.000 40.26759 ? 233 VAL A CA  1 
ATOM   1816 C C   . VAL A 1 233 ? -24.34533 24.71138  24.71883  1.000 36.55926 ? 233 VAL A C   1 
ATOM   1817 O O   . VAL A 1 233 ? -23.69616 25.05119  23.72202  1.000 46.36651 ? 233 VAL A O   1 
ATOM   1818 C CB  . VAL A 1 233 ? -24.11896 25.98214  26.90055  1.000 39.68985 ? 233 VAL A CB  1 
ATOM   1819 C CG1 . VAL A 1 233 ? -22.66165 26.19755  26.53357  1.000 41.29405 ? 233 VAL A CG1 1 
ATOM   1820 C CG2 . VAL A 1 233 ? -24.64360 27.17149  27.67438  1.000 45.90827 ? 233 VAL A CG2 1 
ATOM   1821 N N   . ALA A 1 234 ? -24.55235 23.42850  25.02347  1.000 35.01343 ? 234 ALA A N   1 
ATOM   1822 C CA  . ALA A 1 234 ? -23.85852 22.36073  24.31891  1.000 34.51509 ? 234 ALA A CA  1 
ATOM   1823 C C   . ALA A 1 234 ? -24.40923 22.12274  22.92028  1.000 37.45793 ? 234 ALA A C   1 
ATOM   1824 O O   . ALA A 1 234 ? -23.68294 21.61554  22.05864  1.000 33.55287 ? 234 ALA A O   1 
ATOM   1825 C CB  . ALA A 1 234 ? -23.93024 21.06753  25.12964  1.000 37.50550 ? 234 ALA A CB  1 
ATOM   1826 N N   . MET A 1 235 ? -25.67721 22.46147  22.67302  1.000 33.04767 ? 235 MET A N   1 
ATOM   1827 C CA  . MET A 1 235 ? -26.22219 22.30636  21.32801  1.000 32.98128 ? 235 MET A CA  1 
ATOM   1828 C C   . MET A 1 235 ? -25.39085 23.07841  20.31290  1.000 32.44671 ? 235 MET A C   1 
ATOM   1829 O O   . MET A 1 235 ? -25.11976 22.58662  19.21238  1.000 30.67861 ? 235 MET A O   1 
ATOM   1830 C CB  . MET A 1 235 ? -27.67959 22.76765  21.29009  1.000 39.85216 ? 235 MET A CB  1 
ATOM   1831 C CG  . MET A 1 235 ? -28.22267 22.97542  19.88355  1.000 50.05746 ? 235 MET A CG  1 
ATOM   1832 S SD  . MET A 1 235 ? -29.95193 23.48246  19.85816  1.000 85.54659 ? 235 MET A SD  1 
ATOM   1833 C CE  . MET A 1 235 ? -30.09229 24.31683  21.44215  1.000 65.53381 ? 235 MET A CE  1 
ATOM   1834 N N   . LYS A 1 236 ? -24.95214 24.28118  20.68474  1.000 33.66812 ? 236 LYS A N   1 
ATOM   1835 C CA  . LYS A 1 236 ? -24.13561 25.10193  19.79929  1.000 36.65968 ? 236 LYS A CA  1 
ATOM   1836 C C   . LYS A 1 236 ? -22.81940 24.41755  19.45092  1.000 34.27586 ? 236 LYS A C   1 
ATOM   1837 O O   . LYS A 1 236 ? -22.26338 24.64964  18.37095  1.000 37.71303 ? 236 LYS A O   1 
ATOM   1838 C CB  . LYS A 1 236 ? -23.89845 26.45563  20.47017  1.000 46.03411 ? 236 LYS A CB  1 
ATOM   1839 C CG  . LYS A 1 236 ? -22.77952 27.30509  19.90190  1.000 48.59769 ? 236 LYS A CG  1 
ATOM   1840 C CD  . LYS A 1 236 ? -22.13413 28.07849  21.03671  1.000 53.09796 ? 236 LYS A CD  1 
ATOM   1841 C CE  . LYS A 1 236 ? -20.97513 28.92520  20.57725  1.000 46.46981 ? 236 LYS A CE  1 
ATOM   1842 N NZ  . LYS A 1 236 ? -21.41764 30.26282  20.09856  1.000 43.59482 ? 236 LYS A NZ  1 
ATOM   1843 N N   . TYR A 1 237 ? -22.32080 23.55215  20.33212  1.000 28.30874 ? 237 TYR A N   1 
ATOM   1844 C CA  . TYR A 1 237 ? -21.05336 22.86801  20.12249  1.000 27.88816 ? 237 TYR A CA  1 
ATOM   1845 C C   . TYR A 1 237 ? -21.22636 21.47766  19.53114  1.000 28.71387 ? 237 TYR A C   1 
ATOM   1846 O O   . TYR A 1 237 ? -20.26427 20.70338  19.50769  1.000 28.45349 ? 237 TYR A O   1 
ATOM   1847 C CB  . TYR A 1 237 ? -20.27601 22.79901  21.43874  1.000 28.55368 ? 237 TYR A CB  1 
ATOM   1848 C CG  . TYR A 1 237 ? -19.84185 24.16260  21.90448  1.000 28.68709 ? 237 TYR A CG  1 
ATOM   1849 C CD1 . TYR A 1 237 ? -18.67907 24.74068  21.41636  1.000 30.13836 ? 237 TYR A CD1 1 
ATOM   1850 C CD2 . TYR A 1 237 ? -20.61073 24.88847  22.80016  1.000 31.90912 ? 237 TYR A CD2 1 
ATOM   1851 C CE1 . TYR A 1 237 ? -18.28595 25.99410  21.82047  1.000 29.96083 ? 237 TYR A CE1 1 
ATOM   1852 C CE2 . TYR A 1 237 ? -20.22498 26.14192  23.21154  1.000 33.76992 ? 237 TYR A CE2 1 
ATOM   1853 C CZ  . TYR A 1 237 ? -19.06056 26.69063  22.71806  1.000 34.60814 ? 237 TYR A CZ  1 
ATOM   1854 O OH  . TYR A 1 237 ? -18.66918 27.94099  23.12119  1.000 39.96808 ? 237 TYR A OH  1 
ATOM   1855 N N   . ASN A 1 238 ? -22.42260 21.15498  19.03769  1.000 26.81793 ? 238 ASN A N   1 
ATOM   1856 C CA  . ASN A 1 238 ? -22.70898 19.85209  18.43362  1.000 27.53150 ? 238 ASN A CA  1 
ATOM   1857 C C   . ASN A 1 238 ? -22.45609 18.71950  19.42255  1.000 25.18159 ? 238 ASN A C   1 
ATOM   1858 O O   . ASN A 1 238 ? -21.89945 17.67687  19.07516  1.000 27.16910 ? 238 ASN A O   1 
ATOM   1859 C CB  . ASN A 1 238 ? -21.90920 19.64343  17.14519  1.000 28.91373 ? 238 ASN A CB  1 
ATOM   1860 C CG  . ASN A 1 238 ? -22.31799 20.60309  16.05140  1.000 36.23064 ? 238 ASN A CG  1 
ATOM   1861 O OD1 . ASN A 1 238 ? -23.50355 20.80094  15.80065  1.000 36.43783 ? 238 ASN A OD1 1 
ATOM   1862 N ND2 . ASN A 1 238 ? -21.33677 21.22007  15.40681  1.000 44.85539 ? 238 ASN A ND2 1 
ATOM   1863 N N   . TYR A 1 239 ? -22.86672 18.93130  20.66783  1.000 26.65055 ? 239 TYR A N   1 
ATOM   1864 C CA  . TYR A 1 239 ? -22.86969 17.87901  21.67282  1.000 26.40698 ? 239 TYR A CA  1 
ATOM   1865 C C   . TYR A 1 239 ? -24.23201 17.20186  21.69511  1.000 27.99830 ? 239 TYR A C   1 
ATOM   1866 O O   . TYR A 1 239 ? -25.26199 17.85719  21.50478  1.000 30.24450 ? 239 TYR A O   1 
ATOM   1867 C CB  . TYR A 1 239 ? -22.54428 18.44998  23.05529  1.000 25.00116 ? 239 TYR A CB  1 
ATOM   1868 C CG  . TYR A 1 239 ? -21.07802 18.41291  23.39949  1.000 25.45923 ? 239 TYR A CG  1 
ATOM   1869 C CD1 . TYR A 1 239 ? -20.13413 18.97753  22.55648  1.000 26.45793 ? 239 TYR A CD1 1 
ATOM   1870 C CD2 . TYR A 1 239 ? -20.63806 17.81974  24.57701  1.000 26.68063 ? 239 TYR A CD2 1 
ATOM   1871 C CE1 . TYR A 1 239 ? -18.78726 18.94266  22.86892  1.000 27.14094 ? 239 TYR A CE1 1 
ATOM   1872 C CE2 . TYR A 1 239 ? -19.29130 17.77842  24.89905  1.000 29.91720 ? 239 TYR A CE2 1 
ATOM   1873 C CZ  . TYR A 1 239 ? -18.37282 18.34077  24.04028  1.000 30.72352 ? 239 TYR A CZ  1 
ATOM   1874 O OH  . TYR A 1 239 ? -17.03908 18.30385  24.35467  1.000 29.29268 ? 239 TYR A OH  1 
ATOM   1875 N N   . GLU A 1 240 ? -24.22728 15.88596  21.90395  1.000 25.58548 ? 240 GLU A N   1 
ATOM   1876 C CA  . GLU A 1 240 ? -25.46554 15.15405  22.13160  1.000 29.21441 ? 240 GLU A CA  1 
ATOM   1877 C C   . GLU A 1 240 ? -26.22437 15.76591  23.30687  1.000 29.10523 ? 240 GLU A C   1 
ATOM   1878 O O   . GLU A 1 240 ? -25.60975 16.10849  24.32765  1.000 25.68373 ? 240 GLU A O   1 
ATOM   1879 C CB  . GLU A 1 240 ? -25.17637 13.68305  22.45146  1.000 25.44794 ? 240 GLU A CB  1 
ATOM   1880 C CG  . GLU A 1 240 ? -25.06911 12.75005  21.28271  1.000 43.19962 ? 240 GLU A CG  1 
ATOM   1881 C CD  . GLU A 1 240 ? -25.05850 11.29779  21.73380  1.000 47.84798 ? 240 GLU A CD  1 
ATOM   1882 O OE1 . GLU A 1 240 ? -24.81961 11.04557  22.93957  1.000 43.28677 ? 240 GLU A OE1 1 
ATOM   1883 O OE2 . GLU A 1 240 ? -25.29819 10.41037  20.88913  1.000 59.25766 ? 240 GLU A OE2 1 
ATOM   1884 N N   . PRO A 1 241 ? -27.54678 15.90188  23.21588  1.000 29.09594 ? 241 PRO A N   1 
ATOM   1885 C CA  . PRO A 1 241 ? -28.31675 16.33451  24.38777  1.000 26.64601 ? 241 PRO A CA  1 
ATOM   1886 C C   . PRO A 1 241 ? -28.16259 15.34411  25.53059  1.000 28.25928 ? 241 PRO A C   1 
ATOM   1887 O O   . PRO A 1 241 ? -28.21599 14.12766  25.33394  1.000 29.36647 ? 241 PRO A O   1 
ATOM   1888 C CB  . PRO A 1 241 ? -29.76016 16.38019  23.87283  1.000 31.03607 ? 241 PRO A CB  1 
ATOM   1889 C CG  . PRO A 1 241 ? -29.62879 16.51683  22.39139  1.000 32.26331 ? 241 PRO A CG  1 
ATOM   1890 C CD  . PRO A 1 241 ? -28.39026 15.75822  22.01802  1.000 30.83373 ? 241 PRO A CD  1 
ATOM   1891 N N   . LEU A 1 242 ? -27.94871 15.87603  26.73003  1.000 27.53087 ? 242 LEU A N   1 
ATOM   1892 C CA  . LEU A 1 242 ? -27.82113 15.04890  27.91960  1.000 25.99327 ? 242 LEU A CA  1 
ATOM   1893 C C   . LEU A 1 242 ? -29.19733 14.80819  28.52562  1.000 26.00188 ? 242 LEU A C   1 
ATOM   1894 O O   . LEU A 1 242 ? -29.95112 15.75770  28.77210  1.000 26.77928 ? 242 LEU A O   1 
ATOM   1895 C CB  . LEU A 1 242 ? -26.89516 15.70672  28.94222  1.000 23.57740 ? 242 LEU A CB  1 
ATOM   1896 C CG  . LEU A 1 242 ? -26.32162 14.74678  29.98904  1.000 27.70995 ? 242 LEU A CG  1 
ATOM   1897 C CD1 . LEU A 1 242 ? -25.27581 13.84119  29.35334  1.000 26.75542 ? 242 LEU A CD1 1 
ATOM   1898 C CD2 . LEU A 1 242 ? -25.72437 15.51503  31.15507  1.000 31.50379 ? 242 LEU A CD2 1 
ATOM   1899 N N   . THR A 1 243 ? -29.51353 13.53911  28.76975  1.000 27.96255 ? 243 THR A N   1 
ATOM   1900 C CA  . THR A 1 243 ? -30.79528 13.11699  29.31492  1.000 25.85026 ? 243 THR A CA  1 
ATOM   1901 C C   . THR A 1 243 ? -30.63042 12.65635  30.75653  1.000 31.91771 ? 243 THR A C   1 
ATOM   1902 O O   . THR A 1 243 ? -29.51747 12.44610  31.24953  1.000 26.31178 ? 243 THR A O   1 
ATOM   1903 C CB  . THR A 1 243 ? -31.39562 11.98666  28.47145  1.000 29.42276 ? 243 THR A CB  1 
ATOM   1904 O OG1 . THR A 1 243 ? -30.63873 10.78362  28.67249  1.000 27.07712 ? 243 THR A OG1 1 
ATOM   1905 C CG2 . THR A 1 243 ? -31.36831 12.36770  26.99503  1.000 31.33693 ? 243 THR A CG2 1 
ATOM   1906 N N   . GLN A 1 244 ? -31.76944 12.49845  31.43406  1.000 27.62280 ? 244 GLN A N   1 
ATOM   1907 C CA  . GLN A 1 244 ? -31.74148 11.95067  32.78507  1.000 30.20329 ? 244 GLN A CA  1 
ATOM   1908 C C   . GLN A 1 244 ? -31.19357 10.52827  32.79574  1.000 30.03916 ? 244 GLN A C   1 
ATOM   1909 O O   . GLN A 1 244 ? -30.53500 10.12413  33.76215  1.000 25.52196 ? 244 GLN A O   1 
ATOM   1910 C CB  . GLN A 1 244 ? -33.13960 11.98484  33.39545  1.000 25.60762 ? 244 GLN A CB  1 
ATOM   1911 C CG  . GLN A 1 244 ? -33.16689 11.58777  34.85629  1.000 26.86147 ? 244 GLN A CG  1 
ATOM   1912 C CD  . GLN A 1 244 ? -32.33000 12.50801  35.71520  1.000 30.52840 ? 244 GLN A CD  1 
ATOM   1913 O OE1 . GLN A 1 244 ? -32.40503 13.72972  35.58971  1.000 32.54505 ? 244 GLN A OE1 1 
ATOM   1914 N NE2 . GLN A 1 244 ? -31.51830 11.92610  36.59067  1.000 27.40450 ? 244 GLN A NE2 1 
ATOM   1915 N N   . ASP A 1 245 ? -31.45303 9.75654   31.73529  1.000 26.49104 ? 245 ASP A N   1 
ATOM   1916 C CA  . ASP A 1 245 ? -30.87303 8.42012   31.63458  1.000 28.66820 ? 245 ASP A CA  1 
ATOM   1917 C C   . ASP A 1 245 ? -29.34933 8.47735   31.64015  1.000 28.58040 ? 245 ASP A C   1 
ATOM   1918 O O   . ASP A 1 245 ? -28.69368 7.64495   32.27817  1.000 24.77026 ? 245 ASP A O   1 
ATOM   1919 C CB  . ASP A 1 245 ? -31.37696 7.72157   30.37310  1.000 30.05580 ? 245 ASP A CB  1 
ATOM   1920 C CG  . ASP A 1 245 ? -32.77868 7.15959   30.53372  1.000 41.39272 ? 245 ASP A CG  1 
ATOM   1921 O OD1 . ASP A 1 245 ? -33.34894 7.27773   31.63688  1.000 39.46999 ? 245 ASP A OD1 1 
ATOM   1922 O OD2 . ASP A 1 245 ? -33.30572 6.59226   29.55394  1.000 49.98470 ? 245 ASP A OD2 1 
ATOM   1923 N N   . HIS A 1 246 ? -28.76830 9.45377   30.93504  1.000 28.02580 ? 246 HIS A N   1 
ATOM   1924 C CA  . HIS A 1 246 ? -27.31859 9.63063   30.95914  1.000 25.56633 ? 246 HIS A CA  1 
ATOM   1925 C C   . HIS A 1 246 ? -26.83169 9.96082   32.36318  1.000 26.30083 ? 246 HIS A C   1 
ATOM   1926 O O   . HIS A 1 246 ? -25.81488 9.42337   32.82495  1.000 23.77976 ? 246 HIS A O   1 
ATOM   1927 C CB  . HIS A 1 246 ? -26.90111 10.74519  30.00241  1.000 26.38539 ? 246 HIS A CB  1 
ATOM   1928 C CG  . HIS A 1 246 ? -27.15133 10.44543  28.56008  1.000 27.90470 ? 246 HIS A CG  1 
ATOM   1929 N ND1 . HIS A 1 246 ? -27.52779 11.41836  27.65854  1.000 28.91529 ? 246 HIS A ND1 1 
ATOM   1930 C CD2 . HIS A 1 246 ? -27.05986 9.29277   27.85576  1.000 24.35524 ? 246 HIS A CD2 1 
ATOM   1931 C CE1 . HIS A 1 246 ? -27.67118 10.87417  26.46279  1.000 28.31287 ? 246 HIS A CE1 1 
ATOM   1932 N NE2 . HIS A 1 246 ? -27.39176 9.58642   26.55452  1.000 27.96002 ? 246 HIS A NE2 1 
ATOM   1933 N N   . VAL A 1 247 ? -27.52579 10.88733  33.03475  1.000 21.40497 ? 247 VAL A N   1 
ATOM   1934 C CA  . VAL A 1 247 ? -27.17539 11.26857  34.39960  1.000 20.00971 ? 247 VAL A CA  1 
ATOM   1935 C C   . VAL A 1 247 ? -27.17506 10.04523  35.30474  1.000 21.04711 ? 247 VAL A C   1 
ATOM   1936 O O   . VAL A 1 247 ? -26.27036 9.85932   36.12637  1.000 22.11640 ? 247 VAL A O   1 
ATOM   1937 C CB  . VAL A 1 247 ? -28.14363 12.34538  34.92414  1.000 24.59678 ? 247 VAL A CB  1 
ATOM   1938 C CG1 . VAL A 1 247 ? -27.77210 12.73677  36.33366  1.000 24.64153 ? 247 VAL A CG1 1 
ATOM   1939 C CG2 . VAL A 1 247 ? -28.15124 13.56863  34.01319  1.000 26.88557 ? 247 VAL A CG2 1 
ATOM   1940 N N   . ASP A 1 248 ? -28.19763 9.19133   35.16784  1.000 23.34569 ? 248 ASP A N   1 
ATOM   1941 C CA  . ASP A 1 248 ? -28.27549 7.99459   36.00371  1.000 23.94818 ? 248 ASP A CA  1 
ATOM   1942 C C   . ASP A 1 248 ? -27.14422 7.02408   35.69376  1.000 22.52118 ? 248 ASP A C   1 
ATOM   1943 O O   . ASP A 1 248 ? -26.62710 6.35697   36.59779  1.000 22.83766 ? 248 ASP A O   1 
ATOM   1944 C CB  . ASP A 1 248 ? -29.62661 7.30036   35.82106  1.000 25.33134 ? 248 ASP A CB  1 
ATOM   1945 C CG  . ASP A 1 248 ? -30.78998 8.13645   36.32280  1.000 30.32831 ? 248 ASP A CG  1 
ATOM   1946 O OD1 . ASP A 1 248 ? -30.56033 9.07575   37.11482  1.000 30.98032 ? 248 ASP A OD1 1 
ATOM   1947 O OD2 . ASP A 1 248 ? -31.94163 7.84171   35.93267  1.000 35.19622 ? 248 ASP A OD2 1 
ATOM   1948 N N   . ILE A 1 249 ? -26.75492 6.91937   34.42218  1.000 23.08154 ? 249 ILE A N   1 
ATOM   1949 C CA  . ILE A 1 249 ? -25.67517 6.00660   34.06119  1.000 19.83791 ? 249 ILE A CA  1 
ATOM   1950 C C   . ILE A 1 249 ? -24.35857 6.47390   34.67037  1.000 24.64915 ? 249 ILE A C   1 
ATOM   1951 O O   . ILE A 1 249 ? -23.47928 5.66064   34.97196  1.000 21.70736 ? 249 ILE A O   1 
ATOM   1952 C CB  . ILE A 1 249 ? -25.60602 5.87565   32.52647  1.000 24.96126 ? 249 ILE A CB  1 
ATOM   1953 C CG1 . ILE A 1 249 ? -26.80405 5.06840   32.01658  1.000 26.90975 ? 249 ILE A CG1 1 
ATOM   1954 C CG2 . ILE A 1 249 ? -24.30587 5.22895   32.07356  1.000 30.50084 ? 249 ILE A CG2 1 
ATOM   1955 C CD1 . ILE A 1 249 ? -26.99413 5.12463   30.51013  1.000 25.56164 ? 249 ILE A CD1 1 
ATOM   1956 N N   . LEU A 1 250 ? -24.21008 7.77731   34.88798  1.000 22.36743 ? 250 LEU A N   1 
ATOM   1957 C CA  . LEU A 1 250 ? -23.01012 8.32819   35.50383  1.000 23.67202 ? 250 LEU A CA  1 
ATOM   1958 C C   . LEU A 1 250 ? -23.00983 8.21070   37.02357  1.000 22.56610 ? 250 LEU A C   1 
ATOM   1959 O O   . LEU A 1 250 ? -22.04843 8.65499   37.66126  1.000 25.41287 ? 250 LEU A O   1 
ATOM   1960 C CB  . LEU A 1 250 ? -22.84830 9.79078   35.08570  1.000 20.57809 ? 250 LEU A CB  1 
ATOM   1961 C CG  . LEU A 1 250 ? -22.37671 10.00833  33.65056  1.000 25.59235 ? 250 LEU A CG  1 
ATOM   1962 C CD1 . LEU A 1 250 ? -22.70280 11.42249  33.18634  1.000 20.97903 ? 250 LEU A CD1 1 
ATOM   1963 C CD2 . LEU A 1 250 ? -20.86901 9.73004   33.55968  1.000 24.39277 ? 250 LEU A CD2 1 
ATOM   1964 N N   . GLY A 1 251 ? -24.04846 7.61800   37.61033  1.000 22.35965 ? 251 GLY A N   1 
ATOM   1965 C CA  . GLY A 1 251 ? -24.18037 7.51135   39.04410  1.000 26.64559 ? 251 GLY A CA  1 
ATOM   1966 C C   . GLY A 1 251 ? -22.99195 6.88924   39.74622  1.000 23.06112 ? 251 GLY A C   1 
ATOM   1967 O O   . GLY A 1 251 ? -22.49292 7.42664   40.74119  1.000 24.24938 ? 251 GLY A O   1 
ATOM   1968 N N   . PRO A 1 252 ? -22.52436 5.73210   39.26398  1.000 24.63130 ? 252 PRO A N   1 
ATOM   1969 C CA  . PRO A 1 252 ? -21.34580 5.12228   39.90215  1.000 25.10995 ? 252 PRO A CA  1 
ATOM   1970 C C   . PRO A 1 252 ? -20.14322 6.04983   39.96034  1.000 23.22700 ? 252 PRO A C   1 
ATOM   1971 O O   . PRO A 1 252 ? -19.49288 6.13708   41.00741  1.000 24.62714 ? 252 PRO A O   1 
ATOM   1972 C CB  . PRO A 1 252 ? -21.08986 3.88146   39.03792  1.000 24.55068 ? 252 PRO A CB  1 
ATOM   1973 C CG  . PRO A 1 252 ? -22.44890 3.49991   38.54351  1.000 26.99348 ? 252 PRO A CG  1 
ATOM   1974 C CD  . PRO A 1 252 ? -23.18227 4.80217   38.32353  1.000 25.49813 ? 252 PRO A CD  1 
ATOM   1975 N N   . LEU A 1 253 ? -19.83374 6.75912   38.87371  1.000 21.86749 ? 253 LEU A N   1 
ATOM   1976 C CA  . LEU A 1 253 ? -18.67876 7.65294   38.89432  1.000 21.47334 ? 253 LEU A CA  1 
ATOM   1977 C C   . LEU A 1 253 ? -18.94246 8.87962   39.75530  1.000 24.53813 ? 253 LEU A C   1 
ATOM   1978 O O   . LEU A 1 253 ? -18.02303 9.39511   40.40009  1.000 23.76951 ? 253 LEU A O   1 
ATOM   1979 C CB  . LEU A 1 253 ? -18.30336 8.06924   37.46866  1.000 21.60058 ? 253 LEU A CB  1 
ATOM   1980 C CG  . LEU A 1 253 ? -17.70390 6.96622   36.58263  1.000 26.93223 ? 253 LEU A CG  1 
ATOM   1981 C CD1 . LEU A 1 253 ? -17.61482 7.41246   35.12393  1.000 22.36419 ? 253 LEU A CD1 1 
ATOM   1982 C CD2 . LEU A 1 253 ? -16.32925 6.55451   37.10123  1.000 23.16564 ? 253 LEU A CD2 1 
ATOM   1983 N N   . SER A 1 254 ? -20.18616 9.35865   39.77601  1.000 23.06660 ? 254 SER A N   1 
ATOM   1984 C CA  . SER A 1 254 ? -20.53157 10.47541  40.64367  1.000 25.69707 ? 254 SER A CA  1 
ATOM   1985 C C   . SER A 1 254 ? -20.38883 10.09205  42.11144  1.000 25.34226 ? 254 SER A C   1 
ATOM   1986 O O   . SER A 1 254 ? -19.84830 10.86526  42.91220  1.000 27.41720 ? 254 SER A O   1 
ATOM   1987 C CB  . SER A 1 254 ? -21.95471 10.94627  40.34195  1.000 25.69024 ? 254 SER A CB  1 
ATOM   1988 O OG  . SER A 1 254 ? -22.33142 11.97765  41.23466  1.000 29.72482 ? 254 SER A OG  1 
ATOM   1989 N N   . ALA A 1 255 ? -20.85631 8.89368   42.48115  1.000 23.27585 ? 255 ALA A N   1 
ATOM   1990 C CA  . ALA A 1 255 ? -20.76419 8.46285   43.87258  1.000 26.26394 ? 255 ALA A CA  1 
ATOM   1991 C C   . ALA A 1 255 ? -19.32081 8.22897   44.29708  1.000 26.66953 ? 255 ALA A C   1 
ATOM   1992 O O   . ALA A 1 255 ? -18.96821 8.47530   45.45514  1.000 25.76827 ? 255 ALA A O   1 
ATOM   1993 C CB  . ALA A 1 255 ? -21.58875 7.19699   44.08899  1.000 24.11489 ? 255 ALA A CB  1 
ATOM   1994 N N   . GLN A 1 256 ? -18.47673 7.74506   43.38656  1.000 26.87206 ? 256 GLN A N   1 
ATOM   1995 C CA  . GLN A 1 256 ? -17.08110 7.51531   43.74015  1.000 29.19090 ? 256 GLN A CA  1 
ATOM   1996 C C   . GLN A 1 256 ? -16.36511 8.82701   44.03075  1.000 27.13567 ? 256 GLN A C   1 
ATOM   1997 O O   . GLN A 1 256 ? -15.60055 8.92666   44.99877  1.000 30.47656 ? 256 GLN A O   1 
ATOM   1998 C CB  . GLN A 1 256 ? -16.37534 6.75541   42.61581  1.000 31.10712 ? 256 GLN A CB  1 
ATOM   1999 C CG  . GLN A 1 256 ? -14.98760 6.24712   42.97610  1.000 34.71926 ? 256 GLN A CG  1 
ATOM   2000 C CD  . GLN A 1 256 ? -14.28821 5.58453   41.80355  1.000 43.49456 ? 256 GLN A CD  1 
ATOM   2001 O OE1 . GLN A 1 256 ? -14.92738 4.96430   40.95059  1.000 48.19740 ? 256 GLN A OE1 1 
ATOM   2002 N NE2 . GLN A 1 256 ? -12.96839 5.72049   41.75033  1.000 46.26143 ? 256 GLN A NE2 1 
ATOM   2003 N N   . THR A 1 257 ? -16.60560 9.84399   43.21363  1.000 25.21516 ? 257 THR A N   1 
ATOM   2004 C CA  . THR A 1 257 ? -15.89820 11.11054  43.34044  1.000 25.74282 ? 257 THR A CA  1 
ATOM   2005 C C   . THR A 1 257 ? -16.61740 12.11582  44.22775  1.000 28.72546 ? 257 THR A C   1 
ATOM   2006 O O   . THR A 1 257 ? -16.00962 13.11806  44.61226  1.000 27.21860 ? 257 THR A O   1 
ATOM   2007 C CB  . THR A 1 257 ? -15.67894 11.73141  41.95644  1.000 25.90337 ? 257 THR A CB  1 
ATOM   2008 O OG1 . THR A 1 257 ? -16.94771 11.98788  41.33528  1.000 22.98481 ? 257 THR A OG1 1 
ATOM   2009 C CG2 . THR A 1 257 ? -14.87016 10.78290  41.07859  1.000 21.51414 ? 257 THR A CG2 1 
ATOM   2010 N N   . GLY A 1 258 ? -17.88461 11.88000  44.55864  1.000 27.06493 ? 258 GLY A N   1 
ATOM   2011 C CA  . GLY A 1 258 ? -18.64829 12.87342  45.28558  1.000 25.55901 ? 258 GLY A CA  1 
ATOM   2012 C C   . GLY A 1 258 ? -19.00725 14.10942  44.49304  1.000 30.92666 ? 258 GLY A C   1 
ATOM   2013 O O   . GLY A 1 258 ? -19.41231 15.11182  45.08793  1.000 33.00242 ? 258 GLY A O   1 
ATOM   2014 N N   . ILE A 1 259 ? -18.88263 14.07373  43.16856  1.000 25.90950 ? 259 ILE A N   1 
ATOM   2015 C CA  . ILE A 1 259 ? -19.19138 15.21250  42.31221  1.000 24.20706 ? 259 ILE A CA  1 
ATOM   2016 C C   . ILE A 1 259 ? -20.50392 14.92704  41.60452  1.000 23.80115 ? 259 ILE A C   1 
ATOM   2017 O O   . ILE A 1 259 ? -20.59111 13.98824  40.80335  1.000 23.32861 ? 259 ILE A O   1 
ATOM   2018 C CB  . ILE A 1 259 ? -18.07721 15.47595  41.29074  1.000 24.60388 ? 259 ILE A CB  1 
ATOM   2019 C CG1 . ILE A 1 259 ? -16.75101 15.71780  41.99834  1.000 23.44928 ? 259 ILE A CG1 1 
ATOM   2020 C CG2 . ILE A 1 259 ? -18.44377 16.65695  40.40214  1.000 24.50932 ? 259 ILE A CG2 1 
ATOM   2021 C CD1 . ILE A 1 259 ? -15.58979 15.80685  41.03686  1.000 28.06300 ? 259 ILE A CD1 1 
ATOM   2022 N N   . ALA A 1 260 ? -21.52200 15.72976  41.90239  1.000 24.59337 ? 260 ALA A N   1 
ATOM   2023 C CA  . ALA A 1 260 ? -22.80132 15.58226  41.22784  1.000 24.89204 ? 260 ALA A CA  1 
ATOM   2024 C C   . ALA A 1 260 ? -22.62032 15.76616  39.72617  1.000 22.12814 ? 260 ALA A C   1 
ATOM   2025 O O   . ALA A 1 260 ? -21.78305 16.55328  39.27682  1.000 22.20032 ? 260 ALA A O   1 
ATOM   2026 C CB  . ALA A 1 260 ? -23.80478 16.59602  41.77585  1.000 27.04742 ? 260 ALA A CB  1 
ATOM   2027 N N   . VAL A 1 261 ? -23.39873 15.01754  38.94569  1.000 23.10556 ? 261 VAL A N   1 
ATOM   2028 C CA  . VAL A 1 261 ? -23.25219 15.07544  37.49670  1.000 19.41591 ? 261 VAL A CA  1 
ATOM   2029 C C   . VAL A 1 261 ? -23.45394 16.50059  37.00171  1.000 18.70971 ? 261 VAL A C   1 
ATOM   2030 O O   . VAL A 1 261 ? -22.70822 16.98374  36.14202  1.000 20.85368 ? 261 VAL A O   1 
ATOM   2031 C CB  . VAL A 1 261 ? -24.22597 14.09632  36.81378  1.000 25.30225 ? 261 VAL A CB  1 
ATOM   2032 C CG1 . VAL A 1 261 ? -24.37011 14.43410  35.33886  1.000 23.44765 ? 261 VAL A CG1 1 
ATOM   2033 C CG2 . VAL A 1 261 ? -23.73494 12.67036  36.98580  1.000 26.36981 ? 261 VAL A CG2 1 
ATOM   2034 N N   . LEU A 1 262 ? -24.45315 17.20193  37.54948  1.000 21.98819 ? 262 LEU A N   1 
ATOM   2035 C CA  . LEU A 1 262 ? -24.72882 18.55944  37.08975  1.000 22.02574 ? 262 LEU A CA  1 
ATOM   2036 C C   . LEU A 1 262 ? -23.61858 19.52715  37.48242  1.000 23.13185 ? 262 LEU A C   1 
ATOM   2037 O O   . LEU A 1 262 ? -23.43401 20.54995  36.81336  1.000 22.13694 ? 262 LEU A O   1 
ATOM   2038 C CB  . LEU A 1 262 ? -26.07583 19.03792  37.62592  1.000 25.07239 ? 262 LEU A CB  1 
ATOM   2039 C CG  . LEU A 1 262 ? -27.26133 18.35373  36.93316  1.000 25.64736 ? 262 LEU A CG  1 
ATOM   2040 C CD1 . LEU A 1 262 ? -28.59257 18.88458  37.43657  1.000 22.36570 ? 262 LEU A CD1 1 
ATOM   2041 C CD2 . LEU A 1 262 ? -27.15552 18.49631  35.41610  1.000 24.94248 ? 262 LEU A CD2 1 
ATOM   2042 N N   . ASP A 1 263 ? -22.88078 19.23834  38.56047  1.000 21.11713 ? 263 ASP A N   1 
ATOM   2043 C CA  . ASP A 1 263 ? -21.67019 20.00740  38.83927  1.000 20.61336 ? 263 ASP A CA  1 
ATOM   2044 C C   . ASP A 1 263 ? -20.63794 19.78402  37.74533  1.000 20.88874 ? 263 ASP A C   1 
ATOM   2045 O O   . ASP A 1 263 ? -20.01772 20.73400  37.25483  1.000 24.31288 ? 263 ASP A O   1 
ATOM   2046 C CB  . ASP A 1 263 ? -21.07332 19.62155  40.19759  1.000 25.51735 ? 263 ASP A CB  1 
ATOM   2047 C CG  . ASP A 1 263 ? -21.87206 20.15020  41.37519  1.000 31.86318 ? 263 ASP A CG  1 
ATOM   2048 O OD1 . ASP A 1 263 ? -23.04974 20.51476  41.19550  1.000 27.00830 ? 263 ASP A OD1 1 
ATOM   2049 O OD2 . ASP A 1 263 ? -21.31044 20.18839  42.49319  1.000 30.42100 ? 263 ASP A OD2 1 
ATOM   2050 N N   . MET A 1 264 ? -20.42798 18.52371  37.36217  1.000 21.56815 ? 264 MET A N   1 
ATOM   2051 C CA  . MET A 1 264 ? -19.47724 18.24199  36.29409  1.000 24.69692 ? 264 MET A CA  1 
ATOM   2052 C C   . MET A 1 264 ? -19.93357 18.85542  34.97925  1.000 21.25368 ? 264 MET A C   1 
ATOM   2053 O O   . MET A 1 264 ? -19.10037 19.27937  34.17214  1.000 23.09862 ? 264 MET A O   1 
ATOM   2054 C CB  . MET A 1 264 ? -19.28057 16.73267  36.14291  1.000 20.53575 ? 264 MET A CB  1 
ATOM   2055 C CG  . MET A 1 264 ? -18.07925 16.37187  35.28602  1.000 24.22151 ? 264 MET A CG  1 
ATOM   2056 S SD  . MET A 1 264 ? -16.53161 16.83733  36.09830  1.000 25.30269 ? 264 MET A SD  1 
ATOM   2057 C CE  . MET A 1 264 ? -16.18743 15.35187  37.04155  1.000 22.25492 ? 264 MET A CE  1 
ATOM   2058 N N   . CYS A 1 265 ? -21.24764 18.90417  34.74306  1.000 19.89336 ? 265 CYS A N   1 
ATOM   2059 C CA  . CYS A 1 265 ? -21.75703 19.57180  33.54967  1.000 22.62281 ? 265 CYS A CA  1 
ATOM   2060 C C   . CYS A 1 265 ? -21.36705 21.03998  33.53316  1.000 22.11568 ? 265 CYS A C   1 
ATOM   2061 O O   . CYS A 1 265 ? -21.04925 21.59769  32.47467  1.000 22.20164 ? 265 CYS A O   1 
ATOM   2062 C CB  . CYS A 1 265 ? -23.27638 19.43641  33.47319  1.000 21.73477 ? 265 CYS A CB  1 
ATOM   2063 S SG  . CYS A 1 265 ? -23.82129 17.80091  33.03253  1.000 24.71910 ? 265 CYS A SG  1 
ATOM   2064 N N   . ALA A 1 266 ? -21.40187 21.69030  34.69545  1.000 21.98776 ? 266 ALA A N   1 
ATOM   2065 C CA  . ALA A 1 266 ? -21.01028 23.09435  34.75400  1.000 23.66842 ? 266 ALA A CA  1 
ATOM   2066 C C   . ALA A 1 266 ? -19.54014 23.26364  34.40706  1.000 24.77692 ? 266 ALA A C   1 
ATOM   2067 O O   . ALA A 1 266 ? -19.16514 24.20580  33.70267  1.000 26.82679 ? 266 ALA A O   1 
ATOM   2068 C CB  . ALA A 1 266 ? -21.30462 23.66730  36.13684  1.000 26.16469 ? 266 ALA A CB  1 
ATOM   2069 N N   . SER A 1 267 ? -18.69109 22.35781  34.89362  1.000 24.84056 ? 267 SER A N   1 
ATOM   2070 C CA  . SER A 1 267 ? -17.28380 22.39980  34.52245  1.000 25.69174 ? 267 SER A CA  1 
ATOM   2071 C C   . SER A 1 267 ? -17.10214 22.15447  33.03204  1.000 24.91094 ? 267 SER A C   1 
ATOM   2072 O O   . SER A 1 267 ? -16.28822 22.82245  32.38194  1.000 23.32213 ? 267 SER A O   1 
ATOM   2073 C CB  . SER A 1 267 ? -16.48992 21.37653  35.33700  1.000 27.23190 ? 267 SER A CB  1 
ATOM   2074 O OG  . SER A 1 267 ? -16.44638 21.74761  36.70077  1.000 30.34935 ? 267 SER A OG  1 
ATOM   2075 N N   . LEU A 1 268 ? -17.84285 21.19283  32.47410  1.000 22.66588 ? 268 LEU A N   1 
ATOM   2076 C CA  . LEU A 1 268 ? -17.75180 20.93944  31.03862  1.000 24.77719 ? 268 LEU A CA  1 
ATOM   2077 C C   . LEU A 1 268 ? -18.20487 22.15814  30.24025  1.000 24.73734 ? 268 LEU A C   1 
ATOM   2078 O O   . LEU A 1 268 ? -17.58069 22.52239  29.23796  1.000 24.46519 ? 268 LEU A O   1 
ATOM   2079 C CB  . LEU A 1 268 ? -18.58183 19.70448  30.66982  1.000 24.67244 ? 268 LEU A CB  1 
ATOM   2080 C CG  . LEU A 1 268 ? -18.73740 19.37303  29.18176  1.000 26.69661 ? 268 LEU A CG  1 
ATOM   2081 C CD1 . LEU A 1 268 ? -17.37270 19.28822  28.50106  1.000 22.92567 ? 268 LEU A CD1 1 
ATOM   2082 C CD2 . LEU A 1 268 ? -19.50359 18.06705  28.99955  1.000 23.86673 ? 268 LEU A CD2 1 
ATOM   2083 N N   . LYS A 1 269 ? -19.28402 22.80754  30.68164  1.000 23.38263 ? 269 LYS A N   1 
ATOM   2084 C CA  . LYS A 1 269 ? -19.77533 24.00084  29.99947  1.000 24.74350 ? 269 LYS A CA  1 
ATOM   2085 C C   . LYS A 1 269 ? -18.69706 25.07565  29.89835  1.000 26.09217 ? 269 LYS A C   1 
ATOM   2086 O O   . LYS A 1 269 ? -18.54327 25.71442  28.84959  1.000 26.76029 ? 269 LYS A O   1 
ATOM   2087 C CB  . LYS A 1 269 ? -21.00711 24.53142  30.73209  1.000 24.98167 ? 269 LYS A CB  1 
ATOM   2088 C CG  . LYS A 1 269 ? -21.45103 25.91684  30.31115  1.000 38.12551 ? 269 LYS A CG  1 
ATOM   2089 C CD  . LYS A 1 269 ? -22.69186 26.33689  31.08340  1.000 39.47408 ? 269 LYS A CD  1 
ATOM   2090 C CE  . LYS A 1 269 ? -22.95875 27.82230  30.93728  1.000 44.76830 ? 269 LYS A CE  1 
ATOM   2091 N NZ  . LYS A 1 269 ? -24.13894 28.25392  31.73641  1.000 55.83389 ? 269 LYS A NZ  1 
ATOM   2092 N N   . GLU A 1 270 ? -17.93811 25.29414  30.97597  1.000 25.73356 ? 270 GLU A N   1 
ATOM   2093 C CA  . GLU A 1 270 ? -16.89131 26.31085  30.92300  1.000 26.25324 ? 270 GLU A CA  1 
ATOM   2094 C C   . GLU A 1 270 ? -15.74572 25.88495  30.01623  1.000 27.38883 ? 270 GLU A C   1 
ATOM   2095 O O   . GLU A 1 270 ? -15.13872 26.73183  29.35029  1.000 29.61185 ? 270 GLU A O   1 
ATOM   2096 C CB  . GLU A 1 270 ? -16.37507 26.61628  32.32732  1.000 29.98571 ? 270 GLU A CB  1 
ATOM   2097 C CG  . GLU A 1 270 ? -17.43281 27.18424  33.25614  1.000 45.69707 ? 270 GLU A CG  1 
ATOM   2098 C CD  . GLU A 1 270 ? -17.76732 28.63863  32.97049  1.000 59.28261 ? 270 GLU A CD  1 
ATOM   2099 O OE1 . GLU A 1 270 ? -16.89073 29.36591  32.45297  1.000 56.45217 ? 270 GLU A OE1 1 
ATOM   2100 O OE2 . GLU A 1 270 ? -18.91054 29.05299  33.26710  1.000 52.75889 ? 270 GLU A OE2 1 
ATOM   2101 N N   . LEU A 1 271 ? -15.44132 24.58626  29.96906  1.000 24.12122 ? 271 LEU A N   1 
ATOM   2102 C CA  . LEU A 1 271 ? -14.43129 24.10252  29.03461  1.000 25.53142 ? 271 LEU A CA  1 
ATOM   2103 C C   . LEU A 1 271 ? -14.88151 24.30922  27.59690  1.000 27.89995 ? 271 LEU A C   1 
ATOM   2104 O O   . LEU A 1 271 ? -14.07888 24.68434  26.73449  1.000 30.34723 ? 271 LEU A O   1 
ATOM   2105 C CB  . LEU A 1 271 ? -14.13161 22.62338  29.28968  1.000 28.08268 ? 271 LEU A CB  1 
ATOM   2106 C CG  . LEU A 1 271 ? -13.34687 22.26313  30.55334  1.000 25.77907 ? 271 LEU A CG  1 
ATOM   2107 C CD1 . LEU A 1 271 ? -13.28022 20.74938  30.74229  1.000 27.11116 ? 271 LEU A CD1 1 
ATOM   2108 C CD2 . LEU A 1 271 ? -11.95856 22.85609  30.49316  1.000 34.20336 ? 271 LEU A CD2 1 
ATOM   2109 N N   . LEU A 1 272 ? -16.16287 24.06694  27.32041  1.000 25.46561 ? 272 LEU A N   1 
ATOM   2110 C CA  . LEU A 1 272 ? -16.67425 24.27821  25.97228  1.000 27.54975 ? 272 LEU A CA  1 
ATOM   2111 C C   . LEU A 1 272 ? -16.63337 25.75199  25.59083  1.000 30.97196 ? 272 LEU A C   1 
ATOM   2112 O O   . LEU A 1 272 ? -16.25366 26.09482  24.46537  1.000 32.22946 ? 272 LEU A O   1 
ATOM   2113 C CB  . LEU A 1 272 ? -18.09691 23.73701  25.86297  1.000 24.85113 ? 272 LEU A CB  1 
ATOM   2114 C CG  . LEU A 1 272 ? -18.24409 22.21964  25.78037  1.000 27.37990 ? 272 LEU A CG  1 
ATOM   2115 C CD1 . LEU A 1 272 ? -19.71964 21.83166  25.62275  1.000 29.05698 ? 272 LEU A CD1 1 
ATOM   2116 C CD2 . LEU A 1 272 ? -17.41946 21.69698  24.62728  1.000 31.19345 ? 272 LEU A CD2 1 
ATOM   2117 N N   . GLN A 1 273 ? -17.00572 26.63705  26.51882  1.000 26.85826 ? 273 GLN A N   1 
ATOM   2118 C CA  . GLN A 1 273 ? -17.14450 28.05051  26.18826  1.000 30.73250 ? 273 GLN A CA  1 
ATOM   2119 C C   . GLN A 1 273 ? -15.80188 28.76765  26.17109  1.000 32.07562 ? 273 GLN A C   1 
ATOM   2120 O O   . GLN A 1 273 ? -15.57766 29.64530  25.33037  1.000 33.57455 ? 273 GLN A O   1 
ATOM   2121 C CB  . GLN A 1 273 ? -18.09215 28.72912  27.17504  1.000 28.85524 ? 273 GLN A CB  1 
ATOM   2122 C CG  . GLN A 1 273 ? -19.55027 28.32537  27.01562  1.000 30.21662 ? 273 GLN A CG  1 
ATOM   2123 C CD  . GLN A 1 273 ? -20.48610 29.15703  27.87840  1.000 41.34558 ? 273 GLN A CD  1 
ATOM   2124 O OE1 . GLN A 1 273 ? -21.39126 29.81999  27.37001  1.000 47.98414 ? 273 GLN A OE1 1 
ATOM   2125 N NE2 . GLN A 1 273 ? -20.27389 29.12499  29.18606  1.000 40.31932 ? 273 GLN A NE2 1 
ATOM   2126 N N   . ASN A 1 274 ? -14.89817 28.41724  27.08537  1.000 30.42579 ? 274 ASN A N   1 
ATOM   2127 C CA  . ASN A 1 274 ? -13.64725 29.14665  27.22826  1.000 33.28517 ? 274 ASN A CA  1 
ATOM   2128 C C   . ASN A 1 274 ? -12.42519 28.37046  26.76148  1.000 34.40124 ? 274 ASN A C   1 
ATOM   2129 O O   . ASN A 1 274 ? -11.32409 28.93115  26.76540  1.000 38.28694 ? 274 ASN A O   1 
ATOM   2130 C CB  . ASN A 1 274 ? -13.44824 29.57501  28.68936  1.000 34.06302 ? 274 ASN A CB  1 
ATOM   2131 C CG  . ASN A 1 274 ? -14.58505 30.44103  29.20048  1.000 40.87300 ? 274 ASN A CG  1 
ATOM   2132 O OD1 . ASN A 1 274 ? -15.20475 30.13251  30.21780  1.000 58.39706 ? 274 ASN A OD1 1 
ATOM   2133 N ND2 . ASN A 1 274 ? -14.86911 31.52857  28.49221  1.000 48.08836 ? 274 ASN A ND2 1 
ATOM   2134 N N   . GLY A 1 275 ? -12.58268 27.10963  26.35994  1.000 32.66644 ? 275 GLY A N   1 
ATOM   2135 C CA  . GLY A 1 275 ? -11.45851 26.30784  25.92730  1.000 37.04829 ? 275 GLY A CA  1 
ATOM   2136 C C   . GLY A 1 275 ? -10.62044 25.81933  27.09197  1.000 34.52846 ? 275 GLY A C   1 
ATOM   2137 O O   . GLY A 1 275 ? -10.89488 26.08005  28.26331  1.000 30.80400 ? 275 GLY A O   1 
ATOM   2138 N N   . MET A 1 276 ? -9.56401  25.08875  26.75110  1.000 33.87893 ? 276 MET A N   1 
ATOM   2139 C CA  . MET A 1 276 ? -8.69353  24.49545  27.75462  1.000 41.03495 ? 276 MET A CA  1 
ATOM   2140 C C   . MET A 1 276 ? -7.43256  25.31169  28.01751  1.000 39.72546 ? 276 MET A C   1 
ATOM   2141 O O   . MET A 1 276 ? -6.60103  24.89389  28.83055  1.000 34.71480 ? 276 MET A O   1 
ATOM   2142 C CB  . MET A 1 276 ? -8.33338  23.06568  27.34464  1.000 38.96404 ? 276 MET A CB  1 
ATOM   2143 C CG  . MET A 1 276 ? -9.55097  22.14921  27.31663  1.000 32.82897 ? 276 MET A CG  1 
ATOM   2144 S SD  . MET A 1 276 ? -9.19497  20.52442  26.64486  1.000 51.75344 ? 276 MET A SD  1 
ATOM   2145 C CE  . MET A 1 276 ? -7.87976  20.01242  27.74175  1.000 36.06297 ? 276 MET A CE  1 
ATOM   2146 N N   . ASN A 1 277 ? -7.27801  26.46567  27.36471  1.000 38.03905 ? 277 ASN A N   1 
ATOM   2147 C CA  . ASN A 1 277 ? -6.18611  27.39583  27.66172  1.000 36.99209 ? 277 ASN A CA  1 
ATOM   2148 C C   . ASN A 1 277 ? -4.81577  26.73401  27.50940  1.000 35.86256 ? 277 ASN A C   1 
ATOM   2149 O O   . ASN A 1 277 ? -3.88012  27.02642  28.25731  1.000 38.71403 ? 277 ASN A O   1 
ATOM   2150 C CB  . ASN A 1 277 ? -6.34358  27.98831  29.06308  1.000 42.66338 ? 277 ASN A CB  1 
ATOM   2151 C CG  . ASN A 1 277 ? -6.64727  29.46977  29.04086  1.000 54.80295 ? 277 ASN A CG  1 
ATOM   2152 O OD1 . ASN A 1 277 ? -7.42606  29.94328  28.21506  1.000 54.08707 ? 277 ASN A OD1 1 
ATOM   2153 N ND2 . ASN A 1 277 ? -6.02120  30.21534  29.94716  1.000 63.47438 ? 277 ASN A ND2 1 
ATOM   2154 N N   . GLY A 1 278 ? -4.69290  25.83630  26.53206  1.000 32.31864 ? 278 GLY A N   1 
ATOM   2155 C CA  . GLY A 1 278 ? -3.45816  25.10940  26.31144  1.000 37.22749 ? 278 GLY A CA  1 
ATOM   2156 C C   . GLY A 1 278 ? -3.13547  24.05374  27.34586  1.000 37.57671 ? 278 GLY A C   1 
ATOM   2157 O O   . GLY A 1 278 ? -2.08727  23.40637  27.24138  1.000 38.05876 ? 278 GLY A O   1 
ATOM   2158 N N   . ARG A 1 279 ? -3.99238  23.85967  28.34065  1.000 32.26603 ? 279 ARG A N   1 
ATOM   2159 C CA  . ARG A 1 279 ? -3.77133  22.83632  29.34280  1.000 30.85894 ? 279 ARG A CA  1 
ATOM   2160 C C   . ARG A 1 279 ? -4.22191  21.47678  28.81432  1.000 39.69160 ? 279 ARG A C   1 
ATOM   2161 O O   . ARG A 1 279 ? -4.86346  21.36377  27.76572  1.000 34.59890 ? 279 ARG A O   1 
ATOM   2162 C CB  . ARG A 1 279 ? -4.50291  23.20313  30.63207  1.000 32.92396 ? 279 ARG A CB  1 
ATOM   2163 C CG  . ARG A 1 279 ? -3.94979  24.46646  31.28683  1.000 44.49385 ? 279 ARG A CG  1 
ATOM   2164 C CD  . ARG A 1 279 ? -4.83628  25.01246  32.39910  1.000 45.65307 ? 279 ARG A CD  1 
ATOM   2165 N NE  . ARG A 1 279 ? -5.95772  25.78500  31.87862  1.000 55.56466 ? 279 ARG A NE  1 
ATOM   2166 C CZ  . ARG A 1 279 ? -6.58287  26.74420  32.54889  1.000 61.52588 ? 279 ARG A CZ  1 
ATOM   2167 N NH1 . ARG A 1 279 ? -6.20097  27.10125  33.76322  1.000 60.03956 ? 279 ARG A NH1 1 
ATOM   2168 N NH2 . ARG A 1 279 ? -7.61268  27.36697  31.98291  1.000 65.89666 ? 279 ARG A NH2 1 
ATOM   2169 N N   . THR A 1 280 ? -3.86490  20.42930  29.54732  1.000 28.64273 ? 280 THR A N   1 
ATOM   2170 C CA  . THR A 1 280 ? -4.24517  19.07564  29.18665  1.000 31.68649 ? 280 THR A CA  1 
ATOM   2171 C C   . THR A 1 280 ? -5.04677  18.43587  30.31083  1.000 30.17721 ? 280 THR A C   1 
ATOM   2172 O O   . THR A 1 280 ? -4.94560  18.81616  31.48220  1.000 30.07375 ? 280 THR A O   1 
ATOM   2173 C CB  . THR A 1 280 ? -3.02459  18.20455  28.88266  1.000 32.48221 ? 280 THR A CB  1 
ATOM   2174 O OG1 . THR A 1 280 ? -2.18853  18.15276  30.04357  1.000 30.85805 ? 280 THR A OG1 1 
ATOM   2175 C CG2 . THR A 1 280 ? -2.23925  18.77302  27.70799  1.000 35.80926 ? 280 THR A CG2 1 
ATOM   2176 N N   . ILE A 1 281 ? -5.85169  17.45322  29.92441  1.000 28.11071 ? 281 ILE A N   1 
ATOM   2177 C CA  . ILE A 1 281 ? -6.60797  16.62119  30.84717  1.000 25.92319 ? 281 ILE A CA  1 
ATOM   2178 C C   . ILE A 1 281 ? -6.31144  15.17956  30.47175  1.000 32.49532 ? 281 ILE A C   1 
ATOM   2179 O O   . ILE A 1 281 ? -6.58739  14.76196  29.33888  1.000 28.60922 ? 281 ILE A O   1 
ATOM   2180 C CB  . ILE A 1 281 ? -8.11689  16.90706  30.77977  1.000 23.88392 ? 281 ILE A CB  1 
ATOM   2181 C CG1 . ILE A 1 281 ? -8.41512  18.34396  31.21056  1.000 23.76726 ? 281 ILE A CG1 1 
ATOM   2182 C CG2 . ILE A 1 281 ? -8.89895  15.89340  31.61394  1.000 23.37130 ? 281 ILE A CG2 1 
ATOM   2183 C CD1 . ILE A 1 281 ? -9.86711  18.73754  31.01536  1.000 27.39378 ? 281 ILE A CD1 1 
ATOM   2184 N N   . LEU A 1 282 ? -5.71602  14.43347  31.40231  1.000 30.88648 ? 282 LEU A N   1 
ATOM   2185 C CA  . LEU A 1 282 ? -5.29282  13.05891  31.14299  1.000 30.03382 ? 282 LEU A CA  1 
ATOM   2186 C C   . LEU A 1 282 ? -4.42581  12.98363  29.88609  1.000 27.18046 ? 282 LEU A C   1 
ATOM   2187 O O   . LEU A 1 282 ? -4.57451  12.09084  29.05074  1.000 26.14527 ? 282 LEU A O   1 
ATOM   2188 C CB  . LEU A 1 282 ? -6.50235  12.12409  31.04438  1.000 26.84864 ? 282 LEU A CB  1 
ATOM   2189 C CG  . LEU A 1 282 ? -7.25996  11.88659  32.35600  1.000 26.09299 ? 282 LEU A CG  1 
ATOM   2190 C CD1 . LEU A 1 282 ? -8.44348  10.95619  32.13335  1.000 26.29001 ? 282 LEU A CD1 1 
ATOM   2191 C CD2 . LEU A 1 282 ? -6.32660  11.31792  33.41765  1.000 33.16333 ? 282 LEU A CD2 1 
ATOM   2192 N N   . GLY A 1 283 ? -3.51948  13.94948  29.74651  1.000 30.38583 ? 283 GLY A N   1 
ATOM   2193 C CA  . GLY A 1 283 ? -2.59953  13.97924  28.62643  1.000 32.72681 ? 283 GLY A CA  1 
ATOM   2194 C C   . GLY A 1 283 ? -3.20061  14.37412  27.29608  1.000 37.96668 ? 283 GLY A C   1 
ATOM   2195 O O   . GLY A 1 283 ? -2.51167  14.28665  26.27397  1.000 35.29948 ? 283 GLY A O   1 
ATOM   2196 N N   . SER A 1 284 ? -4.45781  14.81013  27.26897  1.000 32.22100 ? 284 SER A N   1 
ATOM   2197 C CA  . SER A 1 284 ? -5.13898  15.16587  26.03287  1.000 29.31811 ? 284 SER A CA  1 
ATOM   2198 C C   . SER A 1 284 ? -5.42426  16.66088  25.99273  1.000 29.00493 ? 284 SER A C   1 
ATOM   2199 O O   . SER A 1 284 ? -5.74717  17.27195  27.01606  1.000 29.00208 ? 284 SER A O   1 
ATOM   2200 C CB  . SER A 1 284 ? -6.44578  14.38440  25.88124  1.000 33.29755 ? 284 SER A CB  1 
ATOM   2201 O OG  . SER A 1 284 ? -7.24505  14.95483  24.85739  1.000 40.63003 ? 284 SER A OG  1 
ATOM   2202 N N   . ALA A 1 285 ? -5.31411  17.24268  24.80095  1.000 30.97350 ? 285 ALA A N   1 
ATOM   2203 C CA  . ALA A 1 285 ? -5.54771  18.66427  24.60096  1.000 29.39287 ? 285 ALA A CA  1 
ATOM   2204 C C   . ALA A 1 285 ? -6.95768  18.97119  24.11887  1.000 31.39130 ? 285 ALA A C   1 
ATOM   2205 O O   . ALA A 1 285 ? -7.30410  20.14557  23.97233  1.000 36.22113 ? 285 ALA A O   1 
ATOM   2206 C CB  . ALA A 1 285 ? -4.52516  19.23467  23.61142  1.000 36.15857 ? 285 ALA A CB  1 
ATOM   2207 N N   . LEU A 1 286 ? -7.77435  17.95269  23.86892  1.000 29.08211 ? 286 LEU A N   1 
ATOM   2208 C CA  . LEU A 1 286 ? -9.18018  18.13397  23.54456  1.000 28.85297 ? 286 LEU A CA  1 
ATOM   2209 C C   . LEU A 1 286 ? -10.01356 17.21393  24.42794  1.000 30.78908 ? 286 LEU A C   1 
ATOM   2210 O O   . LEU A 1 286 ? -9.48897  16.35089  25.13568  1.000 29.02415 ? 286 LEU A O   1 
ATOM   2211 C CB  . LEU A 1 286 ? -9.46065  17.87019  22.05672  1.000 34.95767 ? 286 LEU A CB  1 
ATOM   2212 C CG  . LEU A 1 286 ? -8.84182  16.65193  21.36900  1.000 40.12854 ? 286 LEU A CG  1 
ATOM   2213 C CD1 . LEU A 1 286 ? -9.52809  15.34522  21.76594  1.000 37.10627 ? 286 LEU A CD1 1 
ATOM   2214 C CD2 . LEU A 1 286 ? -8.86718  16.84805  19.85382  1.000 40.82946 ? 286 LEU A CD2 1 
ATOM   2215 N N   . LEU A 1 287 ? -11.32719 17.40674  24.38585  1.000 25.09141 ? 287 LEU A N   1 
ATOM   2216 C CA  . LEU A 1 287 ? -12.23048 16.63955  25.23131  1.000 23.53628 ? 287 LEU A CA  1 
ATOM   2217 C C   . LEU A 1 287 ? -12.52071 15.29675  24.57304  1.000 23.32768 ? 287 LEU A C   1 
ATOM   2218 O O   . LEU A 1 287 ? -13.06510 15.25094  23.46755  1.000 33.30393 ? 287 LEU A O   1 
ATOM   2219 C CB  . LEU A 1 287 ? -13.51074 17.43389  25.47415  1.000 27.01678 ? 287 LEU A CB  1 
ATOM   2220 C CG  . LEU A 1 287 ? -13.23366 18.84872  25.99942  1.000 25.91366 ? 287 LEU A CG  1 
ATOM   2221 C CD1 . LEU A 1 287 ? -14.50804 19.67813  26.05640  1.000 28.81181 ? 287 LEU A CD1 1 
ATOM   2222 C CD2 . LEU A 1 287 ? -12.54877 18.79966  27.37069  1.000 29.40933 ? 287 LEU A CD2 1 
ATOM   2223 N N   . GLU A 1 288 ? -12.15115 14.20880  25.24714  1.000 26.67508 ? 288 GLU A N   1 
ATOM   2224 C CA  . GLU A 1 288 ? -12.25793 12.86153  24.69538  1.000 28.29519 ? 288 GLU A CA  1 
ATOM   2225 C C   . GLU A 1 288 ? -13.64488 12.29120  24.95971  1.000 23.82187 ? 288 GLU A C   1 
ATOM   2226 O O   . GLU A 1 288 ? -14.12768 12.33372  26.09592  1.000 22.03230 ? 288 GLU A O   1 
ATOM   2227 C CB  . GLU A 1 288 ? -11.19216 11.95395  25.31258  1.000 26.50603 ? 288 GLU A CB  1 
ATOM   2228 C CG  . GLU A 1 288 ? -9.80574  12.57151  25.31147  1.000 36.45581 ? 288 GLU A CG  1 
ATOM   2229 C CD  . GLU A 1 288 ? -8.74982  11.67168  24.69171  1.000 50.95629 ? 288 GLU A CD  1 
ATOM   2230 O OE1 . GLU A 1 288 ? -8.56554  10.53701  25.17969  1.000 68.80946 ? 288 GLU A OE1 1 
ATOM   2231 O OE2 . GLU A 1 288 ? -8.10001  12.10202  23.71567  1.000 44.68507 ? 288 GLU A OE2 1 
ATOM   2232 N N   . ASP A 1 289 ? -14.27657 11.73355  23.91726  1.000 24.40606 ? 289 ASP A N   1 
ATOM   2233 C CA  . ASP A 1 289 ? -15.64132 11.22790  24.04017  1.000 24.17581 ? 289 ASP A CA  1 
ATOM   2234 C C   . ASP A 1 289 ? -15.77907 9.75687   23.65928  1.000 21.63941 ? 289 ASP A C   1 
ATOM   2235 O O   . ASP A 1 289 ? -16.89136 9.29914   23.38060  1.000 19.99461 ? 289 ASP A O   1 
ATOM   2236 C CB  . ASP A 1 289 ? -16.61065 12.07547  23.20778  1.000 24.24633 ? 289 ASP A CB  1 
ATOM   2237 C CG  . ASP A 1 289 ? -16.51353 11.80907  21.70723  1.000 29.10923 ? 289 ASP A CG  1 
ATOM   2238 O OD1 . ASP A 1 289 ? -15.46443 11.32514  21.23116  1.000 26.05443 ? 289 ASP A OD1 1 
ATOM   2239 O OD2 . ASP A 1 289 ? -17.50540 12.10480  20.99702  1.000 27.78152 ? 289 ASP A OD2 1 
ATOM   2240 N N   . GLU A 1 290 ? -14.69205 8.99224   23.64429  1.000 20.48640 ? 290 GLU A N   1 
ATOM   2241 C CA  . GLU A 1 290 ? -14.79456 7.57898   23.29947  1.000 30.22962 ? 290 GLU A CA  1 
ATOM   2242 C C   . GLU A 1 290 ? -14.44800 6.67314   24.48084  1.000 27.46358 ? 290 GLU A C   1 
ATOM   2243 O O   . GLU A 1 290 ? -13.95225 5.56203   24.29646  1.000 24.86700 ? 290 GLU A O   1 
ATOM   2244 C CB  . GLU A 1 290 ? -13.94510 7.25962   22.06627  1.000 27.87023 ? 290 GLU A CB  1 
ATOM   2245 C CG  . GLU A 1 290 ? -14.44368 7.99524   20.81249  1.000 26.21681 ? 290 GLU A CG  1 
ATOM   2246 C CD  . GLU A 1 290 ? -14.06938 7.30794   19.50346  1.000 32.35274 ? 290 GLU A CD  1 
ATOM   2247 O OE1 . GLU A 1 290 ? -13.25460 6.36546   19.52159  1.000 29.69245 ? 290 GLU A OE1 1 
ATOM   2248 O OE2 . GLU A 1 290 ? -14.60702 7.70950   18.44795  1.000 32.90989 ? 290 GLU A OE2 1 
ATOM   2249 N N   . PHE A 1 291 ? -14.73082 7.13598   25.69945  1.000 22.63863 ? 291 PHE A N   1 
ATOM   2250 C CA  . PHE A 1 291 ? -14.78225 6.29732   26.89123  1.000 21.25892 ? 291 PHE A CA  1 
ATOM   2251 C C   . PHE A 1 291 ? -16.20218 6.33706   27.43796  1.000 22.76917 ? 291 PHE A C   1 
ATOM   2252 O O   . PHE A 1 291 ? -16.67550 7.40338   27.83797  1.000 20.00355 ? 291 PHE A O   1 
ATOM   2253 C CB  . PHE A 1 291 ? -13.82559 6.78809   27.98495  1.000 20.97898 ? 291 PHE A CB  1 
ATOM   2254 C CG  . PHE A 1 291 ? -12.36937 6.67932   27.64527  1.000 24.19678 ? 291 PHE A CG  1 
ATOM   2255 C CD1 . PHE A 1 291 ? -11.71054 5.47028   27.76001  1.000 26.39594 ? 291 PHE A CD1 1 
ATOM   2256 C CD2 . PHE A 1 291 ? -11.64322 7.80023   27.27791  1.000 28.63897 ? 291 PHE A CD2 1 
ATOM   2257 C CE1 . PHE A 1 291 ? -10.35908 5.37187   27.47431  1.000 27.92979 ? 291 PHE A CE1 1 
ATOM   2258 C CE2 . PHE A 1 291 ? -10.29407 7.70981   26.99810  1.000 31.60552 ? 291 PHE A CE2 1 
ATOM   2259 C CZ  . PHE A 1 291 ? -9.64928  6.49277   27.10050  1.000 28.77311 ? 291 PHE A CZ  1 
ATOM   2260 N N   . THR A 1 292 ? -16.86392 5.18517   27.49460  1.000 21.92719 ? 292 THR A N   1 
ATOM   2261 C CA  . THR A 1 292 ? -18.16232 5.12968   28.15020  1.000 26.14869 ? 292 THR A CA  1 
ATOM   2262 C C   . THR A 1 292 ? -17.99207 5.15345   29.66567  1.000 25.77602 ? 292 THR A C   1 
ATOM   2263 O O   . THR A 1 292 ? -16.89680 4.91439   30.18153  1.000 22.30697 ? 292 THR A O   1 
ATOM   2264 C CB  . THR A 1 292 ? -18.92693 3.86999   27.74747  1.000 24.53071 ? 292 THR A CB  1 
ATOM   2265 O OG1 . THR A 1 292 ? -18.30557 2.71999   28.33327  1.000 24.10016 ? 292 THR A OG1 1 
ATOM   2266 C CG2 . THR A 1 292 ? -18.99663 3.72763   26.22667  1.000 22.14868 ? 292 THR A CG2 1 
ATOM   2267 N N   . PRO A 1 293 ? -19.06484 5.44498   30.40641  1.000 24.21839 ? 293 PRO A N   1 
ATOM   2268 C CA  . PRO A 1 293 ? -18.97656 5.31744   31.86930  1.000 26.77964 ? 293 PRO A CA  1 
ATOM   2269 C C   . PRO A 1 293 ? -18.52454 3.93898   32.31405  1.000 25.51300 ? 293 PRO A C   1 
ATOM   2270 O O   . PRO A 1 293 ? -17.72810 3.82066   33.25432  1.000 25.47975 ? 293 PRO A O   1 
ATOM   2271 C CB  . PRO A 1 293 ? -20.40566 5.63857   32.32720  1.000 27.62409 ? 293 PRO A CB  1 
ATOM   2272 C CG  . PRO A 1 293 ? -20.90201 6.61017   31.28002  1.000 24.88509 ? 293 PRO A CG  1 
ATOM   2273 C CD  . PRO A 1 293 ? -20.31566 6.10596   29.98219  1.000 23.06865 ? 293 PRO A CD  1 
ATOM   2274 N N   . PHE A 1 294 ? -18.99490 2.88522   31.64396  1.000 27.76461 ? 294 PHE A N   1 
ATOM   2275 C CA  . PHE A 1 294 ? -18.53432 1.54438   31.98443  1.000 27.57564 ? 294 PHE A CA  1 
ATOM   2276 C C   . PHE A 1 294 ? -17.05074 1.37346   31.67004  1.000 26.15294 ? 294 PHE A C   1 
ATOM   2277 O O   . PHE A 1 294 ? -16.32002 0.73752   32.44023  1.000 30.76310 ? 294 PHE A O   1 
ATOM   2278 C CB  . PHE A 1 294 ? -19.37304 0.50064   31.24852  1.000 35.74849 ? 294 PHE A CB  1 
ATOM   2279 C CG  . PHE A 1 294 ? -19.10782 -0.90957  31.69171  1.000 47.66299 ? 294 PHE A CG  1 
ATOM   2280 C CD1 . PHE A 1 294 ? -19.33106 -1.28939  33.00664  1.000 54.23599 ? 294 PHE A CD1 1 
ATOM   2281 C CD2 . PHE A 1 294 ? -18.64388 -1.85929  30.79388  1.000 49.28464 ? 294 PHE A CD2 1 
ATOM   2282 C CE1 . PHE A 1 294 ? -19.08941 -2.59109  33.42000  1.000 58.62399 ? 294 PHE A CE1 1 
ATOM   2283 C CE2 . PHE A 1 294 ? -18.40981 -3.16114  31.20016  1.000 55.93856 ? 294 PHE A CE2 1 
ATOM   2284 C CZ  . PHE A 1 294 ? -18.62713 -3.52596  32.51502  1.000 54.67743 ? 294 PHE A CZ  1 
ATOM   2285 N N   . ASP A 1 295 ? -16.58767 1.93662   30.54872  1.000 23.97262 ? 295 ASP A N   1 
ATOM   2286 C CA  . ASP A 1 295 ? -15.16329 1.89664   30.22204  1.000 23.27606 ? 295 ASP A CA  1 
ATOM   2287 C C   . ASP A 1 295 ? -14.31466 2.47560   31.34382  1.000 31.90866 ? 295 ASP A C   1 
ATOM   2288 O O   . ASP A 1 295 ? -13.26583 1.91978   31.69197  1.000 31.03894 ? 295 ASP A O   1 
ATOM   2289 C CB  . ASP A 1 295 ? -14.88346 2.66302   28.93050  1.000 23.86518 ? 295 ASP A CB  1 
ATOM   2290 C CG  . ASP A 1 295 ? -15.35549 1.92819   27.69487  1.000 34.10816 ? 295 ASP A CG  1 
ATOM   2291 O OD1 . ASP A 1 295 ? -15.59606 0.70421   27.78495  1.000 35.08566 ? 295 ASP A OD1 1 
ATOM   2292 O OD2 . ASP A 1 295 ? -15.47696 2.58156   26.63212  1.000 25.27588 ? 295 ASP A OD2 1 
ATOM   2293 N N   . VAL A 1 296 ? -14.74140 3.60685   31.90805  1.000 27.66606 ? 296 VAL A N   1 
ATOM   2294 C CA  . VAL A 1 296 ? -13.96923 4.24024   32.97043  1.000 23.14837 ? 296 VAL A CA  1 
ATOM   2295 C C   . VAL A 1 296 ? -13.93160 3.34757   34.20383  1.000 28.20202 ? 296 VAL A C   1 
ATOM   2296 O O   . VAL A 1 296 ? -12.86458 3.09413   34.77415  1.000 26.90843 ? 296 VAL A O   1 
ATOM   2297 C CB  . VAL A 1 296 ? -14.54856 5.62994   33.29401  1.000 21.25085 ? 296 VAL A CB  1 
ATOM   2298 C CG1 . VAL A 1 296 ? -13.79020 6.25312   34.43940  1.000 24.78061 ? 296 VAL A CG1 1 
ATOM   2299 C CG2 . VAL A 1 296 ? -14.48137 6.52493   32.06352  1.000 20.32014 ? 296 VAL A CG2 1 
ATOM   2300 N N   . VAL A 1 297 ? -15.09671 2.85671   34.63037  1.000 29.32140 ? 297 VAL A N   1 
ATOM   2301 C CA  . VAL A 1 297 ? -15.16041 1.99285   35.80642  1.000 27.60602 ? 297 VAL A CA  1 
ATOM   2302 C C   . VAL A 1 297 ? -14.28615 0.75939   35.60514  1.000 34.26767 ? 297 VAL A C   1 
ATOM   2303 O O   . VAL A 1 297 ? -13.51690 0.37443   36.49308  1.000 29.81522 ? 297 VAL A O   1 
ATOM   2304 C CB  . VAL A 1 297 ? -16.62080 1.61428   36.11409  1.000 32.14047 ? 297 VAL A CB  1 
ATOM   2305 C CG1 . VAL A 1 297 ? -16.67620 0.45488   37.09450  1.000 36.63784 ? 297 VAL A CG1 1 
ATOM   2306 C CG2 . VAL A 1 297 ? -17.36953 2.81599   36.67188  1.000 30.77919 ? 297 VAL A CG2 1 
ATOM   2307 N N   . ARG A 1 298 ? -14.37083 0.14094   34.42070  1.000 31.94204 ? 298 ARG A N   1 
ATOM   2308 C CA  . ARG A 1 298 ? -13.53064 -1.01525  34.11161  1.000 32.41412 ? 298 ARG A CA  1 
ATOM   2309 C C   . ARG A 1 298 ? -12.05479 -0.69782  34.30392  1.000 28.07621 ? 298 ARG A C   1 
ATOM   2310 O O   . ARG A 1 298 ? -11.32801 -1.43588  34.97839  1.000 34.07474 ? 298 ARG A O   1 
ATOM   2311 C CB  . ARG A 1 298 ? -13.76511 -1.48284  32.67407  1.000 32.64390 ? 298 ARG A CB  1 
ATOM   2312 C CG  . ARG A 1 298 ? -15.10229 -2.14120  32.41988  1.000 43.11068 ? 298 ARG A CG  1 
ATOM   2313 C CD  . ARG A 1 298 ? -15.07548 -2.95729  31.12989  1.000 51.57654 ? 298 ARG A CD  1 
ATOM   2314 N NE  . ARG A 1 298 ? -14.94146 -2.14458  29.92476  1.000 45.78412 ? 298 ARG A NE  1 
ATOM   2315 C CZ  . ARG A 1 298 ? -13.84431 -2.08130  29.18036  1.000 39.84736 ? 298 ARG A CZ  1 
ATOM   2316 N NH1 . ARG A 1 298 ? -12.74766 -2.75112  29.50362  1.000 34.92515 ? 298 ARG A NH1 1 
ATOM   2317 N NH2 . ARG A 1 298 ? -13.84979 -1.33605  28.07861  1.000 37.23994 ? 298 ARG A NH2 1 
ATOM   2318 N N   . GLN A 1 299 ? -11.58862 0.39099   33.69653  1.000 27.68148 ? 299 GLN A N   1 
ATOM   2319 C CA  . GLN A 1 299 ? -10.16062 0.68025   33.71994  1.000 27.43819 ? 299 GLN A CA  1 
ATOM   2320 C C   . GLN A 1 299 ? -9.71200  1.15152   35.09598  1.000 33.42094 ? 299 GLN A C   1 
ATOM   2321 O O   . GLN A 1 299 ? -8.60442  0.82578   35.53879  1.000 31.46656 ? 299 GLN A O   1 
ATOM   2322 C CB  . GLN A 1 299 ? -9.80992  1.71710   32.65228  1.000 28.97570 ? 299 GLN A CB  1 
ATOM   2323 C CG  . GLN A 1 299 ? -8.31964  1.97923   32.58127  1.000 27.14149 ? 299 GLN A CG  1 
ATOM   2324 C CD  . GLN A 1 299 ? -7.89882  2.82757   31.40577  1.000 30.15790 ? 299 GLN A CD  1 
ATOM   2325 O OE1 . GLN A 1 299 ? -6.80225  3.38200   31.40606  1.000 26.81922 ? 299 GLN A OE1 1 
ATOM   2326 N NE2 . GLN A 1 299 ? -8.75516  2.92406   30.38924  1.000 27.14148 ? 299 GLN A NE2 1 
ATOM   2327 N N   . CYS A 1 300 ? -10.55485 1.91454   35.79240  1.000 28.85671 ? 300 CYS A N   1 
ATOM   2328 C CA  . CYS A 1 300 ? -10.16631 2.42709   37.09912  1.000 31.89956 ? 300 CYS A CA  1 
ATOM   2329 C C   . CYS A 1 300 ? -10.32299 1.40229   38.21459  1.000 29.23423 ? 300 CYS A C   1 
ATOM   2330 O O   . CYS A 1 300 ? -9.75562  1.59926   39.29092  1.000 32.15794 ? 300 CYS A O   1 
ATOM   2331 C CB  . CYS A 1 300 ? -10.96753 3.68796   37.43096  1.000 26.03641 ? 300 CYS A CB  1 
ATOM   2332 S SG  . CYS A 1 300 ? -10.56478 5.08252   36.35568  1.000 34.08733 ? 300 CYS A SG  1 
ATOM   2333 N N   . SER A 1 301 ? -11.05909 0.31475   37.98836  1.000 31.52467 ? 301 SER A N   1 
ATOM   2334 C CA  . SER A 1 301 ? -11.23314 -0.72326  38.99633  1.000 28.84708 ? 301 SER A CA  1 
ATOM   2335 C C   . SER A 1 301 ? -10.55140 -2.03665  38.63411  1.000 32.57935 ? 301 SER A C   1 
ATOM   2336 O O   . SER A 1 301 ? -10.61337 -2.98453  39.42262  1.000 34.05817 ? 301 SER A O   1 
ATOM   2337 C CB  . SER A 1 301 ? -12.72419 -0.97644  39.24948  1.000 34.61193 ? 301 SER A CB  1 
ATOM   2338 O OG  . SER A 1 301 ? -13.33710 -1.54913  38.10908  1.000 45.45303 ? 301 SER A OG  1 
ATOM   2339 N N   . GLY A 1 302 ? -9.91642  -2.12458  37.46869  1.000 30.25505 ? 302 GLY A N   1 
ATOM   2340 C CA  . GLY A 1 302 ? -9.17332  -3.32129  37.10225  1.000 30.79032 ? 302 GLY A CA  1 
ATOM   2341 C C   . GLY A 1 302 ? -10.02393 -4.52014  36.73983  1.000 33.13878 ? 302 GLY A C   1 
ATOM   2342 O O   . GLY A 1 302 ? -9.66791  -5.65312  37.08813  1.000 34.81608 ? 302 GLY A O   1 
ATOM   2343 N N   . VAL A 1 303 ? -11.13993 -4.30008  36.03927  1.000 29.76995 ? 303 VAL A N   1 
ATOM   2344 C CA  . VAL A 1 303 ? -11.98472 -5.40922  35.61015  1.000 29.63855 ? 303 VAL A CA  1 
ATOM   2345 C C   . VAL A 1 303 ? -11.21076 -6.28816  34.64010  1.000 34.62874 ? 303 VAL A C   1 
ATOM   2346 O O   . VAL A 1 303 ? -10.61227 -5.79950  33.67272  1.000 33.54543 ? 303 VAL A O   1 
ATOM   2347 C CB  . VAL A 1 303 ? -13.28178 -4.87915  34.97720  1.000 30.38570 ? 303 VAL A CB  1 
ATOM   2348 C CG1 . VAL A 1 303 ? -14.07964 -6.01990  34.35635  1.000 34.23582 ? 303 VAL A CG1 1 
ATOM   2349 C CG2 . VAL A 1 303 ? -14.12117 -4.14714  36.01506  1.000 36.90854 ? 303 VAL A CG2 1 
ATOM   2350 N N   . THR A 1 304 ? -11.21287 -7.59090  34.90004  1.000 28.57137 ? 304 THR A N   1 
ATOM   2351 C CA  . THR A 1 304 ? -10.53026 -8.57124  34.06880  1.000 33.10441 ? 304 THR A CA  1 
ATOM   2352 C C   . THR A 1 304 ? -11.54564 -9.47138  33.37757  1.000 37.35481 ? 304 THR A C   1 
ATOM   2353 O O   . THR A 1 304 ? -12.75335 -9.40686  33.63033  1.000 35.05764 ? 304 THR A O   1 
ATOM   2354 C CB  . THR A 1 304 ? -9.55666  -9.41478  34.90098  1.000 33.99753 ? 304 THR A CB  1 
ATOM   2355 O OG1 . THR A 1 304 ? -10.26172 -10.02994 35.99168  1.000 32.90935 ? 304 THR A OG1 1 
ATOM   2356 C CG2 . THR A 1 304 ? -8.43978  -8.53975  35.44396  1.000 30.23468 ? 304 THR A CG2 1 
ATOM   2357 N N   . PHE A 1 305 ? -11.03525 -10.32558 32.49566  1.000 35.27803 ? 305 PHE A N   1 
ATOM   2358 C CA  . PHE A 1 305 ? -11.87449 -11.20610 31.69773  1.000 41.17942 ? 305 PHE A CA  1 
ATOM   2359 C C   . PHE A 1 305 ? -11.31146 -12.61721 31.71271  1.000 48.60857 ? 305 PHE A C   1 
ATOM   2360 O O   . PHE A 1 305 ? -10.10435 -12.82451 31.87343  1.000 45.66845 ? 305 PHE A O   1 
ATOM   2361 C CB  . PHE A 1 305 ? -12.00009 -10.68794 30.26215  1.000 38.87690 ? 305 PHE A CB  1 
ATOM   2362 C CG  . PHE A 1 305 ? -12.40795 -9.25274  30.19725  1.000 38.38071 ? 305 PHE A CG  1 
ATOM   2363 C CD1 . PHE A 1 305 ? -13.72306 -8.88909  30.43465  1.000 31.45330 ? 305 PHE A CD1 1 
ATOM   2364 C CD2 . PHE A 1 305 ? -11.47101 -8.26138  29.96393  1.000 34.76916 ? 305 PHE A CD2 1 
ATOM   2365 C CE1 . PHE A 1 305 ? -14.10434 -7.56633  30.41493  1.000 32.12235 ? 305 PHE A CE1 1 
ATOM   2366 C CE2 . PHE A 1 305 ? -11.84651 -6.93471  29.93893  1.000 34.91276 ? 305 PHE A CE2 1 
ATOM   2367 C CZ  . PHE A 1 305 ? -13.16433 -6.58766  30.16749  1.000 37.49530 ? 305 PHE A CZ  1 
ATOM   2368 N N   . GLN A 1 306 ? -12.20980 -13.58296 31.55252  1.000 51.07167 ? 306 GLN A N   1 
ATOM   2369 C CA  . GLN A 1 306 ? -11.85650 -14.99446 31.58182  1.000 55.43414 ? 306 GLN A CA  1 
ATOM   2370 C C   . GLN A 1 306 ? -11.99792 -15.62472 30.19801  1.000 50.54708 ? 306 GLN A C   1 
ATOM   2371 O O   . GLN A 1 306 ? -12.33420 -16.80224 30.07307  1.000 70.25169 ? 306 GLN A O   1 
ATOM   2372 C CB  . GLN A 1 306 ? -12.73216 -15.73178 32.59765  1.000 52.94088 ? 306 GLN A CB  1 
ATOM   2373 C CG  . GLN A 1 306 ? -12.51384 -15.28491 34.03333  1.000 53.60288 ? 306 GLN A CG  1 
ATOM   2374 C CD  . GLN A 1 306 ? -11.19085 -15.76797 34.59052  1.000 62.10963 ? 306 GLN A CD  1 
ATOM   2375 O OE1 . GLN A 1 306 ? -10.77893 -16.90074 34.33939  1.000 66.23661 ? 306 GLN A OE1 1 
ATOM   2376 N NE2 . GLN A 1 306 ? -10.51327 -14.90870 35.34582  1.000 58.00387 ? 306 GLN A NE2 1 
HETATM 2377 N N1  . THC B 2 1   ? -17.60691 12.41326  -1.89316  1.000 36.31650 ? 0   THC C N1  1 
HETATM 2378 C CN  . THC B 2 1   ? -17.59348 13.65976  -2.59153  1.000 40.21184 ? 0   THC C CN  1 
HETATM 2379 O ON  . THC B 2 1   ? -16.61849 13.83414  -3.32327  1.000 39.93777 ? 0   THC C ON  1 
HETATM 2380 C CM  . THC B 2 1   ? -18.56214 14.73794  -2.20017  1.000 38.80791 ? 0   THC C CM  1 
HETATM 2381 C CA  . THC B 2 1   ? -16.73990 11.27308  -2.16211  1.000 37.08966 ? 0   THC C CA  1 
HETATM 2382 C CB  . THC B 2 1   ? -15.56370 11.20014  -1.15644  1.000 41.98510 ? 0   THC C CB  1 
HETATM 2383 O OG1 . THC B 2 1   ? -14.85291 12.44661  -1.14972  1.000 41.48812 ? 0   THC C OG1 1 
HETATM 2384 C CG2 . THC B 2 1   ? -14.60132 10.05486  -1.49766  1.000 37.90407 ? 0   THC C CG2 1 
HETATM 2385 C C   . THC B 2 1   ? -17.57284 10.00225  -2.08805  1.000 38.33865 ? 0   THC C C   1 
HETATM 2386 O O   . THC B 2 1   ? -18.47647 9.89793   -1.25815  1.000 35.73849 ? 0   THC C O   1 
ATOM   2387 N N   . SER B 2 2   ? -17.28585 9.04144   -2.95991  1.000 33.17764 ? 1   SER C N   1 
ATOM   2388 C CA  . SER B 2 2   ? -18.02873 7.79561   -2.93349  1.000 31.68621 ? 1   SER C CA  1 
ATOM   2389 C C   . SER B 2 2   ? -17.49762 6.88697   -1.83050  1.000 35.20318 ? 1   SER C C   1 
ATOM   2390 O O   . SER B 2 2   ? -16.32553 6.95612   -1.44173  1.000 34.28219 ? 1   SER C O   1 
ATOM   2391 C CB  . SER B 2 2   ? -17.95644 7.08957   -4.28905  1.000 31.21591 ? 1   SER C CB  1 
ATOM   2392 O OG  . SER B 2 2   ? -16.66262 6.57068   -4.52604  1.000 35.76882 ? 1   SER C OG  1 
ATOM   2393 N N   . ALA B 2 3   ? -18.38672 6.05239   -1.30274  1.000 28.66539 ? 2   ALA C N   1 
ATOM   2394 C CA  . ALA B 2 3   ? -17.96083 5.01929   -0.37435  1.000 27.71823 ? 2   ALA C CA  1 
ATOM   2395 C C   . ALA B 2 3   ? -17.06335 4.01976   -1.09349  1.000 27.05930 ? 2   ALA C C   1 
ATOM   2396 O O   . ALA B 2 3   ? -17.24126 3.73343   -2.27902  1.000 28.52021 ? 2   ALA C O   1 
ATOM   2397 C CB  . ALA B 2 3   ? -19.17558 4.31658   0.23258   1.000 30.51760 ? 2   ALA C CB  1 
ATOM   2398 N N   . VAL B 2 4   ? -16.08399 3.49117   -0.36562  1.000 24.68409 ? 3   VAL C N   1 
ATOM   2399 C CA  . VAL B 2 4   ? -15.10857 2.55552   -0.91142  1.000 22.92568 ? 3   VAL C CA  1 
ATOM   2400 C C   . VAL B 2 4   ? -15.16788 1.27475   -0.09804  1.000 25.67452 ? 3   VAL C C   1 
ATOM   2401 O O   . VAL B 2 4   ? -14.83550 1.27617   1.09155   1.000 25.24832 ? 3   VAL C O   1 
ATOM   2402 C CB  . VAL B 2 4   ? -13.68749 3.13434   -0.88923  1.000 29.87076 ? 3   VAL C CB  1 
ATOM   2403 C CG1 . VAL B 2 4   ? -12.69560 2.10973   -1.43353  1.000 30.48453 ? 3   VAL C CG1 1 
ATOM   2404 C CG2 . VAL B 2 4   ? -13.63479 4.43964   -1.67460  1.000 33.11249 ? 3   VAL C CG2 1 
ATOM   2405 N N   . LEU B 2 5   ? -15.56593 0.18289   -0.73612  1.000 23.49024 ? 4   LEU C N   1 
ATOM   2406 C CA  . LEU B 2 5   ? -15.62315 -1.09804  -0.05173  1.000 21.34685 ? 4   LEU C CA  1 
ATOM   2407 C C   . LEU B 2 5   ? -14.21476 -1.67152  0.05994   1.000 23.69898 ? 4   LEU C C   1 
ATOM   2408 O O   . LEU B 2 5   ? -13.53140 -1.86211  -0.95180  1.000 28.54757 ? 4   LEU C O   1 
ATOM   2409 C CB  . LEU B 2 5   ? -16.56687 -2.04576  -0.78165  1.000 27.73220 ? 4   LEU C CB  1 
ATOM   2410 C CG  . LEU B 2 5   ? -17.56572 -2.48743  0.29077   1.000 41.28466 ? 4   LEU C CG  1 
ATOM   2411 C CD1 . LEU B 2 5   ? -18.93239 -2.76115  -0.26497  1.000 50.07260 ? 4   LEU C CD1 1 
ATOM   2412 C CD2 . LEU B 2 5   ? -17.02786 -3.69580  1.04382   1.000 37.39179 ? 4   LEU C CD2 1 
ATOM   2413 N N   . GLN B 2 6   ? -13.77490 -1.93554  1.28643   1.000 21.65271 ? 5   GLN C N   1 
ATOM   2414 C CA  . GLN B 2 6   ? -12.35669 -2.19760  1.52923   1.000 24.04440 ? 5   GLN C CA  1 
ATOM   2415 C C   . GLN B 2 6   ? -12.02121 -3.68669  1.50751   1.000 27.84492 ? 5   GLN C C   1 
ATOM   2416 O O   . GLN B 2 6   ? -11.33451 -4.21835  2.37653   1.000 22.23924 ? 5   GLN C O   1 
ATOM   2417 C CB  . GLN B 2 6   ? -11.93318 -1.53375  2.83260   1.000 21.68298 ? 5   GLN C CB  1 
ATOM   2418 C CG  . GLN B 2 6   ? -11.85943 -0.01715  2.67650   1.000 23.12478 ? 5   GLN C CG  1 
ATOM   2419 C CD  . GLN B 2 6   ? -11.31532 0.69430   3.89657   1.000 24.74389 ? 5   GLN C CD  1 
ATOM   2420 O OE1 . GLN B 2 6   ? -11.92391 0.67151   4.96220   1.000 24.22215 ? 5   GLN C OE1 1 
ATOM   2421 N NE2 . GLN B 2 6   ? -10.16570 1.34084   3.73998   1.000 23.16466 ? 5   GLN C NE2 1 
ATOM   2422 N N   . SER B 2 7   ? -12.50600 -4.36634  0.47413   1.000 25.16319 ? 6   SER C N   1 
ATOM   2423 C CA  . SER B 2 7   ? -11.96451 -5.66560  0.11856   1.000 23.42031 ? 6   SER C CA  1 
ATOM   2424 C C   . SER B 2 7   ? -10.59845 -5.47655  -0.54231  1.000 24.52995 ? 6   SER C C   1 
ATOM   2425 O O   . SER B 2 7   ? -10.16019 -4.35330  -0.80888  1.000 25.74655 ? 6   SER C O   1 
ATOM   2426 C CB  . SER B 2 7   ? -12.92372 -6.40136  -0.81337  1.000 26.79916 ? 6   SER C CB  1 
ATOM   2427 O OG  . SER B 2 7   ? -13.13772 -5.65350  -1.99855  1.000 30.56548 ? 6   SER C OG  1 
ATOM   2428 N N   . GLY B 2 8   ? -9.91392  -6.58822  -0.79551  1.000 24.37832 ? 7   GLY C N   1 
ATOM   2429 C CA  . GLY B 2 8   ? -8.61011  -6.54642  -1.43642  1.000 27.35530 ? 7   GLY C CA  1 
ATOM   2430 C C   . GLY B 2 8   ? -8.55782  -7.37674  -2.70217  1.000 29.31574 ? 7   GLY C C   1 
ATOM   2431 O O   . GLY B 2 8   ? -9.43015  -8.21540  -2.91339  1.000 27.55826 ? 7   GLY C O   1 
ATOM   2432 N N   . PHE B 2 9   ? -7.55719  -7.15493  -3.55576  1.000 35.50555 ? 8   PHE C N   1 
ATOM   2433 C CA  . PHE B 2 9   ? -7.43063  -7.92020  -4.79359  1.000 37.79960 ? 8   PHE C CA  1 
ATOM   2434 C C   . PHE B 2 9   ? -6.81899  -9.28555  -4.51252  1.000 39.38171 ? 8   PHE C C   1 
ATOM   2435 O O   . PHE B 2 9   ? -5.93909  -9.41841  -3.65776  1.000 36.97641 ? 8   PHE C O   1 
ATOM   2436 C CB  . PHE B 2 9   ? -6.56633  -7.17593  -5.81542  1.000 42.29782 ? 8   PHE C CB  1 
ATOM   2437 C CG  . PHE B 2 9   ? -7.04475  -5.78754  -6.12204  1.000 58.55576 ? 8   PHE C CG  1 
ATOM   2438 C CD1 . PHE B 2 9   ? -7.99329  -5.56534  -7.10822  1.000 63.21338 ? 8   PHE C CD1 1 
ATOM   2439 C CD2 . PHE B 2 9   ? -6.53866  -4.69992  -5.42680  1.000 62.56891 ? 8   PHE C CD2 1 
ATOM   2440 C CE1 . PHE B 2 9   ? -8.43031  -4.28158  -7.39252  1.000 70.27167 ? 8   PHE C CE1 1 
ATOM   2441 C CE2 . PHE B 2 9   ? -6.96961  -3.41717  -5.70497  1.000 65.05315 ? 8   PHE C CE2 1 
ATOM   2442 C CZ  . PHE B 2 9   ? -7.91711  -3.20665  -6.68905  1.000 70.51543 ? 8   PHE C CZ  1 
ATOM   2443 N N   . ARG B 2 10  ? -7.28102  -10.30195 -5.24323  1.000 35.28333 ? 9   ARG C N   1 
ATOM   2444 C CA  . ARG B 2 10  ? -6.74564  -11.64459 -5.05234  1.000 38.47502 ? 9   ARG C CA  1 
ATOM   2445 C C   . ARG B 2 10  ? -5.30975  -11.72174 -5.55396  1.000 43.46558 ? 9   ARG C C   1 
ATOM   2446 O O   . ARG B 2 10  ? -4.99626  -11.25454 -6.65395  1.000 46.15465 ? 9   ARG C O   1 
ATOM   2447 C CB  . ARG B 2 10  ? -7.59734  -12.69609 -5.76597  1.000 42.75590 ? 9   ARG C CB  1 
ATOM   2448 C CG  . ARG B 2 10  ? -7.42988  -14.06890 -5.12395  1.000 44.60764 ? 9   ARG C CG  1 
ATOM   2449 C CD  . ARG B 2 10  ? -7.43850  -15.24483 -6.08772  1.000 51.09631 ? 9   ARG C CD  1 
ATOM   2450 N NE  . ARG B 2 10  ? -8.77371  -15.64919 -6.50818  1.000 49.35537 ? 9   ARG C NE  1 
ATOM   2451 C CZ  . ARG B 2 10  ? -9.11868  -16.89769 -6.80002  1.000 49.84595 ? 9   ARG C CZ  1 
ATOM   2452 N NH1 . ARG B 2 10  ? -8.26197  -17.90028 -6.67881  1.000 50.41407 ? 9   ARG C NH1 1 
ATOM   2453 N NH2 . ARG B 2 10  ? -10.35639 -17.14842 -7.21658  1.000 44.89335 ? 9   ARG C NH2 1 
ATOM   2454 N N   . LYS B 2 11  ? -4.44339  -12.32528 -4.74619  1.000 44.25358 ? 10  LYS C N   1 
ATOM   2455 C CA  . LYS B 2 11  ? -3.03057  -12.46917 -5.07805  1.000 47.14340 ? 10  LYS C CA  1 
ATOM   2456 C C   . LYS B 2 11  ? -2.71868  -13.88714 -5.54903  1.000 49.51324 ? 10  LYS C C   1 
ATOM   2457 O O   . LYS B 2 11  ? -3.53246  -14.79911 -5.38820  1.000 47.55133 ? 10  LYS C O   1 
ATOM   2458 C CB  . LYS B 2 11  ? -2.16638  -12.10898 -3.86801  1.000 50.77897 ? 10  LYS C CB  1 
ATOM   2459 C CG  . LYS B 2 11  ? -2.54758  -10.77604 -3.23671  1.000 60.50919 ? 10  LYS C CG  1 
ATOM   2460 C CD  . LYS B 2 11  ? -1.56536  -10.32512 -2.16357  1.000 60.97411 ? 10  LYS C CD  1 
ATOM   2461 C CE  . LYS B 2 11  ? -1.85978  -10.96235 -0.81356  1.000 63.04899 ? 10  LYS C CE  1 
ATOM   2462 N NZ  . LYS B 2 11  ? -1.43643  -10.07051 0.30607   1.000 60.43966 ? 10  LYS C NZ  1 
HETATM 2463 O O   . HOH C 3 .   ? -14.10012 -27.56598 6.68293   1.000 37.72426 ? 401 HOH A O   1 
HETATM 2464 O O   . HOH C 3 .   ? -20.93989 -1.36178  -11.85060 1.000 48.46978 ? 402 HOH A O   1 
HETATM 2465 O O   . HOH C 3 .   ? -25.57245 27.32821  33.34620  1.000 42.05353 ? 403 HOH A O   1 
HETATM 2466 O O   . HOH C 3 .   ? -29.60376 -6.30130  13.08621  1.000 31.36760 ? 404 HOH A O   1 
HETATM 2467 O O   . HOH C 3 .   ? -26.77450 9.02231   19.68001  1.000 43.21870 ? 405 HOH A O   1 
HETATM 2468 O O   . HOH C 3 .   ? -15.66319 15.43488  13.81078  1.000 45.54412 ? 406 HOH A O   1 
HETATM 2469 O O   . HOH C 3 .   ? -11.45389 5.35526   20.73153  1.000 35.63670 ? 407 HOH A O   1 
HETATM 2470 O O   . HOH C 3 .   ? -18.64718 30.22852  30.55529  1.000 46.81996 ? 408 HOH A O   1 
HETATM 2471 O O   . HOH C 3 .   ? -10.96461 -12.55428 35.36298  1.000 48.27193 ? 409 HOH A O   1 
HETATM 2472 O O   . HOH C 3 .   ? -19.31418 -11.28851 -9.16713  1.000 41.34626 ? 410 HOH A O   1 
HETATM 2473 O O   . HOH C 3 .   ? -25.45138 8.16570   -3.07444  1.000 37.89533 ? 411 HOH A O   1 
HETATM 2474 O O   . HOH C 3 .   ? -13.76636 -4.25328  -11.96039 1.000 53.41712 ? 412 HOH A O   1 
HETATM 2475 O O   . HOH C 3 .   ? -11.39547 -1.95183  26.47766  1.000 37.22819 ? 413 HOH A O   1 
HETATM 2476 O O   . HOH C 3 .   ? -12.75707 -23.27383 0.95844   1.000 30.40478 ? 414 HOH A O   1 
HETATM 2477 O O   . HOH C 3 .   ? -9.06528  -10.52657 38.11316  1.000 45.27083 ? 415 HOH A O   1 
HETATM 2478 O O   . HOH C 3 .   ? -26.69289 -21.00329 -9.40801  1.000 38.06295 ? 416 HOH A O   1 
HETATM 2479 O O   . HOH C 3 .   ? -17.48994 -27.32931 -1.14302  1.000 33.57894 ? 417 HOH A O   1 
HETATM 2480 O O   . HOH C 3 .   ? -20.05197 25.00338  17.25978  1.000 38.45260 ? 418 HOH A O   1 
HETATM 2481 O O   . HOH C 3 .   ? -15.62017 -23.75679 21.43579  1.000 36.45896 ? 419 HOH A O   1 
HETATM 2482 O O   . HOH C 3 .   ? -8.43526  4.75455   1.56268   1.000 35.42267 ? 420 HOH A O   1 
HETATM 2483 O O   . HOH C 3 .   ? -18.49897 -24.94008 17.90440  1.000 35.84784 ? 421 HOH A O   1 
HETATM 2484 O O   . HOH C 3 .   ? -22.33173 -5.81057  -11.42537 1.000 46.10693 ? 422 HOH A O   1 
HETATM 2485 O O   . HOH C 3 .   ? -14.71985 12.78870  19.30097  1.000 45.44811 ? 423 HOH A O   1 
HETATM 2486 O O   . HOH C 3 .   ? -9.01525  21.84942  23.16432  1.000 39.47184 ? 424 HOH A O   1 
HETATM 2487 O O   . HOH C 3 .   ? -23.46624 -7.71607  25.43197  1.000 43.99075 ? 425 HOH A O   1 
HETATM 2488 O O   . HOH C 3 .   ? -33.11964 -10.09728 -2.61408  1.000 43.77131 ? 426 HOH A O   1 
HETATM 2489 O O   . HOH C 3 .   ? -33.76822 8.60353   37.55259  1.000 30.05224 ? 427 HOH A O   1 
HETATM 2490 O O   . HOH C 3 .   ? -3.27008  18.52393  33.88707  1.000 40.53671 ? 428 HOH A O   1 
HETATM 2491 O O   . HOH C 3 .   ? -29.32854 12.59727  23.59605  1.000 35.37600 ? 429 HOH A O   1 
HETATM 2492 O O   . HOH C 3 .   ? -6.90359  -8.65769  0.65286   1.000 40.87842 ? 430 HOH A O   1 
HETATM 2493 O O   . HOH C 3 .   ? -13.76356 15.32447  20.99220  1.000 38.43017 ? 431 HOH A O   1 
HETATM 2494 O O   . HOH C 3 .   ? -29.02080 -17.20864 6.07777   1.000 42.96995 ? 432 HOH A O   1 
HETATM 2495 O O   . HOH C 3 .   ? -14.88707 -23.75137 -1.32460  1.000 40.76952 ? 433 HOH A O   1 
HETATM 2496 O O   . HOH C 3 .   ? -27.66248 -3.02503  22.19728  1.000 44.16172 ? 434 HOH A O   1 
HETATM 2497 O O   . HOH C 3 .   ? -5.66530  -1.52075  9.69834   1.000 26.73543 ? 435 HOH A O   1 
HETATM 2498 O O   . HOH C 3 .   ? -33.81684 8.08044   34.04780  1.000 38.10831 ? 436 HOH A O   1 
HETATM 2499 O O   . HOH C 3 .   ? -20.39626 -10.07037 26.10864  1.000 35.92348 ? 437 HOH A O   1 
HETATM 2500 O O   . HOH C 3 .   ? -10.65040 -18.18340 19.94426  1.000 35.18775 ? 438 HOH A O   1 
HETATM 2501 O O   . HOH C 3 .   ? -26.33539 20.76805  17.83136  1.000 41.86451 ? 439 HOH A O   1 
HETATM 2502 O O   . HOH C 3 .   ? -18.35019 22.42846  39.00157  1.000 38.01354 ? 440 HOH A O   1 
HETATM 2503 O O   . HOH C 3 .   ? -30.11875 4.38969   3.48889   1.000 36.62953 ? 441 HOH A O   1 
HETATM 2504 O O   . HOH C 3 .   ? -30.71565 8.81987   26.97996  1.000 34.48338 ? 442 HOH A O   1 
HETATM 2505 O O   . HOH C 3 .   ? -28.95193 21.95032  39.24977  1.000 25.85072 ? 443 HOH A O   1 
HETATM 2506 O O   . HOH C 3 .   ? -13.18191 2.92308   25.45623  1.000 30.36108 ? 444 HOH A O   1 
HETATM 2507 O O   . HOH C 3 .   ? -27.34952 6.19675   21.91977  1.000 41.42580 ? 445 HOH A O   1 
HETATM 2508 O O   . HOH C 3 .   ? -2.19545  -15.20990 11.21118  1.000 42.48024 ? 446 HOH A O   1 
HETATM 2509 O O   . HOH C 3 .   ? -15.43378 19.19781  22.49416  1.000 29.42565 ? 447 HOH A O   1 
HETATM 2510 O O   . HOH C 3 .   ? -25.78835 -18.67387 -4.66582  1.000 30.48544 ? 448 HOH A O   1 
HETATM 2511 O O   . HOH C 3 .   ? -15.00615 5.89796   16.59265  1.000 25.65193 ? 449 HOH A O   1 
HETATM 2512 O O   . HOH C 3 .   ? -8.75804  3.90671   40.05793  1.000 35.98286 ? 450 HOH A O   1 
HETATM 2513 O O   . HOH C 3 .   ? -22.72145 12.34173  43.80902  1.000 38.32712 ? 451 HOH A O   1 
HETATM 2514 O O   . HOH C 3 .   ? -11.37272 -8.96947  13.32484  1.000 27.43393 ? 452 HOH A O   1 
HETATM 2515 O O   . HOH C 3 .   ? -10.88163 4.33582   40.93284  1.000 43.72642 ? 453 HOH A O   1 
HETATM 2516 O O   . HOH C 3 .   ? -9.10781  1.64583   0.95948   1.000 33.99692 ? 454 HOH A O   1 
HETATM 2517 O O   . HOH C 3 .   ? -6.20425  25.21180  24.46130  1.000 46.41195 ? 455 HOH A O   1 
HETATM 2518 O O   . HOH C 3 .   ? -18.82282 18.27004  18.40779  1.000 39.39678 ? 456 HOH A O   1 
HETATM 2519 O O   . HOH C 3 .   ? -15.70494 0.15085   -3.59011  1.000 34.34247 ? 457 HOH A O   1 
HETATM 2520 O O   . HOH C 3 .   ? -7.65066  -17.72408 13.07396  1.000 38.62309 ? 458 HOH A O   1 
HETATM 2521 O O   . HOH C 3 .   ? -15.90535 -1.09218  25.05357  1.000 31.31392 ? 459 HOH A O   1 
HETATM 2522 O O   . HOH C 3 .   ? -31.66421 -6.17452  4.14509   1.000 44.65906 ? 460 HOH A O   1 
HETATM 2523 O O   . HOH C 3 .   ? -9.19158  -6.47685  39.58163  1.000 42.44405 ? 461 HOH A O   1 
HETATM 2524 O O   . HOH C 3 .   ? -7.81424  -9.36440  3.31660   1.000 23.25671 ? 462 HOH A O   1 
HETATM 2525 O O   . HOH C 3 .   ? -28.39200 1.28162   6.10531   1.000 31.71897 ? 463 HOH A O   1 
HETATM 2526 O O   . HOH C 3 .   ? -3.97159  3.29689   23.58829  1.000 43.61040 ? 464 HOH A O   1 
HETATM 2527 O O   . HOH C 3 .   ? -29.64412 -0.93847  8.92848   1.000 35.63407 ? 465 HOH A O   1 
HETATM 2528 O O   . HOH C 3 .   ? -26.83445 2.51655   -6.51732  1.000 44.52067 ? 466 HOH A O   1 
HETATM 2529 O O   . HOH C 3 .   ? -25.20569 9.71580   6.40226   1.000 33.81003 ? 467 HOH A O   1 
HETATM 2530 O O   . HOH C 3 .   ? -26.20609 5.70610   -2.50272  1.000 34.25121 ? 468 HOH A O   1 
HETATM 2531 O O   . HOH C 3 .   ? -15.16075 -18.04993 26.13252  1.000 37.88445 ? 469 HOH A O   1 
HETATM 2532 O O   . HOH C 3 .   ? -24.08980 9.73073   8.97824   1.000 28.68441 ? 470 HOH A O   1 
HETATM 2533 O O   . HOH C 3 .   ? -19.41476 4.21508   42.89798  1.000 34.53531 ? 471 HOH A O   1 
HETATM 2534 O O   . HOH C 3 .   ? -30.27485 -15.76891 4.52904   1.000 33.54431 ? 472 HOH A O   1 
HETATM 2535 O O   . HOH C 3 .   ? -17.56327 20.72824  19.54856  1.000 44.59024 ? 473 HOH A O   1 
HETATM 2536 O O   . HOH C 3 .   ? -21.39500 11.84237  15.12640  1.000 32.76438 ? 474 HOH A O   1 
HETATM 2537 O O   . HOH C 3 .   ? -14.89932 9.78231   26.83291  1.000 20.40970 ? 475 HOH A O   1 
HETATM 2538 O O   . HOH C 3 .   ? -15.41395 -11.62602 -6.69299  1.000 37.40655 ? 476 HOH A O   1 
HETATM 2539 O O   . HOH C 3 .   ? -32.59314 16.35056  28.76612  1.000 33.62487 ? 477 HOH A O   1 
HETATM 2540 O O   . HOH C 3 .   ? -29.23444 -15.20583 -5.60664  1.000 32.20248 ? 478 HOH A O   1 
HETATM 2541 O O   . HOH C 3 .   ? -28.30462 -7.52219  -12.61590 1.000 39.73376 ? 479 HOH A O   1 
HETATM 2542 O O   . HOH C 3 .   ? -17.10920 -29.97427 13.17380  1.000 38.10377 ? 480 HOH A O   1 
HETATM 2543 O O   . HOH C 3 .   ? -27.04705 20.85585  40.69906  1.000 31.60529 ? 481 HOH A O   1 
HETATM 2544 O O   . HOH C 3 .   ? -15.40750 -9.08136  33.15713  1.000 37.08899 ? 482 HOH A O   1 
HETATM 2545 O O   . HOH C 3 .   ? -20.88584 -28.46837 9.54101   1.000 31.72062 ? 483 HOH A O   1 
HETATM 2546 O O   . HOH C 3 .   ? -2.11569  27.57352  30.25456  1.000 35.06199 ? 484 HOH A O   1 
HETATM 2547 O O   . HOH C 3 .   ? -30.61370 15.73837  35.99381  1.000 30.29606 ? 485 HOH A O   1 
HETATM 2548 O O   . HOH C 3 .   ? -13.58102 -29.02722 15.03534  1.000 39.15038 ? 486 HOH A O   1 
HETATM 2549 O O   . HOH C 3 .   ? -18.75747 0.18702   27.43305  1.000 32.95739 ? 487 HOH A O   1 
HETATM 2550 O O   . HOH C 3 .   ? -9.21247  -17.49679 0.78715   1.000 28.96274 ? 488 HOH A O   1 
HETATM 2551 O O   . HOH C 3 .   ? -14.03382 24.17742  33.81519  1.000 27.01404 ? 489 HOH A O   1 
HETATM 2552 O O   . HOH C 3 .   ? -3.60267  -15.74296 19.07404  1.000 41.15896 ? 490 HOH A O   1 
HETATM 2553 O O   . HOH C 3 .   ? -24.86065 9.84783   2.43633   1.000 39.76212 ? 491 HOH A O   1 
HETATM 2554 O O   . HOH C 3 .   ? -13.56120 14.25400  44.17226  1.000 38.23258 ? 492 HOH A O   1 
HETATM 2555 O O   . HOH C 3 .   ? -21.11239 17.81760  43.84392  1.000 33.12735 ? 493 HOH A O   1 
HETATM 2556 O O   . HOH C 3 .   ? -2.76710  16.06798  31.71972  1.000 34.64351 ? 494 HOH A O   1 
HETATM 2557 O O   . HOH C 3 .   ? -29.66565 -9.11563  1.36566   1.000 27.90755 ? 495 HOH A O   1 
HETATM 2558 O O   . HOH C 3 .   ? -29.11363 -16.52115 0.34479   1.000 31.31134 ? 496 HOH A O   1 
HETATM 2559 O O   . HOH C 3 .   ? -27.38784 9.02212   17.06145  1.000 36.80262 ? 497 HOH A O   1 
HETATM 2560 O O   . HOH C 3 .   ? -21.29646 -13.28805 -10.02200 1.000 36.01478 ? 498 HOH A O   1 
HETATM 2561 O O   . HOH C 3 .   ? -9.06076  12.48549  43.23022  1.000 41.15829 ? 499 HOH A O   1 
HETATM 2562 O O   . HOH C 3 .   ? -19.57443 31.41638  21.79286  1.000 40.22789 ? 500 HOH A O   1 
HETATM 2563 O O   . HOH C 3 .   ? -12.93639 23.45781  24.54443  1.000 38.02780 ? 501 HOH A O   1 
HETATM 2564 O O   . HOH C 3 .   ? -32.38074 22.90662  26.71989  1.000 31.80907 ? 502 HOH A O   1 
HETATM 2565 O O   . HOH C 3 .   ? -31.51250 -10.94673 3.82770   1.000 36.41786 ? 503 HOH A O   1 
HETATM 2566 O O   . HOH C 3 .   ? -0.19927  -3.24250  15.46742  1.000 35.59162 ? 504 HOH A O   1 
HETATM 2567 O O   . HOH C 3 .   ? -4.20347  4.48814   41.04705  1.000 34.50646 ? 505 HOH A O   1 
HETATM 2568 O O   . HOH C 3 .   ? -25.91961 -2.05725  -1.99808  1.000 31.20403 ? 506 HOH A O   1 
HETATM 2569 O O   . HOH C 3 .   ? -19.06830 14.41839  9.72992   1.000 45.32361 ? 507 HOH A O   1 
HETATM 2570 O O   . HOH C 3 .   ? -29.04087 10.58050  38.86864  1.000 30.10718 ? 508 HOH A O   1 
HETATM 2571 O O   . HOH C 3 .   ? -20.97373 5.83305   36.14169  1.000 29.03319 ? 509 HOH A O   1 
HETATM 2572 O O   . HOH C 3 .   ? -28.13396 -2.77119  5.95574   1.000 29.71033 ? 510 HOH A O   1 
HETATM 2573 O O   . HOH C 3 .   ? -24.06909 -8.06315  15.78494  1.000 29.34625 ? 511 HOH A O   1 
HETATM 2574 O O   . HOH C 3 .   ? -26.63733 -2.03604  1.47254   1.000 28.62952 ? 512 HOH A O   1 
HETATM 2575 O O   . HOH C 3 .   ? -22.19337 6.09476   26.08036  1.000 26.41061 ? 513 HOH A O   1 
HETATM 2576 O O   . HOH C 3 .   ? -23.76771 -29.54238 0.94509   1.000 45.45847 ? 514 HOH A O   1 
HETATM 2577 O O   . HOH C 3 .   ? -16.22694 -25.12063 19.01258  1.000 34.64293 ? 515 HOH A O   1 
HETATM 2578 O O   . HOH C 3 .   ? -4.29866  15.91987  42.45778  1.000 34.67485 ? 516 HOH A O   1 
HETATM 2579 O O   . HOH C 3 .   ? -21.61914 -28.25146 -2.06823  1.000 30.00634 ? 517 HOH A O   1 
HETATM 2580 O O   . HOH C 3 .   ? -1.73562  4.04527   24.53102  1.000 46.31638 ? 518 HOH A O   1 
HETATM 2581 O O   . HOH C 3 .   ? -20.58828 26.57624  34.04026  1.000 36.52174 ? 519 HOH A O   1 
HETATM 2582 O O   . HOH C 3 .   ? -26.11697 5.85346   2.24702   1.000 38.12887 ? 520 HOH A O   1 
HETATM 2583 O O   . HOH C 3 .   ? -5.43692  3.81932   36.39368  1.000 33.66354 ? 521 HOH A O   1 
HETATM 2584 O O   . HOH C 3 .   ? -20.38486 -5.59544  21.70306  1.000 29.49652 ? 522 HOH A O   1 
HETATM 2585 O O   . HOH C 3 .   ? -9.21813  -22.37671 14.69396  1.000 32.32568 ? 523 HOH A O   1 
HETATM 2586 O O   . HOH C 3 .   ? -14.16974 -18.02471 -6.89566  1.000 38.96183 ? 524 HOH A O   1 
HETATM 2587 O O   . HOH C 3 .   ? -25.57996 -20.33102 5.39857   1.000 31.04338 ? 525 HOH A O   1 
HETATM 2588 O O   . HOH C 3 .   ? -26.02732 -13.64032 11.24720  1.000 30.15887 ? 526 HOH A O   1 
HETATM 2589 O O   . HOH C 3 .   ? -11.55183 -3.94982  31.78314  1.000 43.88919 ? 527 HOH A O   1 
HETATM 2590 O O   . HOH C 3 .   ? -28.79846 2.44300   12.23167  1.000 33.96181 ? 528 HOH A O   1 
HETATM 2591 O O   . HOH C 3 .   ? -23.76614 2.87205   35.18076  1.000 33.33105 ? 529 HOH A O   1 
HETATM 2592 O O   . HOH C 3 .   ? -16.24642 -17.11236 -8.55974  1.000 36.65689 ? 530 HOH A O   1 
HETATM 2593 O O   . HOH C 3 .   ? -19.70324 -0.36957  25.00320  1.000 29.67688 ? 531 HOH A O   1 
HETATM 2594 O O   . HOH C 3 .   ? -25.23463 3.00246   -8.48902  1.000 43.47071 ? 532 HOH A O   1 
HETATM 2595 O O   . HOH C 3 .   ? -11.24810 1.83199   29.63977  1.000 30.77655 ? 533 HOH A O   1 
HETATM 2596 O O   . HOH C 3 .   ? -10.39534 20.22066  43.94111  0.50  34.53390 ? 534 HOH A O   1 
HETATM 2597 O O   . HOH C 3 .   ? -20.23597 -26.17766 -4.92916  1.000 25.34555 ? 535 HOH A O   1 
HETATM 2598 O O   . HOH C 3 .   ? -18.48247 20.23562  42.49220  1.000 48.74920 ? 536 HOH A O   1 
HETATM 2599 O O   . HOH C 3 .   ? -23.21330 27.09834  35.39808  1.000 34.09552 ? 537 HOH A O   1 
HETATM 2600 O O   . HOH C 3 .   ? -17.81280 10.80285  11.71218  1.000 36.22833 ? 538 HOH A O   1 
HETATM 2601 O O   . HOH C 3 .   ? -14.07831 27.12096  22.96647  1.000 40.77037 ? 539 HOH A O   1 
HETATM 2602 O O   . HOH C 3 .   ? -7.22165  11.26352  27.74995  1.000 31.43416 ? 540 HOH A O   1 
HETATM 2603 O O   . HOH C 3 .   ? -21.77371 2.08138   9.76688   1.000 25.53176 ? 541 HOH A O   1 
HETATM 2604 O O   . HOH C 3 .   ? -25.31683 22.80484  14.91002  1.000 39.96785 ? 542 HOH A O   1 
HETATM 2605 O O   . HOH C 3 .   ? -6.70109  -17.21379 9.30843   1.000 32.96626 ? 543 HOH A O   1 
HETATM 2606 O O   . HOH C 3 .   ? -24.57224 11.97932  25.72020  1.000 30.77064 ? 544 HOH A O   1 
HETATM 2607 O O   . HOH C 3 .   ? -9.28914  -12.43838 24.58220  1.000 32.11442 ? 545 HOH A O   1 
HETATM 2608 O O   . HOH C 3 .   ? -25.28655 4.52091   24.12136  1.000 35.98622 ? 546 HOH A O   1 
HETATM 2609 O O   . HOH C 3 .   ? -23.00629 4.14421   28.23935  1.000 39.76941 ? 547 HOH A O   1 
HETATM 2610 O O   . HOH C 3 .   ? -9.90004  31.20430  28.96742  1.000 50.95248 ? 548 HOH A O   1 
HETATM 2611 O O   . HOH C 3 .   ? -2.91994  -1.80037  9.86451   1.000 32.45657 ? 549 HOH A O   1 
HETATM 2612 O O   . HOH C 3 .   ? -11.60084 8.41200   3.46115   1.000 44.24980 ? 550 HOH A O   1 
HETATM 2613 O O   . HOH C 3 .   ? -22.11237 -19.48224 14.16349  1.000 27.88202 ? 551 HOH A O   1 
HETATM 2614 O O   . HOH C 3 .   ? -19.33403 15.36113  47.96586  1.000 45.49139 ? 552 HOH A O   1 
HETATM 2615 O O   . HOH C 3 .   ? -19.78614 17.51883  11.49246  1.000 39.70083 ? 553 HOH A O   1 
HETATM 2616 O O   . HOH C 3 .   ? -12.60881 19.17312  22.48647  1.000 33.38403 ? 554 HOH A O   1 
HETATM 2617 O O   . HOH C 3 .   ? -20.71015 -5.97629  1.67134   1.000 21.74339 ? 555 HOH A O   1 
HETATM 2618 O O   . HOH C 3 .   ? -30.06904 -13.76242 12.49928  1.000 39.00687 ? 556 HOH A O   1 
HETATM 2619 O O   . HOH C 3 .   ? -6.71911  13.47238  21.57026  1.000 42.76343 ? 557 HOH A O   1 
HETATM 2620 O O   . HOH C 3 .   ? -28.70726 -6.52778  20.08803  1.000 32.71801 ? 558 HOH A O   1 
HETATM 2621 O O   . HOH C 3 .   ? -2.41154  20.95760  31.99872  1.000 39.31158 ? 559 HOH A O   1 
HETATM 2622 O O   . HOH C 3 .   ? -7.16036  1.50238   21.76885  1.000 36.54152 ? 560 HOH A O   1 
HETATM 2623 O O   . HOH C 3 .   ? -34.98737 14.89563  34.96054  1.000 37.03559 ? 561 HOH A O   1 
HETATM 2624 O O   . HOH C 3 .   ? -27.21053 28.01925  29.41100  1.000 42.21328 ? 562 HOH A O   1 
HETATM 2625 O O   . HOH C 3 .   ? -26.18535 -23.14961 -0.14721  1.000 34.95418 ? 563 HOH A O   1 
HETATM 2626 O O   . HOH C 3 .   ? -31.62096 19.57034  35.75928  1.000 32.39391 ? 564 HOH A O   1 
HETATM 2627 O O   . HOH C 3 .   ? -10.86255 2.13519   26.73069  1.000 28.15617 ? 565 HOH A O   1 
HETATM 2628 O O   . HOH C 3 .   ? -23.65693 -24.40172 -4.08655  1.000 29.07631 ? 566 HOH A O   1 
HETATM 2629 O O   . HOH C 3 .   ? -24.67282 -17.55941 20.74997  1.000 45.72304 ? 567 HOH A O   1 
HETATM 2630 O O   . HOH C 3 .   ? -20.60083 -21.92056 -9.92149  1.000 36.57331 ? 568 HOH A O   1 
HETATM 2631 O O   . HOH C 3 .   ? -5.73392  1.30024   35.26489  1.000 30.31991 ? 569 HOH A O   1 
HETATM 2632 O O   . HOH C 3 .   ? -14.62749 28.60410  34.13882  1.000 53.71624 ? 570 HOH A O   1 
HETATM 2633 O O   . HOH C 3 .   ? -27.77471 -1.04750  3.79985   1.000 29.22575 ? 571 HOH A O   1 
HETATM 2634 O O   . HOH C 3 .   ? -33.19755 20.96343  33.60379  1.000 28.56148 ? 572 HOH A O   1 
HETATM 2635 O O   . HOH C 3 .   ? -19.29049 -15.35952 -11.05148 1.000 44.00185 ? 573 HOH A O   1 
HETATM 2636 O O   . HOH C 3 .   ? -24.62782 -6.48771  -10.55291 1.000 32.78986 ? 574 HOH A O   1 
HETATM 2637 O O   . HOH C 3 .   ? -23.16519 -3.33277  -12.05563 1.000 43.95011 ? 575 HOH A O   1 
HETATM 2638 O O   . HOH C 3 .   ? -26.64579 -13.68271 19.94186  1.000 34.84720 ? 576 HOH A O   1 
HETATM 2639 O O   . HOH C 3 .   ? -32.81171 20.07753  27.30641  1.000 34.76740 ? 577 HOH A O   1 
HETATM 2640 O O   . HOH C 3 .   ? -8.55670  28.35502  25.46692  1.000 40.48397 ? 578 HOH A O   1 
HETATM 2641 O O   . HOH C 3 .   ? -8.82762  7.40137   12.74301  1.000 37.70939 ? 579 HOH A O   1 
HETATM 2642 O O   . HOH C 3 .   ? -17.07744 -30.23958 -0.88271  1.000 32.95539 ? 580 HOH A O   1 
HETATM 2643 O O   . HOH C 3 .   ? -23.75068 -25.68478 -8.07245  1.000 47.41890 ? 581 HOH A O   1 
HETATM 2644 O O   . HOH C 3 .   ? -30.13109 13.14733  38.92593  1.000 27.19490 ? 582 HOH A O   1 
HETATM 2645 O O   . HOH C 3 .   ? -13.98544 -20.85564 -7.81930  1.000 40.51083 ? 583 HOH A O   1 
HETATM 2646 O O   . HOH C 3 .   ? -21.95749 4.83756   -8.52263  1.000 38.47999 ? 584 HOH A O   1 
HETATM 2647 O O   . HOH C 3 .   ? -29.91415 -7.79022  -4.48433  1.000 32.43750 ? 585 HOH A O   1 
HETATM 2648 O O   . HOH C 3 .   ? -5.84532  7.22802   40.82495  1.000 41.43169 ? 586 HOH A O   1 
HETATM 2649 O O   . HOH C 3 .   ? -25.58768 -26.16543 -0.63667  1.000 37.48748 ? 587 HOH A O   1 
HETATM 2650 O O   . HOH C 3 .   ? -13.25324 -24.82411 -3.57377  1.000 32.35513 ? 588 HOH A O   1 
HETATM 2651 O O   . HOH C 3 .   ? -20.44909 10.36722  47.26920  1.000 38.69657 ? 589 HOH A O   1 
HETATM 2652 O O   . HOH C 3 .   ? -9.59124  21.96542  41.80012  1.000 44.31730 ? 590 HOH A O   1 
HETATM 2653 O O   . HOH C 3 .   ? -4.38824  -16.20719 7.70916   1.000 38.83841 ? 591 HOH A O   1 
HETATM 2654 O O   . HOH C 3 .   ? -34.18569 13.88689  30.25235  1.000 36.98634 ? 592 HOH A O   1 
HETATM 2655 O O   . HOH C 3 .   ? -16.48236 2.89154   42.51579  1.000 45.94385 ? 593 HOH A O   1 
HETATM 2656 O O   . HOH C 3 .   ? -17.03563 14.93016  17.74234  1.000 36.09957 ? 594 HOH A O   1 
HETATM 2657 O O   . HOH C 3 .   ? -15.15752 -26.06445 -0.47820  1.000 32.23011 ? 595 HOH A O   1 
HETATM 2658 O O   . HOH C 3 .   ? -21.56856 29.57359  24.33619  1.000 45.16310 ? 596 HOH A O   1 
HETATM 2659 O O   . HOH C 3 .   ? -30.84708 -11.78858 1.37070   1.000 41.53129 ? 597 HOH A O   1 
HETATM 2660 O O   . HOH C 3 .   ? -13.43441 -0.07363  -7.07769  1.000 49.01992 ? 598 HOH A O   1 
HETATM 2661 O O   . HOH C 3 .   ? -30.27663 1.60722   9.71986   1.000 44.19824 ? 599 HOH A O   1 
HETATM 2662 O O   . HOH C 3 .   ? -13.23123 -21.69869 23.68981  1.000 36.77603 ? 600 HOH A O   1 
HETATM 2663 O O   . HOH C 3 .   ? -26.56880 16.12132  39.49537  1.000 26.87632 ? 601 HOH A O   1 
HETATM 2664 O O   . HOH C 3 .   ? -21.61398 2.91777   30.04092  1.000 32.70152 ? 602 HOH A O   1 
HETATM 2665 O O   . HOH C 3 .   ? -29.53760 1.17074   14.71704  1.000 42.39515 ? 603 HOH A O   1 
HETATM 2666 O O   . HOH C 3 .   ? -15.21729 24.08240  22.33738  1.000 38.40444 ? 604 HOH A O   1 
HETATM 2667 O O   . HOH C 3 .   ? -17.09629 -22.28266 -10.97420 1.000 41.49683 ? 605 HOH A O   1 
HETATM 2668 O O   . HOH C 3 .   ? -18.22724 -3.28460  27.57013  1.000 42.61836 ? 606 HOH A O   1 
HETATM 2669 O O   . HOH C 3 .   ? -29.19879 -4.15209  -1.84051  1.000 43.48763 ? 607 HOH A O   1 
HETATM 2670 O O   . HOH C 3 .   ? -11.59491 9.60554   23.10236  1.000 31.77694 ? 608 HOH A O   1 
HETATM 2671 O O   . HOH C 3 .   ? -17.14586 12.35568  9.90139   1.000 48.63473 ? 609 HOH A O   1 
HETATM 2672 O O   . HOH C 3 .   ? -4.89897  19.50508  37.79863  1.000 35.02638 ? 610 HOH A O   1 
HETATM 2673 O O   . HOH C 3 .   ? -18.31413 21.97710  15.92958  1.000 45.40795 ? 611 HOH A O   1 
HETATM 2674 O O   . HOH C 3 .   ? -17.06691 -6.64202  32.47819  1.000 37.80071 ? 612 HOH A O   1 
HETATM 2675 O O   . HOH C 3 .   ? -29.73951 -4.48573  5.24299   1.000 37.08401 ? 613 HOH A O   1 
HETATM 2676 O O   . HOH C 3 .   ? -5.19767  15.77312  21.97055  0.50  25.20949 ? 614 HOH A O   1 
HETATM 2677 O O   . HOH C 3 .   ? -25.48338 -1.04833  23.27560  1.000 42.58628 ? 615 HOH A O   1 
HETATM 2678 O O   . HOH C 3 .   ? -28.49872 -5.29326  -4.50316  1.000 30.23767 ? 616 HOH A O   1 
HETATM 2679 O O   . HOH C 3 .   ? -3.71052  5.98918   24.41645  1.000 39.25809 ? 617 HOH A O   1 
HETATM 2680 O O   . HOH C 3 .   ? -7.32543  5.26068   38.05619  1.000 36.99747 ? 618 HOH A O   1 
HETATM 2681 O O   . HOH C 3 .   ? -27.27675 -23.32956 1.80426   1.000 39.01486 ? 619 HOH A O   1 
HETATM 2682 O O   . HOH C 3 .   ? -11.08732 -29.06435 -0.69858  1.000 45.41491 ? 620 HOH A O   1 
HETATM 2683 O O   . HOH C 3 .   ? -34.18683 13.70104  38.38651  1.000 32.91550 ? 621 HOH A O   1 
HETATM 2684 O O   . HOH C 3 .   ? -5.19767  -0.44074  21.97055  0.50  36.85204 ? 622 HOH A O   1 
HETATM 2685 O O   . HOH C 3 .   ? -10.17759 -12.63070 26.98434  1.000 39.14550 ? 623 HOH A O   1 
HETATM 2686 O O   . HOH C 3 .   ? -23.79938 28.44273  23.63786  1.000 45.62895 ? 624 HOH A O   1 
HETATM 2687 O O   . HOH C 3 .   ? -21.49634 -2.31414  25.36051  1.000 41.97152 ? 625 HOH A O   1 
HETATM 2688 O O   . HOH C 3 .   ? -21.37479 -28.41534 13.69497  1.000 46.44600 ? 626 HOH A O   1 
HETATM 2689 O O   . HOH C 3 .   ? -17.01018 20.72052  40.90760  1.000 38.18311 ? 627 HOH A O   1 
HETATM 2690 O O   . HOH C 3 .   ? -31.26700 22.65602  24.06383  1.000 39.62716 ? 628 HOH A O   1 
HETATM 2691 O O   . HOH C 3 .   ? -22.89571 14.92847  45.35203  1.000 41.20840 ? 629 HOH A O   1 
HETATM 2692 O O   . HOH C 3 .   ? -31.22252 -1.92098  11.09312  1.000 38.98076 ? 630 HOH A O   1 
HETATM 2693 O O   . HOH C 3 .   ? -24.58524 12.09222  0.04471   1.000 53.78015 ? 631 HOH A O   1 
HETATM 2694 O O   . HOH C 3 .   ? -26.31502 -22.76869 4.34848   1.000 38.65757 ? 632 HOH A O   1 
HETATM 2695 O O   . HOH C 3 .   ? -21.76587 32.91881  22.46280  1.000 40.30295 ? 633 HOH A O   1 
HETATM 2696 O O   . HOH C 3 .   ? -25.48351 -8.65070  -12.12423 1.000 41.13891 ? 634 HOH A O   1 
HETATM 2697 O O   . HOH C 3 .   ? -21.11328 25.57497  15.07370  1.000 45.77462 ? 635 HOH A O   1 
HETATM 2698 O O   . HOH C 3 .   ? -30.08899 9.58179   24.14188  1.000 45.59762 ? 636 HOH A O   1 
HETATM 2699 O O   . HOH C 3 .   ? -26.73060 -8.11809  15.94022  1.000 35.26745 ? 637 HOH A O   1 
HETATM 2700 O O   . HOH C 3 .   ? -10.96716 -22.75015 22.78541  1.000 50.35098 ? 638 HOH A O   1 
HETATM 2701 O O   . HOH C 3 .   ? -27.44627 -17.84990 -1.46801  1.000 37.74637 ? 639 HOH A O   1 
HETATM 2702 O O   . HOH C 3 .   ? -2.19014  18.05456  42.78667  1.000 40.96778 ? 640 HOH A O   1 
HETATM 2703 O O   . HOH C 3 .   ? -19.67007 -29.50298 11.99848  1.000 39.39031 ? 641 HOH A O   1 
HETATM 2704 O O   . HOH C 3 .   ? -29.32820 6.51699   27.30043  1.000 40.65225 ? 642 HOH A O   1 
HETATM 2705 O O   . HOH C 3 .   ? -32.40187 17.43631  35.88272  1.000 35.47802 ? 643 HOH A O   1 
HETATM 2706 O O   . HOH C 3 .   ? -26.37772 6.02882   26.96446  1.000 40.26057 ? 644 HOH A O   1 
HETATM 2707 O O   . HOH C 3 .   ? -21.76059 -5.51826  23.93267  1.000 39.21976 ? 645 HOH A O   1 
HETATM 2708 O O   . HOH C 3 .   ? -22.27106 -10.82855 27.97762  1.000 46.68337 ? 646 HOH A O   1 
HETATM 2709 O O   . HOH C 3 .   ? -12.78491 -27.43383 -0.11974  1.000 37.90470 ? 647 HOH A O   1 
HETATM 2710 O O   . HOH C 3 .   ? -25.79245 8.34470   3.78140   1.000 39.17850 ? 648 HOH A O   1 
HETATM 2711 O O   . HOH C 3 .   ? -35.13356 11.06744  37.49392  1.000 32.21756 ? 649 HOH A O   1 
HETATM 2712 O O   . HOH C 3 .   ? -28.20603 -1.74924  -0.74238  1.000 42.06466 ? 650 HOH A O   1 
HETATM 2713 O O   . HOH C 3 .   ? -24.09939 6.04400   27.89283  1.000 38.27863 ? 651 HOH A O   1 
HETATM 2714 O O   . HOH C 3 .   ? -17.06078 -9.80610  35.15585  1.000 41.82021 ? 652 HOH A O   1 
HETATM 2715 O O   . HOH C 3 .   ? -19.03171 -27.85886 -3.41208  1.000 32.95015 ? 653 HOH A O   1 
HETATM 2716 O O   . HOH C 3 .   ? -17.81142 23.35094  17.90591  1.000 39.08072 ? 654 HOH A O   1 
HETATM 2717 O O   . HOH C 3 .   ? -28.37345 -17.17364 -4.10110  1.000 31.82949 ? 655 HOH A O   1 
HETATM 2718 O O   . HOH C 3 .   ? -24.71316 6.87482   25.42088  1.000 36.24856 ? 656 HOH A O   1 
HETATM 2719 O O   . HOH C 3 .   ? -30.77678 -0.84845  -3.72047  1.000 43.95455 ? 657 HOH A O   1 
HETATM 2720 O O   . HOH C 3 .   ? -29.56822 -0.03774  -1.65715  1.000 38.62138 ? 658 HOH A O   1 
HETATM 2721 O O   . HOH C 3 .   ? -33.58117 16.84242  37.88407  1.000 41.28659 ? 659 HOH A O   1 
HETATM 2722 O O   . HOH C 3 .   ? -22.82511 -26.67201 -5.16079  1.000 34.67727 ? 660 HOH A O   1 
HETATM 2723 O O   . HOH C 3 .   ? -27.70531 4.29255   -3.84698  1.000 42.29164 ? 661 HOH A O   1 
HETATM 2724 O O   . HOH C 3 .   ? -24.53037 -30.96361 6.42044   1.000 44.61287 ? 662 HOH A O   1 
HETATM 2725 O O   . HOH C 3 .   ? -2.98116  22.95974  34.08781  1.000 41.36875 ? 663 HOH A O   1 
HETATM 2726 O O   . HOH C 3 .   ? -23.25284 17.30430  45.39526  1.000 37.14126 ? 664 HOH A O   1 
HETATM 2727 O O   . HOH C 3 .   ? -9.31832  8.96299   14.58299  1.000 41.12189 ? 665 HOH A O   1 
HETATM 2728 O O   . HOH C 3 .   ? -26.57151 -24.84469 4.98273   1.000 47.40386 ? 666 HOH A O   1 
HETATM 2729 O O   . HOH C 3 .   ? -26.08088 -20.75470 7.82980   1.000 40.66625 ? 667 HOH A O   1 
HETATM 2730 O O   . HOH C 3 .   ? -22.14974 0.52507   -13.13689 1.000 48.23527 ? 668 HOH A O   1 
HETATM 2731 O O   . HOH C 3 .   ? -15.74616 -27.69451 19.02746  1.000 44.65856 ? 669 HOH A O   1 
HETATM 2732 O O   . HOH C 3 .   ? -31.03251 19.77680  23.55699  1.000 38.71478 ? 670 HOH A O   1 
HETATM 2733 O O   . HOH C 3 .   ? -31.27380 20.46901  38.63130  1.000 33.14164 ? 671 HOH A O   1 
HETATM 2734 O O   . HOH C 3 .   ? -36.24867 7.09823   36.72144  1.000 43.77556 ? 672 HOH A O   1 
HETATM 2735 O O   . HOH C 3 .   ? -11.56637 21.68469  23.08805  1.000 44.34086 ? 673 HOH A O   1 
HETATM 2736 O O   . HOH C 3 .   ? -35.97036 9.78305   34.30732  1.000 45.94131 ? 674 HOH A O   1 
HETATM 2737 O O   . HOH C 3 .   ? -22.15680 13.38084  -0.87746  1.000 38.53885 ? 675 HOH A O   1 
HETATM 2738 O O   . HOH C 3 .   ? -2.93372  21.33848  36.36772  1.000 45.33518 ? 676 HOH A O   1 
HETATM 2739 O O   . HOH C 3 .   ? -10.54279 -28.99888 14.15986  1.000 35.78533 ? 677 HOH A O   1 
HETATM 2740 O O   . HOH C 3 .   ? -29.24773 15.54525  38.39261  1.000 29.18607 ? 678 HOH A O   1 
HETATM 2741 O O   . HOH C 3 .   ? -26.80976 -0.07989  25.20562  1.000 50.86705 ? 679 HOH A O   1 
HETATM 2742 O O   . HOH C 3 .   ? -21.51029 -30.60787 -0.20206  1.000 43.60604 ? 680 HOH A O   1 
HETATM 2743 O O   . HOH C 3 .   ? -15.97479 21.60438  21.20715  1.000 39.18615 ? 681 HOH A O   1 
HETATM 2744 O O   . HOH C 3 .   ? -27.17364 18.09679  41.31122  1.000 29.57487 ? 682 HOH A O   1 
HETATM 2745 O O   . HOH C 3 .   ? -25.64094 -30.24140 -0.66268  1.000 43.44448 ? 683 HOH A O   1 
HETATM 2746 O O   . HOH C 3 .   ? -0.61147  25.41199  31.35773  1.000 37.60635 ? 684 HOH A O   1 
HETATM 2747 O O   . HOH C 3 .   ? -30.31432 -0.53935  3.14471   1.000 39.16242 ? 685 HOH A O   1 
HETATM 2748 O O   . HOH C 3 .   ? -23.23780 -31.68139 3.11577   1.000 41.02605 ? 686 HOH A O   1 
HETATM 2749 O O   . HOH C 3 .   ? -34.46406 17.89233  33.91544  1.000 37.62611 ? 687 HOH A O   1 
HETATM 2750 O O   . HOH C 3 .   ? -19.11043 -31.68078 0.33539   1.000 33.88687 ? 688 HOH A O   1 
HETATM 2751 O O   . HOH C 3 .   ? -1.36992  24.91801  33.96174  1.000 41.12567 ? 689 HOH A O   1 
HETATM 2752 O O   . HOH C 3 .   ? -8.58335  -28.20473 -0.44609  1.000 47.72319 ? 690 HOH A O   1 
HETATM 2753 O O   . HOH C 3 .   ? -26.42490 17.52293  44.05668  1.000 34.31165 ? 691 HOH A O   1 
HETATM 2754 O O   . HOH C 3 .   ? -26.25444 14.57500  44.13260  1.000 30.77315 ? 692 HOH A O   1 
HETATM 2755 O O   . HOH C 3 .   ? -21.32753 -32.32281 4.15573   1.000 45.00619 ? 693 HOH A O   1 
HETATM 2756 O O   . HOH D 3 .   ? -14.46035 12.74091  -3.98595  1.000 30.62959 ? 201 HOH C O   1 
HETATM 2757 O O   . HOH D 3 .   ? -15.35767 -6.07413  -3.32223  1.000 32.82093 ? 202 HOH C O   1 
HETATM 2758 O O   . HOH D 3 .   ? -14.84944 7.35803   0.94752   1.000 36.36545 ? 203 HOH C O   1 
HETATM 2759 O O   . HOH D 3 .   ? -11.86610 -19.38623 -8.12782  1.000 51.01321 ? 204 HOH C O   1 
HETATM 2760 O O   . HOH D 3 .   ? -11.19836 -5.31749  -4.07464  1.000 38.00469 ? 205 HOH C O   1 
HETATM 2761 O O   . HOH D 3 .   ? -19.86080 12.31816  0.01128   1.000 31.82553 ? 206 HOH C O   1 
HETATM 2762 O O   . HOH D 3 .   ? -5.27241  -13.00700 -1.99431  1.000 39.65178 ? 207 HOH C O   1 
HETATM 2763 O O   . HOH D 3 .   ? -15.83229 10.31045  -5.22760  1.000 28.07718 ? 208 HOH C O   1 
HETATM 2764 O O   . HOH D 3 .   ? -21.86490 13.98626  -3.56129  1.000 34.41835 ? 209 HOH C O   1 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.pdbx_PDB_ins_code 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1    N N   . SER A 1   ? 0.37482 0.36181 0.35775 0.01629  -0.05327 -0.01295 1   SER A N   
2    C CA  . SER A 1   ? 0.36026 0.35460 0.34976 0.01318  -0.04547 -0.01275 1   SER A CA  
3    C C   . SER A 1   ? 0.39395 0.39701 0.39647 0.01386  -0.04297 -0.01525 1   SER A C   
4    O O   . SER A 1   ? 0.33201 0.33576 0.33864 0.01655  -0.04655 -0.01686 1   SER A O   
5    C CB  . SER A 1   ? 0.56048 0.55765 0.55104 0.01177  -0.04444 -0.01486 1   SER A CB  
6    O OG  . SER A 1   ? 0.59553 0.59636 0.59256 0.01440  -0.04977 -0.01966 1   SER A OG  
7    N N   . GLY A 2   ? 0.38031 0.38943 0.38877 0.01130  -0.03687 -0.01578 2   GLY A N   
8    C CA  . GLY A 2   ? 0.34285 0.35795 0.35995 0.01061  -0.03275 -0.01664 2   GLY A CA  
9    C C   . GLY A 2   ? 0.30040 0.31242 0.31263 0.00908  -0.02868 -0.01211 2   GLY A C   
10   O O   . GLY A 2   ? 0.39264 0.39819 0.39571 0.00885  -0.02956 -0.00876 2   GLY A O   
11   N N   . PHE A 3   ? 0.30437 0.32089 0.32251 0.00774  -0.02406 -0.01227 3   PHE A N   
12   C CA  . PHE A 3   ? 0.33779 0.35208 0.35219 0.00643  -0.02037 -0.00844 3   PHE A CA  
13   C C   . PHE A 3   ? 0.31531 0.33408 0.33660 0.00601  -0.01751 -0.00954 3   PHE A C   
14   O O   . PHE A 3   ? 0.33915 0.36195 0.36559 0.00446  -0.01444 -0.01158 3   PHE A O   
15   C CB  . PHE A 3   ? 0.38469 0.39761 0.39502 0.00414  -0.01646 -0.00632 3   PHE A CB  
16   C CG  . PHE A 3   ? 0.28446 0.29400 0.28931 0.00328  -0.01428 -0.00274 3   PHE A CG  
17   C CD1 . PHE A 3   ? 0.32118 0.32530 0.31815 0.00328  -0.01625 -0.00083 3   PHE A CD1 
18   C CD2 . PHE A 3   ? 0.35922 0.37063 0.36644 0.00227  -0.01035 -0.00158 3   PHE A CD2 
19   C CE1 . PHE A 3   ? 0.33259 0.33427 0.32528 0.00202  -0.01382 0.00174  3   PHE A CE1 
20   C CE2 . PHE A 3   ? 0.37584 0.38499 0.37913 0.00164  -0.00865 0.00100  3   PHE A CE2 
21   C CZ  . PHE A 3   ? 0.33053 0.33535 0.32714 0.00137  -0.01013 0.00244  3   PHE A CZ  
22   N N   . ARG A 4   ? 0.29319 0.31061 0.31379 0.00705  -0.01833 -0.00824 4   ARG A N   
23   C CA  . ARG A 4   ? 0.27856 0.29984 0.30513 0.00677  -0.01612 -0.00960 4   ARG A CA  
24   C C   . ARG A 4   ? 0.27416 0.29290 0.29669 0.00596  -0.01356 -0.00593 4   ARG A C   
25   O O   . ARG A 4   ? 0.30349 0.31768 0.31967 0.00629  -0.01473 -0.00306 4   ARG A O   
26   C CB  . ARG A 4   ? 0.35493 0.37811 0.38659 0.00933  -0.02027 -0.01287 4   ARG A CB  
27   C CG  . ARG A 4   ? 0.41355 0.44188 0.45286 0.01004  -0.02216 -0.01815 4   ARG A CG  
28   C CD  . ARG A 4   ? 0.51287 0.54709 0.55906 0.00729  -0.01692 -0.02094 4   ARG A CD  
29   N NE  . ARG A 4   ? 0.61252 0.65305 0.66812 0.00774  -0.01830 -0.02722 4   ARG A NE  
30   C CZ  . ARG A 4   ? 0.60395 0.65002 0.66644 0.00504  -0.01391 -0.03104 4   ARG A CZ  
31   N NH1 . ARG A 4   ? 0.61034 0.65538 0.67027 0.00190  -0.00828 -0.02882 4   ARG A NH1 
32   N NH2 . ARG A 4   ? 0.40303 0.45551 0.47486 0.00534  -0.01524 -0.03752 4   ARG A NH2 
33   N N   . LYS A 5   ? 0.32138 0.34283 0.34729 0.00463  -0.01001 -0.00634 5   LYS A N   
34   C CA  . LYS A 5   ? 0.32006 0.33973 0.34321 0.00426  -0.00828 -0.00360 5   LYS A CA  
35   C C   . LYS A 5   ? 0.37074 0.38967 0.39473 0.00622  -0.01140 -0.00414 5   LYS A C   
36   O O   . LYS A 5   ? 0.40582 0.42807 0.43552 0.00683  -0.01177 -0.00711 5   LYS A O   
37   C CB  . LYS A 5   ? 0.35864 0.38039 0.38404 0.00235  -0.00420 -0.00405 5   LYS A CB  
38   C CG  . LYS A 5   ? 0.41962 0.43934 0.44166 0.00198  -0.00258 -0.00121 5   LYS A CG  
39   C CD  . LYS A 5   ? 0.38646 0.40316 0.40340 0.00193  -0.00236 0.00179  5   LYS A CD  
40   C CE  . LYS A 5   ? 0.46611 0.48233 0.48216 0.00070  -0.00018 0.00199  5   LYS A CE  
41   N NZ  . LYS A 5   ? 0.44965 0.46555 0.46582 -0.00061 0.00245  0.00194  5   LYS A NZ  
42   N N   . MET A 6   ? 0.30700 0.32123 0.32512 0.00701  -0.01354 -0.00157 6   MET A N   
43   C CA  . MET A 6   ? 0.32184 0.33317 0.33889 0.00909  -0.01757 -0.00188 6   MET A CA  
44   C C   . MET A 6   ? 0.32299 0.33224 0.33746 0.00860  -0.01621 0.00040  6   MET A C   
45   O O   . MET A 6   ? 0.37407 0.38108 0.38369 0.00701  -0.01404 0.00318  6   MET A O   
46   C CB  . MET A 6   ? 0.33148 0.33720 0.34190 0.00991  -0.02129 -0.00072 6   MET A CB  
47   C CG  . MET A 6   ? 0.44446 0.44539 0.45248 0.01240  -0.02654 -0.00117 6   MET A CG  
48   S SD  . MET A 6   ? 0.48601 0.47918 0.48447 0.01288  -0.03092 0.00010  6   MET A SD  
49   C CE  . MET A 6   ? 0.43305 0.43255 0.43846 0.01354  -0.03155 -0.00359 6   MET A CE  
50   N N   . ALA A 7   ? 0.32920 0.33968 0.34755 0.00993  -0.01742 -0.00129 7   ALA A N   
51   C CA  . ALA A 7   ? 0.32906 0.33748 0.34525 0.00960  -0.01654 0.00047  7   ALA A CA  
52   C C   . ALA A 7   ? 0.29381 0.29549 0.30452 0.01104  -0.02066 0.00165  7   ALA A C   
53   O O   . ALA A 7   ? 0.31480 0.31369 0.32446 0.01297  -0.02495 0.00048  7   ALA A O   
54   C CB  . ALA A 7   ? 0.29438 0.30737 0.31721 0.00990  -0.01519 -0.00212 7   ALA A CB  
55   N N   . PHE A 8   ? 0.31498 0.31337 0.32158 0.01000  -0.01953 0.00390  8   PHE A N   
56   C CA  . PHE A 8   ? 0.32705 0.31790 0.32771 0.01094  -0.02311 0.00502  8   PHE A CA  
57   C C   . PHE A 8   ? 0.32514 0.31643 0.33098 0.01401  -0.02682 0.00211  8   PHE A C   
58   O O   . PHE A 8   ? 0.32581 0.32365 0.33954 0.01442  -0.02503 -0.00040 8   PHE A O   
59   C CB  . PHE A 8   ? 0.29899 0.28687 0.29490 0.00864  -0.02044 0.00754  8   PHE A CB  
60   C CG  . PHE A 8   ? 0.32358 0.31039 0.31431 0.00573  -0.01733 0.00971  8   PHE A CG  
61   C CD1 . PHE A 8   ? 0.42433 0.40375 0.40622 0.00447  -0.01867 0.01133  8   PHE A CD1 
62   C CD2 . PHE A 8   ? 0.40771 0.40047 0.40207 0.00423  -0.01316 0.00981  8   PHE A CD2 
63   C CE1 . PHE A 8   ? 0.38624 0.36541 0.36410 0.00148  -0.01528 0.01254  8   PHE A CE1 
64   C CE2 . PHE A 8   ? 0.39763 0.39009 0.38850 0.00191  -0.01052 0.01101  8   PHE A CE2 
65   C CZ  . PHE A 8   ? 0.39317 0.37940 0.37631 0.00040  -0.01128 0.01214  8   PHE A CZ  
66   N N   . PRO A 9   ? 0.36036 0.34433 0.36161 0.01616  -0.03211 0.00210  9   PRO A N   
67   C CA  . PRO A 9   ? 0.32774 0.31128 0.33376 0.01937  -0.03596 -0.00079 9   PRO A CA  
68   C C   . PRO A 9   ? 0.35595 0.34052 0.36331 0.01814  -0.03291 -0.00020 9   PRO A C   
69   O O   . PRO A 9   ? 0.35752 0.33787 0.35811 0.01558  -0.03053 0.00309  9   PRO A O   
70   C CB  . PRO A 9   ? 0.37566 0.34807 0.37287 0.02143  -0.04228 0.00038  9   PRO A CB  
71   C CG  . PRO A 9   ? 0.45172 0.41783 0.43780 0.01796  -0.04007 0.00468  9   PRO A CG  
72   C CD  . PRO A 9   ? 0.37397 0.34859 0.36437 0.01558  -0.03480 0.00476  9   PRO A CD  
73   N N   . SER A 10  ? 0.32121 0.31194 0.33768 0.01969  -0.03266 -0.00387 10  SER A N   
74   C CA  . SER A 10  ? 0.33761 0.33124 0.35645 0.01815  -0.02891 -0.00381 10  SER A CA  
75   C C   . SER A 10  ? 0.32263 0.31113 0.34076 0.02014  -0.03216 -0.00467 10  SER A C   
76   O O   . SER A 10  ? 0.35719 0.34773 0.37717 0.01898  -0.02939 -0.00487 10  SER A O   
77   C CB  . SER A 10  ? 0.32705 0.33056 0.35537 0.01760  -0.02535 -0.00731 10  SER A CB  
78   O OG  . SER A 10  ? 0.32589 0.33281 0.36211 0.02054  -0.02856 -0.01228 10  SER A OG  
79   N N   . GLY A 11  ? 0.32631 0.30743 0.34109 0.02314  -0.03826 -0.00513 11  GLY A N   
80   C CA  . GLY A 11  ? 0.35892 0.33471 0.37367 0.02565  -0.04209 -0.00656 11  GLY A CA  
81   C C   . GLY A 11  ? 0.36719 0.33782 0.37536 0.02294  -0.03941 -0.00329 11  GLY A C   
82   O O   . GLY A 11  ? 0.38203 0.35371 0.39400 0.02362  -0.03909 -0.00511 11  GLY A O   
83   N N   . LYS A 12  ? 0.33764 0.30310 0.33634 0.01963  -0.03722 0.00109  12  LYS A N   
84   C CA  . LYS A 12  ? 0.36700 0.32761 0.35955 0.01665  -0.03458 0.00373  12  LYS A CA  
85   C C   . LYS A 12  ? 0.37964 0.34937 0.37916 0.01491  -0.02941 0.00264  12  LYS A C   
86   O O   . LYS A 12  ? 0.35289 0.32055 0.35160 0.01408  -0.02852 0.00269  12  LYS A O   
87   C CB  . LYS A 12  ? 0.34217 0.29719 0.32457 0.01297  -0.03249 0.00765  12  LYS A CB  
88   C CG  . LYS A 12  ? 0.41982 0.36218 0.39143 0.01374  -0.03750 0.00940  12  LYS A CG  
89   C CD  . LYS A 12  ? 0.48621 0.42470 0.44863 0.00964  -0.03457 0.01254  12  LYS A CD  
90   C CE  . LYS A 12  ? 0.62435 0.54741 0.57252 0.00875  -0.03836 0.01492  12  LYS A CE  
91   N NZ  . LYS A 12  ? 0.72047 0.63764 0.66706 0.01350  -0.04589 0.01378  12  LYS A NZ  
92   N N   . VAL A 13  ? 0.34968 0.32881 0.35545 0.01432  -0.02620 0.00156  13  VAL A N   
93   C CA  . VAL A 13  ? 0.27819 0.26481 0.28900 0.01261  -0.02165 0.00071  13  VAL A CA  
94   C C   . VAL A 13  ? 0.35443 0.34568 0.37339 0.01478  -0.02237 -0.00346 13  VAL A C   
95   O O   . VAL A 13  ? 0.29226 0.28602 0.31326 0.01372  -0.01997 -0.00430 13  VAL A O   
96   C CB  . VAL A 13  ? 0.28407 0.27695 0.29636 0.01079  -0.01804 0.00156  13  VAL A CB  
97   C CG1 . VAL A 13  ? 0.27208 0.27114 0.28794 0.00914  -0.01398 0.00087  13  VAL A CG1 
98   C CG2 . VAL A 13  ? 0.29036 0.27911 0.29537 0.00866  -0.01720 0.00495  13  VAL A CG2 
99   N N   . GLU A 14  ? 0.27791 0.27068 0.30195 0.01775  -0.02563 -0.00662 14  GLU A N   
100  C CA  . GLU A 14  ? 0.29172 0.28986 0.32477 0.01968  -0.02604 -0.01165 14  GLU A CA  
101  C C   . GLU A 14  ? 0.31450 0.30845 0.34699 0.02063  -0.02753 -0.01245 14  GLU A C   
102  O O   . GLU A 14  ? 0.30043 0.29946 0.33845 0.02022  -0.02513 -0.01541 14  GLU A O   
103  C CB  . GLU A 14  ? 0.34303 0.34245 0.38172 0.02323  -0.03050 -0.01545 14  GLU A CB  
104  C CG  . GLU A 14  ? 0.30644 0.31204 0.34842 0.02229  -0.02857 -0.01629 14  GLU A CG  
105  C CD  . GLU A 14  ? 0.33809 0.34438 0.38527 0.02597  -0.03373 -0.02012 14  GLU A CD  
106  O OE1 . GLU A 14  ? 0.38958 0.39777 0.44408 0.02899  -0.03674 -0.02507 14  GLU A OE1 
107  O OE2 . GLU A 14  ? 0.36107 0.36612 0.40532 0.02599  -0.03502 -0.01852 14  GLU A OE2 
108  N N   . GLY A 15  ? 0.30825 0.29229 0.33338 0.02161  -0.03135 -0.00991 15  GLY A N   
109  C CA  . GLY A 15  ? 0.31865 0.29715 0.34212 0.02238  -0.03301 -0.01040 15  GLY A CA  
110  C C   . GLY A 15  ? 0.27748 0.25686 0.29809 0.01875  -0.02829 -0.00830 15  GLY A C   
111  O O   . GLY A 15  ? 0.34603 0.32120 0.36548 0.01900  -0.02918 -0.00886 15  GLY A O   
112  N N   . CYS A 16  ? 0.26387 0.24836 0.28341 0.01557  -0.02366 -0.00615 16  CYS A N   
113  C CA  . CYS A 16  ? 0.30663 0.29280 0.32413 0.01239  -0.01960 -0.00461 16  CYS A CA  
114  C C   . CYS A 16  ? 0.28087 0.27596 0.30455 0.01149  -0.01589 -0.00706 16  CYS A C   
115  O O   . CYS A 16  ? 0.28282 0.27946 0.30511 0.00926  -0.01308 -0.00629 16  CYS A O   
116  C CB  . CYS A 16  ? 0.25730 0.24197 0.26849 0.00948  -0.01742 -0.00066 16  CYS A CB  
117  S SG  . CYS A 16  ? 0.38113 0.35426 0.38259 0.00906  -0.02056 0.00247  16  CYS A SG  
118  N N   . MET A 17  ? 0.30211 0.30279 0.33206 0.01285  -0.01574 -0.01017 17  MET A N   
119  C CA  . MET A 17  ? 0.30158 0.30955 0.33547 0.01114  -0.01165 -0.01227 17  MET A CA  
120  C C   . MET A 17  ? 0.29931 0.30900 0.33766 0.01171  -0.01128 -0.01619 17  MET A C   
121  O O   . MET A 17  ? 0.29705 0.30569 0.33993 0.01450  -0.01437 -0.01948 17  MET A O   
122  C CB  . MET A 17  ? 0.30615 0.31927 0.34440 0.01141  -0.01074 -0.01426 17  MET A CB  
123  C CG  . MET A 17  ? 0.27028 0.28215 0.30443 0.01075  -0.01083 -0.01070 17  MET A CG  
124  S SD  . MET A 17  ? 0.30429 0.31473 0.33126 0.00777  -0.00801 -0.00595 17  MET A SD  
125  C CE  . MET A 17  ? 0.30306 0.31884 0.33166 0.00555  -0.00377 -0.00779 17  MET A CE  
126  N N   . VAL A 18  ? 0.24883 0.26092 0.28577 0.00923  -0.00781 -0.01607 18  VAL A N   
127  C CA  . VAL A 18  ? 0.27733 0.29182 0.31803 0.00905  -0.00650 -0.01999 18  VAL A CA  
128  C C   . VAL A 18  ? 0.24768 0.26739 0.28809 0.00608  -0.00187 -0.02107 18  VAL A C   
129  O O   . VAL A 18  ? 0.25583 0.27634 0.29261 0.00442  -0.00017 -0.01840 18  VAL A O   
130  C CB  . VAL A 18  ? 0.25533 0.26525 0.29272 0.00881  -0.00744 -0.01877 18  VAL A CB  
131  C CG1 . VAL A 18  ? 0.27338 0.27608 0.30900 0.01121  -0.01194 -0.01740 18  VAL A CG1 
132  C CG2 . VAL A 18  ? 0.28555 0.29513 0.31684 0.00596  -0.00515 -0.01502 18  VAL A CG2 
133  N N   . GLN A 19  ? 0.26034 0.28287 0.30405 0.00536  0.00006  -0.02520 19  GLN A N   
134  C CA  . GLN A 19  ? 0.28200 0.30793 0.32378 0.00208  0.00454  -0.02654 19  GLN A CA  
135  C C   . GLN A 19  ? 0.24764 0.27141 0.28440 0.00058  0.00531  -0.02507 19  GLN A C   
136  O O   . GLN A 19  ? 0.26463 0.28657 0.30307 0.00188  0.00355  -0.02617 19  GLN A O   
137  C CB  . GLN A 19  ? 0.29267 0.32369 0.34155 0.00167  0.00682  -0.03301 19  GLN A CB  
138  C CG  . GLN A 19  ? 0.31707 0.35055 0.36274 -0.00244 0.01196  -0.03485 19  GLN A CG  
139  C CD  . GLN A 19  ? 0.35783 0.39671 0.41106 -0.00337 0.01483  -0.04216 19  GLN A CD  
140  O OE1 . GLN A 19  ? 0.44218 0.48470 0.49805 -0.00518 0.01767  -0.04497 19  GLN A OE1 
141  N NE2 . GLN A 19  ? 0.49288 0.53250 0.55000 -0.00233 0.01431  -0.04572 19  GLN A NE2 
142  N N   . VAL A 20  ? 0.25970 0.28314 0.29005 -0.00199 0.00750  -0.02260 20  VAL A N   
143  C CA  . VAL A 20  ? 0.29615 0.31797 0.32150 -0.00349 0.00805  -0.02157 20  VAL A CA  
144  C C   . VAL A 20  ? 0.28516 0.30834 0.30680 -0.00659 0.01179  -0.02363 20  VAL A C   
145  O O   . VAL A 20  ? 0.28211 0.30511 0.30008 -0.00817 0.01347  -0.02243 20  VAL A O   
146  C CB  . VAL A 20  ? 0.27106 0.29021 0.29116 -0.00342 0.00626  -0.01669 20  VAL A CB  
147  C CG1 . VAL A 20  ? 0.25206 0.27014 0.26827 -0.00463 0.00627  -0.01647 20  VAL A CG1 
148  C CG2 . VAL A 20  ? 0.27813 0.29524 0.30053 -0.00123 0.00330  -0.01463 20  VAL A CG2 
149  N N   . THR A 21  ? 0.32025 0.34401 0.34202 -0.00770 0.01315  -0.02674 21  THR A N   
150  C CA  . THR A 21  ? 0.30791 0.33193 0.32472 -0.01116 0.01691  -0.02898 21  THR A CA  
151  C C   . THR A 21  ? 0.34142 0.36287 0.35208 -0.01213 0.01618  -0.02772 21  THR A C   
152  O O   . THR A 21  ? 0.28671 0.30809 0.30035 -0.01059 0.01421  -0.02820 21  THR A O   
153  C CB  . THR A 21  ? 0.30353 0.33145 0.32673 -0.01212 0.01991  -0.03531 21  THR A CB  
154  O OG1 . THR A 21  ? 0.33196 0.36291 0.36146 -0.01122 0.02040  -0.03708 21  THR A OG1 
155  C CG2 . THR A 21  ? 0.33245 0.35991 0.34920 -0.01649 0.02438  -0.03782 21  THR A CG2 
156  N N   . CYS A 22  ? 0.28818 0.30691 0.28979 -0.01470 0.01754  -0.02623 22  CYS A N   
157  C CA  . CYS A 22  ? 0.26237 0.27854 0.25741 -0.01573 0.01664  -0.02557 22  CYS A CA  
158  C C   . CYS A 22  ? 0.37546 0.38876 0.36130 -0.01959 0.01995  -0.02687 22  CYS A C   
159  O O   . CYS A 22  ? 0.38944 0.40023 0.37001 -0.02099 0.02107  -0.02512 22  CYS A O   
160  C CB  . CYS A 22  ? 0.26017 0.27424 0.25213 -0.01385 0.01263  -0.02097 22  CYS A CB  
161  S SG  . CYS A 22  ? 0.44240 0.45436 0.42835 -0.01437 0.01044  -0.02076 22  CYS A SG  
162  N N   . GLY A 23  ? 0.47445 0.48750 0.45778 -0.02160 0.02170  -0.03007 23  GLY A N   
163  C CA  . GLY A 23  ? 0.41405 0.42343 0.38728 -0.02592 0.02525  -0.03168 23  GLY A CA  
164  C C   . GLY A 23  ? 0.45026 0.46113 0.42500 -0.02873 0.03015  -0.03465 23  GLY A C   
165  O O   . GLY A 23  ? 0.49159 0.50775 0.47548 -0.02897 0.03286  -0.03957 23  GLY A O   
166  N N   . THR A 24  ? 0.44915 0.45533 0.41530 -0.03083 0.03118  -0.03206 24  THR A N   
167  C CA  . THR A 24  ? 0.47406 0.48119 0.44085 -0.03410 0.03611  -0.03477 24  THR A CA  
168  C C   . THR A 24  ? 0.47911 0.48735 0.45043 -0.03174 0.03437  -0.03178 24  THR A C   
169  O O   . THR A 24  ? 0.45071 0.45808 0.42004 -0.03464 0.03790  -0.03283 24  THR A O   
170  C CB  . THR A 24  ? 0.58961 0.58903 0.54107 -0.03965 0.03975  -0.03477 24  THR A CB  
171  O OG1 . THR A 24  ? 0.68260 0.67430 0.62309 -0.03851 0.03556  -0.02873 24  THR A OG1 
172  C CG2 . THR A 24  ? 0.61520 0.61346 0.56164 -0.04250 0.04197  -0.03826 24  THR A CG2 
173  N N   . THR A 25  ? 0.36527 0.37531 0.34242 -0.02693 0.02933  -0.02837 25  THR A N   
174  C CA  . THR A 25  ? 0.32409 0.33400 0.30342 -0.02466 0.02710  -0.02479 25  THR A CA  
175  C C   . THR A 25  ? 0.30299 0.31894 0.29528 -0.02069 0.02485  -0.02559 25  THR A C   
176  O O   . THR A 25  ? 0.31599 0.33384 0.31292 -0.01841 0.02259  -0.02614 25  THR A O   
177  C CB  . THR A 25  ? 0.37325 0.37773 0.34443 -0.02297 0.02278  -0.01933 25  THR A CB  
178  O OG1 . THR A 25  ? 0.40840 0.40574 0.36617 -0.02641 0.02414  -0.01855 25  THR A OG1 
179  C CG2 . THR A 25  ? 0.33824 0.34263 0.31165 -0.02070 0.02063  -0.01592 25  THR A CG2 
180  N N   A THR A 26  ? 0.29360 0.31175 0.29090 -0.01998 0.02529  -0.02563 26  THR A N   
181  N N   B THR A 26  ? 0.29426 0.31246 0.29163 -0.02002 0.02536  -0.02573 26  THR A N   
182  C CA  A THR A 26  ? 0.29267 0.31526 0.30080 -0.01624 0.02275  -0.02624 26  THR A CA  
183  C CA  B THR A 26  ? 0.29328 0.31581 0.30133 -0.01622 0.02271  -0.02617 26  THR A CA  
184  C C   A THR A 26  ? 0.30562 0.32700 0.31339 -0.01454 0.02056  -0.02221 26  THR A C   
185  C C   B THR A 26  ? 0.30567 0.32688 0.31312 -0.01454 0.02049  -0.02204 26  THR A C   
186  O O   A THR A 26  ? 0.32513 0.34418 0.32757 -0.01672 0.02245  -0.02106 26  THR A O   
187  O O   B THR A 26  ? 0.32460 0.34327 0.32640 -0.01668 0.02226  -0.02070 26  THR A O   
188  C CB  A THR A 26  ? 0.31153 0.33958 0.32881 -0.01685 0.02555  -0.03239 26  THR A CB  
189  C CB  B THR A 26  ? 0.31162 0.33969 0.32914 -0.01663 0.02531  -0.03218 26  THR A CB  
190  O OG1 A THR A 26  ? 0.41949 0.44887 0.43730 -0.01860 0.02790  -0.03663 26  THR A OG1 
191  O OG1 B THR A 26  ? 0.35730 0.38606 0.37407 -0.01919 0.02848  -0.03338 26  THR A OG1 
192  C CG2 A THR A 26  ? 0.30364 0.33490 0.33101 -0.01249 0.02188  -0.03299 26  THR A CG2 
193  C CG2 B THR A 26  ? 0.41374 0.44339 0.43169 -0.01898 0.02843  -0.03707 26  THR A CG2 
194  N N   . LEU A 27  ? 0.26365 0.28592 0.27628 -0.01094 0.01674  -0.02014 27  LEU A N   
195  C CA  . LEU A 27  ? 0.23853 0.26031 0.25210 -0.00917 0.01469  -0.01698 27  LEU A CA  
196  C C   . LEU A 27  ? 0.26565 0.28895 0.28623 -0.00576 0.01140  -0.01697 27  LEU A C   
197  O O   . LEU A 27  ? 0.26005 0.28479 0.28526 -0.00477 0.01086  -0.01983 27  LEU A O   
198  C CB  . LEU A 27  ? 0.25379 0.27153 0.25958 -0.00925 0.01318  -0.01232 27  LEU A CB  
199  C CG  . LEU A 27  ? 0.26189 0.27762 0.26367 -0.00878 0.01122  -0.01061 27  LEU A CG  
200  C CD1 . LEU A 27  ? 0.23801 0.25525 0.24526 -0.00639 0.00866  -0.01044 27  LEU A CD1 
201  C CD2 . LEU A 27  ? 0.27491 0.28724 0.27013 -0.00857 0.00950  -0.00692 27  LEU A CD2 
202  N N   . ASN A 28  ? 0.27589 0.29810 0.29649 -0.00406 0.00910  -0.01377 28  ASN A N   
203  C CA  . ASN A 28  ? 0.21872 0.24070 0.24385 -0.00125 0.00592  -0.01331 28  ASN A CA  
204  C C   . ASN A 28  ? 0.22366 0.24270 0.24550 -0.00051 0.00374  -0.01000 28  ASN A C   
205  O O   . ASN A 28  ? 0.24157 0.25952 0.25866 -0.00149 0.00400  -0.00744 28  ASN A O   
206  C CB  . ASN A 28  ? 0.24136 0.26380 0.26836 -0.00020 0.00496  -0.01237 28  ASN A CB  
207  C CG  . ASN A 28  ? 0.27487 0.30075 0.30558 -0.00133 0.00740  -0.01599 28  ASN A CG  
208  O OD1 . ASN A 28  ? 0.28959 0.31826 0.32690 -0.00025 0.00706  -0.02013 28  ASN A OD1 
209  N ND2 . ASN A 28  ? 0.25149 0.27703 0.27814 -0.00356 0.00982  -0.01482 28  ASN A ND2 
210  N N   . GLY A 29  ? 0.25042 0.26784 0.27484 0.00121  0.00141  -0.01034 29  GLY A N   
211  C CA  . GLY A 29  ? 0.25945 0.27379 0.28098 0.00138  -0.00027 -0.00761 29  GLY A CA  
212  C C   . GLY A 29  ? 0.27896 0.29017 0.30109 0.00302  -0.00283 -0.00631 29  GLY A C   
213  O O   . GLY A 29  ? 0.26149 0.27267 0.28696 0.00470  -0.00418 -0.00797 29  GLY A O   
214  N N   . LEU A 30  ? 0.24657 0.25498 0.26518 0.00235  -0.00354 -0.00362 30  LEU A N   
215  C CA  . LEU A 30  ? 0.28123 0.28519 0.29799 0.00307  -0.00562 -0.00191 30  LEU A CA  
216  C C   . LEU A 30  ? 0.29191 0.29096 0.30654 0.00261  -0.00675 -0.00181 30  LEU A C   
217  O O   . LEU A 30  ? 0.27391 0.27311 0.28662 0.00069  -0.00544 -0.00113 30  LEU A O   
218  C CB  . LEU A 30  ? 0.26133 0.26564 0.27517 0.00191  -0.00483 0.00073  30  LEU A CB  
219  C CG  . LEU A 30  ? 0.27416 0.27355 0.28477 0.00199  -0.00643 0.00255  30  LEU A CG  
220  C CD1 . LEU A 30  ? 0.27123 0.27001 0.28347 0.00411  -0.00836 0.00198  30  LEU A CD1 
221  C CD2 . LEU A 30  ? 0.29388 0.29430 0.30201 0.00021  -0.00490 0.00443  30  LEU A CD2 
222  N N   . TRP A 31  ? 0.27255 0.26692 0.28747 0.00442  -0.00943 -0.00273 31  TRP A N   
223  C CA  . TRP A 31  ? 0.25039 0.23873 0.26294 0.00422  -0.01085 -0.00298 31  TRP A CA  
224  C C   . TRP A 31  ? 0.25939 0.23987 0.26547 0.00342  -0.01248 -0.00028 31  TRP A C   
225  O O   . TRP A 31  ? 0.29825 0.27428 0.30287 0.00544  -0.01548 0.00006  31  TRP A O   
226  C CB  . TRP A 31  ? 0.24381 0.23125 0.26064 0.00701  -0.01317 -0.00622 31  TRP A CB  
227  C CG  . TRP A 31  ? 0.29327 0.27392 0.30805 0.00732  -0.01507 -0.00695 31  TRP A CG  
228  C CD1 . TRP A 31  ? 0.27575 0.25258 0.28607 0.00469  -0.01386 -0.00555 31  TRP A CD1 
229  C CD2 . TRP A 31  ? 0.27706 0.25380 0.29452 0.01051  -0.01866 -0.00968 31  TRP A CD2 
230  N NE1 . TRP A 31  ? 0.30288 0.27286 0.31207 0.00580  -0.01632 -0.00686 31  TRP A NE1 
231  C CE2 . TRP A 31  ? 0.31564 0.28532 0.32920 0.00964  -0.01953 -0.00939 31  TRP A CE2 
232  C CE3 . TRP A 31  ? 0.28089 0.25961 0.30419 0.01410  -0.02137 -0.01282 31  TRP A CE3 
233  C CZ2 . TRP A 31  ? 0.34140 0.30505 0.35608 0.01252  -0.02334 -0.01180 31  TRP A CZ2 
234  C CZ3 . TRP A 31  ? 0.29419 0.26791 0.31962 0.01718  -0.02529 -0.01568 31  TRP A CZ3 
235  C CH2 . TRP A 31  ? 0.34452 0.31038 0.36536 0.01652  -0.02640 -0.01499 31  TRP A CH2 
236  N N   . LEU A 32  ? 0.26707 0.24577 0.26905 0.00029  -0.01046 0.00131  32  LEU A N   
237  C CA  . LEU A 32  ? 0.30397 0.27474 0.29866 -0.00166 -0.01096 0.00359  32  LEU A CA  
238  C C   . LEU A 32  ? 0.27550 0.24083 0.26655 -0.00418 -0.01020 0.00339  32  LEU A C   
239  O O   . LEU A 32  ? 0.28974 0.26012 0.28342 -0.00609 -0.00758 0.00232  32  LEU A O   
240  C CB  . LEU A 32  ? 0.29187 0.26627 0.28523 -0.00394 -0.00836 0.00514  32  LEU A CB  
241  C CG  . LEU A 32  ? 0.28348 0.26293 0.27991 -0.00190 -0.00877 0.00546  32  LEU A CG  
242  C CD1 . LEU A 32  ? 0.28626 0.27086 0.28306 -0.00400 -0.00588 0.00622  32  LEU A CD1 
243  C CD2 . LEU A 32  ? 0.28979 0.26269 0.28234 -0.00023 -0.01193 0.00654  32  LEU A CD2 
244  N N   . ASP A 33  ? 0.33229 0.28673 0.31681 -0.00422 -0.01271 0.00432  33  ASP A N   
245  C CA  . ASP A 33  ? 0.39609 0.34349 0.37645 -0.00650 -0.01239 0.00398  33  ASP A CA  
246  C C   . ASP A 33  ? 0.37951 0.33282 0.36711 -0.00480 -0.01226 0.00119  33  ASP A C   
247  O O   . ASP A 33  ? 0.30162 0.25785 0.29439 -0.00096 -0.01456 -0.00043 33  ASP A O   
248  C CB  . ASP A 33  ? 0.36495 0.31157 0.34086 -0.01176 -0.00839 0.00492  33  ASP A CB  
249  C CG  . ASP A 33  ? 0.52782 0.46890 0.49646 -0.01363 -0.00815 0.00728  33  ASP A CG  
250  O OD1 . ASP A 33  ? 0.46629 0.39793 0.42888 -0.01181 -0.01182 0.00875  33  ASP A OD1 
251  O OD2 . ASP A 33  ? 0.47029 0.41640 0.43933 -0.01678 -0.00452 0.00735  33  ASP A OD2 
252  N N   . ASP A 34  ? 0.31814 0.27384 0.30664 -0.00768 -0.00949 0.00012  34  ASP A N   
253  C CA  . ASP A 34  ? 0.30855 0.26914 0.30286 -0.00645 -0.00928 -0.00260 34  ASP A CA  
254  C C   . ASP A 34  ? 0.31874 0.29095 0.31889 -0.00689 -0.00661 -0.00368 34  ASP A C   
255  O O   . ASP A 34  ? 0.32225 0.29821 0.32520 -0.00769 -0.00539 -0.00566 34  ASP A O   
256  C CB  . ASP A 34  ? 0.31554 0.26978 0.30645 -0.00908 -0.00867 -0.00342 34  ASP A CB  
257  C CG  . ASP A 34  ? 0.39413 0.34978 0.38260 -0.01398 -0.00500 -0.00298 34  ASP A CG  
258  O OD1 . ASP A 34  ? 0.43606 0.39596 0.42449 -0.01525 -0.00331 -0.00181 34  ASP A OD1 
259  O OD2 . ASP A 34  ? 0.43538 0.38818 0.42253 -0.01661 -0.00376 -0.00430 34  ASP A OD2 
260  N N   . VAL A 35  ? 0.29675 0.27402 0.29818 -0.00632 -0.00598 -0.00246 35  VAL A N   
261  C CA  . VAL A 35  ? 0.24792 0.23454 0.25350 -0.00649 -0.00408 -0.00318 35  VAL A CA  
262  C C   . VAL A 35  ? 0.27199 0.26257 0.28047 -0.00371 -0.00486 -0.00307 35  VAL A C   
263  O O   . VAL A 35  ? 0.27788 0.26585 0.28498 -0.00255 -0.00613 -0.00167 35  VAL A O   
264  C CB  . VAL A 35  ? 0.27770 0.26698 0.28201 -0.00922 -0.00203 -0.00219 35  VAL A CB  
265  C CG1 . VAL A 35  ? 0.26361 0.26142 0.27174 -0.00861 -0.00114 -0.00297 35  VAL A CG1 
266  C CG2 . VAL A 35  ? 0.31234 0.29848 0.31447 -0.01264 -0.00063 -0.00307 35  VAL A CG2 
267  N N   . VAL A 36  ? 0.25868 0.25516 0.27062 -0.00297 -0.00400 -0.00472 36  VAL A N   
268  C CA  . VAL A 36  ? 0.24113 0.24181 0.25540 -0.00132 -0.00382 -0.00494 36  VAL A CA  
269  C C   . VAL A 36  ? 0.26906 0.27458 0.28275 -0.00243 -0.00229 -0.00405 36  VAL A C   
270  O O   . VAL A 36  ? 0.25812 0.26597 0.27166 -0.00350 -0.00154 -0.00500 36  VAL A O   
271  C CB  . VAL A 36  ? 0.26327 0.26588 0.28097 -0.00001 -0.00375 -0.00791 36  VAL A CB  
272  C CG1 . VAL A 36  ? 0.26420 0.27124 0.28383 0.00071  -0.00270 -0.00851 36  VAL A CG1 
273  C CG2 . VAL A 36  ? 0.28231 0.28003 0.30139 0.00183  -0.00605 -0.00928 36  VAL A CG2 
274  N N   . TYR A 37  ? 0.24380 0.25039 0.25698 -0.00200 -0.00225 -0.00237 37  TYR A N   
275  C CA  . TYR A 37  ? 0.26615 0.27645 0.27868 -0.00248 -0.00142 -0.00152 37  TYR A CA  
276  C C   . TYR A 37  ? 0.25865 0.27119 0.27163 -0.00160 -0.00081 -0.00204 37  TYR A C   
277  O O   . TYR A 37  ? 0.27261 0.28465 0.28708 -0.00060 -0.00092 -0.00239 37  TYR A O   
278  C CB  . TYR A 37  ? 0.23357 0.24332 0.24507 -0.00281 -0.00150 0.00038  37  TYR A CB  
279  C CG  . TYR A 37  ? 0.30529 0.31209 0.31541 -0.00451 -0.00137 0.00071  37  TYR A CG  
280  C CD1 . TYR A 37  ? 0.29436 0.29552 0.30256 -0.00459 -0.00220 0.00120  37  TYR A CD1 
281  C CD2 . TYR A 37  ? 0.26144 0.27067 0.27190 -0.00619 -0.00049 0.00020  37  TYR A CD2 
282  C CE1 . TYR A 37  ? 0.31661 0.31360 0.32187 -0.00687 -0.00168 0.00158  37  TYR A CE1 
283  C CE2 . TYR A 37  ? 0.28715 0.29377 0.29623 -0.00858 0.00040  -0.00003 37  TYR A CE2 
284  C CZ  . TYR A 37  ? 0.32387 0.32386 0.32966 -0.00920 0.00004  0.00088  37  TYR A CZ  
285  O OH  . TYR A 37  ? 0.37217 0.36813 0.37497 -0.01226 0.00131  0.00074  37  TYR A OH  
286  N N   . CYS A 38  ? 0.24220 0.25677 0.25352 -0.00213 -0.00025 -0.00234 38  CYS A N   
287  C CA  . CYS A 38  ? 0.22687 0.24227 0.23690 -0.00212 0.00081  -0.00276 38  CYS A CA  
288  C C   . CYS A 38  ? 0.23912 0.25480 0.24524 -0.00254 0.00048  -0.00192 38  CYS A C   
289  O O   . CYS A 38  ? 0.25632 0.27255 0.26194 -0.00261 -0.00071 -0.00193 38  CYS A O   
290  C CB  . CYS A 38  ? 0.21939 0.23506 0.23053 -0.00256 0.00201  -0.00543 38  CYS A CB  
291  S SG  . CYS A 38  ? 0.27107 0.28684 0.27952 -0.00381 0.00227  -0.00699 38  CYS A SG  
292  N N   . PRO A 39  ? 0.24932 0.26423 0.25248 -0.00280 0.00128  -0.00142 39  PRO A N   
293  C CA  . PRO A 39  ? 0.22949 0.24292 0.22753 -0.00289 0.00023  -0.00052 39  PRO A CA  
294  C C   . PRO A 39  ? 0.24251 0.25513 0.23731 -0.00375 -0.00004 -0.00194 39  PRO A C   
295  O O   . PRO A 39  ? 0.24556 0.25815 0.24036 -0.00495 0.00177  -0.00375 39  PRO A O   
296  C CB  . PRO A 39  ? 0.23082 0.24214 0.22542 -0.00358 0.00168  0.00013  39  PRO A CB  
297  C CG  . PRO A 39  ? 0.23139 0.24452 0.23109 -0.00326 0.00287  -0.00008 39  PRO A CG  
298  C CD  . PRO A 39  ? 0.27844 0.29332 0.28265 -0.00299 0.00286  -0.00169 39  PRO A CD  
299  N N   . ARG A 40  ? 0.25023 0.26243 0.24264 -0.00302 -0.00251 -0.00156 40  ARG A N   
300  C CA  . ARG A 40  ? 0.28549 0.29667 0.27429 -0.00369 -0.00335 -0.00297 40  ARG A CA  
301  C C   . ARG A 40  ? 0.29064 0.29751 0.27153 -0.00526 -0.00212 -0.00305 40  ARG A C   
302  O O   . ARG A 40  ? 0.28702 0.29261 0.26427 -0.00645 -0.00190 -0.00453 40  ARG A O   
303  C CB  . ARG A 40  ? 0.28913 0.30115 0.27772 -0.00222 -0.00689 -0.00307 40  ARG A CB  
304  C CG  . ARG A 40  ? 0.23537 0.24471 0.21977 -0.00073 -0.00935 -0.00154 40  ARG A CG  
305  C CD  . ARG A 40  ? 0.27782 0.28865 0.26308 0.00111  -0.01343 -0.00273 40  ARG A CD  
306  N NE  . ARG A 40  ? 0.24719 0.25507 0.22884 0.00319  -0.01660 -0.00166 40  ARG A NE  
307  C CZ  . ARG A 40  ? 0.32896 0.33745 0.31089 0.00547  -0.02106 -0.00301 40  ARG A CZ  
308  N NH1 . ARG A 40  ? 0.26108 0.27356 0.24693 0.00569  -0.02263 -0.00559 40  ARG A NH1 
309  N NH2 . ARG A 40  ? 0.27859 0.28349 0.25697 0.00770  -0.02426 -0.00207 40  ARG A NH2 
310  N N   . ALA A 41  ? 0.29346 0.29767 0.27111 -0.00571 -0.00099 -0.00168 41  ALA A N   
311  C CA  . ALA A 41  ? 0.33066 0.32988 0.29979 -0.00807 0.00092  -0.00192 41  ALA A CA  
312  C C   . ALA A 41  ? 0.30724 0.30813 0.27815 -0.01051 0.00489  -0.00462 41  ALA A C   
313  O O   . ALA A 41  ? 0.30678 0.30387 0.27056 -0.01328 0.00730  -0.00560 41  ALA A O   
314  C CB  . ALA A 41  ? 0.42178 0.41771 0.38752 -0.00840 0.00166  -0.00010 41  ALA A CB  
315  N N   . VAL A 42  ? 0.25910 0.26507 0.23891 -0.00967 0.00561  -0.00614 42  VAL A N   
316  C CA  . VAL A 42  ? 0.25589 0.26373 0.23828 -0.01140 0.00867  -0.00942 42  VAL A CA  
317  C C   . VAL A 42  ? 0.29807 0.30383 0.27466 -0.01301 0.00882  -0.01097 42  VAL A C   
318  O O   . VAL A 42  ? 0.31266 0.31864 0.28843 -0.01535 0.01203  -0.01395 42  VAL A O   
319  C CB  . VAL A 42  ? 0.25924 0.27150 0.25144 -0.00957 0.00821  -0.01055 42  VAL A CB  
320  C CG1 . VAL A 42  ? 0.26689 0.27982 0.26050 -0.00837 0.00567  -0.01028 42  VAL A CG1 
321  C CG2 . VAL A 42  ? 0.25815 0.27266 0.25462 -0.01076 0.01123  -0.01442 42  VAL A CG2 
322  N N   . ILE A 43  ? 0.32088 0.32485 0.29360 -0.01186 0.00538  -0.00948 43  ILE A N   
323  C CA  . ILE A 43  ? 0.31907 0.32090 0.28597 -0.01322 0.00497  -0.01102 43  ILE A CA  
324  C C   . ILE A 43  ? 0.37537 0.37028 0.32972 -0.01540 0.00526  -0.01022 43  ILE A C   
325  O O   . ILE A 43  ? 0.37864 0.37050 0.32607 -0.01683 0.00480  -0.01138 43  ILE A O   
326  C CB  . ILE A 43  ? 0.32826 0.33174 0.29734 -0.01106 0.00089  -0.01063 43  ILE A CB  
327  C CG1 . ILE A 43  ? 0.29739 0.29854 0.26278 -0.00907 -0.00310 -0.00804 43  ILE A CG1 
328  C CG2 . ILE A 43  ? 0.28746 0.29620 0.26722 -0.00964 0.00097  -0.01136 43  ILE A CG2 
329  C CD1 . ILE A 43  ? 0.35281 0.35677 0.32179 -0.00706 -0.00696 -0.00857 43  ILE A CD1 
330  N N   . CYS A 44  ? 0.33988 0.33142 0.29023 -0.01597 0.00606  -0.00832 44  CYS A N   
331  C CA  . CYS A 44  ? 0.36971 0.35273 0.30648 -0.01823 0.00611  -0.00709 44  CYS A CA  
332  C C   . CYS A 44  ? 0.45965 0.44060 0.39215 -0.02282 0.01202  -0.00938 44  CYS A C   
333  O O   . CYS A 44  ? 0.50056 0.48621 0.44095 -0.02354 0.01553  -0.01091 44  CYS A O   
334  C CB  . CYS A 44  ? 0.45128 0.43056 0.38503 -0.01637 0.00339  -0.00375 44  CYS A CB  
335  S SG  . CYS A 44  ? 0.50113 0.48142 0.43735 -0.01153 -0.00367 -0.00187 44  CYS A SG  
336  N N   . THR A 45  ? 0.48359 0.45731 0.40331 -0.02607 0.01304  -0.00991 45  THR A N   
337  C CA  . THR A 45  ? 0.54887 0.51795 0.46077 -0.03125 0.01866  -0.01153 45  THR A CA  
338  C C   . THR A 45  ? 0.54941 0.51066 0.45244 -0.03180 0.01776  -0.00813 45  THR A C   
339  O O   . THR A 45  ? 0.60072 0.55991 0.50319 -0.02791 0.01238  -0.00471 45  THR A O   
340  C CB  . THR A 45  ? 0.55407 0.51720 0.45397 -0.03516 0.02045  -0.01344 45  THR A CB  
341  O OG1 . THR A 45  ? 0.62665 0.57995 0.51274 -0.03418 0.01525  -0.01003 45  THR A OG1 
342  C CG2 . THR A 45  ? 0.50872 0.47913 0.41718 -0.03413 0.02055  -0.01666 45  THR A CG2 
343  N N   . SER A 46  ? 0.62944 0.58625 0.52562 -0.03690 0.02326  -0.00949 46  SER A N   
344  C CA  . SER A 46  ? 0.68234 0.63066 0.56922 -0.03802 0.02292  -0.00642 46  SER A CA  
345  C C   . SER A 46  ? 0.74427 0.68042 0.61513 -0.03700 0.01737  -0.00269 46  SER A C   
346  O O   . SER A 46  ? 0.76887 0.69997 0.63627 -0.03429 0.01320  0.00079  46  SER A O   
347  C CB  . SER A 46  ? 0.75166 0.69687 0.63311 -0.04467 0.03052  -0.00920 46  SER A CB  
348  O OG  . SER A 46  ? 0.77798 0.73452 0.67532 -0.04472 0.03458  -0.01272 46  SER A OG  
349  N N   . GLU A 47  ? 0.58216 0.51335 0.44319 -0.03886 0.01681  -0.00362 47  GLU A N   
350  C CA  . GLU A 47  ? 0.74084 0.65975 0.58592 -0.03755 0.01068  -0.00036 47  GLU A CA  
351  C C   . GLU A 47  ? 0.61524 0.53892 0.46855 -0.03045 0.00267  0.00141  47  GLU A C   
352  O O   . GLU A 47  ? 0.63799 0.55381 0.48346 -0.02736 -0.00356 0.00444  47  GLU A O   
353  C CB  . GLU A 47  ? 0.77744 0.68914 0.60865 -0.04193 0.01244  -0.00210 47  GLU A CB  
354  C CG  . GLU A 47  ? 0.97372 0.87418 0.78870 -0.04944 0.01872  -0.00264 47  GLU A CG  
355  C CD  . GLU A 47  ? 1.21770 1.10968 1.01693 -0.05418 0.02044  -0.00429 47  GLU A CD  
356  O OE1 . GLU A 47  ? 1.17895 1.07593 0.98238 -0.05175 0.01756  -0.00569 47  GLU A OE1 
357  O OE2 . GLU A 47  ? 1.08822 0.96811 0.87032 -0.06069 0.02488  -0.00431 47  GLU A OE2 
358  N N   . ASP A 48  ? 0.52682 0.46310 0.39594 -0.02787 0.00272  -0.00079 48  ASP A N   
359  C CA  . ASP A 48  ? 0.58646 0.52872 0.46533 -0.02182 -0.00372 0.00022  48  ASP A CA  
360  C C   . ASP A 48  ? 0.53128 0.47315 0.41377 -0.01850 -0.00662 0.00293  48  ASP A C   
361  O O   . ASP A 48  ? 0.53602 0.47733 0.41957 -0.01397 -0.01311 0.00425  48  ASP A O   
362  C CB  . ASP A 48  ? 0.45832 0.41378 0.35411 -0.02047 -0.00174 -0.00247 48  ASP A CB  
363  C CG  . ASP A 48  ? 0.60845 0.56521 0.50243 -0.02238 -0.00053 -0.00531 48  ASP A CG  
364  O OD1 . ASP A 48  ? 0.62755 0.57630 0.50873 -0.02313 -0.00347 -0.00493 48  ASP A OD1 
365  O OD2 . ASP A 48  ? 0.57725 0.54262 0.48237 -0.02297 0.00302  -0.00801 48  ASP A OD2 
366  N N   . MET A 49  ? 0.61066 0.55310 0.49547 -0.02072 -0.00193 0.00329  49  MET A N   
367  C CA  . MET A 49  ? 0.56661 0.51154 0.45847 -0.01756 -0.00381 0.00522  49  MET A CA  
368  C C   . MET A 49  ? 0.44079 0.37478 0.32116 -0.01555 -0.00917 0.00823  49  MET A C   
369  O O   . MET A 49  ? 0.44045 0.37698 0.32735 -0.01172 -0.01244 0.00951  49  MET A O   
370  C CB  . MET A 49  ? 0.56135 0.50967 0.45849 -0.02061 0.00253  0.00441  49  MET A CB  
371  C CG  . MET A 49  ? 0.53970 0.50067 0.45292 -0.02004 0.00563  0.00179  49  MET A CG  
372  S SD  . MET A 49  ? 0.83828 0.80815 0.76519 -0.01405 0.00042  0.00256  49  MET A SD  
373  C CE  . MET A 49  ? 0.59680 0.56135 0.52015 -0.01129 -0.00355 0.00580  49  MET A CE  
374  N N   . LEU A 50  ? 0.43313 0.35450 0.29617 -0.01802 -0.01032 0.00925  50  LEU A N   
375  C CA  . LEU A 50  ? 0.45206 0.36155 0.30320 -0.01554 -0.01652 0.01211  50  LEU A CA  
376  C C   . LEU A 50  ? 0.56467 0.47763 0.42162 -0.00908 -0.02480 0.01199  50  LEU A C   
377  O O   . LEU A 50  ? 0.59378 0.50436 0.45178 -0.00493 -0.02992 0.01338  50  LEU A O   
378  C CB  . LEU A 50  ? 0.56245 0.45609 0.39187 -0.01987 -0.01623 0.01325  50  LEU A CB  
379  C CG  . LEU A 50  ? 0.65902 0.54439 0.47789 -0.02647 -0.00914 0.01383  50  LEU A CG  
380  C CD1 . LEU A 50  ? 0.56234 0.44714 0.38532 -0.02517 -0.00891 0.01564  50  LEU A CD1 
381  C CD2 . LEU A 50  ? 0.72770 0.62181 0.55345 -0.03176 -0.00035 0.01039  50  LEU A CD2 
382  N N   . ASN A 51  ? 0.49876 0.41779 0.36025 -0.00822 -0.02610 0.00984  51  ASN A N   
383  C CA  . ASN A 51  ? 0.53791 0.46045 0.40474 -0.00264 -0.03378 0.00889  51  ASN A CA  
384  C C   . ASN A 51  ? 0.43487 0.37005 0.31474 -0.00233 -0.03224 0.00588  51  ASN A C   
385  O O   . ASN A 51  ? 0.48156 0.41531 0.35706 -0.00196 -0.03529 0.00446  51  ASN A O   
386  C CB  . ASN A 51  ? 0.59832 0.50708 0.44763 -0.00157 -0.04043 0.00989  51  ASN A CB  
387  C CG  . ASN A 51  ? 0.65391 0.56572 0.50885 0.00485  -0.04944 0.00842  51  ASN A CG  
388  O OD1 . ASN A 51  ? 0.71266 0.63420 0.58244 0.00866  -0.05113 0.00730  51  ASN A OD1 
389  N ND2 . ASN A 51  ? 0.61573 0.51929 0.45882 0.00591  -0.05525 0.00801  51  ASN A ND2 
390  N N   . PRO A 52  ? 0.35738 0.30422 0.25254 -0.00249 -0.02783 0.00484  52  PRO A N   
391  C CA  . PRO A 52  ? 0.38642 0.34355 0.29239 -0.00286 -0.02580 0.00214  52  PRO A CA  
392  C C   . PRO A 52  ? 0.41631 0.37971 0.33091 0.00155  -0.03162 0.00034  52  PRO A C   
393  O O   . PRO A 52  ? 0.46620 0.43182 0.38646 0.00507  -0.03515 0.00060  52  PRO A O   
394  C CB  . PRO A 52  ? 0.35580 0.32108 0.27346 -0.00430 -0.01982 0.00199  52  PRO A CB  
395  C CG  . PRO A 52  ? 0.39204 0.35524 0.31041 -0.00236 -0.02120 0.00410  52  PRO A CG  
396  C CD  . PRO A 52  ? 0.45379 0.40401 0.35611 -0.00253 -0.02455 0.00608  52  PRO A CD  
397  N N   . ASN A 53  ? 0.35319 0.31966 0.26899 0.00114  -0.03246 -0.00197 53  ASN A N   
398  C CA  . ASN A 53  ? 0.39194 0.36675 0.31856 0.00429  -0.03637 -0.00467 53  ASN A CA  
399  C C   . ASN A 53  ? 0.36881 0.35310 0.30707 0.00212  -0.03078 -0.00625 53  ASN A C   
400  O O   . ASN A 53  ? 0.35481 0.33981 0.29162 -0.00020 -0.02860 -0.00771 53  ASN A O   
401  C CB  . ASN A 53  ? 0.37835 0.34917 0.29756 0.00561  -0.04210 -0.00640 53  ASN A CB  
402  C CG  . ASN A 53  ? 0.40544 0.38522 0.33649 0.00899  -0.04658 -0.00985 53  ASN A CG  
403  O OD1 . ASN A 53  ? 0.39597 0.38560 0.33994 0.00830  -0.04325 -0.01161 53  ASN A OD1 
404  N ND2 . ASN A 53  ? 0.41882 0.39485 0.34529 0.01258  -0.05429 -0.01111 53  ASN A ND2 
405  N N   . TYR A 54  ? 0.33878 0.32953 0.28786 0.00285  -0.02857 -0.00594 54  TYR A N   
406  C CA  . TYR A 54  ? 0.32493 0.32219 0.28290 0.00068  -0.02320 -0.00671 54  TYR A CA  
407  C C   . TYR A 54  ? 0.32613 0.32922 0.29060 0.00056  -0.02386 -0.00972 54  TYR A C   
408  O O   . TYR A 54  ? 0.34543 0.35025 0.31177 -0.00178 -0.02017 -0.01068 54  TYR A O   
409  C CB  . TYR A 54  ? 0.35082 0.35248 0.31741 0.00157  -0.02141 -0.00564 54  TYR A CB  
410  C CG  . TYR A 54  ? 0.31618 0.31313 0.27781 0.00056  -0.01880 -0.00300 54  TYR A CG  
411  C CD1 . TYR A 54  ? 0.29361 0.29046 0.25512 -0.00225 -0.01369 -0.00271 54  TYR A CD1 
412  C CD2 . TYR A 54  ? 0.31303 0.30572 0.27051 0.00245  -0.02155 -0.00126 54  TYR A CD2 
413  C CE1 . TYR A 54  ? 0.32634 0.31958 0.28412 -0.00347 -0.01109 -0.00094 54  TYR A CE1 
414  C CE2 . TYR A 54  ? 0.31917 0.30741 0.27210 0.00115  -0.01890 0.00096  54  TYR A CE2 
415  C CZ  . TYR A 54  ? 0.29040 0.27921 0.24362 -0.00197 -0.01352 0.00101  54  TYR A CZ  
416  O OH  . TYR A 54  ? 0.33667 0.32171 0.28608 -0.00356 -0.01067 0.00258  54  TYR A OH  
417  N N   . GLU A 55  ? 0.30248 0.30878 0.27094 0.00306  -0.02855 -0.01167 55  GLU A N   
418  C CA  . GLU A 55  ? 0.34244 0.35419 0.31687 0.00261  -0.02920 -0.01497 55  GLU A CA  
419  C C   . GLU A 55  ? 0.33504 0.34267 0.30126 0.00089  -0.02926 -0.01580 55  GLU A C   
420  O O   . GLU A 55  ? 0.35533 0.36612 0.32531 -0.00112 -0.02653 -0.01758 55  GLU A O   
421  C CB  . GLU A 55  ? 0.37859 0.39462 0.35856 0.00560  -0.03460 -0.01769 55  GLU A CB  
422  C CG  . GLU A 55  ? 0.52032 0.54429 0.51042 0.00465  -0.03393 -0.02148 55  GLU A CG  
423  C CD  . GLU A 55  ? 0.58059 0.60974 0.58004 0.00293  -0.02913 -0.02131 55  GLU A CD  
424  O OE1 . GLU A 55  ? 0.53636 0.56819 0.54074 0.00431  -0.02964 -0.02123 55  GLU A OE1 
425  O OE2 . GLU A 55  ? 0.47223 0.50213 0.47351 0.00023  -0.02501 -0.02133 55  GLU A OE2 
426  N N   . ASP A 56  ? 0.33391 0.33366 0.28806 0.00146  -0.03229 -0.01456 56  ASP A N   
427  C CA  . ASP A 56  ? 0.37828 0.37318 0.32298 -0.00062 -0.03212 -0.01539 56  ASP A CA  
428  C C   . ASP A 56  ? 0.38354 0.37720 0.32640 -0.00434 -0.02535 -0.01460 56  ASP A C   
429  O O   . ASP A 56  ? 0.33656 0.33129 0.27917 -0.00648 -0.02315 -0.01664 56  ASP A O   
430  C CB  . ASP A 56  ? 0.39571 0.38071 0.32595 0.00055  -0.03703 -0.01401 56  ASP A CB  
431  C CG  . ASP A 56  ? 0.49583 0.48174 0.42709 0.00449  -0.04490 -0.01610 56  ASP A CG  
432  O OD1 . ASP A 56  ? 0.49245 0.48693 0.43466 0.00536  -0.04593 -0.01939 56  ASP A OD1 
433  O OD2 . ASP A 56  ? 0.47538 0.45309 0.39633 0.00668  -0.05022 -0.01475 56  ASP A OD2 
434  N N   . LEU A 57  ? 0.39631 0.38798 0.33833 -0.00509 -0.02209 -0.01212 57  LEU A N   
435  C CA  . LEU A 57  ? 0.41455 0.40614 0.35661 -0.00834 -0.01584 -0.01215 57  LEU A CA  
436  C C   . LEU A 57  ? 0.44036 0.43962 0.39445 -0.00874 -0.01298 -0.01415 57  LEU A C   
437  O O   . LEU A 57  ? 0.41761 0.41742 0.37208 -0.01107 -0.00922 -0.01586 57  LEU A O   
438  C CB  . LEU A 57  ? 0.37559 0.36467 0.31622 -0.00874 -0.01337 -0.00957 57  LEU A CB  
439  C CG  . LEU A 57  ? 0.39584 0.37526 0.32254 -0.00934 -0.01506 -0.00747 57  LEU A CG  
440  C CD1 . LEU A 57  ? 0.44512 0.42301 0.37236 -0.00932 -0.01310 -0.00504 57  LEU A CD1 
441  C CD2 . LEU A 57  ? 0.41699 0.39044 0.33257 -0.01330 -0.01205 -0.00858 57  LEU A CD2 
442  N N   . LEU A 58  ? 0.37581 0.38052 0.33940 -0.00663 -0.01473 -0.01422 58  LEU A N   
443  C CA  . LEU A 58  ? 0.39463 0.40493 0.36832 -0.00717 -0.01221 -0.01568 58  LEU A CA  
444  C C   . LEU A 58  ? 0.42838 0.44040 0.40314 -0.00817 -0.01271 -0.01869 58  LEU A C   
445  O O   . LEU A 58  ? 0.47380 0.48825 0.45427 -0.00932 -0.00994 -0.02008 58  LEU A O   
446  C CB  . LEU A 58  ? 0.40470 0.41930 0.38653 -0.00535 -0.01363 -0.01502 58  LEU A CB  
447  C CG  . LEU A 58  ? 0.52392 0.54181 0.51411 -0.00597 -0.01053 -0.01490 58  LEU A CG  
448  C CD1 . LEU A 58  ? 0.34682 0.36257 0.33596 -0.00703 -0.00686 -0.01388 58  LEU A CD1 
449  C CD2 . LEU A 58  ? 0.43448 0.45491 0.42951 -0.00453 -0.01168 -0.01371 58  LEU A CD2 
450  N N   . ILE A 59  ? 0.37137 0.38162 0.34040 -0.00762 -0.01650 -0.01983 59  ILE A N   
451  C CA  . ILE A 59  ? 0.36372 0.37568 0.33355 -0.00857 -0.01731 -0.02296 59  ILE A CA  
452  C C   . ILE A 59  ? 0.47068 0.48087 0.43803 -0.01122 -0.01301 -0.02418 59  ILE A C   
453  O O   . ILE A 59  ? 0.50470 0.51761 0.47693 -0.01227 -0.01167 -0.02666 59  ILE A O   
454  C CB  . ILE A 59  ? 0.35851 0.36778 0.32092 -0.00728 -0.02273 -0.02391 59  ILE A CB  
455  C CG1 . ILE A 59  ? 0.33316 0.34627 0.30143 -0.00433 -0.02729 -0.02428 59  ILE A CG1 
456  C CG2 . ILE A 59  ? 0.39511 0.40494 0.35596 -0.00873 -0.02325 -0.02717 59  ILE A CG2 
457  C CD1 . ILE A 59  ? 0.42156 0.43155 0.38274 -0.00214 -0.03378 -0.02530 59  ILE A CD1 
458  N N   . ARG A 60  ? 0.44494 0.45062 0.40504 -0.01252 -0.01057 -0.02288 60  ARG A N   
459  C CA  . ARG A 60  ? 0.55651 0.56091 0.51436 -0.01523 -0.00623 -0.02484 60  ARG A CA  
460  C C   . ARG A 60  ? 0.48468 0.49219 0.45119 -0.01551 -0.00207 -0.02507 60  ARG A C   
461  O O   . ARG A 60  ? 0.49225 0.49925 0.45812 -0.01747 0.00172  -0.02711 60  ARG A O   
462  C CB  . ARG A 60  ? 0.63650 0.63427 0.58163 -0.01725 -0.00516 -0.02413 60  ARG A CB  
463  C CG  . ARG A 60  ? 0.75010 0.74299 0.68435 -0.01743 -0.00927 -0.02456 60  ARG A CG  
464  C CD  . ARG A 60  ? 0.81249 0.79960 0.73803 -0.01586 -0.01328 -0.02140 60  ARG A CD  
465  N NE  . ARG A 60  ? 0.96041 0.94223 0.87875 -0.01805 -0.00963 -0.01956 60  ARG A NE  
466  C CZ  . ARG A 60  ? 0.91558 0.89068 0.82484 -0.01741 -0.01204 -0.01664 60  ARG A CZ  
467  N NH1 . ARG A 60  ? 0.75800 0.73079 0.66436 -0.01412 -0.01863 -0.01531 60  ARG A NH1 
468  N NH2 . ARG A 60  ? 0.77933 0.74988 0.68257 -0.02011 -0.00783 -0.01542 60  ARG A NH2 
469  N N   . LYS A 61  ? 0.42741 0.43798 0.40185 -0.01360 -0.00283 -0.02342 61  LYS A N   
470  C CA  . LYS A 61  ? 0.37021 0.38279 0.35215 -0.01338 0.00007  -0.02341 61  LYS A CA  
471  C C   . LYS A 61  ? 0.41036 0.42560 0.40013 -0.01282 -0.00044 -0.02467 61  LYS A C   
472  O O   . LYS A 61  ? 0.42486 0.44167 0.41698 -0.01200 -0.00292 -0.02398 61  LYS A O   
473  C CB  . LYS A 61  ? 0.34380 0.35638 0.32722 -0.01200 -0.00014 -0.02029 61  LYS A CB  
474  C CG  . LYS A 61  ? 0.36714 0.37620 0.34255 -0.01276 0.00051  -0.01878 61  LYS A CG  
475  C CD  . LYS A 61  ? 0.40955 0.41734 0.38238 -0.01518 0.00468  -0.02099 61  LYS A CD  
476  C CE  . LYS A 61  ? 0.47939 0.48279 0.44339 -0.01669 0.00587  -0.01947 61  LYS A CE  
477  N NZ  . LYS A 61  ? 0.52734 0.52923 0.48727 -0.02005 0.01041  -0.02239 61  LYS A NZ  
478  N N   . SER A 62  ? 0.34171 0.35719 0.33550 -0.01338 0.00193  -0.02684 62  SER A N   
479  C CA  . SER A 62  ? 0.32443 0.34061 0.32477 -0.01296 0.00168  -0.02779 62  SER A CA  
480  C C   . SER A 62  ? 0.28828 0.30385 0.29354 -0.01170 0.00270  -0.02665 62  SER A C   
481  O O   . SER A 62  ? 0.32127 0.33689 0.32587 -0.01124 0.00391  -0.02585 62  SER A O   
482  C CB  . SER A 62  ? 0.36357 0.37943 0.36448 -0.01417 0.00277  -0.03151 62  SER A CB  
483  O OG  . SER A 62  ? 0.43079 0.44692 0.42648 -0.01535 0.00157  -0.03273 62  SER A OG  
484  N N   . ASN A 63  ? 0.29923 0.31365 0.30891 -0.01129 0.00209  -0.02675 63  ASN A N   
485  C CA  . ASN A 63  ? 0.34374 0.35623 0.35721 -0.00987 0.00226  -0.02577 63  ASN A CA  
486  C C   . ASN A 63  ? 0.31216 0.32501 0.32744 -0.00908 0.00386  -0.02798 63  ASN A C   
487  O O   . ASN A 63  ? 0.29075 0.30376 0.30770 -0.00783 0.00404  -0.02691 63  ASN A O   
488  C CB  . ASN A 63  ? 0.31150 0.32070 0.32759 -0.01001 0.00144  -0.02633 63  ASN A CB  
489  C CG  . ASN A 63  ? 0.33908 0.34815 0.35439 -0.01124 0.00051  -0.02451 63  ASN A CG  
490  O OD1 . ASN A 63  ? 0.31743 0.32859 0.33165 -0.01113 0.00009  -0.02232 63  ASN A OD1 
491  N ND2 . ASN A 63  ? 0.30807 0.31466 0.32421 -0.01260 0.00038  -0.02583 63  ASN A ND2 
492  N N   . HIS A 64  ? 0.32435 0.33777 0.33982 -0.00994 0.00515  -0.03162 64  HIS A N   
493  C CA  . HIS A 64  ? 0.30163 0.31613 0.32034 -0.00938 0.00700  -0.03493 64  HIS A CA  
494  C C   . HIS A 64  ? 0.34479 0.36168 0.36037 -0.01053 0.00927  -0.03501 64  HIS A C   
495  O O   . HIS A 64  ? 0.33209 0.35073 0.35108 -0.01039 0.01126  -0.03806 64  HIS A O   
496  C CB  . HIS A 64  ? 0.33869 0.35318 0.35888 -0.01018 0.00802  -0.03938 64  HIS A CB  
497  C CG  . HIS A 64  ? 0.33882 0.35467 0.35313 -0.01277 0.00955  -0.04062 64  HIS A CG  
498  N ND1 . HIS A 64  ? 0.35592 0.37096 0.36651 -0.01383 0.00802  -0.03947 64  HIS A ND1 
499  C CD2 . HIS A 64  ? 0.34869 0.36616 0.35959 -0.01471 0.01239  -0.04314 64  HIS A CD2 
500  C CE1 . HIS A 64  ? 0.40892 0.42469 0.41375 -0.01587 0.00926  -0.04099 64  HIS A CE1 
501  N NE2 . HIS A 64  ? 0.34432 0.36107 0.34854 -0.01668 0.01211  -0.04305 64  HIS A NE2 
502  N N   . ASN A 65  ? 0.32114 0.33788 0.33040 -0.01171 0.00895  -0.03209 65  ASN A N   
503  C CA  . ASN A 65  ? 0.36520 0.38249 0.37008 -0.01300 0.01094  -0.03161 65  ASN A CA  
504  C C   . ASN A 65  ? 0.34117 0.35894 0.34883 -0.01150 0.01061  -0.02924 65  ASN A C   
505  O O   . ASN A 65  ? 0.31875 0.33702 0.32414 -0.01266 0.01274  -0.02948 65  ASN A O   
506  C CB  . ASN A 65  ? 0.31881 0.33436 0.31489 -0.01444 0.00997  -0.02938 65  ASN A CB  
507  C CG  . ASN A 65  ? 0.37868 0.39349 0.37050 -0.01628 0.01044  -0.03202 65  ASN A CG  
508  O OD1 . ASN A 65  ? 0.35222 0.36635 0.34154 -0.01610 0.00787  -0.03104 65  ASN A OD1 
509  N ND2 . ASN A 65  ? 0.37730 0.39259 0.36859 -0.01820 0.01382  -0.03589 65  ASN A ND2 
510  N N   . PHE A 66  ? 0.29025 0.30742 0.30212 -0.00933 0.00820  -0.02711 66  PHE A N   
511  C CA  . PHE A 66  ? 0.29046 0.30779 0.30489 -0.00781 0.00760  -0.02499 66  PHE A CA  
512  C C   . PHE A 66  ? 0.35058 0.36846 0.37212 -0.00605 0.00756  -0.02785 66  PHE A C   
513  O O   . PHE A 66  ? 0.35397 0.36971 0.37857 -0.00453 0.00554  -0.02810 66  PHE A O   
514  C CB  . PHE A 66  ? 0.28128 0.29708 0.29492 -0.00680 0.00503  -0.02104 66  PHE A CB  
515  C CG  . PHE A 66  ? 0.32068 0.33652 0.32875 -0.00787 0.00435  -0.01891 66  PHE A CG  
516  C CD1 . PHE A 66  ? 0.29983 0.31573 0.30425 -0.00804 0.00456  -0.01682 66  PHE A CD1 
517  C CD2 . PHE A 66  ? 0.32208 0.33774 0.32872 -0.00855 0.00318  -0.01934 66  PHE A CD2 
518  C CE1 . PHE A 66  ? 0.27635 0.29165 0.27565 -0.00843 0.00311  -0.01515 66  PHE A CE1 
519  C CE2 . PHE A 66  ? 0.36530 0.38126 0.36748 -0.00899 0.00178  -0.01798 66  PHE A CE2 
520  C CZ  . PHE A 66  ? 0.30755 0.32310 0.30601 -0.00871 0.00151  -0.01586 66  PHE A CZ  
521  N N   . LEU A 67  ? 0.26208 0.28246 0.28608 -0.00630 0.00965  -0.03031 67  LEU A N   
522  C CA  . LEU A 67  ? 0.27558 0.29742 0.30743 -0.00426 0.00928  -0.03402 67  LEU A CA  
523  C C   . LEU A 67  ? 0.33493 0.35604 0.36900 -0.00209 0.00709  -0.03144 67  LEU A C   
524  O O   . LEU A 67  ? 0.27409 0.29699 0.30695 -0.00295 0.00851  -0.03043 67  LEU A O   
525  C CB  . LEU A 67  ? 0.32932 0.35527 0.36375 -0.00606 0.01310  -0.03922 67  LEU A CB  
526  C CG  . LEU A 67  ? 0.44611 0.47271 0.47738 -0.00882 0.01595  -0.04232 67  LEU A CG  
527  C CD1 . LEU A 67  ? 0.53060 0.55466 0.56223 -0.00763 0.01356  -0.04218 67  LEU A CD1 
528  C CD2 . LEU A 67  ? 0.53326 0.55860 0.55469 -0.01229 0.01828  -0.03986 67  LEU A CD2 
529  N N   . VAL A 68  ? 0.27729 0.29501 0.31373 0.00049  0.00362  -0.03032 68  VAL A N   
530  C CA  . VAL A 68  ? 0.24022 0.25606 0.27750 0.00251  0.00110  -0.02766 68  VAL A CA  
531  C C   . VAL A 68  ? 0.36488 0.38087 0.40936 0.00556  -0.00107 -0.03156 68  VAL A C   
532  O O   . VAL A 68  ? 0.29519 0.30875 0.34237 0.00715  -0.00290 -0.03403 68  VAL A O   
533  C CB  . VAL A 68  ? 0.28469 0.29527 0.31743 0.00273  -0.00133 -0.02317 68  VAL A CB  
534  C CG1 . VAL A 68  ? 0.28867 0.29706 0.32103 0.00429  -0.00350 -0.02041 68  VAL A CG1 
535  C CG2 . VAL A 68  ? 0.23664 0.24808 0.26387 0.00006  0.00044  -0.02055 68  VAL A CG2 
536  N N   . GLN A 69  ? 0.33333 0.35202 0.38112 0.00655  -0.00121 -0.03240 69  GLN A N   
537  C CA  . GLN A 69  ? 0.39781 0.41811 0.45373 0.00964  -0.00340 -0.03713 69  GLN A CA  
538  C C   . GLN A 69  ? 0.40704 0.42461 0.46282 0.01207  -0.00702 -0.03452 69  GLN A C   
539  O O   . GLN A 69  ? 0.30636 0.32595 0.36000 0.01071  -0.00551 -0.03214 69  GLN A O   
540  C CB  . GLN A 69  ? 0.39311 0.42100 0.45471 0.00799  0.00065  -0.04262 69  GLN A CB  
541  C CG  . GLN A 69  ? 0.54003 0.57138 0.61206 0.01096  -0.00104 -0.04946 69  GLN A CG  
542  C CD  . GLN A 69  ? 0.65873 0.69778 0.73601 0.00815  0.00424  -0.05575 69  GLN A CD  
543  O OE1 . GLN A 69  ? 0.60582 0.64574 0.67819 0.00433  0.00859  -0.05552 69  GLN A OE1 
544  N NE2 . GLN A 69  ? 0.70675 0.75128 0.79377 0.00981  0.00391  -0.06174 69  GLN A NE2 
545  N N   . ALA A 70  ? 0.34583 0.35796 0.40305 0.01561  -0.01200 -0.03490 70  ALA A N   
546  C CA  . ALA A 70  ? 0.43309 0.44145 0.48973 0.01831  -0.01626 -0.03302 70  ALA A CA  
547  C C   . ALA A 70  ? 0.46685 0.47784 0.53310 0.02223  -0.01947 -0.03932 70  ALA A C   
548  O O   . ALA A 70  ? 0.43642 0.44321 0.50508 0.02522  -0.02323 -0.04187 70  ALA A O   
549  C CB  . ALA A 70  ? 0.44761 0.44583 0.49632 0.01904  -0.01985 -0.02822 70  ALA A CB  
550  N N   . GLY A 71  ? 0.52023 0.53818 0.59229 0.02224  -0.01810 -0.04225 71  GLY A N   
551  C CA  . GLY A 71  ? 0.52365 0.54657 0.60693 0.02549  -0.02025 -0.04976 71  GLY A CA  
552  C C   . GLY A 71  ? 0.54943 0.57753 0.63847 0.02420  -0.01668 -0.05532 71  GLY A C   
553  O O   . GLY A 71  ? 0.61098 0.64359 0.69801 0.01975  -0.01058 -0.05521 71  GLY A O   
554  N N   . ASN A 72  ? 0.65362 0.68041 0.74929 0.02815  -0.02073 -0.06036 72  ASN A N   
555  C CA  . ASN A 72  ? 0.71302 0.74425 0.81457 0.02731  -0.01779 -0.06620 72  ASN A CA  
556  C C   . ASN A 72  ? 0.71100 0.73433 0.80600 0.02738  -0.01911 -0.06307 72  ASN A C   
557  O O   . ASN A 72  ? 0.77683 0.80167 0.87714 0.02822  -0.01879 -0.06823 72  ASN A O   
558  C CB  . ASN A 72  ? 0.94387 0.98035 1.05911 0.03163  -0.02097 -0.07539 72  ASN A CB  
559  C CG  . ASN A 72  ? 1.08711 1.13473 1.21108 0.02970  -0.01680 -0.08105 72  ASN A CG  
560  O OD1 . ASN A 72  ? 1.16177 1.21060 1.28776 0.03128  -0.01925 -0.08068 72  ASN A OD1 
561  N ND2 . ASN A 72  ? 1.09521 1.15075 1.22392 0.02586  -0.01019 -0.08653 72  ASN A ND2 
562  N N   . VAL A 73  ? 0.57565 0.59088 0.65963 0.02628  -0.02035 -0.05521 73  VAL A N   
563  C CA  . VAL A 73  ? 0.48104 0.48838 0.55820 0.02578  -0.02140 -0.05199 73  VAL A CA  
564  C C   . VAL A 73  ? 0.49812 0.50704 0.56770 0.02053  -0.01584 -0.04742 73  VAL A C   
565  O O   . VAL A 73  ? 0.47800 0.48823 0.54303 0.01837  -0.01395 -0.04319 73  VAL A O   
566  C CB  . VAL A 73  ? 0.47530 0.47096 0.54558 0.02860  -0.02762 -0.04726 73  VAL A CB  
567  C CG1 . VAL A 73  ? 0.51755 0.50540 0.57860 0.02619  -0.02699 -0.04257 73  VAL A CG1 
568  C CG2 . VAL A 73  ? 0.56734 0.55916 0.64404 0.03431  -0.03415 -0.05217 73  VAL A CG2 
569  N N   . GLN A 74  ? 0.43014 0.43888 0.49857 0.01870  -0.01356 -0.04860 74  GLN A N   
570  C CA  . GLN A 74  ? 0.49785 0.50680 0.55868 0.01432  -0.00955 -0.04440 74  GLN A CA  
571  C C   . GLN A 74  ? 0.47007 0.47001 0.52307 0.01417  -0.01219 -0.03901 74  GLN A C   
572  O O   . GLN A 74  ? 0.58573 0.57929 0.63872 0.01613  -0.01539 -0.04002 74  GLN A O   
573  C CB  . GLN A 74  ? 0.46154 0.47481 0.52444 0.01208  -0.00571 -0.04856 74  GLN A CB  
574  C CG  . GLN A 74  ? 0.60897 0.63096 0.67782 0.01071  -0.00168 -0.05378 74  GLN A CG  
575  C CD  . GLN A 74  ? 0.68703 0.71237 0.75034 0.00696  0.00234  -0.05040 74  GLN A CD  
576  O OE1 . GLN A 74  ? 0.74033 0.76930 0.80636 0.00700  0.00318  -0.05117 74  GLN A OE1 
577  N NE2 . GLN A 74  ? 0.49202 0.51591 0.54760 0.00381  0.00456  -0.04697 74  GLN A NE2 
578  N N   . LEU A 75  ? 0.33135 0.33056 0.37774 0.01170  -0.01079 -0.03365 75  LEU A N   
579  C CA  . LEU A 75  ? 0.32927 0.32149 0.36835 0.01026  -0.01181 -0.02917 75  LEU A CA  
580  C C   . LEU A 75  ? 0.40608 0.40021 0.44326 0.00728  -0.00877 -0.02969 75  LEU A C   
581  O O   . LEU A 75  ? 0.47161 0.47239 0.51043 0.00561  -0.00546 -0.03165 75  LEU A O   
582  C CB  . LEU A 75  ? 0.31873 0.31024 0.35258 0.00882  -0.01142 -0.02407 75  LEU A CB  
583  C CG  . LEU A 75  ? 0.40602 0.39576 0.44092 0.01146  -0.01435 -0.02326 75  LEU A CG  
584  C CD1 . LEU A 75  ? 0.31188 0.30065 0.34110 0.00963  -0.01359 -0.01832 75  LEU A CD1 
585  C CD2 . LEU A 75  ? 0.35657 0.33752 0.39103 0.01466  -0.01937 -0.02410 75  LEU A CD2 
586  N N   . ARG A 76  ? 0.35719 0.34483 0.39027 0.00640  -0.00996 -0.02811 76  ARG A N   
587  C CA  . ARG A 76  ? 0.35940 0.34827 0.39078 0.00369  -0.00765 -0.02885 76  ARG A CA  
588  C C   . ARG A 76  ? 0.31231 0.30211 0.33840 0.00062  -0.00597 -0.02478 76  ARG A C   
589  O O   . ARG A 76  ? 0.35014 0.33456 0.37220 -0.00006 -0.00719 -0.02160 76  ARG A O   
590  C CB  . ARG A 76  ? 0.30579 0.28713 0.33643 0.00433  -0.00979 -0.03025 76  ARG A CB  
591  C CG  . ARG A 76  ? 0.35549 0.33815 0.38515 0.00166  -0.00759 -0.03180 76  ARG A CG  
592  C CD  . ARG A 76  ? 0.44234 0.41723 0.47193 0.00261  -0.00979 -0.03382 76  ARG A CD  
593  N NE  . ARG A 76  ? 0.47015 0.44463 0.50573 0.00648  -0.01202 -0.03798 76  ARG A NE  
594  C CZ  . ARG A 76  ? 0.47365 0.45421 0.51505 0.00706  -0.01034 -0.04300 76  ARG A CZ  
595  N NH1 . ARG A 76  ? 0.39850 0.38490 0.43926 0.00400  -0.00666 -0.04410 76  ARG A NH1 
596  N NH2 . ARG A 76  ? 0.48743 0.46820 0.53541 0.01078  -0.01251 -0.04738 76  ARG A NH2 
597  N N   . VAL A 77  ? 0.29712 0.29339 0.32298 -0.00125 -0.00328 -0.02518 77  VAL A N   
598  C CA  . VAL A 77  ? 0.32991 0.32800 0.35189 -0.00362 -0.00218 -0.02216 77  VAL A CA  
599  C C   . VAL A 77  ? 0.32817 0.32440 0.34840 -0.00578 -0.00187 -0.02285 77  VAL A C   
600  O O   . VAL A 77  ? 0.31596 0.31419 0.33722 -0.00639 -0.00096 -0.02574 77  VAL A O   
601  C CB  . VAL A 77  ? 0.27762 0.28212 0.29916 -0.00433 -0.00026 -0.02226 77  VAL A CB  
602  C CG1 . VAL A 77  ? 0.27486 0.28113 0.29300 -0.00615 0.00006  -0.01980 77  VAL A CG1 
603  C CG2 . VAL A 77  ? 0.28624 0.29236 0.30954 -0.00267 -0.00023 -0.02174 77  VAL A CG2 
604  N N   . ILE A 78  ? 0.33555 0.32795 0.35307 -0.00728 -0.00235 -0.02055 78  ILE A N   
605  C CA  . ILE A 78  ? 0.34130 0.33176 0.35741 -0.00985 -0.00180 -0.02144 78  ILE A CA  
606  C C   . ILE A 78  ? 0.36258 0.35767 0.37771 -0.01217 -0.00067 -0.02045 78  ILE A C   
607  O O   . ILE A 78  ? 0.34535 0.33996 0.36003 -0.01465 -0.00004 -0.02160 78  ILE A O   
608  C CB  . ILE A 78  ? 0.32716 0.30839 0.34062 -0.01046 -0.00294 -0.02056 78  ILE A CB  
609  C CG1 . ILE A 78  ? 0.33765 0.31581 0.34794 -0.01095 -0.00326 -0.01711 78  ILE A CG1 
610  C CG2 . ILE A 78  ? 0.35167 0.32802 0.36666 -0.00756 -0.00495 -0.02229 78  ILE A CG2 
611  C CD1 . ILE A 78  ? 0.36292 0.33068 0.36817 -0.01267 -0.00397 -0.01589 78  ILE A CD1 
612  N N   . GLY A 79  ? 0.30009 0.29968 0.31527 -0.01138 -0.00054 -0.01877 79  GLY A N   
613  C CA  . GLY A 79  ? 0.29651 0.30099 0.31156 -0.01282 -0.00012 -0.01840 79  GLY A CA  
614  C C   . GLY A 79  ? 0.31222 0.32036 0.32699 -0.01118 -0.00040 -0.01659 79  GLY A C   
615  O O   . GLY A 79  ? 0.27593 0.28245 0.29060 -0.00953 -0.00056 -0.01517 79  GLY A O   
616  N N   . HIS A 80  ? 0.27947 0.29229 0.29410 -0.01153 -0.00077 -0.01692 80  HIS A N   
617  C CA  . HIS A 80  ? 0.31040 0.32566 0.32409 -0.01010 -0.00125 -0.01505 80  HIS A CA  
618  C C   . HIS A 80  ? 0.29980 0.31905 0.31412 -0.01056 -0.00227 -0.01543 80  HIS A C   
619  O O   . HIS A 80  ? 0.31378 0.33510 0.32912 -0.01165 -0.00287 -0.01772 80  HIS A O   
620  C CB  . HIS A 80  ? 0.31375 0.32967 0.32535 -0.00889 -0.00117 -0.01539 80  HIS A CB  
621  C CG  . HIS A 80  ? 0.36460 0.38231 0.37411 -0.00949 -0.00179 -0.01742 80  HIS A CG  
622  N ND1 . HIS A 80  ? 0.32401 0.34093 0.33381 -0.01042 -0.00128 -0.01993 80  HIS A ND1 
623  C CD2 . HIS A 80  ? 0.35385 0.37338 0.36026 -0.00915 -0.00324 -0.01737 80  HIS A CD2 
624  C CE1 . HIS A 80  ? 0.35074 0.36924 0.35760 -0.01084 -0.00220 -0.02134 80  HIS A CE1 
625  N NE2 . HIS A 80  ? 0.34687 0.36658 0.35129 -0.00998 -0.00364 -0.01975 80  HIS A NE2 
626  N N   . SER A 81  ? 0.26125 0.28177 0.27548 -0.00954 -0.00269 -0.01358 81  SER A N   
627  C CA  . SER A 81  ? 0.27015 0.29469 0.28570 -0.00928 -0.00414 -0.01431 81  SER A CA  
628  C C   . SER A 81  ? 0.30440 0.32916 0.31814 -0.00732 -0.00499 -0.01213 81  SER A C   
629  O O   . SER A 81  ? 0.31140 0.33372 0.32392 -0.00678 -0.00389 -0.01004 81  SER A O   
630  C CB  . SER A 81  ? 0.32569 0.35173 0.34489 -0.01124 -0.00312 -0.01538 81  SER A CB  
631  O OG  . SER A 81  ? 0.33052 0.35361 0.34916 -0.01166 -0.00156 -0.01313 81  SER A OG  
632  N N   . MET A 82  ? 0.27811 0.30560 0.29177 -0.00614 -0.00727 -0.01290 82  MET A N   
633  C CA  . MET A 82  ? 0.26015 0.28734 0.27192 -0.00426 -0.00845 -0.01104 82  MET A CA  
634  C C   . MET A 82  ? 0.26548 0.29622 0.28187 -0.00407 -0.00893 -0.01186 82  MET A C   
635  O O   . MET A 82  ? 0.31196 0.34657 0.33205 -0.00432 -0.01027 -0.01476 82  MET A O   
636  C CB  . MET A 82  ? 0.30952 0.33555 0.31639 -0.00272 -0.01124 -0.01126 82  MET A CB  
637  C CG  . MET A 82  ? 0.26990 0.29465 0.27420 -0.00075 -0.01299 -0.00954 82  MET A CG  
638  S SD  . MET A 82  ? 0.33999 0.35991 0.33505 0.00046  -0.01596 -0.00901 82  MET A SD  
639  C CE  . MET A 82  ? 0.39099 0.41408 0.38799 0.00149  -0.02015 -0.01252 82  MET A CE  
640  N N   . GLN A 83  ? 0.24114 0.27097 0.25779 -0.00379 -0.00770 -0.00984 83  GLN A N   
641  C CA  . GLN A 83  ? 0.25415 0.28729 0.27484 -0.00362 -0.00785 -0.01074 83  GLN A CA  
642  C C   . GLN A 83  ? 0.27844 0.31045 0.29680 -0.00118 -0.00949 -0.00891 83  GLN A C   
643  O O   . GLN A 83  ? 0.25404 0.28298 0.26977 -0.00109 -0.00808 -0.00626 83  GLN A O   
644  C CB  . GLN A 83  ? 0.29353 0.32589 0.31595 -0.00599 -0.00469 -0.01018 83  GLN A CB  
645  C CG  . GLN A 83  ? 0.29267 0.32878 0.31926 -0.00648 -0.00415 -0.01175 83  GLN A CG  
646  C CD  . GLN A 83  ? 0.36315 0.39712 0.38946 -0.00935 -0.00084 -0.01101 83  GLN A CD  
647  O OE1 . GLN A 83  ? 0.41009 0.43893 0.43252 -0.01001 0.00027  -0.00852 83  GLN A OE1 
648  N NE2 . GLN A 83  ? 0.39587 0.43347 0.42607 -0.01110 0.00061  -0.01351 83  GLN A NE2 
649  N N   . ASN A 84  ? 0.26722 0.30140 0.28657 0.00090  -0.01274 -0.01056 84  ASN A N   
650  C CA  . ASN A 84  ? 0.26025 0.29200 0.27629 0.00338  -0.01487 -0.00887 84  ASN A CA  
651  C C   . ASN A 84  ? 0.26253 0.28851 0.27110 0.00328  -0.01427 -0.00593 84  ASN A C   
652  O O   . ASN A 84  ? 0.23871 0.26284 0.24360 0.00297  -0.01510 -0.00633 84  ASN A O   
653  C CB  . ASN A 84  ? 0.25134 0.28462 0.27070 0.00335  -0.01329 -0.00832 84  ASN A CB  
654  C CG  . ASN A 84  ? 0.28152 0.32095 0.30847 0.00270  -0.01309 -0.01201 84  ASN A CG  
655  O OD1 . ASN A 84  ? 0.31603 0.35891 0.34633 0.00442  -0.01625 -0.01516 84  ASN A OD1 
656  N ND2 . ASN A 84  ? 0.29097 0.33157 0.32045 0.00004  -0.00942 -0.01204 84  ASN A ND2 
657  N N   . CYS A 85  ? 0.27281 0.29616 0.27927 0.00319  -0.01251 -0.00343 85  CYS A N   
658  C CA  . CYS A 85  ? 0.23095 0.24942 0.23094 0.00272  -0.01155 -0.00142 85  CYS A CA  
659  C C   . CYS A 85  ? 0.25969 0.27793 0.26068 0.00079  -0.00811 -0.00085 85  CYS A C   
660  O O   . CYS A 85  ? 0.24185 0.25715 0.23915 0.00016  -0.00664 0.00022  85  CYS A O   
661  C CB  . CYS A 85  ? 0.24745 0.26267 0.24397 0.00384  -0.01208 0.00050  85  CYS A CB  
662  S SG  . CYS A 85  ? 0.28826 0.30149 0.28177 0.00674  -0.01714 -0.00016 85  CYS A SG  
663  N N   . VAL A 86  ? 0.23175 0.25261 0.23745 -0.00024 -0.00689 -0.00184 86  VAL A N   
664  C CA  . VAL A 86  ? 0.23235 0.25205 0.23867 -0.00149 -0.00457 -0.00158 86  VAL A CA  
665  C C   . VAL A 86  ? 0.26946 0.28983 0.27677 -0.00254 -0.00449 -0.00343 86  VAL A C   
666  O O   . VAL A 86  ? 0.29726 0.31983 0.30623 -0.00270 -0.00575 -0.00497 86  VAL A O   
667  C CB  . VAL A 86  ? 0.26046 0.28025 0.26971 -0.00187 -0.00325 -0.00064 86  VAL A CB  
668  C CG1 . VAL A 86  ? 0.30165 0.32075 0.30990 -0.00093 -0.00318 0.00102  86  VAL A CG1 
669  C CG2 . VAL A 86  ? 0.28970 0.31159 0.30215 -0.00281 -0.00325 -0.00171 86  VAL A CG2 
670  N N   . LEU A 87  ? 0.25676 0.27547 0.26352 -0.00320 -0.00306 -0.00373 87  LEU A N   
671  C CA  . LEU A 87  ? 0.25611 0.27482 0.26426 -0.00422 -0.00268 -0.00548 87  LEU A CA  
672  C C   . LEU A 87  ? 0.26160 0.27890 0.27247 -0.00475 -0.00176 -0.00513 87  LEU A C   
673  O O   . LEU A 87  ? 0.25896 0.27479 0.27008 -0.00412 -0.00128 -0.00385 87  LEU A O   
674  C CB  . LEU A 87  ? 0.25621 0.27368 0.26211 -0.00458 -0.00181 -0.00667 87  LEU A CB  
675  C CG  . LEU A 87  ? 0.31189 0.32883 0.31274 -0.00463 -0.00259 -0.00697 87  LEU A CG  
676  C CD1 . LEU A 87  ? 0.34114 0.35674 0.33965 -0.00573 -0.00081 -0.00858 87  LEU A CD1 
677  C CD2 . LEU A 87  ? 0.31587 0.33431 0.31653 -0.00451 -0.00485 -0.00803 87  LEU A CD2 
678  N N   . LYS A 88  ? 0.28098 0.29809 0.29326 -0.00601 -0.00169 -0.00635 88  LYS A N   
679  C CA  . LYS A 88  ? 0.25059 0.26430 0.26356 -0.00688 -0.00104 -0.00605 88  LYS A CA  
680  C C   . LYS A 88  ? 0.29269 0.30449 0.30583 -0.00726 -0.00094 -0.00781 88  LYS A C   
681  O O   . LYS A 88  ? 0.30506 0.31824 0.31861 -0.00838 -0.00096 -0.00955 88  LYS A O   
682  C CB  . LYS A 88  ? 0.29161 0.30562 0.30532 -0.00876 -0.00051 -0.00617 88  LYS A CB  
683  C CG  . LYS A 88  ? 0.30269 0.31930 0.31694 -0.00828 -0.00055 -0.00508 88  LYS A CG  
684  C CD  . LYS A 88  ? 0.42627 0.44268 0.44120 -0.01059 0.00075  -0.00547 88  LYS A CD  
685  C CE  . LYS A 88  ? 0.43447 0.45340 0.45166 -0.01272 0.00131  -0.00827 88  LYS A CE  
686  N NZ  . LYS A 88  ? 0.42824 0.44999 0.44770 -0.01491 0.00278  -0.00980 88  LYS A NZ  
687  N N   . LEU A 89  ? 0.25752 0.26652 0.27086 -0.00612 -0.00103 -0.00780 89  LEU A N   
688  C CA  . LEU A 89  ? 0.26406 0.27136 0.27825 -0.00600 -0.00104 -0.00994 89  LEU A CA  
689  C C   . LEU A 89  ? 0.28246 0.28397 0.29617 -0.00634 -0.00174 -0.00965 89  LEU A C   
690  O O   . LEU A 89  ? 0.30996 0.30809 0.32341 -0.00496 -0.00275 -0.00861 89  LEU A O   
691  C CB  . LEU A 89  ? 0.28531 0.29379 0.30080 -0.00443 -0.00074 -0.01111 89  LEU A CB  
692  C CG  . LEU A 89  ? 0.29489 0.30715 0.30893 -0.00453 0.00020  -0.01098 89  LEU A CG  
693  C CD1 . LEU A 89  ? 0.27411 0.28732 0.28956 -0.00383 0.00132  -0.01284 89  LEU A CD1 
694  C CD2 . LEU A 89  ? 0.26545 0.27948 0.27730 -0.00580 0.00028  -0.01198 89  LEU A CD2 
695  N N   . LYS A 90  ? 0.26525 0.26503 0.27828 -0.00827 -0.00141 -0.01063 90  LYS A N   
696  C CA  . LYS A 90  ? 0.28432 0.27687 0.29534 -0.00910 -0.00201 -0.01039 90  LYS A CA  
697  C C   . LYS A 90  ? 0.28952 0.27881 0.30187 -0.00701 -0.00336 -0.01213 90  LYS A C   
698  O O   . LYS A 90  ? 0.27494 0.26705 0.28948 -0.00684 -0.00288 -0.01460 90  LYS A O   
699  C CB  . LYS A 90  ? 0.27867 0.27051 0.28872 -0.01228 -0.00081 -0.01144 90  LYS A CB  
700  C CG  . LYS A 90  ? 0.33979 0.32265 0.34616 -0.01395 -0.00105 -0.01109 90  LYS A CG  
701  C CD  . LYS A 90  ? 0.48454 0.46353 0.48695 -0.01603 -0.00027 -0.00882 90  LYS A CD  
702  C CE  . LYS A 90  ? 0.58710 0.56267 0.58693 -0.02049 0.00178  -0.00981 90  LYS A CE  
703  N NZ  . LYS A 90  ? 0.65692 0.62733 0.65588 -0.02091 0.00118  -0.01150 90  LYS A NZ  
704  N N   . VAL A 91  ? 0.29305 0.27631 0.30410 -0.00531 -0.00529 -0.01117 91  VAL A N   
705  C CA  . VAL A 91  ? 0.29545 0.27530 0.30859 -0.00274 -0.00729 -0.01335 91  VAL A CA  
706  C C   . VAL A 91  ? 0.31526 0.28479 0.32402 -0.00335 -0.00909 -0.01278 91  VAL A C   
707  O O   . VAL A 91  ? 0.34943 0.31398 0.35289 -0.00585 -0.00862 -0.01036 91  VAL A O   
708  C CB  . VAL A 91  ? 0.31381 0.29513 0.32980 0.00050  -0.00893 -0.01359 91  VAL A CB  
709  C CG1 . VAL A 91  ? 0.30415 0.29471 0.32376 0.00055  -0.00668 -0.01462 91  VAL A CG1 
710  C CG2 . VAL A 91  ? 0.31407 0.29075 0.32606 0.00069  -0.01037 -0.01037 91  VAL A CG2 
711  N N   . ASP A 92  ? 0.36327 0.32906 0.37388 -0.00129 -0.01104 -0.01532 92  ASP A N   
712  C CA  . ASP A 92  ? 0.38321 0.33789 0.38885 -0.00191 -0.01296 -0.01497 92  ASP A CA  
713  C C   . ASP A 92  ? 0.37267 0.31795 0.37442 0.00074  -0.01702 -0.01336 92  ASP A C   
714  O O   . ASP A 92  ? 0.54859 0.48256 0.54497 0.00073  -0.01945 -0.01296 92  ASP A O   
715  C CB  . ASP A 92  ? 0.42667 0.38082 0.43569 -0.00105 -0.01337 -0.01869 92  ASP A CB  
716  C CG  . ASP A 92  ? 0.46318 0.41698 0.47741 0.00367  -0.01652 -0.02176 92  ASP A CG  
717  O OD1 . ASP A 92  ? 0.51062 0.46807 0.52783 0.00618  -0.01766 -0.02171 92  ASP A OD1 
718  O OD2 . ASP A 92  ? 0.56819 0.51842 0.58417 0.00484  -0.01784 -0.02476 92  ASP A OD2 
719  N N   . THR A 93  ? 0.34748 0.29645 0.35120 0.00295  -0.01805 -0.01246 93  THR A N   
720  C CA  . THR A 93  ? 0.40452 0.34522 0.40466 0.00577  -0.02240 -0.01110 93  THR A CA  
721  C C   . THR A 93  ? 0.37776 0.31991 0.37426 0.00421  -0.02121 -0.00766 93  THR A C   
722  O O   . THR A 93  ? 0.37833 0.33075 0.37976 0.00415  -0.01884 -0.00786 93  THR A O   
723  C CB  . THR A 93  ? 0.38955 0.33387 0.39751 0.01090  -0.02562 -0.01474 93  THR A CB  
724  O OG1 . THR A 93  ? 0.43903 0.38297 0.45126 0.01229  -0.02635 -0.01858 93  THR A OG1 
725  C CG2 . THR A 93  ? 0.38191 0.31707 0.38618 0.01436  -0.03116 -0.01372 93  THR A CG2 
726  N N   . ALA A 94  ? 0.33729 0.26854 0.32453 0.00275  -0.02278 -0.00461 94  ALA A N   
727  C CA  . ALA A 94  ? 0.38498 0.31666 0.36846 0.00160  -0.02211 -0.00170 94  ALA A CA  
728  C C   . ALA A 94  ? 0.32570 0.25880 0.31275 0.00634  -0.02603 -0.00244 94  ALA A C   
729  O O   . ALA A 94  ? 0.33559 0.26239 0.32290 0.01015  -0.03085 -0.00403 94  ALA A O   
730  C CB  . ALA A 94  ? 0.40378 0.32246 0.37520 -0.00186 -0.02238 0.00146  94  ALA A CB  
731  N N   . ASN A 95  ? 0.33408 0.27572 0.32448 0.00626  -0.02415 -0.00175 95  ASN A N   
732  C CA  . ASN A 95  ? 0.35835 0.30193 0.35240 0.01028  -0.02752 -0.00272 95  ASN A CA  
733  C C   . ASN A 95  ? 0.34811 0.27872 0.33304 0.01147  -0.03226 -0.00050 95  ASN A C   
734  O O   . ASN A 95  ? 0.33070 0.25644 0.30741 0.00834  -0.03093 0.00286  95  ASN A O   
735  C CB  . ASN A 95  ? 0.28343 0.23744 0.28148 0.00933  -0.02428 -0.00207 95  ASN A CB  
736  C CG  . ASN A 95  ? 0.31467 0.27174 0.31738 0.01309  -0.02727 -0.00360 95  ASN A CG  
737  O OD1 . ASN A 95  ? 0.32753 0.27946 0.33109 0.01677  -0.03217 -0.00543 95  ASN A OD1 
738  N ND2 . ASN A 95  ? 0.30842 0.27387 0.31447 0.01229  -0.02456 -0.00322 95  ASN A ND2 
739  N N   . PRO A 96  ? 0.37162 0.29593 0.35737 0.01593  -0.03801 -0.00255 96  PRO A N   
740  C CA  . PRO A 96  ? 0.41133 0.32145 0.38680 0.01737  -0.04348 -0.00031 96  PRO A CA  
741  C C   . PRO A 96  ? 0.42985 0.34173 0.40382 0.01810  -0.04459 0.00120  96  PRO A C   
742  O O   . PRO A 96  ? 0.42669 0.32653 0.38982 0.01799  -0.04810 0.00389  96  PRO A O   
743  C CB  . PRO A 96  ? 0.39662 0.30203 0.37620 0.02303  -0.04990 -0.00399 96  PRO A CB  
744  C CG  . PRO A 96  ? 0.39595 0.31674 0.39038 0.02508  -0.04762 -0.00869 96  PRO A CG  
745  C CD  . PRO A 96  ? 0.34992 0.27966 0.34599 0.02000  -0.04005 -0.00741 96  PRO A CD  
746  N N   . LYS A 97  ? 0.37056 0.29628 0.35427 0.01864  -0.04173 -0.00046 97  LYS A N   
747  C CA  . LYS A 97  ? 0.35982 0.28849 0.34311 0.01908  -0.04221 0.00068  97  LYS A CA  
748  C C   . LYS A 97  ? 0.42472 0.35735 0.40426 0.01404  -0.03631 0.00388  97  LYS A C   
749  O O   . LYS A 97  ? 0.38784 0.32537 0.36875 0.01405  -0.03555 0.00447  97  LYS A O   
750  C CB  . LYS A 97  ? 0.41551 0.35642 0.41163 0.02257  -0.04267 -0.00348 97  LYS A CB  
751  C CG  . LYS A 97  ? 0.36459 0.30450 0.36745 0.02791  -0.04830 -0.00808 97  LYS A CG  
752  C CD  . LYS A 97  ? 0.46947 0.42363 0.48578 0.02970  -0.04654 -0.01272 97  LYS A CD  
753  C CE  . LYS A 97  ? 0.56080 0.51618 0.58613 0.03503  -0.05175 -0.01861 97  LYS A CE  
754  N NZ  . LYS A 97  ? 0.71310 0.66376 0.73773 0.03925  -0.05862 -0.01970 97  LYS A NZ  
755  N N   . THR A 98  ? 0.37151 0.30278 0.34726 0.00986  -0.03217 0.00542  98  THR A N   
756  C CA  . THR A 98  ? 0.34696 0.28271 0.32042 0.00536  -0.02683 0.00760  98  THR A CA  
757  C C   . THR A 98  ? 0.37807 0.30618 0.34205 0.00393  -0.02798 0.01037  98  THR A C   
758  O O   . THR A 98  ? 0.41487 0.32972 0.36826 0.00304  -0.03068 0.01209  98  THR A O   
759  C CB  . THR A 98  ? 0.36015 0.29431 0.33057 0.00108  -0.02291 0.00822  98  THR A CB  
760  O OG1 . THR A 98  ? 0.34359 0.28431 0.32209 0.00234  -0.02203 0.00559  98  THR A OG1 
761  C CG2 . THR A 98  ? 0.38964 0.32990 0.35961 -0.00310 -0.01769 0.00946  98  THR A CG2 
762  N N   . PRO A 99  ? 0.34369 0.27873 0.31017 0.00354  -0.02613 0.01086  99  PRO A N   
763  C CA  . PRO A 99  ? 0.39604 0.32427 0.35319 0.00154  -0.02648 0.01333  99  PRO A CA  
764  C C   . PRO A 99  ? 0.39338 0.32024 0.34471 -0.00430 -0.02111 0.01490  99  PRO A C   
765  O O   . PRO A 99  ? 0.35895 0.29202 0.31496 -0.00640 -0.01721 0.01392  99  PRO A O   
766  C CB  . PRO A 99  ? 0.41576 0.35371 0.37989 0.00352  -0.02618 0.01253  99  PRO A CB  
767  C CG  . PRO A 99  ? 0.36766 0.31816 0.34254 0.00357  -0.02243 0.01064  99  PRO A CG  
768  C CD  . PRO A 99  ? 0.33228 0.28090 0.30968 0.00498  -0.02387 0.00903  99  PRO A CD  
769  N N   . LYS A 100 ? 0.38039 0.29916 0.32143 -0.00703 -0.02093 0.01694  100 LYS A N   
770  C CA  . LYS A 100 ? 0.44055 0.36102 0.37821 -0.01266 -0.01510 0.01749  100 LYS A CA  
771  C C   . LYS A 100 ? 0.34644 0.28171 0.29502 -0.01207 -0.01181 0.01610  100 LYS A C   
772  O O   . LYS A 100 ? 0.35560 0.29553 0.30834 -0.00892 -0.01371 0.01596  100 LYS A O   
773  C CB  . LYS A 100 ? 0.45839 0.36770 0.38286 -0.01575 -0.01538 0.01957  100 LYS A CB  
774  C CG  . LYS A 100 ? 0.49310 0.38523 0.40438 -0.01639 -0.01926 0.02132  100 LYS A CG  
775  C CD  . LYS A 100 ? 0.59011 0.47024 0.48712 -0.01891 -0.02041 0.02353  100 LYS A CD  
776  C CE  . LYS A 100 ? 0.53732 0.42001 0.43073 -0.02568 -0.01319 0.02335  100 LYS A CE  
777  N NZ  . LYS A 100 ? 0.74391 0.61344 0.62153 -0.02905 -0.01375 0.02539  100 LYS A NZ  
778  N N   . TYR A 101 ? 0.32843 0.27087 0.28175 -0.01491 -0.00720 0.01482  101 TYR A N   
779  C CA  . TYR A 101 ? 0.39665 0.35220 0.36040 -0.01346 -0.00515 0.01340  101 TYR A CA  
780  C C   . TYR A 101 ? 0.38495 0.34607 0.35071 -0.01754 -0.00017 0.01204  101 TYR A C   
781  O O   . TYR A 101 ? 0.32912 0.28595 0.29059 -0.02147 0.00215  0.01156  101 TYR A O   
782  C CB  . TYR A 101 ? 0.33419 0.29601 0.30658 -0.00971 -0.00684 0.01211  101 TYR A CB  
783  C CG  . TYR A 101 ? 0.34904 0.31223 0.32361 -0.01131 -0.00508 0.01087  101 TYR A CG  
784  C CD1 . TYR A 101 ? 0.35305 0.32539 0.33389 -0.01251 -0.00194 0.00933  101 TYR A CD1 
785  C CD2 . TYR A 101 ? 0.34014 0.29511 0.31043 -0.01139 -0.00699 0.01104  101 TYR A CD2 
786  C CE1 . TYR A 101 ? 0.31985 0.29359 0.30275 -0.01394 -0.00062 0.00790  101 TYR A CE1 
787  C CE2 . TYR A 101 ? 0.35292 0.30907 0.32523 -0.01299 -0.00534 0.00971  101 TYR A CE2 
788  C CZ  . TYR A 101 ? 0.35928 0.32511 0.33799 -0.01434 -0.00210 0.00810  101 TYR A CZ  
789  O OH  . TYR A 101 ? 0.42027 0.38733 0.40098 -0.01588 -0.00076 0.00653  101 TYR A OH  
790  N N   . LYS A 102 ? 0.34948 0.32019 0.32211 -0.01652 0.00132  0.01108  102 LYS A N   
791  C CA  . LYS A 102 ? 0.36778 0.34612 0.34522 -0.01899 0.00513  0.00897  102 LYS A CA  
792  C C   . LYS A 102 ? 0.37166 0.35974 0.35825 -0.01546 0.00438  0.00803  102 LYS A C   
793  O O   . LYS A 102 ? 0.32701 0.31604 0.31540 -0.01205 0.00194  0.00905  102 LYS A O   
794  C CB  . LYS A 102 ? 0.35789 0.33616 0.33222 -0.02203 0.00789  0.00852  102 LYS A CB  
795  C CG  . LYS A 102 ? 0.55178 0.51926 0.51505 -0.02625 0.00909  0.00953  102 LYS A CG  
796  C CD  . LYS A 102 ? 0.57170 0.53830 0.53111 -0.02792 0.01059  0.00968  102 LYS A CD  
797  C CE  . LYS A 102 ? 0.53273 0.51091 0.50135 -0.02771 0.01323  0.00702  102 LYS A CE  
798  N NZ  . LYS A 102 ? 0.61456 0.59598 0.58581 -0.02408 0.01113  0.00801  102 LYS A NZ  
799  N N   . PHE A 103 ? 0.28007 0.27497 0.27208 -0.01648 0.00641  0.00581  103 PHE A N   
800  C CA  . PHE A 103 ? 0.32837 0.33144 0.32745 -0.01365 0.00576  0.00485  103 PHE A CA  
801  C C   . PHE A 103 ? 0.34926 0.35690 0.35071 -0.01463 0.00762  0.00339  103 PHE A C   
802  O O   . PHE A 103 ? 0.36794 0.37666 0.36948 -0.01798 0.01031  0.00128  103 PHE A O   
803  C CB  . PHE A 103 ? 0.27976 0.28707 0.28329 -0.01337 0.00572  0.00307  103 PHE A CB  
804  C CG  . PHE A 103 ? 0.28628 0.29038 0.28877 -0.01194 0.00389  0.00399  103 PHE A CG  
805  C CD1 . PHE A 103 ? 0.29954 0.29906 0.29929 -0.01001 0.00192  0.00589  103 PHE A CD1 
806  C CD2 . PHE A 103 ? 0.31929 0.32546 0.32419 -0.01242 0.00403  0.00241  103 PHE A CD2 
807  C CE1 . PHE A 103 ? 0.31455 0.31179 0.31442 -0.00855 0.00027  0.00595  103 PHE A CE1 
808  C CE2 . PHE A 103 ? 0.27842 0.28187 0.28266 -0.01117 0.00255  0.00283  103 PHE A CE2 
809  C CZ  . PHE A 103 ? 0.28829 0.28739 0.29025 -0.00921 0.00075  0.00448  103 PHE A CZ  
810  N N   . VAL A 104 ? 0.27796 0.28824 0.28146 -0.01197 0.00642  0.00412  104 VAL A N   
811  C CA  . VAL A 104 ? 0.30468 0.31927 0.31092 -0.01236 0.00782  0.00251  104 VAL A CA  
812  C C   . VAL A 104 ? 0.34561 0.36524 0.35688 -0.00886 0.00596  0.00214  104 VAL A C   
813  O O   . VAL A 104 ? 0.31075 0.32919 0.32151 -0.00645 0.00401  0.00391  104 VAL A O   
814  C CB  . VAL A 104 ? 0.36333 0.37408 0.36495 -0.01333 0.00848  0.00379  104 VAL A CB  
815  C CG1 . VAL A 104 ? 0.36414 0.36758 0.35840 -0.01687 0.00979  0.00460  104 VAL A CG1 
816  C CG2 . VAL A 104 ? 0.45541 0.46463 0.45629 -0.01010 0.00592  0.00611  104 VAL A CG2 
817  N N   . ARG A 105 ? 0.29384 0.31876 0.30977 -0.00872 0.00657  -0.00050 105 ARG A N   
818  C CA  . ARG A 105 ? 0.30386 0.33199 0.32324 -0.00537 0.00444  -0.00082 105 ARG A CA  
819  C C   . ARG A 105 ? 0.29872 0.32692 0.31791 -0.00502 0.00504  -0.00073 105 ARG A C   
820  O O   . ARG A 105 ? 0.31764 0.34845 0.33895 -0.00676 0.00699  -0.00323 105 ARG A O   
821  C CB  . ARG A 105 ? 0.30049 0.33405 0.32548 -0.00458 0.00362  -0.00418 105 ARG A CB  
822  C CG  . ARG A 105 ? 0.30107 0.33580 0.32776 -0.00080 0.00048  -0.00410 105 ARG A CG  
823  C CD  . ARG A 105 ? 0.30533 0.34464 0.33705 0.00057  -0.00147 -0.00748 105 ARG A CD  
824  N NE  . ARG A 105 ? 0.27429 0.31296 0.30607 0.00435  -0.00507 -0.00725 105 ARG A NE  
825  C CZ  . ARG A 105 ? 0.32964 0.36446 0.35712 0.00604  -0.00735 -0.00489 105 ARG A CZ  
826  N NH1 . ARG A 105 ? 0.29986 0.33231 0.32396 0.00461  -0.00642 -0.00298 105 ARG A NH1 
827  N NH2 . ARG A 105 ? 0.32207 0.35482 0.34811 0.00909  -0.01059 -0.00464 105 ARG A NH2 
828  N N   . ILE A 106 ? 0.27823 0.30377 0.29508 -0.00310 0.00368  0.00174  106 ILE A N   
829  C CA  . ILE A 106 ? 0.30578 0.33078 0.32191 -0.00295 0.00427  0.00199  106 ILE A CA  
830  C C   . ILE A 106 ? 0.32654 0.35495 0.34682 -0.00072 0.00316  0.00012  106 ILE A C   
831  O O   . ILE A 106 ? 0.36548 0.39511 0.38773 0.00143  0.00106  -0.00041 106 ILE A O   
832  C CB  . ILE A 106 ? 0.34167 0.36266 0.35408 -0.00208 0.00337  0.00483  106 ILE A CB  
833  C CG1 . ILE A 106 ? 0.35505 0.37558 0.36775 0.00013  0.00153  0.00593  106 ILE A CG1 
834  C CG2 . ILE A 106 ? 0.42623 0.44324 0.43444 -0.00397 0.00393  0.00616  106 ILE A CG2 
835  C CD1 . ILE A 106 ? 0.44720 0.46546 0.45811 0.00105  0.00103  0.00749  106 ILE A CD1 
836  N N   . GLN A 107 ? 0.35220 0.38150 0.37327 -0.00115 0.00430  -0.00099 107 GLN A N   
837  C CA  . GLN A 107 ? 0.34193 0.37351 0.36662 0.00123  0.00302  -0.00279 107 GLN A CA  
838  C C   . GLN A 107 ? 0.35488 0.38259 0.37652 0.00330  0.00133  -0.00008 107 GLN A C   
839  O O   . GLN A 107 ? 0.33128 0.35586 0.34909 0.00231  0.00201  0.00233  107 GLN A O   
840  C CB  . GLN A 107 ? 0.37235 0.40659 0.39928 -0.00044 0.00540  -0.00556 107 GLN A CB  
841  C CG  . GLN A 107 ? 0.43359 0.47166 0.46331 -0.00348 0.00806  -0.00891 107 GLN A CG  
842  C CD  . GLN A 107 ? 0.51785 0.56139 0.55465 -0.00165 0.00649  -0.01266 107 GLN A CD  
843  O OE1 . GLN A 107 ? 0.58562 0.63135 0.62667 0.00156  0.00414  -0.01458 107 GLN A OE1 
844  N NE2 . GLN A 107 ? 0.66893 0.71431 0.70695 -0.00351 0.00738  -0.01392 107 GLN A NE2 
845  N N   . PRO A 108 ? 0.31306 0.34050 0.33616 0.00610  -0.00103 -0.00070 108 PRO A N   
846  C CA  . PRO A 108 ? 0.28349 0.30673 0.30330 0.00736  -0.00199 0.00140  108 PRO A CA  
847  C C   . PRO A 108 ? 0.36562 0.38883 0.38514 0.00614  -0.00009 0.00127  108 PRO A C   
848  O O   . PRO A 108 ? 0.32551 0.35194 0.34806 0.00531  0.00128  -0.00123 108 PRO A O   
849  C CB  . PRO A 108 ? 0.40296 0.42535 0.42419 0.01048  -0.00503 0.00005  108 PRO A CB  
850  C CG  . PRO A 108 ? 0.44217 0.47008 0.46939 0.01104  -0.00553 -0.00369 108 PRO A CG  
851  C CD  . PRO A 108 ? 0.37799 0.40824 0.40531 0.00829  -0.00332 -0.00346 108 PRO A CD  
852  N N   . GLY A 109 ? 0.28686 0.30659 0.30279 0.00577  0.00014  0.00359  109 GLY A N   
853  C CA  . GLY A 109 ? 0.34003 0.35932 0.35496 0.00450  0.00164  0.00371  109 GLY A CA  
854  C C   . GLY A 109 ? 0.35583 0.37461 0.36836 0.00233  0.00286  0.00486  109 GLY A C   
855  O O   . GLY A 109 ? 0.38042 0.39771 0.39100 0.00157  0.00331  0.00547  109 GLY A O   
856  N N   . GLN A 110 ? 0.30758 0.32706 0.31994 0.00144  0.00305  0.00504  110 GLN A N   
857  C CA  . GLN A 110 ? 0.29601 0.31358 0.30529 -0.00025 0.00351  0.00624  110 GLN A CA  
858  C C   . GLN A 110 ? 0.31357 0.32915 0.32170 0.00062  0.00222  0.00794  110 GLN A C   
859  O O   . GLN A 110 ? 0.31657 0.33229 0.32572 0.00183  0.00155  0.00825  110 GLN A O   
860  C CB  . GLN A 110 ? 0.32505 0.34345 0.33430 -0.00181 0.00437  0.00553  110 GLN A CB  
861  C CG  . GLN A 110 ? 0.42602 0.44672 0.43646 -0.00367 0.00646  0.00309  110 GLN A CG  
862  C CD  . GLN A 110 ? 0.56188 0.58037 0.56867 -0.00544 0.00773  0.00311  110 GLN A CD  
863  O OE1 . GLN A 110 ? 0.55190 0.56622 0.55344 -0.00703 0.00771  0.00460  110 GLN A OE1 
864  N NE2 . GLN A 110 ? 0.51289 0.53363 0.52205 -0.00502 0.00850  0.00132  110 GLN A NE2 
865  N N   . THR A 111 ? 0.34540 0.35881 0.35112 -0.00010 0.00179  0.00870  111 THR A N   
866  C CA  . THR A 111 ? 0.31210 0.32447 0.31794 0.00073  0.00058  0.00933  111 THR A CA  
867  C C   . THR A 111 ? 0.26703 0.27781 0.27167 0.00047  -0.00033 0.00975  111 THR A C   
868  O O   . THR A 111 ? 0.30179 0.31095 0.30401 -0.00075 -0.00004 0.00995  111 THR A O   
869  C CB  . THR A 111 ? 0.24579 0.25711 0.25082 0.00083  -0.00006 0.00916  111 THR A CB  
870  O OG1 . THR A 111 ? 0.31042 0.31932 0.31187 -0.00021 -0.00047 0.00938  111 THR A OG1 
871  C CG2 . THR A 111 ? 0.27653 0.28894 0.28273 0.00107  0.00087  0.00865  111 THR A CG2 
872  N N   . PHE A 112 ? 0.30517 0.31612 0.31139 0.00140  -0.00125 0.00957  112 PHE A N   
873  C CA  . PHE A 112 ? 0.31488 0.32420 0.32061 0.00163  -0.00251 0.00959  112 PHE A CA  
874  C C   . PHE A 112 ? 0.27588 0.28624 0.28452 0.00278  -0.00352 0.00839  112 PHE A C   
875  O O   . PHE A 112 ? 0.30487 0.31729 0.31561 0.00282  -0.00256 0.00764  112 PHE A O   
876  C CB  . PHE A 112 ? 0.33010 0.34018 0.33618 0.00116  -0.00168 0.00974  112 PHE A CB  
877  C CG  . PHE A 112 ? 0.34219 0.35483 0.35044 0.00159  -0.00073 0.00940  112 PHE A CG  
878  C CD1 . PHE A 112 ? 0.31335 0.32658 0.32305 0.00201  -0.00079 0.00873  112 PHE A CD1 
879  C CD2 . PHE A 112 ? 0.39449 0.40839 0.40285 0.00153  0.00008  0.00947  112 PHE A CD2 
880  C CE1 . PHE A 112 ? 0.32707 0.34115 0.33680 0.00192  0.00014  0.00858  112 PHE A CE1 
881  C CE2 . PHE A 112 ? 0.36770 0.38219 0.37639 0.00207  0.00027  0.00937  112 PHE A CE2 
882  C CZ  . PHE A 112 ? 0.39440 0.40850 0.40301 0.00204  0.00040  0.00915  112 PHE A CZ  
883  N N   . SER A 113 ? 0.25975 0.26846 0.26858 0.00357  -0.00539 0.00784  113 SER A N   
884  C CA  . SER A 113 ? 0.25766 0.26822 0.27063 0.00475  -0.00637 0.00572  113 SER A CA  
885  C C   . SER A 113 ? 0.29416 0.30638 0.30911 0.00452  -0.00513 0.00500  113 SER A C   
886  O O   . SER A 113 ? 0.28065 0.29120 0.29364 0.00420  -0.00518 0.00600  113 SER A O   
887  C CB  . SER A 113 ? 0.27769 0.28527 0.29023 0.00636  -0.00993 0.00489  113 SER A CB  
888  O OG  . SER A 113 ? 0.30412 0.30978 0.31419 0.00656  -0.01138 0.00535  113 SER A OG  
889  N N   . VAL A 114 ? 0.27896 0.29431 0.29751 0.00430  -0.00378 0.00299  114 VAL A N   
890  C CA  . VAL A 114 ? 0.24174 0.25857 0.26185 0.00378  -0.00238 0.00178  114 VAL A CA  
891  C C   . VAL A 114 ? 0.25993 0.27843 0.28492 0.00499  -0.00376 -0.00148 114 VAL A C   
892  O O   . VAL A 114 ? 0.26606 0.28666 0.29466 0.00547  -0.00428 -0.00377 114 VAL A O   
893  C CB  . VAL A 114 ? 0.27655 0.29478 0.29597 0.00204  0.00062  0.00155  114 VAL A CB  
894  C CG1 . VAL A 114 ? 0.25669 0.27627 0.27739 0.00110  0.00227  -0.00041 114 VAL A CG1 
895  C CG2 . VAL A 114 ? 0.31722 0.33358 0.33232 0.00154  0.00117  0.00432  114 VAL A CG2 
896  N N   . LEU A 115 ? 0.26613 0.28397 0.29180 0.00558  -0.00449 -0.00215 115 LEU A N   
897  C CA  . LEU A 115 ? 0.24617 0.26623 0.27745 0.00681  -0.00554 -0.00602 115 LEU A CA  
898  C C   . LEU A 115 ? 0.24841 0.27146 0.28116 0.00487  -0.00201 -0.00788 115 LEU A C   
899  O O   . LEU A 115 ? 0.25010 0.27195 0.28078 0.00440  -0.00140 -0.00705 115 LEU A O   
900  C CB  . LEU A 115 ? 0.27952 0.29592 0.31025 0.00890  -0.00906 -0.00587 115 LEU A CB  
901  C CG  . LEU A 115 ? 0.25918 0.27768 0.29641 0.01085  -0.01087 -0.01037 115 LEU A CG  
902  C CD1 . LEU A 115 ? 0.28967 0.31038 0.33189 0.01270  -0.01331 -0.01340 115 LEU A CD1 
903  C CD2 . LEU A 115 ? 0.25133 0.26473 0.28653 0.01266  -0.01414 -0.00970 115 LEU A CD2 
904  N N   . ALA A 116 ? 0.27785 0.30435 0.31350 0.00335  0.00053  -0.01050 116 ALA A N   
905  C CA  . ALA A 116 ? 0.27121 0.29954 0.30668 0.00072  0.00443  -0.01239 116 ALA A CA  
906  C C   . ALA A 116 ? 0.27236 0.30359 0.31365 0.00145  0.00425  -0.01676 116 ALA A C   
907  O O   . ALA A 116 ? 0.30552 0.33994 0.35376 0.00307  0.00263  -0.02068 116 ALA A O   
908  C CB  . ALA A 116 ? 0.27768 0.30787 0.31357 -0.00182 0.00764  -0.01405 116 ALA A CB  
909  N N   . CYS A 117 ? 0.24402 0.27426 0.28288 0.00051  0.00557  -0.01647 117 CYS A N   
910  C CA  . CYS A 117 ? 0.22606 0.25870 0.27012 0.00125  0.00542  -0.02059 117 CYS A CA  
911  C C   . CYS A 117 ? 0.25820 0.29238 0.30069 -0.00222 0.01007  -0.02286 117 CYS A C   
912  O O   . CYS A 117 ? 0.25238 0.28380 0.28760 -0.00471 0.01240  -0.01996 117 CYS A O   
913  C CB  . CYS A 117 ? 0.28278 0.31194 0.32518 0.00357  0.00211  -0.01842 117 CYS A CB  
914  S SG  . CYS A 117 ? 0.32824 0.35362 0.37039 0.00705  -0.00324 -0.01590 117 CYS A SG  
915  N N   . TYR A 118 ? 0.25487 0.29311 0.30403 -0.00229 0.01117  -0.02840 118 TYR A N   
916  C CA  . TYR A 118 ? 0.25292 0.29245 0.30059 -0.00571 0.01563  -0.03126 118 TYR A CA  
917  C C   . TYR A 118 ? 0.27662 0.31824 0.33024 -0.00367 0.01412  -0.03498 118 TYR A C   
918  O O   . TYR A 118 ? 0.25189 0.29637 0.31386 -0.00052 0.01109  -0.03840 118 TYR A O   
919  C CB  . TYR A 118 ? 0.25371 0.29711 0.30398 -0.00941 0.02044  -0.03586 118 TYR A CB  
920  C CG  . TYR A 118 ? 0.23863 0.27881 0.28230 -0.01138 0.02171  -0.03196 118 TYR A CG  
921  C CD1 . TYR A 118 ? 0.26858 0.30354 0.30164 -0.01470 0.02448  -0.02853 118 TYR A CD1 
922  C CD2 . TYR A 118 ? 0.30325 0.34479 0.35067 -0.00954 0.01949  -0.03152 118 TYR A CD2 
923  C CE1 . TYR A 118 ? 0.21779 0.24894 0.24463 -0.01603 0.02505  -0.02496 118 TYR A CE1 
924  C CE2 . TYR A 118 ? 0.27732 0.31564 0.31879 -0.01116 0.02049  -0.02801 118 TYR A CE2 
925  C CZ  . TYR A 118 ? 0.25688 0.28995 0.28824 -0.01433 0.02326  -0.02478 118 TYR A CZ  
926  O OH  . TYR A 118 ? 0.28294 0.31213 0.30836 -0.01558 0.02380  -0.02144 118 TYR A OH  
927  N N   . ASN A 119 ? 0.25044 0.29005 0.29946 -0.00512 0.01562  -0.03424 119 ASN A N   
928  C CA  . ASN A 119 ? 0.28731 0.32839 0.34132 -0.00346 0.01447  -0.03778 119 ASN A CA  
929  C C   . ASN A 119 ? 0.28230 0.32124 0.33983 0.00137  0.00856  -0.03631 119 ASN A C   
930  O O   . ASN A 119 ? 0.27020 0.31105 0.33515 0.00399  0.00635  -0.04066 119 ASN A O   
931  C CB  . ASN A 119 ? 0.34007 0.38758 0.40268 -0.00487 0.01771  -0.04576 119 ASN A CB  
932  C CG  . ASN A 119 ? 0.38163 0.43012 0.43932 -0.01054 0.02419  -0.04747 119 ASN A CG  
933  O OD1 . ASN A 119 ? 0.47152 0.52235 0.53054 -0.01281 0.02690  -0.04931 119 ASN A OD1 
934  N ND2 . ASN A 119 ? 0.41066 0.45666 0.46185 -0.01310 0.02669  -0.04689 119 ASN A ND2 
935  N N   . GLY A 120 ? 0.25035 0.28476 0.30220 0.00250  0.00592  -0.03039 120 GLY A N   
936  C CA  . GLY A 120 ? 0.29281 0.32338 0.34531 0.00619  0.00076  -0.02834 120 GLY A CA  
937  C C   . GLY A 120 ? 0.32588 0.35749 0.38412 0.00917  -0.00267 -0.03031 120 GLY A C   
938  O O   . GLY A 120 ? 0.36401 0.39113 0.42179 0.01230  -0.00741 -0.02880 120 GLY A O   
939  N N   . SER A 121 ? 0.27775 0.31455 0.34075 0.00811  -0.00054 -0.03370 121 SER A N   
940  C CA  . SER A 121 ? 0.31486 0.35364 0.38430 0.01098  -0.00393 -0.03646 121 SER A CA  
941  C C   . SER A 121 ? 0.29987 0.33899 0.36628 0.00947  -0.00275 -0.03370 121 SER A C   
942  O O   . SER A 121 ? 0.29808 0.33887 0.36129 0.00568  0.00205  -0.03293 121 SER A O   
943  C CB  . SER A 121 ? 0.31764 0.36370 0.39808 0.01133  -0.00269 -0.04473 121 SER A CB  
944  O OG  . SER A 121 ? 0.43842 0.48392 0.52262 0.01357  -0.00472 -0.04774 121 SER A OG  
945  N N   . PRO A 122 ? 0.37257 0.40940 0.43924 0.01230  -0.00719 -0.03226 122 PRO A N   
946  C CA  . PRO A 122 ? 0.33818 0.37486 0.40155 0.01096  -0.00628 -0.02941 122 PRO A CA  
947  C C   . PRO A 122 ? 0.37108 0.41457 0.44136 0.00929  -0.00340 -0.03452 122 PRO A C   
948  O O   . PRO A 122 ? 0.38853 0.43694 0.46818 0.01100  -0.00472 -0.04079 122 PRO A O   
949  C CB  . PRO A 122 ? 0.38668 0.41845 0.44827 0.01462  -0.01227 -0.02710 122 PRO A CB  
950  C CG  . PRO A 122 ? 0.53204 0.55925 0.59278 0.01718  -0.01585 -0.02691 122 PRO A CG  
951  C CD  . PRO A 122 ? 0.45988 0.49238 0.52780 0.01675  -0.01354 -0.03239 122 PRO A CD  
952  N N   . SER A 123 ? 0.26837 0.31199 0.33407 0.00586  0.00055  -0.03214 123 SER A N   
953  C CA  . SER A 123 ? 0.31921 0.36799 0.38968 0.00358  0.00361  -0.03614 123 SER A CA  
954  C C   . SER A 123 ? 0.35793 0.40580 0.42803 0.00501  0.00084  -0.03437 123 SER A C   
955  O O   . SER A 123 ? 0.34403 0.39694 0.42140 0.00504  0.00085  -0.03920 123 SER A O   
956  C CB  . SER A 123 ? 0.32478 0.37305 0.38939 -0.00158 0.00996  -0.03496 123 SER A CB  
957  O OG  . SER A 123 ? 0.43431 0.48633 0.50203 -0.00455 0.01345  -0.03844 123 SER A OG  
958  N N   . GLY A 124 ? 0.29069 0.33265 0.35291 0.00604  -0.00140 -0.02808 124 GLY A N   
959  C CA  . GLY A 124 ? 0.24197 0.28264 0.30299 0.00718  -0.00386 -0.02631 124 GLY A CA  
960  C C   . GLY A 124 ? 0.30784 0.34213 0.35951 0.00736  -0.00496 -0.01957 124 GLY A C   
961  O O   . GLY A 124 ? 0.27638 0.30777 0.32295 0.00644  -0.00364 -0.01644 124 GLY A O   
962  N N   . VAL A 125 ? 0.25592 0.28840 0.30574 0.00846  -0.00738 -0.01783 125 VAL A N   
963  C CA  . VAL A 125 ? 0.27045 0.29744 0.31216 0.00848  -0.00833 -0.01228 125 VAL A CA  
964  C C   . VAL A 125 ? 0.31932 0.34673 0.35916 0.00695  -0.00670 -0.01107 125 VAL A C   
965  O O   . VAL A 125 ? 0.28722 0.31775 0.33167 0.00720  -0.00727 -0.01419 125 VAL A O   
966  C CB  . VAL A 125 ? 0.28920 0.31141 0.32851 0.01152  -0.01361 -0.01096 125 VAL A CB  
967  C CG1 . VAL A 125 ? 0.38045 0.40365 0.42361 0.01380  -0.01749 -0.01384 125 VAL A CG1 
968  C CG2 . VAL A 125 ? 0.32537 0.34208 0.35617 0.01070  -0.01362 -0.00577 125 VAL A CG2 
969  N N   . TYR A 126 ? 0.24825 0.27282 0.28190 0.00540  -0.00469 -0.00701 126 TYR A N   
970  C CA  . TYR A 126 ? 0.28083 0.30506 0.31224 0.00412  -0.00328 -0.00569 126 TYR A CA  
971  C C   . TYR A 126 ? 0.28812 0.30844 0.31309 0.00392  -0.00323 -0.00135 126 TYR A C   
972  O O   . TYR A 126 ? 0.27769 0.29625 0.30016 0.00405  -0.00329 0.00041  126 TYR A O   
973  C CB  . TYR A 126 ? 0.28397 0.31043 0.31655 0.00138  0.00089  -0.00729 126 TYR A CB  
974  C CG  . TYR A 126 ? 0.26705 0.29237 0.29670 -0.00022 0.00356  -0.00623 126 TYR A CG  
975  C CD1 . TYR A 126 ? 0.31436 0.33616 0.33793 -0.00090 0.00448  -0.00257 126 TYR A CD1 
976  C CD2 . TYR A 126 ? 0.34432 0.37217 0.37744 -0.00095 0.00492  -0.00932 126 TYR A CD2 
977  C CE1 . TYR A 126 ? 0.30178 0.32207 0.32215 -0.00210 0.00623  -0.00172 126 TYR A CE1 
978  C CE2 . TYR A 126 ? 0.36464 0.39096 0.39420 -0.00257 0.00725  -0.00840 126 TYR A CE2 
979  C CZ  . TYR A 126 ? 0.30690 0.32919 0.32976 -0.00307 0.00768  -0.00447 126 TYR A CZ  
980  O OH  . TYR A 126 ? 0.35162 0.37197 0.37049 -0.00443 0.00935  -0.00370 126 TYR A OH  
981  N N   . GLN A 127 ? 0.29798 0.31741 0.32090 0.00350  -0.00303 -0.00018 127 GLN A N   
982  C CA  . GLN A 127 ? 0.30082 0.31745 0.31881 0.00325  -0.00284 0.00298  127 GLN A CA  
983  C C   . GLN A 127 ? 0.33888 0.35536 0.35514 0.00186  -0.00005 0.00405  127 GLN A C   
984  O O   . GLN A 127 ? 0.39351 0.41080 0.41081 0.00071  0.00172  0.00285  127 GLN A O   
985  C CB  . GLN A 127 ? 0.37228 0.38771 0.38876 0.00364  -0.00431 0.00332  127 GLN A CB  
986  C CG  . GLN A 127 ? 0.42520 0.43796 0.43697 0.00326  -0.00421 0.00577  127 GLN A CG  
987  C CD  . GLN A 127 ? 0.39260 0.40228 0.40129 0.00373  -0.00619 0.00677  127 GLN A CD  
988  O OE1 . GLN A 127 ? 0.40083 0.41004 0.41086 0.00471  -0.00785 0.00598  127 GLN A OE1 
989  N NE2 . GLN A 127 ? 0.42671 0.43390 0.43102 0.00278  -0.00584 0.00824  127 GLN A NE2 
990  N N   . CYS A 128 ? 0.30193 0.31694 0.31531 0.00190  0.00016  0.00607  128 CYS A N   
991  C CA  . CYS A 128 ? 0.31519 0.32922 0.32644 0.00130  0.00166  0.00710  128 CYS A CA  
992  C C   . CYS A 128 ? 0.34103 0.35430 0.35056 0.00177  0.00120  0.00842  128 CYS A C   
993  O O   . CYS A 128 ? 0.31491 0.32820 0.32412 0.00195  0.00033  0.00870  128 CYS A O   
994  C CB  . CYS A 128 ? 0.29842 0.31221 0.30887 0.00105  0.00219  0.00727  128 CYS A CB  
995  S SG  . CYS A 128 ? 0.47294 0.48723 0.48433 -0.00042 0.00407  0.00531  128 CYS A SG  
996  N N   . ALA A 129 ? 0.34498 0.35718 0.35309 0.00186  0.00176  0.00892  129 ALA A N   
997  C CA  . ALA A 129 ? 0.33183 0.34421 0.33960 0.00251  0.00133  0.00928  129 ALA A CA  
998  C C   . ALA A 129 ? 0.31348 0.32517 0.32032 0.00320  0.00083  0.00955  129 ALA A C   
999  O O   . ALA A 129 ? 0.33592 0.34530 0.34061 0.00306  0.00096  0.00988  129 ALA A O   
1000 C CB  . ALA A 129 ? 0.34217 0.35383 0.34976 0.00270  0.00159  0.00900  129 ALA A CB  
1001 N N   . MET A 130 ? 0.29049 0.30392 0.29860 0.00368  0.00028  0.00914  130 MET A N   
1002 C CA  . MET A 130 ? 0.28164 0.29482 0.28957 0.00487  -0.00093 0.00880  130 MET A CA  
1003 C C   . MET A 130 ? 0.31929 0.33086 0.32686 0.00618  -0.00179 0.00839  130 MET A C   
1004 O O   . MET A 130 ? 0.37293 0.38655 0.38300 0.00650  -0.00159 0.00720  130 MET A O   
1005 C CB  . MET A 130 ? 0.31897 0.33537 0.32954 0.00478  -0.00109 0.00764  130 MET A CB  
1006 C CG  . MET A 130 ? 0.32341 0.34052 0.33495 0.00631  -0.00289 0.00656  130 MET A CG  
1007 S SD  . MET A 130 ? 0.31474 0.32838 0.32220 0.00672  -0.00413 0.00783  130 MET A SD  
1008 C CE  . MET A 130 ? 0.31600 0.33104 0.32386 0.00476  -0.00240 0.00832  130 MET A CE  
1009 N N   . ARG A 131 ? 0.31001 0.31729 0.31393 0.00672  -0.00262 0.00923  131 ARG A N   
1010 C CA  . ARG A 131 ? 0.28943 0.29347 0.29190 0.00804  -0.00377 0.00904  131 ARG A CA  
1011 C C   . ARG A 131 ? 0.30730 0.31274 0.31236 0.01051  -0.00628 0.00739  131 ARG A C   
1012 O O   . ARG A 131 ? 0.28741 0.29532 0.29418 0.01107  -0.00729 0.00662  131 ARG A O   
1013 C CB  . ARG A 131 ? 0.35478 0.35218 0.35095 0.00756  -0.00408 0.01045  131 ARG A CB  
1014 C CG  . ARG A 131 ? 0.42075 0.41730 0.41501 0.00485  -0.00139 0.01116  131 ARG A CG  
1015 C CD  . ARG A 131 ? 0.33071 0.32883 0.32727 0.00382  0.00031  0.01069  131 ARG A CD  
1016 N NE  . ARG A 131 ? 0.30302 0.29788 0.29826 0.00477  -0.00048 0.01059  131 ARG A NE  
1017 C CZ  . ARG A 131 ? 0.38425 0.38055 0.38171 0.00432  0.00053  0.00992  131 ARG A CZ  
1018 N NH1 . ARG A 131 ? 0.28360 0.28397 0.28410 0.00302  0.00202  0.00939  131 ARG A NH1 
1019 N NH2 . ARG A 131 ? 0.35238 0.34561 0.34883 0.00541  -0.00035 0.00960  131 ARG A NH2 
1020 N N   . PRO A 132 ? 0.30518 0.30937 0.31118 0.01212  -0.00744 0.00634  132 PRO A N   
1021 C CA  . PRO A 132 ? 0.29974 0.30546 0.30915 0.01501  -0.01039 0.00394  132 PRO A CA  
1022 C C   . PRO A 132 ? 0.36485 0.36640 0.37055 0.01694  -0.01385 0.00440  132 PRO A C   
1023 O O   . PRO A 132 ? 0.30962 0.31428 0.31935 0.01914  -0.01641 0.00199  132 PRO A O   
1024 C CB  . PRO A 132 ? 0.31281 0.31622 0.32271 0.01643  -0.01114 0.00297  132 PRO A CB  
1025 C CG  . PRO A 132 ? 0.34927 0.35382 0.35895 0.01368  -0.00755 0.00399  132 PRO A CG  
1026 C CD  . PRO A 132 ? 0.35767 0.36043 0.36324 0.01138  -0.00599 0.00653  132 PRO A CD  
1027 N N   . ASN A 133 ? 0.32083 0.31540 0.31882 0.01599  -0.01400 0.00707  133 ASN A N   
1028 C CA  . ASN A 133 ? 0.29533 0.28500 0.28808 0.01730  -0.01714 0.00774  133 ASN A CA  
1029 C C   . ASN A 133 ? 0.31269 0.30578 0.30581 0.01552  -0.01570 0.00818  133 ASN A C   
1030 O O   . ASN A 133 ? 0.34077 0.32948 0.32844 0.01585  -0.01765 0.00900  133 ASN A O   
1031 C CB  . ASN A 133 ? 0.36112 0.34016 0.34371 0.01663  -0.01783 0.01019  133 ASN A CB  
1032 C CG  . ASN A 133 ? 0.33797 0.31586 0.31721 0.01253  -0.01324 0.01205  133 ASN A CG  
1033 O OD1 . ASN A 133 ? 0.35856 0.34302 0.34254 0.01069  -0.01031 0.01174  133 ASN A OD1 
1034 N ND2 . ASN A 133 ? 0.36494 0.33404 0.33585 0.01103  -0.01273 0.01367  133 ASN A ND2 
1035 N N   . PHE A 134 ? 0.27925 0.27913 0.27781 0.01358  -0.01247 0.00767  134 PHE A N   
1036 C CA  . PHE A 134 ? 0.28685 0.29048 0.28695 0.01209  -0.01117 0.00764  134 PHE A CA  
1037 C C   . PHE A 134 ? 0.32428 0.32411 0.31870 0.00985  -0.00942 0.00963  134 PHE A C   
1038 O O   . PHE A 134 ? 0.34410 0.34533 0.33832 0.00907  -0.00916 0.00956  134 PHE A O   
1039 C CB  . PHE A 134 ? 0.29160 0.29733 0.29385 0.01407  -0.01422 0.00580  134 PHE A CB  
1040 C CG  . PHE A 134 ? 0.29655 0.30831 0.30648 0.01559  -0.01506 0.00269  134 PHE A CG  
1041 C CD1 . PHE A 134 ? 0.35148 0.36962 0.36695 0.01363  -0.01215 0.00134  134 PHE A CD1 
1042 C CD2 . PHE A 134 ? 0.35705 0.36764 0.36839 0.01883  -0.01871 0.00077  134 PHE A CD2 
1043 C CE1 . PHE A 134 ? 0.42584 0.44965 0.44820 0.01423  -0.01212 -0.00208 134 PHE A CE1 
1044 C CE2 . PHE A 134 ? 0.42568 0.44282 0.44528 0.02005  -0.01910 -0.00303 134 PHE A CE2 
1045 C CZ  . PHE A 134 ? 0.39073 0.41475 0.41586 0.01741  -0.01540 -0.00456 134 PHE A CZ  
1046 N N   . THR A 135 ? 0.33112 0.32637 0.32123 0.00857  -0.00799 0.01096  135 THR A N   
1047 C CA  . THR A 135 ? 0.28580 0.27929 0.27257 0.00578  -0.00521 0.01186  135 THR A CA  
1048 C C   . THR A 135 ? 0.30191 0.30003 0.29366 0.00437  -0.00247 0.01144  135 THR A C   
1049 O O   . THR A 135 ? 0.28487 0.28609 0.28082 0.00525  -0.00263 0.01092  135 THR A O   
1050 C CB  . THR A 135 ? 0.29888 0.28415 0.27742 0.00458  -0.00493 0.01304  135 THR A CB  
1051 O OG1 . THR A 135 ? 0.34942 0.33329 0.32855 0.00472  -0.00444 0.01316  135 THR A OG1 
1052 C CG2 . THR A 135 ? 0.32137 0.30024 0.29340 0.00641  -0.00862 0.01365  135 THR A CG2 
1053 N N   . ILE A 136 ? 0.32070 0.31919 0.31192 0.00219  -0.00012 0.01130  136 ILE A N   
1054 C CA  . ILE A 136 ? 0.28946 0.29105 0.28450 0.00103  0.00189  0.01061  136 ILE A CA  
1055 C C   . ILE A 136 ? 0.31198 0.31046 0.30372 -0.00141 0.00425  0.01018  136 ILE A C   
1056 O O   . ILE A 136 ? 0.32064 0.31546 0.30741 -0.00280 0.00500  0.01029  136 ILE A O   
1057 C CB  . ILE A 136 ? 0.26504 0.27144 0.26475 0.00098  0.00220  0.00981  136 ILE A CB  
1058 C CG1 . ILE A 136 ? 0.29924 0.30543 0.29780 -0.00035 0.00335  0.00907  136 ILE A CG1 
1059 C CG2 . ILE A 136 ? 0.33698 0.34575 0.33894 0.00250  0.00051  0.00999  136 ILE A CG2 
1060 C CD1 . ILE A 136 ? 0.33749 0.34754 0.34063 -0.00026 0.00348  0.00797  136 ILE A CD1 
1061 N N   . LYS A 137 ? 0.30892 0.30876 0.30316 -0.00225 0.00559  0.00938  137 LYS A N   
1062 C CA  . LYS A 137 ? 0.34043 0.33839 0.33285 -0.00508 0.00839  0.00813  137 LYS A CA  
1063 C C   . LYS A 137 ? 0.34722 0.35077 0.34554 -0.00583 0.00964  0.00582  137 LYS A C   
1064 O O   . LYS A 137 ? 0.37756 0.38471 0.38084 -0.00545 0.00954  0.00455  137 LYS A O   
1065 C CB  . LYS A 137 ? 0.43331 0.42924 0.42510 -0.00556 0.00892  0.00816  137 LYS A CB  
1066 C CG  . LYS A 137 ? 0.42850 0.41925 0.41570 -0.00390 0.00683  0.01010  137 LYS A CG  
1067 C CD  . LYS A 137 ? 0.47172 0.45972 0.45788 -0.00465 0.00760  0.00992  137 LYS A CD  
1068 C CE  . LYS A 137 ? 0.72971 0.71050 0.70863 -0.00785 0.00991  0.00992  137 LYS A CE  
1069 N NZ  . LYS A 137 ? 0.83544 0.80751 0.80658 -0.00670 0.00773  0.01191  137 LYS A NZ  
1070 N N   . GLY A 138 ? 0.31441 0.31850 0.31217 -0.00662 0.01040  0.00507  138 GLY A N   
1071 C CA  . GLY A 138 ? 0.32395 0.33310 0.32761 -0.00682 0.01106  0.00252  138 GLY A CA  
1072 C C   . GLY A 138 ? 0.33438 0.34399 0.33835 -0.01009 0.01461  -0.00057 138 GLY A C   
1073 O O   . GLY A 138 ? 0.34184 0.34779 0.34155 -0.01266 0.01693  -0.00075 138 GLY A O   
1074 N N   . SER A 139 ? 0.29020 0.30425 0.29942 -0.01015 0.01515  -0.00340 139 SER A N   
1075 C CA  . SER A 139 ? 0.30169 0.31760 0.31269 -0.01342 0.01889  -0.00744 139 SER A CA  
1076 C C   . SER A 139 ? 0.29255 0.31013 0.30470 -0.01314 0.01893  -0.00866 139 SER A C   
1077 O O   . SER A 139 ? 0.27439 0.29642 0.29326 -0.01071 0.01682  -0.01021 139 SER A O   
1078 C CB  . SER A 139 ? 0.28692 0.30853 0.30644 -0.01340 0.01927  -0.01141 139 SER A CB  
1079 O OG  . SER A 139 ? 0.28562 0.31001 0.30801 -0.01684 0.02330  -0.01625 139 SER A OG  
1080 N N   . PHE A 140 ? 0.29189 0.30507 0.29670 -0.01553 0.02098  -0.00785 140 PHE A N   
1081 C CA  . PHE A 140 ? 0.27946 0.29331 0.28389 -0.01531 0.02088  -0.00849 140 PHE A CA  
1082 C C   . PHE A 140 ? 0.28527 0.29633 0.28410 -0.01988 0.02538  -0.01076 140 PHE A C   
1083 O O   . PHE A 140 ? 0.29948 0.30423 0.28967 -0.02269 0.02728  -0.00923 140 PHE A O   
1084 C CB  . PHE A 140 ? 0.24915 0.25939 0.24853 -0.01287 0.01753  -0.00421 140 PHE A CB  
1085 C CG  . PHE A 140 ? 0.25505 0.26772 0.25910 -0.00904 0.01369  -0.00227 140 PHE A CG  
1086 C CD1 . PHE A 140 ? 0.27268 0.28960 0.28339 -0.00704 0.01209  -0.00377 140 PHE A CD1 
1087 C CD2 . PHE A 140 ? 0.28282 0.29271 0.28379 -0.00761 0.01168  0.00096  140 PHE A CD2 
1088 C CE1 . PHE A 140 ? 0.31211 0.32972 0.32513 -0.00424 0.00889  -0.00183 140 PHE A CE1 
1089 C CE2 . PHE A 140 ? 0.29430 0.30617 0.29880 -0.00484 0.00883  0.00240  140 PHE A CE2 
1090 C CZ  . PHE A 140 ? 0.32983 0.34512 0.33968 -0.00341 0.00758  0.00117  140 PHE A CZ  
1091 N N   . LEU A 141 ? 0.26674 0.28178 0.26982 -0.02073 0.02702  -0.01445 141 LEU A N   
1092 C CA  . LEU A 141 ? 0.28545 0.29838 0.28341 -0.02534 0.03162  -0.01721 141 LEU A CA  
1093 C C   . LEU A 141 ? 0.26967 0.28109 0.26421 -0.02437 0.03024  -0.01609 141 LEU A C   
1094 O O   . LEU A 141 ? 0.28279 0.29564 0.28028 -0.02029 0.02603  -0.01376 141 LEU A O   
1095 C CB  . LEU A 141 ? 0.26831 0.28838 0.27552 -0.02766 0.03544  -0.02398 141 LEU A CB  
1096 C CG  . LEU A 141 ? 0.25855 0.28188 0.27147 -0.02844 0.03663  -0.02627 141 LEU A CG  
1097 C CD1 . LEU A 141 ? 0.35268 0.38502 0.37777 -0.02926 0.03896  -0.03377 141 LEU A CD1 
1098 C CD2 . LEU A 141 ? 0.31206 0.32825 0.31464 -0.03342 0.04062  -0.02506 141 LEU A CD2 
1099 N N   . ASN A 142 ? 0.30709 0.31538 0.29502 -0.02858 0.03412  -0.01806 142 ASN A N   
1100 C CA  . ASN A 142 ? 0.28507 0.29280 0.27062 -0.02813 0.03336  -0.01812 142 ASN A CA  
1101 C C   . ASN A 142 ? 0.31046 0.32650 0.30848 -0.02502 0.03185  -0.02139 142 ASN A C   
1102 O O   . ASN A 142 ? 0.28837 0.31057 0.29552 -0.02561 0.03393  -0.02627 142 ASN A O   
1103 C CB  . ASN A 142 ? 0.32212 0.32575 0.29916 -0.03382 0.03857  -0.02082 142 ASN A CB  
1104 C CG  . ASN A 142 ? 0.49498 0.48748 0.45637 -0.03625 0.03855  -0.01654 142 ASN A CG  
1105 O OD1 . ASN A 142 ? 0.45436 0.44277 0.41173 -0.03283 0.03380  -0.01161 142 ASN A OD1 
1106 N ND2 . ASN A 142 ? 0.55312 0.54026 0.50535 -0.04224 0.04380  -0.01870 142 ASN A ND2 
1107 N N   . GLY A 143 ? 0.28276 0.29867 0.28121 -0.02161 0.02795  -0.01893 143 GLY A N   
1108 C CA  . GLY A 143 ? 0.30635 0.32805 0.31492 -0.01823 0.02559  -0.02103 143 GLY A CA  
1109 C C   . GLY A 143 ? 0.25496 0.27790 0.26837 -0.01390 0.02104  -0.01808 143 GLY A C   
1110 O O   . GLY A 143 ? 0.26695 0.29249 0.28643 -0.01095 0.01835  -0.01881 143 GLY A O   
1111 N N   . SER A 144 ? 0.25019 0.27060 0.26033 -0.01364 0.02016  -0.01483 144 SER A N   
1112 C CA  . SER A 144 ? 0.27168 0.29307 0.28575 -0.01010 0.01638  -0.01234 144 SER A CA  
1113 C C   . SER A 144 ? 0.23341 0.25201 0.24380 -0.00795 0.01309  -0.00821 144 SER A C   
1114 O O   . SER A 144 ? 0.25145 0.27081 0.26503 -0.00536 0.01023  -0.00660 144 SER A O   
1115 C CB  . SER A 144 ? 0.21922 0.23954 0.23198 -0.01080 0.01698  -0.01110 144 SER A CB  
1116 O OG  . SER A 144 ? 0.27605 0.29079 0.27948 -0.01256 0.01779  -0.00806 144 SER A OG  
1117 N N   . ALA A 145 ? 0.25347 0.26871 0.25703 -0.00915 0.01343  -0.00675 145 ALA A N   
1118 C CA  . ALA A 145 ? 0.27139 0.28500 0.27269 -0.00718 0.01033  -0.00374 145 ALA A CA  
1119 C C   . ALA A 145 ? 0.26067 0.27704 0.26802 -0.00510 0.00843  -0.00451 145 ALA A C   
1120 O O   . ALA A 145 ? 0.23180 0.25031 0.24313 -0.00528 0.00933  -0.00751 145 ALA A O   
1121 C CB  . ALA A 145 ? 0.26035 0.27042 0.25421 -0.00861 0.01060  -0.00314 145 ALA A CB  
1122 N N   . GLY A 146 ? 0.23236 0.24830 0.24023 -0.00326 0.00588  -0.00205 146 GLY A N   
1123 C CA  . GLY A 146 ? 0.28254 0.29941 0.29457 -0.00170 0.00410  -0.00233 146 GLY A CA  
1124 C C   . GLY A 146 ? 0.25519 0.27264 0.27106 -0.00032 0.00298  -0.00233 146 GLY A C   
1125 O O   . GLY A 146 ? 0.24432 0.26070 0.26164 0.00091  0.00106  -0.00179 146 GLY A O   
1126 N N   . SER A 147 ? 0.25934 0.27785 0.27633 -0.00067 0.00406  -0.00309 147 SER A N   
1127 C CA  . SER A 147 ? 0.21391 0.23260 0.23356 0.00074  0.00251  -0.00270 147 SER A CA  
1128 C C   . SER A 147 ? 0.26979 0.28648 0.28637 0.00123  0.00113  0.00061  147 SER A C   
1129 O O   . SER A 147 ? 0.25243 0.26847 0.26561 0.00050  0.00169  0.00222  147 SER A O   
1130 C CB  . SER A 147 ? 0.22605 0.24646 0.24714 -0.00012 0.00418  -0.00412 147 SER A CB  
1131 O OG  . SER A 147 ? 0.24162 0.26450 0.26571 -0.00134 0.00634  -0.00788 147 SER A OG  
1132 N N   . VAL A 148 ? 0.26565 0.28109 0.28325 0.00246  -0.00083 0.00128  148 VAL A N   
1133 C CA  . VAL A 148 ? 0.23694 0.25050 0.25166 0.00237  -0.00163 0.00378  148 VAL A CA  
1134 C C   . VAL A 148 ? 0.25712 0.27020 0.27160 0.00281  -0.00224 0.00463  148 VAL A C   
1135 O O   . VAL A 148 ? 0.28682 0.30050 0.30366 0.00362  -0.00293 0.00328  148 VAL A O   
1136 C CB  . VAL A 148 ? 0.29117 0.30195 0.30486 0.00251  -0.00304 0.00420  148 VAL A CB  
1137 C CG1 . VAL A 148 ? 0.25391 0.26531 0.26790 0.00196  -0.00239 0.00323  148 VAL A CG1 
1138 C CG2 . VAL A 148 ? 0.22182 0.23000 0.23654 0.00395  -0.00532 0.00338  148 VAL A CG2 
1139 N N   . GLY A 149 ? 0.23495 0.24740 0.24700 0.00224  -0.00196 0.00641  149 GLY A N   
1140 C CA  . GLY A 149 ? 0.27992 0.29159 0.29107 0.00240  -0.00241 0.00726  149 GLY A CA  
1141 C C   . GLY A 149 ? 0.27328 0.28188 0.28161 0.00184  -0.00325 0.00833  149 GLY A C   
1142 O O   . GLY A 149 ? 0.28896 0.29693 0.29621 0.00091  -0.00278 0.00856  149 GLY A O   
1143 N N   . PHE A 150 ? 0.29510 0.30138 0.30171 0.00209  -0.00441 0.00879  150 PHE A N   
1144 C CA  . PHE A 150 ? 0.26726 0.26876 0.26943 0.00114  -0.00530 0.00975  150 PHE A CA  
1145 C C   . PHE A 150 ? 0.31803 0.31720 0.31714 0.00092  -0.00600 0.01045  150 PHE A C   
1146 O O   . PHE A 150 ? 0.28357 0.28459 0.28476 0.00209  -0.00664 0.00991  150 PHE A O   
1147 C CB  . PHE A 150 ? 0.27902 0.27665 0.28039 0.00215  -0.00764 0.00930  150 PHE A CB  
1148 C CG  . PHE A 150 ? 0.28724 0.28470 0.29103 0.00450  -0.01027 0.00801  150 PHE A CG  
1149 C CD1 . PHE A 150 ? 0.29935 0.30172 0.30901 0.00568  -0.00981 0.00597  150 PHE A CD1 
1150 C CD2 . PHE A 150 ? 0.31984 0.31221 0.31990 0.00535  -0.01320 0.00845  150 PHE A CD2 
1151 C CE1 . PHE A 150 ? 0.32528 0.32863 0.33851 0.00764  -0.01197 0.00384  150 PHE A CE1 
1152 C CE2 . PHE A 150 ? 0.30464 0.29755 0.30796 0.00787  -0.01616 0.00658  150 PHE A CE2 
1153 C CZ  . PHE A 150 ? 0.30116 0.30018 0.31183 0.00900  -0.01541 0.00400  150 PHE A CZ  
1154 N N   . ASN A 151 ? 0.34033 0.33523 0.33410 -0.00102 -0.00558 0.01141  151 ASN A N   
1155 C CA  . ASN A 151 ? 0.36421 0.35473 0.35277 -0.00171 -0.00652 0.01217  151 ASN A CA  
1156 C C   . ASN A 151 ? 0.36526 0.34737 0.34688 -0.00241 -0.00865 0.01310  151 ASN A C   
1157 O O   . ASN A 151 ? 0.35089 0.33102 0.33166 -0.00317 -0.00835 0.01318  151 ASN A O   
1158 C CB  . ASN A 151 ? 0.34986 0.34196 0.33683 -0.00420 -0.00345 0.01220  151 ASN A CB  
1159 C CG  . ASN A 151 ? 0.38377 0.38210 0.37604 -0.00312 -0.00228 0.01144  151 ASN A CG  
1160 O OD1 . ASN A 151 ? 0.49844 0.49665 0.49034 -0.00238 -0.00311 0.01144  151 ASN A OD1 
1161 N ND2 . ASN A 151 ? 0.30930 0.31243 0.30599 -0.00303 -0.00062 0.01073  151 ASN A ND2 
1162 N N   . ILE A 152 ? 0.33204 0.30840 0.30798 -0.00214 -0.01109 0.01379  152 ILE A N   
1163 C CA  . ILE A 152 ? 0.38936 0.35541 0.35617 -0.00304 -0.01352 0.01502  152 ILE A CA  
1164 C C   . ILE A 152 ? 0.40207 0.36276 0.36015 -0.00617 -0.01221 0.01608  152 ILE A C   
1165 O O   . ILE A 152 ? 0.40989 0.37300 0.36867 -0.00570 -0.01226 0.01579  152 ILE A O   
1166 C CB  . ILE A 152 ? 0.43249 0.39444 0.39921 0.00078  -0.01914 0.01459  152 ILE A CB  
1167 C CG1 . ILE A 152 ? 0.41894 0.38776 0.39555 0.00362  -0.01973 0.01269  152 ILE A CG1 
1168 C CG2 . ILE A 152 ? 0.44331 0.39305 0.39973 0.00012  -0.02220 0.01601  152 ILE A CG2 
1169 C CD1 . ILE A 152 ? 0.46796 0.43444 0.44673 0.00757  -0.02509 0.01110  152 ILE A CD1 
1170 N N   . ASP A 153 ? 0.45071 0.40391 0.40025 -0.00975 -0.01070 0.01707  153 ASP A N   
1171 C CA  . ASP A 153 ? 0.49402 0.43974 0.43283 -0.01343 -0.00945 0.01799  153 ASP A CA  
1172 C C   . ASP A 153 ? 0.53675 0.46859 0.46349 -0.01432 -0.01279 0.01975  153 ASP A C   
1173 O O   . ASP A 153 ? 0.48545 0.41359 0.40991 -0.01610 -0.01170 0.02004  153 ASP A O   
1174 C CB  . ASP A 153 ? 0.66305 0.61286 0.60230 -0.01820 -0.00318 0.01686  153 ASP A CB  
1175 C CG  . ASP A 153 ? 0.75593 0.70024 0.68567 -0.02225 -0.00095 0.01699  153 ASP A CG  
1176 O OD1 . ASP A 153 ? 0.73793 0.67370 0.65893 -0.02156 -0.00455 0.01849  153 ASP A OD1 
1177 O OD2 . ASP A 153 ? 0.85150 0.80015 0.78260 -0.02614 0.00433  0.01522  153 ASP A OD2 
1178 N N   . TYR A 154 ? 0.48498 0.40861 0.40370 -0.01295 -0.01720 0.02084  154 TYR A N   
1179 C CA  . TYR A 154 ? 0.50744 0.41620 0.41368 -0.01277 -0.02197 0.02263  154 TYR A CA  
1180 C C   . TYR A 154 ? 0.57345 0.48209 0.48528 -0.00874 -0.02582 0.02222  154 TYR A C   
1181 O O   . TYR A 154 ? 0.58692 0.49907 0.50573 -0.00348 -0.03063 0.02107  154 TYR A O   
1182 C CB  . TYR A 154 ? 0.54126 0.43960 0.43401 -0.01931 -0.01802 0.02396  154 TYR A CB  
1183 C CG  . TYR A 154 ? 0.64655 0.52669 0.52297 -0.01974 -0.02310 0.02626  154 TYR A CG  
1184 C CD1 . TYR A 154 ? 0.62298 0.49525 0.49173 -0.01706 -0.02905 0.02723  154 TYR A CD1 
1185 C CD2 . TYR A 154 ? 0.64824 0.51831 0.51634 -0.02280 -0.02230 0.02736  154 TYR A CD2 
1186 C CE1 . TYR A 154 ? 0.70038 0.55462 0.55308 -0.01704 -0.03460 0.02940  154 TYR A CE1 
1187 C CE2 . TYR A 154 ? 0.60317 0.45481 0.45493 -0.02315 -0.02738 0.02966  154 TYR A CE2 
1188 C CZ  . TYR A 154 ? 0.70702 0.55049 0.55086 -0.02008 -0.03379 0.03075  154 TYR A CZ  
1189 O OH  . TYR A 154 ? 0.74279 0.56660 0.56928 -0.02005 -0.03969 0.03310  154 TYR A OH  
1190 N N   . ASP A 155 ? 0.49140 0.39657 0.40090 -0.01129 -0.02353 0.02264  155 ASP A N   
1191 C CA  . ASP A 155 ? 0.51427 0.41826 0.42811 -0.00782 -0.02702 0.02212  155 ASP A CA  
1192 C C   . ASP A 155 ? 0.53451 0.44918 0.45904 -0.00878 -0.02232 0.02067  155 ASP A C   
1193 O O   . ASP A 155 ? 0.52675 0.44009 0.45404 -0.00696 -0.02414 0.02013  155 ASP A O   
1194 C CB  . ASP A 155 ? 0.57359 0.46029 0.47281 -0.00928 -0.03033 0.02406  155 ASP A CB  
1195 C CG  . ASP A 155 ? 0.67127 0.55212 0.56118 -0.01645 -0.02427 0.02517  155 ASP A CG  
1196 O OD1 . ASP A 155 ? 0.55874 0.44909 0.45351 -0.02009 -0.01788 0.02415  155 ASP A OD1 
1197 O OD2 . ASP A 155 ? 0.72299 0.58953 0.60080 -0.01852 -0.02595 0.02671  155 ASP A OD2 
1198 N N   . CYS A 156 ? 0.41997 0.34490 0.35051 -0.01136 -0.01671 0.01980  156 CYS A N   
1199 C CA  . CYS A 156 ? 0.35989 0.29368 0.29872 -0.01282 -0.01235 0.01842  156 CYS A CA  
1200 C C   . CYS A 156 ? 0.41378 0.36126 0.36560 -0.00973 -0.01150 0.01682  156 CYS A C   
1201 O O   . CYS A 156 ? 0.40255 0.35474 0.35630 -0.00976 -0.01030 0.01662  156 CYS A O   
1202 C CB  . CYS A 156 ? 0.45134 0.38450 0.38549 -0.01886 -0.00658 0.01822  156 CYS A CB  
1203 S SG  . CYS A 156 ? 0.49201 0.43662 0.43680 -0.02048 -0.00175 0.01590  156 CYS A SG  
1204 N N   . VAL A 157 ? 0.36159 0.31465 0.32146 -0.00736 -0.01200 0.01564  157 VAL A N   
1205 C CA  . VAL A 157 ? 0.37632 0.34093 0.34704 -0.00498 -0.01096 0.01417  157 VAL A CA  
1206 C C   . VAL A 157 ? 0.32402 0.29559 0.29868 -0.00764 -0.00630 0.01337  157 VAL A C   
1207 O O   . VAL A 157 ? 0.31644 0.28740 0.29101 -0.00937 -0.00483 0.01290  157 VAL A O   
1208 C CB  . VAL A 157 ? 0.30852 0.27536 0.28535 -0.00141 -0.01365 0.01288  157 VAL A CB  
1209 C CG1 . VAL A 157 ? 0.29013 0.26771 0.27646 0.00025  -0.01205 0.01139  157 VAL A CG1 
1210 C CG2 . VAL A 157 ? 0.34627 0.30649 0.32027 0.00170  -0.01891 0.01284  157 VAL A CG2 
1211 N N   . SER A 158 ? 0.32143 0.29962 0.29991 -0.00773 -0.00435 0.01290  158 SER A N   
1212 C CA  . SER A 158 ? 0.34767 0.33331 0.33136 -0.00910 -0.00098 0.01161  158 SER A CA  
1213 C C   . SER A 158 ? 0.30235 0.29488 0.29356 -0.00604 -0.00175 0.01087  158 SER A C   
1214 O O   . SER A 158 ? 0.28241 0.27775 0.27606 -0.00421 -0.00246 0.01094  158 SER A O   
1215 C CB  . SER A 158 ? 0.36367 0.35157 0.34657 -0.01105 0.00146  0.01118  158 SER A CB  
1216 O OG  . SER A 158 ? 0.41152 0.39373 0.38748 -0.01505 0.00346  0.01121  158 SER A OG  
1217 N N   . PHE A 159 ? 0.25521 0.24984 0.24936 -0.00583 -0.00148 0.01008  159 PHE A N   
1218 C CA  . PHE A 159 ? 0.26685 0.26725 0.26666 -0.00371 -0.00168 0.00928  159 PHE A CA  
1219 C C   . PHE A 159 ? 0.34343 0.34928 0.34615 -0.00430 0.00017  0.00852  159 PHE A C   
1220 O O   . PHE A 159 ? 0.31978 0.32665 0.32251 -0.00630 0.00172  0.00759  159 PHE A O   
1221 C CB  . PHE A 159 ? 0.27250 0.27265 0.27371 -0.00333 -0.00221 0.00852  159 PHE A CB  
1222 C CG  . PHE A 159 ? 0.25229 0.24738 0.25179 -0.00205 -0.00458 0.00867  159 PHE A CG  
1223 C CD1 . PHE A 159 ? 0.28124 0.27795 0.28393 0.00046  -0.00617 0.00791  159 PHE A CD1 
1224 C CD2 . PHE A 159 ? 0.26424 0.25273 0.25905 -0.00339 -0.00530 0.00916  159 PHE A CD2 
1225 C CE1 . PHE A 159 ? 0.27092 0.26362 0.27332 0.00217  -0.00887 0.00725  159 PHE A CE1 
1226 C CE2 . PHE A 159 ? 0.29367 0.27668 0.28680 -0.00162 -0.00830 0.00909  159 PHE A CE2 
1227 C CZ  . PHE A 159 ? 0.30047 0.28604 0.29802 0.00145  -0.01030 0.00793  159 PHE A CZ  
1228 N N   . CYS A 160 ? 0.29275 0.30184 0.29797 -0.00259 -0.00011 0.00855  160 CYS A N   
1229 C CA  . CYS A 160 ? 0.27322 0.28642 0.28081 -0.00247 0.00078  0.00779  160 CYS A CA  
1230 C C   . CYS A 160 ? 0.26108 0.27660 0.27060 -0.00077 0.00008  0.00759  160 CYS A C   
1231 O O   . CYS A 160 ? 0.31487 0.33290 0.32586 -0.00028 0.00000  0.00684  160 CYS A O   
1232 C CB  . CYS A 160 ? 0.32027 0.33363 0.32727 -0.00254 0.00127  0.00809  160 CYS A CB  
1233 S SG  . CYS A 160 ? 0.34536 0.35717 0.35168 -0.00090 0.00010  0.00921  160 CYS A SG  
1234 N N   . TYR A 161 ? 0.26312 0.27756 0.27241 0.00005  -0.00048 0.00790  161 TYR A N   
1235 C CA  . TYR A 161 ? 0.26423 0.27972 0.27373 0.00092  -0.00059 0.00772  161 TYR A CA  
1236 C C   . TYR A 161 ? 0.24241 0.25735 0.25206 0.00089  -0.00059 0.00706  161 TYR A C   
1237 O O   . TYR A 161 ? 0.26678 0.28054 0.27715 0.00098  -0.00088 0.00675  161 TYR A O   
1238 C CB  . TYR A 161 ? 0.26422 0.27933 0.27332 0.00147  -0.00035 0.00825  161 TYR A CB  
1239 C CG  . TYR A 161 ? 0.26823 0.28283 0.27589 0.00164  -0.00001 0.00814  161 TYR A CG  
1240 C CD1 . TYR A 161 ? 0.28256 0.29657 0.28837 0.00216  -0.00061 0.00846  161 TYR A CD1 
1241 C CD2 . TYR A 161 ? 0.26722 0.28144 0.27502 0.00116  0.00087  0.00739  161 TYR A CD2 
1242 C CE1 . TYR A 161 ? 0.26708 0.27869 0.26949 0.00195  -0.00040 0.00865  161 TYR A CE1 
1243 C CE2 . TYR A 161 ? 0.21213 0.22502 0.21736 0.00045  0.00185  0.00713  161 TYR A CE2 
1244 C CZ  . TYR A 161 ? 0.23367 0.24453 0.23532 0.00072  0.00119  0.00807  161 TYR A CZ  
1245 O OH  . TYR A 161 ? 0.27667 0.28432 0.27370 -0.00031 0.00202  0.00813  161 TYR A OH  
1246 N N   . MET A 162 ? 0.24935 0.26484 0.25815 0.00087  -0.00055 0.00657  162 MET A N   
1247 C CA  . MET A 162 ? 0.26022 0.27538 0.26879 0.00056  -0.00003 0.00555  162 MET A CA  
1248 C C   . MET A 162 ? 0.25582 0.27013 0.26149 0.00026  0.00062  0.00559  162 MET A C   
1249 O O   . MET A 162 ? 0.23159 0.24514 0.23479 0.00061  -0.00027 0.00623  162 MET A O   
1250 C CB  . MET A 162 ? 0.23398 0.24945 0.24281 0.00018  -0.00041 0.00472  162 MET A CB  
1251 C CG  . MET A 162 ? 0.23558 0.25087 0.24403 -0.00028 0.00035  0.00329  162 MET A CG  
1252 S SD  . MET A 162 ? 0.31708 0.33246 0.32650 -0.00070 -0.00007 0.00200  162 MET A SD  
1253 C CE  . MET A 162 ? 0.34316 0.35701 0.35539 -0.00014 -0.00057 0.00159  162 MET A CE  
1254 N N   . HIS A 163 ? 0.26368 0.27773 0.26941 -0.00047 0.00207  0.00459  163 HIS A N   
1255 C CA  . HIS A 163 ? 0.26870 0.28071 0.27040 -0.00154 0.00329  0.00467  163 HIS A CA  
1256 C C   . HIS A 163 ? 0.24957 0.25976 0.24699 -0.00250 0.00355  0.00418  163 HIS A C   
1257 O O   . HIS A 163 ? 0.26640 0.27786 0.26530 -0.00294 0.00402  0.00271  163 HIS A O   
1258 C CB  . HIS A 163 ? 0.26797 0.28073 0.27149 -0.00266 0.00537  0.00308  163 HIS A CB  
1259 C CG  . HIS A 163 ? 0.24634 0.25610 0.24476 -0.00461 0.00728  0.00303  163 HIS A CG  
1260 N ND1 . HIS A 163 ? 0.26441 0.27084 0.25851 -0.00438 0.00652  0.00505  163 HIS A ND1 
1261 C CD2 . HIS A 163 ? 0.24748 0.25626 0.24361 -0.00711 0.01005  0.00108  163 HIS A CD2 
1262 C CE1 . HIS A 163 ? 0.27280 0.27536 0.26128 -0.00667 0.00853  0.00474  163 HIS A CE1 
1263 N NE2 . HIS A 163 ? 0.24524 0.24925 0.23468 -0.00866 0.01100  0.00228  163 HIS A NE2 
1264 N N   . HIS A 164 ? 0.26148 0.26797 0.25298 -0.00277 0.00297  0.00536  164 HIS A N   
1265 C CA  . HIS A 164 ? 0.24721 0.25042 0.23260 -0.00384 0.00289  0.00509  164 HIS A CA  
1266 C C   . HIS A 164 ? 0.25111 0.24906 0.22912 -0.00614 0.00481  0.00525  164 HIS A C   
1267 O O   . HIS A 164 ? 0.29622 0.29295 0.27123 -0.00857 0.00724  0.00367  164 HIS A O   
1268 C CB  . HIS A 164 ? 0.21336 0.21545 0.19667 -0.00191 -0.00059 0.00613  164 HIS A CB  
1269 C CG  . HIS A 164 ? 0.23549 0.24213 0.22466 -0.00076 -0.00177 0.00530  164 HIS A CG  
1270 N ND1 . HIS A 164 ? 0.24227 0.24913 0.23026 -0.00073 -0.00298 0.00437  164 HIS A ND1 
1271 C CD2 . HIS A 164 ? 0.24420 0.25464 0.23966 0.00003  -0.00179 0.00521  164 HIS A CD2 
1272 C CE1 . HIS A 164 ? 0.23540 0.24624 0.22917 -0.00009 -0.00349 0.00363  164 HIS A CE1 
1273 N NE2 . HIS A 164 ? 0.27925 0.29188 0.27710 0.00025  -0.00271 0.00422  164 HIS A NE2 
1274 N N   A MET A 165 ? 0.27652 0.27088 0.25110 -0.00578 0.00407  0.00687  165 MET A N   
1275 N N   B MET A 165 ? 0.28110 0.27547 0.25569 -0.00578 0.00408  0.00687  165 MET A N   
1276 C CA  A MET A 165 ? 0.29873 0.28574 0.26359 -0.00818 0.00535  0.00743  165 MET A CA  
1277 C CA  B MET A 165 ? 0.29873 0.28573 0.26358 -0.00817 0.00534  0.00743  165 MET A CA  
1278 C C   A MET A 165 ? 0.29161 0.27612 0.25534 -0.00877 0.00637  0.00830  165 MET A C   
1279 C C   B MET A 165 ? 0.29170 0.27619 0.25541 -0.00877 0.00636  0.00831  165 MET A C   
1280 O O   A MET A 165 ? 0.26086 0.24910 0.23088 -0.00680 0.00538  0.00874  165 MET A O   
1281 O O   B MET A 165 ? 0.25884 0.24705 0.22883 -0.00679 0.00536  0.00876  165 MET A O   
1282 C CB  A MET A 165 ? 0.34396 0.32489 0.30059 -0.00696 0.00175  0.00893  165 MET A CB  
1283 C CB  B MET A 165 ? 0.34384 0.32481 0.30052 -0.00692 0.00171  0.00894  165 MET A CB  
1284 C CG  A MET A 165 ? 0.34804 0.32931 0.30692 -0.00321 -0.00260 0.01032  165 MET A CG  
1285 C CG  B MET A 165 ? 0.35613 0.33936 0.31699 -0.00297 -0.00266 0.00992  165 MET A CG  
1286 S SD  A MET A 165 ? 0.46578 0.44415 0.41995 -0.00087 -0.00756 0.01046  165 MET A SD  
1287 S SD  B MET A 165 ? 0.46713 0.44400 0.41951 -0.00105 -0.00768 0.01067  165 MET A SD  
1288 C CE  A MET A 165 ? 0.42609 0.39769 0.36915 -0.00469 -0.00525 0.01015  165 MET A CE  
1289 C CE  B MET A 165 ? 0.32462 0.29835 0.27661 0.00221  -0.01152 0.01204  165 MET A CE  
1290 N N   . GLU A 166 ? 0.28798 0.26540 0.24267 -0.01191 0.00854  0.00845  166 GLU A N   
1291 C CA  . GLU A 166 ? 0.28262 0.25606 0.23436 -0.01336 0.01005  0.00908  166 GLU A CA  
1292 C C   . GLU A 166 ? 0.36035 0.32310 0.30027 -0.01301 0.00728  0.01161  166 GLU A C   
1293 O O   . GLU A 166 ? 0.37912 0.33556 0.30989 -0.01401 0.00633  0.01217  166 GLU A O   
1294 C CB  . GLU A 166 ? 0.37866 0.35226 0.32960 -0.01811 0.01560  0.00649  166 GLU A CB  
1295 C CG  . GLU A 166 ? 0.40393 0.37546 0.35434 -0.02003 0.01788  0.00629  166 GLU A CG  
1296 C CD  . GLU A 166 ? 0.43427 0.40890 0.38737 -0.02458 0.02354  0.00248  166 GLU A CD  
1297 O OE1 . GLU A 166 ? 0.50715 0.47518 0.45086 -0.02915 0.02700  0.00162  166 GLU A OE1 
1298 O OE2 . GLU A 166 ? 0.35653 0.34000 0.32094 -0.02367 0.02444  0.00003  166 GLU A OE2 
1299 N N   . LEU A 167 ? 0.37162 0.33186 0.31141 -0.01144 0.00565  0.01300  167 LEU A N   
1300 C CA  . LEU A 167 ? 0.39777 0.34752 0.32734 -0.01027 0.00220  0.01530  167 LEU A CA  
1301 C C   . LEU A 167 ? 0.52285 0.46503 0.44525 -0.01388 0.00535  0.01571  167 LEU A C   
1302 O O   . LEU A 167 ? 0.45386 0.40112 0.38208 -0.01648 0.00974  0.01397  167 LEU A O   
1303 C CB  . LEU A 167 ? 0.38036 0.33347 0.31644 -0.00511 -0.00260 0.01607  167 LEU A CB  
1304 C CG  . LEU A 167 ? 0.41183 0.37221 0.35515 -0.00173 -0.00572 0.01534  167 LEU A CG  
1305 C CD1 . LEU A 167 ? 0.43850 0.40441 0.39057 0.00209  -0.00845 0.01506  167 LEU A CD1 
1306 C CD2 . LEU A 167 ? 0.43435 0.38788 0.36883 -0.00055 -0.00963 0.01605  167 LEU A CD2 
1307 N N   . PRO A 168 ? 0.48692 0.41642 0.39638 -0.01416 0.00299  0.01779  168 PRO A N   
1308 C CA  . PRO A 168 ? 0.49626 0.41733 0.39809 -0.01782 0.00595  0.01830  168 PRO A CA  
1309 C C   . PRO A 168 ? 0.56134 0.48830 0.47293 -0.01597 0.00611  0.01788  168 PRO A C   
1310 O O   . PRO A 168 ? 0.49953 0.43270 0.41972 -0.01110 0.00227  0.01813  168 PRO A O   
1311 C CB  . PRO A 168 ? 0.55641 0.46206 0.44266 -0.01681 0.00136  0.02105  168 PRO A CB  
1312 C CG  . PRO A 168 ? 0.55936 0.46798 0.44888 -0.01112 -0.00506 0.02162  168 PRO A CG  
1313 C CD  . PRO A 168 ? 0.52098 0.44221 0.42104 -0.01155 -0.00250 0.01955  168 PRO A CD  
1314 N N   . THR A 169 ? 0.64574 0.57043 0.55551 -0.02031 0.01084  0.01692  169 THR A N   
1315 C CA  . THR A 169 ? 0.75033 0.68141 0.66944 -0.02017 0.01267  0.01568  169 THR A CA  
1316 C C   . THR A 169 ? 0.61598 0.56103 0.54865 -0.02051 0.01558  0.01281  169 THR A C   
1317 O O   . THR A 169 ? 0.56842 0.52039 0.51025 -0.01965 0.01633  0.01159  169 THR A O   
1318 C CB  . THR A 169 ? 0.75382 0.68554 0.67716 -0.01488 0.00771  0.01713  169 THR A CB  
1319 O OG1 . THR A 169 ? 0.73599 0.67661 0.66831 -0.01030 0.00423  0.01700  169 THR A OG1 
1320 C CG2 . THR A 169 ? 0.81932 0.73679 0.72974 -0.01368 0.00381  0.01964  169 THR A CG2 
1321 N N   . GLY A 170 ? 0.58701 0.53583 0.52083 -0.02160 0.01693  0.01160  170 GLY A N   
1322 C CA  . GLY A 170 ? 0.44393 0.40473 0.38988 -0.02186 0.01936  0.00860  170 GLY A CA  
1323 C C   . GLY A 170 ? 0.47981 0.44953 0.43674 -0.01687 0.01580  0.00899  170 GLY A C   
1324 O O   . GLY A 170 ? 0.45622 0.43393 0.42270 -0.01659 0.01703  0.00699  170 GLY A O   
1325 N N   . VAL A 171 ? 0.35686 0.32505 0.31232 -0.01305 0.01132  0.01123  171 VAL A N   
1326 C CA  . VAL A 171 ? 0.29433 0.27053 0.25927 -0.00906 0.00850  0.01132  171 VAL A CA  
1327 C C   . VAL A 171 ? 0.27530 0.25416 0.24121 -0.00782 0.00702  0.01125  171 VAL A C   
1328 O O   . VAL A 171 ? 0.31617 0.29047 0.27520 -0.00967 0.00775  0.01129  171 VAL A O   
1329 C CB  . VAL A 171 ? 0.37766 0.35168 0.34248 -0.00572 0.00488  0.01298  171 VAL A CB  
1330 C CG1 . VAL A 171 ? 0.43148 0.40272 0.39537 -0.00709 0.00649  0.01289  171 VAL A CG1 
1331 C CG2 . VAL A 171 ? 0.34853 0.31493 0.30514 -0.00403 0.00132  0.01465  171 VAL A CG2 
1332 N N   . HIS A 172 ? 0.28929 0.27496 0.26303 -0.00500 0.00508  0.01106  172 HIS A N   
1333 C CA  . HIS A 172 ? 0.29856 0.28809 0.27496 -0.00454 0.00467  0.01032  172 HIS A CA  
1334 C C   . HIS A 172 ? 0.28902 0.28100 0.26846 -0.00125 0.00108  0.01105  172 HIS A C   
1335 O O   . HIS A 172 ? 0.29315 0.28646 0.27558 0.00065  -0.00046 0.01149  172 HIS A O   
1336 C CB  . HIS A 172 ? 0.28312 0.27915 0.26690 -0.00554 0.00704  0.00829  172 HIS A CB  
1337 C CG  . HIS A 172 ? 0.26336 0.25844 0.24591 -0.00888 0.01076  0.00647  172 HIS A CG  
1338 N ND1 . HIS A 172 ? 0.27261 0.26921 0.25837 -0.00967 0.01223  0.00553  172 HIS A ND1 
1339 C CD2 . HIS A 172 ? 0.28115 0.27399 0.25957 -0.01200 0.01361  0.00494  172 HIS A CD2 
1340 C CE1 . HIS A 172 ? 0.26831 0.26420 0.25276 -0.01315 0.01587  0.00324  172 HIS A CE1 
1341 N NE2 . HIS A 172 ? 0.32602 0.31957 0.30588 -0.01479 0.01700  0.00280  172 HIS A NE2 
1342 N N   . ALA A 173 ? 0.27870 0.27152 0.25756 -0.00088 0.00005  0.01071  173 ALA A N   
1343 C CA  . ALA A 173 ? 0.25323 0.24862 0.23502 0.00173  -0.00308 0.01070  173 ALA A CA  
1344 C C   . ALA A 173 ? 0.26626 0.26630 0.25216 0.00133  -0.00243 0.00957  173 ALA A C   
1345 O O   . ALA A 173 ? 0.26611 0.26558 0.25021 -0.00055 -0.00050 0.00890  173 ALA A O   
1346 C CB  . ALA A 173 ? 0.30094 0.29066 0.27604 0.00314  -0.00640 0.01136  173 ALA A CB  
1347 N N   . GLY A 174 ? 0.23766 0.24208 0.22900 0.00286  -0.00382 0.00905  174 GLY A N   
1348 C CA  . GLY A 174 ? 0.22019 0.22824 0.21511 0.00240  -0.00331 0.00803  174 GLY A CA  
1349 C C   . GLY A 174 ? 0.25137 0.26305 0.25079 0.00369  -0.00490 0.00728  174 GLY A C   
1350 O O   . GLY A 174 ? 0.23470 0.24653 0.23474 0.00518  -0.00665 0.00712  174 GLY A O   
1351 N N   . THR A 175 ? 0.26684 0.28133 0.26956 0.00293  -0.00412 0.00646  175 THR A N   
1352 C CA  . THR A 175 ? 0.21295 0.23075 0.21945 0.00324  -0.00501 0.00516  175 THR A CA  
1353 C C   . THR A 175 ? 0.27165 0.29113 0.28135 0.00213  -0.00334 0.00515  175 THR A C   
1354 O O   . THR A 175 ? 0.24837 0.26644 0.25751 0.00152  -0.00212 0.00608  175 THR A O   
1355 C CB  . THR A 175 ? 0.21806 0.23656 0.22436 0.00282  -0.00566 0.00399  175 THR A CB  
1356 O OG1 . THR A 175 ? 0.25624 0.27414 0.26257 0.00145  -0.00387 0.00418  175 THR A OG1 
1357 C CG2 . THR A 175 ? 0.19652 0.21215 0.19799 0.00372  -0.00757 0.00410  175 THR A CG2 
1358 N N   . ASP A 176 ? 0.22582 0.24807 0.23864 0.00173  -0.00337 0.00375  176 ASP A N   
1359 C CA  . ASP A 176 ? 0.27282 0.29513 0.28672 -0.00012 -0.00164 0.00367  176 ASP A CA  
1360 C C   . ASP A 176 ? 0.27174 0.29306 0.28511 -0.00116 -0.00136 0.00336  176 ASP A C   
1361 O O   . ASP A 176 ? 0.25091 0.27222 0.26352 -0.00051 -0.00227 0.00302  176 ASP A O   
1362 C CB  . ASP A 176 ? 0.23528 0.26059 0.25221 -0.00107 -0.00090 0.00185  176 ASP A CB  
1363 C CG  . ASP A 176 ? 0.30323 0.33224 0.32347 -0.00099 -0.00183 -0.00084 176 ASP A CG  
1364 O OD1 . ASP A 176 ? 0.29365 0.32230 0.31318 -0.00079 -0.00275 -0.00103 176 ASP A OD1 
1365 O OD2 . ASP A 176 ? 0.30787 0.34057 0.33191 -0.00112 -0.00166 -0.00323 176 ASP A OD2 
1366 N N   . LEU A 177 ? 0.22851 0.24818 0.24151 -0.00289 -0.00016 0.00343  177 LEU A N   
1367 C CA  . LEU A 177 ? 0.23843 0.25625 0.25070 -0.00375 -0.00007 0.00311  177 LEU A CA  
1368 C C   . LEU A 177 ? 0.35913 0.37951 0.37340 -0.00491 0.00007  0.00101  177 LEU A C   
1369 O O   . LEU A 177 ? 0.31619 0.33511 0.32997 -0.00578 0.00019  0.00047  177 LEU A O   
1370 C CB  . LEU A 177 ? 0.24593 0.25928 0.25580 -0.00500 0.00053  0.00410  177 LEU A CB  
1371 C CG  . LEU A 177 ? 0.34148 0.35201 0.35012 -0.00342 -0.00049 0.00531  177 LEU A CG  
1372 C CD1 . LEU A 177 ? 0.31676 0.32754 0.32641 -0.00259 -0.00105 0.00443  177 LEU A CD1 
1373 C CD2 . LEU A 177 ? 0.30593 0.31807 0.31509 -0.00202 -0.00069 0.00609  177 LEU A CD2 
1374 N N   . GLU A 178 ? 0.26041 0.28477 0.27745 -0.00483 -0.00010 -0.00062 178 GLU A N   
1375 C CA  . GLU A 178 ? 0.33016 0.35814 0.35021 -0.00526 -0.00069 -0.00330 178 GLU A CA  
1376 C C   . GLU A 178 ? 0.26951 0.29867 0.28926 -0.00273 -0.00331 -0.00351 178 GLU A C   
1377 O O   . GLU A 178 ? 0.30732 0.33938 0.32931 -0.00249 -0.00466 -0.00585 178 GLU A O   
1378 C CB  . GLU A 178 ? 0.31042 0.34268 0.33460 -0.00645 0.00025  -0.00598 178 GLU A CB  
1379 C CG  . GLU A 178 ? 0.38029 0.41049 0.40331 -0.00999 0.00337  -0.00616 178 GLU A CG  
1380 C CD  . GLU A 178 ? 0.62011 0.65512 0.64757 -0.01194 0.00516  -0.00964 178 GLU A CD  
1381 O OE1 . GLU A 178 ? 0.55720 0.59764 0.58965 -0.00984 0.00344  -0.01206 178 GLU A OE1 
1382 O OE2 . GLU A 178 ? 0.69560 0.72856 0.72128 -0.01567 0.00825  -0.01024 178 GLU A OE2 
1383 N N   . GLY A 179 ? 0.26149 0.28799 0.27800 -0.00109 -0.00405 -0.00130 179 GLY A N   
1384 C CA  . GLY A 179 ? 0.28331 0.30890 0.29720 0.00064  -0.00618 -0.00113 179 GLY A CA  
1385 C C   . GLY A 179 ? 0.21859 0.24514 0.23267 0.00279  -0.00864 -0.00168 179 GLY A C   
1386 O O   . GLY A 179 ? 0.24987 0.27433 0.26035 0.00420  -0.01094 -0.00151 179 GLY A O   
1387 N N   . ASN A 180 ? 0.25734 0.28634 0.27493 0.00307  -0.00838 -0.00247 180 ASN A N   
1388 C CA  . ASN A 180 ? 0.28454 0.31430 0.30296 0.00556  -0.01110 -0.00338 180 ASN A CA  
1389 C C   . ASN A 180 ? 0.25879 0.28442 0.27312 0.00645  -0.01091 -0.00067 180 ASN A C   
1390 O O   . ASN A 180 ? 0.24389 0.26931 0.25876 0.00526  -0.00846 0.00054  180 ASN A O   
1391 C CB  . ASN A 180 ? 0.28057 0.31578 0.30579 0.00532  -0.01068 -0.00649 180 ASN A CB  
1392 C CG  . ASN A 180 ? 0.33156 0.37142 0.36148 0.00468  -0.01140 -0.01012 180 ASN A CG  
1393 O OD1 . ASN A 180 ? 0.34356 0.38342 0.37280 0.00653  -0.01471 -0.01125 180 ASN A OD1 
1394 N ND2 . ASN A 180 ? 0.29672 0.34005 0.33082 0.00177  -0.00829 -0.01210 180 ASN A ND2 
1395 N N   . PHE A 181 ? 0.25393 0.27565 0.26355 0.00836  -0.01360 0.00020  181 PHE A N   
1396 C CA  . PHE A 181 ? 0.26846 0.28569 0.27373 0.00879  -0.01322 0.00254  181 PHE A CA  
1397 C C   . PHE A 181 ? 0.29297 0.31242 0.30233 0.00966  -0.01303 0.00187  181 PHE A C   
1398 O O   . PHE A 181 ? 0.25347 0.27696 0.26800 0.01095  -0.01459 -0.00079 181 PHE A O   
1399 C CB  . PHE A 181 ? 0.25372 0.26494 0.25187 0.01042  -0.01636 0.00344  181 PHE A CB  
1400 C CG  . PHE A 181 ? 0.27981 0.28645 0.27122 0.00847  -0.01467 0.00523  181 PHE A CG  
1401 C CD1 . PHE A 181 ? 0.27166 0.27462 0.25922 0.00701  -0.01219 0.00713  181 PHE A CD1 
1402 C CD2 . PHE A 181 ? 0.27194 0.27846 0.26138 0.00782  -0.01525 0.00447  181 PHE A CD2 
1403 C CE1 . PHE A 181 ? 0.27651 0.27609 0.25875 0.00477  -0.01004 0.00789  181 PHE A CE1 
1404 C CE2 . PHE A 181 ? 0.25444 0.25718 0.23804 0.00569  -0.01319 0.00551  181 PHE A CE2 
1405 C CZ  . PHE A 181 ? 0.25398 0.25344 0.23419 0.00409  -0.01045 0.00704  181 PHE A CZ  
1406 N N   . TYR A 182 ? 0.23965 0.25704 0.24731 0.00878  -0.01090 0.00378  182 TYR A N   
1407 C CA  . TYR A 182 ? 0.26624 0.28388 0.27570 0.00994  -0.01125 0.00348  182 TYR A CA  
1408 C C   . TYR A 182 ? 0.26766 0.28026 0.27262 0.01239  -0.01466 0.00392  182 TYR A C   
1409 O O   . TYR A 182 ? 0.29768 0.30459 0.29572 0.01197  -0.01502 0.00586  182 TYR A O   
1410 C CB  . TYR A 182 ? 0.28887 0.30546 0.29744 0.00828  -0.00828 0.00527  182 TYR A CB  
1411 C CG  . TYR A 182 ? 0.27828 0.29846 0.29038 0.00627  -0.00573 0.00480  182 TYR A CG  
1412 C CD1 . TYR A 182 ? 0.29427 0.31794 0.31052 0.00588  -0.00487 0.00312  182 TYR A CD1 
1413 C CD2 . TYR A 182 ? 0.28083 0.30026 0.29157 0.00465  -0.00424 0.00580  182 TYR A CD2 
1414 C CE1 . TYR A 182 ? 0.28688 0.31204 0.30433 0.00358  -0.00252 0.00291  182 TYR A CE1 
1415 C CE2 . TYR A 182 ? 0.29864 0.31956 0.31118 0.00298  -0.00252 0.00558  182 TYR A CE2 
1416 C CZ  . TYR A 182 ? 0.31363 0.33684 0.32877 0.00228  -0.00163 0.00436  182 TYR A CZ  
1417 O OH  . TYR A 182 ? 0.27772 0.30072 0.29270 0.00015  0.00011  0.00435  182 TYR A OH  
1418 N N   . GLY A 183 ? 0.29263 0.30687 0.30116 0.01485  -0.01724 0.00182  183 GLY A N   
1419 C CA  . GLY A 183 ? 0.26437 0.27278 0.26832 0.01772  -0.02138 0.00205  183 GLY A CA  
1420 C C   . GLY A 183 ? 0.33796 0.34383 0.33846 0.01936  -0.02530 0.00142  183 GLY A C   
1421 O O   . GLY A 183 ? 0.33596 0.34634 0.33971 0.01860  -0.02501 -0.00004 183 GLY A O   
1422 N N   . PRO A 184 ? 0.30931 0.30704 0.30231 0.02156  -0.02924 0.00252  184 PRO A N   
1423 C CA  . PRO A 184 ? 0.33277 0.32672 0.32123 0.02369  -0.03413 0.00178  184 PRO A CA  
1424 C C   . PRO A 184 ? 0.34006 0.32840 0.31924 0.02105  -0.03274 0.00438  184 PRO A C   
1425 O O   . PRO A 184 ? 0.36772 0.35107 0.34076 0.02253  -0.03687 0.00422  184 PRO A O   
1426 C CB  . PRO A 184 ? 0.33782 0.32364 0.32086 0.02722  -0.03920 0.00205  184 PRO A CB  
1427 C CG  . PRO A 184 ? 0.39831 0.37965 0.37712 0.02497  -0.03542 0.00495  184 PRO A CG  
1428 C CD  . PRO A 184 ? 0.37603 0.36688 0.36390 0.02228  -0.02977 0.00432  184 PRO A CD  
1429 N N   . PHE A 185 ? 0.33924 0.32836 0.31739 0.01729  -0.02728 0.00631  185 PHE A N   
1430 C CA  . PHE A 185 ? 0.33176 0.31489 0.30072 0.01454  -0.02549 0.00838  185 PHE A CA  
1431 C C   . PHE A 185 ? 0.30404 0.29092 0.27455 0.01380  -0.02556 0.00708  185 PHE A C   
1432 O O   . PHE A 185 ? 0.29377 0.28898 0.27346 0.01418  -0.02506 0.00495  185 PHE A O   
1433 C CB  . PHE A 185 ? 0.34417 0.32754 0.31286 0.01108  -0.01989 0.01002  185 PHE A CB  
1434 C CG  . PHE A 185 ? 0.28901 0.26891 0.25637 0.01152  -0.01959 0.01111  185 PHE A CG  
1435 C CD1 . PHE A 185 ? 0.33902 0.30854 0.29606 0.01190  -0.02181 0.01268  185 PHE A CD1 
1436 C CD2 . PHE A 185 ? 0.30330 0.28943 0.27889 0.01151  -0.01735 0.01051  185 PHE A CD2 
1437 C CE1 . PHE A 185 ? 0.41884 0.38466 0.37452 0.01227  -0.02160 0.01356  185 PHE A CE1 
1438 C CE2 . PHE A 185 ? 0.30754 0.29052 0.28199 0.01193  -0.01715 0.01128  185 PHE A CE2 
1439 C CZ  . PHE A 185 ? 0.36311 0.33616 0.32801 0.01235  -0.01923 0.01275  185 PHE A CZ  
1440 N N   . VAL A 186 ? 0.31727 0.29732 0.27797 0.01235  -0.02594 0.00824  186 VAL A N   
1441 C CA  . VAL A 186 ? 0.31850 0.30069 0.27888 0.01145  -0.02609 0.00707  186 VAL A CA  
1442 C C   . VAL A 186 ? 0.32915 0.30799 0.28325 0.00736  -0.02144 0.00838  186 VAL A C   
1443 O O   . VAL A 186 ? 0.33460 0.30645 0.28077 0.00545  -0.01962 0.01016  186 VAL A O   
1444 C CB  . VAL A 186 ? 0.31375 0.29086 0.26807 0.01426  -0.03238 0.00623  186 VAL A CB  
1445 C CG1 . VAL A 186 ? 0.36144 0.34444 0.32501 0.01838  -0.03681 0.00354  186 VAL A CG1 
1446 C CG2 . VAL A 186 ? 0.41556 0.37972 0.35568 0.01422  -0.03461 0.00871  186 VAL A CG2 
1447 N N   . ASP A 187 ? 0.31547 0.29944 0.27346 0.00583  -0.01934 0.00703  187 ASP A N   
1448 C CA  . ASP A 187 ? 0.28638 0.26894 0.24070 0.00210  -0.01472 0.00726  187 ASP A CA  
1449 C C   . ASP A 187 ? 0.33645 0.31088 0.27867 0.00078  -0.01612 0.00754  187 ASP A C   
1450 O O   . ASP A 187 ? 0.35711 0.33282 0.29849 -0.00015 -0.01599 0.00619  187 ASP A O   
1451 C CB  . ASP A 187 ? 0.28429 0.27512 0.24794 0.00120  -0.01199 0.00557  187 ASP A CB  
1452 C CG  . ASP A 187 ? 0.29003 0.28501 0.25789 0.00292  -0.01502 0.00380  187 ASP A CG  
1453 O OD1 . ASP A 187 ? 0.33587 0.32900 0.30156 0.00537  -0.01962 0.00343  187 ASP A OD1 
1454 O OD2 . ASP A 187 ? 0.29068 0.29076 0.26435 0.00184  -0.01290 0.00245  187 ASP A OD2 
1455 N N   . ARG A 188 ? 0.34281 0.30782 0.27452 0.00047  -0.01743 0.00937  188 ARG A N   
1456 C CA  . ARG A 188 ? 0.32359 0.27846 0.24098 -0.00160 -0.01823 0.01006  188 ARG A CA  
1457 C C   . ARG A 188 ? 0.39983 0.34518 0.30707 -0.00403 -0.01624 0.01210  188 ARG A C   
1458 O O   . ARG A 188 ? 0.34099 0.28662 0.25164 -0.00264 -0.01652 0.01311  188 ARG A O   
1459 C CB  . ARG A 188 ? 0.37519 0.32574 0.28739 0.00193  -0.02537 0.00991  188 ARG A CB  
1460 C CG  . ARG A 188 ? 0.49235 0.43991 0.40481 0.00621  -0.03087 0.01076  188 ARG A CG  
1461 C CD  . ARG A 188 ? 0.58380 0.53035 0.49534 0.01047  -0.03841 0.00933  188 ARG A CD  
1462 N NE  . ARG A 188 ? 0.57459 0.53197 0.49696 0.01100  -0.03807 0.00657  188 ARG A NE  
1463 C CZ  . ARG A 188 ? 0.62062 0.57690 0.53897 0.01101  -0.04056 0.00522  188 ARG A CZ  
1464 N NH1 . ARG A 188 ? 0.67405 0.61862 0.57728 0.01083  -0.04417 0.00637  188 ARG A NH1 
1465 N NH2 . ARG A 188 ? 0.52143 0.48788 0.45042 0.01104  -0.03949 0.00262  188 ARG A NH2 
1466 N N   . GLN A 189 ? 0.39468 0.33129 0.28896 -0.00808 -0.01390 0.01247  189 GLN A N   
1467 C CA  . GLN A 189 ? 0.43435 0.36113 0.31761 -0.01182 -0.01073 0.01399  189 GLN A CA  
1468 C C   . GLN A 189 ? 0.40580 0.31885 0.27487 -0.00985 -0.01675 0.01649  189 GLN A C   
1469 O O   . GLN A 189 ? 0.48631 0.38717 0.33917 -0.01248 -0.01744 0.01749  189 GLN A O   
1470 C CB  . GLN A 189 ? 0.42926 0.35346 0.30560 -0.01788 -0.00445 0.01254  189 GLN A CB  
1471 C CG  . GLN A 189 ? 0.39924 0.31500 0.26588 -0.02297 0.00050  0.01318  189 GLN A CG  
1472 C CD  . GLN A 189 ? 0.42155 0.33859 0.28589 -0.02915 0.00787  0.01037  189 GLN A CD  
1473 O OE1 . GLN A 189 ? 0.45254 0.38132 0.32965 -0.02922 0.01087  0.00756  189 GLN A OE1 
1474 N NE2 . GLN A 189 ? 0.42036 0.32486 0.26805 -0.03450 0.01080  0.01083  189 GLN A NE2 
1475 N N   . THR A 190 ? 0.38434 0.29908 0.25948 -0.00507 -0.02135 0.01731  190 THR A N   
1476 C CA  . THR A 190 ? 0.41618 0.31887 0.28049 -0.00196 -0.02802 0.01929  190 THR A CA  
1477 C C   . THR A 190 ? 0.41785 0.31843 0.28393 -0.00161 -0.02694 0.02058  190 THR A C   
1478 O O   . THR A 190 ? 0.40910 0.31967 0.28727 -0.00260 -0.02221 0.01969  190 THR A O   
1479 C CB  . THR A 190 ? 0.47998 0.38712 0.35107 0.00447  -0.03591 0.01807  190 THR A CB  
1480 O OG1 . THR A 190 ? 0.44878 0.37072 0.33855 0.00698  -0.03471 0.01626  190 THR A OG1 
1481 C CG2 . THR A 190 ? 0.48676 0.39451 0.35456 0.00427  -0.03779 0.01675  190 THR A CG2 
1482 N N   . ALA A 191 ? 0.45571 0.34249 0.30912 0.00001  -0.03186 0.02263  191 ALA A N   
1483 C CA  . ALA A 191 ? 0.44764 0.33074 0.30141 0.00068  -0.03168 0.02387  191 ALA A CA  
1484 C C   . ALA A 191 ? 0.49235 0.38879 0.36439 0.00587  -0.03397 0.02216  191 ALA A C   
1485 O O   . ALA A 191 ? 0.50747 0.40530 0.38335 0.01143  -0.04093 0.02116  191 ALA A O   
1486 C CB  . ALA A 191 ? 0.47767 0.34215 0.31365 0.00216  -0.03776 0.02630  191 ALA A CB  
1487 N N   . GLN A 192 ? 0.41366 0.32010 0.29709 0.00395  -0.02814 0.02140  192 GLN A N   
1488 C CA  . GLN A 192 ? 0.39049 0.30878 0.28992 0.00781  -0.02922 0.01984  192 GLN A CA  
1489 C C   . GLN A 192 ? 0.51273 0.43026 0.41379 0.00596  -0.02540 0.02063  192 GLN A C   
1490 O O   . GLN A 192 ? 0.47324 0.38850 0.37002 0.00088  -0.01953 0.02124  192 GLN A O   
1491 C CB  . GLN A 192 ? 0.36970 0.30287 0.28302 0.00753  -0.02618 0.01770  192 GLN A CB  
1492 C CG  . GLN A 192 ? 0.36430 0.29916 0.27704 0.00912  -0.02961 0.01654  192 GLN A CG  
1493 C CD  . GLN A 192 ? 0.42933 0.37760 0.35483 0.00842  -0.02633 0.01452  192 GLN A CD  
1494 O OE1 . GLN A 192 ? 0.37164 0.32948 0.30949 0.01075  -0.02671 0.01301  192 GLN A OE1 
1495 N NE2 . GLN A 192 ? 0.34703 0.29545 0.26908 0.00496  -0.02295 0.01432  192 GLN A NE2 
1496 N N   . ALA A 193 ? 0.46042 0.37994 0.36783 0.00999  -0.02874 0.02015  193 ALA A N   
1497 C CA  . ALA A 193 ? 0.46443 0.38219 0.37269 0.00872  -0.02599 0.02082  193 ALA A CA  
1498 C C   . ALA A 193 ? 0.47626 0.40650 0.40025 0.01185  -0.02618 0.01885  193 ALA A C   
1499 O O   . ALA A 193 ? 0.51496 0.44992 0.44558 0.01633  -0.03085 0.01715  193 ALA A O   
1500 C CB  . ALA A 193 ? 0.50613 0.40847 0.40137 0.01005  -0.03029 0.02264  193 ALA A CB  
1501 N N   . ALA A 194 ? 0.43389 0.36954 0.36373 0.00923  -0.02098 0.01868  194 ALA A N   
1502 C CA  . ALA A 194 ? 0.46225 0.40790 0.40488 0.01159  -0.02083 0.01701  194 ALA A CA  
1503 C C   . ALA A 194 ? 0.50224 0.44239 0.44363 0.01528  -0.02528 0.01681  194 ALA A C   
1504 O O   . ALA A 194 ? 0.44661 0.37463 0.37706 0.01480  -0.02673 0.01850  194 ALA A O   
1505 C CB  . ALA A 194 ? 0.42868 0.37992 0.37632 0.00799  -0.01483 0.01692  194 ALA A CB  
1506 N N   . GLY A 195 ? 0.44456 0.39333 0.39704 0.01880  -0.02732 0.01446  195 GLY A N   
1507 C CA  . GLY A 195 ? 0.47442 0.42013 0.42836 0.02228  -0.03083 0.01343  195 GLY A CA  
1508 C C   . GLY A 195 ? 0.42288 0.36787 0.37727 0.01980  -0.02671 0.01419  195 GLY A C   
1509 O O   . GLY A 195 ? 0.36651 0.31171 0.31858 0.01542  -0.02163 0.01558  195 GLY A O   
1510 N N   . THR A 196 ? 0.37419 0.31880 0.33236 0.02283  -0.02912 0.01270  196 THR A N   
1511 C CA  . THR A 196 ? 0.35485 0.29889 0.31399 0.02093  -0.02577 0.01299  196 THR A CA  
1512 C C   . THR A 196 ? 0.41056 0.36579 0.37802 0.01777  -0.02013 0.01243  196 THR A C   
1513 O O   . THR A 196 ? 0.40165 0.36700 0.37829 0.01884  -0.01983 0.01052  196 THR A O   
1514 C CB  . THR A 196 ? 0.38255 0.32678 0.34684 0.02517  -0.02939 0.01062  196 THR A CB  
1515 O OG1 . THR A 196 ? 0.40408 0.33688 0.36028 0.02874  -0.03561 0.01099  196 THR A OG1 
1516 C CG2 . THR A 196 ? 0.37342 0.31667 0.33832 0.02315  -0.02599 0.01082  196 THR A CG2 
1517 N N   . ASP A 197 ? 0.36663 0.31962 0.33060 0.01377  -0.01580 0.01385  197 ASP A N   
1518 C CA  . ASP A 197 ? 0.38827 0.35098 0.35983 0.01129  -0.01131 0.01310  197 ASP A CA  
1519 C C   . ASP A 197 ? 0.42824 0.39504 0.40631 0.01267  -0.01115 0.01141  197 ASP A C   
1520 O O   . ASP A 197 ? 0.48328 0.44610 0.45902 0.01140  -0.00978 0.01166  197 ASP A O   
1521 C CB  . ASP A 197 ? 0.50790 0.46810 0.47493 0.00673  -0.00700 0.01429  197 ASP A CB  
1522 C CG  . ASP A 197 ? 0.60486 0.57507 0.57969 0.00484  -0.00352 0.01330  197 ASP A CG  
1523 O OD1 . ASP A 197 ? 0.46046 0.43796 0.44143 0.00635  -0.00428 0.01252  197 ASP A OD1 
1524 O OD2 . ASP A 197 ? 0.61141 0.58180 0.58607 0.00187  -0.00026 0.01307  197 ASP A OD2 
1525 N N   . THR A 198 ? 0.36643 0.34120 0.35258 0.01496  -0.01231 0.00938  198 THR A N   
1526 C CA  . THR A 198 ? 0.33028 0.30969 0.32295 0.01620  -0.01204 0.00718  198 THR A CA  
1527 C C   . THR A 198 ? 0.35220 0.33811 0.34877 0.01321  -0.00787 0.00710  198 THR A C   
1528 O O   . THR A 198 ? 0.39911 0.38903 0.39673 0.01145  -0.00614 0.00778  198 THR A O   
1529 C CB  . THR A 198 ? 0.36149 0.34653 0.36087 0.01945  -0.01476 0.00438  198 THR A CB  
1530 O OG1 . THR A 198 ? 0.42683 0.40512 0.42245 0.02285  -0.01962 0.00416  198 THR A OG1 
1531 C CG2 . THR A 198 ? 0.39068 0.38138 0.39721 0.02023  -0.01383 0.00143  198 THR A CG2 
1532 N N   . THR A 199 ? 0.32918 0.31547 0.32747 0.01280  -0.00665 0.00617  199 THR A N   
1533 C CA  . THR A 199 ? 0.29542 0.28687 0.29664 0.01030  -0.00344 0.00591  199 THR A CA  
1534 C C   . THR A 199 ? 0.28563 0.28462 0.29305 0.01084  -0.00296 0.00385  199 THR A C   
1535 O O   . THR A 199 ? 0.30124 0.30178 0.31209 0.01296  -0.00433 0.00158  199 THR A O   
1536 C CB  . THR A 199 ? 0.35008 0.33817 0.34975 0.00933  -0.00234 0.00566  199 THR A CB  
1537 O OG1 . THR A 199 ? 0.35358 0.33440 0.34686 0.00780  -0.00195 0.00740  199 THR A OG1 
1538 C CG2 . THR A 199 ? 0.37510 0.36845 0.37775 0.00714  0.00024  0.00505  199 THR A CG2 
1539 N N   . ILE A 200 ? 0.28814 0.29143 0.29676 0.00879  -0.00101 0.00432  200 ILE A N   
1540 C CA  . ILE A 200 ? 0.25643 0.26553 0.26902 0.00837  -0.00005 0.00266  200 ILE A CA  
1541 C C   . ILE A 200 ? 0.28291 0.29338 0.29664 0.00744  0.00144  0.00122  200 ILE A C   
1542 O O   . ILE A 200 ? 0.26829 0.27906 0.28045 0.00552  0.00276  0.00202  200 ILE A O   
1543 C CB  . ILE A 200 ? 0.26876 0.28008 0.28069 0.00661  0.00096  0.00396  200 ILE A CB  
1544 C CG1 . ILE A 200 ? 0.28526 0.29493 0.29568 0.00734  -0.00034 0.00529  200 ILE A CG1 
1545 C CG2 . ILE A 200 ? 0.29291 0.30866 0.30740 0.00567  0.00211  0.00232  200 ILE A CG2 
1546 C CD1 . ILE A 200 ? 0.31670 0.32689 0.32570 0.00567  0.00057  0.00680  200 ILE A CD1 
1547 N N   . THR A 201 ? 0.25305 0.26452 0.26976 0.00894  0.00097  -0.00130 201 THR A N   
1548 C CA  . THR A 201 ? 0.26736 0.27938 0.28491 0.00828  0.00226  -0.00300 201 THR A CA  
1549 C C   . THR A 201 ? 0.25429 0.26965 0.27134 0.00553  0.00465  -0.00343 201 THR A C   
1550 O O   . THR A 201 ? 0.24903 0.26331 0.26400 0.00415  0.00557  -0.00316 201 THR A O   
1551 C CB  . THR A 201 ? 0.28613 0.29963 0.30814 0.01058  0.00129  -0.00643 201 THR A CB  
1552 O OG1 . THR A 201 ? 0.29452 0.30346 0.31573 0.01351  -0.00184 -0.00581 201 THR A OG1 
1553 C CG2 . THR A 201 ? 0.24926 0.26272 0.27202 0.01007  0.00256  -0.00839 201 THR A CG2 
1554 N N   . VAL A 202 ? 0.23570 0.25447 0.25402 0.00456  0.00554  -0.00422 202 VAL A N   
1555 C CA  . VAL A 202 ? 0.23882 0.25903 0.25488 0.00163  0.00773  -0.00456 202 VAL A CA  
1556 C C   . VAL A 202 ? 0.26502 0.28231 0.27645 0.00048  0.00720  -0.00153 202 VAL A C   
1557 O O   . VAL A 202 ? 0.23663 0.25297 0.24478 -0.00136 0.00799  -0.00148 202 VAL A O   
1558 C CB  . VAL A 202 ? 0.30098 0.32455 0.31872 0.00035  0.00905  -0.00611 202 VAL A CB  
1559 C CG1 . VAL A 202 ? 0.32330 0.34624 0.34059 0.00108  0.00759  -0.00383 202 VAL A CG1 
1560 C CG2 . VAL A 202 ? 0.27695 0.30041 0.29068 -0.00324 0.01162  -0.00667 202 VAL A CG2 
1561 N N   . ASN A 203 ? 0.26095 0.27668 0.27204 0.00160  0.00567  0.00064  203 ASN A N   
1562 C CA  . ASN A 203 ? 0.23979 0.25365 0.24805 0.00082  0.00500  0.00264  203 ASN A CA  
1563 C C   . ASN A 203 ? 0.25866 0.27090 0.26632 0.00081  0.00477  0.00251  203 ASN A C   
1564 O O   . ASN A 203 ? 0.22917 0.24083 0.23489 -0.00017 0.00438  0.00278  203 ASN A O   
1565 C CB  . ASN A 203 ? 0.24430 0.25755 0.25291 0.00168  0.00397  0.00427  203 ASN A CB  
1566 C CG  . ASN A 203 ? 0.23928 0.25393 0.24795 0.00127  0.00407  0.00454  203 ASN A CG  
1567 O OD1 . ASN A 203 ? 0.24805 0.26406 0.25650 0.00011  0.00518  0.00339  203 ASN A OD1 
1568 N ND2 . ASN A 203 ? 0.30120 0.31540 0.30995 0.00184  0.00324  0.00580  203 ASN A ND2 
1569 N N   . VAL A 204 ? 0.25766 0.26869 0.26674 0.00194  0.00472  0.00195  204 VAL A N   
1570 C CA  . VAL A 204 ? 0.27239 0.28172 0.28093 0.00153  0.00490  0.00143  204 VAL A CA  
1571 C C   . VAL A 204 ? 0.28802 0.29851 0.29577 0.00043  0.00562  -0.00007 204 VAL A C   
1572 O O   . VAL A 204 ? 0.23267 0.24268 0.23908 -0.00053 0.00535  -0.00023 204 VAL A O   
1573 C CB  . VAL A 204 ? 0.23364 0.24010 0.24279 0.00284  0.00466  0.00102  204 VAL A CB  
1574 C CG1 . VAL A 204 ? 0.27001 0.27439 0.27846 0.00200  0.00519  0.00024  204 VAL A CG1 
1575 C CG2 . VAL A 204 ? 0.29462 0.29848 0.30260 0.00349  0.00389  0.00268  204 VAL A CG2 
1576 N N   . LEU A 205 ? 0.27464 0.28684 0.28325 0.00039  0.00659  -0.00160 205 LEU A N   
1577 C CA  . LEU A 205 ? 0.27619 0.28910 0.28305 -0.00122 0.00779  -0.00327 205 LEU A CA  
1578 C C   . LEU A 205 ? 0.23524 0.24724 0.23766 -0.00296 0.00733  -0.00204 205 LEU A C   
1579 O O   . LEU A 205 ? 0.24789 0.25861 0.24733 -0.00405 0.00704  -0.00250 205 LEU A O   
1580 C CB  . LEU A 205 ? 0.23396 0.24946 0.24307 -0.00141 0.00947  -0.00580 205 LEU A CB  
1581 C CG  . LEU A 205 ? 0.23326 0.24928 0.24688 0.00077  0.00927  -0.00791 205 LEU A CG  
1582 C CD1 . LEU A 205 ? 0.25234 0.27222 0.26989 0.00092  0.01059  -0.01110 205 LEU A CD1 
1583 C CD2 . LEU A 205 ? 0.27641 0.29093 0.28942 0.00050  0.00966  -0.00921 205 LEU A CD2 
1584 N N   . ALA A 206 ? 0.24541 0.25746 0.24693 -0.00309 0.00687  -0.00056 206 ALA A N   
1585 C CA  . ALA A 206 ? 0.26329 0.27313 0.26000 -0.00432 0.00572  0.00073  206 ALA A CA  
1586 C C   . ALA A 206 ? 0.25535 0.26400 0.25180 -0.00352 0.00348  0.00132  206 ALA A C   
1587 O O   . ALA A 206 ? 0.24289 0.24942 0.23529 -0.00428 0.00209  0.00120  206 ALA A O   
1588 C CB  . ALA A 206 ? 0.24532 0.25509 0.24177 -0.00425 0.00539  0.00218  206 ALA A CB  
1589 N N   . TRP A 207 ? 0.24559 0.25540 0.24614 -0.00215 0.00309  0.00161  207 TRP A N   
1590 C CA  . TRP A 207 ? 0.27850 0.28823 0.28020 -0.00176 0.00151  0.00133  207 TRP A CA  
1591 C C   . TRP A 207 ? 0.27891 0.28842 0.28039 -0.00232 0.00165  -0.00033 207 TRP A C   
1592 O O   . TRP A 207 ? 0.26866 0.27808 0.26976 -0.00239 -0.00015 -0.00117 207 TRP A O   
1593 C CB  . TRP A 207 ? 0.28161 0.29220 0.28694 -0.00101 0.00196  0.00179  207 TRP A CB  
1594 C CG  . TRP A 207 ? 0.26799 0.27921 0.27575 -0.00123 0.00154  0.00065  207 TRP A CG  
1595 C CD1 . TRP A 207 ? 0.29799 0.31051 0.30737 -0.00103 -0.00010 -0.00009 207 TRP A CD1 
1596 C CD2 . TRP A 207 ? 0.25990 0.27052 0.26916 -0.00186 0.00296  -0.00039 207 TRP A CD2 
1597 N NE1 . TRP A 207 ? 0.29492 0.30861 0.30743 -0.00179 0.00058  -0.00196 207 TRP A NE1 
1598 C CE2 . TRP A 207 ? 0.29800 0.31005 0.30988 -0.00255 0.00261  -0.00193 207 TRP A CE2 
1599 C CE3 . TRP A 207 ? 0.33311 0.34181 0.34180 -0.00191 0.00438  -0.00047 207 TRP A CE3 
1600 C CZ2 . TRP A 207 ? 0.33701 0.34844 0.35038 -0.00391 0.00421  -0.00343 207 TRP A CZ2 
1601 C CZ3 . TRP A 207 ? 0.35999 0.36711 0.36945 -0.00287 0.00547  -0.00152 207 TRP A CZ3 
1602 C CH2 . TRP A 207 ? 0.33145 0.33983 0.34295 -0.00416 0.00566  -0.00292 207 TRP A CH2 
1603 N N   . LEU A 208 ? 0.26285 0.27240 0.26486 -0.00256 0.00350  -0.00120 208 LEU A N   
1604 C CA  . LEU A 208 ? 0.24256 0.25171 0.24392 -0.00326 0.00378  -0.00296 208 LEU A CA  
1605 C C   . LEU A 208 ? 0.28309 0.29106 0.27943 -0.00445 0.00290  -0.00340 208 LEU A C   
1606 O O   . LEU A 208 ? 0.26689 0.27423 0.26182 -0.00490 0.00169  -0.00459 208 LEU A O   
1607 C CB  . LEU A 208 ? 0.25489 0.26405 0.25807 -0.00298 0.00575  -0.00410 208 LEU A CB  
1608 C CG  . LEU A 208 ? 0.26895 0.27701 0.27516 -0.00193 0.00612  -0.00383 208 LEU A CG  
1609 C CD1 . LEU A 208 ? 0.27857 0.28585 0.28619 -0.00104 0.00717  -0.00522 208 LEU A CD1 
1610 C CD2 . LEU A 208 ? 0.26456 0.27175 0.27147 -0.00269 0.00579  -0.00446 208 LEU A CD2 
1611 N N   . TYR A 209 ? 0.26307 0.27018 0.25601 -0.00523 0.00349  -0.00260 209 TYR A N   
1612 C CA  . TYR A 209 ? 0.26193 0.26602 0.24790 -0.00681 0.00252  -0.00258 209 TYR A CA  
1613 C C   . TYR A 209 ? 0.27530 0.27741 0.25921 -0.00586 -0.00130 -0.00162 209 TYR A C   
1614 O O   . TYR A 209 ? 0.27171 0.27126 0.25108 -0.00630 -0.00348 -0.00228 209 TYR A O   
1615 C CB  . TYR A 209 ? 0.25066 0.25360 0.23299 -0.00843 0.00441  -0.00202 209 TYR A CB  
1616 C CG  . TYR A 209 ? 0.24994 0.25467 0.23302 -0.01000 0.00799  -0.00427 209 TYR A CG  
1617 C CD1 . TYR A 209 ? 0.28889 0.29191 0.26723 -0.01208 0.00909  -0.00603 209 TYR A CD1 
1618 C CD2 . TYR A 209 ? 0.27872 0.28695 0.26746 -0.00930 0.01006  -0.00509 209 TYR A CD2 
1619 C CE1 . TYR A 209 ? 0.26626 0.27153 0.24610 -0.01359 0.01263  -0.00884 209 TYR A CE1 
1620 C CE2 . TYR A 209 ? 0.27839 0.28902 0.26918 -0.01038 0.01304  -0.00802 209 TYR A CE2 
1621 C CZ  . TYR A 209 ? 0.29785 0.30725 0.28449 -0.01261 0.01455  -0.01002 209 TYR A CZ  
1622 O OH  . TYR A 209 ? 0.32189 0.33428 0.31139 -0.01376 0.01778  -0.01364 209 TYR A OH  
1623 N N   . ALA A 210 ? 0.26738 0.27068 0.25478 -0.00439 -0.00243 -0.00043 210 ALA A N   
1624 C CA  . ALA A 210 ? 0.24334 0.24568 0.23065 -0.00303 -0.00626 -0.00036 210 ALA A CA  
1625 C C   . ALA A 210 ? 0.22568 0.22994 0.21630 -0.00245 -0.00770 -0.00255 210 ALA A C   
1626 O O   . ALA A 210 ? 0.31331 0.31606 0.30193 -0.00167 -0.01140 -0.00349 210 ALA A O   
1627 C CB  . ALA A 210 ? 0.25380 0.25811 0.24571 -0.00171 -0.00648 0.00058  210 ALA A CB  
1628 N N   . ALA A 211 ? 0.23179 0.23891 0.22723 -0.00281 -0.00508 -0.00359 211 ALA A N   
1629 C CA  . ALA A 211 ? 0.22843 0.23733 0.22713 -0.00281 -0.00586 -0.00599 211 ALA A CA  
1630 C C   . ALA A 211 ? 0.27304 0.27979 0.26674 -0.00359 -0.00714 -0.00714 211 ALA A C   
1631 O O   . ALA A 211 ? 0.31774 0.32483 0.31182 -0.00308 -0.01014 -0.00902 211 ALA A O   
1632 C CB  . ALA A 211 ? 0.28898 0.29967 0.29228 -0.00342 -0.00255 -0.00657 211 ALA A CB  
1633 N N   . VAL A 212 ? 0.27361 0.27836 0.26279 -0.00492 -0.00489 -0.00647 212 VAL A N   
1634 C CA  . VAL A 212 ? 0.28935 0.29150 0.27253 -0.00618 -0.00560 -0.00762 212 VAL A CA  
1635 C C   . VAL A 212 ? 0.33049 0.32848 0.30683 -0.00580 -0.00991 -0.00697 212 VAL A C   
1636 O O   . VAL A 212 ? 0.33466 0.33115 0.30824 -0.00561 -0.01297 -0.00851 212 VAL A O   
1637 C CB  . VAL A 212 ? 0.27832 0.27949 0.25827 -0.00801 -0.00182 -0.00752 212 VAL A CB  
1638 C CG1 . VAL A 212 ? 0.33344 0.33106 0.30541 -0.00992 -0.00227 -0.00865 212 VAL A CG1 
1639 C CG2 . VAL A 212 ? 0.30636 0.31077 0.29288 -0.00775 0.00129  -0.00873 212 VAL A CG2 
1640 N N   . ILE A 213 ? 0.29907 0.29457 0.27220 -0.00556 -0.01058 -0.00477 213 ILE A N   
1641 C CA  . ILE A 213 ? 0.32560 0.31542 0.29103 -0.00501 -0.01513 -0.00383 213 ILE A CA  
1642 C C   . ILE A 213 ? 0.37483 0.36625 0.34453 -0.00235 -0.02015 -0.00562 213 ILE A C   
1643 O O   . ILE A 213 ? 0.39338 0.38025 0.35690 -0.00157 -0.02492 -0.00619 213 ILE A O   
1644 C CB  . ILE A 213 ? 0.35531 0.34255 0.31811 -0.00508 -0.01472 -0.00131 213 ILE A CB  
1645 C CG1 . ILE A 213 ? 0.31594 0.30101 0.27323 -0.00822 -0.01016 -0.00035 213 ILE A CG1 
1646 C CG2 . ILE A 213 ? 0.38538 0.36632 0.34141 -0.00370 -0.02029 -0.00036 213 ILE A CG2 
1647 C CD1 . ILE A 213 ? 0.30736 0.29134 0.26395 -0.00867 -0.00873 0.00164  213 ILE A CD1 
1648 N N   . ASN A 214 ? 0.39805 0.39574 0.37812 -0.00108 -0.01922 -0.00695 214 ASN A N   
1649 C CA  . ASN A 214 ? 0.38728 0.38817 0.37356 0.00107  -0.02317 -0.00969 214 ASN A CA  
1650 C C   . ASN A 214 ? 0.41861 0.42259 0.40836 0.00052  -0.02315 -0.01282 214 ASN A C   
1651 O O   . ASN A 214 ? 0.49764 0.50537 0.49382 0.00194  -0.02598 -0.01597 214 ASN A O   
1652 C CB  . ASN A 214 ? 0.38659 0.39257 0.38194 0.00199  -0.02159 -0.01007 214 ASN A CB  
1653 C CG  . ASN A 214 ? 0.46200 0.46555 0.45567 0.00368  -0.02428 -0.00852 214 ASN A CG  
1654 O OD1 . ASN A 214 ? 0.53832 0.54336 0.53603 0.00595  -0.02839 -0.01064 214 ASN A OD1 
1655 N ND2 . ASN A 214 ? 0.48874 0.48867 0.47683 0.00262  -0.02208 -0.00526 214 ASN A ND2 
1656 N N   . GLY A 215 ? 0.32953 0.33238 0.31580 -0.00157 -0.01997 -0.01254 215 GLY A N   
1657 C CA  . GLY A 215 ? 0.38827 0.39340 0.37711 -0.00226 -0.01993 -0.01553 215 GLY A CA  
1658 C C   . GLY A 215 ? 0.31744 0.32753 0.31478 -0.00327 -0.01567 -0.01694 215 GLY A C   
1659 O O   . GLY A 215 ? 0.34967 0.36184 0.35001 -0.00399 -0.01557 -0.01979 215 GLY A O   
1660 N N   . ASP A 216 ? 0.31938 0.33068 0.31991 -0.00349 -0.01228 -0.01507 216 ASP A N   
1661 C CA  . ASP A 216 ? 0.38387 0.39781 0.39040 -0.00462 -0.00829 -0.01588 216 ASP A CA  
1662 C C   . ASP A 216 ? 0.38568 0.39730 0.38889 -0.00577 -0.00488 -0.01462 216 ASP A C   
1663 O O   . ASP A 216 ? 0.52497 0.53536 0.52673 -0.00564 -0.00288 -0.01229 216 ASP A O   
1664 C CB  . ASP A 216 ? 0.42776 0.44333 0.43842 -0.00415 -0.00698 -0.01465 216 ASP A CB  
1665 C CG  . ASP A 216 ? 0.58399 0.60314 0.60180 -0.00507 -0.00575 -0.01745 216 ASP A CG  
1666 O OD1 . ASP A 216 ? 0.60374 0.62402 0.62366 -0.00629 -0.00528 -0.02018 216 ASP A OD1 
1667 O OD2 . ASP A 216 ? 0.49840 0.51913 0.51955 -0.00494 -0.00495 -0.01717 216 ASP A OD2 
1668 N N   . ARG A 217 ? 0.34121 0.35253 0.34374 -0.00681 -0.00436 -0.01667 217 ARG A N   
1669 C CA  . ARG A 217 ? 0.35372 0.36292 0.35276 -0.00770 -0.00182 -0.01633 217 ARG A CA  
1670 C C   . ARG A 217 ? 0.39990 0.40917 0.40260 -0.00851 0.00115  -0.01772 217 ARG A C   
1671 O O   . ARG A 217 ? 0.36466 0.37249 0.36546 -0.00895 0.00307  -0.01811 217 ARG A O   
1672 C CB  . ARG A 217 ? 0.44029 0.44766 0.43319 -0.00840 -0.00371 -0.01753 217 ARG A CB  
1673 C CG  . ARG A 217 ? 0.50959 0.51406 0.49536 -0.00819 -0.00585 -0.01559 217 ARG A CG  
1674 C CD  . ARG A 217 ? 0.49249 0.49370 0.47044 -0.00929 -0.00791 -0.01686 217 ARG A CD  
1675 N NE  . ARG A 217 ? 0.51570 0.51781 0.49505 -0.00840 -0.01207 -0.01911 217 ARG A NE  
1676 C CZ  . ARG A 217 ? 0.58483 0.58866 0.56676 -0.00909 -0.01186 -0.02202 217 ARG A CZ  
1677 N NH1 . ARG A 217 ? 0.59138 0.59557 0.57419 -0.01059 -0.00781 -0.02291 217 ARG A NH1 
1678 N NH2 . ARG A 217 ? 0.50044 0.50579 0.48456 -0.00814 -0.01601 -0.02449 217 ARG A NH2 
1679 N N   . TRP A 218 ? 0.34816 0.35863 0.35579 -0.00893 0.00174  -0.01874 218 TRP A N   
1680 C CA  . TRP A 218 ? 0.39278 0.40182 0.40245 -0.01011 0.00422  -0.02029 218 TRP A CA  
1681 C C   . TRP A 218 ? 0.33875 0.34473 0.34743 -0.00948 0.00661  -0.01858 218 TRP A C   
1682 O O   . TRP A 218 ? 0.35633 0.36004 0.36507 -0.00993 0.00814  -0.01987 218 TRP A O   
1683 C CB  . TRP A 218 ? 0.39977 0.40989 0.41400 -0.01140 0.00497  -0.02172 218 TRP A CB  
1684 C CG  . TRP A 218 ? 0.37601 0.38576 0.39155 -0.01113 0.00597  -0.01959 218 TRP A CG  
1685 C CD1 . TRP A 218 ? 0.33567 0.34847 0.35340 -0.01064 0.00448  -0.01943 218 TRP A CD1 
1686 C CD2 . TRP A 218 ? 0.38293 0.38862 0.39735 -0.01128 0.00842  -0.01761 218 TRP A CD2 
1687 N NE1 . TRP A 218 ? 0.33537 0.34660 0.35335 -0.01081 0.00630  -0.01748 218 TRP A NE1 
1688 C CE2 . TRP A 218 ? 0.36481 0.37136 0.38031 -0.01119 0.00855  -0.01619 218 TRP A CE2 
1689 C CE3 . TRP A 218 ? 0.33913 0.34007 0.35150 -0.01126 0.01010  -0.01708 218 TRP A CE3 
1690 C CZ2 . TRP A 218 ? 0.39279 0.39529 0.40652 -0.01129 0.01031  -0.01405 218 TRP A CZ2 
1691 C CZ3 . TRP A 218 ? 0.32447 0.32106 0.33522 -0.01096 0.01133  -0.01495 218 TRP A CZ3 
1692 C CH2 . TRP A 218 ? 0.38508 0.38232 0.39610 -0.01110 0.01145  -0.01336 218 TRP A CH2 
1693 N N   . PHE A 219 ? 0.32535 0.33117 0.33337 -0.00824 0.00664  -0.01602 219 PHE A N   
1694 C CA  . PHE A 219 ? 0.29407 0.29733 0.30198 -0.00717 0.00819  -0.01475 219 PHE A CA  
1695 C C   . PHE A 219 ? 0.29461 0.29828 0.30090 -0.00648 0.00867  -0.01539 219 PHE A C   
1696 O O   . PHE A 219 ? 0.39552 0.39767 0.40279 -0.00525 0.00962  -0.01534 219 PHE A O   
1697 C CB  . PHE A 219 ? 0.31658 0.31979 0.32489 -0.00624 0.00794  -0.01217 219 PHE A CB  
1698 C CG  . PHE A 219 ? 0.28023 0.28624 0.28732 -0.00576 0.00649  -0.01098 219 PHE A CG  
1699 C CD1 . PHE A 219 ? 0.33562 0.34209 0.34088 -0.00505 0.00673  -0.01033 219 PHE A CD1 
1700 C CD2 . PHE A 219 ? 0.30122 0.30919 0.30903 -0.00614 0.00488  -0.01094 219 PHE A CD2 
1701 C CE1 . PHE A 219 ? 0.32304 0.33079 0.32596 -0.00508 0.00556  -0.00915 219 PHE A CE1 
1702 C CE2 . PHE A 219 ? 0.34243 0.35165 0.34831 -0.00551 0.00310  -0.00977 219 PHE A CE2 
1703 C CZ  . PHE A 219 ? 0.30563 0.31419 0.30841 -0.00516 0.00352  -0.00863 219 PHE A CZ  
1704 N N   . LEU A 220 ? 0.34947 0.35490 0.35309 -0.00730 0.00798  -0.01628 220 LEU A N   
1705 C CA  . LEU A 220 ? 0.32408 0.32984 0.32575 -0.00755 0.00928  -0.01764 220 LEU A CA  
1706 C C   . LEU A 220 ? 0.41823 0.42272 0.42167 -0.00764 0.01064  -0.02028 220 LEU A C   
1707 O O   . LEU A 220 ? 0.46492 0.46891 0.46788 -0.00874 0.01025  -0.02184 220 LEU A O   
1708 C CB  . LEU A 220 ? 0.36239 0.36867 0.35883 -0.00903 0.00828  -0.01799 220 LEU A CB  
1709 C CG  . LEU A 220 ? 0.36511 0.37146 0.35874 -0.00890 0.00649  -0.01550 220 LEU A CG  
1710 C CD1 . LEU A 220 ? 0.38910 0.39382 0.37572 -0.01039 0.00491  -0.01587 220 LEU A CD1 
1711 C CD2 . LEU A 220 ? 0.35473 0.36174 0.34923 -0.00830 0.00804  -0.01414 220 LEU A CD2 
1712 N N   . ASN A 221 ? 0.51216 0.51608 0.51804 -0.00629 0.01193  -0.02110 221 ASN A N   
1713 C CA  . ASN A 221 ? 0.50515 0.50733 0.51285 -0.00599 0.01292  -0.02385 221 ASN A CA  
1714 C C   . ASN A 221 ? 0.48580 0.49029 0.49282 -0.00676 0.01461  -0.02691 221 ASN A C   
1715 O O   . ASN A 221 ? 0.50513 0.51178 0.50890 -0.00822 0.01515  -0.02677 221 ASN A O   
1716 C CB  . ASN A 221 ? 0.45890 0.45778 0.46967 -0.00366 0.01261  -0.02335 221 ASN A CB  
1717 C CG  . ASN A 221 ? 0.36298 0.36360 0.37593 -0.00167 0.01260  -0.02325 221 ASN A CG  
1718 O OD1 . ASN A 221 ? 0.48889 0.49339 0.50199 -0.00229 0.01377  -0.02476 221 ASN A OD1 
1719 N ND2 . ASN A 221 ? 0.49108 0.48849 0.50536 0.00049  0.01130  -0.02171 221 ASN A ND2 
1720 N N   . ARG A 222 ? 0.52717 0.53063 0.53687 -0.00599 0.01561  -0.02993 222 ARG A N   
1721 C CA  . ARG A 222 ? 0.63123 0.63696 0.64083 -0.00707 0.01770  -0.03383 222 ARG A CA  
1722 C C   . ARG A 222 ? 0.61152 0.61960 0.62581 -0.00526 0.01889  -0.03615 222 ARG A C   
1723 O O   . ARG A 222 ? 0.70565 0.71550 0.72228 -0.00545 0.02076  -0.04049 222 ARG A O   
1724 C CB  . ARG A 222 ? 0.56787 0.57142 0.57795 -0.00750 0.01803  -0.03649 222 ARG A CB  
1725 C CG  . ARG A 222 ? 0.73518 0.73773 0.74113 -0.00967 0.01698  -0.03539 222 ARG A CG  
1726 C CD  . ARG A 222 ? 0.82098 0.82161 0.82747 -0.01041 0.01747  -0.03839 222 ARG A CD  
1727 N NE  . ARG A 222 ? 0.77386 0.77515 0.77603 -0.01284 0.01667  -0.03874 222 ARG A NE  
1728 C CZ  . ARG A 222 ? 0.85577 0.85841 0.85381 -0.01480 0.01758  -0.04105 222 ARG A CZ  
1729 N NH1 . ARG A 222 ? 0.74150 0.74555 0.73963 -0.01511 0.02007  -0.04366 222 ARG A NH1 
1730 N NH2 . ARG A 222 ? 0.95175 0.95423 0.94534 -0.01658 0.01590  -0.04114 222 ARG A NH2 
1731 N N   . PHE A 223 ? 0.44029 0.44891 0.45646 -0.00354 0.01781  -0.03383 223 PHE A N   
1732 C CA  . PHE A 223 ? 0.44941 0.45994 0.47138 -0.00094 0.01789  -0.03616 223 PHE A CA  
1733 C C   . PHE A 223 ? 0.42432 0.43921 0.44641 -0.00192 0.01909  -0.03590 223 PHE A C   
1734 O O   . PHE A 223 ? 0.33951 0.35450 0.35664 -0.00405 0.01920  -0.03278 223 PHE A O   
1735 C CB  . PHE A 223 ? 0.45306 0.45910 0.47737 0.00256  0.01491  -0.03401 223 PHE A CB  
1736 C CG  . PHE A 223 ? 0.69965 0.70001 0.72329 0.00332  0.01385  -0.03421 223 PHE A CG  
1737 C CD1 . PHE A 223 ? 0.68214 0.67919 0.70139 0.00140  0.01350  -0.03125 223 PHE A CD1 
1738 C CD2 . PHE A 223 ? 0.73447 0.73267 0.76218 0.00598  0.01310  -0.03774 223 PHE A CD2 
1739 C CE1 . PHE A 223 ? 0.73515 0.72674 0.75360 0.00151  0.01297  -0.03171 223 PHE A CE1 
1740 C CE2 . PHE A 223 ? 0.79651 0.78836 0.82281 0.00644  0.01216  -0.03784 223 PHE A CE2 
1741 C CZ  . PHE A 223 ? 0.78897 0.77744 0.81039 0.00392  0.01235  -0.03475 223 PHE A CZ  
1742 N N   . THR A 224 ? 0.29002 0.30843 0.31821 -0.00025 0.01985  -0.03965 224 THR A N   
1743 C CA  . THR A 224 ? 0.26734 0.28972 0.29765 -0.00032 0.02047  -0.03974 224 THR A CA  
1744 C C   . THR A 224 ? 0.28570 0.30856 0.32356 0.00423  0.01797  -0.04159 224 THR A C   
1745 O O   . THR A 224 ? 0.33315 0.35250 0.37353 0.00721  0.01580  -0.04266 224 THR A O   
1746 C CB  . THR A 224 ? 0.33118 0.35864 0.36110 -0.00402 0.02471  -0.04381 224 THR A CB  
1747 O OG1 . THR A 224 ? 0.27949 0.30956 0.30897 -0.00524 0.02552  -0.04260 224 THR A OG1 
1748 C CG2 . THR A 224 ? 0.33136 0.36305 0.36928 -0.00273 0.02635  -0.05072 224 THR A CG2 
1749 N N   . THR A 225 ? 0.23695 0.26348 0.27796 0.00486  0.01786  -0.04198 225 THR A N   
1750 C CA  . THR A 225 ? 0.31798 0.34506 0.36606 0.00948  0.01477  -0.04398 225 THR A CA  
1751 C C   . THR A 225 ? 0.29582 0.33035 0.34941 0.00873  0.01665  -0.04771 225 THR A C   
1752 O O   . THR A 225 ? 0.29194 0.33048 0.34345 0.00430  0.02084  -0.04906 225 THR A O   
1753 C CB  . THR A 225 ? 0.33712 0.35775 0.38167 0.01203  0.01072  -0.03835 225 THR A CB  
1754 O OG1 . THR A 225 ? 0.33007 0.34935 0.38010 0.01690  0.00690  -0.04033 225 THR A OG1 
1755 C CG2 . THR A 225 ? 0.30890 0.33064 0.34944 0.00988  0.01128  -0.03412 225 THR A CG2 
1756 N N   . THR A 226 ? 0.29406 0.33001 0.35433 0.01289  0.01348  -0.04966 226 THR A N   
1757 C CA  . THR A 226 ? 0.24642 0.28970 0.31279 0.01245  0.01479  -0.05331 226 THR A CA  
1758 C C   . THR A 226 ? 0.28630 0.32714 0.35067 0.01429  0.01147  -0.04860 226 THR A C   
1759 O O   . THR A 226 ? 0.28782 0.32145 0.34768 0.01678  0.00774  -0.04377 226 THR A O   
1760 C CB  . THR A 226 ? 0.32407 0.37289 0.40202 0.01603  0.01369  -0.06129 226 THR A CB  
1761 O OG1 . THR A 226 ? 0.31814 0.36147 0.39826 0.02217  0.00741  -0.06024 226 THR A OG1 
1762 C CG2 . THR A 226 ? 0.35690 0.40810 0.43717 0.01430  0.01708  -0.06643 226 THR A CG2 
1763 N N   . LEU A 227 ? 0.25562 0.30233 0.32299 0.01258  0.01323  -0.05029 227 LEU A N   
1764 C CA  . LEU A 227 ? 0.30994 0.35522 0.37633 0.01435  0.01017  -0.04667 227 LEU A CA  
1765 C C   . LEU A 227 ? 0.33493 0.37707 0.40568 0.02061  0.00416  -0.04746 227 LEU A C   
1766 O O   . LEU A 227 ? 0.28820 0.32358 0.35351 0.02259  0.00057  -0.04214 227 LEU A O   
1767 C CB  . LEU A 227 ? 0.33826 0.39116 0.40884 0.01160  0.01318  -0.04991 227 LEU A CB  
1768 C CG  . LEU A 227 ? 0.44138 0.49262 0.50620 0.00953  0.01331  -0.04467 227 LEU A CG  
1769 C CD1 . LEU A 227 ? 0.36407 0.40895 0.41816 0.00660  0.01450  -0.03826 227 LEU A CD1 
1770 C CD2 . LEU A 227 ? 0.36561 0.42407 0.43391 0.00562  0.01748  -0.04862 227 LEU A CD2 
1771 N N   . ASN A 228 ? 0.27557 0.32201 0.35573 0.02375  0.00287  -0.05434 228 ASN A N   
1772 C CA  . ASN A 228 ? 0.31028 0.35293 0.39434 0.03024  -0.00374 -0.05559 228 ASN A CA  
1773 C C   . ASN A 228 ? 0.28275 0.31425 0.35929 0.03249  -0.00700 -0.05097 228 ASN A C   
1774 O O   . ASN A 228 ? 0.31849 0.34231 0.39087 0.03596  -0.01208 -0.04741 228 ASN A O   
1775 C CB  . ASN A 228 ? 0.33344 0.38373 0.43032 0.03335  -0.00464 -0.06489 228 ASN A CB  
1776 C CG  . ASN A 228 ? 0.40138 0.46198 0.50678 0.03234  -0.00306 -0.06990 228 ASN A CG  
1777 O OD1 . ASN A 228 ? 0.42853 0.48902 0.53015 0.03073  -0.00298 -0.06597 228 ASN A OD1 
1778 N ND2 . ASN A 228 ? 0.29537 0.36517 0.41274 0.03312  -0.00163 -0.07905 228 ASN A ND2 
1779 N N   . ASP A 229 ? 0.34073 0.37065 0.41465 0.03016  -0.00398 -0.05097 229 ASP A N   
1780 C CA  . ASP A 229 ? 0.33356 0.35292 0.40045 0.03172  -0.00658 -0.04700 229 ASP A CA  
1781 C C   . ASP A 229 ? 0.34796 0.36080 0.40433 0.02914  -0.00630 -0.03912 229 ASP A C   
1782 O O   . ASP A 229 ? 0.37019 0.37348 0.42055 0.03119  -0.00984 -0.03536 229 ASP A O   
1783 C CB  . ASP A 229 ? 0.38519 0.40516 0.45262 0.02979  -0.00335 -0.04960 229 ASP A CB  
1784 C CG  . ASP A 229 ? 0.50556 0.52590 0.58109 0.03440  -0.00617 -0.05617 229 ASP A CG  
1785 O OD1 . ASP A 229 ? 0.55379 0.57605 0.63614 0.03895  -0.01028 -0.05979 229 ASP A OD1 
1786 O OD2 . ASP A 229 ? 0.60435 0.62297 0.67964 0.03372  -0.00462 -0.05799 229 ASP A OD2 
1787 N N   . PHE A 230 ? 0.26078 0.27817 0.31450 0.02450  -0.00212 -0.03682 230 PHE A N   
1788 C CA  . PHE A 230 ? 0.28605 0.29836 0.33122 0.02231  -0.00198 -0.03017 230 PHE A CA  
1789 C C   . PHE A 230 ? 0.29290 0.30158 0.33658 0.02515  -0.00601 -0.02771 230 PHE A C   
1790 O O   . PHE A 230 ? 0.28773 0.28822 0.32438 0.02549  -0.00797 -0.02321 230 PHE A O   
1791 C CB  . PHE A 230 ? 0.28536 0.30309 0.32847 0.01749  0.00243  -0.02872 230 PHE A CB  
1792 C CG  . PHE A 230 ? 0.32680 0.34063 0.36292 0.01574  0.00220  -0.02281 230 PHE A CG  
1793 C CD1 . PHE A 230 ? 0.28723 0.29630 0.31745 0.01380  0.00300  -0.01953 230 PHE A CD1 
1794 C CD2 . PHE A 230 ? 0.31131 0.32656 0.34738 0.01609  0.00117  -0.02107 230 PHE A CD2 
1795 C CE1 . PHE A 230 ? 0.32149 0.32775 0.34650 0.01227  0.00288  -0.01501 230 PHE A CE1 
1796 C CE2 . PHE A 230 ? 0.32432 0.33622 0.35453 0.01459  0.00104  -0.01620 230 PHE A CE2 
1797 C CZ  . PHE A 230 ? 0.33574 0.34335 0.36070 0.01270  0.00194  -0.01334 230 PHE A CZ  
1798 N N   . ASN A 231 ? 0.26908 0.28384 0.31908 0.02678  -0.00702 -0.03088 231 ASN A N   
1799 C CA  . ASN A 231 ? 0.32355 0.33529 0.37210 0.02945  -0.01104 -0.02884 231 ASN A CA  
1800 C C   . ASN A 231 ? 0.28768 0.29003 0.33375 0.03424  -0.01670 -0.02852 231 ASN A C   
1801 O O   . ASN A 231 ? 0.38955 0.38477 0.42926 0.03549  -0.01987 -0.02463 231 ASN A O   
1802 C CB  . ASN A 231 ? 0.26603 0.28693 0.32301 0.03028  -0.01104 -0.03332 231 ASN A CB  
1803 C CG  . ASN A 231 ? 0.31313 0.34032 0.36938 0.02528  -0.00609 -0.03206 231 ASN A CG  
1804 O OD1 . ASN A 231 ? 0.29594 0.31963 0.34477 0.02235  -0.00437 -0.02683 231 ASN A OD1 
1805 N ND2 . ASN A 231 ? 0.31390 0.35012 0.37784 0.02423  -0.00386 -0.03718 231 ASN A ND2 
1806 N N   . LEU A 232 ? 0.33153 0.33305 0.38188 0.03686  -0.01810 -0.03265 232 LEU A N   
1807 C CA  . LEU A 232 ? 0.32584 0.31658 0.37257 0.04142  -0.02376 -0.03224 232 LEU A CA  
1808 C C   . LEU A 232 ? 0.49556 0.47498 0.53021 0.03907  -0.02335 -0.02581 232 LEU A C   
1809 O O   . LEU A 232 ? 0.45686 0.42594 0.48406 0.04114  -0.02755 -0.02268 232 LEU A O   
1810 C CB  . LEU A 232 ? 0.41099 0.40327 0.46471 0.04409  -0.02457 -0.03804 232 LEU A CB  
1811 C CG  . LEU A 232 ? 0.51048 0.50019 0.56992 0.05090  -0.03138 -0.04288 232 LEU A CG  
1812 C CD1 . LEU A 232 ? 0.52984 0.52758 0.59667 0.05310  -0.03358 -0.04604 232 LEU A CD1 
1813 C CD2 . LEU A 232 ? 0.60497 0.59894 0.67302 0.05257  -0.03064 -0.04943 232 LEU A CD2 
1814 N N   . VAL A 233 ? 0.42426 0.40533 0.45654 0.03449  -0.01827 -0.02406 233 VAL A N   
1815 C CA  . VAL A 233 ? 0.51201 0.48379 0.53419 0.03169  -0.01721 -0.01891 233 VAL A CA  
1816 C C   . VAL A 233 ? 0.46724 0.43804 0.48381 0.02934  -0.01646 -0.01430 233 VAL A C   
1817 O O   . VAL A 233 ? 0.59767 0.55853 0.60552 0.02893  -0.01802 -0.01057 233 VAL A O   
1818 C CB  . VAL A 233 ? 0.50355 0.47842 0.52607 0.02779  -0.01243 -0.01923 233 VAL A CB  
1819 C CG1 . VAL A 233 ? 0.52935 0.49675 0.54288 0.02427  -0.01072 -0.01453 233 VAL A CG1 
1820 C CG2 . VAL A 233 ? 0.58121 0.55511 0.60798 0.03013  -0.01338 -0.02359 233 VAL A CG2 
1821 N N   . ALA A 234 ? 0.44293 0.42346 0.46397 0.02756  -0.01395 -0.01471 234 ALA A N   
1822 C CA  . ALA A 234 ? 0.43813 0.41872 0.45457 0.02493  -0.01261 -0.01069 234 ALA A CA  
1823 C C   . ALA A 234 ? 0.47783 0.45394 0.49146 0.02773  -0.01679 -0.00940 234 ALA A C   
1824 O O   . ALA A 234 ? 0.43180 0.40403 0.43902 0.02580  -0.01636 -0.00561 234 ALA A O   
1825 C CB  . ALA A 234 ? 0.47080 0.46205 0.49219 0.02223  -0.00891 -0.01159 234 ALA A CB  
1826 N N   . MET A 235 ? 0.42011 0.39692 0.43863 0.03226  -0.02095 -0.01288 235 MET A N   
1827 C CA  . MET A 235 ? 0.42206 0.39376 0.43732 0.03535  -0.02580 -0.01186 235 MET A CA  
1828 C C   . MET A 235 ? 0.42411 0.38157 0.42714 0.03505  -0.02791 -0.00748 235 MET A C   
1829 O O   . MET A 235 ? 0.40553 0.35826 0.40185 0.03437  -0.02908 -0.00434 235 MET A O   
1830 C CB  . MET A 235 ? 0.50576 0.47974 0.52870 0.04089  -0.03077 -0.01708 235 MET A CB  
1831 C CG  . MET A 235 ? 0.63947 0.60504 0.65745 0.04511  -0.03743 -0.01620 235 MET A CG  
1832 S SD  . MET A 235 ? 1.08406 1.05345 1.11287 0.05231  -0.04413 -0.02341 235 MET A SD  
1833 C CE  . MET A 235 ? 0.82579 0.80100 0.86319 0.05207  -0.04084 -0.02812 235 MET A CE  
1834 N N   . LYS A 236 ? 0.44319 0.39339 0.44266 0.03503  -0.02797 -0.00737 236 LYS A N   
1835 C CA  . LYS A 236 ? 0.49014 0.42571 0.47704 0.03393  -0.02930 -0.00347 236 LYS A CA  
1836 C C   . LYS A 236 ? 0.46226 0.39723 0.44284 0.02829  -0.02448 0.00060  236 LYS A C   
1837 O O   . LYS A 236 ? 0.51300 0.43715 0.48277 0.02681  -0.02533 0.00390  236 LYS A O   
1838 C CB  . LYS A 236 ? 0.61138 0.54072 0.59698 0.03438  -0.02940 -0.00468 236 LYS A CB  
1839 C CG  . LYS A 236 ? 0.65276 0.56808 0.62565 0.03123  -0.02845 -0.00088 236 LYS A CG  
1840 C CD  . LYS A 236 ? 0.70870 0.62497 0.68381 0.02890  -0.02486 -0.00218 236 LYS A CD  
1841 C CE  . LYS A 236 ? 0.63302 0.53626 0.59636 0.02498  -0.02305 0.00095  236 LYS A CE  
1842 N NZ  . LYS A 236 ? 0.60419 0.49229 0.55992 0.02825  -0.02810 0.00093  236 LYS A NZ  
1843 N N   . TYR A 237 ? 0.38087 0.32699 0.36774 0.02507  -0.01956 0.00013  237 TYR A N   
1844 C CA  . TYR A 237 ? 0.37659 0.32360 0.35943 0.02012  -0.01519 0.00306  237 TYR A CA  
1845 C C   . TYR A 237 ? 0.38456 0.33749 0.36895 0.01967  -0.01489 0.00406  237 TYR A C   
1846 O O   . TYR A 237 ? 0.38046 0.33668 0.36396 0.01597  -0.01126 0.00566  237 TYR A O   
1847 C CB  . TYR A 237 ? 0.38098 0.33518 0.36875 0.01705  -0.01067 0.00196  237 TYR A CB  
1848 C CG  . TYR A 237 ? 0.38589 0.33331 0.37078 0.01651  -0.01031 0.00135  237 TYR A CG  
1849 C CD1 . TYR A 237 ? 0.40979 0.34875 0.38658 0.01295  -0.00833 0.00355  237 TYR A CD1 
1850 C CD2 . TYR A 237 ? 0.42428 0.37357 0.41456 0.01932  -0.01175 -0.00180 237 TYR A CD2 
1851 C CE1 . TYR A 237 ? 0.41078 0.34298 0.38461 0.01215  -0.00787 0.00289  237 TYR A CE1 
1852 C CE2 . TYR A 237 ? 0.45096 0.39363 0.43851 0.01888  -0.01152 -0.00247 237 TYR A CE2 
1853 C CZ  . TYR A 237 ? 0.46731 0.40120 0.44644 0.01527  -0.00964 0.00004  237 TYR A CZ  
1854 O OH  . TYR A 237 ? 0.53853 0.46539 0.51468 0.01449  -0.00922 -0.00073 237 TYR A OH  
1855 N N   . ASN A 238 ? 0.35918 0.31355 0.34623 0.02348  -0.01883 0.00279  238 ASN A N   
1856 C CA  . ASN A 238 ? 0.36589 0.32563 0.35456 0.02328  -0.01890 0.00342  238 ASN A CA  
1857 C C   . ASN A 238 ? 0.32970 0.30127 0.32581 0.02076  -0.01466 0.00250  238 ASN A C   
1858 O O   . ASN A 238 ? 0.35429 0.32869 0.34932 0.01832  -0.01256 0.00423  238 ASN A O   
1859 C CB  . ASN A 238 ? 0.38946 0.34108 0.36805 0.02095  -0.01867 0.00703  238 ASN A CB  
1860 C CG  . ASN A 238 ? 0.48955 0.42811 0.45894 0.02352  -0.02356 0.00816  238 ASN A CG  
1861 O OD1 . ASN A 238 ? 0.49160 0.42948 0.46340 0.02817  -0.02861 0.00627  238 ASN A OD1 
1862 N ND2 . ASN A 238 ? 0.60603 0.53371 0.56456 0.02043  -0.02220 0.01093  238 ASN A ND2 
1863 N N   . TYR A 239 ? 0.34390 0.32171 0.34699 0.02130  -0.01350 -0.00036 239 TYR A N   
1864 C CA  . TYR A 239 ? 0.33539 0.32330 0.34465 0.01922  -0.01012 -0.00159 239 TYR A CA  
1865 C C   . TYR A 239 ? 0.35102 0.34574 0.36705 0.02144  -0.01163 -0.00459 239 TYR A C   
1866 O O   . TYR A 239 ? 0.37867 0.37263 0.39785 0.02504  -0.01497 -0.00735 239 TYR A O   
1867 C CB  . TYR A 239 ? 0.31580 0.30632 0.32781 0.01789  -0.00760 -0.00325 239 TYR A CB  
1868 C CG  . TYR A 239 ? 0.32344 0.31239 0.33150 0.01430  -0.00459 -0.00092 239 TYR A CG  
1869 C CD1 . TYR A 239 ? 0.34090 0.32205 0.34233 0.01318  -0.00475 0.00158  239 TYR A CD1 
1870 C CD2 . TYR A 239 ? 0.33599 0.33100 0.34675 0.01190  -0.00166 -0.00159 239 TYR A CD2 
1871 C CE1 . TYR A 239 ? 0.35039 0.33123 0.34961 0.00981  -0.00190 0.00278  239 TYR A CE1 
1872 C CE2 . TYR A 239 ? 0.37821 0.37228 0.38623 0.00909  0.00040  -0.00007 239 TYR A CE2 
1873 C CZ  . TYR A 239 ? 0.39218 0.37988 0.39529 0.00810  0.00036  0.00181  239 TYR A CZ  
1874 O OH  . TYR A 239 ? 0.37446 0.36230 0.37623 0.00524  0.00250  0.00241  239 TYR A OH  
1875 N N   . GLU A 240 ? 0.31754 0.31869 0.33590 0.01930  -0.00931 -0.00434 240 GLU A N   
1876 C CA  . GLU A 240 ? 0.35870 0.36733 0.38398 0.02026  -0.00953 -0.00771 240 GLU A CA  
1877 C C   . GLU A 240 ? 0.35365 0.36693 0.38529 0.02092  -0.00855 -0.01209 240 GLU A C   
1878 O O   . GLU A 240 ? 0.31057 0.32402 0.34128 0.01883  -0.00584 -0.01193 240 GLU A O   
1879 C CB  . GLU A 240 ? 0.30916 0.32293 0.33482 0.01693  -0.00633 -0.00663 240 GLU A CB  
1880 C CG  . GLU A 240 ? 0.53520 0.54790 0.55828 0.01688  -0.00751 -0.00443 240 GLU A CG  
1881 C CD  . GLU A 240 ? 0.59176 0.60985 0.61639 0.01398  -0.00463 -0.00434 240 GLU A CD  
1882 O OE1 . GLU A 240 ? 0.53284 0.55363 0.55823 0.01157  -0.00168 -0.00494 240 GLU A OE1 
1883 O OE2 . GLU A 240 ? 0.73606 0.75498 0.76048 0.01405  -0.00548 -0.00369 240 GLU A OE2 
1884 N N   . PRO A 241 ? 0.34982 0.36734 0.38835 0.02369  -0.01064 -0.01653 241 PRO A N   
1885 C CA  . PRO A 241 ? 0.31444 0.33789 0.36010 0.02372  -0.00887 -0.02162 241 PRO A CA  
1886 C C   . PRO A 241 ? 0.33259 0.36207 0.37906 0.01896  -0.00350 -0.02214 241 PRO A C   
1887 O O   . PRO A 241 ? 0.34587 0.37816 0.39177 0.01680  -0.00201 -0.02108 241 PRO A O   
1888 C CB  . PRO A 241 ? 0.36582 0.39384 0.41957 0.02741  -0.01221 -0.02669 241 PRO A CB  
1889 C CG  . PRO A 241 ? 0.38534 0.40631 0.43420 0.03059  -0.01728 -0.02363 241 PRO A CG  
1890 C CD  . PRO A 241 ? 0.37143 0.38836 0.41175 0.02714  -0.01504 -0.01762 241 PRO A CD  
1891 N N   . LEU A 242 ? 0.32288 0.35340 0.36976 0.01724  -0.00076 -0.02368 242 LEU A N   
1892 C CA  . LEU A 242 ? 0.30230 0.33698 0.34834 0.01261  0.00408  -0.02431 242 LEU A CA  
1893 C C   . LEU A 242 ? 0.29708 0.33977 0.35110 0.01178  0.00629  -0.03068 242 LEU A C   
1894 O O   . LEU A 242 ? 0.30394 0.34922 0.36433 0.01416  0.00539  -0.03546 242 LEU A O   
1895 C CB  . LEU A 242 ? 0.27415 0.30577 0.31592 0.01080  0.00598  -0.02305 242 LEU A CB  
1896 C CG  . LEU A 242 ? 0.32783 0.36032 0.36470 0.00603  0.00987  -0.02155 242 LEU A CG  
1897 C CD1 . LEU A 242 ? 0.31900 0.34773 0.34985 0.00512  0.00896  -0.01622 242 LEU A CD1 
1898 C CD2 . LEU A 242 ? 0.37733 0.40814 0.41154 0.00450  0.01159  -0.02205 242 LEU A CD2 
1899 N N   . THR A 243 ? 0.32076 0.36720 0.37449 0.00824  0.00930  -0.03110 243 THR A N   
1900 C CA  . THR A 243 ? 0.28902 0.34331 0.34986 0.00625  0.01236  -0.03737 243 THR A CA  
1901 C C   . THR A 243 ? 0.36700 0.42213 0.42359 0.00060  0.01796  -0.03824 243 THR A C   
1902 O O   . THR A 243 ? 0.30075 0.35036 0.34862 -0.00154 0.01884  -0.03352 243 THR A O   
1903 C CB  . THR A 243 ? 0.33242 0.38983 0.39568 0.00589  0.01187  -0.03773 243 THR A CB  
1904 O OG1 . THR A 243 ? 0.30655 0.36065 0.36161 0.00183  0.01430  -0.03307 243 THR A OG1 
1905 C CG2 . THR A 243 ? 0.35710 0.41176 0.42180 0.01124  0.00595  -0.03576 243 THR A CG2 
1906 N N   . GLN A 244 ? 0.30825 0.37029 0.37100 -0.00194 0.02169  -0.04477 244 GLN A N   
1907 C CA  . GLN A 244 ? 0.34269 0.40482 0.40008 -0.00814 0.02748  -0.04594 244 GLN A CA  
1908 C C   . GLN A 244 ? 0.34510 0.40288 0.39338 -0.01209 0.02907  -0.04112 244 GLN A C   
1909 O O   . GLN A 244 ? 0.29262 0.34555 0.33154 -0.01614 0.03170  -0.03858 244 GLN A O   
1910 C CB  . GLN A 244 ? 0.27871 0.34945 0.34481 -0.01070 0.03176  -0.05456 244 GLN A CB  
1911 C CG  . GLN A 244 ? 0.29700 0.36703 0.35658 -0.01757 0.03820  -0.05639 244 GLN A CG  
1912 C CD  . GLN A 244 ? 0.34685 0.41224 0.40085 -0.01742 0.03817  -0.05452 244 GLN A CD  
1913 O OE1 . GLN A 244 ? 0.36969 0.43688 0.42999 -0.01315 0.03567  -0.05677 244 GLN A OE1 
1914 N NE2 . GLN A 244 ? 0.31356 0.37236 0.35533 -0.02195 0.04058  -0.05046 244 GLN A NE2 
1915 N N   . ASP A 245 ? 0.29904 0.35795 0.34955 -0.01083 0.02714  -0.03991 245 ASP A N   
1916 C CA  . ASP A 245 ? 0.33104 0.38514 0.37308 -0.01393 0.02798  -0.03514 245 ASP A CA  
1917 C C   . ASP A 245 ? 0.33563 0.38171 0.36859 -0.01275 0.02533  -0.02823 245 ASP A C   
1918 O O   . ASP A 245 ? 0.29217 0.33298 0.31601 -0.01626 0.02690  -0.02505 245 ASP A O   
1919 C CB  . ASP A 245 ? 0.34610 0.40297 0.39291 -0.01205 0.02579  -0.03519 245 ASP A CB  
1920 C CG  . ASP A 245 ? 0.48490 0.54917 0.53867 -0.01520 0.02953  -0.04181 245 ASP A CG  
1921 O OD1 . ASP A 245 ? 0.45937 0.52646 0.51385 -0.01930 0.03431  -0.04641 245 ASP A OD1 
1922 O OD2 . ASP A 245 ? 0.59110 0.65848 0.64962 -0.01387 0.02788  -0.04275 245 ASP A OD2 
1923 N N   . HIS A 246 ? 0.32832 0.37302 0.36351 -0.00790 0.02119  -0.02615 246 HIS A N   
1924 C CA  . HIS A 246 ? 0.30175 0.33991 0.32974 -0.00698 0.01904  -0.02065 246 HIS A CA  
1925 C C   . HIS A 246 ? 0.31376 0.34935 0.33620 -0.00984 0.02142  -0.02083 246 HIS A C   
1926 O O   . HIS A 246 ? 0.28628 0.31659 0.30065 -0.01156 0.02118  -0.01705 246 HIS A O   
1927 C CB  . HIS A 246 ? 0.31142 0.34840 0.34270 -0.00202 0.01497  -0.01928 246 HIS A CB  
1928 C CG  . HIS A 246 ? 0.32947 0.36699 0.36379 0.00090  0.01195  -0.01817 246 HIS A CG  
1929 N ND1 . HIS A 246 ? 0.34053 0.37843 0.37969 0.00518  0.00861  -0.01938 246 HIS A ND1 
1930 C CD2 . HIS A 246 ? 0.28532 0.32229 0.31778 0.00017  0.01150  -0.01593 246 HIS A CD2 
1931 C CE1 . HIS A 246 ? 0.33280 0.37039 0.37257 0.00685  0.00626  -0.01792 246 HIS A CE1 
1932 N NE2 . HIS A 246 ? 0.32955 0.36703 0.36577 0.00383  0.00813  -0.01593 246 HIS A NE2 
1933 N N   . VAL A 247 ? 0.24908 0.28826 0.27595 -0.01005 0.02331  -0.02547 247 VAL A N   
1934 C CA  . VAL A 247 ? 0.23385 0.27090 0.25552 -0.01298 0.02583  -0.02631 247 VAL A CA  
1935 C C   . VAL A 247 ? 0.25089 0.28488 0.26392 -0.01848 0.02921  -0.02559 247 VAL A C   
1936 O O   . VAL A 247 ? 0.26934 0.29758 0.27340 -0.02045 0.02918  -0.02278 247 VAL A O   
1937 C CB  . VAL A 247 ? 0.28770 0.33016 0.31670 -0.01264 0.02790  -0.03253 247 VAL A CB  
1938 C CG1 . VAL A 247 ? 0.29107 0.33110 0.31409 -0.01593 0.03067  -0.03349 247 VAL A CG1 
1939 C CG2 . VAL A 247 ? 0.31381 0.35752 0.35020 -0.00690 0.02387  -0.03306 247 VAL A CG2 
1940 N N   . ASP A 248 ? 0.27819 0.31544 0.29340 -0.02112 0.03198  -0.02830 248 ASP A N   
1941 C CA  . ASP A 248 ? 0.29039 0.32337 0.29616 -0.02692 0.03548  -0.02768 248 ASP A CA  
1942 C C   . ASP A 248 ? 0.27770 0.30319 0.27481 -0.02654 0.03235  -0.02129 248 ASP A C   
1943 O O   . ASP A 248 ? 0.28773 0.30619 0.27381 -0.03009 0.03326  -0.01908 248 ASP A O   
1944 C CB  . ASP A 248 ? 0.30447 0.34282 0.31519 -0.03006 0.03935  -0.03237 248 ASP A CB  
1945 C CG  . ASP A 248 ? 0.36228 0.40846 0.38160 -0.03128 0.04312  -0.03991 248 ASP A CG  
1946 O OD1 . ASP A 248 ? 0.37095 0.41679 0.38938 -0.03125 0.04384  -0.04131 248 ASP A OD1 
1947 O OD2 . ASP A 248 ? 0.41893 0.47196 0.44641 -0.03232 0.04538  -0.04491 248 ASP A OD2 
1948 N N   . ILE A 249 ? 0.28298 0.30944 0.28458 -0.02227 0.02847  -0.01852 249 ILE A N   
1949 C CA  . ILE A 249 ? 0.24624 0.26646 0.24106 -0.02160 0.02547  -0.01317 249 ILE A CA  
1950 C C   . ILE A 249 ? 0.31087 0.32595 0.29974 -0.02047 0.02296  -0.01015 249 ILE A C   
1951 O O   . ILE A 249 ? 0.27844 0.28713 0.25921 -0.02131 0.02117  -0.00676 249 ILE A O   
1952 C CB  . ILE A 249 ? 0.30797 0.33101 0.30944 -0.01753 0.02237  -0.01160 249 ILE A CB  
1953 C CG1 . ILE A 249 ? 0.33003 0.35695 0.33547 -0.01929 0.02455  -0.01424 249 ILE A CG1 
1954 C CG2 . ILE A 249 ? 0.38164 0.39925 0.37800 -0.01591 0.01887  -0.00661 249 ILE A CG2 
1955 C CD1 . ILE A 249 ? 0.30922 0.33989 0.32211 -0.01521 0.02162  -0.01383 249 ILE A CD1 
1956 N N   . LEU A 250 ? 0.27979 0.29741 0.27267 -0.01852 0.02259  -0.01169 250 LEU A N   
1957 C CA  . LEU A 250 ? 0.29921 0.31281 0.28741 -0.01764 0.02044  -0.00962 250 LEU A CA  
1958 C C   . LEU A 250 ? 0.28952 0.29897 0.26892 -0.02177 0.02273  -0.01067 250 LEU A C   
1959 O O   . LEU A 250 ? 0.32816 0.33420 0.30321 -0.02126 0.02082  -0.00938 250 LEU A O   
1960 C CB  . LEU A 250 ? 0.25634 0.27361 0.25192 -0.01412 0.01919  -0.01086 250 LEU A CB  
1961 C CG  . LEU A 250 ? 0.31771 0.33611 0.31858 -0.01008 0.01602  -0.00866 250 LEU A CG  
1962 C CD1 . LEU A 250 ? 0.25592 0.27739 0.26379 -0.00718 0.01550  -0.01076 250 LEU A CD1 
1963 C CD2 . LEU A 250 ? 0.30541 0.31954 0.30187 -0.00912 0.01305  -0.00498 250 LEU A CD2 
1964 N N   . GLY A 251 ? 0.28795 0.29736 0.26425 -0.02613 0.02683  -0.01320 251 GLY A N   
1965 C CA  . GLY A 251 ? 0.34692 0.35177 0.31372 -0.03084 0.02972  -0.01460 251 GLY A CA  
1966 C C   . GLY A 251 ? 0.30874 0.30417 0.26330 -0.03163 0.02657  -0.01053 251 GLY A C   
1967 O O   . GLY A 251 ? 0.32679 0.31894 0.27563 -0.03259 0.02619  -0.01080 251 GLY A O   
1968 N N   . PRO A 252 ? 0.33166 0.32233 0.28189 -0.03110 0.02392  -0.00698 252 PRO A N   
1969 C CA  . PRO A 252 ? 0.34453 0.32592 0.28361 -0.03103 0.01984  -0.00343 252 PRO A CA  
1970 C C   . PRO A 252 ? 0.31942 0.30179 0.26131 -0.02705 0.01572  -0.00249 252 PRO A C   
1971 O O   . PRO A 252 ? 0.34202 0.31850 0.27520 -0.02809 0.01395  -0.00194 252 PRO A O   
1972 C CB  . PRO A 252 ? 0.33874 0.31718 0.27689 -0.02977 0.01734  -0.00043 252 PRO A CB  
1973 C CG  . PRO A 252 ? 0.36674 0.34958 0.30931 -0.03242 0.02204  -0.00274 252 PRO A CG  
1974 C CD  . PRO A 252 ? 0.34089 0.33339 0.29454 -0.03142 0.02491  -0.00666 252 PRO A CD  
1975 N N   . LEU A 253 ? 0.29613 0.28534 0.24940 -0.02280 0.01421  -0.00250 253 LEU A N   
1976 C CA  . LEU A 253 ? 0.28984 0.28005 0.24601 -0.01960 0.01084  -0.00201 253 LEU A CA  
1977 C C   . LEU A 253 ? 0.32779 0.32003 0.28452 -0.02081 0.01311  -0.00488 253 LEU A C   
1978 O O   . LEU A 253 ? 0.31974 0.30979 0.27360 -0.02007 0.01072  -0.00475 253 LEU A O   
1979 C CB  . LEU A 253 ? 0.28601 0.28186 0.25285 -0.01554 0.00921  -0.00132 253 LEU A CB  
1980 C CG  . LEU A 253 ? 0.35409 0.34818 0.32103 -0.01374 0.00624  0.00137  253 LEU A CG  
1981 C CD1 . LEU A 253 ? 0.29107 0.29078 0.26789 -0.01068 0.00591  0.00156  253 LEU A CD1 
1982 C CD2 . LEU A 253 ? 0.30984 0.29891 0.27144 -0.01253 0.00170  0.00290  253 LEU A CD2 
1983 N N   . SER A 254 ? 0.30623 0.30298 0.26722 -0.02255 0.01757  -0.00795 254 SER A N   
1984 C CA  . SER A 254 ? 0.33870 0.33738 0.30029 -0.02392 0.02007  -0.01127 254 SER A CA  
1985 C C   . SER A 254 ? 0.34074 0.33252 0.28963 -0.02807 0.02094  -0.01149 254 SER A C   
1986 O O   . SER A 254 ? 0.36836 0.35880 0.31457 -0.02816 0.02013  -0.01243 254 SER A O   
1987 C CB  . SER A 254 ? 0.33379 0.33904 0.30328 -0.02479 0.02447  -0.01525 254 SER A CB  
1988 O OG  . SER A 254 ? 0.38403 0.39117 0.35421 -0.02626 0.02711  -0.01900 254 SER A OG  
1989 N N   . ALA A 255 ? 0.31927 0.30578 0.25933 -0.03176 0.02250  -0.01063 255 ALA A N   
1990 C CA  . ALA A 255 ? 0.36476 0.34276 0.29039 -0.03624 0.02333  -0.01060 255 ALA A CA  
1991 C C   . ALA A 255 ? 0.37486 0.34573 0.29273 -0.03407 0.01717  -0.00729 255 ALA A C   
1992 O O   . ALA A 255 ? 0.36839 0.33382 0.27686 -0.03613 0.01657  -0.00783 255 ALA A O   
1993 C CB  . ALA A 255 ? 0.34216 0.31489 0.25921 -0.04101 0.02647  -0.01027 255 ALA A CB  
1994 N N   . GLN A 256 ? 0.37610 0.34703 0.29789 -0.02994 0.01246  -0.00431 256 GLN A N   
1995 C CA  . GLN A 256 ? 0.40918 0.37447 0.32547 -0.02740 0.00620  -0.00205 256 GLN A CA  
1996 C C   . GLN A 256 ? 0.37999 0.34946 0.30159 -0.02522 0.00475  -0.00383 256 GLN A C   
1997 O O   . GLN A 256 ? 0.42675 0.39082 0.34040 -0.02545 0.00153  -0.00376 256 GLN A O   
1998 C CB  . GLN A 256 ? 0.43153 0.39749 0.35291 -0.02347 0.00204  0.00057  256 GLN A CB  
1999 C CG  . GLN A 256 ? 0.48129 0.44098 0.39691 -0.02082 -0.00485 0.00237  256 GLN A CG  
2000 C CD  . GLN A 256 ? 0.58938 0.55121 0.51200 -0.01685 -0.00851 0.00403  256 GLN A CD  
2001 O OE1 . GLN A 256 ? 0.64732 0.61084 0.57312 -0.01716 -0.00637 0.00499  256 GLN A OE1 
2002 N NE2 . GLN A 256 ? 0.62330 0.58555 0.54886 -0.01319 -0.01392 0.00388  256 GLN A NE2 
2003 N N   . THR A 257 ? 0.34844 0.32680 0.28282 -0.02314 0.00686  -0.00550 257 THR A N   
2004 C CA  . THR A 257 ? 0.35192 0.33412 0.29207 -0.02105 0.00560  -0.00715 257 THR A CA  
2005 C C   . THR A 257 ? 0.38954 0.37325 0.32865 -0.02376 0.00968  -0.01044 257 THR A C   
2006 O O   . THR A 257 ? 0.36922 0.35442 0.31054 -0.02272 0.00857  -0.01195 257 THR A O   
2007 C CB  . THR A 257 ? 0.34717 0.33658 0.30046 -0.01743 0.00538  -0.00709 257 THR A CB  
2008 O OG1 . THR A 257 ? 0.30669 0.30067 0.26596 -0.01808 0.00974  -0.00834 257 THR A OG1 
2009 C CG2 . THR A 257 ? 0.29139 0.27984 0.24621 -0.01486 0.00152  -0.00439 257 THR A CG2 
2010 N N   . GLY A 258 ? 0.36945 0.35313 0.30576 -0.02734 0.01456  -0.01207 258 GLY A N   
2011 C CA  . GLY A 258 ? 0.34907 0.33558 0.28647 -0.02975 0.01892  -0.01605 258 GLY A CA  
2012 C C   . GLY A 258 ? 0.40974 0.40451 0.36082 -0.02686 0.02048  -0.01844 258 GLY A C   
2013 O O   . GLY A 258 ? 0.43454 0.43173 0.38767 -0.02792 0.02311  -0.02196 258 GLY A O   
2014 N N   . ILE A 259 ? 0.34203 0.34051 0.30191 -0.02330 0.01881  -0.01674 259 ILE A N   
2015 C CA  . ILE A 259 ? 0.31461 0.31910 0.28604 -0.02031 0.01954  -0.01852 259 ILE A CA  
2016 C C   . ILE A 259 ? 0.30612 0.31481 0.28340 -0.02041 0.02247  -0.02004 259 ILE A C   
2017 O O   . ILE A 259 ? 0.30004 0.30855 0.27780 -0.01973 0.02150  -0.01766 259 ILE A O   
2018 C CB  . ILE A 259 ? 0.31783 0.32278 0.29423 -0.01647 0.01557  -0.01582 259 ILE A CB  
2019 C CG1 . ILE A 259 ? 0.30583 0.30755 0.27758 -0.01639 0.01250  -0.01509 259 ILE A CG1 
2020 C CG2 . ILE A 259 ? 0.31196 0.32109 0.29820 -0.01375 0.01627  -0.01739 259 ILE A CG2 
2021 C CD1 . ILE A 259 ? 0.36247 0.36490 0.33890 -0.01338 0.00903  -0.01300 259 ILE A CD1 
2022 N N   . ALA A 260 ? 0.31316 0.32591 0.29537 -0.02116 0.02589  -0.02444 260 ALA A N   
2023 C CA  . ALA A 260 ? 0.31281 0.33063 0.30235 -0.02079 0.02829  -0.02695 260 ALA A CA  
2024 C C   . ALA A 260 ? 0.27460 0.29434 0.27184 -0.01618 0.02509  -0.02471 260 ALA A C   
2025 O O   . ALA A 260 ? 0.27516 0.29372 0.27463 -0.01327 0.02228  -0.02309 260 ALA A O   
2026 C CB  . ALA A 260 ? 0.33667 0.35909 0.33192 -0.02151 0.03176  -0.03285 260 ALA A CB  
2027 N N   . VAL A 261 ? 0.28499 0.30727 0.28564 -0.01588 0.02567  -0.02474 261 VAL A N   
2028 C CA  . VAL A 261 ? 0.23598 0.25928 0.24245 -0.01185 0.02258  -0.02246 261 VAL A CA  
2029 C C   . VAL A 261 ? 0.22391 0.24910 0.23787 -0.00823 0.02130  -0.02458 261 VAL A C   
2030 O O   . VAL A 261 ? 0.25145 0.27431 0.26659 -0.00531 0.01826  -0.02187 261 VAL A O   
2031 C CB  . VAL A 261 ? 0.30856 0.33485 0.31796 -0.01228 0.02361  -0.02306 261 VAL A CB  
2032 C CG1 . VAL A 261 ? 0.28218 0.31013 0.29859 -0.00787 0.02061  -0.02207 261 VAL A CG1 
2033 C CG2 . VAL A 261 ? 0.32607 0.34849 0.32737 -0.01496 0.02358  -0.01954 261 VAL A CG2 
2034 N N   . LEU A 262 ? 0.26260 0.29152 0.28133 -0.00856 0.02368  -0.02973 262 LEU A N   
2035 C CA  . LEU A 262 ? 0.26041 0.29030 0.28616 -0.00475 0.02198  -0.03210 262 LEU A CA  
2036 C C   . LEU A 262 ? 0.27692 0.30256 0.29943 -0.00421 0.02067  -0.03055 262 LEU A C   
2037 O O   . LEU A 262 ? 0.26382 0.28750 0.28978 -0.00087 0.01825  -0.03040 262 LEU A O   
2038 C CB  . LEU A 262 ? 0.29484 0.33034 0.32745 -0.00507 0.02474  -0.03881 262 LEU A CB  
2039 C CG  . LEU A 262 ? 0.29831 0.33894 0.33723 -0.00438 0.02520  -0.04132 262 LEU A CG  
2040 C CD1 . LEU A 262 ? 0.25166 0.29896 0.29917 -0.00448 0.02786  -0.04907 262 LEU A CD1 
2041 C CD2 . LEU A 262 ? 0.28884 0.32772 0.33114 0.00040  0.02049  -0.03840 262 LEU A CD2 
2042 N N   . ASP A 263 ? 0.25444 0.27802 0.26989 -0.00751 0.02206  -0.02957 263 ASP A N   
2043 C CA  . ASP A 263 ? 0.25037 0.27011 0.26274 -0.00708 0.02038  -0.02780 263 ASP A CA  
2044 C C   . ASP A 263 ? 0.25522 0.27187 0.26659 -0.00516 0.01717  -0.02311 263 ASP A C   
2045 O O   . ASP A 263 ? 0.29888 0.31305 0.31185 -0.00325 0.01546  -0.02236 263 ASP A O   
2046 C CB  . ASP A 263 ? 0.31569 0.33366 0.32020 -0.01084 0.02182  -0.02775 263 ASP A CB  
2047 C CG  . ASP A 263 ? 0.39531 0.41542 0.39992 -0.01315 0.02530  -0.03275 263 ASP A CG  
2048 O OD1 . ASP A 263 ? 0.33021 0.35443 0.34156 -0.01230 0.02715  -0.03673 263 ASP A OD1 
2049 O OD2 . ASP A 263 ? 0.38006 0.39780 0.37800 -0.01585 0.02607  -0.03306 263 ASP A OD2 
2050 N N   . MET A 264 ? 0.26486 0.28133 0.27330 -0.00597 0.01658  -0.02017 264 MET A N   
2051 C CA  . MET A 264 ? 0.30540 0.31957 0.31340 -0.00438 0.01392  -0.01631 264 MET A CA  
2052 C C   . MET A 264 ? 0.26014 0.27407 0.27334 -0.00125 0.01260  -0.01614 264 MET A C   
2053 O O   . MET A 264 ? 0.28459 0.29550 0.29755 -0.00002 0.01087  -0.01398 264 MET A O   
2054 C CB  . MET A 264 ? 0.25398 0.26805 0.25823 -0.00567 0.01351  -0.01369 264 MET A CB  
2055 C CG  . MET A 264 ? 0.30164 0.31366 0.30501 -0.00459 0.01101  -0.01030 264 MET A CG  
2056 S SD  . MET A 264 ? 0.31715 0.32696 0.31727 -0.00552 0.00963  -0.01006 264 MET A SD  
2057 C CE  . MET A 264 ? 0.28139 0.28974 0.27446 -0.00760 0.00871  -0.00881 264 MET A CE  
2058 N N   . CYS A 265 ? 0.24049 0.25725 0.25812 -0.00006 0.01331  -0.01868 265 CYS A N   
2059 C CA  . CYS A 265 ? 0.27399 0.28960 0.29598 0.00341  0.01122  -0.01889 265 CYS A CA  
2060 C C   . CYS A 265 ? 0.26866 0.28038 0.29125 0.00498  0.01015  -0.01971 265 CYS A C   
2061 O O   . CYS A 265 ? 0.27140 0.27862 0.29354 0.00704  0.00791  -0.01783 265 CYS A O   
2062 C CB  . CYS A 265 ? 0.25930 0.27946 0.28706 0.00463  0.01184  -0.02267 265 CYS A CB  
2063 S SG  . CYS A 265 ? 0.29596 0.31964 0.32362 0.00330  0.01257  -0.02153 265 CYS A SG  
2064 N N   . ALA A 266 ? 0.26661 0.27931 0.28951 0.00377  0.01184  -0.02261 266 ALA A N   
2065 C CA  . ALA A 266 ? 0.28912 0.29777 0.31240 0.00502  0.01096  -0.02359 266 ALA A CA  
2066 C C   . ALA A 266 ? 0.30620 0.31031 0.32490 0.00389  0.01014  -0.02001 266 ALA A C   
2067 O O   . ALA A 266 ? 0.33411 0.33296 0.35223 0.00525  0.00871  -0.01918 266 ALA A O   
2068 C CB  . ALA A 266 ? 0.31956 0.33062 0.34396 0.00357  0.01323  -0.02765 266 ALA A CB  
2069 N N   . SER A 267 ? 0.30760 0.31334 0.32288 0.00131  0.01095  -0.01819 267 SER A N   
2070 C CA  . SER A 267 ? 0.32032 0.32314 0.33270 0.00023  0.01016  -0.01559 267 SER A CA  
2071 C C   . SER A 267 ? 0.31143 0.31152 0.32355 0.00151  0.00877  -0.01276 267 SER A C   
2072 O O   . SER A 267 ? 0.29323 0.28901 0.30389 0.00125  0.00834  -0.01164 267 SER A O   
2073 C CB  . SER A 267 ? 0.34001 0.34532 0.34936 -0.00213 0.01049  -0.01472 267 SER A CB  
2074 O OG  . SER A 267 ? 0.37961 0.38594 0.38759 -0.00365 0.01155  -0.01717 267 SER A OG  
2075 N N   . LEU A 268 ? 0.28196 0.28424 0.29500 0.00248  0.00831  -0.01176 268 LEU A N   
2076 C CA  . LEU A 268 ? 0.30988 0.30939 0.32215 0.00367  0.00692  -0.00923 268 LEU A CA  
2077 C C   . LEU A 268 ? 0.31121 0.30515 0.32355 0.00593  0.00549  -0.00965 268 LEU A C   
2078 O O   . LEU A 268 ? 0.31062 0.29915 0.31980 0.00579  0.00476  -0.00760 268 LEU A O   
2079 C CB  . LEU A 268 ? 0.30690 0.31006 0.32048 0.00434  0.00663  -0.00858 268 LEU A CB  
2080 C CG  . LEU A 268 ? 0.33360 0.33429 0.34647 0.00583  0.00502  -0.00636 268 LEU A CG  
2081 C CD1 . LEU A 268 ? 0.28803 0.28552 0.29752 0.00427  0.00512  -0.00384 268 LEU A CD1 
2082 C CD2 . LEU A 268 ? 0.29577 0.30082 0.31024 0.00604  0.00501  -0.00612 268 LEU A CD2 
2083 N N   . LYS A 269 ? 0.29274 0.28741 0.30828 0.00791  0.00503  -0.01257 269 LYS A N   
2084 C CA  . LYS A 269 ? 0.31208 0.30055 0.32751 0.01068  0.00283  -0.01332 269 LYS A CA  
2085 C C   . LYS A 269 ? 0.33287 0.31442 0.34410 0.00930  0.00313  -0.01231 269 LYS A C   
2086 O O   . LYS A 269 ? 0.34527 0.31894 0.35256 0.01022  0.00146  -0.01065 269 LYS A O   
2087 C CB  . LYS A 269 ? 0.31225 0.30384 0.33310 0.01292  0.00249  -0.01768 269 LYS A CB  
2088 C CG  . LYS A 269 ? 0.48094 0.46568 0.50198 0.01609  -0.00017 -0.01923 269 LYS A CG  
2089 C CD  . LYS A 269 ? 0.49413 0.48354 0.52217 0.01845  -0.00042 -0.02449 269 LYS A CD  
2090 C CE  . LYS A 269 ? 0.56352 0.54573 0.59174 0.02148  -0.00303 -0.02651 269 LYS A CE  
2091 N NZ  . LYS A 269 ? 0.69920 0.68680 0.73543 0.02385  -0.00314 -0.03252 269 LYS A NZ  
2092 N N   . GLU A 270 ? 0.32752 0.31132 0.33891 0.00682  0.00526  -0.01342 270 GLU A N   
2093 C CA  . GLU A 270 ? 0.33722 0.31504 0.34524 0.00506  0.00589  -0.01302 270 GLU A CA  
2094 C C   . GLU A 270 ? 0.35375 0.32900 0.35790 0.00268  0.00655  -0.01005 270 GLU A C   
2095 O O   . GLU A 270 ? 0.38573 0.35355 0.38584 0.00154  0.00673  -0.00918 270 GLU A O   
2096 C CB  . GLU A 270 ? 0.38275 0.36425 0.39233 0.00305  0.00776  -0.01541 270 GLU A CB  
2097 C CG  . GLU A 270 ? 0.57982 0.56346 0.59299 0.00485  0.00772  -0.01899 270 GLU A CG  
2098 C CD  . GLU A 270 ? 0.75446 0.73078 0.76723 0.00683  0.00639  -0.02046 270 GLU A CD  
2099 O OE1 . GLU A 270 ? 0.72231 0.69164 0.73097 0.00549  0.00639  -0.01898 270 GLU A OE1 
2100 O OE2 . GLU A 270 ? 0.67022 0.64756 0.68681 0.00961  0.00538  -0.02343 270 GLU A OE2 
2101 N N   . LEU A 271 ? 0.31015 0.29107 0.31528 0.00169  0.00708  -0.00875 271 LEU A N   
2102 C CA  . LEU A 271 ? 0.32944 0.30874 0.33190 -0.00036 0.00776  -0.00655 271 LEU A CA  
2103 C C   . LEU A 271 ? 0.36301 0.33549 0.36157 0.00092  0.00642  -0.00447 271 LEU A C   
2104 O O   . LEU A 271 ? 0.39740 0.36409 0.39157 -0.00119 0.00734  -0.00323 271 LEU A O   
2105 C CB  . LEU A 271 ? 0.35864 0.34513 0.36324 -0.00104 0.00803  -0.00587 271 LEU A CB  
2106 C CG  . LEU A 271 ? 0.32704 0.31883 0.33362 -0.00273 0.00880  -0.00744 271 LEU A CG  
2107 C CD1 . LEU A 271 ? 0.34179 0.33893 0.34938 -0.00270 0.00822  -0.00651 271 LEU A CD1 
2108 C CD2 . LEU A 271 ? 0.43445 0.42459 0.44053 -0.00535 0.01000  -0.00830 271 LEU A CD2 
2109 N N   . LEU A 272 ? 0.33161 0.30451 0.33145 0.00416  0.00427  -0.00439 272 LEU A N   
2110 C CA  . LEU A 272 ? 0.36177 0.32761 0.35738 0.00589  0.00213  -0.00257 272 LEU A CA  
2111 C C   . LEU A 272 ? 0.41032 0.36560 0.40088 0.00628  0.00109  -0.00262 272 LEU A C   
2112 O O   . LEU A 272 ? 0.43146 0.37806 0.41505 0.00520  0.00072  -0.00051 272 LEU A O   
2113 C CB  . LEU A 272 ? 0.32515 0.29461 0.32447 0.00957  -0.00035 -0.00334 272 LEU A CB  
2114 C CG  . LEU A 272 ? 0.35373 0.33076 0.35582 0.00915  0.00026  -0.00252 272 LEU A CG  
2115 C CD1 . LEU A 272 ? 0.37258 0.35282 0.37863 0.01256  -0.00207 -0.00396 272 LEU A CD1 
2116 C CD2 . LEU A 272 ? 0.40472 0.37845 0.40204 0.00726  0.00076  0.00032  272 LEU A CD2 
2117 N N   . GLN A 273 ? 0.35737 0.31252 0.35061 0.00754  0.00074  -0.00510 273 GLN A N   
2118 C CA  . GLN A 273 ? 0.41162 0.35594 0.40013 0.00860  -0.00092 -0.00538 273 GLN A CA  
2119 C C   . GLN A 273 ? 0.43221 0.37080 0.41572 0.00424  0.00194  -0.00474 273 GLN A C   
2120 O O   . GLN A 273 ? 0.45768 0.38454 0.43345 0.00348  0.00122  -0.00336 273 GLN A O   
2121 C CB  . GLN A 273 ? 0.38526 0.33186 0.37925 0.01177  -0.00239 -0.00887 273 GLN A CB  
2122 C CG  . GLN A 273 ? 0.39964 0.34996 0.39849 0.01637  -0.00562 -0.01043 273 GLN A CG  
2123 C CD  . GLN A 273 ? 0.53826 0.48997 0.54272 0.01953  -0.00708 -0.01469 273 GLN A CD  
2124 O OE1 . GLN A 273 ? 0.62423 0.57024 0.62871 0.02371  -0.01112 -0.01599 273 GLN A OE1 
2125 N NE2 . GLN A 273 ? 0.52124 0.48033 0.53038 0.01766  -0.00403 -0.01716 273 GLN A NE2 
2126 N N   . ASN A 274 ? 0.40751 0.35366 0.39488 0.00120  0.00506  -0.00596 274 ASN A N   
2127 C CA  . ASN A 274 ? 0.44600 0.38827 0.43042 -0.00297 0.00785  -0.00648 274 ASN A CA  
2128 C C   . ASN A 274 ? 0.45935 0.40475 0.44299 -0.00701 0.01066  -0.00552 274 ASN A C   
2129 O O   . ASN A 274 ? 0.51013 0.45280 0.49180 -0.01096 0.01333  -0.00647 274 ASN A O   
2130 C CB  . ASN A 274 ? 0.45227 0.40007 0.44189 -0.00339 0.00896  -0.00955 274 ASN A CB  
2131 C CG  . ASN A 274 ? 0.53899 0.48393 0.53006 0.00029  0.00667  -0.01136 274 ASN A CG  
2132 O OD1 . ASN A 274 ? 0.75643 0.70910 0.75330 0.00207  0.00638  -0.01352 274 ASN A OD1 
2133 N ND2 . ASN A 274 ? 0.63614 0.56944 0.62156 0.00134  0.00500  -0.01073 274 ASN A ND2 
2134 N N   . GLY A 275 ? 0.43478 0.38602 0.42037 -0.00623 0.01021  -0.00417 275 GLY A N   
2135 C CA  . GLY A 275 ? 0.48892 0.44389 0.47486 -0.00963 0.01262  -0.00385 275 GLY A CA  
2136 C C   . GLY A 275 ? 0.45161 0.41625 0.44406 -0.01108 0.01395  -0.00625 275 GLY A C   
2137 O O   . GLY A 275 ? 0.40211 0.37033 0.39797 -0.00982 0.01326  -0.00791 275 GLY A O   
2138 N N   . MET A 276 ? 0.44148 0.41022 0.43554 -0.01375 0.01572  -0.00674 276 MET A N   
2139 C CA  . MET A 276 ? 0.52708 0.50480 0.52727 -0.01470 0.01611  -0.00919 276 MET A CA  
2140 C C   . MET A 276 ? 0.51030 0.48754 0.51155 -0.01856 0.01860  -0.01217 276 MET A C   
2141 O O   . MET A 276 ? 0.44262 0.42716 0.44922 -0.01932 0.01850  -0.01477 276 MET A O   
2142 C CB  . MET A 276 ? 0.49789 0.48172 0.50085 -0.01452 0.01577  -0.00867 276 MET A CB  
2143 C CG  . MET A 276 ? 0.41961 0.40527 0.42247 -0.01092 0.01335  -0.00627 276 MET A CG  
2144 S SD  . MET A 276 ? 0.65681 0.64776 0.66183 -0.01077 0.01298  -0.00540 276 MET A SD  
2145 C CE  . MET A 276 ? 0.45353 0.45222 0.46448 -0.01191 0.01269  -0.00868 276 MET A CE  
2146 N N   . ASN A 277 ? 0.49364 0.46201 0.48965 -0.02104 0.02061  -0.01207 277 ASN A N   
2147 C CA  . ASN A 277 ? 0.48060 0.44765 0.47728 -0.02510 0.02334  -0.01521 277 ASN A CA  
2148 C C   . ASN A 277 ? 0.46213 0.43646 0.46403 -0.02841 0.02550  -0.01825 277 ASN A C   
2149 O O   . ASN A 277 ? 0.49503 0.47411 0.50182 -0.03045 0.02646  -0.02201 277 ASN A O   
2150 C CB  . ASN A 277 ? 0.55049 0.52017 0.55035 -0.02372 0.02204  -0.01714 277 ASN A CB  
2151 C CG  . ASN A 277 ? 0.70923 0.66908 0.70395 -0.02472 0.02293  -0.01718 277 ASN A CG  
2152 O OD1 . ASN A 277 ? 0.70541 0.65598 0.69367 -0.02369 0.02238  -0.01454 277 ASN A OD1 
2153 N ND2 . ASN A 277 ? 0.81769 0.77902 0.81503 -0.02660 0.02397  -0.02035 277 ASN A ND2 
2154 N N   . GLY A 278 ? 0.41701 0.39255 0.41840 -0.02882 0.02611  -0.01710 278 GLY A N   
2155 C CA  . GLY A 278 ? 0.47471 0.45776 0.48200 -0.03149 0.02794  -0.02046 278 GLY A CA  
2156 C C   . GLY A 278 ? 0.47269 0.46675 0.48830 -0.02860 0.02484  -0.02238 278 GLY A C   
2157 O O   . GLY A 278 ? 0.47446 0.47544 0.49617 -0.03010 0.02555  -0.02579 278 GLY A O   
2158 N N   . ARG A 279 ? 0.40491 0.40038 0.42067 -0.02460 0.02138  -0.02061 279 ARG A N   
2159 C CA  . ARG A 279 ? 0.38247 0.38626 0.40377 -0.02192 0.01806  -0.02187 279 ARG A CA  
2160 C C   . ARG A 279 ? 0.49353 0.49965 0.51492 -0.01946 0.01634  -0.01943 279 ARG A C   
2161 O O   . ARG A 279 ? 0.43191 0.43355 0.44914 -0.01942 0.01745  -0.01658 279 ARG A O   
2162 C CB  . ARG A 279 ? 0.40914 0.41258 0.42924 -0.01948 0.01568  -0.02118 279 ARG A CB  
2163 C CG  . ARG A 279 ? 0.55588 0.55796 0.57673 -0.02180 0.01705  -0.02416 279 ARG A CG  
2164 C CD  . ARG A 279 ? 0.57196 0.57217 0.59048 -0.01972 0.01543  -0.02335 279 ARG A CD  
2165 N NE  . ARG A 279 ? 0.70180 0.69433 0.71507 -0.01900 0.01649  -0.02057 279 ARG A NE  
2166 C CZ  . ARG A 279 ? 0.77912 0.76812 0.79047 -0.01831 0.01638  -0.02084 279 ARG A CZ  
2167 N NH1 . ARG A 279 ? 0.75850 0.75067 0.77207 -0.01868 0.01572  -0.02358 279 ARG A NH1 
2168 N NH2 . ARG A 279 ? 0.83821 0.82019 0.84537 -0.01705 0.01665  -0.01862 279 ARG A NH2 
2169 N N   . THR A 280 ? 0.34998 0.36261 0.37571 -0.01738 0.01331  -0.02068 280 THR A N   
2170 C CA  . THR A 280 ? 0.38776 0.40251 0.41367 -0.01499 0.01136  -0.01863 280 THR A CA  
2171 C C   . THR A 280 ? 0.36895 0.38454 0.39310 -0.01174 0.00781  -0.01677 280 THR A C   
2172 O O   . THR A 280 ? 0.36734 0.38376 0.39156 -0.01133 0.00631  -0.01809 280 THR A O   
2173 C CB  . THR A 280 ? 0.39367 0.41459 0.42592 -0.01555 0.01082  -0.02205 280 THR A CB  
2174 O OG1 . THR A 280 ? 0.36994 0.39568 0.40684 -0.01484 0.00811  -0.02563 280 THR A OG1 
2175 C CG2 . THR A 280 ? 0.43553 0.45579 0.46927 -0.01959 0.01521  -0.02439 280 THR A CG2 
2176 N N   . ILE A 281 ? 0.34368 0.35868 0.36572 -0.00982 0.00673  -0.01383 281 ILE A N   
2177 C CA  . ILE A 281 ? 0.31663 0.33202 0.33631 -0.00738 0.00387  -0.01209 281 ILE A CA  
2178 C C   . ILE A 281 ? 0.39850 0.41640 0.41978 -0.00603 0.00189  -0.01170 281 ILE A C   
2179 O O   . ILE A 281 ? 0.34951 0.36678 0.37073 -0.00613 0.00322  -0.01023 281 ILE A O   
2180 C CB  . ILE A 281 ? 0.29354 0.30514 0.30880 -0.00652 0.00482  -0.00907 281 ILE A CB  
2181 C CG1 . ILE A 281 ? 0.29339 0.30224 0.30741 -0.00742 0.00635  -0.00986 281 ILE A CG1 
2182 C CG2 . ILE A 281 ? 0.28777 0.29985 0.30039 -0.00483 0.00267  -0.00759 281 ILE A CG2 
2183 C CD1 . ILE A 281 ? 0.34143 0.34691 0.35250 -0.00627 0.00712  -0.00780 281 ILE A CD1 
2184 N N   . LEU A 282 ? 0.37700 0.39719 0.39936 -0.00472 -0.00158 -0.01319 282 LEU A N   
2185 C CA  . LEU A 282 ? 0.36496 0.38707 0.38912 -0.00309 -0.00419 -0.01337 282 LEU A CA  
2186 C C   . LEU A 282 ? 0.32587 0.35115 0.35572 -0.00423 -0.00228 -0.01555 282 LEU A C   
2187 O O   . LEU A 282 ? 0.31248 0.33808 0.34284 -0.00357 -0.00221 -0.01449 282 LEU A O   
2188 C CB  . LEU A 282 ? 0.32729 0.34640 0.34644 -0.00183 -0.00473 -0.00958 282 LEU A CB  
2189 C CG  . LEU A 282 ? 0.32073 0.33680 0.33389 -0.00114 -0.00664 -0.00805 282 LEU A CG  
2190 C CD1 . LEU A 282 ? 0.32551 0.33901 0.33438 -0.00062 -0.00636 -0.00489 282 LEU A CD1 
2191 C CD2 . LEU A 282 ? 0.41037 0.42662 0.42307 0.00012  -0.01113 -0.01002 282 LEU A CD2 
2192 N N   . GLY A 283 ? 0.36434 0.39188 0.39831 -0.00635 -0.00033 -0.01892 283 GLY A N   
2193 C CA  . GLY A 283 ? 0.39113 0.42186 0.43048 -0.00836 0.00225  -0.02190 283 GLY A CA  
2194 C C   . GLY A 283 ? 0.45983 0.48693 0.49581 -0.01049 0.00654  -0.01949 283 GLY A C   
2195 O O   . GLY A 283 ? 0.42436 0.45336 0.46350 -0.01259 0.00911  -0.02175 283 GLY A O   
2196 N N   . SER A 284 ? 0.39096 0.41276 0.42054 -0.01007 0.00728  -0.01535 284 SER A N   
2197 C CA  . SER A 284 ? 0.35713 0.37437 0.38245 -0.01145 0.01028  -0.01281 284 SER A CA  
2198 C C   . SER A 284 ? 0.35611 0.36827 0.37767 -0.01343 0.01270  -0.01228 284 SER A C   
2199 O O   . SER A 284 ? 0.35662 0.36798 0.37734 -0.01261 0.01159  -0.01215 284 SER A O   
2200 C CB  . SER A 284 ? 0.40956 0.42462 0.43098 -0.00890 0.00863  -0.00883 284 SER A CB  
2201 O OG  . SER A 284 ? 0.50575 0.51559 0.52241 -0.00974 0.01072  -0.00640 284 SER A OG  
2202 N N   . ALA A 285 ? 0.38346 0.39139 0.40200 -0.01614 0.01595  -0.01201 285 ALA A N   
2203 C CA  . ALA A 285 ? 0.36730 0.36852 0.38097 -0.01821 0.01815  -0.01138 285 ALA A CA  
2204 C C   . ALA A 285 ? 0.39713 0.39149 0.40411 -0.01634 0.01730  -0.00726 285 ALA A C   
2205 O O   . ALA A 285 ? 0.46212 0.44972 0.46440 -0.01728 0.01826  -0.00645 285 ALA A O   
2206 C CB  . ALA A 285 ? 0.45402 0.45300 0.46684 -0.02293 0.02236  -0.01384 285 ALA A CB  
2207 N N   . LEU A 286 ? 0.36751 0.36329 0.37418 -0.01364 0.01529  -0.00498 286 LEU A N   
2208 C CA  . LEU A 286 ? 0.36778 0.35869 0.36981 -0.01127 0.01380  -0.00183 286 LEU A CA  
2209 C C   . LEU A 286 ? 0.38972 0.38548 0.39464 -0.00802 0.01109  -0.00097 286 LEU A C   
2210 O O   . LEU A 286 ? 0.36414 0.36556 0.37308 -0.00764 0.01018  -0.00219 286 LEU A O   
2211 C CB  . LEU A 286 ? 0.44819 0.43455 0.44549 -0.01196 0.01457  0.00001  286 LEU A CB  
2212 C CG  . LEU A 286 ? 0.51144 0.50212 0.51114 -0.01289 0.01538  -0.00066 286 LEU A CG  
2213 C CD1 . LEU A 286 ? 0.47030 0.46624 0.47332 -0.00967 0.01269  0.00044  286 LEU A CD1 
2214 C CD2 . LEU A 286 ? 0.52468 0.50880 0.51786 -0.01502 0.01721  0.00054  286 LEU A CD2 
2215 N N   . LEU A 287 ? 0.31925 0.31229 0.32182 -0.00575 0.00969  0.00085  287 LEU A N   
2216 C CA  . LEU A 287 ? 0.29747 0.29457 0.30224 -0.00339 0.00786  0.00126  287 LEU A CA  
2217 C C   . LEU A 287 ? 0.29389 0.29333 0.29912 -0.00258 0.00712  0.00253  287 LEU A C   
2218 O O   . LEU A 287 ? 0.42208 0.41848 0.42484 -0.00208 0.00696  0.00391  287 LEU A O   
2219 C CB  . LEU A 287 ? 0.34293 0.33718 0.34640 -0.00146 0.00694  0.00161  287 LEU A CB  
2220 C CG  . LEU A 287 ? 0.33039 0.32124 0.33298 -0.00221 0.00766  0.00031  287 LEU A CG  
2221 C CD1 . LEU A 287 ? 0.36853 0.35598 0.37020 0.00013  0.00639  0.00024  287 LEU A CD1 
2222 C CD2 . LEU A 287 ? 0.37223 0.36752 0.37766 -0.00319 0.00806  -0.00157 287 LEU A CD2 
2223 N N   . GLU A 288 ? 0.33388 0.33797 0.34168 -0.00241 0.00637  0.00203  288 GLU A N   
2224 C CA  . GLU A 288 ? 0.35350 0.35967 0.36192 -0.00184 0.00566  0.00296  288 GLU A CA  
2225 C C   . GLU A 288 ? 0.29684 0.30364 0.30464 -0.00020 0.00463  0.00410  288 GLU A C   
2226 O O   . GLU A 288 ? 0.27372 0.28170 0.28170 0.00014  0.00425  0.00357  288 GLU A O   
2227 C CB  . GLU A 288 ? 0.32872 0.33857 0.33982 -0.00219 0.00479  0.00165  288 GLU A CB  
2228 C CG  . GLU A 288 ? 0.45368 0.46442 0.46705 -0.00387 0.00577  -0.00067 288 GLU A CG  
2229 C CD  . GLU A 288 ? 0.63529 0.64895 0.65187 -0.00442 0.00575  -0.00220 288 GLU A CD  
2230 O OE1 . GLU A 288 ? 0.86001 0.87615 0.87828 -0.00302 0.00350  -0.00248 288 GLU A OE1 
2231 O OE2 . GLU A 288 ? 0.55588 0.56894 0.57300 -0.00640 0.00803  -0.00337 288 GLU A OE2 
2232 N N   . ASP A 289 ? 0.30471 0.31087 0.31174 0.00048  0.00438  0.00530  289 ASP A N   
2233 C CA  . ASP A 289 ? 0.30136 0.30861 0.30860 0.00180  0.00363  0.00577  289 ASP A CA  
2234 C C   . ASP A 289 ? 0.26846 0.27766 0.27608 0.00185  0.00314  0.00651  289 ASP A C   
2235 O O   . ASP A 289 ? 0.24727 0.25725 0.25518 0.00264  0.00276  0.00675  289 ASP A O   
2236 C CB  . ASP A 289 ? 0.30356 0.30793 0.30976 0.00313  0.00312  0.00602  289 ASP A CB  
2237 C CG  . ASP A 289 ? 0.36674 0.36855 0.37073 0.00320  0.00275  0.00726  289 ASP A CG  
2238 O OD1 . ASP A 289 ? 0.32823 0.33011 0.33161 0.00174  0.00365  0.00759  289 ASP A OD1 
2239 O OD2 . ASP A 289 ? 0.35099 0.35069 0.35389 0.00479  0.00141  0.00754  289 ASP A OD2 
2240 N N   . GLU A 290 ? 0.25336 0.26355 0.26148 0.00112  0.00300  0.00647  290 GLU A N   
2241 C CA  . GLU A 290 ? 0.37627 0.38768 0.38464 0.00131  0.00233  0.00707  290 GLU A CA  
2242 C C   . GLU A 290 ? 0.34112 0.35326 0.34911 0.00112  0.00125  0.00681  290 GLU A C   
2243 O O   . GLU A 290 ? 0.30807 0.32045 0.31631 0.00129  0.00023  0.00692  290 GLU A O   
2244 C CB  . GLU A 290 ? 0.34623 0.35750 0.35521 0.00091  0.00270  0.00700  290 GLU A CB  
2245 C CG  . GLU A 290 ? 0.32678 0.33553 0.33381 0.00089  0.00346  0.00769  290 GLU A CG  
2246 C CD  . GLU A 290 ? 0.40481 0.41322 0.41124 0.00033  0.00392  0.00785  290 GLU A CD  
2247 O OE1 . GLU A 290 ? 0.36964 0.38030 0.37824 -0.00005 0.00391  0.00699  290 GLU A OE1 
2248 O OE2 . GLU A 290 ? 0.41379 0.41932 0.41731 0.00038  0.00404  0.00865  290 GLU A OE2 
2249 N N   . PHE A 291 ? 0.28055 0.29234 0.28728 0.00079  0.00126  0.00640  291 PHE A N   
2250 C CA  . PHE A 291 ? 0.26432 0.27509 0.26833 0.00029  0.00024  0.00650  291 PHE A CA  
2251 C C   . PHE A 291 ? 0.28404 0.29474 0.28634 -0.00056 0.00166  0.00644  291 PHE A C   
2252 O O   . PHE A 291 ? 0.24856 0.25994 0.25155 -0.00070 0.00277  0.00550  291 PHE A O   
2253 C CB  . PHE A 291 ? 0.26129 0.27139 0.26442 0.00011  -0.00086 0.00553  291 PHE A CB  
2254 C CG  . PHE A 291 ? 0.30082 0.31188 0.30666 0.00082  -0.00238 0.00454  291 PHE A CG  
2255 C CD1 . PHE A 291 ? 0.32908 0.33935 0.33450 0.00161  -0.00483 0.00444  291 PHE A CD1 
2256 C CD2 . PHE A 291 ? 0.35556 0.36814 0.36445 0.00057  -0.00141 0.00323  291 PHE A CD2 
2257 C CE1 . PHE A 291 ? 0.34657 0.35872 0.35591 0.00245  -0.00636 0.00255  291 PHE A CE1 
2258 C CE2 . PHE A 291 ? 0.39139 0.40576 0.40372 0.00076  -0.00234 0.00140  291 PHE A CE2 
2259 C CZ  . PHE A 291 ? 0.35511 0.36984 0.36830 0.00185  -0.00489 0.00080  291 PHE A CZ  
2260 N N   . THR A 292 ? 0.27431 0.28423 0.27460 -0.00131 0.00176  0.00701  292 THR A N   
2261 C CA  . THR A 292 ? 0.32817 0.33839 0.32697 -0.00285 0.00363  0.00618  292 THR A CA  
2262 C C   . THR A 292 ? 0.32598 0.33353 0.31986 -0.00453 0.00379  0.00578  292 THR A C   
2263 O O   . THR A 292 ? 0.28388 0.28874 0.27494 -0.00420 0.00170  0.00649  292 THR A O   
2264 C CB  . THR A 292 ? 0.30811 0.31802 0.30593 -0.00380 0.00415  0.00658  292 THR A CB  
2265 O OG1 . THR A 292 ? 0.30579 0.31145 0.29846 -0.00470 0.00276  0.00780  292 THR A OG1 
2266 C CG2 . THR A 292 ? 0.27589 0.28793 0.27773 -0.00215 0.00358  0.00703  292 THR A CG2 
2267 N N   . PRO A 293 ? 0.30638 0.31463 0.29917 -0.00638 0.00617  0.00425  293 PRO A N   
2268 C CA  . PRO A 293 ? 0.34218 0.34684 0.32848 -0.00867 0.00667  0.00390  293 PRO A CA  
2269 C C   . PRO A 293 ? 0.33044 0.32938 0.30956 -0.00989 0.00502  0.00568  293 PRO A C   
2270 O O   . PRO A 293 ? 0.33343 0.32790 0.30679 -0.01023 0.00305  0.00631  293 PRO A O   
2271 C CB  . PRO A 293 ? 0.35176 0.35889 0.33894 -0.01095 0.01029  0.00136  293 PRO A CB  
2272 C CG  . PRO A 293 ? 0.31248 0.32497 0.30806 -0.00846 0.01056  0.00005  293 PRO A CG  
2273 C CD  . PRO A 293 ? 0.28875 0.30123 0.28652 -0.00625 0.00830  0.00220  293 PRO A CD  
2274 N N   . PHE A 294 ? 0.35915 0.35757 0.33821 -0.01037 0.00534  0.00643  294 PHE A N   
2275 C CA  . PHE A 294 ? 0.36131 0.35320 0.33324 -0.01122 0.00332  0.00821  294 PHE A CA  
2276 C C   . PHE A 294 ? 0.34344 0.33391 0.31635 -0.00808 -0.00099 0.00944  294 PHE A C   
2277 O O   . PHE A 294 ? 0.40607 0.39040 0.37239 -0.00804 -0.00394 0.01037  294 PHE A O   
2278 C CB  . PHE A 294 ? 0.46463 0.45660 0.43705 -0.01242 0.00476  0.00845  294 PHE A CB  
2279 C CG  . PHE A 294 ? 0.62108 0.60499 0.58490 -0.01388 0.00311  0.01016  294 PHE A CG  
2280 C CD1 . PHE A 294 ? 0.71017 0.68685 0.66370 -0.01723 0.00383  0.01043  294 PHE A CD1 
2281 C CD2 . PHE A 294 ? 0.64155 0.62426 0.60678 -0.01206 0.00078  0.01141  294 PHE A CD2 
2282 C CE1 . PHE A 294 ? 0.77203 0.73938 0.71603 -0.01861 0.00189  0.01223  294 PHE A CE1 
2283 C CE2 . PHE A 294 ? 0.73137 0.70568 0.68836 -0.01315 -0.00114 0.01292  294 PHE A CE2 
2284 C CZ  . PHE A 294 ? 0.72180 0.68792 0.66778 -0.01636 -0.00079 0.01349  294 PHE A CZ  
2285 N N   . ASP A 295 ? 0.31141 0.30718 0.29226 -0.00553 -0.00148 0.00910  295 ASP A N   
2286 C CA  . ASP A 295 ? 0.30175 0.29759 0.28505 -0.00295 -0.00485 0.00922  295 ASP A CA  
2287 C C   . ASP A 295 ? 0.41267 0.40650 0.39321 -0.00262 -0.00688 0.00859  295 ASP A C   
2288 O O   . ASP A 295 ? 0.40332 0.39410 0.38192 -0.00115 -0.01067 0.00858  295 ASP A O   
2289 C CB  . ASP A 295 ? 0.30462 0.30622 0.29593 -0.00131 -0.00394 0.00854  295 ASP A CB  
2290 C CG  . ASP A 295 ? 0.43302 0.43606 0.42687 -0.00099 -0.00319 0.00911  295 ASP A CG  
2291 O OD1 . ASP A 295 ? 0.44765 0.44742 0.43803 -0.00157 -0.00400 0.00993  295 ASP A OD1 
2292 O OD2 . ASP A 295 ? 0.31835 0.32507 0.31696 -0.00027 -0.00192 0.00874  295 ASP A OD2 
2293 N N   . VAL A 296 ? 0.35826 0.35391 0.33901 -0.00374 -0.00473 0.00769  296 VAL A N   
2294 C CA  . VAL A 296 ? 0.30241 0.29646 0.28066 -0.00357 -0.00651 0.00684  296 VAL A CA  
2295 C C   . VAL A 296 ? 0.37228 0.35879 0.34047 -0.00490 -0.00869 0.00771  296 VAL A C   
2296 O O   . VAL A 296 ? 0.35792 0.34113 0.32334 -0.00342 -0.01286 0.00754  296 VAL A O   
2297 C CB  . VAL A 296 ? 0.27656 0.27386 0.25702 -0.00463 -0.00346 0.00553  296 VAL A CB  
2298 C CG1 . VAL A 296 ? 0.32288 0.31836 0.30030 -0.00472 -0.00521 0.00452  296 VAL A CG1 
2299 C CG2 . VAL A 296 ? 0.26021 0.26292 0.24895 -0.00318 -0.00205 0.00493  296 VAL A CG2 
2300 N N   . VAL A 297 ? 0.38953 0.37280 0.35176 -0.00783 -0.00600 0.00839  297 VAL A N   
2301 C CA  . VAL A 297 ? 0.37472 0.34903 0.32515 -0.00995 -0.00754 0.00942  297 VAL A CA  
2302 C C   . VAL A 297 ? 0.46200 0.43080 0.40921 -0.00780 -0.01245 0.01086  297 VAL A C   
2303 O O   . VAL A 297 ? 0.41037 0.37228 0.35019 -0.00706 -0.01680 0.01130  297 VAL A O   
2304 C CB  . VAL A 297 ? 0.43451 0.40682 0.37986 -0.01417 -0.00284 0.00941  297 VAL A CB  
2305 C CG1 . VAL A 297 ? 0.49973 0.46093 0.43141 -0.01682 -0.00433 0.01096  297 VAL A CG1 
2306 C CG2 . VAL A 297 ? 0.41530 0.39177 0.36240 -0.01626 0.00124  0.00726  297 VAL A CG2 
2307 N N   . ARG A 298 ? 0.42973 0.40135 0.38257 -0.00650 -0.01223 0.01134  298 ARG A N   
2308 C CA  . ARG A 298 ? 0.43768 0.40486 0.38904 -0.00407 -0.01689 0.01217  298 ARG A CA  
2309 C C   . ARG A 298 ? 0.38129 0.34944 0.33604 -0.00048 -0.02192 0.01081  298 ARG A C   
2310 O O   . ARG A 298 ? 0.46181 0.42270 0.41018 0.00103  -0.02711 0.01111  298 ARG A O   
2311 C CB  . ARG A 298 ? 0.43639 0.40849 0.39543 -0.00301 -0.01543 0.01224  298 ARG A CB  
2312 C CG  . ARG A 298 ? 0.57064 0.54101 0.52636 -0.00613 -0.01165 0.01326  298 ARG A CG  
2313 C CD  . ARG A 298 ? 0.67533 0.64796 0.63638 -0.00462 -0.01198 0.01349  298 ARG A CD  
2314 N NE  . ARG A 298 ? 0.59527 0.57716 0.56716 -0.00285 -0.01034 0.01230  298 ARG A NE  
2315 C CZ  . ARG A 298 ? 0.51685 0.50208 0.49509 0.00014  -0.01272 0.01138  298 ARG A CZ  
2316 N NH1 . ARG A 298 ? 0.45634 0.43768 0.43298 0.00233  -0.01727 0.01104  298 ARG A NH1 
2317 N NH2 . ARG A 298 ? 0.47883 0.47114 0.46499 0.00086  -0.01056 0.01047  298 ARG A NH2 
2318 N N   . GLN A 299 ? 0.37007 0.34686 0.33484 0.00092  -0.02064 0.00901  299 GLN A N   
2319 C CA  . GLN A 299 ? 0.36443 0.34368 0.33442 0.00405  -0.02485 0.00686  299 GLN A CA  
2320 C C   . GLN A 299 ? 0.44357 0.41880 0.40747 0.00396  -0.02767 0.00624  299 GLN A C   
2321 O O   . GLN A 299 ? 0.41977 0.39260 0.38321 0.00664  -0.03325 0.00483  299 GLN A O   
2322 C CB  . GLN A 299 ? 0.37690 0.36571 0.35834 0.00472  -0.02200 0.00499  299 GLN A CB  
2323 C CG  . GLN A 299 ? 0.35026 0.34264 0.33835 0.00740  -0.02563 0.00195  299 GLN A CG  
2324 C CD  . GLN A 299 ? 0.38227 0.38292 0.38068 0.00743  -0.02249 -0.00003 299 GLN A CD  
2325 O OE1 . GLN A 299 ? 0.33664 0.34134 0.34102 0.00851  -0.02389 -0.00307 299 GLN A OE1 
2326 N NE2 . GLN A 299 ? 0.34276 0.34557 0.34293 0.00606  -0.01828 0.00142  299 GLN A NE2 
2327 N N   . CYS A 300 ? 0.38750 0.36204 0.34688 0.00102  -0.02412 0.00686  300 CYS A N   
2328 C CA  . CYS A 300 ? 0.42937 0.40013 0.38253 0.00061  -0.02644 0.00612  300 CYS A CA  
2329 C C   . CYS A 300 ? 0.40427 0.36330 0.34320 -0.00045 -0.02986 0.00792  300 CYS A C   
2330 O O   . CYS A 300 ? 0.44500 0.39928 0.37758 -0.00004 -0.03358 0.00729  300 CYS A O   
2331 C CB  . CYS A 300 ? 0.35357 0.32813 0.30756 -0.00214 -0.02126 0.00559  300 CYS A CB  
2332 S SG  . CYS A 300 ? 0.44709 0.43278 0.41530 -0.00081 -0.01843 0.00340  300 CYS A SG  
2333 N N   . SER A 301 ? 0.43706 0.39060 0.37013 -0.00195 -0.02886 0.01007  301 SER A N   
2334 C CA  . SER A 301 ? 0.41254 0.35310 0.33041 -0.00348 -0.03191 0.01203  301 SER A CA  
2335 C C   . SER A 301 ? 0.46246 0.39702 0.37839 -0.00032 -0.03769 0.01285  301 SER A C   
2336 O O   . SER A 301 ? 0.48992 0.41194 0.39219 -0.00122 -0.04110 0.01469  301 SER A O   
2337 C CB  . SER A 301 ? 0.48940 0.42625 0.39945 -0.00879 -0.02578 0.01361  301 SER A CB  
2338 O OG  . SER A 301 ? 0.62347 0.56407 0.53946 -0.00907 -0.02281 0.01424  301 SER A OG  
2339 N N   . GLY A 302 ? 0.42619 0.36863 0.35474 0.00316  -0.03882 0.01140  302 GLY A N   
2340 C CA  . GLY A 302 ? 0.43460 0.37231 0.36298 0.00669  -0.04461 0.01137  302 GLY A CA  
2341 C C   . GLY A 302 ? 0.46879 0.39971 0.39063 0.00472  -0.04303 0.01389  302 GLY A C   
2342 O O   . GLY A 302 ? 0.49638 0.41670 0.40977 0.00627  -0.04845 0.01493  302 GLY A O   
2343 N N   . VAL A 303 ? 0.42304 0.35949 0.34859 0.00147  -0.03602 0.01467  303 VAL A N   
2344 C CA  . VAL A 303 ? 0.42474 0.35597 0.34542 -0.00069 -0.03401 0.01658  303 VAL A CA  
2345 C C   . VAL A 303 ? 0.48538 0.41763 0.41273 0.00341  -0.03802 0.01581  303 VAL A C   
2346 O O   . VAL A 303 ? 0.46373 0.40651 0.40433 0.00617  -0.03774 0.01362  303 VAL A O   
2347 C CB  . VAL A 303 ? 0.42995 0.36890 0.35567 -0.00442 -0.02611 0.01664  303 VAL A CB  
2348 C CG1 . VAL A 303 ? 0.48078 0.41615 0.40388 -0.00634 -0.02407 0.01794  303 VAL A CG1 
2349 C CG2 . VAL A 303 ? 0.51555 0.45268 0.43412 -0.00872 -0.02209 0.01685  303 VAL A CG2 
2350 N N   . THR A 304 ? 0.41570 0.33648 0.33340 0.00359  -0.04163 0.01741  304 THR A N   
2351 C CA  . THR A 304 ? 0.47162 0.39177 0.39443 0.00745  -0.04579 0.01653  304 THR A CA  
2352 C C   . THR A 304 ? 0.52706 0.44471 0.44755 0.00459  -0.04186 0.01819  304 THR A C   
2353 O O   . THR A 304 ? 0.50069 0.41635 0.41499 -0.00042 -0.03635 0.01984  304 THR A O   
2354 C CB  . THR A 304 ? 0.48995 0.39790 0.40390 0.01102  -0.05466 0.01657  304 THR A CB  
2355 O OG1 . THR A 304 ? 0.48733 0.38013 0.38295 0.00727  -0.05508 0.01978  304 THR A OG1 
2356 C CG2 . THR A 304 ? 0.43925 0.35149 0.35804 0.01450  -0.05910 0.01403  304 THR A CG2 
2357 N N   . PHE A 305 ? 0.49871 0.41688 0.42481 0.00777  -0.04471 0.01720  305 PHE A N   
2358 C CA  . PHE A 305 ? 0.57408 0.49088 0.49967 0.00559  -0.04140 0.01827  305 PHE A CA  
2359 C C   . PHE A 305 ? 0.67378 0.57950 0.59363 0.00837  -0.04762 0.01859  305 PHE A C   
2360 O O   . PHE A 305 ? 0.63630 0.54021 0.55868 0.01338  -0.05446 0.01679  305 PHE A O   
2361 C CB  . PHE A 305 ? 0.53508 0.46632 0.47575 0.00625  -0.03699 0.01635  305 PHE A CB  
2362 C CG  . PHE A 305 ? 0.52338 0.46484 0.47007 0.00443  -0.03200 0.01579  305 PHE A CG  
2363 C CD1 . PHE A 305 ? 0.43688 0.37877 0.37943 -0.00027 -0.02629 0.01716  305 PHE A CD1 
2364 C CD2 . PHE A 305 ? 0.47157 0.42170 0.42780 0.00732  -0.03315 0.01352  305 PHE A CD2 
2365 C CE1 . PHE A 305 ? 0.44066 0.39121 0.38863 -0.00152 -0.02228 0.01640  305 PHE A CE1 
2366 C CE2 . PHE A 305 ? 0.46923 0.42732 0.42997 0.00565  -0.02883 0.01313  305 PHE A CE2 
2367 C CZ  . PHE A 305 ? 0.50333 0.46142 0.45990 0.00150  -0.02368 0.01465  305 PHE A CZ  
2368 N N   . GLN A 306 ? 0.70995 0.60823 0.62231 0.00508  -0.04528 0.02052  306 GLN A N   
2369 C CA  . GLN A 306 ? 0.77179 0.65761 0.67684 0.00703  -0.05072 0.02121  306 GLN A CA  
2370 C C   . GLN A 306 ? 0.70450 0.59664 0.61942 0.00802  -0.04878 0.01983  306 GLN A C   
2371 O O   . GLN A 306 ? 0.95964 0.84206 0.86754 0.00700  -0.04981 0.02100  306 GLN A O   
2372 C CB  . GLN A 306 ? 0.75205 0.62141 0.63805 0.00193  -0.04991 0.02458  306 GLN A CB  
2373 C CG  . GLN A 306 ? 0.76761 0.62788 0.64118 0.00096  -0.05272 0.02601  306 GLN A CG  
2374 C CD  . GLN A 306 ? 0.88002 0.73072 0.74914 0.00697  -0.06300 0.02549  306 GLN A CD  
2375 O OE1 . GLN A 306 ? 0.93627 0.77811 0.80231 0.00986  -0.06824 0.02554  306 GLN A OE1 
2376 N NE2 . GLN A 306 ? 0.82739 0.67990 0.69659 0.00911  -0.06627 0.02464  306 GLN A NE2 
2377 N N1  . THC B 1   ? 0.56069 0.42334 0.39583 -0.01687 -0.01115 0.02698  0   THC C N1  
2378 C CN  . THC B 1   ? 0.62300 0.46617 0.43869 -0.01878 -0.01322 0.02956  0   THC C CN  
2379 O ON  . THC B 1   ? 0.62635 0.46118 0.42992 -0.02579 -0.00744 0.02965  0   THC C ON  
2380 C CM  . THC B 1   ? 0.60891 0.44393 0.42168 -0.01296 -0.02090 0.03139  0   THC C CM  
2381 C CA  . THC B 1   ? 0.56551 0.43760 0.40613 -0.02134 -0.00456 0.02465  0   THC C CA  
2382 C CB  . THC B 1   ? 0.61996 0.50265 0.47263 -0.02467 0.00263  0.02245  0   THC C CB  
2383 O OG1 . THC B 1   ? 0.62073 0.49240 0.46323 -0.02887 0.00564  0.02336  0   THC C OG1 
2384 C CG2 . THC B 1   ? 0.56341 0.45516 0.42161 -0.02917 0.00915  0.01941  0   THC C CG2 
2385 C C   . THC B 1   ? 0.57335 0.45759 0.42575 -0.01677 -0.00791 0.02337  0   THC C C   
2386 O O   . THC B 1   ? 0.53417 0.42596 0.39777 -0.01101 -0.01251 0.02323  0   THC C O   
2387 N N   . SER B 2   ? 0.50830 0.39426 0.35804 -0.01962 -0.00539 0.02213  1   SER C N   
2388 C CA  . SER B 2   ? 0.48216 0.37916 0.34261 -0.01585 -0.00815 0.02074  1   SER C CA  
2389 C C   . SER B 2   ? 0.51498 0.42858 0.39400 -0.01570 -0.00385 0.01833  1   SER C C   
2390 O O   . SER B 2   ? 0.50115 0.41795 0.38346 -0.01972 0.00227  0.01703  1   SER C O   
2391 C CB  . SER B 2   ? 0.48113 0.37339 0.33154 -0.01879 -0.00737 0.02018  1   SER C CB  
2392 O OG  . SER B 2   ? 0.53724 0.43322 0.38859 -0.02492 0.00071  0.01798  1   SER C OG  
2393 N N   . ALA B 3   ? 0.42481 0.34855 0.31580 -0.01100 -0.00737 0.01753  2   ALA C N   
2394 C CA  . ALA B 3   ? 0.40285 0.34076 0.30955 -0.01084 -0.00393 0.01540  2   ALA C CA  
2395 C C   . ALA B 3   ? 0.39367 0.33449 0.29997 -0.01505 0.00105  0.01332  2   ALA C C   
2396 O O   . ALA B 3   ? 0.41724 0.35228 0.31413 -0.01658 0.00041  0.01330  2   ALA C O   
2397 C CB  . ALA B 3   ? 0.43183 0.37832 0.34938 -0.00564 -0.00854 0.01491  2   ALA C CB  
2398 N N   . VAL B 4   ? 0.35718 0.30691 0.27379 -0.01680 0.00581  0.01124  3   VAL C N   
2399 C CA  . VAL B 4   ? 0.33292 0.28671 0.25145 -0.02058 0.01080  0.00839  3   VAL C CA  
2400 C C   . VAL B 4   ? 0.35868 0.32475 0.29209 -0.01792 0.01061  0.00661  3   VAL C C   
2401 O O   . VAL B 4   ? 0.34792 0.32035 0.29105 -0.01654 0.01124  0.00618  3   VAL C O   
2402 C CB  . VAL B 4   ? 0.42201 0.37429 0.33865 -0.02566 0.01695  0.00660  3   VAL C CB  
2403 C CG1 . VAL B 4   ? 0.42665 0.38449 0.34714 -0.02926 0.02204  0.00264  3   VAL C CG1 
2404 C CG2 . VAL B 4   ? 0.47318 0.41154 0.37340 -0.02890 0.01741  0.00858  3   VAL C CG2 
2405 N N   . LEU B 5   ? 0.32982 0.29845 0.26425 -0.01737 0.00969  0.00555  4   LEU C N   
2406 C CA  . LEU B 5   ? 0.29511 0.27380 0.24217 -0.01520 0.00950  0.00388  4   LEU C CA  
2407 C C   . LEU B 5   ? 0.32117 0.30503 0.27425 -0.01808 0.01462  0.00054  4   LEU C C   
2408 O O   . LEU B 5   ? 0.38500 0.36662 0.33306 -0.02177 0.01810  -0.00163 4   LEU C O   
2409 C CB  . LEU B 5   ? 0.37613 0.35541 0.32216 -0.01370 0.00667  0.00368  4   LEU C CB  
2410 C CG  . LEU B 5   ? 0.54265 0.52794 0.49804 -0.00946 0.00298  0.00454  4   LEU C CG  
2411 C CD1 . LEU B 5   ? 0.65529 0.63920 0.60805 -0.00712 -0.00154 0.00516  4   LEU C CD1 
2412 C CD2 . LEU B 5   ? 0.48696 0.48039 0.45337 -0.00917 0.00495  0.00255  4   LEU C CD2 
2413 N N   . GLN B 6   ? 0.28944 0.28008 0.25318 -0.01643 0.01496  -0.00027 5   GLN C N   
2414 C CA  . GLN B 6   ? 0.31612 0.31140 0.28606 -0.01873 0.01920  -0.00381 5   GLN C CA  
2415 C C   . GLN B 6   ? 0.35927 0.36111 0.33760 -0.01785 0.01962  -0.00682 5   GLN C C   
2416 O O   . GLN B 6   ? 0.28310 0.29084 0.27105 -0.01657 0.01991  -0.00888 5   GLN C O   
2417 C CB  . GLN B 6   ? 0.28340 0.28130 0.25915 -0.01753 0.01904  -0.00334 5   GLN C CB  
2418 C CG  . GLN B 6   ? 0.30683 0.29780 0.27400 -0.01967 0.02012  -0.00155 5   GLN C CG  
2419 C CD  . GLN B 6   ? 0.32463 0.31819 0.29734 -0.01905 0.02052  -0.00161 5   GLN C CD  
2420 O OE1 . GLN B 6   ? 0.31555 0.31165 0.29313 -0.01553 0.01727  0.00024  5   GLN C OE1 
2421 N NE2 . GLN B 6   ? 0.30517 0.29804 0.27694 -0.02284 0.02477  -0.00406 5   GLN C NE2 
2422 N N   . SER B 7   ? 0.32726 0.32741 0.30141 -0.01846 0.01931  -0.00721 6   SER C N   
2423 C CA  . SER B 7   ? 0.30154 0.30656 0.28176 -0.01882 0.02086  -0.01090 6   SER C CA  
2424 C C   . SER B 7   ? 0.31544 0.32128 0.29530 -0.02312 0.02627  -0.01526 6   SER C C   
2425 O O   . SER B 7   ? 0.33434 0.33609 0.30782 -0.02629 0.02898  -0.01508 6   SER C O   
2426 C CB  . SER B 7   ? 0.34662 0.34948 0.32215 -0.01841 0.01901  -0.01020 6   SER C CB  
2427 O OG  . SER B 7   ? 0.40079 0.39651 0.36405 -0.02141 0.02016  -0.00933 6   SER C OG  
2428 N N   . GLY B 8   ? 0.30939 0.32050 0.29637 -0.02342 0.02801  -0.01962 7   GLY C N   
2429 C CA  . GLY B 8   ? 0.34583 0.35922 0.33433 -0.02759 0.03349  -0.02500 7   GLY C CA  
2430 C C   . GLY B 8   ? 0.37182 0.38484 0.35721 -0.02997 0.03580  -0.02802 7   GLY C C   
2431 O O   . GLY B 8   ? 0.34989 0.36242 0.33478 -0.02755 0.03263  -0.02639 7   GLY C O   
2432 N N   . PHE B 9   ? 0.45089 0.46413 0.43403 -0.03503 0.04158  -0.03272 8   PHE C N   
2433 C CA  . PHE B 9   ? 0.48116 0.49407 0.46098 -0.03787 0.04444  -0.03620 8   PHE C CA  
2434 C C   . PHE B 9   ? 0.49353 0.51526 0.48754 -0.03533 0.04422  -0.04142 8   PHE C C   
2435 O O   . PHE B 9   ? 0.45699 0.48525 0.46269 -0.03368 0.04443  -0.04476 8   PHE C O   
2436 C CB  . PHE B 9   ? 0.54200 0.55155 0.51357 -0.04496 0.05139  -0.03984 8   PHE C CB  
2437 C CG  . PHE B 9   ? 0.75643 0.75565 0.71277 -0.04783 0.05171  -0.03498 8   PHE C CG  
2438 C CD1 . PHE B 9   ? 0.82366 0.81333 0.76483 -0.04921 0.05021  -0.03124 8   PHE C CD1 
2439 C CD2 . PHE B 9   ? 0.80729 0.80582 0.76422 -0.04901 0.05313  -0.03432 8   PHE C CD2 
2440 C CE1 . PHE B 9   ? 0.92155 0.90044 0.84802 -0.05142 0.04974  -0.02682 8   PHE C CE1 
2441 C CE2 . PHE B 9   ? 0.84707 0.83509 0.78957 -0.05154 0.05318  -0.02989 8   PHE C CE2 
2442 C CZ  . PHE B 9   ? 0.92480 0.90262 0.85184 -0.05261 0.05130  -0.02608 8   PHE C CZ  
2443 N N   . ARG B 10  ? 0.44209 0.46360 0.43492 -0.03484 0.04343  -0.04232 9   ARG C N   
2444 C CA  . ARG B 10  ? 0.47588 0.50460 0.48139 -0.03229 0.04289  -0.04734 9   ARG C CA  
2445 C C   . ARG B 10  ? 0.53513 0.56945 0.54691 -0.03616 0.04899  -0.05547 9   ARG C C   
2446 O O   . ARG B 10  ? 0.57298 0.60446 0.57622 -0.04196 0.05444  -0.05782 9   ARG C O   
2447 C CB  . ARG B 10  ? 0.53178 0.55860 0.53415 -0.03121 0.04087  -0.04661 9   ARG C CB  
2448 C CG  . ARG B 10  ? 0.54912 0.58146 0.56430 -0.02656 0.03766  -0.04921 9   ARG C CG  
2449 C CD  . ARG B 10  ? 0.63054 0.66407 0.64682 -0.02731 0.03885  -0.05325 9   ARG C CD  
2450 N NE  . ARG B 10  ? 0.61273 0.64135 0.62120 -0.02639 0.03569  -0.04876 9   ARG C NE  
2451 C CZ  . ARG B 10  ? 0.61752 0.64706 0.62934 -0.02467 0.03399  -0.05043 9   ARG C CZ  
2452 N NH1 . ARG B 10  ? 0.61939 0.65398 0.64213 -0.02317 0.03462  -0.05616 9   ARG C NH1 
2453 N NH2 . ARG B 10  ? 0.55868 0.58397 0.56309 -0.02430 0.03134  -0.04659 9   ARG C NH2 
2454 N N   . LYS B 11  ? 0.53764 0.57965 0.56414 -0.03302 0.04794  -0.06010 10  LYS C N   
2455 C CA  . LYS B 11  ? 0.56875 0.61798 0.60450 -0.03590 0.05318  -0.06903 10  LYS C CA  
2456 C C   . LYS B 11  ? 0.59435 0.64834 0.63859 -0.03425 0.05306  -0.07484 10  LYS C C   
2457 O O   . LYS B 11  ? 0.57016 0.62205 0.61452 -0.03017 0.04823  -0.07168 10  LYS C O   
2458 C CB  . LYS B 11  ? 0.60895 0.66403 0.65639 -0.03330 0.05175  -0.07136 10  LYS C CB  
2459 C CG  . LYS B 11  ? 0.73625 0.78660 0.77622 -0.03405 0.05099  -0.06524 10  LYS C CG  
2460 C CD  . LYS B 11  ? 0.73640 0.79285 0.78748 -0.03250 0.05052  -0.06852 10  LYS C CD  
2461 C CE  . LYS B 11  ? 0.75945 0.81743 0.81870 -0.02515 0.04289  -0.06572 10  LYS C CE  
2462 N NZ  . LYS B 11  ? 0.72457 0.78421 0.78765 -0.02394 0.04144  -0.06479 10  LYS C NZ  
2463 O O   . HOH C .   ? 0.47982 0.44901 0.50452 0.00910  -0.01720 -0.02285 401 HOH A O   
2464 O O   . HOH C .   ? 0.70166 0.60584 0.53412 -0.02096 -0.01669 0.00752  402 HOH A O   
2465 O O   . HOH C .   ? 0.51525 0.51966 0.56293 0.02232  0.00145  -0.04028 403 HOH A O   
2466 O O   . HOH C .   ? 0.37291 0.41367 0.40525 -0.00267 -0.00153 -0.00955 404 HOH A O   
2467 O O   . HOH C .   ? 0.52957 0.55380 0.55874 0.01526  -0.00762 -0.00611 405 HOH A O   
2468 O O   . HOH C .   ? 0.60506 0.55954 0.56587 -0.00196 0.00153  0.01435  406 HOH A O   
2469 O O   . HOH C .   ? 0.44178 0.45657 0.45568 0.00004  0.00264  0.00432  407 HOH A O   
2470 O O   . HOH C .   ? 0.60505 0.56217 0.61173 0.01246  0.00039  -0.01820 408 HOH A O   
2471 O O   . HOH C .   ? 0.69201 0.56695 0.57516 0.00591  -0.05689 0.02288  409 HOH A O   
2472 O O   . HOH C .   ? 0.55108 0.53625 0.48364 -0.01987 0.00381  -0.01384 410 HOH A O   
2473 O O   . HOH C .   ? 0.55588 0.45400 0.42997 0.01716  -0.05126 0.01881  411 HOH A O   
2474 O O   . HOH C .   ? 0.74490 0.67984 0.60487 -0.04852 0.02922  -0.01132 412 HOH A O   
2475 O O   . HOH C .   ? 0.47303 0.47049 0.47099 0.00584  -0.01516 0.00722  413 HOH A O   
2476 O O   . HOH C .   ? 0.36817 0.38029 0.40678 0.00176  0.00105  -0.03378 414 HOH A O   
2477 O O   . HOH C .   ? 0.65867 0.52909 0.53232 0.01057  -0.06820 0.02085  415 HOH A O   
2478 O O   . HOH C .   ? 0.48129 0.50017 0.46476 -0.01351 -0.01139 -0.03151 416 HOH A O   
2479 O O   . HOH C .   ? 0.41634 0.41686 0.44265 -0.00516 0.00028  -0.03292 417 HOH A O   
2480 O O   . HOH C .   ? 0.53345 0.44266 0.48492 0.01816  -0.01973 0.00970  418 HOH A O   
2481 O O   . HOH C .   ? 0.51721 0.41075 0.45731 0.00137  -0.03395 0.01300  419 HOH A O   
2482 O O   . HOH C .   ? 0.47880 0.44773 0.41937 -0.03859 0.03703  -0.00540 420 HOH A O   
2483 O O   . HOH C .   ? 0.49794 0.41085 0.45326 -0.00786 -0.01939 0.00853  421 HOH A O   
2484 O O   . HOH C .   ? 0.64500 0.58702 0.51983 -0.01532 -0.01738 -0.00149 422 HOH A O   
2485 O O   . HOH C .   ? 0.57966 0.57176 0.57540 -0.00013 0.00484  0.00856  423 HOH A O   
2486 O O   . HOH C .   ? 0.51266 0.48422 0.50287 -0.01580 0.01730  -0.00223 424 HOH A O   
2487 O O   . HOH C .   ? 0.56860 0.55741 0.54544 -0.01973 0.00965  0.00821  425 HOH A O   
2488 O O   . HOH C .   ? 0.54043 0.57449 0.54819 0.01044  -0.03825 -0.02363 426 HOH A O   
2489 O O   . HOH C .   ? 0.34748 0.41113 0.38324 -0.03926 0.05525  -0.05868 427 HOH A O   
2490 O O   . HOH C .   ? 0.49572 0.51941 0.52509 -0.01015 0.00012  -0.02437 428 HOH A O   
2491 O O   . HOH C .   ? 0.41936 0.45574 0.46903 0.01845  -0.00512 -0.02181 429 HOH A O   
2492 O O   . HOH C .   ? 0.50083 0.53147 0.52089 -0.02023 0.03023  -0.03327 430 HOH A O   
2493 O O   . HOH C .   ? 0.49214 0.48031 0.48772 -0.00184 0.00658  0.00654  431 HOH A O   
2494 O O   . HOH C .   ? 0.52664 0.55559 0.55043 -0.01339 -0.00061 -0.01473 432 HOH A O   
2495 O O   . HOH C .   ? 0.50234 0.51515 0.53157 -0.00375 0.00442  -0.03333 433 HOH A O   
2496 O O   . HOH C .   ? 0.54358 0.57303 0.56134 -0.01231 0.01230  -0.00526 434 HOH A O   
2497 O O   . HOH C .   ? 0.31720 0.34901 0.34961 -0.01158 0.01922  -0.01998 435 HOH A O   
2498 O O   . HOH C .   ? 0.44247 0.51136 0.49411 -0.02647 0.04287  -0.05336 436 HOH A O   
2499 O O   . HOH C .   ? 0.47959 0.44556 0.43978 -0.01561 -0.00053 0.01433  437 HOH A O   
2500 O O   . HOH C .   ? 0.46377 0.41548 0.45773 0.01875  -0.03746 0.00087  438 HOH A O   
2501 O O   . HOH C .   ? 0.54361 0.50360 0.54346 0.03692  -0.03291 -0.00489 439 HOH A O   
2502 O O   . HOH C .   ? 0.47516 0.48556 0.48362 -0.00553 0.01574  -0.02447 440 HOH A O   
2503 O O   . HOH C .   ? 0.47478 0.46197 0.45501 0.03012  -0.04813 -0.00194 441 HOH A O   
2504 O O   . HOH C .   ? 0.40111 0.45483 0.45427 0.00151  0.01228  -0.02920 442 HOH A O   
2505 O O   . HOH C .   ? 0.29245 0.34158 0.34818 -0.00244 0.02985  -0.05988 443 HOH A O   
2506 O O   . HOH C .   ? 0.37956 0.38922 0.38480 0.00199  -0.00392 0.00718  444 HOH A O   
2507 O O   . HOH C .   ? 0.50187 0.53695 0.53517 0.00662  0.00133  -0.00888 445 HOH A O   
2508 O O   . HOH C .   ? 0.49587 0.53411 0.58407 0.02280  -0.01770 -0.04784 446 HOH A O   
2509 O O   . HOH C .   ? 0.38327 0.35931 0.37546 0.00187  0.00385  0.00491  447 HOH A O   
2510 O O   . HOH C .   ? 0.38016 0.40119 0.37695 -0.00953 -0.00822 -0.02142 448 HOH A O   
2511 O O   . HOH C .   ? 0.32206 0.32818 0.32442 0.00041  0.00366  0.00921  449 HOH A O   
2512 O O   . HOH C .   ? 0.48734 0.45129 0.42856 0.00076  -0.03353 0.00293  450 HOH A O   
2513 O O   . HOH C .   ? 0.49969 0.50136 0.45520 -0.03412 0.03259  -0.02362 451 HOH A O   
2514 O O   . HOH C .   ? 0.33360 0.34944 0.35932 0.00554  -0.00425 -0.00376 452 HOH A O   
2515 O O   . HOH C .   ? 0.59083 0.55034 0.52024 -0.00621 -0.02483 0.00500  453 HOH A O   
2516 O O   . HOH C .   ? 0.45180 0.43434 0.40558 -0.03320 0.03349  -0.00801 454 HOH A O   
2517 O O   . HOH C .   ? 0.60283 0.56759 0.59303 -0.02651 0.02505  -0.01034 455 HOH A O   
2518 O O   . HOH C .   ? 0.51747 0.48062 0.49881 0.01024  -0.00639 0.00901  456 HOH A O   
2519 O O   . HOH C .   ? 0.48067 0.43378 0.39041 -0.02288 0.01049  0.00526  457 HOH A O   
2520 O O   . HOH C .   ? 0.47437 0.47410 0.51903 0.02126  -0.02453 -0.02111 458 HOH A O   
2521 O O   . HOH C .   ? 0.39701 0.39949 0.39328 -0.00022 -0.00386 0.01046  459 HOH A O   
2522 O O   . HOH C .   ? 0.54508 0.58315 0.56861 0.01093  -0.02565 -0.01531 460 HOH A O   
2523 O O   . HOH C .   ? 0.61172 0.50558 0.49539 0.00585  -0.05863 0.01750  461 HOH A O   
2524 O O   . HOH C .   ? 0.27434 0.30580 0.30351 -0.01094 0.02005  -0.02718 462 HOH A O   
2525 O O   . HOH C .   ? 0.39898 0.40818 0.39802 0.01875  -0.02870 -0.00113 463 HOH A O   
2526 O O   . HOH C .   ? 0.52711 0.55944 0.57045 0.00498  -0.00871 -0.01546 464 HOH A O   
2527 O O   . HOH C .   ? 0.43358 0.46415 0.45620 0.01416  -0.02037 -0.00729 465 HOH A O   
2528 O O   . HOH C .   ? 0.62997 0.55095 0.51067 0.01408  -0.05246 0.01059  466 HOH A O   
2529 O O   . HOH C .   ? 0.45742 0.41418 0.41302 0.02242  -0.03415 0.01166  467 HOH A O   
2530 O O   . HOH C .   ? 0.49196 0.41727 0.39216 0.01823  -0.04844 0.01371  468 HOH A O   
2531 O O   . HOH C .   ? 0.53541 0.43955 0.46447 -0.00104 -0.03203 0.01892  469 HOH A O   
2532 O O   . HOH C .   ? 0.38338 0.35305 0.35344 0.01897  -0.02515 0.01111  470 HOH A O   
2533 O O   . HOH C .   ? 0.48410 0.43982 0.38827 -0.03525 0.01297  0.00090  471 HOH A O   
2534 O O   . HOH C .   ? 0.40315 0.44060 0.43078 -0.00982 -0.00540 -0.01800 472 HOH A O   
2535 O O   . HOH C .   ? 0.58789 0.54145 0.56489 0.00748  -0.00379 0.00814  473 HOH A O   
2536 O O   . HOH C .   ? 0.42354 0.40789 0.41347 0.01317  -0.01064 0.00977  474 HOH A O   
2537 O O   . HOH C .   ? 0.25248 0.26353 0.25947 0.00042  0.00280  0.00465  475 HOH A O   
2538 O O   . HOH C .   ? 0.48774 0.48695 0.44659 -0.02241 0.01717  -0.01888 476 HOH A O   
2539 O O   . HOH C .   ? 0.37938 0.43812 0.46009 0.01844  0.00395  -0.04932 477 HOH A O   
2540 O O   . HOH C .   ? 0.40345 0.42672 0.39338 -0.00287 -0.02274 -0.02153 478 HOH A O   
2541 O O   . HOH C .   ? 0.55529 0.50975 0.44467 0.00216  -0.04787 -0.00890 479 HOH A O   
2542 O O   . HOH C .   ? 0.52239 0.42962 0.49576 0.00014  -0.02580 -0.00388 480 HOH A O   
2543 O O   . HOH C .   ? 0.37504 0.41588 0.40994 -0.01043 0.03304  -0.05182 481 HOH A O   
2544 O O   . HOH C .   ? 0.52442 0.44653 0.43827 -0.00994 -0.02248 0.02071  482 HOH A O   
2545 O O   . HOH C .   ? 0.42261 0.36914 0.41350 -0.01184 -0.00814 -0.00829 483 HOH A O   
2546 O O   . HOH C .   ? 0.44100 0.43183 0.45937 -0.03311 0.02650  -0.03039 484 HOH A O   
2547 O O   . HOH C .   ? 0.34653 0.40414 0.40044 -0.00811 0.03074  -0.05114 485 HOH A O   
2548 O O   . HOH C .   ? 0.53607 0.43788 0.51358 0.01449  -0.04051 -0.00510 486 HOH A O   
2549 O O   . HOH C .   ? 0.42021 0.42226 0.40976 -0.00581 0.00209  0.00936  487 HOH A O   
2550 O O   . HOH C .   ? 0.34244 0.37288 0.38514 -0.00324 0.01221  -0.03761 488 HOH A O   
2551 O O   . HOH C .   ? 0.34114 0.33523 0.35003 -0.00292 0.00992  -0.01403 489 HOH A O   
2552 O O   . HOH C .   ? 0.50755 0.49951 0.55680 0.03587  -0.04838 -0.02563 490 HOH A O   
2553 O O   . HOH C .   ? 0.55486 0.48218 0.47374 0.02023  -0.04089 0.01644  491 HOH A O   
2554 O O   . HOH C .   ? 0.50462 0.49303 0.45501 -0.01699 0.00107  -0.01190 492 HOH A O   
2555 O O   . HOH C .   ? 0.42229 0.43436 0.40204 -0.02295 0.02785  -0.02998 493 HOH A O   
2556 O O   . HOH C .   ? 0.41780 0.44585 0.45264 -0.00831 -0.00070 -0.02327 494 HOH A O   
2557 O O   . HOH C .   ? 0.34087 0.37011 0.34938 0.00543  -0.02202 -0.01202 495 HOH A O   
2558 O O   . HOH C .   ? 0.38003 0.41288 0.39678 -0.00700 -0.01055 -0.01882 496 HOH A O   
2559 O O   . HOH C .   ? 0.45133 0.47006 0.47694 0.01986  -0.01471 -0.00518 497 HOH A O   
2560 O O   . HOH C .   ? 0.48034 0.47047 0.41759 -0.01711 -0.00246 -0.01681 498 HOH A O   
2561 O O   . HOH C .   ? 0.54040 0.52719 0.49623 -0.00782 -0.01737 -0.00988 499 HOH A O   
2562 O O   . HOH C .   ? 0.56104 0.44992 0.51752 0.02053  -0.01915 -0.00016 500 HOH A O   
2563 O O   . HOH C .   ? 0.49770 0.46133 0.48586 -0.00475 0.00906  0.00028  501 HOH A O   
2564 O O   . HOH C .   ? 0.36691 0.39396 0.44773 0.04327  -0.02080 -0.05086 502 HOH A O   
2565 O O   . HOH C .   ? 0.43721 0.48065 0.46585 0.00082  -0.01629 -0.01833 503 HOH A O   
2566 O O   . HOH C .   ? 0.40402 0.46153 0.48677 0.00444  0.00010  -0.04215 504 HOH A O   
2567 O O   . HOH C .   ? 0.46154 0.43180 0.41774 0.01199  -0.05352 -0.00760 505 HOH A O   
2568 O O   . HOH C .   ? 0.41922 0.39896 0.36743 0.00899  -0.02994 0.00346  506 HOH A O   
2569 O O   . HOH C .   ? 0.61484 0.55172 0.55553 0.00602  -0.01228 0.01823  507 HOH A O   
2570 O O   . HOH C .   ? 0.36628 0.40415 0.37350 -0.03149 0.04318  -0.03883 508 HOH A O   
2571 O O   . HOH C .   ? 0.37875 0.37702 0.34736 -0.01964 0.01521  -0.00183 509 HOH A O   
2572 O O   . HOH C .   ? 0.36668 0.38798 0.37420 0.01161  -0.02077 -0.00312 510 HOH A O   
2573 O O   . HOH C .   ? 0.36197 0.37967 0.37338 -0.00585 0.00238  0.00374  511 HOH A O   
2574 O O   . HOH C .   ? 0.37143 0.36945 0.34692 0.01157  -0.02666 0.00167  512 HOH A O   
2575 O O   . HOH C .   ? 0.32387 0.34422 0.33539 -0.00110 0.00674  0.00123  513 HOH A O   
2576 O O   . HOH C .   ? 0.57479 0.56282 0.58961 -0.01717 0.00027  -0.02653 514 HOH A O   
2577 O O   . HOH C .   ? 0.48752 0.38921 0.43955 0.00064  -0.03005 0.00894  515 HOH A O   
2578 O O   . HOH C .   ? 0.43985 0.44756 0.43008 -0.00354 -0.02328 -0.02321 516 HOH A O   
2579 O O   . HOH C .   ? 0.37354 0.37427 0.39229 -0.01252 0.00077  -0.03131 517 HOH A O   
2580 O O   . HOH C .   ? 0.55474 0.59506 0.61001 0.00565  -0.01142 -0.02419 518 HOH A O   
2581 O O   . HOH C .   ? 0.45635 0.45093 0.48037 0.00973  0.00726  -0.02562 519 HOH A O   
2582 O O   . HOH C .   ? 0.51562 0.47344 0.45966 0.02020  -0.03857 0.01036  520 HOH A O   
2583 O O   . HOH C .   ? 0.43571 0.42462 0.41873 0.01077  -0.03856 -0.00521 521 HOH A O   
2584 O O   . HOH C .   ? 0.37349 0.37681 0.37043 -0.00552 0.00129  0.00991  522 HOH A O   
2585 O O   . HOH C .   ? 0.41483 0.37642 0.43698 0.02509  -0.03771 -0.01501 523 HOH A O   
2586 O O   . HOH C .   ? 0.48940 0.50688 0.48409 -0.01898 0.01964  -0.03499 524 HOH A O   
2587 O O   . HOH C .   ? 0.38412 0.39616 0.39923 -0.01321 0.00041  -0.01161 525 HOH A O   
2588 O O   . HOH C .   ? 0.37071 0.38936 0.38583 -0.01029 0.00201  -0.00297 526 HOH A O   
2589 O O   . HOH C .   ? 0.58073 0.54547 0.54139 0.00403  -0.02666 0.01189  527 HOH A O   
2590 O O   . HOH C .   ? 0.41246 0.44053 0.43741 0.01578  -0.01716 -0.00549 528 HOH A O   
2591 O O   . HOH C .   ? 0.43375 0.43216 0.40052 -0.02711 0.02240  -0.00376 529 HOH A O   
2592 O O   . HOH C .   ? 0.46956 0.47911 0.44413 -0.02139 0.01638  -0.03041 530 HOH A O   
2593 O O   . HOH C .   ? 0.37407 0.38195 0.37157 -0.00437 0.00289  0.00891  531 HOH A O   
2594 O O   . HOH C .   ? 0.63546 0.53290 0.48333 0.00550  -0.04793 0.01456  532 HOH A O   
2595 O O   . HOH C .   ? 0.39252 0.39124 0.38561 0.00335  -0.01350 0.00620  533 HOH A O   
2596 O O   . HOH C .   ? 0.44358 0.44585 0.42270 0.00000  0.00044  -0.00000 534 HOH A O   
2597 O O   . HOH C .   ? 0.31229 0.32365 0.32708 -0.01234 0.00375  -0.03482 535 HOH A O   
2598 O O   . HOH C .   ? 0.61718 0.62778 0.60729 -0.01466 0.01967  -0.02648 536 HOH A O   
2599 O O   . HOH C .   ? 0.41799 0.42264 0.45484 0.01290  0.00864  -0.03645 537 HOH A O   
2600 O O   . HOH C .   ? 0.47913 0.44961 0.44777 0.00279  -0.00336 0.01454  538 HOH A O   
2601 O O   . HOH C .   ? 0.55000 0.48028 0.51882 -0.00282 0.00513  0.00224  539 HOH A O   
2602 O O   . HOH C .   ? 0.38471 0.40373 0.40591 -0.00265 0.00018  -0.00648 540 HOH A O   
2603 O O   . HOH C .   ? 0.32462 0.32799 0.31748 0.00690  -0.00810 0.00928  541 HOH A O   
2604 O O   . HOH C .   ? 0.54428 0.46434 0.50998 0.03828  -0.04181 0.00370  542 HOH A O   
2605 O O   . HOH C .   ? 0.39096 0.41099 0.45062 0.01622  -0.01247 -0.03166 543 HOH A O   
2606 O O   . HOH C .   ? 0.37296 0.39654 0.39964 0.00840  0.00302  -0.00801 544 HOH A O   
2607 O O   . HOH C .   ? 0.42364 0.38454 0.41202 0.01856  -0.03935 0.00441  545 HOH A O   
2608 O O   . HOH C .   ? 0.43901 0.46806 0.46024 -0.00074 0.00705  -0.00354 546 HOH A O   
2609 O O   . HOH C .   ? 0.49629 0.51458 0.50019 -0.00782 0.01104  -0.00010 547 HOH A O   
2610 O O   . HOH C .   ? 0.66972 0.61133 0.65491 -0.01579 0.01702  -0.01295 548 HOH A O   
2611 O O   . HOH C .   ? 0.37948 0.42374 0.42998 -0.01316 0.02225  -0.03257 549 HOH A O   
2612 O O   . HOH C .   ? 0.60383 0.55003 0.52743 -0.02794 0.02193  0.00901  550 HOH A O   
2613 O O   . HOH C .   ? 0.36330 0.34054 0.35555 -0.01275 -0.00141 0.00296  551 HOH A O   
2614 O O   . HOH C .   ? 0.60284 0.59069 0.53493 -0.03572 0.02601  -0.02564 552 HOH A O   
2615 O O   . HOH C .   ? 0.54711 0.47350 0.48784 0.01097  -0.01691 0.01743  553 HOH A O   
2616 O O   . HOH C .   ? 0.43314 0.41050 0.42480 -0.00504 0.00919  0.00372  554 HOH A O   
2617 O O   . HOH C .   ? 0.28122 0.28453 0.26040 -0.00226 -0.00437 0.00225  555 HOH A O   
2618 O O   . HOH C .   ? 0.47553 0.50587 0.50069 -0.01782 0.00715  -0.01201 556 HOH A O   
2619 O O   . HOH C .   ? 0.53362 0.54251 0.54869 -0.01269 0.01464  -0.00616 557 HOH A O   
2620 O O   . HOH C .   ? 0.39859 0.42753 0.41702 -0.01618 0.01284  -0.00673 558 HOH A O   
2621 O O   . HOH C .   ? 0.48007 0.50057 0.51302 -0.01732 0.00953  -0.02757 559 HOH A O   
2622 O O   . HOH C .   ? 0.44492 0.46841 0.47508 0.00458  -0.00584 -0.00551 560 HOH A O   
2623 O O   . HOH C .   ? 0.41129 0.49629 0.49960 -0.00749 0.03483  -0.07310 561 HOH A O   
2624 O O   . HOH C .   ? 0.52244 0.51088 0.57059 0.03614  -0.01441 -0.03802 562 HOH A O   
2625 O O   . HOH C .   ? 0.43156 0.44886 0.44768 -0.01456 -0.00150 -0.02228 563 HOH A O   
2626 O O   . HOH C .   ? 0.36455 0.42649 0.43978 0.00415  0.02416  -0.06239 564 HOH A O   
2627 O O   . HOH C .   ? 0.35196 0.35991 0.35794 0.00413  -0.00971 0.00472  565 HOH A O   
2628 O O   . HOH C .   ? 0.35962 0.37519 0.36996 -0.01371 -0.00029 -0.02861 566 HOH A O   
2629 O O   . HOH C .   ? 0.60420 0.56407 0.56899 -0.02798 0.00793  0.00768  567 HOH A O   
2630 O O   . HOH C .   ? 0.46476 0.47780 0.44706 -0.01842 0.00573  -0.03511 568 HOH A O   
2631 O O   . HOH C .   ? 0.39646 0.37881 0.37675 0.01332  -0.04178 -0.00247 569 HOH A O   
2632 O O   . HOH C .   ? 0.68468 0.66315 0.69314 -0.00139 0.01052  -0.01956 570 HOH A O   
2633 O O   . HOH C .   ? 0.37099 0.37794 0.36152 0.01489  -0.02748 -0.00034 571 HOH A O   
2634 O O   . HOH C .   ? 0.30850 0.37367 0.40304 0.01736  0.01313  -0.06899 572 HOH A O   
2635 O O   . HOH C .   ? 0.57837 0.57298 0.52052 -0.02276 0.00730  -0.02435 573 HOH A O   
2636 O O   . HOH C .   ? 0.46620 0.42044 0.35923 -0.00654 -0.02758 -0.00293 574 HOH A O   
2637 O O   . HOH C .   ? 0.63349 0.55315 0.48326 -0.01260 -0.02691 0.00381  575 HOH A O   
2638 O O   . HOH C .   ? 0.44729 0.44041 0.43634 -0.02577 0.01290  0.00161  576 HOH A O   
2639 O O   . HOH C .   ? 0.39714 0.44153 0.48234 0.03424  -0.01131 -0.05165 577 HOH A O   
2640 O O   . HOH C .   ? 0.53862 0.48212 0.51747 -0.02123 0.02056  -0.00746 578 HOH A O   
2641 O O   . HOH C .   ? 0.47814 0.47947 0.47518 -0.01494 0.01874  -0.00054 579 HOH A O   
2642 O O   . HOH C .   ? 0.41113 0.40015 0.44088 -0.00327 -0.00285 -0.03742 580 HOH A O   
2643 O O   . HOH C .   ? 0.59414 0.61108 0.59648 -0.01691 0.00019  -0.03739 581 HOH A O   
2644 O O   . HOH C .   ? 0.31870 0.36876 0.34582 -0.02595 0.04346  -0.04894 582 HOH A O   
2645 O O   . HOH C .   ? 0.50491 0.52545 0.50887 -0.01842 0.02012  -0.04290 583 HOH A O   
2646 O O   . HOH C .   ? 0.58743 0.46410 0.41053 -0.00871 -0.03137 0.01977  584 HOH A O   
2647 O O   . HOH C .   ? 0.41844 0.42443 0.38960 0.01006  -0.03801 -0.01170 585 HOH A O   
2648 O O   . HOH C .   ? 0.54358 0.52487 0.50576 0.00465  -0.03806 -0.00710 586 HOH A O   
2649 O O   . HOH C .   ? 0.46612 0.47534 0.48290 -0.01705 0.00014  -0.02616 587 HOH A O   
2650 O O   . HOH C .   ? 0.39206 0.41007 0.42721 -0.00517 0.00899  -0.04434 588 HOH A O   
2651 O O   . HOH C .   ? 0.53097 0.50137 0.43796 -0.04321 0.02672  -0.01647 589 HOH A O   
2652 O O   . HOH C .   ? 0.56089 0.56735 0.55561 -0.01134 0.00278  -0.02317 590 HOH A O   
2653 O O   . HOH C .   ? 0.45419 0.49107 0.53041 0.01391  -0.00554 -0.04433 591 HOH A O   
2654 O O   . HOH C .   ? 0.41417 0.48944 0.50170 0.00693  0.01613  -0.05801 592 HOH A O   
2655 O O   . HOH C .   ? 0.63456 0.57862 0.53248 -0.02627 -0.00289 0.00731  593 HOH A O   
2656 O O   . HOH C .   ? 0.46986 0.44667 0.45509 0.00428  -0.00040 0.01052  594 HOH A O   
2657 O O   . HOH C .   ? 0.39583 0.40039 0.42838 -0.00136 0.00036  -0.03447 595 HOH A O   
2658 O O   . HOH C .   ? 0.59971 0.52733 0.58895 0.02645  -0.01800 -0.00913 596 HOH A O   
2659 O O   . HOH C .   ? 0.50703 0.54490 0.52608 0.00131  -0.01926 -0.01772 597 HOH A O   
2660 O O   . HOH C .   ? 0.68196 0.61879 0.56178 -0.03956 0.02446  -0.00079 598 HOH A O   
2661 O O   . HOH C .   ? 0.54192 0.57062 0.56679 0.01927  -0.02468 -0.00882 599 HOH A O   
2662 O O   . HOH C .   ? 0.52157 0.41495 0.46081 0.00990  -0.04431 0.01359  600 HOH A O   
2663 O O   . HOH C .   ? 0.32263 0.35859 0.33996 -0.01741 0.03341  -0.03889 601 HOH A O   
2664 O O   . HOH C .   ? 0.41467 0.42300 0.40484 -0.01132 0.01049  0.00304  602 HOH A O   
2665 O O   . HOH C .   ? 0.51205 0.55118 0.54760 0.01031  -0.00955 -0.00954 603 HOH A O   
2666 O O   . HOH C .   ? 0.51152 0.45883 0.48884 0.00118  0.00278  0.00405  604 HOH A O   
2667 O O   . HOH C .   ? 0.52600 0.54028 0.51041 -0.02253 0.01642  -0.04354 605 HOH A O   
2668 O O   . HOH C .   ? 0.55070 0.53980 0.52881 -0.00733 -0.00152 0.01210  606 HOH A O   
2669 O O   . HOH C .   ? 0.56029 0.56011 0.53193 0.01430  -0.03778 -0.00538 607 HOH A O   
2670 O O   . HOH C .   ? 0.39512 0.40605 0.40621 -0.00135 0.00440  0.00373  608 HOH A O   
2671 O O   . HOH C .   ? 0.64897 0.60052 0.59840 -0.00063 -0.00309 0.01678  609 HOH A O   
2672 O O   . HOH C .   ? 0.43270 0.45012 0.44802 -0.00867 -0.00410 -0.02345 610 HOH A O   
2673 O O   . HOH C .   ? 0.61764 0.53983 0.56782 0.00928  -0.01117 0.01336  611 HOH A O   
2674 O O   . HOH C .   ? 0.51997 0.46531 0.45097 -0.01366 -0.01070 0.01764  612 HOH A O   
2675 O O   . HOH C .   ? 0.45483 0.48417 0.47002 0.01113  -0.02251 -0.00838 613 HOH A O   
2676 O O   . HOH C .   ? 0.31199 0.31832 0.32754 0.00000  0.01929  -0.00000 614 HOH A O   
2677 O O   . HOH C .   ? 0.52735 0.55120 0.53953 -0.00859 0.00977  -0.00043 615 HOH A O   
2678 O O   . HOH C .   ? 0.40179 0.39177 0.35534 0.01070  -0.03822 -0.00508 616 HOH A O   
2679 O O   . HOH C .   ? 0.47201 0.50518 0.51444 0.00122  -0.00474 -0.01622 617 HOH A O   
2680 O O   . HOH C .   ? 0.48478 0.46791 0.45304 0.00465  -0.03188 -0.00180 618 HOH A O   
2681 O O   . HOH C .   ? 0.48263 0.49867 0.50109 -0.01711 -0.00008 -0.02113 619 HOH A O   
2682 O O   . HOH C .   ? 0.55557 0.55845 0.61154 0.00823  -0.00430 -0.05214 620 HOH A O   
2683 O O   . HOH C .   ? 0.37010 0.44758 0.43296 -0.02577 0.05054  -0.07214 621 HOH A O   
2684 O O   . HOH C .   ? 0.44436 0.47147 0.48438 0.00000  -0.01208 -0.00000 622 HOH A O   
2685 O O   . HOH C .   ? 0.52625 0.46871 0.49239 0.01558  -0.04236 0.00998  623 HOH A O   
2686 O O   . HOH C .   ? 0.59920 0.53602 0.59847 0.03415  -0.02456 -0.01250 624 HOH A O   
2687 O O   . HOH C .   ? 0.53215 0.53738 0.52520 -0.00903 0.00580  0.00797  625 HOH A O   
2688 O O   . HOH C .   ? 0.62645 0.54594 0.59235 -0.01715 -0.00960 0.00024  626 HOH A O   
2689 O O   . HOH C .   ? 0.48205 0.49125 0.47748 -0.01069 0.01527  -0.02254 627 HOH A O   
2690 O O   . HOH C .   ? 0.47852 0.48642 0.54071 0.04625  -0.02904 -0.03868 628 HOH A O   
2691 O O   . HOH C .   ? 0.53302 0.53956 0.49315 -0.03478 0.03610  -0.03142 629 HOH A O   
2692 O O   . HOH C .   ? 0.46620 0.51043 0.50447 0.01056  -0.01508 -0.01387 630 HOH A O   
2693 O O   . HOH C .   ? 0.75909 0.64688 0.63744 0.01964  -0.04918 0.02199  631 HOH A O   
2694 O O   . HOH C .   ? 0.48139 0.49034 0.49708 -0.01670 0.00125  -0.01586 632 HOH A O   
2695 O O   . HOH C .   ? 0.56067 0.44514 0.52551 0.03182  -0.02882 -0.00650 633 HOH A O   
2696 O O   . HOH C .   ? 0.56997 0.52939 0.46373 -0.00749 -0.02971 -0.00827 634 HOH A O   
2697 O O   . HOH C .   ? 0.63901 0.52689 0.57332 0.02280  -0.02904 0.01258  635 HOH A O   
2698 O O   . HOH C .   ? 0.54455 0.59126 0.59670 0.01069  0.00185  -0.02357 636 HOH A O   
2699 O O   . HOH C .   ? 0.43243 0.45761 0.44996 -0.00885 0.00471  -0.00143 637 HOH A O   
2700 O O   . HOH C .   ? 0.68867 0.58282 0.64162 0.02092  -0.05506 0.00732  638 HOH A O   
2701 O O   . HOH C .   ? 0.46598 0.49293 0.47528 -0.00817 -0.00898 -0.01893 639 HOH A O   
2702 O O   . HOH C .   ? 0.51175 0.52873 0.51610 -0.00465 -0.02402 -0.03219 640 HOH A O   
2703 O O   . HOH C .   ? 0.53318 0.45435 0.50912 -0.00950 -0.01494 -0.00408 641 HOH A O   
2704 O O   . HOH C .   ? 0.48661 0.53277 0.52521 -0.00500 0.01563  -0.02134 642 HOH A O   
2705 O O   . HOH C .   ? 0.40194 0.47023 0.47584 -0.00262 0.02975  -0.06348 643 HOH A O   
2706 O O   . HOH C .   ? 0.49099 0.52410 0.51463 -0.00415 0.01225  -0.00988 644 HOH A O   
2707 O O   . HOH C .   ? 0.50032 0.49979 0.49006 -0.01072 0.00484  0.00914  645 HOH A O   
2708 O O   . HOH C .   ? 0.62495 0.57979 0.56901 -0.02583 0.00601  0.01386  646 HOH A O   
2709 O O   . HOH C .   ? 0.46430 0.46712 0.50878 0.00417  -0.00252 -0.04231 647 HOH A O   
2710 O O   . HOH C .   ? 0.53175 0.48197 0.47488 0.02246  -0.03922 0.01202  648 HOH A O   
2711 O O   . HOH C .   ? 0.36100 0.44102 0.42210 -0.03217 0.05429  -0.07167 649 HOH A O   
2712 O O   . HOH C .   ? 0.54756 0.53814 0.51257 0.01561  -0.03701 -0.00052 650 HOH A O   
2713 O O   . HOH C .   ? 0.47227 0.49687 0.48528 -0.00508 0.01135  -0.00410 651 HOH A O   
2714 O O   . HOH C .   ? 0.59986 0.50244 0.48667 -0.02053 -0.01726 0.02314  652 HOH A O   
2715 O O   . HOH C .   ? 0.40836 0.41303 0.43057 -0.00955 0.00260  -0.03608 653 HOH A O   
2716 O O   . HOH C .   ? 0.53418 0.45929 0.49142 0.00861  -0.00852 0.01057  654 HOH A O   
2717 O O   . HOH C .   ? 0.39400 0.42073 0.39464 -0.00656 -0.01498 -0.02179 655 HOH A O   
2718 O O   . HOH C .   ? 0.44274 0.47045 0.46409 0.00080  0.00713  -0.00449 656 HOH A O   
2719 O O   . HOH C .   ? 0.58153 0.55847 0.53007 0.02446  -0.05706 -0.00455 657 HOH A O   
2720 O O   . HOH C .   ? 0.51028 0.49077 0.46639 0.02209  -0.04852 -0.00132 658 HOH A O   
2721 O O   . HOH C .   ? 0.47223 0.54918 0.54729 -0.01248 0.04093  -0.07337 659 HOH A O   
2722 O O   . HOH C .   ? 0.43087 0.44320 0.44350 -0.01491 0.00144  -0.03422 660 HOH A O   
2723 O O   . HOH C .   ? 0.59178 0.52160 0.49350 0.02167  -0.05586 0.01001  661 HOH A O   
2724 O O   . HOH C .   ? 0.58155 0.53611 0.57742 -0.02379 0.00036  -0.01708 662 HOH A O   
2725 O O   . HOH C .   ? 0.50898 0.52520 0.53765 -0.01777 0.00912  -0.02884 663 HOH A O   
2726 O O   . HOH C .   ? 0.47377 0.48867 0.44876 -0.03102 0.03731  -0.03778 664 HOH A O   
2727 O O   . HOH C .   ? 0.52176 0.52133 0.51936 -0.01275 0.01635  0.00147  665 HOH A O   
2728 O O   . HOH C .   ? 0.59609 0.59583 0.60921 -0.02052 0.00283  -0.01698 666 HOH A O   
2729 O O   . HOH C .   ? 0.50923 0.51453 0.52137 -0.01668 0.00261  -0.00960 667 HOH A O   
2730 O O   . HOH C .   ? 0.71844 0.59492 0.51936 -0.01815 -0.02890 0.01232  668 HOH A O   
2731 O O   . HOH C .   ? 0.62565 0.50407 0.56710 0.00275  -0.03715 0.00836  669 HOH A O   
2732 O O   . HOH C .   ? 0.46380 0.48265 0.52454 0.03924  -0.02309 -0.03430 670 HOH A O   
2733 O O   . HOH C .   ? 0.37586 0.43850 0.44488 -0.00375 0.03323  -0.06809 671 HOH A O   
2734 O O   . HOH C .   ? 0.51094 0.58949 0.56284 -0.04495 0.06199  -0.07044 672 HOH A O   
2735 O O   . HOH C .   ? 0.57644 0.54442 0.56390 -0.00866 0.01180  0.00159  673 HOH A O   
2736 O O   . HOH C .   ? 0.52735 0.61443 0.60378 -0.02371 0.04520  -0.06978 674 HOH A O   
2737 O O   . HOH C .   ? 0.58385 0.44727 0.43318 0.00780  -0.03942 0.02737  675 HOH A O   
2738 O O   . HOH C .   ? 0.55777 0.57950 0.58526 -0.01304 0.00072  -0.02956 676 HOH A O   
2739 O O   . HOH C .   ? 0.48182 0.39562 0.48223 0.02720  -0.04925 -0.01542 677 HOH A O   
2740 O O   . HOH C .   ? 0.34141 0.39085 0.37667 -0.01665 0.03660  -0.04807 678 HOH A O   
2741 O O   . HOH C .   ? 0.63048 0.65801 0.64423 -0.01231 0.01442  -0.00534 679 HOH A O   
2742 O O   . HOH C .   ? 0.55118 0.53619 0.56946 -0.01266 -0.00117 -0.03073 680 HOH A O   
2743 O O   . HOH C .   ? 0.51726 0.47396 0.49767 0.00314  0.00120  0.00616  681 HOH A O   
2744 O O   . HOH C .   ? 0.35425 0.39392 0.37554 -0.01920 0.03800  -0.04820 682 HOH A O   
2745 O O   . HOH C .   ? 0.54649 0.54105 0.56315 -0.02151 0.00166  -0.03130 683 HOH A O   
2746 O O   . HOH C .   ? 0.46147 0.47257 0.49483 -0.03038 0.02157  -0.03604 684 HOH A O   
2747 O O   . HOH C .   ? 0.49337 0.50430 0.49033 0.02130  -0.03766 -0.00634 685 HOH A O   
2748 O O   . HOH C .   ? 0.52839 0.49439 0.53602 -0.01819 -0.00148 -0.02427 686 HOH A O   
2749 O O   . HOH C .   ? 0.41791 0.49700 0.51471 0.00701  0.02255  -0.07260 687 HOH A O   
2750 O O   . HOH C .   ? 0.42972 0.40613 0.45170 -0.00693 -0.00445 -0.03322 688 HOH A O   
2751 O O   . HOH C .   ? 0.50424 0.52039 0.53796 -0.02395 0.01376  -0.03552 689 HOH A O   
2752 O O   . HOH C .   ? 0.57673 0.58943 0.64710 0.01222  -0.00421 -0.06028 690 HOH A O   
2753 O O   . HOH C .   ? 0.42414 0.45585 0.42370 -0.02970 0.04413  -0.04844 691 HOH A O   
2754 O O   . HOH C .   ? 0.38835 0.41131 0.36957 -0.03673 0.04556  -0.04152 692 HOH A O   
2755 O O   . HOH C .   ? 0.58362 0.53746 0.58895 -0.01304 -0.00585 -0.02298 693 HOH A O   
2756 O O   . HOH D .   ? 0.50551 0.34852 0.30976 -0.03849 0.00808  0.02525  201 HOH C O   
2757 O O   . HOH D .   ? 0.43556 0.42446 0.38703 -0.01920 0.01372  -0.00594 202 HOH C O   
2758 O O   . HOH D .   ? 0.51533 0.44738 0.41902 -0.02072 0.00897  0.01471  203 HOH C O   
2759 O O   . HOH D .   ? 0.63689 0.66046 0.64092 -0.02225 0.02723  -0.04731 204 HOH C O   
2760 O O   . HOH D .   ? 0.50041 0.49134 0.45226 -0.03147 0.03054  -0.01591 205 HOH C O   
2761 O O   . HOH D .   ? 0.48899 0.36931 0.35092 -0.00244 -0.02285 0.02589  206 HOH C O   
2762 O O   . HOH D .   ? 0.47468 0.51797 0.51394 -0.02084 0.03503  -0.05250 207 HOH C O   
2763 O O   . HOH D .   ? 0.46725 0.32205 0.27750 -0.03279 0.00171  0.02391  208 HOH C O   
2764 O O   . HOH D .   ? 0.55609 0.38638 0.36527 0.00254  -0.04300 0.03156  209 HOH C O   
# 
