data_9ODV
# 
_entry.id   9ODV 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.403 
_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   9ODV         pdb_00009odv 10.2210/pdb9odv/pdb 
WWPDB D_1000295407 ?            ?                   
EMDB  EMD-70378    ?            ?                   
# 
_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       2025-05-28 
_pdbx_audit_revision_history.part_number         ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9ODV 
_pdbx_database_status.recvd_initial_deposition_date   2025-04-28 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_database_related.db_name        EMDB 
_pdbx_database_related.details        'MicroED structure of proteinase K without energy filtering' 
_pdbx_database_related.db_id          EMD-70378 
_pdbx_database_related.content_type   'associated EM volume' 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              tgonen@g.ucla.edu 
_pdbx_contact_author.name_first         Tamir 
_pdbx_contact_author.name_last          Gonen 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-9254-4069 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Clabbers, M.T.B.' 1 0000-0002-5466-6508 
'Gonen, T.'        2 0000-0002-9254-4069 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Struct Dyn.' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2329-7778 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            12 
_citation.language                  ? 
_citation.page_first                034702 
_citation.page_last                 034702 
_citation.title                     'Recovering high-resolution information using energy filtering in MicroED.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1063/4.0000755 
_citation.pdbx_database_id_PubMed   40370641 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Clabbers, M.T.B.' 1 0000-0002-5466-6508 
primary 'Gonen, T.'        2 0000-0002-9254-4069 
# 
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 'Proteinase K' 28958.791 1   3.4.21.64 ? ? ? 
2 non-polymer syn 'CALCIUM ION'  40.078    2   ?         ? ? ? 
3 non-polymer syn 'NITRATE ION'  62.005    1   ?         ? ? ? 
4 water       nat water          18.015    375 ?         ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'Endopeptidase K,Tritirachium alkaline proteinase' 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;AAQTNAPWGLARISSTSPGTSTYYYDESAGQGSCVYVIDTGIEASHPEFEGRAQMVKTYYYSSRDGNGHGTHCAGTVGSR
TYGVAKKTQLFGVKVLDDNGSGQYSTIIAGMDFVASDKNNRNCPKGVVASLSLGGGYSSSVNSAAARLQSSGVMVAVAAG
NNNADARNYSPASEPSVCTVGASDRYDRRSSFSNYGSVLDIFGPGTDILSTWIGGSTRSISGTSMATPHVAGLAAYLMTL
GKTTAASACRYIADTANKGDLSNIPFGTVNLLAYNNYQA
;
_entity_poly.pdbx_seq_one_letter_code_can   
;AAQTNAPWGLARISSTSPGTSTYYYDESAGQGSCVYVIDTGIEASHPEFEGRAQMVKTYYYSSRDGNGHGTHCAGTVGSR
TYGVAKKTQLFGVKVLDDNGSGQYSTIIAGMDFVASDKNNRNCPKGVVASLSLGGGYSSSVNSAAARLQSSGVMVAVAAG
NNNADARNYSPASEPSVCTVGASDRYDRRSSFSNYGSVLDIFGPGTDILSTWIGGSTRSISGTSMATPHVAGLAAYLMTL
GKTTAASACRYIADTANKGDLSNIPFGTVNLLAYNNYQA
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'CALCIUM ION' CA  
3 'NITRATE ION' NO3 
4 water         HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   ALA n 
1 2   ALA n 
1 3   GLN n 
1 4   THR n 
1 5   ASN n 
1 6   ALA n 
1 7   PRO n 
1 8   TRP n 
1 9   GLY n 
1 10  LEU n 
1 11  ALA n 
1 12  ARG n 
1 13  ILE n 
1 14  SER n 
1 15  SER n 
1 16  THR n 
1 17  SER n 
1 18  PRO n 
1 19  GLY n 
1 20  THR n 
1 21  SER n 
1 22  THR n 
1 23  TYR n 
1 24  TYR n 
1 25  TYR n 
1 26  ASP n 
1 27  GLU n 
1 28  SER n 
1 29  ALA n 
1 30  GLY n 
1 31  GLN n 
1 32  GLY n 
1 33  SER n 
1 34  CYS n 
1 35  VAL n 
1 36  TYR n 
1 37  VAL n 
1 38  ILE n 
1 39  ASP n 
1 40  THR n 
1 41  GLY n 
1 42  ILE n 
1 43  GLU n 
1 44  ALA n 
1 45  SER n 
1 46  HIS n 
1 47  PRO n 
1 48  GLU n 
1 49  PHE n 
1 50  GLU n 
1 51  GLY n 
1 52  ARG n 
1 53  ALA n 
1 54  GLN n 
1 55  MET n 
1 56  VAL n 
1 57  LYS n 
1 58  THR n 
1 59  TYR n 
1 60  TYR n 
1 61  TYR n 
1 62  SER n 
1 63  SER n 
1 64  ARG n 
1 65  ASP n 
1 66  GLY n 
1 67  ASN n 
1 68  GLY n 
1 69  HIS n 
1 70  GLY n 
1 71  THR n 
1 72  HIS n 
1 73  CYS n 
1 74  ALA n 
1 75  GLY n 
1 76  THR n 
1 77  VAL n 
1 78  GLY n 
1 79  SER n 
1 80  ARG n 
1 81  THR n 
1 82  TYR n 
1 83  GLY n 
1 84  VAL n 
1 85  ALA n 
1 86  LYS n 
1 87  LYS n 
1 88  THR n 
1 89  GLN n 
1 90  LEU n 
1 91  PHE n 
1 92  GLY n 
1 93  VAL n 
1 94  LYS n 
1 95  VAL n 
1 96  LEU n 
1 97  ASP n 
1 98  ASP n 
1 99  ASN n 
1 100 GLY n 
1 101 SER n 
1 102 GLY n 
1 103 GLN n 
1 104 TYR n 
1 105 SER n 
1 106 THR n 
1 107 ILE n 
1 108 ILE n 
1 109 ALA n 
1 110 GLY n 
1 111 MET n 
1 112 ASP n 
1 113 PHE n 
1 114 VAL n 
1 115 ALA n 
1 116 SER n 
1 117 ASP n 
1 118 LYS n 
1 119 ASN n 
1 120 ASN n 
1 121 ARG n 
1 122 ASN n 
1 123 CYS n 
1 124 PRO n 
1 125 LYS n 
1 126 GLY n 
1 127 VAL n 
1 128 VAL n 
1 129 ALA n 
1 130 SER n 
1 131 LEU n 
1 132 SER n 
1 133 LEU n 
1 134 GLY n 
1 135 GLY n 
1 136 GLY n 
1 137 TYR n 
1 138 SER n 
1 139 SER n 
1 140 SER n 
1 141 VAL n 
1 142 ASN n 
1 143 SER n 
1 144 ALA n 
1 145 ALA n 
1 146 ALA n 
1 147 ARG n 
1 148 LEU n 
1 149 GLN n 
1 150 SER n 
1 151 SER n 
1 152 GLY n 
1 153 VAL n 
1 154 MET n 
1 155 VAL n 
1 156 ALA n 
1 157 VAL n 
1 158 ALA n 
1 159 ALA n 
1 160 GLY n 
1 161 ASN n 
1 162 ASN n 
1 163 ASN n 
1 164 ALA n 
1 165 ASP n 
1 166 ALA n 
1 167 ARG n 
1 168 ASN n 
1 169 TYR n 
1 170 SER n 
1 171 PRO n 
1 172 ALA n 
1 173 SER n 
1 174 GLU n 
1 175 PRO n 
1 176 SER n 
1 177 VAL n 
1 178 CYS n 
1 179 THR n 
1 180 VAL n 
1 181 GLY n 
1 182 ALA n 
1 183 SER n 
1 184 ASP n 
1 185 ARG n 
1 186 TYR n 
1 187 ASP n 
1 188 ARG n 
1 189 ARG n 
1 190 SER n 
1 191 SER n 
1 192 PHE n 
1 193 SER n 
1 194 ASN n 
1 195 TYR n 
1 196 GLY n 
1 197 SER n 
1 198 VAL n 
1 199 LEU n 
1 200 ASP n 
1 201 ILE n 
1 202 PHE n 
1 203 GLY n 
1 204 PRO n 
1 205 GLY n 
1 206 THR n 
1 207 ASP n 
1 208 ILE n 
1 209 LEU n 
1 210 SER n 
1 211 THR n 
1 212 TRP n 
1 213 ILE n 
1 214 GLY n 
1 215 GLY n 
1 216 SER n 
1 217 THR n 
1 218 ARG n 
1 219 SER n 
1 220 ILE n 
1 221 SER n 
1 222 GLY n 
1 223 THR n 
1 224 SER n 
1 225 MET n 
1 226 ALA n 
1 227 THR n 
1 228 PRO n 
1 229 HIS n 
1 230 VAL n 
1 231 ALA n 
1 232 GLY n 
1 233 LEU n 
1 234 ALA n 
1 235 ALA n 
1 236 TYR n 
1 237 LEU n 
1 238 MET n 
1 239 THR n 
1 240 LEU n 
1 241 GLY n 
1 242 LYS n 
1 243 THR n 
1 244 THR n 
1 245 ALA n 
1 246 ALA n 
1 247 SER n 
1 248 ALA n 
1 249 CYS n 
1 250 ARG n 
1 251 TYR n 
1 252 ILE n 
1 253 ALA n 
1 254 ASP n 
1 255 THR n 
1 256 ALA n 
1 257 ASN n 
1 258 LYS n 
1 259 GLY n 
1 260 ASP n 
1 261 LEU n 
1 262 SER n 
1 263 ASN n 
1 264 ILE n 
1 265 PRO n 
1 266 PHE n 
1 267 GLY n 
1 268 THR n 
1 269 VAL n 
1 270 ASN n 
1 271 LEU n 
1 272 LEU n 
1 273 ALA n 
1 274 TYR n 
1 275 ASN n 
1 276 ASN n 
1 277 TYR n 
1 278 GLN n 
1 279 ALA n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   279 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 PROK 
_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      'Parengyodontium album' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     37998 
_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      'Parengyodontium album' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     37998 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE      ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4'     133.103 
CA  non-polymer         . 'CALCIUM ION'   ? 'Ca 2'           40.078  
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 
NO3 non-polymer         . 'NITRATE ION'   ? 'N O3 -1'        62.005  
PHE 'L-peptide linking' y PHENYLALANINE   ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE         ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE          ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE       ? 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN      ? 'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE        ? 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE          ? 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   ALA 1   106 106 ALA ALA A . n 
A 1 2   ALA 2   107 107 ALA ALA A . n 
A 1 3   GLN 3   108 108 GLN GLN A . n 
A 1 4   THR 4   109 109 THR THR A . n 
A 1 5   ASN 5   110 110 ASN ASN A . n 
A 1 6   ALA 6   111 111 ALA ALA A . n 
A 1 7   PRO 7   112 112 PRO PRO A . n 
A 1 8   TRP 8   113 113 TRP TRP A . n 
A 1 9   GLY 9   114 114 GLY GLY A . n 
A 1 10  LEU 10  115 115 LEU LEU A . n 
A 1 11  ALA 11  116 116 ALA ALA A . n 
A 1 12  ARG 12  117 117 ARG ARG A . n 
A 1 13  ILE 13  118 118 ILE ILE A . n 
A 1 14  SER 14  119 119 SER SER A . n 
A 1 15  SER 15  120 120 SER SER A . n 
A 1 16  THR 16  121 121 THR THR A . n 
A 1 17  SER 17  122 122 SER SER A . n 
A 1 18  PRO 18  123 123 PRO PRO A . n 
A 1 19  GLY 19  124 124 GLY GLY A . n 
A 1 20  THR 20  125 125 THR THR A . n 
A 1 21  SER 21  126 126 SER SER A . n 
A 1 22  THR 22  127 127 THR THR A . n 
A 1 23  TYR 23  128 128 TYR TYR A . n 
A 1 24  TYR 24  129 129 TYR TYR A . n 
A 1 25  TYR 25  130 130 TYR TYR A . n 
A 1 26  ASP 26  131 131 ASP ASP A . n 
A 1 27  GLU 27  132 132 GLU GLU A . n 
A 1 28  SER 28  133 133 SER SER A . n 
A 1 29  ALA 29  134 134 ALA ALA A . n 
A 1 30  GLY 30  135 135 GLY GLY A . n 
A 1 31  GLN 31  136 136 GLN GLN A . n 
A 1 32  GLY 32  137 137 GLY GLY A . n 
A 1 33  SER 33  138 138 SER SER A . n 
A 1 34  CYS 34  139 139 CYS CYS A . n 
A 1 35  VAL 35  140 140 VAL VAL A . n 
A 1 36  TYR 36  141 141 TYR TYR A . n 
A 1 37  VAL 37  142 142 VAL VAL A . n 
A 1 38  ILE 38  143 143 ILE ILE A . n 
A 1 39  ASP 39  144 144 ASP ASP A . n 
A 1 40  THR 40  145 145 THR THR A . n 
A 1 41  GLY 41  146 146 GLY GLY A . n 
A 1 42  ILE 42  147 147 ILE ILE A . n 
A 1 43  GLU 43  148 148 GLU GLU A . n 
A 1 44  ALA 44  149 149 ALA ALA A . n 
A 1 45  SER 45  150 150 SER SER A . n 
A 1 46  HIS 46  151 151 HIS HIS A . n 
A 1 47  PRO 47  152 152 PRO PRO A . n 
A 1 48  GLU 48  153 153 GLU GLU A . n 
A 1 49  PHE 49  154 154 PHE PHE A . n 
A 1 50  GLU 50  155 155 GLU GLU A . n 
A 1 51  GLY 51  156 156 GLY GLY A . n 
A 1 52  ARG 52  157 157 ARG ARG A . n 
A 1 53  ALA 53  158 158 ALA ALA A . n 
A 1 54  GLN 54  159 159 GLN GLN A . n 
A 1 55  MET 55  160 160 MET MET A . n 
A 1 56  VAL 56  161 161 VAL VAL A . n 
A 1 57  LYS 57  162 162 LYS LYS A . n 
A 1 58  THR 58  163 163 THR THR A . n 
A 1 59  TYR 59  164 164 TYR TYR A . n 
A 1 60  TYR 60  165 165 TYR TYR A . n 
A 1 61  TYR 61  166 166 TYR TYR A . n 
A 1 62  SER 62  167 167 SER SER A . n 
A 1 63  SER 63  168 168 SER SER A . n 
A 1 64  ARG 64  169 169 ARG ARG A . n 
A 1 65  ASP 65  170 170 ASP ASP A . n 
A 1 66  GLY 66  171 171 GLY GLY A . n 
A 1 67  ASN 67  172 172 ASN ASN A . n 
A 1 68  GLY 68  173 173 GLY GLY A . n 
A 1 69  HIS 69  174 174 HIS HIS A . n 
A 1 70  GLY 70  175 175 GLY GLY A . n 
A 1 71  THR 71  176 176 THR THR A . n 
A 1 72  HIS 72  177 177 HIS HIS A . n 
A 1 73  CYS 73  178 178 CYS CYS A . n 
A 1 74  ALA 74  179 179 ALA ALA A . n 
A 1 75  GLY 75  180 180 GLY GLY A . n 
A 1 76  THR 76  181 181 THR THR A . n 
A 1 77  VAL 77  182 182 VAL VAL A . n 
A 1 78  GLY 78  183 183 GLY GLY A . n 
A 1 79  SER 79  184 184 SER SER A . n 
A 1 80  ARG 80  185 185 ARG ARG A . n 
A 1 81  THR 81  186 186 THR THR A . n 
A 1 82  TYR 82  187 187 TYR TYR A . n 
A 1 83  GLY 83  188 188 GLY GLY A . n 
A 1 84  VAL 84  189 189 VAL VAL A . n 
A 1 85  ALA 85  190 190 ALA ALA A . n 
A 1 86  LYS 86  191 191 LYS LYS A . n 
A 1 87  LYS 87  192 192 LYS LYS A . n 
A 1 88  THR 88  193 193 THR THR A . n 
A 1 89  GLN 89  194 194 GLN GLN A . n 
A 1 90  LEU 90  195 195 LEU LEU A . n 
A 1 91  PHE 91  196 196 PHE PHE A . n 
A 1 92  GLY 92  197 197 GLY GLY A . n 
A 1 93  VAL 93  198 198 VAL VAL A . n 
A 1 94  LYS 94  199 199 LYS LYS A . n 
A 1 95  VAL 95  200 200 VAL VAL A . n 
A 1 96  LEU 96  201 201 LEU LEU A . n 
A 1 97  ASP 97  202 202 ASP ASP A . n 
A 1 98  ASP 98  203 203 ASP ASP A . n 
A 1 99  ASN 99  204 204 ASN ASN A . n 
A 1 100 GLY 100 205 205 GLY GLY A . n 
A 1 101 SER 101 206 206 SER SER A . n 
A 1 102 GLY 102 207 207 GLY GLY A . n 
A 1 103 GLN 103 208 208 GLN GLN A . n 
A 1 104 TYR 104 209 209 TYR TYR A . n 
A 1 105 SER 105 210 210 SER SER A . n 
A 1 106 THR 106 211 211 THR THR A . n 
A 1 107 ILE 107 212 212 ILE ILE A . n 
A 1 108 ILE 108 213 213 ILE ILE A . n 
A 1 109 ALA 109 214 214 ALA ALA A . n 
A 1 110 GLY 110 215 215 GLY GLY A . n 
A 1 111 MET 111 216 216 MET MET A . n 
A 1 112 ASP 112 217 217 ASP ASP A . n 
A 1 113 PHE 113 218 218 PHE PHE A . n 
A 1 114 VAL 114 219 219 VAL VAL A . n 
A 1 115 ALA 115 220 220 ALA ALA A . n 
A 1 116 SER 116 221 221 SER SER A . n 
A 1 117 ASP 117 222 222 ASP ASP A . n 
A 1 118 LYS 118 223 223 LYS LYS A . n 
A 1 119 ASN 119 224 224 ASN ASN A . n 
A 1 120 ASN 120 225 225 ASN ASN A . n 
A 1 121 ARG 121 226 226 ARG ARG A . n 
A 1 122 ASN 122 227 227 ASN ASN A . n 
A 1 123 CYS 123 228 228 CYS CYS A . n 
A 1 124 PRO 124 229 229 PRO PRO A . n 
A 1 125 LYS 125 230 230 LYS LYS A . n 
A 1 126 GLY 126 231 231 GLY GLY A . n 
A 1 127 VAL 127 232 232 VAL VAL A . n 
A 1 128 VAL 128 233 233 VAL VAL A . n 
A 1 129 ALA 129 234 234 ALA ALA A . n 
A 1 130 SER 130 235 235 SER SER A . n 
A 1 131 LEU 131 236 236 LEU LEU A . n 
A 1 132 SER 132 237 237 SER SER A . n 
A 1 133 LEU 133 238 238 LEU LEU A . n 
A 1 134 GLY 134 239 239 GLY GLY A . n 
A 1 135 GLY 135 240 240 GLY GLY A . n 
A 1 136 GLY 136 241 241 GLY GLY A . n 
A 1 137 TYR 137 242 242 TYR TYR A . n 
A 1 138 SER 138 243 243 SER SER A . n 
A 1 139 SER 139 244 244 SER SER A . n 
A 1 140 SER 140 245 245 SER SER A . n 
A 1 141 VAL 141 246 246 VAL VAL A . n 
A 1 142 ASN 142 247 247 ASN ASN A . n 
A 1 143 SER 143 248 248 SER SER A . n 
A 1 144 ALA 144 249 249 ALA ALA A . n 
A 1 145 ALA 145 250 250 ALA ALA A . n 
A 1 146 ALA 146 251 251 ALA ALA A . n 
A 1 147 ARG 147 252 252 ARG ARG A . n 
A 1 148 LEU 148 253 253 LEU LEU A . n 
A 1 149 GLN 149 254 254 GLN GLN A . n 
A 1 150 SER 150 255 255 SER SER A . n 
A 1 151 SER 151 256 256 SER SER A . n 
A 1 152 GLY 152 257 257 GLY GLY A . n 
A 1 153 VAL 153 258 258 VAL VAL A . n 
A 1 154 MET 154 259 259 MET MET A . n 
A 1 155 VAL 155 260 260 VAL VAL A . n 
A 1 156 ALA 156 261 261 ALA ALA A . n 
A 1 157 VAL 157 262 262 VAL VAL A . n 
A 1 158 ALA 158 263 263 ALA ALA A . n 
A 1 159 ALA 159 264 264 ALA ALA A . n 
A 1 160 GLY 160 265 265 GLY GLY A . n 
A 1 161 ASN 161 266 266 ASN ASN A . n 
A 1 162 ASN 162 267 267 ASN ASN A . n 
A 1 163 ASN 163 268 268 ASN ASN A . n 
A 1 164 ALA 164 269 269 ALA ALA A . n 
A 1 165 ASP 165 270 270 ASP ASP A . n 
A 1 166 ALA 166 271 271 ALA ALA A . n 
A 1 167 ARG 167 272 272 ARG ARG A . n 
A 1 168 ASN 168 273 273 ASN ASN A . n 
A 1 169 TYR 169 274 274 TYR TYR A . n 
A 1 170 SER 170 275 275 SER SER A . n 
A 1 171 PRO 171 276 276 PRO PRO A . n 
A 1 172 ALA 172 277 277 ALA ALA A . n 
A 1 173 SER 173 278 278 SER SER A . n 
A 1 174 GLU 174 279 279 GLU GLU A . n 
A 1 175 PRO 175 280 280 PRO PRO A . n 
A 1 176 SER 176 281 281 SER SER A . n 
A 1 177 VAL 177 282 282 VAL VAL A . n 
A 1 178 CYS 178 283 283 CYS CYS A . n 
A 1 179 THR 179 284 284 THR THR A . n 
A 1 180 VAL 180 285 285 VAL VAL A . n 
A 1 181 GLY 181 286 286 GLY GLY A . n 
A 1 182 ALA 182 287 287 ALA ALA A . n 
A 1 183 SER 183 288 288 SER SER A . n 
A 1 184 ASP 184 289 289 ASP ASP A . n 
A 1 185 ARG 185 290 290 ARG ARG A . n 
A 1 186 TYR 186 291 291 TYR TYR A . n 
A 1 187 ASP 187 292 292 ASP ASP A . n 
A 1 188 ARG 188 293 293 ARG ARG A . n 
A 1 189 ARG 189 294 294 ARG ARG A . n 
A 1 190 SER 190 295 295 SER SER A . n 
A 1 191 SER 191 296 296 SER SER A . n 
A 1 192 PHE 192 297 297 PHE PHE A . n 
A 1 193 SER 193 298 298 SER SER A . n 
A 1 194 ASN 194 299 299 ASN ASN A . n 
A 1 195 TYR 195 300 300 TYR TYR A . n 
A 1 196 GLY 196 301 301 GLY GLY A . n 
A 1 197 SER 197 302 302 SER SER A . n 
A 1 198 VAL 198 303 303 VAL VAL A . n 
A 1 199 LEU 199 304 304 LEU LEU A . n 
A 1 200 ASP 200 305 305 ASP ASP A . n 
A 1 201 ILE 201 306 306 ILE ILE A . n 
A 1 202 PHE 202 307 307 PHE PHE A . n 
A 1 203 GLY 203 308 308 GLY GLY A . n 
A 1 204 PRO 204 309 309 PRO PRO A . n 
A 1 205 GLY 205 310 310 GLY GLY A . n 
A 1 206 THR 206 311 311 THR THR A . n 
A 1 207 ASP 207 312 312 ASP ASP A . n 
A 1 208 ILE 208 313 313 ILE ILE A . n 
A 1 209 LEU 209 314 314 LEU LEU A . n 
A 1 210 SER 210 315 315 SER SER A . n 
A 1 211 THR 211 316 316 THR THR A . n 
A 1 212 TRP 212 317 317 TRP TRP A . n 
A 1 213 ILE 213 318 318 ILE ILE A . n 
A 1 214 GLY 214 319 319 GLY GLY A . n 
A 1 215 GLY 215 320 320 GLY GLY A . n 
A 1 216 SER 216 321 321 SER SER A . n 
A 1 217 THR 217 322 322 THR THR A . n 
A 1 218 ARG 218 323 323 ARG ARG A . n 
A 1 219 SER 219 324 324 SER SER A . n 
A 1 220 ILE 220 325 325 ILE ILE A . n 
A 1 221 SER 221 326 326 SER SER A . n 
A 1 222 GLY 222 327 327 GLY GLY A . n 
A 1 223 THR 223 328 328 THR THR A . n 
A 1 224 SER 224 329 329 SER SER A . n 
A 1 225 MET 225 330 330 MET MET A . n 
A 1 226 ALA 226 331 331 ALA ALA A . n 
A 1 227 THR 227 332 332 THR THR A . n 
A 1 228 PRO 228 333 333 PRO PRO A . n 
A 1 229 HIS 229 334 334 HIS HIS A . n 
A 1 230 VAL 230 335 335 VAL VAL A . n 
A 1 231 ALA 231 336 336 ALA ALA A . n 
A 1 232 GLY 232 337 337 GLY GLY A . n 
A 1 233 LEU 233 338 338 LEU LEU A . n 
A 1 234 ALA 234 339 339 ALA ALA A . n 
A 1 235 ALA 235 340 340 ALA ALA A . n 
A 1 236 TYR 236 341 341 TYR TYR A . n 
A 1 237 LEU 237 342 342 LEU LEU A . n 
A 1 238 MET 238 343 343 MET MET A . n 
A 1 239 THR 239 344 344 THR THR A . n 
A 1 240 LEU 240 345 345 LEU LEU A . n 
A 1 241 GLY 241 346 346 GLY GLY A . n 
A 1 242 LYS 242 347 347 LYS LYS A . n 
A 1 243 THR 243 348 348 THR THR A . n 
A 1 244 THR 244 349 349 THR THR A . n 
A 1 245 ALA 245 350 350 ALA ALA A . n 
A 1 246 ALA 246 351 351 ALA ALA A . n 
A 1 247 SER 247 352 352 SER SER A . n 
A 1 248 ALA 248 353 353 ALA ALA A . n 
A 1 249 CYS 249 354 354 CYS CYS A . n 
A 1 250 ARG 250 355 355 ARG ARG A . n 
A 1 251 TYR 251 356 356 TYR TYR A . n 
A 1 252 ILE 252 357 357 ILE ILE A . n 
A 1 253 ALA 253 358 358 ALA ALA A . n 
A 1 254 ASP 254 359 359 ASP ASP A . n 
A 1 255 THR 255 360 360 THR THR A . n 
A 1 256 ALA 256 361 361 ALA ALA A . n 
A 1 257 ASN 257 362 362 ASN ASN A . n 
A 1 258 LYS 258 363 363 LYS LYS A . n 
A 1 259 GLY 259 364 364 GLY GLY A . n 
A 1 260 ASP 260 365 365 ASP ASP A . n 
A 1 261 LEU 261 366 366 LEU LEU A . n 
A 1 262 SER 262 367 367 SER SER A . n 
A 1 263 ASN 263 368 368 ASN ASN A . n 
A 1 264 ILE 264 369 369 ILE ILE A . n 
A 1 265 PRO 265 370 370 PRO PRO A . n 
A 1 266 PHE 266 371 371 PHE PHE A . n 
A 1 267 GLY 267 372 372 GLY GLY A . n 
A 1 268 THR 268 373 373 THR THR A . n 
A 1 269 VAL 269 374 374 VAL VAL A . n 
A 1 270 ASN 270 375 375 ASN ASN A . n 
A 1 271 LEU 271 376 376 LEU LEU A . n 
A 1 272 LEU 272 377 377 LEU LEU A . n 
A 1 273 ALA 273 378 378 ALA ALA A . n 
A 1 274 TYR 274 379 379 TYR TYR A . n 
A 1 275 ASN 275 380 380 ASN ASN A . n 
A 1 276 ASN 276 381 381 ASN ASN A . n 
A 1 277 TYR 277 382 382 TYR TYR A . n 
A 1 278 GLN 278 383 383 GLN GLN A . n 
A 1 279 ALA 279 384 384 ALA ALA A . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
B 2 CA  1   401 401  CA  CA  A . 
C 2 CA  1   402 402  CA  CA  A . 
D 3 NO3 1   403 501  NO3 NO3 A . 
E 4 HOH 1   501 948  HOH HOH A . 
E 4 HOH 2   502 64   HOH HOH A . 
E 4 HOH 3   503 407  HOH HOH A . 
E 4 HOH 4   504 262  HOH HOH A . 
E 4 HOH 5   505 653  HOH HOH A . 
E 4 HOH 6   506 961  HOH HOH A . 
E 4 HOH 7   507 510  HOH HOH A . 
E 4 HOH 8   508 494  HOH HOH A . 
E 4 HOH 9   509 725  HOH HOH A . 
E 4 HOH 10  510 788  HOH HOH A . 
E 4 HOH 11  511 96   HOH HOH A . 
E 4 HOH 12  512 828  HOH HOH A . 
E 4 HOH 13  513 205  HOH HOH A . 
E 4 HOH 14  514 144  HOH HOH A . 
E 4 HOH 15  515 154  HOH HOH A . 
E 4 HOH 16  516 49   HOH HOH A . 
E 4 HOH 17  517 77   HOH HOH A . 
E 4 HOH 18  518 984  HOH HOH A . 
E 4 HOH 19  519 31   HOH HOH A . 
E 4 HOH 20  520 701  HOH HOH A . 
E 4 HOH 21  521 547  HOH HOH A . 
E 4 HOH 22  522 80   HOH HOH A . 
E 4 HOH 23  523 180  HOH HOH A . 
E 4 HOH 24  524 815  HOH HOH A . 
E 4 HOH 25  525 33   HOH HOH A . 
E 4 HOH 26  526 181  HOH HOH A . 
E 4 HOH 27  527 81   HOH HOH A . 
E 4 HOH 28  528 69   HOH HOH A . 
E 4 HOH 29  529 20   HOH HOH A . 
E 4 HOH 30  530 24   HOH HOH A . 
E 4 HOH 31  531 162  HOH HOH A . 
E 4 HOH 32  532 72   HOH HOH A . 
E 4 HOH 33  533 4    HOH HOH A . 
E 4 HOH 34  534 34   HOH HOH A . 
E 4 HOH 35  535 134  HOH HOH A . 
E 4 HOH 36  536 183  HOH HOH A . 
E 4 HOH 37  537 83   HOH HOH A . 
E 4 HOH 38  538 243  HOH HOH A . 
E 4 HOH 39  539 318  HOH HOH A . 
E 4 HOH 40  540 1    HOH HOH A . 
E 4 HOH 41  541 104  HOH HOH A . 
E 4 HOH 42  542 59   HOH HOH A . 
E 4 HOH 43  543 186  HOH HOH A . 
E 4 HOH 44  544 14   HOH HOH A . 
E 4 HOH 45  545 211  HOH HOH A . 
E 4 HOH 46  546 125  HOH HOH A . 
E 4 HOH 47  547 166  HOH HOH A . 
E 4 HOH 48  548 999  HOH HOH A . 
E 4 HOH 49  549 234  HOH HOH A . 
E 4 HOH 50  550 132  HOH HOH A . 
E 4 HOH 51  551 500  HOH HOH A . 
E 4 HOH 52  552 50   HOH HOH A . 
E 4 HOH 53  553 70   HOH HOH A . 
E 4 HOH 54  554 82   HOH HOH A . 
E 4 HOH 55  555 44   HOH HOH A . 
E 4 HOH 56  556 356  HOH HOH A . 
E 4 HOH 57  557 137  HOH HOH A . 
E 4 HOH 58  558 143  HOH HOH A . 
E 4 HOH 59  559 218  HOH HOH A . 
E 4 HOH 60  560 28   HOH HOH A . 
E 4 HOH 61  561 124  HOH HOH A . 
E 4 HOH 62  562 360  HOH HOH A . 
E 4 HOH 63  563 40   HOH HOH A . 
E 4 HOH 64  564 86   HOH HOH A . 
E 4 HOH 65  565 159  HOH HOH A . 
E 4 HOH 66  566 90   HOH HOH A . 
E 4 HOH 67  567 273  HOH HOH A . 
E 4 HOH 68  568 3    HOH HOH A . 
E 4 HOH 69  569 146  HOH HOH A . 
E 4 HOH 70  570 173  HOH HOH A . 
E 4 HOH 71  571 160  HOH HOH A . 
E 4 HOH 72  572 29   HOH HOH A . 
E 4 HOH 73  573 5    HOH HOH A . 
E 4 HOH 74  574 220  HOH HOH A . 
E 4 HOH 75  575 149  HOH HOH A . 
E 4 HOH 76  576 115  HOH HOH A . 
E 4 HOH 77  577 63   HOH HOH A . 
E 4 HOH 78  578 79   HOH HOH A . 
E 4 HOH 79  579 103  HOH HOH A . 
E 4 HOH 80  580 48   HOH HOH A . 
E 4 HOH 81  581 13   HOH HOH A . 
E 4 HOH 82  582 106  HOH HOH A . 
E 4 HOH 83  583 75   HOH HOH A . 
E 4 HOH 84  584 67   HOH HOH A . 
E 4 HOH 85  585 51   HOH HOH A . 
E 4 HOH 86  586 129  HOH HOH A . 
E 4 HOH 87  587 2    HOH HOH A . 
E 4 HOH 88  588 18   HOH HOH A . 
E 4 HOH 89  589 26   HOH HOH A . 
E 4 HOH 90  590 216  HOH HOH A . 
E 4 HOH 91  591 25   HOH HOH A . 
E 4 HOH 92  592 43   HOH HOH A . 
E 4 HOH 93  593 615  HOH HOH A . 
E 4 HOH 94  594 128  HOH HOH A . 
E 4 HOH 95  595 12   HOH HOH A . 
E 4 HOH 96  596 1113 HOH HOH A . 
E 4 HOH 97  597 8    HOH HOH A . 
E 4 HOH 98  598 876  HOH HOH A . 
E 4 HOH 99  599 153  HOH HOH A . 
E 4 HOH 100 600 101  HOH HOH A . 
E 4 HOH 101 601 19   HOH HOH A . 
E 4 HOH 102 602 11   HOH HOH A . 
E 4 HOH 103 603 845  HOH HOH A . 
E 4 HOH 104 604 434  HOH HOH A . 
E 4 HOH 105 605 595  HOH HOH A . 
E 4 HOH 106 606 244  HOH HOH A . 
E 4 HOH 107 607 514  HOH HOH A . 
E 4 HOH 108 608 66   HOH HOH A . 
E 4 HOH 109 609 6    HOH HOH A . 
E 4 HOH 110 610 156  HOH HOH A . 
E 4 HOH 111 611 54   HOH HOH A . 
E 4 HOH 112 612 537  HOH HOH A . 
E 4 HOH 113 613 55   HOH HOH A . 
E 4 HOH 114 614 520  HOH HOH A . 
E 4 HOH 115 615 37   HOH HOH A . 
E 4 HOH 116 616 15   HOH HOH A . 
E 4 HOH 117 617 229  HOH HOH A . 
E 4 HOH 118 618 161  HOH HOH A . 
E 4 HOH 119 619 116  HOH HOH A . 
E 4 HOH 120 620 178  HOH HOH A . 
E 4 HOH 121 621 157  HOH HOH A . 
E 4 HOH 122 622 74   HOH HOH A . 
E 4 HOH 123 623 17   HOH HOH A . 
E 4 HOH 124 624 35   HOH HOH A . 
E 4 HOH 125 625 122  HOH HOH A . 
E 4 HOH 126 626 41   HOH HOH A . 
E 4 HOH 127 627 337  HOH HOH A . 
E 4 HOH 128 628 95   HOH HOH A . 
E 4 HOH 129 629 504  HOH HOH A . 
E 4 HOH 130 630 38   HOH HOH A . 
E 4 HOH 131 631 36   HOH HOH A . 
E 4 HOH 132 632 21   HOH HOH A . 
E 4 HOH 133 633 1185 HOH HOH A . 
E 4 HOH 134 634 938  HOH HOH A . 
E 4 HOH 135 635 60   HOH HOH A . 
E 4 HOH 136 636 240  HOH HOH A . 
E 4 HOH 137 637 175  HOH HOH A . 
E 4 HOH 138 638 110  HOH HOH A . 
E 4 HOH 139 639 16   HOH HOH A . 
E 4 HOH 140 640 45   HOH HOH A . 
E 4 HOH 141 641 46   HOH HOH A . 
E 4 HOH 142 642 47   HOH HOH A . 
E 4 HOH 143 643 108  HOH HOH A . 
E 4 HOH 144 644 97   HOH HOH A . 
E 4 HOH 145 645 408  HOH HOH A . 
E 4 HOH 146 646 145  HOH HOH A . 
E 4 HOH 147 647 184  HOH HOH A . 
E 4 HOH 148 648 541  HOH HOH A . 
E 4 HOH 149 649 22   HOH HOH A . 
E 4 HOH 150 650 119  HOH HOH A . 
E 4 HOH 151 651 23   HOH HOH A . 
E 4 HOH 152 652 27   HOH HOH A . 
E 4 HOH 153 653 85   HOH HOH A . 
E 4 HOH 154 654 291  HOH HOH A . 
E 4 HOH 155 655 264  HOH HOH A . 
E 4 HOH 156 656 217  HOH HOH A . 
E 4 HOH 157 657 1083 HOH HOH A . 
E 4 HOH 158 658 688  HOH HOH A . 
E 4 HOH 159 659 191  HOH HOH A . 
E 4 HOH 160 660 361  HOH HOH A . 
E 4 HOH 161 661 99   HOH HOH A . 
E 4 HOH 162 662 362  HOH HOH A . 
E 4 HOH 163 663 32   HOH HOH A . 
E 4 HOH 164 664 236  HOH HOH A . 
E 4 HOH 165 665 136  HOH HOH A . 
E 4 HOH 166 666 481  HOH HOH A . 
E 4 HOH 167 667 87   HOH HOH A . 
E 4 HOH 168 668 71   HOH HOH A . 
E 4 HOH 169 669 1142 HOH HOH A . 
E 4 HOH 170 670 691  HOH HOH A . 
E 4 HOH 171 671 609  HOH HOH A . 
E 4 HOH 172 672 451  HOH HOH A . 
E 4 HOH 173 673 78   HOH HOH A . 
E 4 HOH 174 674 30   HOH HOH A . 
E 4 HOH 175 675 170  HOH HOH A . 
E 4 HOH 176 676 383  HOH HOH A . 
E 4 HOH 177 677 42   HOH HOH A . 
E 4 HOH 178 678 9    HOH HOH A . 
E 4 HOH 179 679 593  HOH HOH A . 
E 4 HOH 180 680 332  HOH HOH A . 
E 4 HOH 181 681 1190 HOH HOH A . 
E 4 HOH 182 682 581  HOH HOH A . 
E 4 HOH 183 683 258  HOH HOH A . 
E 4 HOH 184 684 84   HOH HOH A . 
E 4 HOH 185 685 567  HOH HOH A . 
E 4 HOH 186 686 65   HOH HOH A . 
E 4 HOH 187 687 630  HOH HOH A . 
E 4 HOH 188 688 93   HOH HOH A . 
E 4 HOH 189 689 606  HOH HOH A . 
E 4 HOH 190 690 404  HOH HOH A . 
E 4 HOH 191 691 323  HOH HOH A . 
E 4 HOH 192 692 354  HOH HOH A . 
E 4 HOH 193 693 779  HOH HOH A . 
E 4 HOH 194 694 994  HOH HOH A . 
E 4 HOH 195 695 717  HOH HOH A . 
E 4 HOH 196 696 242  HOH HOH A . 
E 4 HOH 197 697 507  HOH HOH A . 
E 4 HOH 198 698 249  HOH HOH A . 
E 4 HOH 199 699 197  HOH HOH A . 
E 4 HOH 200 700 604  HOH HOH A . 
E 4 HOH 201 701 105  HOH HOH A . 
E 4 HOH 202 702 203  HOH HOH A . 
E 4 HOH 203 703 76   HOH HOH A . 
E 4 HOH 204 704 100  HOH HOH A . 
E 4 HOH 205 705 121  HOH HOH A . 
E 4 HOH 206 706 629  HOH HOH A . 
E 4 HOH 207 707 62   HOH HOH A . 
E 4 HOH 208 708 575  HOH HOH A . 
E 4 HOH 209 709 89   HOH HOH A . 
E 4 HOH 210 710 682  HOH HOH A . 
E 4 HOH 211 711 109  HOH HOH A . 
E 4 HOH 212 712 366  HOH HOH A . 
E 4 HOH 213 713 659  HOH HOH A . 
E 4 HOH 214 714 58   HOH HOH A . 
E 4 HOH 215 715 306  HOH HOH A . 
E 4 HOH 216 716 201  HOH HOH A . 
E 4 HOH 217 717 88   HOH HOH A . 
E 4 HOH 218 718 39   HOH HOH A . 
E 4 HOH 219 719 1095 HOH HOH A . 
E 4 HOH 220 720 52   HOH HOH A . 
E 4 HOH 221 721 280  HOH HOH A . 
E 4 HOH 222 722 710  HOH HOH A . 
E 4 HOH 223 723 741  HOH HOH A . 
E 4 HOH 224 724 1192 HOH HOH A . 
E 4 HOH 225 725 94   HOH HOH A . 
E 4 HOH 226 726 309  HOH HOH A . 
E 4 HOH 227 727 202  HOH HOH A . 
E 4 HOH 228 728 158  HOH HOH A . 
E 4 HOH 229 729 316  HOH HOH A . 
E 4 HOH 230 730 276  HOH HOH A . 
E 4 HOH 231 731 369  HOH HOH A . 
E 4 HOH 232 732 444  HOH HOH A . 
E 4 HOH 233 733 91   HOH HOH A . 
E 4 HOH 234 734 113  HOH HOH A . 
E 4 HOH 235 735 1099 HOH HOH A . 
E 4 HOH 236 736 1048 HOH HOH A . 
E 4 HOH 237 737 221  HOH HOH A . 
E 4 HOH 238 738 107  HOH HOH A . 
E 4 HOH 239 739 7    HOH HOH A . 
E 4 HOH 240 740 711  HOH HOH A . 
E 4 HOH 241 741 120  HOH HOH A . 
E 4 HOH 242 742 283  HOH HOH A . 
E 4 HOH 243 743 281  HOH HOH A . 
E 4 HOH 244 744 590  HOH HOH A . 
E 4 HOH 245 745 799  HOH HOH A . 
E 4 HOH 246 746 668  HOH HOH A . 
E 4 HOH 247 747 208  HOH HOH A . 
E 4 HOH 248 748 269  HOH HOH A . 
E 4 HOH 249 749 163  HOH HOH A . 
E 4 HOH 250 750 139  HOH HOH A . 
E 4 HOH 251 751 266  HOH HOH A . 
E 4 HOH 252 752 224  HOH HOH A . 
E 4 HOH 253 753 1045 HOH HOH A . 
E 4 HOH 254 754 471  HOH HOH A . 
E 4 HOH 255 755 272  HOH HOH A . 
E 4 HOH 256 756 253  HOH HOH A . 
E 4 HOH 257 757 543  HOH HOH A . 
E 4 HOH 258 758 259  HOH HOH A . 
E 4 HOH 259 759 839  HOH HOH A . 
E 4 HOH 260 760 695  HOH HOH A . 
E 4 HOH 261 761 390  HOH HOH A . 
E 4 HOH 262 762 1084 HOH HOH A . 
E 4 HOH 263 763 255  HOH HOH A . 
E 4 HOH 264 764 686  HOH HOH A . 
E 4 HOH 265 765 658  HOH HOH A . 
E 4 HOH 266 766 763  HOH HOH A . 
E 4 HOH 267 767 736  HOH HOH A . 
E 4 HOH 268 768 117  HOH HOH A . 
E 4 HOH 269 769 417  HOH HOH A . 
E 4 HOH 270 770 61   HOH HOH A . 
E 4 HOH 271 771 1104 HOH HOH A . 
E 4 HOH 272 772 936  HOH HOH A . 
E 4 HOH 273 773 1143 HOH HOH A . 
E 4 HOH 274 774 130  HOH HOH A . 
E 4 HOH 275 775 68   HOH HOH A . 
E 4 HOH 276 776 187  HOH HOH A . 
E 4 HOH 277 777 142  HOH HOH A . 
E 4 HOH 278 778 888  HOH HOH A . 
E 4 HOH 279 779 440  HOH HOH A . 
E 4 HOH 280 780 569  HOH HOH A . 
E 4 HOH 281 781 940  HOH HOH A . 
E 4 HOH 282 782 866  HOH HOH A . 
E 4 HOH 283 783 319  HOH HOH A . 
E 4 HOH 284 784 519  HOH HOH A . 
E 4 HOH 285 785 620  HOH HOH A . 
E 4 HOH 286 786 561  HOH HOH A . 
E 4 HOH 287 787 370  HOH HOH A . 
E 4 HOH 288 788 1039 HOH HOH A . 
E 4 HOH 289 789 429  HOH HOH A . 
E 4 HOH 290 790 427  HOH HOH A . 
E 4 HOH 291 791 586  HOH HOH A . 
E 4 HOH 292 792 533  HOH HOH A . 
E 4 HOH 293 793 469  HOH HOH A . 
E 4 HOH 294 794 397  HOH HOH A . 
E 4 HOH 295 795 636  HOH HOH A . 
E 4 HOH 296 796 320  HOH HOH A . 
E 4 HOH 297 797 150  HOH HOH A . 
E 4 HOH 298 798 329  HOH HOH A . 
E 4 HOH 299 799 270  HOH HOH A . 
E 4 HOH 300 800 998  HOH HOH A . 
E 4 HOH 301 801 1053 HOH HOH A . 
E 4 HOH 302 802 248  HOH HOH A . 
E 4 HOH 303 803 596  HOH HOH A . 
E 4 HOH 304 804 359  HOH HOH A . 
E 4 HOH 305 805 251  HOH HOH A . 
E 4 HOH 306 806 53   HOH HOH A . 
E 4 HOH 307 807 200  HOH HOH A . 
E 4 HOH 308 808 215  HOH HOH A . 
E 4 HOH 309 809 897  HOH HOH A . 
E 4 HOH 310 810 140  HOH HOH A . 
E 4 HOH 311 811 666  HOH HOH A . 
E 4 HOH 312 812 650  HOH HOH A . 
E 4 HOH 313 813 237  HOH HOH A . 
E 4 HOH 314 814 748  HOH HOH A . 
E 4 HOH 315 815 56   HOH HOH A . 
E 4 HOH 316 816 460  HOH HOH A . 
E 4 HOH 317 817 357  HOH HOH A . 
E 4 HOH 318 818 300  HOH HOH A . 
E 4 HOH 319 819 126  HOH HOH A . 
E 4 HOH 320 820 476  HOH HOH A . 
E 4 HOH 321 821 863  HOH HOH A . 
E 4 HOH 322 822 539  HOH HOH A . 
E 4 HOH 323 823 286  HOH HOH A . 
E 4 HOH 324 824 892  HOH HOH A . 
E 4 HOH 325 825 171  HOH HOH A . 
E 4 HOH 326 826 254  HOH HOH A . 
E 4 HOH 327 827 453  HOH HOH A . 
E 4 HOH 328 828 231  HOH HOH A . 
E 4 HOH 329 829 271  HOH HOH A . 
E 4 HOH 330 830 495  HOH HOH A . 
E 4 HOH 331 831 515  HOH HOH A . 
E 4 HOH 332 832 317  HOH HOH A . 
E 4 HOH 333 833 432  HOH HOH A . 
E 4 HOH 334 834 712  HOH HOH A . 
E 4 HOH 335 835 531  HOH HOH A . 
E 4 HOH 336 836 138  HOH HOH A . 
E 4 HOH 337 837 544  HOH HOH A . 
E 4 HOH 338 838 568  HOH HOH A . 
E 4 HOH 339 839 953  HOH HOH A . 
E 4 HOH 340 840 555  HOH HOH A . 
E 4 HOH 341 841 610  HOH HOH A . 
E 4 HOH 342 842 1066 HOH HOH A . 
E 4 HOH 343 843 182  HOH HOH A . 
E 4 HOH 344 844 783  HOH HOH A . 
E 4 HOH 345 845 274  HOH HOH A . 
E 4 HOH 346 846 908  HOH HOH A . 
E 4 HOH 347 847 886  HOH HOH A . 
E 4 HOH 348 848 349  HOH HOH A . 
E 4 HOH 349 849 198  HOH HOH A . 
E 4 HOH 350 850 896  HOH HOH A . 
E 4 HOH 351 851 894  HOH HOH A . 
E 4 HOH 352 852 412  HOH HOH A . 
E 4 HOH 353 853 1177 HOH HOH A . 
E 4 HOH 354 854 781  HOH HOH A . 
E 4 HOH 355 855 92   HOH HOH A . 
E 4 HOH 356 856 563  HOH HOH A . 
E 4 HOH 357 857 745  HOH HOH A . 
E 4 HOH 358 858 746  HOH HOH A . 
E 4 HOH 359 859 705  HOH HOH A . 
E 4 HOH 360 860 365  HOH HOH A . 
E 4 HOH 361 861 261  HOH HOH A . 
E 4 HOH 362 862 637  HOH HOH A . 
E 4 HOH 363 863 693  HOH HOH A . 
E 4 HOH 364 864 389  HOH HOH A . 
E 4 HOH 365 865 422  HOH HOH A . 
E 4 HOH 366 866 168  HOH HOH A . 
E 4 HOH 367 867 865  HOH HOH A . 
E 4 HOH 368 868 405  HOH HOH A . 
E 4 HOH 369 869 786  HOH HOH A . 
E 4 HOH 370 870 837  HOH HOH A . 
E 4 HOH 371 871 299  HOH HOH A . 
E 4 HOH 372 872 607  HOH HOH A . 
E 4 HOH 373 873 376  HOH HOH A . 
E 4 HOH 374 874 1136 HOH HOH A . 
E 4 HOH 375 875 1085 HOH HOH A . 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9ODV 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     67.620 
_cell.length_a_esd                 ? 
_cell.length_b                     67.620 
_cell.length_b_esd                 ? 
_cell.length_c                     106.590 
_cell.length_c_esd                 ? 
_cell.volume                       487379.003 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9ODV 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                96 
_symmetry.space_group_name_Hall            'P 4nw 2abw' 
_symmetry.space_group_name_H-M             'P 43 21 2' 
_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                   9ODV 
_exptl.crystals_number            ? 
_exptl.details                    ? 
_exptl.method                     'ELECTRON CRYSTALLOGRAPHY' 
_exptl.method_details             ? 
# 
_reflns.B_iso_Wilson_estimate                          9.89 
_reflns.entry_id                                       9ODV 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              ? 
_reflns.d_resolution_low                               ? 
_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                                     ? 
_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                           ? 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                ? 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          ? 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                ? 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   ? 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_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                               12.57 
_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                                 9ODV 
_refine.pdbx_refine_id                           'ELECTRON CRYSTALLOGRAPHY' 
_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                            1.30 
_refine.ls_d_res_low                             57.10 
_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                     57511 
_refine.ls_number_reflns_R_free                  2850 
_refine.ls_number_reflns_R_work                  54661 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    93.64 
_refine.ls_percent_reflns_R_free                 4.96 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1836 
_refine.ls_R_factor_R_free                       0.2263 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1814 
_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.correlation_coeff_I_to_Fcsqd_work        ? 
_refine.correlation_coeff_I_to_Fcsqd_free        ? 
_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                          1.33 
_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          ? 
_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             0.9000 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.6000 
_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                 21.9931 
_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                            0.1869 
_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                    ? 
# 
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_Zscore 
_refine_ls_restr.pdbx_restraint_function 
'ELECTRON CRYSTALLOGRAPHY' ? 0.0111  ? 2277 ? f_bond_d           ? ? ? 
'ELECTRON CRYSTALLOGRAPHY' ? 1.1335  ? 3128 ? f_angle_d          ? ? ? 
'ELECTRON CRYSTALLOGRAPHY' ? 0.0917  ? 338  ? f_chiral_restr     ? ? ? 
'ELECTRON CRYSTALLOGRAPHY' ? 0.0089  ? 429  ? f_plane_restr      ? ? ? 
'ELECTRON CRYSTALLOGRAPHY' ? 12.7278 ? 806  ? 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.correlation_coeff_Fo_to_Fc 
_refine_ls_shell.correlation_coeff_Fo_to_Fc_free 
_refine_ls_shell.correlation_coeff_I_to_Fcsqd_work 
_refine_ls_shell.correlation_coeff_I_to_Fcsqd_free 
_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 
'ELECTRON CRYSTALLOGRAPHY' 1.30 1.32  . . 134 2545 89.42 . . . . 0.3287 . . . . . . . . . . . . . . . 0.3758 
'ELECTRON CRYSTALLOGRAPHY' 1.32 1.35  . . 119 2573 88.79 . . . . 0.3007 . . . . . . . . . . . . . . . 0.3126 
'ELECTRON CRYSTALLOGRAPHY' 1.35 1.37  . . 132 2560 89.41 . . . . 0.2857 . . . . . . . . . . . . . . . 0.3155 
'ELECTRON CRYSTALLOGRAPHY' 1.37 1.40  . . 136 2602 90.27 . . . . 0.2747 . . . . . . . . . . . . . . . 0.3281 
'ELECTRON CRYSTALLOGRAPHY' 1.40 1.43  . . 120 2631 91.00 . . . . 0.2608 . . . . . . . . . . . . . . . 0.3030 
'ELECTRON CRYSTALLOGRAPHY' 1.43 1.46  . . 136 2638 91.79 . . . . 0.2460 . . . . . . . . . . . . . . . 0.2934 
'ELECTRON CRYSTALLOGRAPHY' 1.46 1.50  . . 131 2690 92.43 . . . . 0.2375 . . . . . . . . . . . . . . . 0.2963 
'ELECTRON CRYSTALLOGRAPHY' 1.50 1.54  . . 130 2736 94.18 . . . . 0.2266 . . . . . . . . . . . . . . . 0.3075 
'ELECTRON CRYSTALLOGRAPHY' 1.54 1.59  . . 160 2682 94.48 . . . . 0.2165 . . . . . . . . . . . . . . . 0.2501 
'ELECTRON CRYSTALLOGRAPHY' 1.59 1.64  . . 152 2745 95.14 . . . . 0.2232 . . . . . . . . . . . . . . . 0.2630 
'ELECTRON CRYSTALLOGRAPHY' 1.64 1.70  . . 157 2748 95.06 . . . . 0.2099 . . . . . . . . . . . . . . . 0.2761 
'ELECTRON CRYSTALLOGRAPHY' 1.70 1.76  . . 139 2773 95.70 . . . . 0.1995 . . . . . . . . . . . . . . . 0.2837 
'ELECTRON CRYSTALLOGRAPHY' 1.76 1.84  . . 149 2770 95.49 . . . . 0.1855 . . . . . . . . . . . . . . . 0.2532 
'ELECTRON CRYSTALLOGRAPHY' 1.84 1.94  . . 152 2797 95.75 . . . . 0.1721 . . . . . . . . . . . . . . . 0.2364 
'ELECTRON CRYSTALLOGRAPHY' 1.94 2.06  . . 137 2797 95.88 . . . . 0.1654 . . . . . . . . . . . . . . . 0.1967 
'ELECTRON CRYSTALLOGRAPHY' 2.06 2.22  . . 149 2806 95.66 . . . . 0.1594 . . . . . . . . . . . . . . . 0.1967 
'ELECTRON CRYSTALLOGRAPHY' 2.22 2.45  . . 150 2828 95.91 . . . . 0.1620 . . . . . . . . . . . . . . . 0.1920 
'ELECTRON CRYSTALLOGRAPHY' 2.45 2.80  . . 151 2851 95.54 . . . . 0.1571 . . . . . . . . . . . . . . . 0.2091 
'ELECTRON CRYSTALLOGRAPHY' 2.80 3.53  . . 167 2859 95.64 . . . . 0.1402 . . . . . . . . . . . . . . . 0.1749 
'ELECTRON CRYSTALLOGRAPHY' 3.53 57.10 . . 149 3030 94.92 . . . . 0.1387 . . . . . . . . . . . . . . . 0.1731 
# 
_struct.entry_id                     9ODV 
_struct.title                        'MicroED structure of proteinase K without energy filtering' 
_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        9ODV 
_struct_keywords.text            'serine protease, 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 2 ? 
D N N 3 ? 
E N N 4 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    PRTK_PARAQ 
_struct_ref.pdbx_db_accession          P06873 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;AAQTNAPWGLARISSTSPGTSTYYYDESAGQGSCVYVIDTGIEASHPEFEGRAQMVKTYYYSSRDGNGHGTHCAGTVGSR
TYGVAKKTQLFGVKVLDDNGSGQYSTIIAGMDFVASDKNNRNCPKGVVASLSLGGGYSSSVNSAAARLQSSGVMVAVAAG
NNNADARNYSPASEPSVCTVGASDRYDRRSSFSNYGSVLDIFGPGTSILSTWIGGSTRSISGTSMATPHVAGLAAYLMTL
GKTTAASACRYIADTANKGDLSNIPFGTVNLLAYNNYQA
;
_struct_ref.pdbx_align_begin           106 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9ODV 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 1 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 279 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P06873 
_struct_ref_seq.db_align_beg                  106 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  384 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       106 
_struct_ref_seq.pdbx_auth_seq_align_end       384 
# 
_struct_ref_seq_dif.align_id                     1 
_struct_ref_seq_dif.pdbx_pdb_id_code             9ODV 
_struct_ref_seq_dif.mon_id                       ASP 
_struct_ref_seq_dif.pdbx_pdb_strand_id           A 
_struct_ref_seq_dif.seq_num                      207 
_struct_ref_seq_dif.pdbx_pdb_ins_code            ? 
_struct_ref_seq_dif.pdbx_seq_db_name             UNP 
_struct_ref_seq_dif.pdbx_seq_db_accession_code   P06873 
_struct_ref_seq_dif.db_mon_id                    SER 
_struct_ref_seq_dif.pdbx_seq_db_seq_num          312 
_struct_ref_seq_dif.details                      conflict 
_struct_ref_seq_dif.pdbx_auth_seq_num            312 
_struct_ref_seq_dif.pdbx_ordinal                 1 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 PRO A 7   ? ILE A 13  ? PRO A 112 ILE A 118 1 ? 7  
HELX_P HELX_P2 AA2 HIS A 46  ? GLU A 50  ? HIS A 151 GLU A 155 5 ? 5  
HELX_P HELX_P3 AA3 GLY A 68  ? SER A 79  ? GLY A 173 SER A 184 1 ? 12 
HELX_P HELX_P4 AA4 GLN A 103 ? LYS A 118 ? GLN A 208 LYS A 223 1 ? 16 
HELX_P HELX_P5 AA5 ASN A 119 ? ARG A 121 ? ASN A 224 ARG A 226 5 ? 3  
HELX_P HELX_P6 AA6 SER A 138 ? SER A 151 ? SER A 243 SER A 256 1 ? 14 
HELX_P HELX_P7 AA7 ASP A 165 ? ARG A 167 ? ASP A 270 ARG A 272 5 ? 3  
HELX_P HELX_P8 AA8 GLY A 222 ? LEU A 240 ? GLY A 327 LEU A 345 1 ? 19 
HELX_P HELX_P9 AA9 SER A 247 ? ALA A 256 ? SER A 352 ALA A 361 1 ? 10 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1  disulf ? ? A CYS 34  SG  A ? ? 1_555 A CYS 123 SG ? ? A CYS 139 A CYS 228 1_555 ? ? ? ? ? ? ? 2.021 ? ? 
disulf2  disulf ? ? A CYS 34  SG  B ? ? 1_555 A CYS 123 SG ? ? A CYS 139 A CYS 228 1_555 ? ? ? ? ? ? ? 2.036 ? ? 
disulf3  disulf ? ? A CYS 178 SG  ? ? ? 1_555 A CYS 249 SG ? ? A CYS 283 A CYS 354 1_555 ? ? ? ? ? ? ? 2.058 ? ? 
metalc1  metalc ? ? A THR 16  O   ? ? ? 1_555 C CA  .   CA ? ? A THR 121 A CA  402 1_555 ? ? ? ? ? ? ? 2.369 ? ? 
metalc2  metalc ? ? A PRO 175 O   ? ? ? 1_555 B CA  .   CA ? ? A PRO 280 A CA  401 1_555 ? ? ? ? ? ? ? 2.379 ? ? 
metalc3  metalc ? ? A VAL 177 O   ? ? ? 1_555 B CA  .   CA ? ? A VAL 282 A CA  401 1_555 ? ? ? ? ? ? ? 2.404 ? ? 
metalc4  metalc ? ? A ASP 200 OD1 ? ? ? 1_555 B CA  .   CA ? ? A ASP 305 A CA  401 1_555 ? ? ? ? ? ? ? 2.663 ? ? 
metalc5  metalc ? ? A ASP 200 OD2 ? ? ? 1_555 B CA  .   CA ? ? A ASP 305 A CA  401 1_555 ? ? ? ? ? ? ? 2.468 ? ? 
metalc6  metalc ? ? A ASP 260 OD1 ? ? ? 1_555 C CA  .   CA ? ? A ASP 365 A CA  402 1_555 ? ? ? ? ? ? ? 2.363 ? ? 
metalc7  metalc ? ? A ASP 260 OD2 ? ? ? 1_555 C CA  .   CA ? ? A ASP 365 A CA  402 1_555 ? ? ? ? ? ? ? 2.443 ? ? 
metalc8  metalc ? ? B CA  .   CA  ? ? ? 1_555 E HOH .   O  ? ? A CA  401 A HOH 581 1_555 ? ? ? ? ? ? ? 2.561 ? ? 
metalc9  metalc ? ? B CA  .   CA  ? ? ? 1_555 E HOH .   O  ? ? A CA  401 A HOH 609 1_555 ? ? ? ? ? ? ? 2.455 ? ? 
metalc10 metalc ? ? B CA  .   CA  ? ? ? 1_555 E HOH .   O  ? ? A CA  401 A HOH 631 1_555 ? ? ? ? ? ? ? 2.320 ? ? 
metalc11 metalc ? ? B CA  .   CA  ? ? ? 1_555 E HOH .   O  ? ? A CA  401 A HOH 739 1_555 ? ? ? ? ? ? ? 2.630 ? ? 
metalc12 metalc ? ? C CA  .   CA  ? ? ? 1_555 E HOH .   O  ? ? A CA  402 A HOH 640 1_555 ? ? ? ? ? ? ? 2.442 ? ? 
metalc13 metalc ? ? C CA  .   CA  ? ? ? 1_555 E HOH .   O  ? ? A CA  402 A HOH 701 1_555 ? ? ? ? ? ? ? 2.123 ? ? 
metalc14 metalc ? ? C CA  .   CA  ? ? ? 1_555 E HOH .   O  ? ? A CA  402 A HOH 736 1_555 ? ? ? ? ? ? ? 2.485 ? ? 
metalc15 metalc ? ? C CA  .   CA  ? ? ? 1_555 E HOH .   O  ? ? A CA  402 A HOH 749 1_555 ? ? ? ? ? ? ? 2.725 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
metalc ? ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1  O   ? A THR 16  ? A THR 121 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 OD1 ? A ASP 260 ? A ASP 365 ? 1_555 79.5  ? 
2  O   ? A THR 16  ? A THR 121 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 OD2 ? A ASP 260 ? A ASP 365 ? 1_555 133.3 ? 
3  OD1 ? A ASP 260 ? A ASP 365 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 OD2 ? A ASP 260 ? A ASP 365 ? 1_555 54.2  ? 
4  O   ? A THR 16  ? A THR 121 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 640 ? 1_555 88.7  ? 
5  OD1 ? A ASP 260 ? A ASP 365 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 640 ? 1_555 84.3  ? 
6  OD2 ? A ASP 260 ? A ASP 365 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 640 ? 1_555 92.4  ? 
7  O   ? A THR 16  ? A THR 121 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 701 ? 1_555 82.7  ? 
8  OD1 ? A ASP 260 ? A ASP 365 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 701 ? 1_555 94.9  ? 
9  OD2 ? A ASP 260 ? A ASP 365 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 701 ? 1_555 94.1  ? 
10 O   ? E HOH .   ? A HOH 640 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 701 ? 1_555 171.4 ? 
11 O   ? A THR 16  ? A THR 121 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 736 ? 1_555 147.7 ? 
12 OD1 ? A ASP 260 ? A ASP 365 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 736 ? 1_555 129.4 ? 
13 OD2 ? A ASP 260 ? A ASP 365 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 736 ? 1_555 78.1  ? 
14 O   ? E HOH .   ? A HOH 640 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 736 ? 1_555 81.5  ? 
15 O   ? E HOH .   ? A HOH 701 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 736 ? 1_555 105.4 ? 
16 O   ? A THR 16  ? A THR 121 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 749 ? 1_555 77.0  ? 
17 OD1 ? A ASP 260 ? A ASP 365 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 749 ? 1_555 156.4 ? 
18 OD2 ? A ASP 260 ? A ASP 365 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 749 ? 1_555 149.3 ? 
19 O   ? E HOH .   ? A HOH 640 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 749 ? 1_555 93.2  ? 
20 O   ? E HOH .   ? A HOH 701 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 749 ? 1_555 84.0  ? 
21 O   ? E HOH .   ? A HOH 736 ? 1_555 CA ? C CA . ? A CA 402 ? 1_555 O   ? E HOH .   ? A HOH 749 ? 1_555 73.0  ? 
22 O   ? A PRO 175 ? A PRO 280 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? A VAL 177 ? A VAL 282 ? 1_555 87.4  ? 
23 O   ? A PRO 175 ? A PRO 280 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 OD1 ? A ASP 200 ? A ASP 305 ? 1_555 152.2 ? 
24 O   ? A VAL 177 ? A VAL 282 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 OD1 ? A ASP 200 ? A ASP 305 ? 1_555 113.4 ? 
25 O   ? A PRO 175 ? A PRO 280 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 OD2 ? A ASP 200 ? A ASP 305 ? 1_555 157.9 ? 
26 O   ? A VAL 177 ? A VAL 282 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 OD2 ? A ASP 200 ? A ASP 305 ? 1_555 77.9  ? 
27 OD1 ? A ASP 200 ? A ASP 305 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 OD2 ? A ASP 200 ? A ASP 305 ? 1_555 49.8  ? 
28 O   ? A PRO 175 ? A PRO 280 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 581 ? 1_555 96.6  ? 
29 O   ? A VAL 177 ? A VAL 282 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 581 ? 1_555 147.3 ? 
30 OD1 ? A ASP 200 ? A ASP 305 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 581 ? 1_555 76.1  ? 
31 OD2 ? A ASP 200 ? A ASP 305 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 581 ? 1_555 87.5  ? 
32 O   ? A PRO 175 ? A PRO 280 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 609 ? 1_555 80.9  ? 
33 O   ? A VAL 177 ? A VAL 282 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 609 ? 1_555 74.3  ? 
34 OD1 ? A ASP 200 ? A ASP 305 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 609 ? 1_555 121.3 ? 
35 OD2 ? A ASP 200 ? A ASP 305 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 609 ? 1_555 79.2  ? 
36 O   ? E HOH .   ? A HOH 581 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 609 ? 1_555 74.4  ? 
37 O   ? A PRO 175 ? A PRO 280 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 631 ? 1_555 90.0  ? 
38 O   ? A VAL 177 ? A VAL 282 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 631 ? 1_555 72.3  ? 
39 OD1 ? A ASP 200 ? A ASP 305 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 631 ? 1_555 79.8  ? 
40 OD2 ? A ASP 200 ? A ASP 305 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 631 ? 1_555 100.9 ? 
41 O   ? E HOH .   ? A HOH 581 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 631 ? 1_555 139.8 ? 
42 O   ? E HOH .   ? A HOH 609 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 631 ? 1_555 145.7 ? 
43 O   ? A PRO 175 ? A PRO 280 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 739 ? 1_555 77.2  ? 
44 O   ? A VAL 177 ? A VAL 282 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 739 ? 1_555 135.8 ? 
45 OD1 ? A ASP 200 ? A ASP 305 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 739 ? 1_555 75.0  ? 
46 OD2 ? A ASP 200 ? A ASP 305 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 739 ? 1_555 124.8 ? 
47 O   ? E HOH .   ? A HOH 581 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 739 ? 1_555 76.2  ? 
48 O   ? E HOH .   ? A HOH 609 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 739 ? 1_555 140.8 ? 
49 O   ? E HOH .   ? A HOH 631 ? 1_555 CA ? B CA . ? A CA 401 ? 1_555 O   ? E HOH .   ? A HOH 739 ? 1_555 66.7  ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_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 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_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 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1 CYS A 34  A CYS A 123 ? CYS A 139 ? 1_555 CYS A 228 ? 1_555 SG SG . . . None 'Disulfide bridge' 
2 CYS A 34  B CYS A 123 ? CYS A 139 ? 1_555 CYS A 228 ? 1_555 SG SG . . . None 'Disulfide bridge' 
3 CYS A 178 ? CYS A 249 ? CYS A 283 ? 1_555 CYS A 354 ? 1_555 SG SG . . . None 'Disulfide bridge' 
# 
_struct_mon_prot_cis.pdbx_id                1 
_struct_mon_prot_cis.label_comp_id          SER 
_struct_mon_prot_cis.label_seq_id           170 
_struct_mon_prot_cis.label_asym_id          A 
_struct_mon_prot_cis.label_alt_id           . 
_struct_mon_prot_cis.pdbx_PDB_ins_code      ? 
_struct_mon_prot_cis.auth_comp_id           SER 
_struct_mon_prot_cis.auth_seq_id            275 
_struct_mon_prot_cis.auth_asym_id           A 
_struct_mon_prot_cis.pdbx_label_comp_id_2   PRO 
_struct_mon_prot_cis.pdbx_label_seq_id_2    171 
_struct_mon_prot_cis.pdbx_label_asym_id_2   A 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2    ? 
_struct_mon_prot_cis.pdbx_auth_comp_id_2    PRO 
_struct_mon_prot_cis.pdbx_auth_seq_id_2     276 
_struct_mon_prot_cis.pdbx_auth_asym_id_2    A 
_struct_mon_prot_cis.pdbx_PDB_model_num     1 
_struct_mon_prot_cis.pdbx_omega_angle       3.20 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 2 ? 
AA2 ? 7 ? 
AA3 ? 2 ? 
AA4 ? 2 ? 
AA5 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA2 1 2 ? parallel      
AA2 2 3 ? parallel      
AA2 3 4 ? parallel      
AA2 4 5 ? parallel      
AA2 5 6 ? parallel      
AA2 6 7 ? parallel      
AA3 1 2 ? anti-parallel 
AA4 1 2 ? anti-parallel 
AA5 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 ALA A 2   ? GLN A 3   ? ALA A 107 GLN A 108 
AA1 2 TYR A 23  ? TYR A 24  ? TYR A 128 TYR A 129 
AA2 1 ALA A 53  ? THR A 58  ? ALA A 158 THR A 163 
AA2 2 GLN A 89  ? LYS A 94  ? GLN A 194 LYS A 199 
AA2 3 SER A 33  ? ASP A 39  ? SER A 138 ASP A 144 
AA2 4 GLY A 126 ? LEU A 131 ? GLY A 231 LEU A 236 
AA2 5 MET A 154 ? ALA A 158 ? MET A 259 ALA A 263 
AA2 6 CYS A 178 ? SER A 183 ? CYS A 283 SER A 288 
AA2 7 ILE A 201 ? PRO A 204 ? ILE A 306 PRO A 309 
AA3 1 GLY A 135 ? GLY A 136 ? GLY A 240 GLY A 241 
AA3 2 TYR A 169 ? SER A 170 ? TYR A 274 SER A 275 
AA4 1 ILE A 208 ? TRP A 212 ? ILE A 313 TRP A 317 
AA4 2 SER A 216 ? ILE A 220 ? SER A 321 ILE A 325 
AA5 1 ASN A 257 ? LYS A 258 ? ASN A 362 LYS A 363 
AA5 2 LEU A 271 ? LEU A 272 ? LEU A 376 LEU A 377 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 N GLN A 3   ? N GLN A 108 O TYR A 23  ? O TYR A 128 
AA2 1 2 N VAL A 56  ? N VAL A 161 O GLY A 92  ? O GLY A 197 
AA2 2 3 O PHE A 91  ? O PHE A 196 N VAL A 37  ? N VAL A 142 
AA2 3 4 N TYR A 36  ? N TYR A 141 O SER A 130 ? O SER A 235 
AA2 4 5 N ALA A 129 ? N ALA A 234 O MET A 154 ? O MET A 259 
AA2 5 6 N VAL A 157 ? N VAL A 262 O CYS A 178 ? O CYS A 283 
AA2 6 7 N GLY A 181 ? N GLY A 286 O ILE A 201 ? O ILE A 306 
AA3 1 2 N GLY A 135 ? N GLY A 240 O SER A 170 ? O SER A 275 
AA4 1 2 N ILE A 208 ? N ILE A 313 O ILE A 220 ? O ILE A 325 
AA5 1 2 N ASN A 257 ? N ASN A 362 O LEU A 272 ? O LEU A 377 
# 
_pdbx_entry_details.entry_id                   9ODV 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     N 
_pdbx_entry_details.has_protein_modification   Y 
# 
_pdbx_validate_rmsd_angle.id                         1 
_pdbx_validate_rmsd_angle.PDB_model_num              1 
_pdbx_validate_rmsd_angle.auth_atom_id_1             CB 
_pdbx_validate_rmsd_angle.auth_asym_id_1             A 
_pdbx_validate_rmsd_angle.auth_comp_id_1             ASP 
_pdbx_validate_rmsd_angle.auth_seq_id_1              202 
_pdbx_validate_rmsd_angle.PDB_ins_code_1             ? 
_pdbx_validate_rmsd_angle.label_alt_id_1             ? 
_pdbx_validate_rmsd_angle.auth_atom_id_2             CG 
_pdbx_validate_rmsd_angle.auth_asym_id_2             A 
_pdbx_validate_rmsd_angle.auth_comp_id_2             ASP 
_pdbx_validate_rmsd_angle.auth_seq_id_2              202 
_pdbx_validate_rmsd_angle.PDB_ins_code_2             ? 
_pdbx_validate_rmsd_angle.label_alt_id_2             ? 
_pdbx_validate_rmsd_angle.auth_atom_id_3             OD1 
_pdbx_validate_rmsd_angle.auth_asym_id_3             A 
_pdbx_validate_rmsd_angle.auth_comp_id_3             ASP 
_pdbx_validate_rmsd_angle.auth_seq_id_3              202 
_pdbx_validate_rmsd_angle.PDB_ins_code_3             ? 
_pdbx_validate_rmsd_angle.label_alt_id_3             ? 
_pdbx_validate_rmsd_angle.angle_value                123.84 
_pdbx_validate_rmsd_angle.angle_target_value         118.30 
_pdbx_validate_rmsd_angle.angle_deviation            5.54 
_pdbx_validate_rmsd_angle.angle_standard_deviation   0.90 
_pdbx_validate_rmsd_angle.linker_flag                N 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 ASP A 144 ? ? -168.32 -145.29 
2 1 ASN A 266 ? A -101.88 40.32   
3 1 ASN A 266 ? B -107.03 40.37   
4 1 ASP A 312 ? A 62.96   60.59   
5 1 SER A 321 ? A -109.22 -168.90 
6 1 PHE A 371 ? B -39.25  129.45  
7 1 ASN A 375 ? ? -107.36 77.13   
# 
_pdbx_struct_special_symmetry.id              1 
_pdbx_struct_special_symmetry.PDB_model_num   1 
_pdbx_struct_special_symmetry.auth_asym_id    A 
_pdbx_struct_special_symmetry.auth_comp_id    HOH 
_pdbx_struct_special_symmetry.auth_seq_id     626 
_pdbx_struct_special_symmetry.PDB_ins_code    ? 
_pdbx_struct_special_symmetry.label_asym_id   E 
_pdbx_struct_special_symmetry.label_comp_id   HOH 
_pdbx_struct_special_symmetry.label_seq_id    . 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z               
2 -y+1/2,x+1/2,z+3/4  
3 y+1/2,-x+1/2,z+1/4  
4 x+1/2,-y+1/2,-z+1/4 
5 -x+1/2,y+1/2,-z+3/4 
6 -x,-y,z+1/2         
7 y,x,-z              
8 -y,-x,-z+1/2        
# 
_em_3d_fitting.id                1 
_em_3d_fitting.entry_id          9ODV 
_em_3d_fitting.method            ? 
_em_3d_fitting.target_criteria   'Maximum likelihood' 
_em_3d_fitting.details           ? 
_em_3d_fitting.overall_b_value   11.57 
_em_3d_fitting.ref_space         RECIPROCAL 
_em_3d_fitting.ref_protocol      OTHER 
# 
_em_3d_fitting_list.id                            1 
_em_3d_fitting_list.3d_fitting_id                 1 
_em_3d_fitting_list.pdb_entry_id                  9dho 
_em_3d_fitting_list.pdb_chain_id                  ? 
_em_3d_fitting_list.pdb_chain_residue_range       ? 
_em_3d_fitting_list.details                       'Molecular replacement' 
_em_3d_fitting_list.chain_id                      ? 
_em_3d_fitting_list.chain_residue_range           ? 
_em_3d_fitting_list.source_name                   PDB 
_em_3d_fitting_list.type                          'experimental model' 
_em_3d_fitting_list.accession_code                9dho 
_em_3d_fitting_list.initial_refinement_model_id   ? 
# 
_em_3d_reconstruction.entry_id                    9ODV 
_em_3d_reconstruction.id                          1 
_em_3d_reconstruction.method                      ? 
_em_3d_reconstruction.algorithm                   ? 
_em_3d_reconstruction.citation_id                 ? 
_em_3d_reconstruction.details                     ? 
_em_3d_reconstruction.resolution                  1.30 
_em_3d_reconstruction.resolution_method           'DIFFRACTION PATTERN/LAYERLINES' 
_em_3d_reconstruction.magnification_calibration   ? 
_em_3d_reconstruction.nominal_pixel_size          ? 
_em_3d_reconstruction.actual_pixel_size           ? 
_em_3d_reconstruction.num_particles               ? 
_em_3d_reconstruction.euler_angles_details        ? 
_em_3d_reconstruction.num_class_averages          ? 
_em_3d_reconstruction.refinement_type             ? 
_em_3d_reconstruction.image_processing_id         1 
_em_3d_reconstruction.symmetry_type               '3D CRYSTAL' 
# 
_em_buffer.id            1 
_em_buffer.specimen_id   1 
_em_buffer.name          ? 
_em_buffer.details       ? 
_em_buffer.pH            6.5 
# 
_em_entity_assembly.id                   1 
_em_entity_assembly.parent_id            0 
_em_entity_assembly.source               RECOMBINANT 
_em_entity_assembly.type                 COMPLEX 
_em_entity_assembly.name                 'Proteinase K' 
_em_entity_assembly.details              'Serine protease' 
_em_entity_assembly.synonym              ? 
_em_entity_assembly.oligomeric_details   ? 
_em_entity_assembly.entity_id_list       1 
# 
_em_image_scans.entry_id                9ODV 
_em_image_scans.id                      1 
_em_image_scans.number_digital_images   ? 
_em_image_scans.details                 ? 
_em_image_scans.scanner_model           ? 
_em_image_scans.sampling_size           14 
_em_image_scans.od_range                ? 
_em_image_scans.quant_bit_size          ? 
_em_image_scans.citation_id             ? 
_em_image_scans.dimension_height        4096 
_em_image_scans.dimension_width         4096 
_em_image_scans.frames_per_image        ? 
_em_image_scans.image_recording_id      1 
_em_image_scans.used_frames_per_image   ? 
# 
_em_imaging.entry_id                        9ODV 
_em_imaging.id                              1 
_em_imaging.astigmatism                     ? 
_em_imaging.electron_beam_tilt_params       ? 
_em_imaging.residual_tilt                   ? 
_em_imaging.microscope_model                'TFS KRIOS' 
_em_imaging.specimen_holder_type            ? 
_em_imaging.specimen_holder_model           'FEI TITAN KRIOS AUTOGRID HOLDER' 
_em_imaging.details                         ? 
_em_imaging.date                            ? 
_em_imaging.accelerating_voltage            300 
_em_imaging.illumination_mode               'FLOOD BEAM' 
_em_imaging.mode                            DIFFRACTION 
_em_imaging.nominal_cs                      ? 
_em_imaging.nominal_defocus_min             0 
_em_imaging.nominal_defocus_max             0 
_em_imaging.calibrated_defocus_min          ? 
_em_imaging.calibrated_defocus_max          ? 
_em_imaging.tilt_angle_min                  ? 
_em_imaging.tilt_angle_max                  ? 
_em_imaging.nominal_magnification           ? 
_em_imaging.calibrated_magnification        ? 
_em_imaging.electron_source                 'FIELD EMISSION GUN' 
_em_imaging.citation_id                     ? 
_em_imaging.temperature                     ? 
_em_imaging.detector_distance               ? 
_em_imaging.recording_temperature_minimum   77 
_em_imaging.recording_temperature_maximum   90 
_em_imaging.alignment_procedure             BASIC 
_em_imaging.c2_aperture_diameter            50.0 
_em_imaging.specimen_id                     1 
_em_imaging.cryogen                         NITROGEN 
_em_imaging.objective_aperture              ? 
_em_imaging.microscope_serial_number        ? 
_em_imaging.microscope_version              ? 
# 
_em_sample_support.id               1 
_em_sample_support.film_material    ? 
_em_sample_support.method           ? 
_em_sample_support.grid_material    COPPER 
_em_sample_support.grid_mesh_size   200 
_em_sample_support.grid_type        'Quantifoil R2/2' 
_em_sample_support.details          'Negative 15 mA' 
_em_sample_support.specimen_id      1 
_em_sample_support.citation_id      ? 
# 
_em_vitrification.entry_id              9ODV 
_em_vitrification.id                    1 
_em_vitrification.specimen_id           1 
_em_vitrification.cryogen_name          ETHANE 
_em_vitrification.humidity              95 
_em_vitrification.temp                  ? 
_em_vitrification.chamber_temperature   277 
_em_vitrification.instrument            'LEICA PLUNGER' 
_em_vitrification.method                ? 
_em_vitrification.time_resolved_state   ? 
_em_vitrification.citation_id           ? 
_em_vitrification.details               ? 
# 
_em_experiment.entry_id                9ODV 
_em_experiment.id                      1 
_em_experiment.reconstruction_method   CRYSTALLOGRAPHY 
_em_experiment.aggregation_state       '3D ARRAY' 
_em_experiment.entity_assembly_id      1 
# 
loop_
_pdbx_distant_solvent_atoms.id 
_pdbx_distant_solvent_atoms.PDB_model_num 
_pdbx_distant_solvent_atoms.auth_atom_id 
_pdbx_distant_solvent_atoms.label_alt_id 
_pdbx_distant_solvent_atoms.auth_asym_id 
_pdbx_distant_solvent_atoms.auth_comp_id 
_pdbx_distant_solvent_atoms.auth_seq_id 
_pdbx_distant_solvent_atoms.PDB_ins_code 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance 
1 1 O ? A HOH 871 ? 5.83 . 
2 1 O ? A HOH 872 ? 5.97 . 
3 1 O ? A HOH 873 ? 6.06 . 
4 1 O ? A HOH 874 ? 6.11 . 
5 1 O ? A HOH 875 ? 6.76 . 
# 
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  
CA  CA   CA N N 74  
CYS N    N  N N 75  
CYS CA   C  N R 76  
CYS C    C  N N 77  
CYS O    O  N N 78  
CYS CB   C  N N 79  
CYS SG   S  N N 80  
CYS OXT  O  N N 81  
CYS H    H  N N 82  
CYS H2   H  N N 83  
CYS HA   H  N N 84  
CYS HB2  H  N N 85  
CYS HB3  H  N N 86  
CYS HG   H  N N 87  
CYS HXT  H  N N 88  
GLN N    N  N N 89  
GLN CA   C  N S 90  
GLN C    C  N N 91  
GLN O    O  N N 92  
GLN CB   C  N N 93  
GLN CG   C  N N 94  
GLN CD   C  N N 95  
GLN OE1  O  N N 96  
GLN NE2  N  N N 97  
GLN OXT  O  N N 98  
GLN H    H  N N 99  
GLN H2   H  N N 100 
GLN HA   H  N N 101 
GLN HB2  H  N N 102 
GLN HB3  H  N N 103 
GLN HG2  H  N N 104 
GLN HG3  H  N N 105 
GLN HE21 H  N N 106 
GLN HE22 H  N N 107 
GLN HXT  H  N N 108 
GLU N    N  N N 109 
GLU CA   C  N S 110 
GLU C    C  N N 111 
GLU O    O  N N 112 
GLU CB   C  N N 113 
GLU CG   C  N N 114 
GLU CD   C  N N 115 
GLU OE1  O  N N 116 
GLU OE2  O  N N 117 
GLU OXT  O  N N 118 
GLU H    H  N N 119 
GLU H2   H  N N 120 
GLU HA   H  N N 121 
GLU HB2  H  N N 122 
GLU HB3  H  N N 123 
GLU HG2  H  N N 124 
GLU HG3  H  N N 125 
GLU HE2  H  N N 126 
GLU HXT  H  N N 127 
GLY N    N  N N 128 
GLY CA   C  N N 129 
GLY C    C  N N 130 
GLY O    O  N N 131 
GLY OXT  O  N N 132 
GLY H    H  N N 133 
GLY H2   H  N N 134 
GLY HA2  H  N N 135 
GLY HA3  H  N N 136 
GLY HXT  H  N N 137 
HIS N    N  N N 138 
HIS CA   C  N S 139 
HIS C    C  N N 140 
HIS O    O  N N 141 
HIS CB   C  N N 142 
HIS CG   C  Y N 143 
HIS ND1  N  Y N 144 
HIS CD2  C  Y N 145 
HIS CE1  C  Y N 146 
HIS NE2  N  Y N 147 
HIS OXT  O  N N 148 
HIS H    H  N N 149 
HIS H2   H  N N 150 
HIS HA   H  N N 151 
HIS HB2  H  N N 152 
HIS HB3  H  N N 153 
HIS HD1  H  N N 154 
HIS HD2  H  N N 155 
HIS HE1  H  N N 156 
HIS HE2  H  N N 157 
HIS HXT  H  N N 158 
HOH O    O  N N 159 
HOH H1   H  N N 160 
HOH H2   H  N N 161 
ILE N    N  N N 162 
ILE CA   C  N S 163 
ILE C    C  N N 164 
ILE O    O  N N 165 
ILE CB   C  N S 166 
ILE CG1  C  N N 167 
ILE CG2  C  N N 168 
ILE CD1  C  N N 169 
ILE OXT  O  N N 170 
ILE H    H  N N 171 
ILE H2   H  N N 172 
ILE HA   H  N N 173 
ILE HB   H  N N 174 
ILE HG12 H  N N 175 
ILE HG13 H  N N 176 
ILE HG21 H  N N 177 
ILE HG22 H  N N 178 
ILE HG23 H  N N 179 
ILE HD11 H  N N 180 
ILE HD12 H  N N 181 
ILE HD13 H  N N 182 
ILE HXT  H  N N 183 
LEU N    N  N N 184 
LEU CA   C  N S 185 
LEU C    C  N N 186 
LEU O    O  N N 187 
LEU CB   C  N N 188 
LEU CG   C  N N 189 
LEU CD1  C  N N 190 
LEU CD2  C  N N 191 
LEU OXT  O  N N 192 
LEU H    H  N N 193 
LEU H2   H  N N 194 
LEU HA   H  N N 195 
LEU HB2  H  N N 196 
LEU HB3  H  N N 197 
LEU HG   H  N N 198 
LEU HD11 H  N N 199 
LEU HD12 H  N N 200 
LEU HD13 H  N N 201 
LEU HD21 H  N N 202 
LEU HD22 H  N N 203 
LEU HD23 H  N N 204 
LEU HXT  H  N N 205 
LYS N    N  N N 206 
LYS CA   C  N S 207 
LYS C    C  N N 208 
LYS O    O  N N 209 
LYS CB   C  N N 210 
LYS CG   C  N N 211 
LYS CD   C  N N 212 
LYS CE   C  N N 213 
LYS NZ   N  N N 214 
LYS OXT  O  N N 215 
LYS H    H  N N 216 
LYS H2   H  N N 217 
LYS HA   H  N N 218 
LYS HB2  H  N N 219 
LYS HB3  H  N N 220 
LYS HG2  H  N N 221 
LYS HG3  H  N N 222 
LYS HD2  H  N N 223 
LYS HD3  H  N N 224 
LYS HE2  H  N N 225 
LYS HE3  H  N N 226 
LYS HZ1  H  N N 227 
LYS HZ2  H  N N 228 
LYS HZ3  H  N N 229 
LYS HXT  H  N N 230 
MET N    N  N N 231 
MET CA   C  N S 232 
MET C    C  N N 233 
MET O    O  N N 234 
MET CB   C  N N 235 
MET CG   C  N N 236 
MET SD   S  N N 237 
MET CE   C  N N 238 
MET OXT  O  N N 239 
MET H    H  N N 240 
MET H2   H  N N 241 
MET HA   H  N N 242 
MET HB2  H  N N 243 
MET HB3  H  N N 244 
MET HG2  H  N N 245 
MET HG3  H  N N 246 
MET HE1  H  N N 247 
MET HE2  H  N N 248 
MET HE3  H  N N 249 
MET HXT  H  N N 250 
NO3 N    N  N N 251 
NO3 O1   O  N N 252 
NO3 O2   O  N N 253 
NO3 O3   O  N N 254 
PHE N    N  N N 255 
PHE CA   C  N S 256 
PHE C    C  N N 257 
PHE O    O  N N 258 
PHE CB   C  N N 259 
PHE CG   C  Y N 260 
PHE CD1  C  Y N 261 
PHE CD2  C  Y N 262 
PHE CE1  C  Y N 263 
PHE CE2  C  Y N 264 
PHE CZ   C  Y N 265 
PHE OXT  O  N N 266 
PHE H    H  N N 267 
PHE H2   H  N N 268 
PHE HA   H  N N 269 
PHE HB2  H  N N 270 
PHE HB3  H  N N 271 
PHE HD1  H  N N 272 
PHE HD2  H  N N 273 
PHE HE1  H  N N 274 
PHE HE2  H  N N 275 
PHE HZ   H  N N 276 
PHE HXT  H  N N 277 
PRO N    N  N N 278 
PRO CA   C  N S 279 
PRO C    C  N N 280 
PRO O    O  N N 281 
PRO CB   C  N N 282 
PRO CG   C  N N 283 
PRO CD   C  N N 284 
PRO OXT  O  N N 285 
PRO H    H  N N 286 
PRO HA   H  N N 287 
PRO HB2  H  N N 288 
PRO HB3  H  N N 289 
PRO HG2  H  N N 290 
PRO HG3  H  N N 291 
PRO HD2  H  N N 292 
PRO HD3  H  N N 293 
PRO HXT  H  N N 294 
SER N    N  N N 295 
SER CA   C  N S 296 
SER C    C  N N 297 
SER O    O  N N 298 
SER CB   C  N N 299 
SER OG   O  N N 300 
SER OXT  O  N N 301 
SER H    H  N N 302 
SER H2   H  N N 303 
SER HA   H  N N 304 
SER HB2  H  N N 305 
SER HB3  H  N N 306 
SER HG   H  N N 307 
SER HXT  H  N N 308 
THR N    N  N N 309 
THR CA   C  N S 310 
THR C    C  N N 311 
THR O    O  N N 312 
THR CB   C  N R 313 
THR OG1  O  N N 314 
THR CG2  C  N N 315 
THR OXT  O  N N 316 
THR H    H  N N 317 
THR H2   H  N N 318 
THR HA   H  N N 319 
THR HB   H  N N 320 
THR HG1  H  N N 321 
THR HG21 H  N N 322 
THR HG22 H  N N 323 
THR HG23 H  N N 324 
THR HXT  H  N N 325 
TRP N    N  N N 326 
TRP CA   C  N S 327 
TRP C    C  N N 328 
TRP O    O  N N 329 
TRP CB   C  N N 330 
TRP CG   C  Y N 331 
TRP CD1  C  Y N 332 
TRP CD2  C  Y N 333 
TRP NE1  N  Y N 334 
TRP CE2  C  Y N 335 
TRP CE3  C  Y N 336 
TRP CZ2  C  Y N 337 
TRP CZ3  C  Y N 338 
TRP CH2  C  Y N 339 
TRP OXT  O  N N 340 
TRP H    H  N N 341 
TRP H2   H  N N 342 
TRP HA   H  N N 343 
TRP HB2  H  N N 344 
TRP HB3  H  N N 345 
TRP HD1  H  N N 346 
TRP HE1  H  N N 347 
TRP HE3  H  N N 348 
TRP HZ2  H  N N 349 
TRP HZ3  H  N N 350 
TRP HH2  H  N N 351 
TRP HXT  H  N N 352 
TYR N    N  N N 353 
TYR CA   C  N S 354 
TYR C    C  N N 355 
TYR O    O  N N 356 
TYR CB   C  N N 357 
TYR CG   C  Y N 358 
TYR CD1  C  Y N 359 
TYR CD2  C  Y N 360 
TYR CE1  C  Y N 361 
TYR CE2  C  Y N 362 
TYR CZ   C  Y N 363 
TYR OH   O  N N 364 
TYR OXT  O  N N 365 
TYR H    H  N N 366 
TYR H2   H  N N 367 
TYR HA   H  N N 368 
TYR HB2  H  N N 369 
TYR HB3  H  N N 370 
TYR HD1  H  N N 371 
TYR HD2  H  N N 372 
TYR HE1  H  N N 373 
TYR HE2  H  N N 374 
TYR HH   H  N N 375 
TYR HXT  H  N N 376 
VAL N    N  N N 377 
VAL CA   C  N S 378 
VAL C    C  N N 379 
VAL O    O  N N 380 
VAL CB   C  N N 381 
VAL CG1  C  N N 382 
VAL CG2  C  N N 383 
VAL OXT  O  N N 384 
VAL H    H  N N 385 
VAL H2   H  N N 386 
VAL HA   H  N N 387 
VAL HB   H  N N 388 
VAL HG11 H  N N 389 
VAL HG12 H  N N 390 
VAL HG13 H  N N 391 
VAL HG21 H  N N 392 
VAL HG22 H  N N 393 
VAL HG23 H  N N 394 
VAL HXT  H  N N 395 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
HIS N   CA   sing N N 129 
HIS N   H    sing N N 130 
HIS N   H2   sing N N 131 
HIS CA  C    sing N N 132 
HIS CA  CB   sing N N 133 
HIS CA  HA   sing N N 134 
HIS C   O    doub N N 135 
HIS C   OXT  sing N N 136 
HIS CB  CG   sing N N 137 
HIS CB  HB2  sing N N 138 
HIS CB  HB3  sing N N 139 
HIS CG  ND1  sing Y N 140 
HIS CG  CD2  doub Y N 141 
HIS ND1 CE1  doub Y N 142 
HIS ND1 HD1  sing N N 143 
HIS CD2 NE2  sing Y N 144 
HIS CD2 HD2  sing N N 145 
HIS CE1 NE2  sing Y N 146 
HIS CE1 HE1  sing N N 147 
HIS NE2 HE2  sing N N 148 
HIS OXT HXT  sing N N 149 
HOH O   H1   sing N N 150 
HOH O   H2   sing N N 151 
ILE N   CA   sing N N 152 
ILE N   H    sing N N 153 
ILE N   H2   sing N N 154 
ILE CA  C    sing N N 155 
ILE CA  CB   sing N N 156 
ILE CA  HA   sing N N 157 
ILE C   O    doub N N 158 
ILE C   OXT  sing N N 159 
ILE CB  CG1  sing N N 160 
ILE CB  CG2  sing N N 161 
ILE CB  HB   sing N N 162 
ILE CG1 CD1  sing N N 163 
ILE CG1 HG12 sing N N 164 
ILE CG1 HG13 sing N N 165 
ILE CG2 HG21 sing N N 166 
ILE CG2 HG22 sing N N 167 
ILE CG2 HG23 sing N N 168 
ILE CD1 HD11 sing N N 169 
ILE CD1 HD12 sing N N 170 
ILE CD1 HD13 sing N N 171 
ILE OXT HXT  sing N N 172 
LEU N   CA   sing N N 173 
LEU N   H    sing N N 174 
LEU N   H2   sing N N 175 
LEU CA  C    sing N N 176 
LEU CA  CB   sing N N 177 
LEU CA  HA   sing N N 178 
LEU C   O    doub N N 179 
LEU C   OXT  sing N N 180 
LEU CB  CG   sing N N 181 
LEU CB  HB2  sing N N 182 
LEU CB  HB3  sing N N 183 
LEU CG  CD1  sing N N 184 
LEU CG  CD2  sing N N 185 
LEU CG  HG   sing N N 186 
LEU CD1 HD11 sing N N 187 
LEU CD1 HD12 sing N N 188 
LEU CD1 HD13 sing N N 189 
LEU CD2 HD21 sing N N 190 
LEU CD2 HD22 sing N N 191 
LEU CD2 HD23 sing N N 192 
LEU OXT HXT  sing N N 193 
LYS N   CA   sing N N 194 
LYS N   H    sing N N 195 
LYS N   H2   sing N N 196 
LYS CA  C    sing N N 197 
LYS CA  CB   sing N N 198 
LYS CA  HA   sing N N 199 
LYS C   O    doub N N 200 
LYS C   OXT  sing N N 201 
LYS CB  CG   sing N N 202 
LYS CB  HB2  sing N N 203 
LYS CB  HB3  sing N N 204 
LYS CG  CD   sing N N 205 
LYS CG  HG2  sing N N 206 
LYS CG  HG3  sing N N 207 
LYS CD  CE   sing N N 208 
LYS CD  HD2  sing N N 209 
LYS CD  HD3  sing N N 210 
LYS CE  NZ   sing N N 211 
LYS CE  HE2  sing N N 212 
LYS CE  HE3  sing N N 213 
LYS NZ  HZ1  sing N N 214 
LYS NZ  HZ2  sing N N 215 
LYS NZ  HZ3  sing N N 216 
LYS OXT HXT  sing N N 217 
MET N   CA   sing N N 218 
MET N   H    sing N N 219 
MET N   H2   sing N N 220 
MET CA  C    sing N N 221 
MET CA  CB   sing N N 222 
MET CA  HA   sing N N 223 
MET C   O    doub N N 224 
MET C   OXT  sing N N 225 
MET CB  CG   sing N N 226 
MET CB  HB2  sing N N 227 
MET CB  HB3  sing N N 228 
MET CG  SD   sing N N 229 
MET CG  HG2  sing N N 230 
MET CG  HG3  sing N N 231 
MET SD  CE   sing N N 232 
MET CE  HE1  sing N N 233 
MET CE  HE2  sing N N 234 
MET CE  HE3  sing N N 235 
MET OXT HXT  sing N N 236 
NO3 N   O1   doub N N 237 
NO3 N   O2   sing N N 238 
NO3 N   O3   sing N N 239 
PHE N   CA   sing N N 240 
PHE N   H    sing N N 241 
PHE N   H2   sing N N 242 
PHE CA  C    sing N N 243 
PHE CA  CB   sing N N 244 
PHE CA  HA   sing N N 245 
PHE C   O    doub N N 246 
PHE C   OXT  sing N N 247 
PHE CB  CG   sing N N 248 
PHE CB  HB2  sing N N 249 
PHE CB  HB3  sing N N 250 
PHE CG  CD1  doub Y N 251 
PHE CG  CD2  sing Y N 252 
PHE CD1 CE1  sing Y N 253 
PHE CD1 HD1  sing N N 254 
PHE CD2 CE2  doub Y N 255 
PHE CD2 HD2  sing N N 256 
PHE CE1 CZ   doub Y N 257 
PHE CE1 HE1  sing N N 258 
PHE CE2 CZ   sing Y N 259 
PHE CE2 HE2  sing N N 260 
PHE CZ  HZ   sing N N 261 
PHE OXT HXT  sing N N 262 
PRO N   CA   sing N N 263 
PRO N   CD   sing N N 264 
PRO N   H    sing N N 265 
PRO CA  C    sing N N 266 
PRO CA  CB   sing N N 267 
PRO CA  HA   sing N N 268 
PRO C   O    doub N N 269 
PRO C   OXT  sing N N 270 
PRO CB  CG   sing N N 271 
PRO CB  HB2  sing N N 272 
PRO CB  HB3  sing N N 273 
PRO CG  CD   sing N N 274 
PRO CG  HG2  sing N N 275 
PRO CG  HG3  sing N N 276 
PRO CD  HD2  sing N N 277 
PRO CD  HD3  sing N N 278 
PRO OXT HXT  sing N N 279 
SER N   CA   sing N N 280 
SER N   H    sing N N 281 
SER N   H2   sing N N 282 
SER CA  C    sing N N 283 
SER CA  CB   sing N N 284 
SER CA  HA   sing N N 285 
SER C   O    doub N N 286 
SER C   OXT  sing N N 287 
SER CB  OG   sing N N 288 
SER CB  HB2  sing N N 289 
SER CB  HB3  sing N N 290 
SER OG  HG   sing N N 291 
SER OXT HXT  sing N N 292 
THR N   CA   sing N N 293 
THR N   H    sing N N 294 
THR N   H2   sing N N 295 
THR CA  C    sing N N 296 
THR CA  CB   sing N N 297 
THR CA  HA   sing N N 298 
THR C   O    doub N N 299 
THR C   OXT  sing N N 300 
THR CB  OG1  sing N N 301 
THR CB  CG2  sing N N 302 
THR CB  HB   sing N N 303 
THR OG1 HG1  sing N N 304 
THR CG2 HG21 sing N N 305 
THR CG2 HG22 sing N N 306 
THR CG2 HG23 sing N N 307 
THR OXT HXT  sing N N 308 
TRP N   CA   sing N N 309 
TRP N   H    sing N N 310 
TRP N   H2   sing N N 311 
TRP CA  C    sing N N 312 
TRP CA  CB   sing N N 313 
TRP CA  HA   sing N N 314 
TRP C   O    doub N N 315 
TRP C   OXT  sing N N 316 
TRP CB  CG   sing N N 317 
TRP CB  HB2  sing N N 318 
TRP CB  HB3  sing N N 319 
TRP CG  CD1  doub Y N 320 
TRP CG  CD2  sing Y N 321 
TRP CD1 NE1  sing Y N 322 
TRP CD1 HD1  sing N N 323 
TRP CD2 CE2  doub Y N 324 
TRP CD2 CE3  sing Y N 325 
TRP NE1 CE2  sing Y N 326 
TRP NE1 HE1  sing N N 327 
TRP CE2 CZ2  sing Y N 328 
TRP CE3 CZ3  doub Y N 329 
TRP CE3 HE3  sing N N 330 
TRP CZ2 CH2  doub Y N 331 
TRP CZ2 HZ2  sing N N 332 
TRP CZ3 CH2  sing Y N 333 
TRP CZ3 HZ3  sing N N 334 
TRP CH2 HH2  sing N N 335 
TRP OXT HXT  sing N N 336 
TYR N   CA   sing N N 337 
TYR N   H    sing N N 338 
TYR N   H2   sing N N 339 
TYR CA  C    sing N N 340 
TYR CA  CB   sing N N 341 
TYR CA  HA   sing N N 342 
TYR C   O    doub N N 343 
TYR C   OXT  sing N N 344 
TYR CB  CG   sing N N 345 
TYR CB  HB2  sing N N 346 
TYR CB  HB3  sing N N 347 
TYR CG  CD1  doub Y N 348 
TYR CG  CD2  sing Y N 349 
TYR CD1 CE1  sing Y N 350 
TYR CD1 HD1  sing N N 351 
TYR CD2 CE2  doub Y N 352 
TYR CD2 HD2  sing N N 353 
TYR CE1 CZ   doub Y N 354 
TYR CE1 HE1  sing N N 355 
TYR CE2 CZ   sing Y N 356 
TYR CE2 HE2  sing N N 357 
TYR CZ  OH   sing N N 358 
TYR OH  HH   sing N N 359 
TYR OXT HXT  sing N N 360 
VAL N   CA   sing N N 361 
VAL N   H    sing N N 362 
VAL N   H2   sing N N 363 
VAL CA  C    sing N N 364 
VAL CA  CB   sing N N 365 
VAL CA  HA   sing N N 366 
VAL C   O    doub N N 367 
VAL C   OXT  sing N N 368 
VAL CB  CG1  sing N N 369 
VAL CB  CG2  sing N N 370 
VAL CB  HB   sing N N 371 
VAL CG1 HG11 sing N N 372 
VAL CG1 HG12 sing N N 373 
VAL CG1 HG13 sing N N 374 
VAL CG2 HG21 sing N N 375 
VAL CG2 HG22 sing N N 376 
VAL CG2 HG23 sing N N 377 
VAL OXT HXT  sing N N 378 
# 
_em_3d_crystal_entity.angle_alpha           90 
_em_3d_crystal_entity.angle_beta            90 
_em_3d_crystal_entity.angle_gamma           90 
_em_3d_crystal_entity.image_processing_id   1 
_em_3d_crystal_entity.id                    1 
_em_3d_crystal_entity.length_a              67.62 
_em_3d_crystal_entity.length_b              67.62 
_em_3d_crystal_entity.length_c              106.59 
_em_3d_crystal_entity.space_group_name      'P 43 21 1' 
_em_3d_crystal_entity.space_group_num       96 
# 
_em_admin.current_status     REL 
_em_admin.deposition_date    2025-04-28 
_em_admin.deposition_site    RCSB 
_em_admin.entry_id           9ODV 
_em_admin.last_update        2025-05-28 
_em_admin.map_release_date   2025-05-28 
_em_admin.title              'MicroED structure of proteinase K without energy filtering' 
# 
_em_ctf_correction.details                  ? 
_em_ctf_correction.em_image_processing_id   1 
_em_ctf_correction.id                       1 
_em_ctf_correction.type                     NONE 
# 
_em_diffraction.camera_length     1402 
_em_diffraction.id                1 
_em_diffraction.imaging_id        1 
_em_diffraction.tilt_angle_list   ? 
# 
_em_diffraction_shell.em_diffraction_stats_id   1 
_em_diffraction_shell.fourier_space_coverage    97.5 
_em_diffraction_shell.high_resolution           1.09 
_em_diffraction_shell.id                        1 
_em_diffraction_shell.low_resolution            56.82 
_em_diffraction_shell.multiplicity              28.5 
_em_diffraction_shell.num_structure_factors     98228 
_em_diffraction_shell.phase_residual            16.04 
# 
_em_diffraction_stats.details                          ? 
_em_diffraction_stats.fourier_space_coverage           97.5 
_em_diffraction_stats.high_resolution                  1.09 
_em_diffraction_stats.id                               1 
_em_diffraction_stats.image_processing_id              1 
_em_diffraction_stats.num_intensities_measured         2811895 
_em_diffraction_stats.num_structure_factors            98228 
_em_diffraction_stats.overall_phase_error              ? 
_em_diffraction_stats.overall_phase_residual           ? 
_em_diffraction_stats.phase_error_rejection_criteria   None 
_em_diffraction_stats.r_merge                          28.4 
_em_diffraction_stats.r_sym                            ? 
# 
_em_entity_assembly_molwt.entity_assembly_id   1 
_em_entity_assembly_molwt.experimental_flag    NO 
_em_entity_assembly_molwt.id                   1 
_em_entity_assembly_molwt.units                MEGADALTONS 
_em_entity_assembly_molwt.value                0.0289 
# 
_em_entity_assembly_naturalsource.cell                 ? 
_em_entity_assembly_naturalsource.cellular_location    ? 
_em_entity_assembly_naturalsource.entity_assembly_id   1 
_em_entity_assembly_naturalsource.id                   2 
_em_entity_assembly_naturalsource.ncbi_tax_id          37998 
_em_entity_assembly_naturalsource.organism             'Parengyodontium album' 
_em_entity_assembly_naturalsource.organelle            ? 
_em_entity_assembly_naturalsource.organ                ? 
_em_entity_assembly_naturalsource.strain               ? 
_em_entity_assembly_naturalsource.tissue               ? 
_em_entity_assembly_naturalsource.details              ? 
# 
_em_entity_assembly_recombinant.cell                 ? 
_em_entity_assembly_recombinant.entity_assembly_id   1 
_em_entity_assembly_recombinant.id                   2 
_em_entity_assembly_recombinant.ncbi_tax_id          37998 
_em_entity_assembly_recombinant.organism             'Parengyodontium album' 
_em_entity_assembly_recombinant.plasmid              ? 
_em_entity_assembly_recombinant.strain               ? 
# 
_em_image_processing.details              ? 
_em_image_processing.id                   1 
_em_image_processing.image_recording_id   1 
# 
_em_image_recording.average_exposure_time               1 
_em_image_recording.avg_electron_dose_per_subtomogram   ? 
_em_image_recording.avg_electron_dose_per_image         0.002 
_em_image_recording.details                             ? 
_em_image_recording.detector_mode                       ? 
_em_image_recording.film_or_detector_model              'FEI FALCON IV (4k x 4k)' 
_em_image_recording.id                                  1 
_em_image_recording.imaging_id                          1 
_em_image_recording.num_diffraction_images              420 
_em_image_recording.num_grids_imaged                    1 
_em_image_recording.num_real_images                     1 
# 
loop_
_em_software.category 
_em_software.details 
_em_software.id 
_em_software.image_processing_id 
_em_software.fitting_id 
_em_software.imaging_id 
_em_software.name 
_em_software.version 
_em_software.reference_DOI 
'IMAGE ACQUISITION'             ? 1  ? ? 1 SerialEM 4.2.0          ? 
MASKING                         ? 2  ? ? ? ?        ?              ? 
'CTF CORRECTION'                ? 3  1 ? ? ?        ?              ? 
'LAYERLINE INDEXING'            ? 4  ? ? ? ?        ?              ? 
'DIFFRACTION INDEXING'          ? 5  ? ? ? ?        ?              ? 
'MODEL FITTING'                 ? 6  ? 1 ? Coot     0.9.8.93       ? 
OTHER                           ? 7  ? ? ? ?        ?              ? 
'MODEL REFINEMENT'              ? 8  ? 1 ? PHENIX   1.21.1         ? 
'MOLECULAR REPLACEMENT'         ? 9  1 ? ? PHASER   2.8.3          ? 
'LATTICE DISTORTION CORRECTION' ? 10 1 ? ? ?        ?              ? 
'SYMMETRY DETERMINATION'        ? 11 1 ? ? XDS      BUILT=20230630 ? 
'CRYSTALLOGRAPHY MERGING'       ? 12 1 ? ? XSCALE   BUILT=20230630 ? 
RECONSTRUCTION                  ? 13 1 ? ? PHENIX   1.21.1         ? 
# 
_em_specimen.concentration           40 
_em_specimen.details                 Microcrystals 
_em_specimen.embedding_applied       NO 
_em_specimen.experiment_id           1 
_em_specimen.id                      1 
_em_specimen.shadowing_applied       NO 
_em_specimen.staining_applied        NO 
_em_specimen.vitrification_applied   YES 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)' 'United States' P41GM136508      1 
'Department of Defense (DOD, United States)'                                               'United States' HDTRA1-21-1-0004 2 
'Howard Hughes Medical Institute (HHMI)'                                                   'United States' ?                3 
# 
_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   5kxv 
_pdbx_initial_refinement_model.details          ? 
# 
_space_group.name_H-M_alt     'P 43 21 2' 
_space_group.name_Hall        'P 4nw 2abw' 
_space_group.IT_number        96 
_space_group.crystal_system   tetragonal 
_space_group.id               1 
# 
_atom_sites.entry_id                    9ODV 
_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]   0.014789 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.014789 
_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]   0.009382 
_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.pdbx_scat_Cromer_Mann_a5 
_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.pdbx_scat_Cromer_Mann_b5 
_atom_type.scat_Cromer_Mann_c 
_atom_type.scat_source 
_atom_type.scat_dispersion_source 
C  ? ? 0.08930 0.25630 0.75700 1.04870 0.35750 0.24650 1.71000 6.40940  18.61130 50.25230  0.0 
;5-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
CA ? ? 0.40540 1.38800 2.16020 3.75320 2.20630 0.34990 3.09910 11.96080 53.93530 142.38920 0.0 
;5-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
N  ? ? 0.10220 0.32190 0.79820 0.81970 0.17150 0.24510 1.74810 6.19250  17.38940 48.14310  0.0 
;5-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O  ? ? 0.09740 0.29210 0.69100 0.69900 0.20390 0.20670 1.38150 4.69430  12.71050 32.47260  0.0 
;5-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
S  ? ? 0.24970 0.56280 1.38990 2.18650 0.77150 0.26810 1.67110 7.02670  19.53770 50.38880  0.0 
;5-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   . ALA A 1 1   ? -10.25491 11.47840 -17.35696 1.000 14.98408 ? 106 ALA A N   1 
ATOM   2    C  CA  . ALA A 1 1   ? -9.13517  11.75344 -16.46327 1.000 15.71897 ? 106 ALA A CA  1 
ATOM   3    C  C   . ALA A 1 1   ? -9.04869  10.69456 -15.40593 1.000 15.67634 ? 106 ALA A C   1 
ATOM   4    O  O   . ALA A 1 1   ? -10.01370 10.01065 -15.08567 1.000 15.47571 ? 106 ALA A O   1 
ATOM   5    C  CB  . ALA A 1 1   ? -9.26396  13.12545 -15.84145 1.000 15.65281 ? 106 ALA A CB  1 
ATOM   6    N  N   . ALA A 1 2   ? -7.85366  10.55187 -14.86875 1.000 16.54999 ? 107 ALA A N   1 
ATOM   7    C  CA  . ALA A 1 2   ? -7.59086  9.54440  -13.86473 1.000 16.65335 ? 107 ALA A CA  1 
ATOM   8    C  C   . ALA A 1 2   ? -6.60524  10.17321 -12.89756 1.000 16.34738 ? 107 ALA A C   1 
ATOM   9    O  O   . ALA A 1 2   ? -5.58362  10.72524 -13.33293 1.000 17.32113 ? 107 ALA A O   1 
ATOM   10   C  CB  . ALA A 1 2   ? -7.01132  8.28383  -14.52134 1.000 17.34958 ? 107 ALA A CB  1 
ATOM   11   N  N   . GLN A 1 3   ? -6.95038  10.14130 -11.59967 1.000 14.35035 ? 108 GLN A N   1 
ATOM   12   C  CA  . GLN A 1 3   ? -6.07049  10.56149 -10.51774 1.000 13.09316 ? 108 GLN A CA  1 
ATOM   13   C  C   . GLN A 1 3   ? -5.62086  9.29428  -9.79214  1.000 13.87512 ? 108 GLN A C   1 
ATOM   14   O  O   . GLN A 1 3   ? -6.42636  8.62387  -9.13935  1.000 14.26583 ? 108 GLN A O   1 
ATOM   15   C  CB  . GLN A 1 3   ? -6.78314  11.53760 -9.57798  1.000 12.13955 ? 108 GLN A CB  1 
ATOM   16   C  CG  . GLN A 1 3   ? -5.99965  11.75625 -8.26957  1.000 11.65737 ? 108 GLN A CG  1 
ATOM   17   C  CD  . GLN A 1 3   ? -6.79173  12.50961 -7.20923  1.000 10.65649 ? 108 GLN A CD  1 
ATOM   18   O  OE1 . GLN A 1 3   ? -7.93007  12.91382 -7.44314  1.000 10.56703 ? 108 GLN A OE1 1 
ATOM   19   N  NE2 . GLN A 1 3   ? -6.18653  12.70265 -6.04466  1.000 10.48105 ? 108 GLN A NE2 1 
ATOM   20   N  N   A THR A 1 4   ? -4.34135  8.95495  -9.91577  0.796 14.48898 ? 109 THR A N   1 
ATOM   21   N  N   B THR A 1 4   ? -4.33681  8.96775  -9.91214  0.204 13.83059 ? 109 THR A N   1 
ATOM   22   C  CA  A THR A 1 4   ? -3.82625  7.76569  -9.26569  0.796 14.74082 ? 109 THR A CA  1 
ATOM   23   C  CA  B THR A 1 4   ? -3.78970  7.78517  -9.26799  0.204 14.04541 ? 109 THR A CA  1 
ATOM   24   C  C   A THR A 1 4   ? -3.60874  8.02684  -7.78128  0.796 14.01431 ? 109 THR A C   1 
ATOM   25   C  C   B THR A 1 4   ? -3.59938  8.03147  -7.77597  0.204 13.62649 ? 109 THR A C   1 
ATOM   26   O  O   A THR A 1 4   ? -3.35510  9.16199  -7.35263  0.796 13.40333 ? 109 THR A O   1 
ATOM   27   O  O   B THR A 1 4   ? -3.36152  9.16201  -7.33595  0.204 13.40372 ? 109 THR A O   1 
ATOM   28   C  CB  A THR A 1 4   ? -2.49378  7.33556  -9.88504  0.796 16.02338 ? 109 THR A CB  1 
ATOM   29   C  CB  B THR A 1 4   ? -2.44181  7.41360  -9.89019  0.204 14.41228 ? 109 THR A CB  1 
ATOM   30   O  OG1 A THR A 1 4   ? -1.51681  8.36616  -9.69627  0.796 15.93880 ? 109 THR A OG1 1 
ATOM   31   O  OG1 B THR A 1 4   ? -1.90016  6.27221  -9.21574  0.204 14.63201 ? 109 THR A OG1 1 
ATOM   32   C  CG2 A THR A 1 4   ? -2.66571  7.10801  -11.35408 0.796 16.25092 ? 109 THR A CG2 1 
ATOM   33   C  CG2 B THR A 1 4   ? -1.45982  8.56832  -9.77340  0.204 14.60201 ? 109 THR A CG2 1 
ATOM   34   N  N   . ASN A 1 5   ? -3.70429  6.95105  -6.99611  1.000 13.82595 ? 110 ASN A N   1 
ATOM   35   C  CA  . ASN A 1 5   ? -3.52303  7.01114  -5.54939  1.000 14.08604 ? 110 ASN A CA  1 
ATOM   36   C  C   . ASN A 1 5   ? -4.39874  8.09860  -4.94070  1.000 12.85982 ? 110 ASN A C   1 
ATOM   37   O  O   . ASN A 1 5   ? -3.97838  8.87238  -4.07202  1.000 12.47797 ? 110 ASN A O   1 
ATOM   38   C  CB  . ASN A 1 5   ? -2.04801  7.18583  -5.16395  1.000 15.52651 ? 110 ASN A CB  1 
ATOM   39   C  CG  . ASN A 1 5   ? -1.19554  6.03566  -5.65719  1.000 17.60006 ? 110 ASN A CG  1 
ATOM   40   O  OD1 . ASN A 1 5   ? -1.43848  4.86045  -5.33300  1.000 17.80702 ? 110 ASN A OD1 1 
ATOM   41   N  ND2 . ASN A 1 5   ? -0.20923  6.35815  -6.46759  1.000 18.63751 ? 110 ASN A ND2 1 
ATOM   42   N  N   . ALA A 1 6   ? -5.63023  8.17627  -5.43478  1.000 12.09113 ? 111 ALA A N   1 
ATOM   43   C  CA  . ALA A 1 6   ? -6.56016  9.14412  -4.91151  1.000 11.36758 ? 111 ALA A CA  1 
ATOM   44   C  C   . ALA A 1 6   ? -7.05080  8.70712  -3.53035  1.000 10.71770 ? 111 ALA A C   1 
ATOM   45   O  O   . ALA A 1 6   ? -7.01220  7.51639  -3.18781  1.000 10.76506 ? 111 ALA A O   1 
ATOM   46   C  CB  . ALA A 1 6   ? -7.75864  9.24366  -5.85006  1.000 11.46034 ? 111 ALA A CB  1 
ATOM   47   N  N   . PRO A 1 7   ? -7.56815  9.64299  -2.73291  1.000 9.87049  ? 112 PRO A N   1 
ATOM   48   C  CA  . PRO A 1 7   ? -8.28542  9.23398  -1.52309  1.000 8.70044  ? 112 PRO A CA  1 
ATOM   49   C  C   . PRO A 1 7   ? -9.33718  8.18654  -1.86009  1.000 7.99631  ? 112 PRO A C   1 
ATOM   50   O  O   . PRO A 1 7   ? -9.95105  8.21094  -2.93723  1.000 7.93844  ? 112 PRO A O   1 
ATOM   51   C  CB  . PRO A 1 7   ? -8.91814  10.53752 -1.01905  1.000 8.78014  ? 112 PRO A CB  1 
ATOM   52   C  CG  . PRO A 1 7   ? -8.02236  11.61498 -1.61887  1.000 9.77147  ? 112 PRO A CG  1 
ATOM   53   C  CD  . PRO A 1 7   ? -7.62861  11.10551 -2.94620  1.000 9.66438  ? 112 PRO A CD  1 
ATOM   54   N  N   . TRP A 1 8   ? -9.49918  7.22684  -0.94555  1.000 7.72534  ? 113 TRP A N   1 
ATOM   55   C  CA  . TRP A 1 8   ? -10.33699 6.06614  -1.23070  1.000 7.51837  ? 113 TRP A CA  1 
ATOM   56   C  C   . TRP A 1 8   ? -11.74580 6.47435  -1.63366  1.000 7.19028  ? 113 TRP A C   1 
ATOM   57   O  O   . TRP A 1 8   ? -12.34355 5.83458  -2.50071  1.000 7.02544  ? 113 TRP A O   1 
ATOM   58   C  CB  . TRP A 1 8   ? -10.34251 5.06643  -0.06976  1.000 8.14301  ? 113 TRP A CB  1 
ATOM   59   C  CG  . TRP A 1 8   ? -11.27165 5.43935  1.09464   1.000 7.78199  ? 113 TRP A CG  1 
ATOM   60   C  CD1 . TRP A 1 8   ? -10.92211 6.08440  2.25712   1.000 6.92519  ? 113 TRP A CD1 1 
ATOM   61   C  CD2 . TRP A 1 8   ? -12.69195 5.21345  1.17147   1.000 7.99287  ? 113 TRP A CD2 1 
ATOM   62   N  NE1 . TRP A 1 8   ? -12.04231 6.27393  3.04927   1.000 6.86294  ? 113 TRP A NE1 1 
ATOM   63   C  CE2 . TRP A 1 8   ? -13.14177 5.77317  2.39525   1.000 7.59303  ? 113 TRP A CE2 1 
ATOM   64   C  CE3 . TRP A 1 8   ? -13.62994 4.61236  0.30593   1.000 8.29931  ? 113 TRP A CE3 1 
ATOM   65   C  CZ2 . TRP A 1 8   ? -14.48672 5.70524  2.80699   1.000 7.23464  ? 113 TRP A CZ2 1 
ATOM   66   C  CZ3 . TRP A 1 8   ? -14.97253 4.57142  0.69009   1.000 7.14140  ? 113 TRP A CZ3 1 
ATOM   67   C  CH2 . TRP A 1 8   ? -15.39003 5.13433  1.91392   1.000 7.71118  ? 113 TRP A CH2 1 
ATOM   68   N  N   . GLY A 1 9   ? -12.27904 7.54799  -1.03895  1.000 7.30710  ? 114 GLY A N   1 
ATOM   69   C  CA  . GLY A 1 9   ? -13.63773 7.96769  -1.37531  1.000 7.48524  ? 114 GLY A CA  1 
ATOM   70   C  C   . GLY A 1 9   ? -13.80196 8.42012  -2.81580  1.000 8.00028  ? 114 GLY A C   1 
ATOM   71   O  O   . GLY A 1 9   ? -14.82481 8.12832  -3.45223  1.000 8.14259  ? 114 GLY A O   1 
ATOM   72   N  N   . LEU A 1 10  ? -12.81910 9.15383  -3.34658  1.000 7.98456  ? 115 LEU A N   1 
ATOM   73   C  CA  . LEU A 1 10  ? -12.86979 9.53249  -4.75677  1.000 8.40781  ? 115 LEU A CA  1 
ATOM   74   C  C   . LEU A 1 10  ? -12.79146 8.29296  -5.62624  1.000 8.88811  ? 115 LEU A C   1 
ATOM   75   O  O   . LEU A 1 10  ? -13.53754 8.16074  -6.59464  1.000 9.89565  ? 115 LEU A O   1 
ATOM   76   C  CB  . LEU A 1 10  ? -11.73440 10.49253 -5.13412  1.000 8.13163  ? 115 LEU A CB  1 
ATOM   77   C  CG  . LEU A 1 10  ? -11.69612 11.80600 -4.35243  1.000 8.05768  ? 115 LEU A CG  1 
ATOM   78   C  CD1 . LEU A 1 10  ? -10.66567 12.73480 -4.97305  1.000 8.74843  ? 115 LEU A CD1 1 
ATOM   79   C  CD2 . LEU A 1 10  ? -13.11882 12.44351 -4.27445  1.000 8.27134  ? 115 LEU A CD2 1 
ATOM   80   N  N   . ALA A 1 11  ? -11.88235 7.37253  -5.29393  1.000 8.80054  ? 116 ALA A N   1 
ATOM   81   C  CA  . ALA A 1 11  ? -11.85144 6.11579  -6.02733  1.000 9.42013  ? 116 ALA A CA  1 
ATOM   82   C  C   . ALA A 1 11  ? -13.20081 5.38489  -5.93572  1.000 10.23688 ? 116 ALA A C   1 
ATOM   83   O  O   . ALA A 1 11  ? -13.67910 4.82852  -6.92668  1.000 10.48318 ? 116 ALA A O   1 
ATOM   84   C  CB  . ALA A 1 11  ? -10.71019 5.23052  -5.50520  1.000 9.98836  ? 116 ALA A CB  1 
ATOM   85   N  N   . ARG A 1 12  ? -13.82498 5.36308  -4.75112  1.000 10.04579 ? 117 ARG A N   1 
ATOM   86   C  CA  . ARG A 1 12  ? -15.06123 4.61999  -4.60281  1.000 10.00692 ? 117 ARG A CA  1 
ATOM   87   C  C   . ARG A 1 12  ? -16.16282 5.19356  -5.47515  1.000 10.28935 ? 117 ARG A C   1 
ATOM   88   O  O   . ARG A 1 12  ? -16.94043 4.44453  -6.06289  1.000 9.82176  ? 117 ARG A O   1 
ATOM   89   C  CB  . ARG A 1 12  ? -15.50056 4.57942  -3.15014  1.000 10.19350 ? 117 ARG A CB  1 
ATOM   90   C  CG  . ARG A 1 12  ? -16.66763 3.61984  -2.91514  1.000 10.03568 ? 117 ARG A CG  1 
ATOM   91   C  CD  . ARG A 1 12  ? -16.15548 2.16178  -3.01774  1.000 10.22509 ? 117 ARG A CD  1 
ATOM   92   N  NE  . ARG A 1 12  ? -17.24161 1.18437  -2.98887  1.000 10.31243 ? 117 ARG A NE  1 
ATOM   93   C  CZ  . ARG A 1 12  ? -17.95809 0.87068  -4.05664  1.000 10.68387 ? 117 ARG A CZ  1 
ATOM   94   N  NH1 . ARG A 1 12  ? -17.75488 1.48358  -5.21982  1.000 10.97820 ? 117 ARG A NH1 1 
ATOM   95   N  NH2 . ARG A 1 12  ? -18.86136 -0.11100 -3.96629  1.000 11.00501 ? 117 ARG A NH2 1 
ATOM   96   N  N   A ILE A 1 13  ? -16.26465 6.50000  -5.58038  0.619 10.10935 ? 118 ILE A N   1 
ATOM   97   N  N   B ILE A 1 13  ? -16.25697 6.52831  -5.51514  0.381 10.83656 ? 118 ILE A N   1 
ATOM   98   C  CA  A ILE A 1 13  ? -17.40468 7.01245  -6.32614  0.619 10.04236 ? 118 ILE A CA  1 
ATOM   99   C  CA  B ILE A 1 13  ? -17.21775 7.26539  -6.33277  0.381 11.26698 ? 118 ILE A CA  1 
ATOM   100  C  C   A ILE A 1 13  ? -17.19827 6.86876  -7.83065  0.619 9.94089  ? 118 ILE A C   1 
ATOM   101  C  C   B ILE A 1 13  ? -17.21150 6.77001  -7.76834  0.381 10.84361 ? 118 ILE A C   1 
ATOM   102  O  O   A ILE A 1 13  ? -18.07340 7.23924  -8.61191  0.619 9.22738  ? 118 ILE A O   1 
ATOM   103  O  O   B ILE A 1 13  ? -18.25529 6.74975  -8.42753  0.381 10.55884 ? 118 ILE A O   1 
ATOM   104  C  CB  A ILE A 1 13  ? -17.77041 8.45344  -5.94178  0.619 9.95771  ? 118 ILE A CB  1 
ATOM   105  C  CB  B ILE A 1 13  ? -16.91897 8.78706  -6.24793  0.381 11.91176 ? 118 ILE A CB  1 
ATOM   106  C  CG1 A ILE A 1 13  ? -16.64208 9.41799  -6.30209  0.619 10.07116 ? 118 ILE A CG1 1 
ATOM   107  C  CG1 B ILE A 1 13  ? -17.43834 9.38695  -4.93781  0.381 12.15553 ? 118 ILE A CG1 1 
ATOM   108  C  CG2 A ILE A 1 13  ? -18.15473 8.54279  -4.45920  0.619 9.63149  ? 118 ILE A CG2 1 
ATOM   109  C  CG2 B ILE A 1 13  ? -17.49846 9.56282  -7.44366  0.381 12.28307 ? 118 ILE A CG2 1 
ATOM   110  C  CD1 A ILE A 1 13  ? -17.05408 10.89648 -6.31055  0.619 10.66178 ? 118 ILE A CD1 1 
ATOM   111  C  CD1 B ILE A 1 13  ? -18.92725 9.51153  -4.89297  0.381 12.42203 ? 118 ILE A CD1 1 
ATOM   112  N  N   . SER A 1 14  ? -16.05177 6.34444  -8.27308  1.000 10.84115 ? 119 SER A N   1 
ATOM   113  C  CA  . SER A 1 14  ? -15.86095 6.08156  -9.69306  1.000 11.73505 ? 119 SER A CA  1 
ATOM   114  C  C   . SER A 1 14  ? -15.65846 4.60419  -9.96626  1.000 12.01610 ? 119 SER A C   1 
ATOM   115  O  O   . SER A 1 14  ? -15.06880 4.24297  -10.98963 1.000 13.18919 ? 119 SER A O   1 
ATOM   116  C  CB  . SER A 1 14  ? -14.67849 6.86974  -10.24981 1.000 11.23336 ? 119 SER A CB  1 
ATOM   117  O  OG  . SER A 1 14  ? -13.49423 6.48004  -9.55828  1.000 11.21826 ? 119 SER A OG  1 
ATOM   118  N  N   . SER A 1 15  ? -16.10714 3.74614  -9.05871  1.000 11.64896 ? 120 SER A N   1 
ATOM   119  C  CA  . SER A 1 15  ? -15.96093 2.30804  -9.20972  1.000 11.77103 ? 120 SER A CA  1 
ATOM   120  C  C   . SER A 1 15  ? -17.25379 1.60761  -8.83207  1.000 12.11225 ? 120 SER A C   1 
ATOM   121  O  O   . SER A 1 15  ? -17.97430 2.04055  -7.94278  1.000 11.90864 ? 120 SER A O   1 
ATOM   122  C  CB  . SER A 1 15  ? -14.85767 1.79551  -8.25229  1.000 12.27001 ? 120 SER A CB  1 
ATOM   123  O  OG  . SER A 1 15  ? -14.70504 0.39742  -8.42537  1.000 12.76732 ? 120 SER A OG  1 
ATOM   124  N  N   . THR A 1 16  ? -17.54053 0.49359  -9.50535  1.000 12.31804 ? 121 THR A N   1 
ATOM   125  C  CA  . THR A 1 16  ? -18.63481 -0.34689 -9.03275  1.000 13.01818 ? 121 THR A CA  1 
ATOM   126  C  C   . THR A 1 16  ? -18.23569 -1.19197 -7.82991  1.000 13.00226 ? 121 THR A C   1 
ATOM   127  O  O   . THR A 1 16  ? -19.10651 -1.79774 -7.19445  1.000 13.72911 ? 121 THR A O   1 
ATOM   128  C  CB  . THR A 1 16  ? -19.15829 -1.23932 -10.16098 1.000 13.67016 ? 121 THR A CB  1 
ATOM   129  O  OG1 . THR A 1 16  ? -18.06682 -1.96476 -10.71882 1.000 13.98123 ? 121 THR A OG1 1 
ATOM   130  C  CG2 . THR A 1 16  ? -19.79466 -0.41956 -11.26119 1.000 13.89213 ? 121 THR A CG2 1 
ATOM   131  N  N   . SER A 1 17  ? -16.95405 -1.25186 -7.49367  1.000 12.75694 ? 122 SER A N   1 
ATOM   132  C  CA  . SER A 1 17  ? -16.50420 -2.12672 -6.42780  1.000 13.68223 ? 122 SER A CA  1 
ATOM   133  C  C   . SER A 1 17  ? -15.58837 -1.37448 -5.47877  1.000 12.79402 ? 122 SER A C   1 
ATOM   134  O  O   . SER A 1 17  ? -14.86999 -0.46664 -5.90547  1.000 12.51725 ? 122 SER A O   1 
ATOM   135  C  CB  . SER A 1 17  ? -15.70989 -3.29436 -7.01911  1.000 14.61352 ? 122 SER A CB  1 
ATOM   136  O  OG  . SER A 1 17  ? -14.65203 -2.84053 -7.84667  1.000 15.14028 ? 122 SER A OG  1 
ATOM   137  N  N   . PRO A 1 18  ? -15.54568 -1.78174 -4.20068  1.000 12.51124 ? 123 PRO A N   1 
ATOM   138  C  CA  . PRO A 1 18  ? -14.61739 -1.16167 -3.24975  1.000 12.34385 ? 123 PRO A CA  1 
ATOM   139  C  C   . PRO A 1 18  ? -13.19148 -1.62367 -3.50344  1.000 12.13832 ? 123 PRO A C   1 
ATOM   140  O  O   . PRO A 1 18  ? -12.93315 -2.59419 -4.20318  1.000 12.56760 ? 123 PRO A O   1 
ATOM   141  C  CB  . PRO A 1 18  ? -15.10422 -1.69170 -1.90543  1.000 12.62699 ? 123 PRO A CB  1 
ATOM   142  C  CG  . PRO A 1 18  ? -15.65970 -3.06646 -2.22887  1.000 12.80841 ? 123 PRO A CG  1 
ATOM   143  C  CD  . PRO A 1 18  ? -16.36077 -2.84239 -3.55959  1.000 12.87870 ? 123 PRO A CD  1 
ATOM   144  N  N   . GLY A 1 19  ? -12.25289 -0.89657 -2.91095  1.000 12.48299 ? 124 GLY A N   1 
ATOM   145  C  CA  . GLY A 1 19  ? -10.85748 -1.29275 -2.91403  1.000 13.00951 ? 124 GLY A CA  1 
ATOM   146  C  C   . GLY A 1 19  ? -9.99779  -0.82182 -4.06772  1.000 13.38818 ? 124 GLY A C   1 
ATOM   147  O  O   . GLY A 1 19  ? -8.84744  -1.24369 -4.17246  1.000 13.55210 ? 124 GLY A O   1 
ATOM   148  N  N   . THR A 1 20  ? -10.49339 0.04819  -4.92419  1.000 13.39049 ? 125 THR A N   1 
ATOM   149  C  CA  . THR A 1 20  ? -9.65827  0.58237  -5.98794  1.000 13.37308 ? 125 THR A CA  1 
ATOM   150  C  C   . THR A 1 20  ? -8.95592  1.83359  -5.48541  1.000 13.99040 ? 125 THR A C   1 
ATOM   151  O  O   . THR A 1 20  ? -9.27281  2.34395  -4.42606  1.000 14.26643 ? 125 THR A O   1 
ATOM   152  C  CB  . THR A 1 20  ? -10.50002 0.90546  -7.22011  1.000 13.72851 ? 125 THR A CB  1 
ATOM   153  O  OG1 . THR A 1 20  ? -11.36628 2.00750  -6.92031  1.000 12.83136 ? 125 THR A OG1 1 
ATOM   154  C  CG2 . THR A 1 20  ? -11.35131 -0.31875 -7.65707  1.000 14.44083 ? 125 THR A CG2 1 
ATOM   155  N  N   . SER A 1 21  ? -8.00832  2.35017  -6.27540  1.000 14.60247 ? 126 SER A N   1 
ATOM   156  C  CA  . SER A 1 21  ? -7.21004  3.50124  -5.85885  1.000 14.98377 ? 126 SER A CA  1 
ATOM   157  C  C   . SER A 1 21  ? -7.20090  4.66661  -6.84096  1.000 14.60685 ? 126 SER A C   1 
ATOM   158  O  O   . SER A 1 21  ? -6.66656  5.73162  -6.50700  1.000 14.55558 ? 126 SER A O   1 
ATOM   159  C  CB  . SER A 1 21  ? -5.76531  3.07698  -5.58641  1.000 15.27761 ? 126 SER A CB  1 
ATOM   160  O  OG  . SER A 1 21  ? -5.23825  2.43763  -6.72380  1.000 15.32576 ? 126 SER A OG  1 
ATOM   161  N  N   . THR A 1 22  ? -7.77077  4.52006  -8.02218  1.000 13.87048 ? 127 THR A N   1 
ATOM   162  C  CA  . THR A 1 22  ? -7.71718  5.57192  -9.02260  1.000 13.27729 ? 127 THR A CA  1 
ATOM   163  C  C   . THR A 1 22  ? -9.08965  6.22755  -9.11855  1.000 12.41591 ? 127 THR A C   1 
ATOM   164  O  O   . THR A 1 22  ? -10.10810 5.52880  -9.16771  1.000 12.70030 ? 127 THR A O   1 
ATOM   165  C  CB  . THR A 1 22  ? -7.33197  4.97700  -10.36879 1.000 13.95058 ? 127 THR A CB  1 
ATOM   166  O  OG1 . THR A 1 22  ? -5.99672  4.45337  -10.29196 1.000 14.63368 ? 127 THR A OG1 1 
ATOM   167  C  CG2 . THR A 1 22  ? -7.39691  6.03603  -11.43808 1.000 14.16149 ? 127 THR A CG2 1 
ATOM   168  N  N   . TYR A 1 23  ? -9.11656  7.56748  -9.13278  1.000 11.12206 ? 128 TYR A N   1 
ATOM   169  C  CA  . TYR A 1 23  ? -10.36343 8.31052  -9.30025  1.000 10.34967 ? 128 TYR A CA  1 
ATOM   170  C  C   . TYR A 1 23  ? -10.49179 8.65084  -10.77241 1.000 11.36846 ? 128 TYR A C   1 
ATOM   171  O  O   . TYR A 1 23  ? -9.70571  9.44103  -11.30385 1.000 11.63602 ? 128 TYR A O   1 
ATOM   172  C  CB  . TYR A 1 23  ? -10.34739 9.59433  -8.47278  1.000 9.29022  ? 128 TYR A CB  1 
ATOM   173  C  CG  . TYR A 1 23  ? -11.55501 10.49344 -8.69537  1.000 9.33558  ? 128 TYR A CG  1 
ATOM   174  C  CD1 . TYR A 1 23  ? -12.82092 9.96297  -9.03918  1.000 8.99598  ? 128 TYR A CD1 1 
ATOM   175  C  CD2 . TYR A 1 23  ? -11.43443 11.87168 -8.54539  1.000 9.68344  ? 128 TYR A CD2 1 
ATOM   176  C  CE1 . TYR A 1 23  ? -13.93808 10.80889 -9.19626  1.000 9.24064  ? 128 TYR A CE1 1 
ATOM   177  C  CE2 . TYR A 1 23  ? -12.51223 12.71230 -8.70219  1.000 9.80982  ? 128 TYR A CE2 1 
ATOM   178  C  CZ  . TYR A 1 23  ? -13.76353 12.18606 -9.06004  1.000 9.51368  ? 128 TYR A CZ  1 
ATOM   179  O  OH  . TYR A 1 23  ? -14.86552 13.00352 -9.23059  1.000 9.86553  ? 128 TYR A OH  1 
ATOM   180  N  N   A TYR A 1 24  ? -11.49116 8.05477  -11.42335 0.589 11.96632 ? 129 TYR A N   1 
ATOM   181  N  N   B TYR A 1 24  ? -11.47238 8.04508  -11.43524 0.411 11.71652 ? 129 TYR A N   1 
ATOM   182  C  CA  A TYR A 1 24  ? -11.74928 8.22799  -12.83983 0.589 12.27822 ? 129 TYR A CA  1 
ATOM   183  C  CA  B TYR A 1 24  ? -11.71491 8.27351  -12.84706 0.411 11.85061 ? 129 TYR A CA  1 
ATOM   184  C  C   A TYR A 1 24  ? -12.85731 9.26283  -12.98343 0.589 11.88294 ? 129 TYR A C   1 
ATOM   185  C  C   B TYR A 1 24  ? -12.84760 9.26898  -12.98701 0.411 11.65818 ? 129 TYR A C   1 
ATOM   186  O  O   A TYR A 1 24  ? -13.91279 9.12578  -12.35940 0.589 12.14918 ? 129 TYR A O   1 
ATOM   187  O  O   B TYR A 1 24  ? -13.90356 9.10627  -12.36918 0.411 11.83954 ? 129 TYR A O   1 
ATOM   188  C  CB  A TYR A 1 24  ? -12.23431 6.89028  -13.41514 0.589 12.47737 ? 129 TYR A CB  1 
ATOM   189  C  CB  B TYR A 1 24  ? -12.08910 6.96627  -13.54079 0.411 11.89857 ? 129 TYR A CB  1 
ATOM   190  C  CG  A TYR A 1 24  ? -11.25578 5.70530  -13.31282 0.589 12.87340 ? 129 TYR A CG  1 
ATOM   191  C  CG  B TYR A 1 24  ? -10.89919 6.04852  -13.72220 0.411 12.08265 ? 129 TYR A CG  1 
ATOM   192  C  CD1 A TYR A 1 24  ? -10.26236 5.50230  -14.28167 0.589 13.22022 ? 129 TYR A CD1 1 
ATOM   193  C  CD1 B TYR A 1 24  ? -9.91994  6.33275  -14.66654 0.411 12.13010 ? 129 TYR A CD1 1 
ATOM   194  C  CD2 A TYR A 1 24  ? -11.34527 4.76214  -12.27359 0.589 12.81178 ? 129 TYR A CD2 1 
ATOM   195  C  CD2 B TYR A 1 24  ? -10.74637 4.89488  -12.94149 0.411 12.15874 ? 129 TYR A CD2 1 
ATOM   196  C  CE1 A TYR A 1 24  ? -9.37377  4.42819  -14.19983 0.589 13.31122 ? 129 TYR A CE1 1 
ATOM   197  C  CE1 B TYR A 1 24  ? -8.82117  5.48757  -14.83695 0.411 11.84524 ? 129 TYR A CE1 1 
ATOM   198  C  CE2 A TYR A 1 24  ? -10.45629 3.66747  -12.19906 0.589 12.99029 ? 129 TYR A CE2 1 
ATOM   199  C  CE2 B TYR A 1 24  ? -9.65627  4.05103  -13.10381 0.411 12.09563 ? 129 TYR A CE2 1 
ATOM   200  C  CZ  A TYR A 1 24  ? -9.49218  3.50668  -13.16220 0.589 12.84506 ? 129 TYR A CZ  1 
ATOM   201  C  CZ  B TYR A 1 24  ? -8.69051  4.36275  -14.05598 0.411 11.83822 ? 129 TYR A CZ  1 
ATOM   202  O  OH  A TYR A 1 24  ? -8.63027  2.43966  -13.07185 0.589 12.64330 ? 129 TYR A OH  1 
ATOM   203  O  OH  B TYR A 1 24  ? -7.60005  3.54605  -14.23858 0.411 11.78519 ? 129 TYR A OH  1 
ATOM   204  N  N   . TYR A 1 25  ? -12.62940 10.29395 -13.79973 1.000 11.56119 ? 130 TYR A N   1 
ATOM   205  C  CA  . TYR A 1 25  ? -13.64092 11.33989 -13.91614 1.000 11.16943 ? 130 TYR A CA  1 
ATOM   206  C  C   . TYR A 1 25  ? -13.48800 12.09608 -15.22282 1.000 11.87876 ? 130 TYR A C   1 
ATOM   207  O  O   . TYR A 1 25  ? -12.38850 12.20629 -15.77102 1.000 12.51961 ? 130 TYR A O   1 
ATOM   208  C  CB  . TYR A 1 25  ? -13.55059 12.28252 -12.70532 1.000 11.16700 ? 130 TYR A CB  1 
ATOM   209  C  CG  . TYR A 1 25  ? -12.22303 13.00182 -12.59158 1.000 10.93017 ? 130 TYR A CG  1 
ATOM   210  C  CD1 . TYR A 1 25  ? -11.10777 12.39092 -11.99816 1.000 11.23193 ? 130 TYR A CD1 1 
ATOM   211  C  CD2 . TYR A 1 25  ? -12.09051 14.29682 -13.07171 1.000 10.28672 ? 130 TYR A CD2 1 
ATOM   212  C  CE1 . TYR A 1 25  ? -9.87386  13.06803 -11.91876 1.000 11.00797 ? 130 TYR A CE1 1 
ATOM   213  C  CE2 . TYR A 1 25  ? -10.88636 14.98369 -12.99175 1.000 10.20018 ? 130 TYR A CE2 1 
ATOM   214  C  CZ  . TYR A 1 25  ? -9.80015  14.37083 -12.40503 1.000 10.98030 ? 130 TYR A CZ  1 
ATOM   215  O  OH  . TYR A 1 25  ? -8.61761  15.03408 -12.35071 1.000 11.00992 ? 130 TYR A OH  1 
ATOM   216  N  N   . ASP A 1 26  ? -14.60070 12.63199 -15.71687 1.000 12.18886 ? 131 ASP A N   1 
ATOM   217  C  CA  . ASP A 1 26  ? -14.55520 13.47073 -16.90374 1.000 12.37790 ? 131 ASP A CA  1 
ATOM   218  C  C   . ASP A 1 26  ? -13.80338 14.76277 -16.60646 1.000 12.98311 ? 131 ASP A C   1 
ATOM   219  O  O   . ASP A 1 26  ? -14.03989 15.41625 -15.58383 1.000 12.24082 ? 131 ASP A O   1 
ATOM   220  C  CB  . ASP A 1 26  ? -15.97878 13.81628 -17.34854 1.000 12.58736 ? 131 ASP A CB  1 
ATOM   221  C  CG  . ASP A 1 26  ? -15.98657 14.46565 -18.70667 1.000 13.66301 ? 131 ASP A CG  1 
ATOM   222  O  OD1 . ASP A 1 26  ? -16.17473 13.71740 -19.66343 1.000 14.86325 ? 131 ASP A OD1 1 
ATOM   223  O  OD2 . ASP A 1 26  ? -15.79074 15.68546 -18.82667 1.000 13.68158 ? 131 ASP A OD2 1 
ATOM   224  N  N   A GLU A 1 27  ? -12.92122 15.13604 -17.53735 0.422 13.25755 ? 132 GLU A N   1 
ATOM   225  N  N   B GLU A 1 27  ? -12.90069 15.14614 -17.51151 0.578 13.57623 ? 132 GLU A N   1 
ATOM   226  C  CA  A GLU A 1 27  ? -12.04104 16.28841 -17.36936 0.422 13.67269 ? 132 GLU A CA  1 
ATOM   227  C  CA  B GLU A 1 27  ? -12.04375 16.30107 -17.24635 0.578 14.29167 ? 132 GLU A CA  1 
ATOM   228  C  C   A GLU A 1 27  ? -12.79539 17.59591 -17.13986 0.422 13.00398 ? 132 GLU A C   1 
ATOM   229  C  C   B GLU A 1 27  ? -12.81985 17.59637 -17.05677 0.578 13.26769 ? 132 GLU A C   1 
ATOM   230  O  O   A GLU A 1 27  ? -12.20274 18.55744 -16.64074 0.422 13.12398 ? 132 GLU A O   1 
ATOM   231  O  O   B GLU A 1 27  ? -12.26432 18.55561 -16.51185 0.578 13.35525 ? 132 GLU A O   1 
ATOM   232  C  CB  A GLU A 1 27  ? -11.10297 16.39115 -18.58360 0.422 14.45558 ? 132 GLU A CB  1 
ATOM   233  C  CB  B GLU A 1 27  ? -11.00565 16.46971 -18.35750 0.578 15.72202 ? 132 GLU A CB  1 
ATOM   234  C  CG  A GLU A 1 27  ? -10.03799 15.28462 -18.68999 0.422 15.50573 ? 132 GLU A CG  1 
ATOM   235  C  CG  B GLU A 1 27  ? -11.61081 16.80340 -19.71268 0.578 17.37446 ? 132 GLU A CG  1 
ATOM   236  C  CD  A GLU A 1 27  ? -10.48367 13.98872 -19.41161 0.422 16.28648 ? 132 GLU A CD  1 
ATOM   237  C  CD  B GLU A 1 27  ? -10.57470 16.75226 -20.80722 0.578 18.80688 ? 132 GLU A CD  1 
ATOM   238  O  OE1 A GLU A 1 27  ? -11.69186 13.78793 -19.68024 0.422 16.42393 ? 132 GLU A OE1 1 
ATOM   239  O  OE1 B GLU A 1 27  ? -9.38047  16.91625 -20.48240 0.578 19.48861 ? 132 GLU A OE1 1 
ATOM   240  O  OE2 A GLU A 1 27  ? -9.58421  13.16391 -19.70626 0.422 16.60608 ? 132 GLU A OE2 1 
ATOM   241  O  OE2 B GLU A 1 27  ? -10.93923 16.53412 -21.98035 0.578 19.38058 ? 132 GLU A OE2 1 
ATOM   242  N  N   . SER A 1 28  ? -14.08383 17.65442 -17.47853 1.000 12.66273 ? 133 SER A N   1 
ATOM   243  C  CA  . SER A 1 28  ? -14.85654 18.87019 -17.23395 1.000 11.99517 ? 133 SER A CA  1 
ATOM   244  C  C   . SER A 1 28  ? -14.90394 19.21773 -15.75056 1.000 10.86007 ? 133 SER A C   1 
ATOM   245  O  O   . SER A 1 28  ? -14.88691 20.40429 -15.37643 1.000 10.70915 ? 133 SER A O   1 
ATOM   246  C  CB  . SER A 1 28  ? -16.26847 18.72772 -17.79142 1.000 12.61366 ? 133 SER A CB  1 
ATOM   247  O  OG  . SER A 1 28  ? -16.90694 17.58107 -17.25600 1.000 12.67805 ? 133 SER A OG  1 
ATOM   248  N  N   . ALA A 1 29  ? -14.93779 18.19134 -14.88685 1.000 9.57865  ? 134 ALA A N   1 
ATOM   249  C  CA  . ALA A 1 29  ? -14.61302 18.34352 -13.46472 1.000 9.31004  ? 134 ALA A CA  1 
ATOM   250  C  C   . ALA A 1 29  ? -15.50136 19.39032 -12.77119 1.000 8.59851  ? 134 ALA A C   1 
ATOM   251  O  O   . ALA A 1 29  ? -15.01834 20.13440 -11.92035 1.000 8.20961  ? 134 ALA A O   1 
ATOM   252  C  CB  . ALA A 1 29  ? -13.13604 18.71909 -13.25851 1.000 9.66194  ? 134 ALA A CB  1 
ATOM   253  N  N   . GLY A 1 30  ? -16.76104 19.56099 -13.16777 1.000 8.71682  ? 135 GLY A N   1 
ATOM   254  C  CA  . GLY A 1 30  ? -17.53972 20.54894 -12.46290 1.000 9.31551  ? 135 GLY A CA  1 
ATOM   255  C  C   . GLY A 1 30  ? -17.30899 21.98326 -12.87406 1.000 9.84253  ? 135 GLY A C   1 
ATOM   256  O  O   . GLY A 1 30  ? -17.88839 22.87592 -12.24938 1.000 9.33185  ? 135 GLY A O   1 
ATOM   257  N  N   A GLN A 1 31  ? -16.50051 22.24851 -13.90264 0.658 10.67009 ? 136 GLN A N   1 
ATOM   258  N  N   B GLN A 1 31  ? -16.50414 22.25312 -13.89989 0.342 9.91208  ? 136 GLN A N   1 
ATOM   259  C  CA  A GLN A 1 31  ? -16.27965 23.62837 -14.32537 0.658 11.64456 ? 136 GLN A CA  1 
ATOM   260  C  CA  B GLN A 1 31  ? -16.28086 23.64230 -14.28318 0.342 10.13335 ? 136 GLN A CA  1 
ATOM   261  C  C   A GLN A 1 31  ? -17.59308 24.28976 -14.73614 0.658 11.39185 ? 136 GLN A C   1 
ATOM   262  C  C   B GLN A 1 31  ? -17.58557 24.29452 -14.73050 0.342 10.51919 ? 136 GLN A C   1 
ATOM   263  O  O   A GLN A 1 31  ? -18.41194 23.69800 -15.44061 0.658 11.89387 ? 136 GLN A O   1 
ATOM   264  O  O   B GLN A 1 31  ? -18.39703 23.68914 -15.43423 0.342 10.77792 ? 136 GLN A O   1 
ATOM   265  C  CB  A GLN A 1 31  ? -15.29194 23.66108 -15.49703 0.658 13.15834 ? 136 GLN A CB  1 
ATOM   266  C  CB  B GLN A 1 31  ? -15.23086 23.73398 -15.39133 0.342 10.21280 ? 136 GLN A CB  1 
ATOM   267  C  CG  A GLN A 1 31  ? -15.17562 25.00779 -16.16834 0.658 14.46207 ? 136 GLN A CG  1 
ATOM   268  C  CG  B GLN A 1 31  ? -15.65218 23.13325 -16.71232 0.342 10.36188 ? 136 GLN A CG  1 
ATOM   269  C  CD  A GLN A 1 31  ? -14.28782 25.96592 -15.41600 0.658 15.83226 ? 136 GLN A CD  1 
ATOM   270  C  CD  B GLN A 1 31  ? -14.52137 23.17626 -17.71972 0.342 10.98842 ? 136 GLN A CD  1 
ATOM   271  O  OE1 A GLN A 1 31  ? -14.75442 26.98854 -14.87826 0.658 16.45597 ? 136 GLN A OE1 1 
ATOM   272  O  OE1 B GLN A 1 31  ? -13.45798 23.75653 -17.45054 0.342 11.09970 ? 136 GLN A OE1 1 
ATOM   273  N  NE2 A GLN A 1 31  ? -12.98115 25.67590 -15.40105 0.658 16.24453 ? 136 GLN A NE2 1 
ATOM   274  N  NE2 B GLN A 1 31  ? -14.73961 22.56424 -18.88238 0.342 11.31928 ? 136 GLN A NE2 1 
ATOM   275  N  N   . GLY A 1 32  ? -17.79365 25.54353 -14.31167 1.000 10.71153 ? 137 GLY A N   1 
ATOM   276  C  CA  . GLY A 1 32  ? -19.03642 26.25538 -14.61111 1.000 10.21204 ? 137 GLY A CA  1 
ATOM   277  C  C   . GLY A 1 32  ? -20.12417 26.10839 -13.55529 1.000 9.83417  ? 137 GLY A C   1 
ATOM   278  O  O   . GLY A 1 32  ? -21.11134 26.85854 -13.57875 1.000 10.48362 ? 137 GLY A O   1 
ATOM   279  N  N   . SER A 1 33  ? -19.99295 25.13152 -12.65992 1.000 9.56294  ? 138 SER A N   1 
ATOM   280  C  CA  . SER A 1 33  ? -20.89805 24.99058 -11.53879 1.000 8.94612  ? 138 SER A CA  1 
ATOM   281  C  C   . SER A 1 33  ? -20.35256 25.74222 -10.32564 1.000 8.26457  ? 138 SER A C   1 
ATOM   282  O  O   . SER A 1 33  ? -19.18125 26.13184 -10.25309 1.000 8.15178  ? 138 SER A O   1 
ATOM   283  C  CB  . SER A 1 33  ? -21.07502 23.51959 -11.19679 1.000 8.89475  ? 138 SER A CB  1 
ATOM   284  O  OG  . SER A 1 33  ? -19.86270 23.01414 -10.62277 1.000 8.95029  ? 138 SER A OG  1 
ATOM   285  N  N   A CYS A 1 34  ? -21.23646 25.97339 -9.36251  0.886 8.01219  ? 139 CYS A N   1 
ATOM   286  N  N   B CYS A 1 34  ? -21.21245 25.96069 -9.33620  0.114 8.11800  ? 139 CYS A N   1 
ATOM   287  C  CA  A CYS A 1 34  ? -20.88611 26.65262 -8.12722  0.886 7.93188  ? 139 CYS A CA  1 
ATOM   288  C  CA  B CYS A 1 34  ? -20.74479 26.64011 -8.13354  0.114 7.97997  ? 139 CYS A CA  1 
ATOM   289  C  C   A CYS A 1 34  ? -21.39239 25.83217 -6.95890  0.886 7.26672  ? 139 CYS A C   1 
ATOM   290  C  C   B CYS A 1 34  ? -21.40049 26.06821 -6.88631  0.114 7.21214  ? 139 CYS A C   1 
ATOM   291  O  O   A CYS A 1 34  ? -22.51672 25.32671 -6.99028  0.886 7.66004  ? 139 CYS A O   1 
ATOM   292  O  O   B CYS A 1 34  ? -22.62923 25.99439 -6.79393  0.114 7.16268  ? 139 CYS A O   1 
ATOM   293  C  CB  A CYS A 1 34  ? -21.52975 28.01618 -8.11025  0.886 8.66527  ? 139 CYS A CB  1 
ATOM   294  C  CB  B CYS A 1 34  ? -20.91611 28.16201 -8.22519  0.114 8.60117  ? 139 CYS A CB  1 
ATOM   295  S  SG  A CYS A 1 34  ? -20.94358 29.10665 -9.40001  0.886 8.91231  ? 139 CYS A SG  1 
ATOM   296  S  SG  B CYS A 1 34  ? -22.60894 28.75189 -8.25048  0.114 9.24956  ? 139 CYS A SG  1 
ATOM   297  N  N   . VAL A 1 35  ? -20.56662 25.67498 -5.92871  1.000 6.68094  ? 140 VAL A N   1 
ATOM   298  C  CA  . VAL A 1 35  ? -20.98963 24.98352 -4.72116  1.000 5.95102  ? 140 VAL A CA  1 
ATOM   299  C  C   . VAL A 1 35  ? -20.76265 25.92153 -3.53617  1.000 5.84683  ? 140 VAL A C   1 
ATOM   300  O  O   . VAL A 1 35  ? -19.61877 26.30828 -3.24083  1.000 6.14458  ? 140 VAL A O   1 
ATOM   301  C  CB  . VAL A 1 35  ? -20.23329 23.66164 -4.52681  1.000 6.70014  ? 140 VAL A CB  1 
ATOM   302  C  CG1 . VAL A 1 35  ? -20.83056 22.96830 -3.31446  1.000 6.74442  ? 140 VAL A CG1 1 
ATOM   303  C  CG2 . VAL A 1 35  ? -20.30755 22.77485 -5.77928  1.000 6.41164  ? 140 VAL A CG2 1 
ATOM   304  N  N   . TYR A 1 36  ? -21.86178 26.28387 -2.86438  1.000 5.80471  ? 141 TYR A N   1 
ATOM   305  C  CA  . TYR A 1 36  ? -21.81328 26.97002 -1.57524  1.000 5.86750  ? 141 TYR A CA  1 
ATOM   306  C  C   . TYR A 1 36  ? -21.56227 25.93656 -0.50371  1.000 5.61358  ? 141 TYR A C   1 
ATOM   307  O  O   . TYR A 1 36  ? -22.28538 24.93777 -0.39233  1.000 5.57406  ? 141 TYR A O   1 
ATOM   308  C  CB  . TYR A 1 36  ? -23.15290 27.67363 -1.34732  1.000 6.06392  ? 141 TYR A CB  1 
ATOM   309  C  CG  . TYR A 1 36  ? -23.34588 28.89884 -2.21967  1.000 6.93175  ? 141 TYR A CG  1 
ATOM   310  C  CD1 . TYR A 1 36  ? -23.80859 28.79479 -3.55492  1.000 7.35755  ? 141 TYR A CD1 1 
ATOM   311  C  CD2 . TYR A 1 36  ? -23.11248 30.16579 -1.70730  1.000 7.33958  ? 141 TYR A CD2 1 
ATOM   312  C  CE1 . TYR A 1 36  ? -24.03761 29.91139 -4.34693  1.000 7.34646  ? 141 TYR A CE1 1 
ATOM   313  C  CE2 . TYR A 1 36  ? -23.34426 31.31103 -2.49937  1.000 7.19051  ? 141 TYR A CE2 1 
ATOM   314  C  CZ  . TYR A 1 36  ? -23.81027 31.18288 -3.80541  1.000 7.52656  ? 141 TYR A CZ  1 
ATOM   315  O  OH  . TYR A 1 36  ? -24.02434 32.28667 -4.61219  1.000 7.52891  ? 141 TYR A OH  1 
ATOM   316  N  N   . VAL A 1 37  ? -20.52094 26.16288 0.27081   1.000 5.76547  ? 142 VAL A N   1 
ATOM   317  C  CA  . VAL A 1 37  ? -20.21932 25.32038 1.41769   1.000 5.80965  ? 142 VAL A CA  1 
ATOM   318  C  C   . VAL A 1 37  ? -20.64997 26.10912 2.64391   1.000 6.29476  ? 142 VAL A C   1 
ATOM   319  O  O   . VAL A 1 37  ? -20.01351 27.09445 3.02844   1.000 6.82946  ? 142 VAL A O   1 
ATOM   320  C  CB  . VAL A 1 37  ? -18.73645 24.90378 1.45642   1.000 6.15197  ? 142 VAL A CB  1 
ATOM   321  C  CG1 . VAL A 1 37  ? -18.41540 24.01147 2.73196   1.000 6.73125  ? 142 VAL A CG1 1 
ATOM   322  C  CG2 . VAL A 1 37  ? -18.35865 24.19081 0.18514   1.000 7.46797  ? 142 VAL A CG2 1 
ATOM   323  N  N   . ILE A 1 38  ? -21.74753 25.70611 3.26120   1.000 6.66483  ? 143 ILE A N   1 
ATOM   324  C  CA  . ILE A 1 38  ? -22.34063 26.41627 4.38294   1.000 6.14035  ? 143 ILE A CA  1 
ATOM   325  C  C   . ILE A 1 38  ? -21.82377 25.73368 5.64557   1.000 5.93607  ? 143 ILE A C   1 
ATOM   326  O  O   . ILE A 1 38  ? -22.25378 24.62545 5.99403   1.000 6.28398  ? 143 ILE A O   1 
ATOM   327  C  CB  . ILE A 1 38  ? -23.86950 26.37240 4.27656   1.000 6.97315  ? 143 ILE A CB  1 
ATOM   328  C  CG1 . ILE A 1 38  ? -24.31563 26.93053 2.92507   1.000 6.61242  ? 143 ILE A CG1 1 
ATOM   329  C  CG2 . ILE A 1 38  ? -24.52029 27.14469 5.40299   1.000 8.23353  ? 143 ILE A CG2 1 
ATOM   330  C  CD1 . ILE A 1 38  ? -25.84436 26.86260 2.67803   1.000 6.74576  ? 143 ILE A CD1 1 
ATOM   331  N  N   . ASP A 1 39  ? -20.87666 26.37195 6.34106   1.000 6.09116  ? 144 ASP A N   1 
ATOM   332  C  CA  . ASP A 1 39  ? -20.06796 25.65054 7.32442   1.000 5.73526  ? 144 ASP A CA  1 
ATOM   333  C  C   . ASP A 1 39  ? -19.27276 26.64563 8.17785   1.000 5.69948  ? 144 ASP A C   1 
ATOM   334  O  O   . ASP A 1 39  ? -19.75759 27.74644 8.47447   1.000 6.47796  ? 144 ASP A O   1 
ATOM   335  C  CB  . ASP A 1 39  ? -19.15291 24.65813 6.56197   1.000 6.26637  ? 144 ASP A CB  1 
ATOM   336  C  CG  . ASP A 1 39  ? -18.86023 23.44531 7.33821   1.000 6.98135  ? 144 ASP A CG  1 
ATOM   337  O  OD1 . ASP A 1 39  ? -18.13728 23.55862 8.34132   1.000 7.21281  ? 144 ASP A OD1 1 
ATOM   338  O  OD2 . ASP A 1 39  ? -19.31764 22.33180 6.97403   1.000 7.91145  ? 144 ASP A OD2 1 
ATOM   339  N  N   . THR A 1 40  ? -18.06346 26.27404 8.57409   1.000 6.08516  ? 145 THR A N   1 
ATOM   340  C  CA  . THR A 1 40  ? -17.21854 27.13638 9.39118   1.000 5.25100  ? 145 THR A CA  1 
ATOM   341  C  C   . THR A 1 40  ? -16.40174 28.11286 8.55482   1.000 5.50312  ? 145 THR A C   1 
ATOM   342  O  O   . THR A 1 40  ? -15.58927 28.84979 9.11204   1.000 5.65488  ? 145 THR A O   1 
ATOM   343  C  CB  . THR A 1 40  ? -16.26014 26.30286 10.25753  1.000 4.94364  ? 145 THR A CB  1 
ATOM   344  O  OG1 . THR A 1 40  ? -15.36969 25.59377 9.37895   1.000 5.26700  ? 145 THR A OG1 1 
ATOM   345  C  CG2 . THR A 1 40  ? -16.97341 25.29394 11.13563  1.000 5.42425  ? 145 THR A CG2 1 
ATOM   346  N  N   . GLY A 1 41  ? -16.64658 28.20153 7.25608   1.000 5.22537  ? 146 GLY A N   1 
ATOM   347  C  CA  . GLY A 1 41  ? -15.83570 28.98661 6.33944   1.000 5.49807  ? 146 GLY A CA  1 
ATOM   348  C  C   . GLY A 1 41  ? -14.96303 28.09514 5.47452   1.000 5.18083  ? 146 GLY A C   1 
ATOM   349  O  O   . GLY A 1 41  ? -15.00372 26.86546 5.55401   1.000 5.19836  ? 146 GLY A O   1 
ATOM   350  N  N   . ILE A 1 42  ? -14.15128 28.75153 4.63802   1.000 5.97343  ? 147 ILE A N   1 
ATOM   351  C  CA  . ILE A 1 42  ? -13.20012 28.06078 3.77173   1.000 6.71059  ? 147 ILE A CA  1 
ATOM   352  C  C   . ILE A 1 42  ? -11.90615 28.86122 3.84231   1.000 6.45541  ? 147 ILE A C   1 
ATOM   353  O  O   . ILE A 1 42  ? -11.92510 30.08225 3.63956   1.000 6.80820  ? 147 ILE A O   1 
ATOM   354  C  CB  . ILE A 1 42  ? -13.67199 27.98042 2.30144   1.000 7.16110  ? 147 ILE A CB  1 
ATOM   355  C  CG1 . ILE A 1 42  ? -15.09398 27.39277 2.19548   1.000 6.91777  ? 147 ILE A CG1 1 
ATOM   356  C  CG2 . ILE A 1 42  ? -12.62917 27.19603 1.46801   1.000 7.69988  ? 147 ILE A CG2 1 
ATOM   357  C  CD1 . ILE A 1 42  ? -15.57775 27.42339 0.78668   1.000 7.07897  ? 147 ILE A CD1 1 
ATOM   358  N  N   . GLU A 1 43  ? -10.77040 28.17534 4.01659   1.000 7.09168  ? 148 GLU A N   1 
ATOM   359  C  CA  . GLU A 1 43  ? -9.48156  28.84550 3.91632   1.000 7.37482  ? 148 GLU A CA  1 
ATOM   360  C  C   . GLU A 1 43  ? -9.16015  28.94722 2.43109   1.000 8.42942  ? 148 GLU A C   1 
ATOM   361  O  O   . GLU A 1 43  ? -8.47147  28.10640 1.84987   1.000 8.19157  ? 148 GLU A O   1 
ATOM   362  C  CB  . GLU A 1 43  ? -8.40627  28.05883 4.65259   1.000 7.29240  ? 148 GLU A CB  1 
ATOM   363  C  CG  . GLU A 1 43  ? -7.04033  28.78134 4.59524   1.000 8.38048  ? 148 GLU A CG  1 
ATOM   364  C  CD  . GLU A 1 43  ? -6.04851  28.06707 5.46088   1.000 9.29664  ? 148 GLU A CD  1 
ATOM   365  O  OE1 . GLU A 1 43  ? -6.10362  28.23424 6.68465   1.000 9.37528  ? 148 GLU A OE1 1 
ATOM   366  O  OE2 . GLU A 1 43  ? -5.23514  27.30699 4.91796   1.000 10.56862 ? 148 GLU A OE2 1 
ATOM   367  N  N   . ALA A 1 44  ? -9.68773  30.00582 1.80432   1.000 9.42438  ? 149 ALA A N   1 
ATOM   368  C  CA  . ALA A 1 44  ? -9.60735  30.11034 0.35519   1.000 10.20088 ? 149 ALA A CA  1 
ATOM   369  C  C   . ALA A 1 44  ? -8.17132  30.20849 -0.15082  1.000 9.95883  ? 149 ALA A C   1 
ATOM   370  O  O   . ALA A 1 44  ? -7.90246  29.82984 -1.29514  1.000 10.20145 ? 149 ALA A O   1 
ATOM   371  C  CB  . ALA A 1 44  ? -10.46014 31.28728 -0.14679  1.000 11.15874 ? 149 ALA A CB  1 
ATOM   372  N  N   . SER A 1 45  ? -7.23093  30.67100 0.68298   1.000 10.03236 ? 150 SER A N   1 
ATOM   373  C  CA  . SER A 1 45  ? -5.83450  30.78462 0.27058   1.000 10.36598 ? 150 SER A CA  1 
ATOM   374  C  C   . SER A 1 45  ? -5.14762  29.42911 0.16934   1.000 10.69829 ? 150 SER A C   1 
ATOM   375  O  O   . SER A 1 45  ? -4.02349  29.37496 -0.32653  1.000 11.23255 ? 150 SER A O   1 
ATOM   376  C  CB  . SER A 1 45  ? -5.04281  31.64382 1.26031   1.000 11.37400 ? 150 SER A CB  1 
ATOM   377  O  OG  . SER A 1 45  ? -5.05517  31.03398 2.55237   1.000 12.10368 ? 150 SER A OG  1 
ATOM   378  N  N   . HIS A 1 46  ? -5.77930  28.34167 0.61979   1.000 9.81897  ? 151 HIS A N   1 
ATOM   379  C  CA  . HIS A 1 46  ? -5.14382  27.03556 0.52932   1.000 8.87996  ? 151 HIS A CA  1 
ATOM   380  C  C   . HIS A 1 46  ? -4.75696  26.75226 -0.92125  1.000 8.65888  ? 151 HIS A C   1 
ATOM   381  O  O   . HIS A 1 46  ? -5.62076  26.80848 -1.81712  1.000 8.31667  ? 151 HIS A O   1 
ATOM   382  C  CB  . HIS A 1 46  ? -6.08633  25.94010 1.03496   1.000 8.82626  ? 151 HIS A CB  1 
ATOM   383  C  CG  . HIS A 1 46  ? -5.37998  24.67142 1.42900   1.000 9.18468  ? 151 HIS A CG  1 
ATOM   384  N  ND1 . HIS A 1 46  ? -4.61807  23.94358 0.54015   1.000 8.96507  ? 151 HIS A ND1 1 
ATOM   385  C  CD2 . HIS A 1 46  ? -5.35581  23.99039 2.59844   1.000 9.28948  ? 151 HIS A CD2 1 
ATOM   386  C  CE1 . HIS A 1 46  ? -4.10469  22.89360 1.16436   1.000 9.60073  ? 151 HIS A CE1 1 
ATOM   387  N  NE2 . HIS A 1 46  ? -4.55186  22.89048 2.40830   1.000 9.68174  ? 151 HIS A NE2 1 
ATOM   388  N  N   . PRO A 1 47  ? -3.49773  26.41691 -1.18832  1.000 8.61084  ? 152 PRO A N   1 
ATOM   389  C  CA  . PRO A 1 47  ? -3.08525  26.11384 -2.57732  1.000 9.67580  ? 152 PRO A CA  1 
ATOM   390  C  C   . PRO A 1 47  ? -3.96475  25.08077 -3.26245  1.000 8.72631  ? 152 PRO A C   1 
ATOM   391  O  O   . PRO A 1 47  ? -4.16482  25.14624 -4.48825  1.000 8.31314  ? 152 PRO A O   1 
ATOM   392  C  CB  . PRO A 1 47  ? -1.65185  25.60130 -2.40179  1.000 10.10788 ? 152 PRO A CB  1 
ATOM   393  C  CG  . PRO A 1 47  ? -1.18308  26.36457 -1.18622  1.000 9.74861  ? 152 PRO A CG  1 
ATOM   394  C  CD  . PRO A 1 47  ? -2.36782  26.33743 -0.24635  1.000 9.20728  ? 152 PRO A CD  1 
ATOM   395  N  N   . GLU A 1 48  ? -4.56721  24.17899 -2.49174  1.000 8.34109  ? 153 GLU A N   1 
ATOM   396  C  CA  . GLU A 1 48  ? -5.40098  23.13830 -3.07663  1.000 8.16965  ? 153 GLU A CA  1 
ATOM   397  C  C   . GLU A 1 48  ? -6.63518  23.70585 -3.75205  1.000 7.92700  ? 153 GLU A C   1 
ATOM   398  O  O   . GLU A 1 48  ? -7.20591  23.04701 -4.62429  1.000 8.29015  ? 153 GLU A O   1 
ATOM   399  C  CB  . GLU A 1 48  ? -5.76766  22.12894 -1.97746  1.000 9.31211  ? 153 GLU A CB  1 
ATOM   400  C  CG  . GLU A 1 48  ? -4.70732  21.09193 -1.72851  1.000 10.39303 ? 153 GLU A CG  1 
ATOM   401  C  CD  . GLU A 1 48  ? -4.73872  20.03811 -2.79899  1.000 10.23037 ? 153 GLU A CD  1 
ATOM   402  O  OE1 . GLU A 1 48  ? -5.85034  19.80046 -3.32614  1.000 10.18925 ? 153 GLU A OE1 1 
ATOM   403  O  OE2 . GLU A 1 48  ? -3.68082  19.44722 -3.13527  1.000 10.51299 ? 153 GLU A OE2 1 
ATOM   404  N  N   . PHE A 1 49  ? -7.01790  24.93146 -3.41564  1.000 7.70793  ? 154 PHE A N   1 
ATOM   405  C  CA  . PHE A 1 49  ? -8.19896  25.51461 -4.04409  1.000 7.87341  ? 154 PHE A CA  1 
ATOM   406  C  C   . PHE A 1 49  ? -7.87743  26.30057 -5.30226  1.000 7.81822  ? 154 PHE A C   1 
ATOM   407  O  O   . PHE A 1 49  ? -8.80000  26.61073 -6.07015  1.000 7.46027  ? 154 PHE A O   1 
ATOM   408  C  CB  . PHE A 1 49  ? -8.97400  26.40360 -3.05701  1.000 8.11317  ? 154 PHE A CB  1 
ATOM   409  C  CG  . PHE A 1 49  ? -9.56853  25.64481 -1.90497  1.000 7.48499  ? 154 PHE A CG  1 
ATOM   410  C  CD1 . PHE A 1 49  ? -10.44053 24.56681 -2.12492  1.000 6.44426  ? 154 PHE A CD1 1 
ATOM   411  C  CD2 . PHE A 1 49  ? -9.27441  26.02850 -0.61343  1.000 7.17102  ? 154 PHE A CD2 1 
ATOM   412  C  CE1 . PHE A 1 49  ? -10.98690 23.85219 -1.05872  1.000 6.83888  ? 154 PHE A CE1 1 
ATOM   413  C  CE2 . PHE A 1 49  ? -9.82230  25.35087 0.45804   1.000 6.93273  ? 154 PHE A CE2 1 
ATOM   414  C  CZ  . PHE A 1 49  ? -10.69753 24.24864 0.23614   1.000 7.37058  ? 154 PHE A CZ  1 
ATOM   415  N  N   . GLU A 1 50  ? -6.59841  26.60304 -5.55439  1.000 8.09356  ? 155 GLU A N   1 
ATOM   416  C  CA  . GLU A 1 50  ? -6.17463  27.12928 -6.85213  1.000 8.58640  ? 155 GLU A CA  1 
ATOM   417  C  C   . GLU A 1 50  ? -6.88781  28.42624 -7.22516  1.000 9.00498  ? 155 GLU A C   1 
ATOM   418  O  O   . GLU A 1 50  ? -7.08623  28.70808 -8.39423  1.000 10.10365 ? 155 GLU A O   1 
ATOM   419  C  CB  . GLU A 1 50  ? -6.31793  26.07903 -7.96950  1.000 9.29849  ? 155 GLU A CB  1 
ATOM   420  C  CG  . GLU A 1 50  ? -5.65578  24.73670 -7.65198  1.000 9.75300  ? 155 GLU A CG  1 
ATOM   421  C  CD  . GLU A 1 50  ? -5.98101  23.71061 -8.71474  1.000 9.58955  ? 155 GLU A CD  1 
ATOM   422  O  OE1 . GLU A 1 50  ? -7.18253  23.47313 -8.96565  1.000 9.39225  ? 155 GLU A OE1 1 
ATOM   423  O  OE2 . GLU A 1 50  ? -5.04617  23.13487 -9.29612  1.000 10.59168 ? 155 GLU A OE2 1 
ATOM   424  N  N   . GLY A 1 51  ? -7.27761  29.21390 -6.24823  1.000 8.60906  ? 156 GLY A N   1 
ATOM   425  C  CA  . GLY A 1 51  ? -7.94785  30.45716 -6.54233  1.000 8.59073  ? 156 GLY A CA  1 
ATOM   426  C  C   . GLY A 1 51  ? -9.44612  30.32507 -6.74998  1.000 8.40309  ? 156 GLY A C   1 
ATOM   427  O  O   . GLY A 1 51  ? -10.12912 31.35589 -6.80764  1.000 8.73801  ? 156 GLY A O   1 
ATOM   428  N  N   . ARG A 1 52  ? -9.97348  29.10831 -6.78185  1.000 8.23115  ? 157 ARG A N   1 
ATOM   429  C  CA  . ARG A 1 52  ? -11.36420 28.85770 -7.11750  1.000 7.86761  ? 157 ARG A CA  1 
ATOM   430  C  C   . ARG A 1 52  ? -12.29542 28.94351 -5.91979  1.000 7.97727  ? 157 ARG A C   1 
ATOM   431  O  O   . ARG A 1 52  ? -13.49969 28.71614 -6.09847  1.000 7.93892  ? 157 ARG A O   1 
ATOM   432  C  CB  . ARG A 1 52  ? -11.55046 27.48198 -7.76687  1.000 7.71388  ? 157 ARG A CB  1 
ATOM   433  C  CG  . ARG A 1 52  ? -10.84425 27.35358 -9.09322  1.000 8.11802  ? 157 ARG A CG  1 
ATOM   434  C  CD  . ARG A 1 52  ? -11.00938 25.94209 -9.64763  1.000 8.46592  ? 157 ARG A CD  1 
ATOM   435  N  NE  . ARG A 1 52  ? -10.16184 24.98727 -8.93645  1.000 8.29646  ? 157 ARG A NE  1 
ATOM   436  C  CZ  . ARG A 1 52  ? -10.56184 24.13556 -7.98752  1.000 8.57987  ? 157 ARG A CZ  1 
ATOM   437  N  NH1 . ARG A 1 52  ? -11.84508 24.02795 -7.63489  1.000 8.38105  ? 157 ARG A NH1 1 
ATOM   438  N  NH2 . ARG A 1 52  ? -9.65246  23.39820 -7.35389  1.000 9.32942  ? 157 ARG A NH2 1 
ATOM   439  N  N   . ALA A 1 53  ? -11.78493 29.23004 -4.71513  1.000 8.70693  ? 158 ALA A N   1 
ATOM   440  C  CA  . ALA A 1 53  ? -12.62510 29.36636 -3.52410  1.000 9.04497  ? 158 ALA A CA  1 
ATOM   441  C  C   . ALA A 1 53  ? -12.67115 30.82287 -3.11011  1.000 9.68050  ? 158 ALA A C   1 
ATOM   442  O  O   . ALA A 1 53  ? -11.68445 31.54094 -3.23722  1.000 10.22796 ? 158 ALA A O   1 
ATOM   443  C  CB  . ALA A 1 53  ? -12.11562 28.52853 -2.33309  1.000 8.79064  ? 158 ALA A CB  1 
ATOM   444  N  N   . GLN A 1 54  ? -13.80284 31.25422 -2.56276  1.000 10.35706 ? 159 GLN A N   1 
ATOM   445  C  CA  . GLN A 1 54  ? -13.85226 32.55400 -1.91931  1.000 11.09180 ? 159 GLN A CA  1 
ATOM   446  C  C   . GLN A 1 54  ? -14.96824 32.56614 -0.90366  1.000 9.79871  ? 159 GLN A C   1 
ATOM   447  O  O   . GLN A 1 54  ? -16.01636 31.94216 -1.11103  1.000 9.52886  ? 159 GLN A O   1 
ATOM   448  C  CB  . GLN A 1 54  ? -14.08477 33.66597 -2.91911  1.000 13.43869 ? 159 GLN A CB  1 
ATOM   449  C  CG  . GLN A 1 54  ? -15.40938 33.62068 -3.56423  1.000 16.11220 ? 159 GLN A CG  1 
ATOM   450  C  CD  . GLN A 1 54  ? -15.59822 34.76694 -4.51789  1.000 17.98184 ? 159 GLN A CD  1 
ATOM   451  O  OE1 . GLN A 1 54  ? -15.67772 35.93659 -4.11508  1.000 18.40705 ? 159 GLN A OE1 1 
ATOM   452  N  NE2 . GLN A 1 54  ? -15.64781 34.44633 -5.81306  1.000 18.87058 ? 159 GLN A NE2 1 
ATOM   453  N  N   . MET A 1 55  ? -14.71795 33.28991 0.18494   1.000 8.76757  ? 160 MET A N   1 
ATOM   454  C  CA  . MET A 1 55  ? -15.75398 33.57116 1.16088   1.000 8.21542  ? 160 MET A CA  1 
ATOM   455  C  C   . MET A 1 55  ? -16.69889 34.61149 0.60022   1.000 8.48212  ? 160 MET A C   1 
ATOM   456  O  O   . MET A 1 55  ? -16.26630 35.61340 0.03839   1.000 10.06898 ? 160 MET A O   1 
ATOM   457  C  CB  . MET A 1 55  ? -15.12404 34.11148 2.44461   1.000 7.93474  ? 160 MET A CB  1 
ATOM   458  C  CG  . MET A 1 55  ? -14.33486 33.03734 3.21085   1.000 7.76779  ? 160 MET A CG  1 
ATOM   459  S  SD  . MET A 1 55  ? -15.42195 31.64980 3.61773   1.000 7.66838  ? 160 MET A SD  1 
ATOM   460  C  CE  . MET A 1 55  ? -16.61632 32.41056 4.70813   1.000 8.23536  ? 160 MET A CE  1 
ATOM   461  N  N   . VAL A 1 56  ? -17.99800 34.39419 0.79017   1.000 8.75854  ? 161 VAL A N   1 
ATOM   462  C  CA  . VAL A 1 56  ? -18.98757 35.35709 0.32731   1.000 9.17813  ? 161 VAL A CA  1 
ATOM   463  C  C   . VAL A 1 56  ? -19.85199 35.90292 1.44849   1.000 9.65569  ? 161 VAL A C   1 
ATOM   464  O  O   . VAL A 1 56  ? -20.52336 36.92609 1.24999   1.000 9.95848  ? 161 VAL A O   1 
ATOM   465  C  CB  . VAL A 1 56  ? -19.87187 34.80016 -0.80605  1.000 9.76522  ? 161 VAL A CB  1 
ATOM   466  C  CG1 . VAL A 1 56  ? -18.97642 34.39854 -1.95618  1.000 10.84932 ? 161 VAL A CG1 1 
ATOM   467  C  CG2 . VAL A 1 56  ? -20.72267 33.63188 -0.28278  1.000 10.25460 ? 161 VAL A CG2 1 
ATOM   468  N  N   . LYS A 1 57  ? -19.86058 35.26717 2.60999   1.000 9.91813  ? 162 LYS A N   1 
ATOM   469  C  CA  . LYS A 1 57  ? -20.70056 35.72932 3.69714   1.000 9.62013  ? 162 LYS A CA  1 
ATOM   470  C  C   . LYS A 1 57  ? -20.20314 35.11225 4.98487   1.000 9.13631  ? 162 LYS A C   1 
ATOM   471  O  O   . LYS A 1 57  ? -19.92466 33.91733 5.03026   1.000 8.61682  ? 162 LYS A O   1 
ATOM   472  C  CB  . LYS A 1 57  ? -22.15795 35.29187 3.45800   1.000 10.25747 ? 162 LYS A CB  1 
ATOM   473  C  CG  . LYS A 1 57  ? -23.11372 35.64745 4.58188   1.000 11.15058 ? 162 LYS A CG  1 
ATOM   474  C  CD  . LYS A 1 57  ? -23.35639 37.17213 4.61858   1.000 12.68280 ? 162 LYS A CD  1 
ATOM   475  C  CE  . LYS A 1 57  ? -24.20409 37.56016 5.81391   1.000 13.75388 ? 162 LYS A CE  1 
ATOM   476  N  NZ  . LYS A 1 57  ? -24.31211 39.04825 5.95870   1.000 14.28290 ? 162 LYS A NZ  1 
ATOM   477  N  N   . THR A 1 58  ? -20.19651 35.90020 6.04903   1.000 9.18231  ? 163 THR A N   1 
ATOM   478  C  CA  . THR A 1 58  ? -19.94023 35.37267 7.36915   1.000 9.04665  ? 163 THR A CA  1 
ATOM   479  C  C   . THR A 1 58  ? -20.94858 35.93309 8.36130   1.000 9.66637  ? 163 THR A C   1 
ATOM   480  O  O   . THR A 1 58  ? -21.41159 37.07514 8.24139   1.000 10.65492 ? 163 THR A O   1 
ATOM   481  C  CB  . THR A 1 58  ? -18.50410 35.66437 7.86710   1.000 8.99350  ? 163 THR A CB  1 
ATOM   482  O  OG1 . THR A 1 58  ? -18.33988 35.07057 9.16038   1.000 9.49110  ? 163 THR A OG1 1 
ATOM   483  C  CG2 . THR A 1 58  ? -18.21175 37.20328 7.94060   1.000 9.68030  ? 163 THR A CG2 1 
ATOM   484  N  N   . TYR A 1 59  ? -21.30257 35.11518 9.33306   1.000 9.34555  ? 164 TYR A N   1 
ATOM   485  C  CA  . TYR A 1 59  ? -22.19667 35.55293 10.38989  1.000 9.28121  ? 164 TYR A CA  1 
ATOM   486  C  C   . TYR A 1 59  ? -21.43577 35.78368 11.67541  1.000 9.42921  ? 164 TYR A C   1 
ATOM   487  O  O   . TYR A 1 59  ? -22.05692 35.94536 12.73130  1.000 10.16269 ? 164 TYR A O   1 
ATOM   488  C  CB  . TYR A 1 59  ? -23.33408 34.54329 10.55019  1.000 9.29016  ? 164 TYR A CB  1 
ATOM   489  C  CG  . TYR A 1 59  ? -24.24943 34.57777 9.33268   1.000 8.85161  ? 164 TYR A CG  1 
ATOM   490  C  CD1 . TYR A 1 59  ? -25.30789 35.50655 9.27011   1.000 9.44451  ? 164 TYR A CD1 1 
ATOM   491  C  CD2 . TYR A 1 59  ? -24.02324 33.74442 8.23237   1.000 8.73836  ? 164 TYR A CD2 1 
ATOM   492  C  CE1 . TYR A 1 59  ? -26.13200 35.58799 8.22076   1.000 9.41812  ? 164 TYR A CE1 1 
ATOM   493  C  CE2 . TYR A 1 59  ? -24.86404 33.82189 7.14165   1.000 9.08201  ? 164 TYR A CE2 1 
ATOM   494  C  CZ  . TYR A 1 59  ? -25.92066 34.75919 7.14343   1.000 9.46638  ? 164 TYR A CZ  1 
ATOM   495  O  OH  . TYR A 1 59  ? -26.74528 34.88892 6.03854   1.000 10.23810 ? 164 TYR A OH  1 
ATOM   496  N  N   . TYR A 1 60  ? -20.10723 35.82085 11.60900  1.000 9.25094  ? 165 TYR A N   1 
ATOM   497  C  CA  . TYR A 1 60  ? -19.27847 36.01303 12.78321  1.000 10.35878 ? 165 TYR A CA  1 
ATOM   498  C  C   . TYR A 1 60  ? -18.33436 37.18083 12.53490  1.000 10.62313 ? 165 TYR A C   1 
ATOM   499  O  O   . TYR A 1 60  ? -18.40005 37.86200 11.50868  1.000 11.33176 ? 165 TYR A O   1 
ATOM   500  C  CB  . TYR A 1 60  ? -18.52974 34.71920 13.13258  1.000 11.90191 ? 165 TYR A CB  1 
ATOM   501  C  CG  . TYR A 1 60  ? -19.53960 33.63454 13.43201  1.000 12.57870 ? 165 TYR A CG  1 
ATOM   502  C  CD1 . TYR A 1 60  ? -20.03617 32.83953 12.40383  1.000 12.53395 ? 165 TYR A CD1 1 
ATOM   503  C  CD2 . TYR A 1 60  ? -20.06396 33.44355 14.71622  1.000 12.93331 ? 165 TYR A CD2 1 
ATOM   504  C  CE1 . TYR A 1 60  ? -20.99894 31.87546 12.62958  1.000 12.73432 ? 165 TYR A CE1 1 
ATOM   505  C  CE2 . TYR A 1 60  ? -21.03831 32.43701 14.94818  1.000 13.09235 ? 165 TYR A CE2 1 
ATOM   506  C  CZ  . TYR A 1 60  ? -21.48415 31.68334 13.87474  1.000 13.17361 ? 165 TYR A CZ  1 
ATOM   507  O  OH  . TYR A 1 60  ? -22.43698 30.69519 14.00121  1.000 14.17895 ? 165 TYR A OH  1 
ATOM   508  N  N   . TYR A 1 61  ? -17.45786 37.41665 13.50734  1.000 10.07593 ? 166 TYR A N   1 
ATOM   509  C  CA  . TYR A 1 61  ? -16.56968 38.57826 13.44382  1.000 10.52887 ? 166 TYR A CA  1 
ATOM   510  C  C   . TYR A 1 61  ? -15.66153 38.52991 12.23016  1.000 10.60305 ? 166 TYR A C   1 
ATOM   511  O  O   . TYR A 1 61  ? -15.32652 39.57006 11.66137  1.000 11.35602 ? 166 TYR A O   1 
ATOM   512  C  CB  . TYR A 1 61  ? -15.72658 38.63039 14.70986  1.000 10.99000 ? 166 TYR A CB  1 
ATOM   513  C  CG  . TYR A 1 61  ? -16.56207 38.44745 15.93989  1.000 11.40774 ? 166 TYR A CG  1 
ATOM   514  C  CD1 . TYR A 1 61  ? -17.27498 39.53029 16.49152  1.000 11.57978 ? 166 TYR A CD1 1 
ATOM   515  C  CD2 . TYR A 1 61  ? -16.65241 37.19676 16.55160  1.000 11.60116 ? 166 TYR A CD2 1 
ATOM   516  C  CE1 . TYR A 1 61  ? -18.06183 39.36066 17.58330  1.000 11.75484 ? 166 TYR A CE1 1 
ATOM   517  C  CE2 . TYR A 1 61  ? -17.42764 37.02133 17.68597  1.000 12.09245 ? 166 TYR A CE2 1 
ATOM   518  C  CZ  . TYR A 1 61  ? -18.12356 38.11549 18.20563  1.000 12.05335 ? 166 TYR A CZ  1 
ATOM   519  O  OH  . TYR A 1 61  ? -18.90555 37.98241 19.32989  1.000 13.09342 ? 166 TYR A OH  1 
ATOM   520  N  N   . SER A 1 62  ? -15.21566 37.34138 11.84664  1.000 10.10007 ? 167 SER A N   1 
ATOM   521  C  CA  . SER A 1 62  ? -14.32963 37.18637 10.70825  1.000 10.57948 ? 167 SER A CA  1 
ATOM   522  C  C   . SER A 1 62  ? -14.92618 36.15390 9.77270   1.000 10.27876 ? 167 SER A C   1 
ATOM   523  O  O   . SER A 1 62  ? -15.82467 35.38943 10.14027  1.000 10.36393 ? 167 SER A O   1 
ATOM   524  C  CB  . SER A 1 62  ? -12.91143 36.77291 11.17662  1.000 10.70186 ? 167 SER A CB  1 
ATOM   525  O  OG  . SER A 1 62  ? -12.04124 36.49293 10.08962  1.000 11.25203 ? 167 SER A OG  1 
ATOM   526  N  N   . SER A 1 63  ? -14.42721 36.16959 8.55441   1.000 10.27116 ? 168 SER A N   1 
ATOM   527  C  CA  . SER A 1 63  ? -14.78109 35.15282 7.58343   1.000 10.06928 ? 168 SER A CA  1 
ATOM   528  C  C   . SER A 1 63  ? -13.78212 34.00456 7.58693   1.000 9.35667  ? 168 SER A C   1 
ATOM   529  O  O   . SER A 1 63  ? -14.00343 33.00804 6.89407   1.000 10.40774 ? 168 SER A O   1 
ATOM   530  C  CB  . SER A 1 63  ? -14.84546 35.76713 6.18651   1.000 11.71930 ? 168 SER A CB  1 
ATOM   531  O  OG  . SER A 1 63  ? -13.57832 36.28797 5.82549   1.000 12.97552 ? 168 SER A OG  1 
ATOM   532  N  N   . ARG A 1 64  ? -12.70111 34.12501 8.35124   1.000 9.75189  ? 169 ARG A N   1 
ATOM   533  C  CA  . ARG A 1 64  ? -11.69459 33.07200 8.45808   1.000 9.91763  ? 169 ARG A CA  1 
ATOM   534  C  C   . ARG A 1 64  ? -12.29226 31.77305 8.99048   1.000 9.37663  ? 169 ARG A C   1 
ATOM   535  O  O   . ARG A 1 64  ? -13.05216 31.76873 9.96096   1.000 10.36351 ? 169 ARG A O   1 
ATOM   536  C  CB  . ARG A 1 64  ? -10.63801 33.54681 9.45405   1.000 11.24876 ? 169 ARG A CB  1 
ATOM   537  C  CG  . ARG A 1 64  ? -9.52383  32.55823 9.66781   1.000 12.78517 ? 169 ARG A CG  1 
ATOM   538  C  CD  . ARG A 1 64  ? -8.51256  33.11063 10.72534  1.000 15.14948 ? 169 ARG A CD  1 
ATOM   539  N  NE  . ARG A 1 64  ? -7.81937  32.02944 11.42482  1.000 17.92011 ? 169 ARG A NE  1 
ATOM   540  C  CZ  . ARG A 1 64  ? -8.14480  31.62251 12.64606  1.000 19.91419 ? 169 ARG A CZ  1 
ATOM   541  N  NH1 . ARG A 1 64  ? -9.09283  32.23685 13.35015  1.000 20.52548 ? 169 ARG A NH1 1 
ATOM   542  N  NH2 . ARG A 1 64  ? -7.49157  30.59109 13.18931  1.000 20.60560 ? 169 ARG A NH2 1 
ATOM   543  N  N   . ASP A 1 65  ? -11.92439 30.66086 8.37697   1.000 8.30170  ? 170 ASP A N   1 
ATOM   544  C  CA  . ASP A 1 65  ? -12.24830 29.36184 8.97224   1.000 7.50558  ? 170 ASP A CA  1 
ATOM   545  C  C   . ASP A 1 65  ? -11.23405 29.10081 10.06957  1.000 7.77135  ? 170 ASP A C   1 
ATOM   546  O  O   . ASP A 1 65  ? -10.08415 28.77533 9.78377   1.000 7.91663  ? 170 ASP A O   1 
ATOM   547  C  CB  . ASP A 1 65  ? -12.21201 28.26587 7.91465   1.000 7.97120  ? 170 ASP A CB  1 
ATOM   548  C  CG  . ASP A 1 65  ? -12.44250 26.86953 8.47089   1.000 7.35498  ? 170 ASP A CG  1 
ATOM   549  O  OD1 . ASP A 1 65  ? -12.82302 26.73592 9.63605   1.000 7.82898  ? 170 ASP A OD1 1 
ATOM   550  O  OD2 . ASP A 1 65  ? -12.26971 25.88105 7.72270   1.000 6.80783  ? 170 ASP A OD2 1 
ATOM   551  N  N   . GLY A 1 66  ? -11.64660 29.32321 11.31581  1.000 7.60055  ? 171 GLY A N   1 
ATOM   552  C  CA  . GLY A 1 66  ? -10.83147 29.05617 12.46580  1.000 8.11529  ? 171 GLY A CA  1 
ATOM   553  C  C   . GLY A 1 66  ? -10.91732 27.62927 12.91436  1.000 7.59218  ? 171 GLY A C   1 
ATOM   554  O  O   . GLY A 1 66  ? -10.25281 27.28035 13.87123  1.000 7.59729  ? 171 GLY A O   1 
ATOM   555  N  N   . ASN A 1 67  ? -11.67795 26.78716 12.23566  1.000 7.24409  ? 172 ASN A N   1 
ATOM   556  C  CA  . ASN A 1 67  ? -11.91227 25.44300 12.70488  1.000 7.32007  ? 172 ASN A CA  1 
ATOM   557  C  C   . ASN A 1 67  ? -11.24137 24.38945 11.85285  1.000 7.09569  ? 172 ASN A C   1 
ATOM   558  O  O   . ASN A 1 67  ? -10.53178 23.53601 12.38146  1.000 7.40633  ? 172 ASN A O   1 
ATOM   559  C  CB  . ASN A 1 67  ? -13.41261 25.16278 12.75836  1.000 7.24235  ? 172 ASN A CB  1 
ATOM   560  C  CG  . ASN A 1 67  ? -13.69374 23.77711 13.31209  1.000 7.49768  ? 172 ASN A CG  1 
ATOM   561  O  OD1 . ASN A 1 67  ? -13.69622 22.79552 12.56894  1.000 8.76775  ? 172 ASN A OD1 1 
ATOM   562  N  ND2 . ASN A 1 67  ? -13.85594 23.68655 14.62960  1.000 7.66251  ? 172 ASN A ND2 1 
ATOM   563  N  N   . GLY A 1 68  ? -11.45512 24.44572 10.54513  1.000 6.85515  ? 173 GLY A N   1 
ATOM   564  C  CA  . GLY A 1 68  ? -10.97801 23.44680 9.62730   1.000 6.00418  ? 173 GLY A CA  1 
ATOM   565  C  C   . GLY A 1 68  ? -12.09371 22.65364 8.97277   1.000 5.73650  ? 173 GLY A C   1 
ATOM   566  O  O   . GLY A 1 68  ? -11.93922 22.20886 7.83404   1.000 5.78408  ? 173 GLY A O   1 
ATOM   567  N  N   . HIS A 1 69  ? -13.21240 22.43509 9.68619   1.000 5.87404  ? 174 HIS A N   1 
ATOM   568  C  CA  . HIS A 1 69  ? -14.28798 21.59739 9.15244   1.000 6.67920  ? 174 HIS A CA  1 
ATOM   569  C  C   . HIS A 1 69  ? -14.75660 22.08174 7.77655   1.000 6.60487  ? 174 HIS A C   1 
ATOM   570  O  O   . HIS A 1 69  ? -14.88780 21.29088 6.82137   1.000 6.07321  ? 174 HIS A O   1 
ATOM   571  C  CB  . HIS A 1 69  ? -15.42458 21.58697 10.17525  1.000 8.03559  ? 174 HIS A CB  1 
ATOM   572  C  CG  . HIS A 1 69  ? -16.53159 20.62561 9.87593   1.000 8.39436  ? 174 HIS A CG  1 
ATOM   573  N  ND1 . HIS A 1 69  ? -17.65510 21.00881 9.18164   1.000 8.39406  ? 174 HIS A ND1 1 
ATOM   574  C  CD2 . HIS A 1 69  ? -16.72441 19.31637 10.20525  1.000 9.53162  ? 174 HIS A CD2 1 
ATOM   575  C  CE1 . HIS A 1 69  ? -18.49833 19.99192 9.09579   1.000 9.19795  ? 174 HIS A CE1 1 
ATOM   576  N  NE2 . HIS A 1 69  ? -17.96133 18.95798 9.71247   1.000 9.89976  ? 174 HIS A NE2 1 
ATOM   577  N  N   . GLY A 1 70  ? -15.05635 23.37084 7.65739   1.000 6.84442  ? 175 GLY A N   1 
ATOM   578  C  CA  . GLY A 1 70  ? -15.52849 23.87383 6.37888   1.000 6.83154  ? 175 GLY A CA  1 
ATOM   579  C  C   . GLY A 1 70  ? -14.49102 23.77889 5.27710   1.000 6.60752  ? 175 GLY A C   1 
ATOM   580  O  O   . GLY A 1 70  ? -14.82074 23.54317 4.11779   1.000 6.38011  ? 175 GLY A O   1 
ATOM   581  N  N   . THR A 1 71  ? -13.22762 23.98335 5.62646   1.000 6.71230  ? 176 THR A N   1 
ATOM   582  C  CA  . THR A 1 71  ? -12.15944 23.83505 4.65565   1.000 6.32914  ? 176 THR A CA  1 
ATOM   583  C  C   . THR A 1 71  ? -12.02666 22.37874 4.22573   1.000 6.30565  ? 176 THR A C   1 
ATOM   584  O  O   . THR A 1 71  ? -11.79582 22.10172 3.04536   1.000 6.29731  ? 176 THR A O   1 
ATOM   585  C  CB  . THR A 1 71  ? -10.85725 24.33860 5.27506   1.000 6.59340  ? 176 THR A CB  1 
ATOM   586  O  OG1 . THR A 1 71  ? -10.98047 25.74370 5.50461   1.000 6.87065  ? 176 THR A OG1 1 
ATOM   587  C  CG2 . THR A 1 71  ? -9.66982  24.09163 4.36147   1.000 6.75177  ? 176 THR A CG2 1 
ATOM   588  N  N   . HIS A 1 72  ? -12.22330 21.44754 5.16571   1.000 6.01627  ? 177 HIS A N   1 
ATOM   589  C  CA  . HIS A 1 72  ? -12.17420 20.03623 4.82827   1.000 5.81643  ? 177 HIS A CA  1 
ATOM   590  C  C   . HIS A 1 72  ? -13.29801 19.67178 3.87805   1.000 5.34176  ? 177 HIS A C   1 
ATOM   591  O  O   . HIS A 1 72  ? -13.06184 19.06556 2.83951   1.000 5.79692  ? 177 HIS A O   1 
ATOM   592  C  CB  . HIS A 1 72  ? -12.20463 19.21887 6.11244   1.000 6.03336  ? 177 HIS A CB  1 
ATOM   593  C  CG  . HIS A 1 72  ? -11.84694 17.77350 5.93769   1.000 6.41562  ? 177 HIS A CG  1 
ATOM   594  N  ND1 . HIS A 1 72  ? -12.77209 16.79135 5.64065   1.000 7.26986  ? 177 HIS A ND1 1 
ATOM   595  C  CD2 . HIS A 1 72  ? -10.66132 17.13749 6.09076   1.000 6.69670  ? 177 HIS A CD2 1 
ATOM   596  C  CE1 . HIS A 1 72  ? -12.15979 15.61737 5.59008   1.000 7.83937  ? 177 HIS A CE1 1 
ATOM   597  N  NE2 . HIS A 1 72  ? -10.88166 15.79682 5.86450   1.000 7.93577  ? 177 HIS A NE2 1 
ATOM   598  N  N   . CYS A 1 73  ? -14.53777 20.06768 4.21830   1.000 4.94519  ? 178 CYS A N   1 
ATOM   599  C  CA  . CYS A 1 73  ? -15.68389 19.76126 3.35934   1.000 5.64320  ? 178 CYS A CA  1 
ATOM   600  C  C   . CYS A 1 73  ? -15.52934 20.40003 1.99628   1.000 5.01880  ? 178 CYS A C   1 
ATOM   601  O  O   . CYS A 1 73  ? -15.77634 19.76274 0.97038   1.000 5.03436  ? 178 CYS A O   1 
ATOM   602  C  CB  . CYS A 1 73  ? -16.98458 20.21913 4.01696   1.000 6.27181  ? 178 CYS A CB  1 
ATOM   603  S  SG  . CYS A 1 73  ? -17.34829 19.31926 5.55898   1.000 7.34534  ? 178 CYS A SG  1 
ATOM   604  N  N   . ALA A 1 74  ? -15.10833 21.66742 1.96809   1.000 5.24243  ? 179 ALA A N   1 
ATOM   605  C  CA  . ALA A 1 74  ? -14.88891 22.36507 0.70644   1.000 5.77142  ? 179 ALA A CA  1 
ATOM   606  C  C   . ALA A 1 74  ? -13.84886 21.62822 -0.12348  1.000 5.29690  ? 179 ALA A C   1 
ATOM   607  O  O   . ALA A 1 74  ? -13.96941 21.56770 -1.35293  1.000 4.99276  ? 179 ALA A O   1 
ATOM   608  C  CB  . ALA A 1 74  ? -14.43968 23.82500 0.94872   1.000 6.89495  ? 179 ALA A CB  1 
ATOM   609  N  N   . GLY A 1 75  ? -12.81000 21.09439 0.52390   1.000 5.75669  ? 180 GLY A N   1 
ATOM   610  C  CA  . GLY A 1 75  ? -11.81446 20.35129 -0.20465  1.000 6.01080  ? 180 GLY A CA  1 
ATOM   611  C  C   . GLY A 1 75  ? -12.36679 19.07246 -0.80779  1.000 5.44956  ? 180 GLY A C   1 
ATOM   612  O  O   . GLY A 1 75  ? -11.95843 18.67958 -1.90451  1.000 5.37300  ? 180 GLY A O   1 
ATOM   613  N  N   . THR A 1 76  ? -13.32094 18.41322 -0.12686  1.000 4.78117  ? 181 THR A N   1 
ATOM   614  C  CA  . THR A 1 76  ? -13.89855 17.20549 -0.73000  1.000 4.52604  ? 181 THR A CA  1 
ATOM   615  C  C   . THR A 1 76  ? -14.79817 17.56364 -1.90026  1.000 5.28889  ? 181 THR A C   1 
ATOM   616  O  O   . THR A 1 76  ? -14.93056 16.78298 -2.84037  1.000 6.50449  ? 181 THR A O   1 
ATOM   617  C  CB  . THR A 1 76  ? -14.62987 16.37665 0.32362   1.000 5.14813  ? 181 THR A CB  1 
ATOM   618  O  OG1 . THR A 1 76  ? -13.65355 15.93919 1.29691   1.000 5.99195  ? 181 THR A OG1 1 
ATOM   619  C  CG2 . THR A 1 76  ? -15.38655 15.15260 -0.28555  1.000 5.93663  ? 181 THR A CG2 1 
ATOM   620  N  N   . VAL A 1 77  ? -15.46142 18.72290 -1.83914  1.000 5.37745  ? 182 VAL A N   1 
ATOM   621  C  CA  . VAL A 1 77  ? -16.21301 19.15336 -2.99904  1.000 5.98373  ? 182 VAL A CA  1 
ATOM   622  C  C   . VAL A 1 77  ? -15.26625 19.42836 -4.15905  1.000 6.35821  ? 182 VAL A C   1 
ATOM   623  O  O   . VAL A 1 77  ? -15.49115 18.94743 -5.27412  1.000 7.43335  ? 182 VAL A O   1 
ATOM   624  C  CB  . VAL A 1 77  ? -17.02842 20.42278 -2.69092  1.000 5.61882  ? 182 VAL A CB  1 
ATOM   625  C  CG1 . VAL A 1 77  ? -17.72056 20.87864 -4.00127  1.000 6.18454  ? 182 VAL A CG1 1 
ATOM   626  C  CG2 . VAL A 1 77  ? -18.06322 20.21663 -1.54940  1.000 5.84705  ? 182 VAL A CG2 1 
ATOM   627  N  N   . GLY A 1 78  ? -14.24534 20.28232 -3.93761  1.000 5.77229  ? 183 GLY A N   1 
ATOM   628  C  CA  . GLY A 1 78  ? -13.63483 20.84177 -5.11601  1.000 6.50386  ? 183 GLY A CA  1 
ATOM   629  C  C   . GLY A 1 78  ? -12.15167 21.14579 -5.02420  1.000 6.68468  ? 183 GLY A C   1 
ATOM   630  O  O   . GLY A 1 78  ? -11.65873 21.89779 -5.85687  1.000 7.17355  ? 183 GLY A O   1 
ATOM   631  N  N   . SER A 1 79  ? -11.40902 20.63267 -4.04431  1.000 6.77606  ? 184 SER A N   1 
ATOM   632  C  CA  . SER A 1 79  ? -9.96016  20.84869 -4.11289  1.000 6.99733  ? 184 SER A CA  1 
ATOM   633  C  C   . SER A 1 79  ? -9.35222  20.02077 -5.22208  1.000 6.42291  ? 184 SER A C   1 
ATOM   634  O  O   . SER A 1 79  ? -9.92329  19.04254 -5.67606  1.000 5.09567  ? 184 SER A O   1 
ATOM   635  C  CB  . SER A 1 79  ? -9.26911  20.51194 -2.79581  1.000 6.99839  ? 184 SER A CB  1 
ATOM   636  O  OG  . SER A 1 79  ? -9.35618  19.12357 -2.51664  1.000 7.07654  ? 184 SER A OG  1 
ATOM   637  N  N   . ARG A 1 80  ? -8.15687  20.42220 -5.63278  1.000 6.70233  ? 185 ARG A N   1 
ATOM   638  C  CA  . ARG A 1 80  ? -7.45429  19.71328 -6.68473  1.000 6.82108  ? 185 ARG A CA  1 
ATOM   639  C  C   . ARG A 1 80  ? -7.24341  18.23998 -6.34522  1.000 7.51226  ? 185 ARG A C   1 
ATOM   640  O  O   . ARG A 1 80  ? -7.65371  17.36158 -7.09529  1.000 7.65309  ? 185 ARG A O   1 
ATOM   641  C  CB  . ARG A 1 80  ? -6.09721  20.38431 -6.94422  1.000 7.76282  ? 185 ARG A CB  1 
ATOM   642  C  CG  . ARG A 1 80  ? -5.29444  19.71709 -8.02106  1.000 9.17132  ? 185 ARG A CG  1 
ATOM   643  C  CD  . ARG A 1 80  ? -3.81215  19.98261 -7.89081  1.000 11.54541 ? 185 ARG A CD  1 
ATOM   644  N  NE  . ARG A 1 80  ? -3.22718  19.08999 -6.91645  1.000 13.47469 ? 185 ARG A NE  1 
ATOM   645  C  CZ  . ARG A 1 80  ? -1.94360  18.76855 -6.91799  1.000 14.40157 ? 185 ARG A CZ  1 
ATOM   646  N  NH1 . ARG A 1 80  ? -1.11304  19.25700 -7.83105  1.000 14.82116 ? 185 ARG A NH1 1 
ATOM   647  N  NH2 . ARG A 1 80  ? -1.48667  17.91976 -5.99641  1.000 15.13008 ? 185 ARG A NH2 1 
ATOM   648  N  N   . THR A 1 81  ? -6.60158  17.95051 -5.24129  1.000 7.30183  ? 186 THR A N   1 
ATOM   649  C  CA  . THR A 1 81  ? -6.20901  16.57796 -4.92201  1.000 7.17224  ? 186 THR A CA  1 
ATOM   650  C  C   . THR A 1 81  ? -7.31858  15.78931 -4.23351  1.000 6.78149  ? 186 THR A C   1 
ATOM   651  O  O   . THR A 1 81  ? -7.43502  14.56790 -4.43585  1.000 7.44452  ? 186 THR A O   1 
ATOM   652  C  CB  . THR A 1 81  ? -4.94232  16.56640 -4.04886  1.000 8.29055  ? 186 THR A CB  1 
ATOM   653  O  OG1 . THR A 1 81  ? -3.95906  17.40978 -4.66553  1.000 8.49975  ? 186 THR A OG1 1 
ATOM   654  C  CG2 . THR A 1 81  ? -4.40005  15.14617 -3.91231  1.000 8.89999  ? 186 THR A CG2 1 
ATOM   655  N  N   . TYR A 1 82  ? -8.15824  16.45441 -3.44909  1.000 6.64453  ? 187 TYR A N   1 
ATOM   656  C  CA  . TYR A 1 82  ? -9.12898  15.78012 -2.58544  1.000 7.59248  ? 187 TYR A CA  1 
ATOM   657  C  C   . TYR A 1 82  ? -10.57173 15.93764 -3.04369  1.000 7.45889  ? 187 TYR A C   1 
ATOM   658  O  O   . TYR A 1 82  ? -11.47090 15.37754 -2.41098  1.000 7.63444  ? 187 TYR A O   1 
ATOM   659  C  CB  . TYR A 1 82  ? -8.93520  16.23841 -1.11664  1.000 8.48098  ? 187 TYR A CB  1 
ATOM   660  C  CG  . TYR A 1 82  ? -7.46953  16.23598 -0.78337  1.000 7.74716  ? 187 TYR A CG  1 
ATOM   661  C  CD1 . TYR A 1 82  ? -6.76280  15.02715 -0.62808  1.000 6.91535  ? 187 TYR A CD1 1 
ATOM   662  C  CD2 . TYR A 1 82  ? -6.76563  17.42875 -0.68695  1.000 8.41632  ? 187 TYR A CD2 1 
ATOM   663  C  CE1 . TYR A 1 82  ? -5.39049  15.02229 -0.39638  1.000 7.03472  ? 187 TYR A CE1 1 
ATOM   664  C  CE2 . TYR A 1 82  ? -5.42255  17.43691 -0.44052  1.000 8.53474  ? 187 TYR A CE2 1 
ATOM   665  C  CZ  . TYR A 1 82  ? -4.72642  16.24258 -0.29917  1.000 7.84230  ? 187 TYR A CZ  1 
ATOM   666  O  OH  . TYR A 1 82  ? -3.37504  16.23866 -0.09632  1.000 8.99245  ? 187 TYR A OH  1 
ATOM   667  N  N   . GLY A 1 83  ? -10.80801 16.71376 -4.08665  1.000 7.68034  ? 188 GLY A N   1 
ATOM   668  C  CA  . GLY A 1 83  ? -12.15743 17.04363 -4.50442  1.000 6.93735  ? 188 GLY A CA  1 
ATOM   669  C  C   . GLY A 1 83  ? -12.76124 16.15510 -5.58963  1.000 7.06402  ? 188 GLY A C   1 
ATOM   670  O  O   . GLY A 1 83  ? -12.09477 15.62623 -6.46513  1.000 7.27538  ? 188 GLY A O   1 
ATOM   671  N  N   . VAL A 1 84  ? -14.09280 16.04357 -5.51676  1.000 7.13728  ? 189 VAL A N   1 
ATOM   672  C  CA  . VAL A 1 84  ? -14.85903 15.33608 -6.54268  1.000 7.71399  ? 189 VAL A CA  1 
ATOM   673  C  C   . VAL A 1 84  ? -14.90775 16.15487 -7.82591  1.000 7.87358  ? 189 VAL A C   1 
ATOM   674  O  O   . VAL A 1 84  ? -14.79492 15.61659 -8.93270  1.000 7.73652  ? 189 VAL A O   1 
ATOM   675  C  CB  . VAL A 1 84  ? -16.27296 15.04084 -6.01586  1.000 8.18744  ? 189 VAL A CB  1 
ATOM   676  C  CG1 . VAL A 1 84  ? -17.13952 14.49047 -7.12556  1.000 8.31145  ? 189 VAL A CG1 1 
ATOM   677  C  CG2 . VAL A 1 84  ? -16.22952 14.08818 -4.83955  1.000 8.38641  ? 189 VAL A CG2 1 
ATOM   678  N  N   . ALA A 1 85  ? -15.21509 17.45401 -7.70172  1.000 7.44934  ? 190 ALA A N   1 
ATOM   679  C  CA  . ALA A 1 85  ? -15.43155 18.35803 -8.82573  1.000 8.00386  ? 190 ALA A CA  1 
ATOM   680  C  C   . ALA A 1 85  ? -14.29223 19.36876 -8.77928  1.000 7.62608  ? 190 ALA A C   1 
ATOM   681  O  O   . ALA A 1 85  ? -14.42341 20.46893 -8.25353  1.000 7.09802  ? 190 ALA A O   1 
ATOM   682  C  CB  . ALA A 1 85  ? -16.79377 19.01310 -8.66650  1.000 7.87600  ? 190 ALA A CB  1 
ATOM   683  N  N   . LYS A 1 86  ? -13.17110 18.97780 -9.36604  1.000 7.74925  ? 191 LYS A N   1 
ATOM   684  C  CA  . LYS A 1 86  ? -11.90049 19.67852 -9.19129  1.000 7.94837  ? 191 LYS A CA  1 
ATOM   685  C  C   . LYS A 1 86  ? -11.84364 21.02983 -9.90002  1.000 8.22474  ? 191 LYS A C   1 
ATOM   686  O  O   . LYS A 1 86  ? -10.86256 21.76104 -9.70919  1.000 8.29783  ? 191 LYS A O   1 
ATOM   687  C  CB  . LYS A 1 86  ? -10.77226 18.77162 -9.68489  1.000 8.02388  ? 191 LYS A CB  1 
ATOM   688  C  CG  . LYS A 1 86  ? -10.57171 17.53363 -8.84322  1.000 8.47881  ? 191 LYS A CG  1 
ATOM   689  C  CD  . LYS A 1 86  ? -9.55428  16.65060 -9.52941  1.000 8.88041  ? 191 LYS A CD  1 
ATOM   690  C  CE  . LYS A 1 86  ? -9.54205  15.25085 -8.89937  1.000 8.69735  ? 191 LYS A CE  1 
ATOM   691  N  NZ  . LYS A 1 86  ? -9.40174  15.22368 -7.41380  1.000 8.22992  ? 191 LYS A NZ  1 
ATOM   692  N  N   . LYS A 1 87  ? -12.83951 21.39521 -10.72018 1.000 8.43419  ? 192 LYS A N   1 
ATOM   693  C  CA  . LYS A 1 87  ? -12.84881 22.70789 -11.38273 1.000 8.32392  ? 192 LYS A CA  1 
ATOM   694  C  C   . LYS A 1 87  ? -14.07268 23.53436 -11.02557 1.000 8.10739  ? 192 LYS A C   1 
ATOM   695  O  O   . LYS A 1 87  ? -14.30219 24.58280 -11.64475 1.000 7.83714  ? 192 LYS A O   1 
ATOM   696  C  CB  . LYS A 1 87  ? -12.67999 22.60332 -12.90638 1.000 9.84126  ? 192 LYS A CB  1 
ATOM   697  C  CG  . LYS A 1 87  ? -11.33447 22.01223 -13.33929 1.000 12.17706 ? 192 LYS A CG  1 
ATOM   698  C  CD  . LYS A 1 87  ? -11.34979 21.65138 -14.83584 1.000 14.71353 ? 192 LYS A CD  1 
ATOM   699  C  CE  . LYS A 1 87  ? -10.07930 20.91982 -15.27524 1.000 16.89018 ? 192 LYS A CE  1 
ATOM   700  N  NZ  . LYS A 1 87  ? -9.99038  20.74345 -16.77939 1.000 17.67048 ? 192 LYS A NZ  1 
ATOM   701  N  N   . THR A 1 88  ? -14.84932 23.10564 -10.02959 1.000 7.44468  ? 193 THR A N   1 
ATOM   702  C  CA  . THR A 1 88  ? -15.96768 23.94528 -9.61119  1.000 7.67042  ? 193 THR A CA  1 
ATOM   703  C  C   . THR A 1 88  ? -15.48602 25.23443 -8.91635  1.000 8.02407  ? 193 THR A C   1 
ATOM   704  O  O   . THR A 1 88  ? -14.32879 25.38802 -8.53114  1.000 8.24722  ? 193 THR A O   1 
ATOM   705  C  CB  . THR A 1 88  ? -16.92876 23.17233 -8.70608  1.000 7.00133  ? 193 THR A CB  1 
ATOM   706  O  OG1 . THR A 1 88  ? -18.16597 23.89163 -8.61483  1.000 6.20425  ? 193 THR A OG1 1 
ATOM   707  C  CG2 . THR A 1 88  ? -16.34704 22.96956 -7.29691  1.000 8.01794  ? 193 THR A CG2 1 
ATOM   708  N  N   A GLN A 1 89  ? -16.39553 26.19876 -8.80857  0.528 8.16119  ? 194 GLN A N   1 
ATOM   709  N  N   B GLN A 1 89  ? -16.41585 26.17064 -8.75502  0.472 8.14189  ? 194 GLN A N   1 
ATOM   710  C  CA  A GLN A 1 89  ? -16.16926 27.37449 -7.97888  0.528 8.46643  ? 194 GLN A CA  1 
ATOM   711  C  CA  B GLN A 1 89  ? -16.19710 27.38981 -7.98698  0.472 8.45562  ? 194 GLN A CA  1 
ATOM   712  C  C   A GLN A 1 89  ? -16.78210 27.10954 -6.61033  0.528 8.13796  ? 194 GLN A C   1 
ATOM   713  C  C   B GLN A 1 89  ? -16.82454 27.20438 -6.61162  0.472 8.09632  ? 194 GLN A C   1 
ATOM   714  O  O   A GLN A 1 89  ? -17.90087 26.59770 -6.51055  0.528 8.41353  ? 194 GLN A O   1 
ATOM   715  O  O   B GLN A 1 89  ? -18.00063 26.84188 -6.51267  0.472 8.16791  ? 194 GLN A O   1 
ATOM   716  C  CB  A GLN A 1 89  ? -16.82563 28.61258 -8.59243  0.528 9.10359  ? 194 GLN A CB  1 
ATOM   717  C  CB  B GLN A 1 89  ? -16.85732 28.57120 -8.69615  0.472 9.23652  ? 194 GLN A CB  1 
ATOM   718  C  CG  A GLN A 1 89  ? -16.95102 29.78738 -7.61220  0.528 10.20709 ? 194 GLN A CG  1 
ATOM   719  C  CG  B GLN A 1 89  ? -16.06571 29.07602 -9.87755  0.472 10.37187 ? 194 GLN A CG  1 
ATOM   720  C  CD  A GLN A 1 89  ? -15.64544 30.54168 -7.38254  0.528 10.82690 ? 194 GLN A CD  1 
ATOM   721  C  CD  B GLN A 1 89  ? -14.90683 29.94945 -9.46111  0.472 11.37837 ? 194 GLN A CD  1 
ATOM   722  O  OE1 A GLN A 1 89  ? -14.88462 30.77465 -8.32067  0.528 11.76888 ? 194 GLN A OE1 1 
ATOM   723  O  OE1 B GLN A 1 89  ? -15.09072 30.96660 -8.78045  0.472 11.98968 ? 194 GLN A OE1 1 
ATOM   724  N  NE2 A GLN A 1 89  ? -15.38625 30.94813 -6.12899  0.528 10.26482 ? 194 GLN A NE2 1 
ATOM   725  N  NE2 B GLN A 1 89  ? -13.70509 29.57189 -9.87779  0.472 11.34251 ? 194 GLN A NE2 1 
ATOM   726  N  N   . LEU A 1 90  ? -16.05358 27.46707 -5.55575  1.000 7.82235  ? 195 LEU A N   1 
ATOM   727  C  CA  . LEU A 1 90  ? -16.50454 27.24282 -4.19129  1.000 7.94332  ? 195 LEU A CA  1 
ATOM   728  C  C   . LEU A 1 90  ? -16.79578 28.58658 -3.55039  1.000 7.19934  ? 195 LEU A C   1 
ATOM   729  O  O   . LEU A 1 90  ? -15.99570 29.52752 -3.68020  1.000 8.02266  ? 195 LEU A O   1 
ATOM   730  C  CB  . LEU A 1 90  ? -15.41125 26.54305 -3.37562  1.000 8.05626  ? 195 LEU A CB  1 
ATOM   731  C  CG  . LEU A 1 90  ? -15.06667 25.16318 -3.95366  1.000 8.81026  ? 195 LEU A CG  1 
ATOM   732  C  CD1 . LEU A 1 90  ? -13.69573 24.70225 -3.41608  1.000 10.49420 ? 195 LEU A CD1 1 
ATOM   733  C  CD2 . LEU A 1 90  ? -16.16274 24.14047 -3.58841  1.000 8.47371  ? 195 LEU A CD2 1 
ATOM   734  N  N   . PHE A 1 91  ? -17.92750 28.68329 -2.85280  1.000 7.48377  ? 196 PHE A N   1 
ATOM   735  C  CA  . PHE A 1 91  ? -18.28122 29.90689 -2.15860  1.000 8.06366  ? 196 PHE A CA  1 
ATOM   736  C  C   . PHE A 1 91  ? -18.51776 29.54396 -0.70752  1.000 8.61975  ? 196 PHE A C   1 
ATOM   737  O  O   . PHE A 1 91  ? -19.30840 28.64989 -0.40617  1.000 9.54778  ? 196 PHE A O   1 
ATOM   738  C  CB  . PHE A 1 91  ? -19.59293 30.47697 -2.68754  1.000 8.90305  ? 196 PHE A CB  1 
ATOM   739  C  CG  . PHE A 1 91  ? -19.54140 30.96048 -4.10896  1.000 10.21006 ? 196 PHE A CG  1 
ATOM   740  C  CD1 . PHE A 1 91  ? -18.56526 31.86555 -4.52225  1.000 10.84788 ? 196 PHE A CD1 1 
ATOM   741  C  CD2 . PHE A 1 91  ? -20.50888 30.55500 -5.02649  1.000 11.06701 ? 196 PHE A CD2 1 
ATOM   742  C  CE1 . PHE A 1 91  ? -18.54551 32.33869 -5.82003  1.000 11.46688 ? 196 PHE A CE1 1 
ATOM   743  C  CE2 . PHE A 1 91  ? -20.49678 31.03019 -6.32028  1.000 11.79537 ? 196 PHE A CE2 1 
ATOM   744  C  CZ  . PHE A 1 91  ? -19.49535 31.90506 -6.72826  1.000 12.12289 ? 196 PHE A CZ  1 
ATOM   745  N  N   . GLY A 1 92  ? -17.82345 30.21442 0.20996   1.000 7.71379  ? 197 GLY A N   1 
ATOM   746  C  CA  . GLY A 1 92  ? -17.95728 29.90771 1.60903   1.000 7.44658  ? 197 GLY A CA  1 
ATOM   747  C  C   . GLY A 1 92  ? -18.96365 30.82445 2.27921   1.000 6.77062  ? 197 GLY A C   1 
ATOM   748  O  O   . GLY A 1 92  ? -18.92459 32.04560 2.10485   1.000 6.81587  ? 197 GLY A O   1 
ATOM   749  N  N   . VAL A 1 93  ? -19.82679 30.20862 3.09593   1.000 6.81869  ? 198 VAL A N   1 
ATOM   750  C  CA  . VAL A 1 93  ? -20.80949 30.88799 3.91966   1.000 7.44678  ? 198 VAL A CA  1 
ATOM   751  C  C   . VAL A 1 93  ? -20.61335 30.41749 5.34488   1.000 7.80006  ? 198 VAL A C   1 
ATOM   752  O  O   . VAL A 1 93  ? -20.90427 29.26193 5.66480   1.000 7.67094  ? 198 VAL A O   1 
ATOM   753  C  CB  . VAL A 1 93  ? -22.23983 30.60856 3.45665   1.000 7.95284  ? 198 VAL A CB  1 
ATOM   754  C  CG1 . VAL A 1 93  ? -23.24111 31.34939 4.35550   1.000 8.51317  ? 198 VAL A CG1 1 
ATOM   755  C  CG2 . VAL A 1 93  ? -22.39585 31.01392 2.00578   1.000 8.20466  ? 198 VAL A CG2 1 
ATOM   756  N  N   . LYS A 1 94  ? -20.09235 31.29362 6.19428   1.000 7.68947  ? 199 LYS A N   1 
ATOM   757  C  CA  . LYS A 1 94  ? -19.68703 30.87195 7.51770   1.000 7.33017  ? 199 LYS A CA  1 
ATOM   758  C  C   . LYS A 1 94  ? -20.86236 31.04528 8.47378   1.000 7.80763  ? 199 LYS A C   1 
ATOM   759  O  O   . LYS A 1 94  ? -21.08549 32.12303 9.04692   1.000 8.53901  ? 199 LYS A O   1 
ATOM   760  C  CB  . LYS A 1 94  ? -18.44966 31.62422 7.97086   1.000 6.71978  ? 199 LYS A CB  1 
ATOM   761  C  CG  . LYS A 1 94  ? -18.03973 31.29432 9.37951   1.000 6.80787  ? 199 LYS A CG  1 
ATOM   762  C  CD  . LYS A 1 94  ? -16.73710 31.99355 9.74133   1.000 7.22871  ? 199 LYS A CD  1 
ATOM   763  C  CE  . LYS A 1 94  ? -16.27301 31.69812 11.20178  1.000 7.44820  ? 199 LYS A CE  1 
ATOM   764  N  NZ  . LYS A 1 94  ? -16.15341 30.23129 11.53153  1.000 7.75609  ? 199 LYS A NZ  1 
ATOM   765  N  N   . VAL A 1 95  ? -21.63557 29.96537 8.63139   1.000 7.27897  ? 200 VAL A N   1 
ATOM   766  C  CA  . VAL A 1 95  ? -22.72700 29.93663 9.59557   1.000 6.58782  ? 200 VAL A CA  1 
ATOM   767  C  C   . VAL A 1 95  ? -22.33468 29.28753 10.89865  1.000 6.24119  ? 200 VAL A C   1 
ATOM   768  O  O   . VAL A 1 95  ? -23.11090 29.36953 11.86086  1.000 5.86070  ? 200 VAL A O   1 
ATOM   769  C  CB  . VAL A 1 95  ? -23.98939 29.22247 9.07798   1.000 7.05400  ? 200 VAL A CB  1 
ATOM   770  C  CG1 . VAL A 1 95  ? -24.52475 29.91228 7.87207   1.000 7.50048  ? 200 VAL A CG1 1 
ATOM   771  C  CG2 . VAL A 1 95  ? -23.72570 27.68555 8.83801   1.000 6.89051  ? 200 VAL A CG2 1 
ATOM   772  N  N   . LEU A 1 96  ? -21.21606 28.57272 10.93934  1.000 7.10277  ? 201 LEU A N   1 
ATOM   773  C  CA  . LEU A 1 96  ? -20.76963 27.88411 12.14377  1.000 7.11492  ? 201 LEU A CA  1 
ATOM   774  C  C   . LEU A 1 96  ? -19.56925 28.64417 12.66093  1.000 7.09663  ? 201 LEU A C   1 
ATOM   775  O  O   . LEU A 1 96  ? -18.72206 29.09749 11.87747  1.000 6.95104  ? 201 LEU A O   1 
ATOM   776  C  CB  . LEU A 1 96  ? -20.31741 26.44194 11.87060  1.000 7.49493  ? 201 LEU A CB  1 
ATOM   777  C  CG  . LEU A 1 96  ? -21.39562 25.57373 11.19716  1.000 8.19918  ? 201 LEU A CG  1 
ATOM   778  C  CD1 . LEU A 1 96  ? -20.78948 24.17582 10.95293  1.000 8.53669  ? 201 LEU A CD1 1 
ATOM   779  C  CD2 . LEU A 1 96  ? -22.72034 25.45766 11.99728  1.000 8.96830  ? 201 LEU A CD2 1 
ATOM   780  N  N   . ASP A 1 97  ? -19.48963 28.74878 13.97348  1.000 7.82952  ? 202 ASP A N   1 
ATOM   781  C  CA  . ASP A 1 97  ? -18.36674 29.39598 14.62394  1.000 8.19865  ? 202 ASP A CA  1 
ATOM   782  C  C   . ASP A 1 97  ? -17.09181 28.54789 14.53745  1.000 8.49946  ? 202 ASP A C   1 
ATOM   783  O  O   . ASP A 1 97  ? -17.05806 27.46348 13.93776  1.000 7.88257  ? 202 ASP A O   1 
ATOM   784  C  CB  . ASP A 1 97  ? -18.75508 29.81912 16.04560  1.000 9.52028  ? 202 ASP A CB  1 
ATOM   785  C  CG  . ASP A 1 97  ? -18.92134 28.65128 17.00156  1.000 10.24030 ? 202 ASP A CG  1 
ATOM   786  O  OD1 . ASP A 1 97  ? -18.38316 27.53493 16.83721  1.000 9.84209  ? 202 ASP A OD1 1 
ATOM   787  O  OD2 . ASP A 1 97  ? -19.61024 28.89029 18.00152  1.000 11.21397 ? 202 ASP A OD2 1 
ATOM   788  N  N   . ASP A 1 98  ? -16.03130 29.04807 15.15579  1.000 9.08370  ? 203 ASP A N   1 
ATOM   789  C  CA  . ASP A 1 98  ? -14.75387 28.33960 15.03330  1.000 9.51158  ? 203 ASP A CA  1 
ATOM   790  C  C   . ASP A 1 98  ? -14.66721 27.09645 15.92723  1.000 10.45447 ? 203 ASP A C   1 
ATOM   791  O  O   . ASP A 1 98  ? -13.67943 26.36656 15.84025  1.000 10.53257 ? 203 ASP A O   1 
ATOM   792  C  CB  . ASP A 1 98  ? -13.56601 29.27594 15.25678  1.000 9.33093  ? 203 ASP A CB  1 
ATOM   793  C  CG  . ASP A 1 98  ? -13.40281 30.24682 14.11029  1.000 9.18639  ? 203 ASP A CG  1 
ATOM   794  O  OD1 . ASP A 1 98  ? -13.86310 29.91390 13.00948  1.000 9.18915  ? 203 ASP A OD1 1 
ATOM   795  O  OD2 . ASP A 1 98  ? -12.78752 31.31440 14.27740  1.000 10.18670 ? 203 ASP A OD2 1 
ATOM   796  N  N   . ASN A 1 99  ? -15.67368 26.83788 16.75797  1.000 11.79458 ? 204 ASN A N   1 
ATOM   797  C  CA  . ASN A 1 99  ? -15.83488 25.55021 17.42587  1.000 12.71705 ? 204 ASN A CA  1 
ATOM   798  C  C   . ASN A 1 99  ? -16.66845 24.56634 16.63166  1.000 11.86036 ? 204 ASN A C   1 
ATOM   799  O  O   . ASN A 1 99  ? -16.91642 23.46151 17.12920  1.000 12.17121 ? 204 ASN A O   1 
ATOM   800  C  CB  . ASN A 1 99  ? -16.45830 25.75639 18.80662  1.000 15.06971 ? 204 ASN A CB  1 
ATOM   801  C  CG  . ASN A 1 99  ? -15.55024 26.53951 19.71334  1.000 17.04249 ? 204 ASN A CG  1 
ATOM   802  O  OD1 . ASN A 1 99  ? -14.33753 26.32300 19.70459  1.000 17.51103 ? 204 ASN A OD1 1 
ATOM   803  N  ND2 . ASN A 1 99  ? -16.11097 27.47803 20.48371  1.000 17.88923 ? 204 ASN A ND2 1 
ATOM   804  N  N   . GLY A 1 100 ? -17.16482 24.95917 15.46433  1.000 11.34023 ? 205 GLY A N   1 
ATOM   805  C  CA  . GLY A 1 100 ? -18.02612 24.09457 14.67762  1.000 11.32373 ? 205 GLY A CA  1 
ATOM   806  C  C   . GLY A 1 100 ? -19.48399 24.16530 15.02952  1.000 12.20039 ? 205 GLY A C   1 
ATOM   807  O  O   . GLY A 1 100 ? -20.24800 23.35801 14.51071  1.000 12.72497 ? 205 GLY A O   1 
ATOM   808  N  N   . SER A 1 101 ? -19.89878 25.09111 15.89811  1.000 13.22180 ? 206 SER A N   1 
ATOM   809  C  CA  . SER A 1 101 ? -21.27751 25.15843 16.36325  1.000 14.30436 ? 206 SER A CA  1 
ATOM   810  C  C   . SER A 1 101 ? -21.99979 26.34601 15.74344  1.000 13.87895 ? 206 SER A C   1 
ATOM   811  O  O   . SER A 1 101 ? -21.37456 27.31630 15.32791  1.000 13.93086 ? 206 SER A O   1 
ATOM   812  C  CB  . SER A 1 101 ? -21.32559 25.33456 17.87883  1.000 15.58175 ? 206 SER A CB  1 
ATOM   813  O  OG  . SER A 1 101 ? -20.51005 24.37220 18.54177  1.000 16.14747 ? 206 SER A OG  1 
ATOM   814  N  N   . GLY A 1 102 ? -23.33160 26.28854 15.68541  1.000 14.02765 ? 207 GLY A N   1 
ATOM   815  C  CA  . GLY A 1 102 ? -24.02429 27.45236 15.15403  1.000 14.08743 ? 207 GLY A CA  1 
ATOM   816  C  C   . GLY A 1 102 ? -25.49758 27.42172 15.48953  1.000 15.03034 ? 207 GLY A C   1 
ATOM   817  O  O   . GLY A 1 102 ? -26.10358 26.35880 15.54054  1.000 15.16686 ? 207 GLY A O   1 
ATOM   818  N  N   A GLN A 1 103 ? -26.07132 28.59460 15.69032  0.529 16.07618 ? 208 GLN A N   1 
ATOM   819  N  N   B GLN A 1 103 ? -26.08114 28.58292 15.75591  0.471 16.08035 ? 208 GLN A N   1 
ATOM   820  C  CA  A GLN A 1 103 ? -27.47499 28.70531 16.05438  0.529 16.71067 ? 208 GLN A CA  1 
ATOM   821  C  CA  B GLN A 1 103 ? -27.49501 28.62877 16.09028  0.471 16.77180 ? 208 GLN A CA  1 
ATOM   822  C  C   A GLN A 1 103 ? -28.34319 28.44457 14.83084  0.529 15.33092 ? 208 GLN A C   1 
ATOM   823  C  C   B GLN A 1 103 ? -28.33052 28.40722 14.84262  0.471 15.34270 ? 208 GLN A C   1 
ATOM   824  O  O   A GLN A 1 103 ? -28.00231 28.85435 13.72174  0.529 15.45117 ? 208 GLN A O   1 
ATOM   825  O  O   B GLN A 1 103 ? -27.96812 28.82170 13.74243  0.471 15.44922 ? 208 GLN A O   1 
ATOM   826  C  CB  A GLN A 1 103 ? -27.71022 30.13262 16.54920  0.529 18.88414 ? 208 GLN A CB  1 
ATOM   827  C  CB  B GLN A 1 103 ? -27.88514 29.99083 16.67406  0.471 19.06678 ? 208 GLN A CB  1 
ATOM   828  C  CG  A GLN A 1 103 ? -28.98699 30.39727 17.27809  0.529 21.58325 ? 208 GLN A CG  1 
ATOM   829  C  CG  B GLN A 1 103 ? -27.08385 30.45590 17.86440  0.471 21.68971 ? 208 GLN A CG  1 
ATOM   830  C  CD  A GLN A 1 103 ? -29.04770 31.84565 17.72476  0.529 23.85163 ? 208 GLN A CD  1 
ATOM   831  C  CD  B GLN A 1 103 ? -26.99906 29.42766 18.97624  0.471 23.96484 ? 208 GLN A CD  1 
ATOM   832  O  OE1 A GLN A 1 103 ? -28.02258 32.51900 17.77731  0.529 26.43306 ? 208 GLN A OE1 1 
ATOM   833  O  OE1 B GLN A 1 103 ? -27.98787 28.78935 19.33579  0.471 26.43306 ? 208 GLN A OE1 1 
ATOM   834  N  NE2 A GLN A 1 103 ? -30.24713 32.33504 18.02004  0.529 24.92308 ? 208 GLN A NE2 1 
ATOM   835  N  NE2 B GLN A 1 103 ? -25.80168 29.26947 19.53327  0.471 24.92308 ? 208 GLN A NE2 1 
ATOM   836  N  N   . TYR A 1 104 ? -29.48248 27.77793 15.04193  1.000 14.07601 ? 209 TYR A N   1 
ATOM   837  C  CA  . TYR A 1 104 ? -30.37785 27.49281 13.93254  1.000 11.84617 ? 209 TYR A CA  1 
ATOM   838  C  C   . TYR A 1 104 ? -30.78723 28.76451 13.19655  1.000 10.97114 ? 209 TYR A C   1 
ATOM   839  O  O   . TYR A 1 104 ? -30.87355 28.76475 11.96932  1.000 10.38120 ? 209 TYR A O   1 
ATOM   840  C  CB  . TYR A 1 104 ? -31.58453 26.72806 14.45545  1.000 11.52608 ? 209 TYR A CB  1 
ATOM   841  C  CG  . TYR A 1 104 ? -31.41196 25.20841 14.44267  1.000 12.74723 ? 209 TYR A CG  1 
ATOM   842  C  CD1 . TYR A 1 104 ? -30.33625 24.57946 13.76801  1.000 13.47860 ? 209 TYR A CD1 1 
ATOM   843  C  CD2 . TYR A 1 104 ? -32.36141 24.40471 15.05348  1.000 12.91667 ? 209 TYR A CD2 1 
ATOM   844  C  CE1 . TYR A 1 104 ? -30.21504 23.17169 13.71980  1.000 13.80232 ? 209 TYR A CE1 1 
ATOM   845  C  CE2 . TYR A 1 104 ? -32.25181 23.01160 15.01872  1.000 13.47746 ? 209 TYR A CE2 1 
ATOM   846  C  CZ  . TYR A 1 104 ? -31.19071 22.40958 14.35626  1.000 13.76813 ? 209 TYR A CZ  1 
ATOM   847  O  OH  . TYR A 1 104 ? -31.15038 21.05181 14.33493  1.000 13.89945 ? 209 TYR A OH  1 
ATOM   848  N  N   . SER A 1 105 ? -31.02285 29.86005 13.91230  1.000 10.76895 ? 210 SER A N   1 
ATOM   849  C  CA  . SER A 1 105 ? -31.43433 31.07542 13.20888  1.000 10.77380 ? 210 SER A CA  1 
ATOM   850  C  C   . SER A 1 105 ? -30.33837 31.54858 12.25657  1.000 10.15790 ? 210 SER A C   1 
ATOM   851  O  O   . SER A 1 105 ? -30.62904 32.09372 11.18544  1.000 9.95739  ? 210 SER A O   1 
ATOM   852  C  CB  . SER A 1 105 ? -31.78803 32.16779 14.21386  1.000 11.34768 ? 210 SER A CB  1 
ATOM   853  O  OG  . SER A 1 105 ? -30.65148 32.48756 14.98117  1.000 12.36208 ? 210 SER A OG  1 
ATOM   854  N  N   . THR A 1 106 ? -29.06812 31.36535 12.64355  1.000 9.71419  ? 211 THR A N   1 
ATOM   855  C  CA  . THR A 1 106 ? -27.97501 31.76197 11.76864  1.000 9.07113  ? 211 THR A CA  1 
ATOM   856  C  C   . THR A 1 106 ? -27.84995 30.79611 10.60474  1.000 8.50283  ? 211 THR A C   1 
ATOM   857  O  O   . THR A 1 106 ? -27.57438 31.20724 9.46499   1.000 8.39823  ? 211 THR A O   1 
ATOM   858  C  CB  . THR A 1 106 ? -26.67272 31.79597 12.55982  1.000 9.60959  ? 211 THR A CB  1 
ATOM   859  O  OG1 . THR A 1 106 ? -26.78169 32.75165 13.62896  1.000 11.16552 ? 211 THR A OG1 1 
ATOM   860  C  CG2 . THR A 1 106 ? -25.50147 32.15542 11.63060  1.000 9.55493  ? 211 THR A CG2 1 
ATOM   861  N  N   . ILE A 1 107 ? -28.00760 29.49807 10.87431  1.000 7.36478  ? 212 ILE A N   1 
ATOM   862  C  CA  . ILE A 1 107 ? -27.99215 28.52261 9.78927   1.000 7.73812  ? 212 ILE A CA  1 
ATOM   863  C  C   . ILE A 1 107 ? -29.09192 28.83281 8.78010   1.000 7.91026  ? 212 ILE A C   1 
ATOM   864  O  O   . ILE A 1 107 ? -28.86835 28.80204 7.56542   1.000 8.10815  ? 212 ILE A O   1 
ATOM   865  C  CB  . ILE A 1 107 ? -28.05224 27.09457 10.35633  1.000 7.82834  ? 212 ILE A CB  1 
ATOM   866  C  CG1 . ILE A 1 107 ? -26.74181 26.83132 11.09369  1.000 8.32367  ? 212 ILE A CG1 1 
ATOM   867  C  CG2 . ILE A 1 107 ? -28.28942 26.10135 9.31278   1.000 9.03300  ? 212 ILE A CG2 1 
ATOM   868  C  CD1 . ILE A 1 107 ? -26.78597 25.61170 11.96642  1.000 8.85293  ? 212 ILE A CD1 1 
ATOM   869  N  N   . ILE A 1 108 ? -30.30705 29.10282 9.26114   1.000 7.41135  ? 213 ILE A N   1 
ATOM   870  C  CA  . ILE A 1 108 ? -31.38650 29.45639 8.35071   1.000 7.38683  ? 213 ILE A CA  1 
ATOM   871  C  C   . ILE A 1 108 ? -31.02756 30.69640 7.54254   1.000 7.31983  ? 213 ILE A C   1 
ATOM   872  O  O   . ILE A 1 108 ? -31.26881 30.75952 6.33660   1.000 7.37885  ? 213 ILE A O   1 
ATOM   873  C  CB  . ILE A 1 108 ? -32.67590 29.66691 9.15675   1.000 6.89919  ? 213 ILE A CB  1 
ATOM   874  C  CG1 . ILE A 1 108 ? -33.13028 28.31450 9.74004   1.000 7.74855  ? 213 ILE A CG1 1 
ATOM   875  C  CG2 . ILE A 1 108 ? -33.73193 30.32394 8.24852   1.000 8.02851  ? 213 ILE A CG2 1 
ATOM   876  C  CD1 . ILE A 1 108 ? -34.21956 28.40416 10.77110  1.000 8.02854  ? 213 ILE A CD1 1 
ATOM   877  N  N   . ALA A 1 109 ? -30.51025 31.72990 8.21069   1.000 6.97473  ? 214 ALA A N   1 
ATOM   878  C  CA  . ALA A 1 109 ? -30.13853 32.93390 7.47475   1.000 7.29444  ? 214 ALA A CA  1 
ATOM   879  C  C   . ALA A 1 109 ? -29.14765 32.61686 6.36245   1.000 7.39046  ? 214 ALA A C   1 
ATOM   880  O  O   . ALA A 1 109 ? -29.24935 33.16600 5.26173   1.000 7.61626  ? 214 ALA A O   1 
ATOM   881  C  CB  . ALA A 1 109 ? -29.59090 34.00051 8.43228   1.000 7.71503  ? 214 ALA A CB  1 
ATOM   882  N  N   . GLY A 1 110 ? -28.19555 31.72146 6.62395   1.000 7.26802  ? 215 GLY A N   1 
ATOM   883  C  CA  . GLY A 1 110 ? -27.19466 31.42067 5.61380   1.000 7.54430  ? 215 GLY A CA  1 
ATOM   884  C  C   . GLY A 1 110 ? -27.80901 30.70218 4.42770   1.000 7.98742  ? 215 GLY A C   1 
ATOM   885  O  O   . GLY A 1 110 ? -27.42672 30.94864 3.27169   1.000 8.79228  ? 215 GLY A O   1 
ATOM   886  N  N   . MET A 1 111 ? -28.79254 29.82394 4.68657   1.000 7.53020  ? 216 MET A N   1 
ATOM   887  C  CA  . MET A 1 111 ? -29.52329 29.20132 3.57845   1.000 7.54454  ? 216 MET A CA  1 
ATOM   888  C  C   . MET A 1 111 ? -30.27788 30.24486 2.76556   1.000 7.43069  ? 216 MET A C   1 
ATOM   889  O  O   . MET A 1 111 ? -30.19743 30.26787 1.53899   1.000 8.25385  ? 216 MET A O   1 
ATOM   890  C  CB  . MET A 1 111 ? -30.47653 28.11499 4.08522   1.000 8.08365  ? 216 MET A CB  1 
ATOM   891  C  CG  . MET A 1 111 ? -29.71763 26.94714 4.72643   1.000 8.39726  ? 216 MET A CG  1 
ATOM   892  S  SD  . MET A 1 111 ? -30.91021 25.61237 4.95520   1.000 9.49878  ? 216 MET A SD  1 
ATOM   893  C  CE  . MET A 1 111 ? -30.81021 25.36751 6.68751   1.000 10.48156 ? 216 MET A CE  1 
ATOM   894  N  N   . ASP A 1 112 ? -30.99692 31.14735 3.43540   1.000 7.78352  ? 217 ASP A N   1 
ATOM   895  C  CA  . ASP A 1 112 ? -31.71002 32.17979 2.68624   1.000 8.37749  ? 217 ASP A CA  1 
ATOM   896  C  C   . ASP A 1 112 ? -30.72628 33.04661 1.92630   1.000 8.01822  ? 217 ASP A C   1 
ATOM   897  O  O   . ASP A 1 112 ? -30.99794 33.47337 0.80137   1.000 8.02824  ? 217 ASP A O   1 
ATOM   898  C  CB  . ASP A 1 112 ? -32.51029 33.06259 3.64429   1.000 10.12783 ? 217 ASP A CB  1 
ATOM   899  C  CG  . ASP A 1 112 ? -33.63105 32.33901 4.28096   1.000 11.65346 ? 217 ASP A CG  1 
ATOM   900  O  OD1 . ASP A 1 112 ? -34.14969 31.41290 3.66069   1.000 11.98588 ? 217 ASP A OD1 1 
ATOM   901  O  OD2 . ASP A 1 112 ? -34.01973 32.76320 5.37218   1.000 12.33687 ? 217 ASP A OD2 1 
ATOM   902  N  N   . PHE A 1 113 ? -29.56486 33.31898 2.54299   1.000 7.94688  ? 218 PHE A N   1 
ATOM   903  C  CA  . PHE A 1 113 ? -28.55031 34.11376 1.85889   1.000 8.44579  ? 218 PHE A CA  1 
ATOM   904  C  C   . PHE A 1 113 ? -28.12809 33.46546 0.54691   1.000 7.93317  ? 218 PHE A C   1 
ATOM   905  O  O   . PHE A 1 113 ? -28.07020 34.12640 -0.48979  1.000 7.45686  ? 218 PHE A O   1 
ATOM   906  C  CB  . PHE A 1 113 ? -27.33124 34.33955 2.76613   1.000 9.48133  ? 218 PHE A CB  1 
ATOM   907  C  CG  . PHE A 1 113 ? -26.14142 34.92264 1.99627   1.000 10.56808 ? 218 PHE A CG  1 
ATOM   908  C  CD1 . PHE A 1 113 ? -25.96890 36.30661 1.88673   1.000 11.83269 ? 218 PHE A CD1 1 
ATOM   909  C  CD2 . PHE A 1 113 ? -25.23480 34.08800 1.31381   1.000 11.81083 ? 218 PHE A CD2 1 
ATOM   910  C  CE1 . PHE A 1 113 ? -24.89035 36.84900 1.13029   1.000 12.56171 ? 218 PHE A CE1 1 
ATOM   911  C  CE2 . PHE A 1 113 ? -24.21314 34.60975 0.53442   1.000 12.91468 ? 218 PHE A CE2 1 
ATOM   912  C  CZ  . PHE A 1 113 ? -24.01231 35.98638 0.45909   1.000 13.07083 ? 218 PHE A CZ  1 
ATOM   913  N  N   . VAL A 1 114 ? -27.82480 32.16469 0.57847   1.000 8.02933  ? 219 VAL A N   1 
ATOM   914  C  CA  . VAL A 1 114 ? -27.42783 31.46582 -0.64022  1.000 7.94826  ? 219 VAL A CA  1 
ATOM   915  C  C   . VAL A 1 114 ? -28.51982 31.52732 -1.69652  1.000 7.22670  ? 219 VAL A C   1 
ATOM   916  O  O   . VAL A 1 114 ? -28.22996 31.74126 -2.88428  1.000 6.70447  ? 219 VAL A O   1 
ATOM   917  C  CB  . VAL A 1 114 ? -27.03908 30.00246 -0.35634  1.000 8.58135  ? 219 VAL A CB  1 
ATOM   918  C  CG1 . VAL A 1 114 ? -26.82822 29.24515 -1.69405  1.000 8.71292  ? 219 VAL A CG1 1 
ATOM   919  C  CG2 . VAL A 1 114 ? -25.78225 29.91522 0.48473   1.000 8.10884  ? 219 VAL A CG2 1 
ATOM   920  N  N   . ALA A 1 115 ? -29.79484 31.35021 -1.29298  1.000 7.38977  ? 220 ALA A N   1 
ATOM   921  C  CA  . ALA A 1 115 ? -30.88388 31.39260 -2.26475  1.000 7.21024  ? 220 ALA A CA  1 
ATOM   922  C  C   . ALA A 1 115 ? -30.92634 32.71669 -2.98412  1.000 7.88966  ? 220 ALA A C   1 
ATOM   923  O  O   . ALA A 1 115 ? -31.25491 32.77019 -4.17582  1.000 8.65990  ? 220 ALA A O   1 
ATOM   924  C  CB  . ALA A 1 115 ? -32.22443 31.11108 -1.59760  1.000 6.76461  ? 220 ALA A CB  1 
ATOM   925  N  N   . SER A 1 116 ? -30.58371 33.79416 -2.30483  1.000 8.18448  ? 221 SER A N   1 
ATOM   926  C  CA  . SER A 1 116 ? -30.57074 35.08916 -2.97534  1.000 8.23939  ? 221 SER A CA  1 
ATOM   927  C  C   . SER A 1 116 ? -29.24013 35.36464 -3.68849  1.000 8.10128  ? 221 SER A C   1 
ATOM   928  O  O   . SER A 1 116 ? -29.22307 35.84883 -4.82670  1.000 8.23029  ? 221 SER A O   1 
ATOM   929  C  CB  . SER A 1 116 ? -30.79234 36.18479 -1.94263  1.000 8.57628  ? 221 SER A CB  1 
ATOM   930  O  OG  . SER A 1 116 ? -30.72483 37.46801 -2.53601  1.000 8.22052  ? 221 SER A OG  1 
ATOM   931  N  N   . ASP A 1 117 ? -28.11565 35.08212 -3.02804  1.000 7.63846  ? 222 ASP A N   1 
ATOM   932  C  CA  . ASP A 1 117 ? -26.81922 35.44883 -3.55516  1.000 8.07247  ? 222 ASP A CA  1 
ATOM   933  C  C   . ASP A 1 117 ? -26.53020 34.77945 -4.87918  1.000 9.52868  ? 222 ASP A C   1 
ATOM   934  O  O   . ASP A 1 117 ? -25.77027 35.32179 -5.68206  1.000 9.91500  ? 222 ASP A O   1 
ATOM   935  C  CB  . ASP A 1 117 ? -25.74231 35.06345 -2.52502  1.000 7.84745  ? 222 ASP A CB  1 
ATOM   936  C  CG  . ASP A 1 117 ? -24.33295 35.44822 -2.95084  1.000 8.75439  ? 222 ASP A CG  1 
ATOM   937  O  OD1 . ASP A 1 117 ? -24.01074 36.66218 -2.94027  1.000 9.69580  ? 222 ASP A OD1 1 
ATOM   938  O  OD2 . ASP A 1 117 ? -23.55808 34.54801 -3.29421  1.000 8.77327  ? 222 ASP A OD2 1 
ATOM   939  N  N   . LYS A 1 118 ? -27.05931 33.56523 -5.10011  1.000 9.83345  ? 223 LYS A N   1 
ATOM   940  C  CA  . LYS A 1 118 ? -26.73720 32.87111 -6.33220  1.000 11.83490 ? 223 LYS A CA  1 
ATOM   941  C  C   . LYS A 1 118 ? -27.19802 33.68112 -7.54802  1.000 13.59846 ? 223 LYS A C   1 
ATOM   942  O  O   . LYS A 1 118 ? -26.60137 33.58719 -8.62363  1.000 14.03316 ? 223 LYS A O   1 
ATOM   943  C  CB  . LYS A 1 118 ? -27.37363 31.47907 -6.30600  1.000 12.56580 ? 223 LYS A CB  1 
ATOM   944  C  CG  . LYS A 1 118 ? -28.89471 31.56898 -6.41947  1.000 13.64884 ? 223 LYS A CG  1 
ATOM   945  C  CD  . LYS A 1 118 ? -29.46167 30.22402 -6.68822  1.000 13.97686 ? 223 LYS A CD  1 
ATOM   946  C  CE  . LYS A 1 118 ? -30.92898 30.24984 -7.07613  1.000 13.56821 ? 223 LYS A CE  1 
ATOM   947  N  NZ  . LYS A 1 118 ? -31.71740 31.02526 -6.13411  1.000 14.35256 ? 223 LYS A NZ  1 
ATOM   948  N  N   . ASN A 1 119 ? -28.19938 34.54727 -7.36552  1.000 15.26113 ? 224 ASN A N   1 
ATOM   949  C  CA  . ASN A 1 119 ? -28.70857 35.35729 -8.46622  1.000 17.58867 ? 224 ASN A CA  1 
ATOM   950  C  C   . ASN A 1 119 ? -27.71567 36.42670 -8.90346  1.000 18.49818 ? 224 ASN A C   1 
ATOM   951  O  O   . ASN A 1 119 ? -27.94588 37.07854 -9.92907  1.000 19.23430 ? 224 ASN A O   1 
ATOM   952  C  CB  . ASN A 1 119 ? -30.06819 35.97390 -8.07794  1.000 18.02287 ? 224 ASN A CB  1 
ATOM   953  C  CG  . ASN A 1 119 ? -31.11309 34.91613 -7.68312  1.000 18.56473 ? 224 ASN A CG  1 
ATOM   954  O  OD1 . ASN A 1 119 ? -31.24244 33.86495 -8.33641  1.000 19.03338 ? 224 ASN A OD1 1 
ATOM   955  N  ND2 . ASN A 1 119 ? -31.79253 35.14391 -6.55964  1.000 18.01326 ? 224 ASN A ND2 1 
ATOM   956  N  N   . ASN A 1 120 ? -26.64792 36.65536 -8.14061  1.000 18.95651 ? 225 ASN A N   1 
ATOM   957  C  CA  . ASN A 1 120 ? -25.61530 37.62355 -8.49785  1.000 19.92519 ? 225 ASN A CA  1 
ATOM   958  C  C   . ASN A 1 120 ? -24.35592 36.95782 -9.05330  1.000 18.40576 ? 225 ASN A C   1 
ATOM   959  O  O   . ASN A 1 120 ? -23.38145 37.65992 -9.33588  1.000 18.89988 ? 225 ASN A O   1 
ATOM   960  C  CB  . ASN A 1 120 ? -25.19578 38.49405 -7.28996  1.000 21.60392 ? 225 ASN A CB  1 
ATOM   961  C  CG  . ASN A 1 120 ? -26.33357 38.82727 -6.34832  1.000 23.66521 ? 225 ASN A CG  1 
ATOM   962  O  OD1 . ASN A 1 120 ? -27.48802 39.02495 -6.75454  1.000 24.59940 ? 225 ASN A OD1 1 
ATOM   963  N  ND2 . ASN A 1 120 ? -26.00891 38.87190 -5.05786  1.000 24.21355 ? 225 ASN A ND2 1 
ATOM   964  N  N   . ARG A 1 121 ? -24.33337 35.63079 -9.19603  1.000 17.18184 ? 226 ARG A N   1 
ATOM   965  C  CA  . ARG A 1 121 ? -23.12218 34.91012 -9.57192  1.000 16.55685 ? 226 ARG A CA  1 
ATOM   966  C  C   . ARG A 1 121 ? -23.32804 34.28500 -10.93884 1.000 15.94954 ? 226 ARG A C   1 
ATOM   967  O  O   . ARG A 1 121 ? -24.43899 33.91404 -11.30758 1.000 16.31662 ? 226 ARG A O   1 
ATOM   968  C  CB  . ARG A 1 121 ? -22.81482 33.77477 -8.57655  1.000 16.49536 ? 226 ARG A CB  1 
ATOM   969  C  CG  . ARG A 1 121 ? -22.80404 34.12345 -7.08325  1.000 16.63309 ? 226 ARG A CG  1 
ATOM   970  C  CD  . ARG A 1 121 ? -21.55008 34.86970 -6.68924  1.000 16.88786 ? 226 ARG A CD  1 
ATOM   971  N  NE  . ARG A 1 121 ? -21.66730 35.42729 -5.35116  1.000 16.51864 ? 226 ARG A NE  1 
ATOM   972  C  CZ  . ARG A 1 121 ? -20.81011 36.29519 -4.84135  1.000 16.18475 ? 226 ARG A CZ  1 
ATOM   973  N  NH1 . ARG A 1 121 ? -19.71815 36.64560 -5.50109  1.000 16.22836 ? 226 ARG A NH1 1 
ATOM   974  N  NH2 . ARG A 1 121 ? -21.06905 36.85357 -3.66105  1.000 15.64075 ? 226 ARG A NH2 1 
ATOM   975  N  N   A ASN A 1 122 ? -22.23732 34.13251 -11.67802 0.535 15.70318 ? 227 ASN A N   1 
ATOM   976  N  N   B ASN A 1 122 ? -22.25939 34.25236 -11.73203 0.465 15.35096 ? 227 ASN A N   1 
ATOM   977  C  CA  A ASN A 1 122 ? -22.27864 33.48088 -12.98161 0.535 15.29975 ? 227 ASN A CA  1 
ATOM   978  C  CA  B ASN A 1 122 ? -22.25966 33.47789 -12.96583 0.465 14.74579 ? 227 ASN A CA  1 
ATOM   979  C  C   A ASN A 1 122 ? -21.96056 31.99848 -12.77956 0.535 14.29951 ? 227 ASN A C   1 
ATOM   980  C  C   B ASN A 1 122 ? -21.98805 32.02579 -12.57889 0.465 13.84303 ? 227 ASN A C   1 
ATOM   981  O  O   A ASN A 1 122 ? -20.79878 31.60298 -12.70133 0.535 14.69926 ? 227 ASN A O   1 
ATOM   982  O  O   B ASN A 1 122 ? -20.89059 31.69272 -12.12744 0.465 13.80805 ? 227 ASN A O   1 
ATOM   983  C  CB  A ASN A 1 122 ? -21.27161 34.15043 -13.90952 0.535 15.20489 ? 227 ASN A CB  1 
ATOM   984  C  CB  B ASN A 1 122 ? -21.18056 34.00378 -13.91697 0.465 14.64569 ? 227 ASN A CB  1 
ATOM   985  C  CG  A ASN A 1 122 ? -21.24549 33.52970 -15.27033 0.535 15.11318 ? 227 ASN A CG  1 
ATOM   986  C  CG  B ASN A 1 122 ? -21.73050 34.95396 -14.98533 0.465 14.52818 ? 227 ASN A CG  1 
ATOM   987  O  OD1 A ASN A 1 122 ? -22.29548 33.22791 -15.84894 0.535 14.90362 ? 227 ASN A OD1 1 
ATOM   988  O  OD1 B ASN A 1 122 ? -22.82124 34.75153 -15.51198 0.465 14.85876 ? 227 ASN A OD1 1 
ATOM   989  N  ND2 A ASN A 1 122 ? -20.04067 33.32002 -15.80063 0.535 14.94144 ? 227 ASN A ND2 1 
ATOM   990  N  ND2 B ASN A 1 122 ? -20.94741 35.98142 -15.33294 0.465 14.42943 ? 227 ASN A ND2 1 
ATOM   991  N  N   . CYS A 1 123 ? -22.99678 31.17264 -12.71256 1.000 13.12582 ? 228 CYS A N   1 
ATOM   992  C  CA  . CYS A 1 123 ? -22.86579 29.73464 -12.46419 1.000 10.93617 ? 228 CYS A CA  1 
ATOM   993  C  C   . CYS A 1 123 ? -23.63839 29.02935 -13.56434 1.000 10.05262 ? 228 CYS A C   1 
ATOM   994  O  O   . CYS A 1 123 ? -24.73694 28.49087 -13.33699 1.000 9.92544  ? 228 CYS A O   1 
ATOM   995  C  CB  . CYS A 1 123 ? -23.43508 29.35985 -11.09186 1.000 10.61690 ? 228 CYS A CB  1 
ATOM   996  S  SG  . CYS A 1 123 ? -22.62555 30.18895 -9.69222  1.000 10.04653 ? 228 CYS A SG  1 
ATOM   997  N  N   . PRO A 1 124 ? -23.10488 29.02223 -14.77865 1.000 10.28515 ? 229 PRO A N   1 
ATOM   998  C  CA  . PRO A 1 124 ? -23.93886 28.58722 -15.91652 1.000 11.37596 ? 229 PRO A CA  1 
ATOM   999  C  C   . PRO A 1 124 ? -24.35874 27.13211 -15.85113 1.000 11.10501 ? 229 PRO A C   1 
ATOM   1000 O  O   . PRO A 1 124 ? -25.39178 26.75301 -16.41802 1.000 11.44375 ? 229 PRO A O   1 
ATOM   1001 C  CB  . PRO A 1 124 ? -23.05162 28.87280 -17.13198 1.000 12.17406 ? 229 PRO A CB  1 
ATOM   1002 C  CG  . PRO A 1 124 ? -21.66300 28.94542 -16.56309 1.000 12.23782 ? 229 PRO A CG  1 
ATOM   1003 C  CD  . PRO A 1 124 ? -21.79251 29.53385 -15.21423 1.000 11.12156 ? 229 PRO A CD  1 
ATOM   1004 N  N   . LYS A 1 125 ? -23.58251 26.29727 -15.17697 1.000 10.67966 ? 230 LYS A N   1 
ATOM   1005 C  CA  . LYS A 1 125 ? -23.93286 24.90275 -15.03962 1.000 11.21586 ? 230 LYS A CA  1 
ATOM   1006 C  C   . LYS A 1 125 ? -24.76394 24.61757 -13.79763 1.000 10.78935 ? 230 LYS A C   1 
ATOM   1007 O  O   . LYS A 1 125 ? -25.13578 23.47087 -13.57462 1.000 11.49435 ? 230 LYS A O   1 
ATOM   1008 C  CB  . LYS A 1 125 ? -22.66054 24.04275 -15.04307 1.000 11.76789 ? 230 LYS A CB  1 
ATOM   1009 C  CG  . LYS A 1 125 ? -21.86630 24.15609 -16.34060 1.000 12.60557 ? 230 LYS A CG  1 
ATOM   1010 C  CD  . LYS A 1 125 ? -22.72663 23.78147 -17.55337 1.000 13.36587 ? 230 LYS A CD  1 
ATOM   1011 C  CE  . LYS A 1 125 ? -21.88374 23.90342 -18.80113 1.000 14.80936 ? 230 LYS A CE  1 
ATOM   1012 N  NZ  . LYS A 1 125 ? -22.71577 23.68197 -19.99174 1.000 15.71208 ? 230 LYS A NZ  1 
ATOM   1013 N  N   . GLY A 1 126 ? -25.09281 25.61079 -12.99862 1.000 10.63348 ? 231 GLY A N   1 
ATOM   1014 C  CA  . GLY A 1 126 ? -26.00395 25.41056 -11.88219 1.000 10.11113 ? 231 GLY A CA  1 
ATOM   1015 C  C   . GLY A 1 126 ? -25.30871 25.55064 -10.53592 1.000 9.49458  ? 231 GLY A C   1 
ATOM   1016 O  O   . GLY A 1 126 ? -24.09555 25.75187 -10.43102 1.000 9.93761  ? 231 GLY A O   1 
ATOM   1017 N  N   . VAL A 1 127 ? -26.10895 25.41800 -9.48618  1.000 9.44008  ? 232 VAL A N   1 
ATOM   1018 C  CA  . VAL A 1 127 ? -25.68338 25.80331 -8.15781  1.000 8.59746  ? 232 VAL A CA  1 
ATOM   1019 C  C   . VAL A 1 127 ? -26.02230 24.66694 -7.22016  1.000 7.73141  ? 232 VAL A C   1 
ATOM   1020 O  O   . VAL A 1 127 ? -27.14403 24.14124 -7.26519  1.000 7.41792  ? 232 VAL A O   1 
ATOM   1021 C  CB  . VAL A 1 127 ? -26.39565 27.10009 -7.71089  1.000 8.58294  ? 232 VAL A CB  1 
ATOM   1022 C  CG1 . VAL A 1 127 ? -25.89862 27.52787 -6.32457  1.000 8.65255  ? 232 VAL A CG1 1 
ATOM   1023 C  CG2 . VAL A 1 127 ? -26.15156 28.18942 -8.75244  1.000 9.03196  ? 232 VAL A CG2 1 
ATOM   1024 N  N   . VAL A 1 128 ? -25.07248 24.30018 -6.36845  1.000 6.75464  ? 233 VAL A N   1 
ATOM   1025 C  CA  . VAL A 1 128 ? -25.24582 23.30709 -5.31305  1.000 7.16307  ? 233 VAL A CA  1 
ATOM   1026 C  C   . VAL A 1 128 ? -24.96809 23.98038 -3.97671  1.000 7.02495  ? 233 VAL A C   1 
ATOM   1027 O  O   . VAL A 1 128 ? -24.20506 24.94660 -3.90175  1.000 7.17924  ? 233 VAL A O   1 
ATOM   1028 C  CB  . VAL A 1 128 ? -24.21685 22.16861 -5.58013  1.000 6.76694  ? 233 VAL A CB  1 
ATOM   1029 C  CG1 . VAL A 1 128 ? -24.25606 21.08749 -4.46151  1.000 6.26536  ? 233 VAL A CG1 1 
ATOM   1030 C  CG2 . VAL A 1 128 ? -24.39988 21.63679 -7.02755  1.000 7.30155  ? 233 VAL A CG2 1 
ATOM   1031 N  N   . ALA A 1 129 ? -25.55071 23.45361 -2.89917  1.000 7.07222  ? 234 ALA A N   1 
ATOM   1032 C  CA  . ALA A 1 129 ? -25.15471 23.87504 -1.55945  1.000 6.36347  ? 234 ALA A CA  1 
ATOM   1033 C  C   . ALA A 1 129 ? -24.92500 22.62392 -0.73805  1.000 6.44072  ? 234 ALA A C   1 
ATOM   1034 O  O   . ALA A 1 129 ? -25.70100 21.66074 -0.82682  1.000 7.56228  ? 234 ALA A O   1 
ATOM   1035 C  CB  . ALA A 1 129 ? -26.22835 24.71747 -0.86106  1.000 6.09647  ? 234 ALA A CB  1 
ATOM   1036 N  N   . SER A 1 130 ? -23.80191 22.60368 -0.03866  1.000 6.75863  ? 235 SER A N   1 
ATOM   1037 C  CA  . SER A 1 130 ? -23.39720 21.47421 0.77374   1.000 7.23797  ? 235 SER A CA  1 
ATOM   1038 C  C   . SER A 1 130 ? -23.54578 21.89260 2.22594   1.000 6.08216  ? 235 SER A C   1 
ATOM   1039 O  O   . SER A 1 130 ? -22.92537 22.87078 2.65435   1.000 5.51357  ? 235 SER A O   1 
ATOM   1040 C  CB  . SER A 1 130 ? -21.95369 21.09279 0.40811   1.000 7.38399  ? 235 SER A CB  1 
ATOM   1041 O  OG  . SER A 1 130 ? -21.57700 19.87059 0.98958   1.000 7.90151  ? 235 SER A OG  1 
ATOM   1042 N  N   A LEU A 1 131 ? -24.38039 21.16840 2.98160   0.590 6.86740  ? 236 LEU A N   1 
ATOM   1043 N  N   B LEU A 1 131 ? -24.39756 21.18801 2.97606   0.410 6.73304  ? 236 LEU A N   1 
ATOM   1044 C  CA  A LEU A 1 131 ? -24.63610 21.48654 4.38898   0.590 7.41903  ? 236 LEU A CA  1 
ATOM   1045 C  CA  B LEU A 1 131 ? -24.62789 21.49322 4.39097   0.410 7.33873  ? 236 LEU A CA  1 
ATOM   1046 C  C   A LEU A 1 131 ? -24.17776 20.32592 5.27181   0.590 7.54755  ? 236 LEU A C   1 
ATOM   1047 C  C   B LEU A 1 131 ? -24.17152 20.31758 5.25264   0.410 7.50833  ? 236 LEU A C   1 
ATOM   1048 O  O   A LEU A 1 131 ? -24.96412 19.43094 5.59872   0.590 7.75192  ? 236 LEU A O   1 
ATOM   1049 O  O   B LEU A 1 131 ? -24.95224 19.40722 5.54606   0.410 7.56040  ? 236 LEU A O   1 
ATOM   1050 C  CB  A LEU A 1 131 ? -26.11999 21.76360 4.62227   0.590 7.30877  ? 236 LEU A CB  1 
ATOM   1051 C  CB  B LEU A 1 131 ? -26.09783 21.81095 4.64566   0.410 7.42986  ? 236 LEU A CB  1 
ATOM   1052 C  CG  A LEU A 1 131 ? -26.66784 23.08581 4.06641   0.590 7.80038  ? 236 LEU A CG  1 
ATOM   1053 C  CG  B LEU A 1 131 ? -26.54263 23.15505 4.06041   0.410 7.89829  ? 236 LEU A CG  1 
ATOM   1054 C  CD1 A LEU A 1 131 ? -26.67503 23.14983 2.56219   0.590 8.57274  ? 236 LEU A CD1 1 
ATOM   1055 C  CD1 B LEU A 1 131 ? -27.91251 23.02237 3.41410   0.410 8.27500  ? 236 LEU A CD1 1 
ATOM   1056 C  CD2 A LEU A 1 131 ? -28.11325 23.25219 4.55838   0.590 7.58663  ? 236 LEU A CD2 1 
ATOM   1057 C  CD2 B LEU A 1 131 ? -26.62575 24.19053 5.14484   0.410 8.17404  ? 236 LEU A CD2 1 
ATOM   1058 N  N   . SER A 1 132 ? -22.90146 20.33857 5.65995   1.000 7.78965  ? 237 SER A N   1 
ATOM   1059 C  CA  . SER A 1 132 ? -22.37668 19.33355 6.58737   1.000 7.87602  ? 237 SER A CA  1 
ATOM   1060 C  C   . SER A 1 132 ? -22.61520 19.79862 8.01677   1.000 8.47454  ? 237 SER A C   1 
ATOM   1061 O  O   . SER A 1 132 ? -21.68095 20.16815 8.75134   1.000 9.23302  ? 237 SER A O   1 
ATOM   1062 C  CB  . SER A 1 132 ? -20.90333 19.10690 6.31439   1.000 7.03384  ? 237 SER A CB  1 
ATOM   1063 O  OG  . SER A 1 132 ? -20.77695 18.50770 5.03434   1.000 6.83533  ? 237 SER A OG  1 
ATOM   1064 N  N   . LEU A 1 133 ? -23.89188 19.79701 8.39463   1.000 8.97411  ? 238 LEU A N   1 
ATOM   1065 C  CA  . LEU A 1 133 ? -24.30106 20.35057 9.66356   1.000 9.77527  ? 238 LEU A CA  1 
ATOM   1066 C  C   . LEU A 1 133 ? -25.63480 19.73679 10.02094  1.000 10.40595 ? 238 LEU A C   1 
ATOM   1067 O  O   . LEU A 1 133 ? -26.27778 19.07437 9.21062   1.000 10.32806 ? 238 LEU A O   1 
ATOM   1068 C  CB  . LEU A 1 133 ? -24.33967 21.89981 9.59548   1.000 10.73547 ? 238 LEU A CB  1 
ATOM   1069 C  CG  . LEU A 1 133 ? -25.12436 22.62371 8.47644   1.000 11.25337 ? 238 LEU A CG  1 
ATOM   1070 C  CD1 . LEU A 1 133 ? -26.62342 22.51592 8.71724   1.000 11.88414 ? 238 LEU A CD1 1 
ATOM   1071 C  CD2 . LEU A 1 133 ? -24.74919 24.09597 8.36905   1.000 11.77485 ? 238 LEU A CD2 1 
ATOM   1072 N  N   . GLY A 1 134 ? -26.04476 19.97364 11.24708  1.000 12.17913 ? 239 GLY A N   1 
ATOM   1073 C  CA  . GLY A 1 134 ? -27.35590 19.54657 11.66546  1.000 13.00219 ? 239 GLY A CA  1 
ATOM   1074 C  C   . GLY A 1 134 ? -27.43014 19.36505 13.16184  1.000 12.34903 ? 239 GLY A C   1 
ATOM   1075 O  O   . GLY A 1 134 ? -26.43439 19.23220 13.86375  1.000 12.39312 ? 239 GLY A O   1 
ATOM   1076 N  N   . GLY A 1 135 ? -28.64632 19.42007 13.65692  1.000 11.50049 ? 240 GLY A N   1 
ATOM   1077 C  CA  . GLY A 1 135 ? -28.97516 19.13225 15.02512  1.000 11.12489 ? 240 GLY A CA  1 
ATOM   1078 C  C   . GLY A 1 135 ? -30.32351 18.43992 15.11968  1.000 10.63504 ? 240 GLY A C   1 
ATOM   1079 O  O   . GLY A 1 135 ? -30.72427 17.77378 14.17060  1.000 9.72984  ? 240 GLY A O   1 
ATOM   1080 N  N   . GLY A 1 136 ? -31.01975 18.59195 16.23938  1.000 11.08131 ? 241 GLY A N   1 
ATOM   1081 C  CA  . GLY A 1 136 ? -32.33646 17.99757 16.40690  1.000 10.21026 ? 241 GLY A CA  1 
ATOM   1082 C  C   . GLY A 1 136 ? -33.37005 18.56742 15.45114  1.000 9.90571  ? 241 GLY A C   1 
ATOM   1083 O  O   . GLY A 1 136 ? -33.22008 19.63472 14.84996  1.000 10.32928 ? 241 GLY A O   1 
ATOM   1084 N  N   . TYR A 1 137 ? -34.48351 17.85836 15.36004  1.000 9.39568  ? 242 TYR A N   1 
ATOM   1085 C  CA  . TYR A 1 137 ? -35.50724 18.21272 14.38879  1.000 9.40578  ? 242 TYR A CA  1 
ATOM   1086 C  C   . TYR A 1 137 ? -35.96997 19.64684 14.59792  1.000 9.40322  ? 242 TYR A C   1 
ATOM   1087 O  O   . TYR A 1 137 ? -36.27175 20.06425 15.72539  1.000 10.02100 ? 242 TYR A O   1 
ATOM   1088 C  CB  . TYR A 1 137 ? -36.71269 17.28298 14.60394  1.000 9.82756  ? 242 TYR A CB  1 
ATOM   1089 C  CG  . TYR A 1 137 ? -37.86224 17.64680 13.70262  1.000 9.65874  ? 242 TYR A CG  1 
ATOM   1090 C  CD1 . TYR A 1 137 ? -37.90867 17.17073 12.38351  1.000 9.86325  ? 242 TYR A CD1 1 
ATOM   1091 C  CD2 . TYR A 1 137 ? -38.85698 18.56003 14.12491  1.000 9.25982  ? 242 TYR A CD2 1 
ATOM   1092 C  CE1 . TYR A 1 137 ? -38.95243 17.50319 11.51481  1.000 10.49756 ? 242 TYR A CE1 1 
ATOM   1093 C  CE2 . TYR A 1 137 ? -39.86787 18.94116 13.23748  1.000 9.99387  ? 242 TYR A CE2 1 
ATOM   1094 C  CZ  . TYR A 1 137 ? -39.91883 18.40778 11.95741  1.000 10.58380 ? 242 TYR A CZ  1 
ATOM   1095 O  OH  . TYR A 1 137 ? -40.94396 18.81473 11.16713  1.000 11.32080 ? 242 TYR A OH  1 
ATOM   1096 N  N   . SER A 1 138 ? -36.09147 20.38369 13.49419  1.000 8.09126  ? 243 SER A N   1 
ATOM   1097 C  CA  . SER A 1 138 ? -36.62605 21.74661 13.54447  1.000 7.86719  ? 243 SER A CA  1 
ATOM   1098 C  C   . SER A 1 138 ? -37.41050 21.94804 12.26044  1.000 8.82110  ? 243 SER A C   1 
ATOM   1099 O  O   . SER A 1 138 ? -36.83782 21.80999 11.17366  1.000 8.49021  ? 243 SER A O   1 
ATOM   1100 C  CB  . SER A 1 138 ? -35.48586 22.77084 13.61757  1.000 8.11459  ? 243 SER A CB  1 
ATOM   1101 O  OG  . SER A 1 138 ? -36.00351 24.05956 13.30977  1.000 8.98552  ? 243 SER A OG  1 
ATOM   1102 N  N   A SER A 1 139 ? -38.70726 22.26431 12.37236  0.577 8.59181  ? 244 SER A N   1 
ATOM   1103 N  N   B SER A 1 139 ? -38.70338 22.26103 12.38226  0.423 8.83022  ? 244 SER A N   1 
ATOM   1104 C  CA  A SER A 1 139 ? -39.46345 22.51697 11.15373  0.577 8.22040  ? 244 SER A CA  1 
ATOM   1105 C  CA  B SER A 1 139 ? -39.48036 22.55793 11.18846  0.423 8.70035  ? 244 SER A CA  1 
ATOM   1106 C  C   A SER A 1 139 ? -38.96287 23.77649 10.43418  0.577 8.26840  ? 244 SER A C   1 
ATOM   1107 C  C   B SER A 1 139 ? -38.95295 23.80396 10.47502  0.423 8.06122  ? 244 SER A C   1 
ATOM   1108 O  O   A SER A 1 139 ? -39.02047 23.85971 9.20759   0.577 8.13281  ? 244 SER A O   1 
ATOM   1109 O  O   B SER A 1 139 ? -39.00681 23.89117 9.24654   0.423 8.02464  ? 244 SER A O   1 
ATOM   1110 C  CB  A SER A 1 139 ? -40.97512 22.57714 11.43390  0.577 7.99738  ? 244 SER A CB  1 
ATOM   1111 C  CB  B SER A 1 139 ? -40.96120 22.71603 11.54536  0.423 9.21874  ? 244 SER A CB  1 
ATOM   1112 O  OG  A SER A 1 139 ? -41.30454 23.64969 12.30994  0.577 7.65864  ? 244 SER A OG  1 
ATOM   1113 O  OG  B SER A 1 139 ? -41.67587 23.29826 10.47427  0.423 9.45887  ? 244 SER A OG  1 
ATOM   1114 N  N   A SER A 1 140 ? -38.45706 24.76140 11.17349  0.577 8.68375  ? 245 SER A N   1 
ATOM   1115 N  N   B SER A 1 140 ? -38.43877 24.77772 11.22358  0.423 7.63917  ? 245 SER A N   1 
ATOM   1116 C  CA  A SER A 1 140 ? -37.97257 25.96107 10.50623  0.577 9.00160  ? 245 SER A CA  1 
ATOM   1117 C  CA  B SER A 1 140 ? -37.93920 25.98475 10.57937  0.423 7.35280  ? 245 SER A CA  1 
ATOM   1118 C  C   A SER A 1 140 ? -36.64085 25.72147 9.81401   0.577 8.41099  ? 245 SER A C   1 
ATOM   1119 C  C   B SER A 1 140 ? -36.65213 25.71158 9.82260   0.423 7.54234  ? 245 SER A C   1 
ATOM   1120 O  O   A SER A 1 140 ? -36.39344 26.29344 8.74752   0.577 8.15154  ? 245 SER A O   1 
ATOM   1121 O  O   B SER A 1 140 ? -36.44684 26.24559 8.72720   0.423 7.23447  ? 245 SER A O   1 
ATOM   1122 C  CB  A SER A 1 140 ? -37.85745 27.11422 11.49970  0.577 9.77477  ? 245 SER A CB  1 
ATOM   1123 C  CB  B SER A 1 140 ? -37.71227 27.07504 11.62152  0.423 6.62409  ? 245 SER A CB  1 
ATOM   1124 O  OG  A SER A 1 140 ? -36.96286 26.81281 12.55424  0.577 10.88806 ? 245 SER A OG  1 
ATOM   1125 O  OG  B SER A 1 140 ? -38.94530 27.52453 12.15901  0.423 6.56136  ? 245 SER A OG  1 
ATOM   1126 N  N   . VAL A 1 141 ? -35.76975 24.88120 10.38269  1.000 7.91150  ? 246 VAL A N   1 
ATOM   1127 C  CA  . VAL A 1 141 ? -34.56674 24.51764 9.64310   1.000 7.17815  ? 246 VAL A CA  1 
ATOM   1128 C  C   . VAL A 1 141 ? -34.93622 23.73938 8.39509   1.000 7.14109  ? 246 VAL A C   1 
ATOM   1129 O  O   . VAL A 1 141 ? -34.41016 24.02615 7.32320   1.000 6.60424  ? 246 VAL A O   1 
ATOM   1130 C  CB  . VAL A 1 141 ? -33.55452 23.78099 10.53942  1.000 7.49418  ? 246 VAL A CB  1 
ATOM   1131 C  CG1 . VAL A 1 141 ? -32.37965 23.16925 9.68297   1.000 8.48389  ? 246 VAL A CG1 1 
ATOM   1132 C  CG2 . VAL A 1 141 ? -33.02426 24.74990 11.55622  1.000 7.34375  ? 246 VAL A CG2 1 
ATOM   1133 N  N   . ASN A 1 142 ? -35.88092 22.79190 8.50243   1.000 7.25819  ? 247 ASN A N   1 
ATOM   1134 C  CA  . ASN A 1 142 ? -36.26168 21.99886 7.34253   1.000 7.68783  ? 247 ASN A CA  1 
ATOM   1135 C  C   . ASN A 1 142 ? -36.85722 22.88820 6.27997   1.000 7.55633  ? 247 ASN A C   1 
ATOM   1136 O  O   . ASN A 1 142 ? -36.55869 22.72727 5.09459   1.000 7.87012  ? 247 ASN A O   1 
ATOM   1137 C  CB  . ASN A 1 142 ? -37.27267 20.92905 7.73464   1.000 7.22530  ? 247 ASN A CB  1 
ATOM   1138 C  CG  . ASN A 1 142 ? -36.62994 19.73467 8.41731   1.000 7.82315  ? 247 ASN A CG  1 
ATOM   1139 O  OD1 . ASN A 1 142 ? -35.43060 19.75980 8.70089   1.000 8.24397  ? 247 ASN A OD1 1 
ATOM   1140 N  ND2 . ASN A 1 142 ? -37.42786 18.69488 8.71039   1.000 8.37300  ? 247 ASN A ND2 1 
ATOM   1141 N  N   A SER A 1 143 ? -37.68701 23.84889 6.69130   0.712 7.91522  ? 248 SER A N   1 
ATOM   1142 N  N   B SER A 1 143 ? -37.71087 23.83791 6.68311   0.288 7.69948  ? 248 SER A N   1 
ATOM   1143 C  CA  A SER A 1 143 ? -38.32997 24.73341 5.73560   0.712 7.97697  ? 248 SER A CA  1 
ATOM   1144 C  CA  B SER A 1 143 ? -38.32475 24.74215 5.71714   0.288 7.62290  ? 248 SER A CA  1 
ATOM   1145 C  C   A SER A 1 143 ? -37.30540 25.60027 5.01872   0.712 7.00709  ? 248 SER A C   1 
ATOM   1146 C  C   B SER A 1 143 ? -37.27366 25.57431 5.00364   0.288 6.86786  ? 248 SER A C   1 
ATOM   1147 O  O   A SER A 1 143 ? -37.45334 25.88521 3.82305   0.712 7.51541  ? 248 SER A O   1 
ATOM   1148 O  O   B SER A 1 143 ? -37.38143 25.82085 3.79701   0.288 7.21031  ? 248 SER A O   1 
ATOM   1149 C  CB  A SER A 1 143 ? -39.34552 25.60387 6.47210   0.712 8.52992  ? 248 SER A CB  1 
ATOM   1150 C  CB  B SER A 1 143 ? -39.32467 25.66908 6.40970   0.288 8.08837  ? 248 SER A CB  1 
ATOM   1151 O  OG  A SER A 1 143 ? -40.07890 26.40848 5.58445   0.712 8.75721  ? 248 SER A OG  1 
ATOM   1152 O  OG  B SER A 1 143 ? -40.44513 24.96097 6.90287   0.288 8.27004  ? 248 SER A OG  1 
ATOM   1153 N  N   . ALA A 1 144 ? -36.24973 26.02849 5.73538   1.000 5.89729  ? 249 ALA A N   1 
ATOM   1154 C  CA  . ALA A 1 144 ? -35.20892 26.81421 5.09904   1.000 6.13467  ? 249 ALA A CA  1 
ATOM   1155 C  C   . ALA A 1 144 ? -34.45994 25.99767 4.07979   1.000 6.38360  ? 249 ALA A C   1 
ATOM   1156 O  O   . ALA A 1 144 ? -34.13789 26.49661 2.99683   1.000 6.67658  ? 249 ALA A O   1 
ATOM   1157 C  CB  . ALA A 1 144 ? -34.24171 27.35633 6.14998   1.000 6.44653  ? 249 ALA A CB  1 
ATOM   1158 N  N   . ALA A 1 145 ? -34.18273 24.73945 4.39460   1.000 6.84388  ? 250 ALA A N   1 
ATOM   1159 C  CA  . ALA A 1 145 ? -33.53741 23.89541 3.39847   1.000 6.83748  ? 250 ALA A CA  1 
ATOM   1160 C  C   . ALA A 1 145 ? -34.46611 23.61036 2.22986   1.000 6.63004  ? 250 ALA A C   1 
ATOM   1161 O  O   . ALA A 1 145 ? -34.03122 23.59445 1.07298   1.000 7.03091  ? 250 ALA A O   1 
ATOM   1162 C  CB  . ALA A 1 145 ? -33.09353 22.58505 4.06677   1.000 7.34687  ? 250 ALA A CB  1 
ATOM   1163 N  N   . ALA A 1 146 ? -35.76488 23.41483 2.50779   1.000 6.06809  ? 251 ALA A N   1 
ATOM   1164 C  CA  . ALA A 1 146 ? -36.73844 23.26171 1.43349   1.000 5.98931  ? 251 ALA A CA  1 
ATOM   1165 C  C   . ALA A 1 146 ? -36.79243 24.51315 0.54837   1.000 5.42012  ? 251 ALA A C   1 
ATOM   1166 O  O   . ALA A 1 146 ? -36.92496 24.39306 -0.66999  1.000 4.77705  ? 251 ALA A O   1 
ATOM   1167 C  CB  . ALA A 1 146 ? -38.12276 22.93673 1.98857   1.000 5.94102  ? 251 ALA A CB  1 
ATOM   1168 N  N   . ARG A 1 147 ? -36.73004 25.71533 1.14574   1.000 6.12938  ? 252 ARG A N   1 
ATOM   1169 C  CA  . ARG A 1 147 ? -36.76050 26.93213 0.35330   1.000 6.60057  ? 252 ARG A CA  1 
ATOM   1170 C  C   . ARG A 1 147 ? -35.50897 26.99006 -0.48251  1.000 6.18082  ? 252 ARG A C   1 
ATOM   1171 O  O   . ARG A 1 147 ? -35.56691 27.33081 -1.67533  1.000 6.22196  ? 252 ARG A O   1 
ATOM   1172 C  CB  . ARG A 1 147 ? -36.79305 28.17814 1.26625   1.000 7.41545  ? 252 ARG A CB  1 
ATOM   1173 C  CG  . ARG A 1 147 ? -38.12136 28.44564 1.95224   1.000 8.52680  ? 252 ARG A CG  1 
ATOM   1174 C  CD  . ARG A 1 147 ? -38.18511 29.84378 2.51023   1.000 8.99283  ? 252 ARG A CD  1 
ATOM   1175 N  NE  . ARG A 1 147 ? -37.12429 30.08636 3.47702   1.000 9.07656  ? 252 ARG A NE  1 
ATOM   1176 C  CZ  . ARG A 1 147 ? -37.20108 29.78108 4.76490   1.000 9.35505  ? 252 ARG A CZ  1 
ATOM   1177 N  NH1 . ARG A 1 147 ? -38.23714 29.10900 5.26333   1.000 9.46798  ? 252 ARG A NH1 1 
ATOM   1178 N  NH2 . ARG A 1 147 ? -36.20989 30.14887 5.57959   1.000 9.33040  ? 252 ARG A NH2 1 
ATOM   1179 N  N   . LEU A 1 148 ? -34.35597 26.68208 0.12150   1.000 6.25927  ? 253 LEU A N   1 
ATOM   1180 C  CA  . LEU A 1 148 ? -33.14515 26.76835 -0.68056  1.000 6.58309  ? 253 LEU A CA  1 
ATOM   1181 C  C   . LEU A 1 148 ? -33.24041 25.85573 -1.89132  1.000 6.25605  ? 253 LEU A C   1 
ATOM   1182 O  O   . LEU A 1 148 ? -32.86635 26.23125 -3.00195  1.000 6.01754  ? 253 LEU A O   1 
ATOM   1183 C  CB  . LEU A 1 148 ? -31.92268 26.42675 0.15088   1.000 6.73620  ? 253 LEU A CB  1 
ATOM   1184 C  CG  . LEU A 1 148 ? -30.53477 26.49331 -0.48738  1.000 7.00502  ? 253 LEU A CG  1 
ATOM   1185 C  CD1 . LEU A 1 148 ? -30.29125 27.88907 -1.06016  1.000 7.44405  ? 253 LEU A CD1 1 
ATOM   1186 C  CD2 . LEU A 1 148 ? -29.46922 26.19538 0.58496   1.000 6.58955  ? 253 LEU A CD2 1 
ATOM   1187 N  N   . GLN A 1 149 ? -33.73247 24.63807 -1.69050  1.000 5.47563  ? 254 GLN A N   1 
ATOM   1188 C  CA  . GLN A 1 149 ? -33.88452 23.70306 -2.79783  1.000 6.14974  ? 254 GLN A CA  1 
ATOM   1189 C  C   . GLN A 1 149 ? -34.87677 24.22848 -3.82815  1.000 6.22290  ? 254 GLN A C   1 
ATOM   1190 O  O   . GLN A 1 149 ? -34.59917 24.23047 -5.02746  1.000 6.49677  ? 254 GLN A O   1 
ATOM   1191 C  CB  . GLN A 1 149 ? -34.32401 22.33738 -2.23370  1.000 5.95888  ? 254 GLN A CB  1 
ATOM   1192 C  CG  . GLN A 1 149 ? -34.64232 21.27406 -3.24505  1.000 6.56980  ? 254 GLN A CG  1 
ATOM   1193 C  CD  . GLN A 1 149 ? -33.39054 20.70846 -3.84665  1.000 7.77649  ? 254 GLN A CD  1 
ATOM   1194 O  OE1 . GLN A 1 149 ? -32.41395 20.45327 -3.14288  1.000 7.03300  ? 254 GLN A OE1 1 
ATOM   1195 N  NE2 . GLN A 1 149 ? -33.38032 20.58769 -5.15203  1.000 9.23143  ? 254 GLN A NE2 1 
ATOM   1196 N  N   . SER A 1 150 ? -36.02242 24.74610 -3.35841  1.000 6.44622  ? 255 SER A N   1 
ATOM   1197 C  CA  . SER A 1 150 ? -37.03331 25.26636 -4.26141  1.000 7.51922  ? 255 SER A CA  1 
ATOM   1198 C  C   . SER A 1 150 ? -36.50440 26.44054 -5.08122  1.000 7.77101  ? 255 SER A C   1 
ATOM   1199 O  O   . SER A 1 150 ? -36.97309 26.67892 -6.18831  1.000 8.65546  ? 255 SER A O   1 
ATOM   1200 C  CB  . SER A 1 150 ? -38.21719 25.72259 -3.39293  1.000 7.91283  ? 255 SER A CB  1 
ATOM   1201 O  OG  . SER A 1 150 ? -39.17814 26.45954 -4.11459  1.000 8.67570  ? 255 SER A OG  1 
ATOM   1202 N  N   . SER A 1 151 ? -35.58736 27.23638 -4.51676  1.000 7.05126  ? 256 SER A N   1 
ATOM   1203 C  CA  . SER A 1 151 ? -35.07073 28.37207 -5.25636  1.000 7.37499  ? 256 SER A CA  1 
ATOM   1204 C  C   . SER A 1 151 ? -34.18006 27.95736 -6.41920  1.000 7.53999  ? 256 SER A C   1 
ATOM   1205 O  O   . SER A 1 151 ? -33.76278 28.82619 -7.19873  1.000 7.16487  ? 256 SER A O   1 
ATOM   1206 C  CB  . SER A 1 151 ? -34.25979 29.27091 -4.30790  1.000 7.89801  ? 256 SER A CB  1 
ATOM   1207 O  OG  . SER A 1 151 ? -32.92745 28.78632 -4.08498  1.000 8.07985  ? 256 SER A OG  1 
ATOM   1208 N  N   . GLY A 1 152 ? -33.87530 26.67585 -6.56685  1.000 8.46344  ? 257 GLY A N   1 
ATOM   1209 C  CA  . GLY A 1 152 ? -33.06589 26.20838 -7.66303  1.000 9.06750  ? 257 GLY A CA  1 
ATOM   1210 C  C   . GLY A 1 152 ? -31.66750 25.79814 -7.31892  1.000 9.08215  ? 257 GLY A C   1 
ATOM   1211 O  O   . GLY A 1 152 ? -30.80146 25.83269 -8.19030  1.000 9.62811  ? 257 GLY A O   1 
ATOM   1212 N  N   . VAL A 1 153 ? -31.40766 25.44718 -6.08659  1.000 8.56708  ? 258 VAL A N   1 
ATOM   1213 C  CA  . VAL A 1 153 ? -30.10105 24.99464 -5.64173  1.000 7.94108  ? 258 VAL A CA  1 
ATOM   1214 C  C   . VAL A 1 153 ? -30.20439 23.51038 -5.31033  1.000 6.93289  ? 258 VAL A C   1 
ATOM   1215 O  O   . VAL A 1 153 ? -31.13905 23.08340 -4.61750  1.000 6.39298  ? 258 VAL A O   1 
ATOM   1216 C  CB  . VAL A 1 153 ? -29.67204 25.80980 -4.41760  1.000 7.93531  ? 258 VAL A CB  1 
ATOM   1217 C  CG1 . VAL A 1 153 ? -28.39471 25.26097 -3.80775  1.000 7.81286  ? 258 VAL A CG1 1 
ATOM   1218 C  CG2 . VAL A 1 153 ? -29.47386 27.28102 -4.75977  1.000 7.84156  ? 258 VAL A CG2 1 
ATOM   1219 N  N   . MET A 1 154 ? -29.24589 22.73156 -5.77923  1.000 6.50558  ? 259 MET A N   1 
ATOM   1220 C  CA  . MET A 1 154 ? -29.17652 21.34954 -5.34975  1.000 6.36558  ? 259 MET A CA  1 
ATOM   1221 C  C   . MET A 1 154 ? -28.65426 21.28947 -3.91186  1.000 5.77368  ? 259 MET A C   1 
ATOM   1222 O  O   . MET A 1 154 ? -27.48503 21.55926 -3.65683  1.000 5.61975  ? 259 MET A O   1 
ATOM   1223 C  CB  . MET A 1 154 ? -28.26130 20.60414 -6.31982  1.000 7.05510  ? 259 MET A CB  1 
ATOM   1224 C  CG  . MET A 1 154 ? -28.27188 19.06512 -6.14383  1.000 7.31163  ? 259 MET A CG  1 
ATOM   1225 S  SD  . MET A 1 154 ? -27.49132 18.45233 -4.61392  1.000 7.31654  ? 259 MET A SD  1 
ATOM   1226 C  CE  . MET A 1 154 ? -27.80590 16.67918 -4.79908  1.000 7.87007  ? 259 MET A CE  1 
ATOM   1227 N  N   . VAL A 1 155 ? -29.51678 20.97624 -2.95603  1.000 6.62615  ? 260 VAL A N   1 
ATOM   1228 C  CA  . VAL A 1 155 ? -29.13610 20.99651 -1.55459  1.000 7.19665  ? 260 VAL A CA  1 
ATOM   1229 C  C   . VAL A 1 155 ? -28.78792 19.57869 -1.12406  1.000 6.89744  ? 260 VAL A C   1 
ATOM   1230 O  O   . VAL A 1 155 ? -29.61929 18.66875 -1.23761  1.000 6.81639  ? 260 VAL A O   1 
ATOM   1231 C  CB  . VAL A 1 155 ? -30.26458 21.58504 -0.70095  1.000 7.90428  ? 260 VAL A CB  1 
ATOM   1232 C  CG1 . VAL A 1 155 ? -29.86598 21.59464 0.79817   1.000 8.57682  ? 260 VAL A CG1 1 
ATOM   1233 C  CG2 . VAL A 1 155 ? -30.55904 22.97443 -1.20526  1.000 8.05386  ? 260 VAL A CG2 1 
ATOM   1234 N  N   . ALA A 1 156 ? -27.56156 19.38546 -0.62389  1.000 7.61331  ? 261 ALA A N   1 
ATOM   1235 C  CA  . ALA A 1 156 ? -27.12806 18.11948 -0.05814  1.000 7.57022  ? 261 ALA A CA  1 
ATOM   1236 C  C   . ALA A 1 156 ? -26.85426 18.36414 1.40929   1.000 7.20548  ? 261 ALA A C   1 
ATOM   1237 O  O   . ALA A 1 156 ? -26.14864 19.32875 1.74499   1.000 7.46976  ? 261 ALA A O   1 
ATOM   1238 C  CB  . ALA A 1 156 ? -25.85682 17.64035 -0.79445  1.000 7.75230  ? 261 ALA A CB  1 
ATOM   1239 N  N   . VAL A 1 157 ? -27.37567 17.49320 2.28866   1.000 6.91134  ? 262 VAL A N   1 
ATOM   1240 C  CA  . VAL A 1 157 ? -27.26027 17.69503 3.72498   1.000 6.74777  ? 262 VAL A CA  1 
ATOM   1241 C  C   . VAL A 1 157 ? -26.82383 16.40617 4.37477   1.000 7.12037  ? 262 VAL A C   1 
ATOM   1242 O  O   . VAL A 1 157 ? -27.16233 15.30786 3.91920   1.000 7.37792  ? 262 VAL A O   1 
ATOM   1243 C  CB  . VAL A 1 157 ? -28.55535 18.19382 4.41711   1.000 7.01011  ? 262 VAL A CB  1 
ATOM   1244 C  CG1 . VAL A 1 157 ? -29.12036 19.36895 3.65517   1.000 6.20355  ? 262 VAL A CG1 1 
ATOM   1245 C  CG2 . VAL A 1 157 ? -29.61066 17.13617 4.44508   1.000 7.53027  ? 262 VAL A CG2 1 
ATOM   1246 N  N   . ALA A 1 158 ? -26.06928 16.54341 5.45647   1.000 6.67800  ? 263 ALA A N   1 
ATOM   1247 C  CA  . ALA A 1 158 ? -25.62015 15.36393 6.18654   1.000 7.38124  ? 263 ALA A CA  1 
ATOM   1248 C  C   . ALA A 1 158 ? -26.79250 14.65909 6.85095   1.000 6.75689  ? 263 ALA A C   1 
ATOM   1249 O  O   . ALA A 1 158 ? -27.70363 15.28878 7.38614   1.000 7.63984  ? 263 ALA A O   1 
ATOM   1250 C  CB  . ALA A 1 158 ? -24.57453 15.75410 7.23761   1.000 8.39175  ? 263 ALA A CB  1 
ATOM   1251 N  N   . ALA A 1 159 ? -26.75954 13.31753 6.85678   1.000 6.69322  ? 264 ALA A N   1 
ATOM   1252 C  CA  . ALA A 1 159 ? -27.76656 12.60346 7.61587   1.000 7.11077  ? 264 ALA A CA  1 
ATOM   1253 C  C   . ALA A 1 159 ? -27.59793 12.72586 9.13397   1.000 7.46391  ? 264 ALA A C   1 
ATOM   1254 O  O   . ALA A 1 159 ? -28.59042 12.58093 9.86757   1.000 7.29931  ? 264 ALA A O   1 
ATOM   1255 C  CB  . ALA A 1 159 ? -27.77584 11.12940 7.18514   1.000 7.18482  ? 264 ALA A CB  1 
ATOM   1256 N  N   . GLY A 1 160 ? -26.38448 12.98564 9.62597   1.000 7.68089  ? 265 GLY A N   1 
ATOM   1257 C  CA  . GLY A 1 160 ? -26.11580 13.03410 11.04318  1.000 8.13674  ? 265 GLY A CA  1 
ATOM   1258 C  C   . GLY A 1 160 ? -25.33978 11.82992 11.54113  1.000 7.65568  ? 265 GLY A C   1 
ATOM   1259 O  O   . GLY A 1 160 ? -25.41568 10.73017 10.99228  1.000 7.45994  ? 265 GLY A O   1 
ATOM   1260 N  N   A ASN A 1 161 ? -24.54861 12.05524 12.58721  0.597 8.07555  ? 266 ASN A N   1 
ATOM   1261 N  N   B ASN A 1 161 ? -24.59931 12.03447 12.61954  0.403 8.25818  ? 266 ASN A N   1 
ATOM   1262 C  CA  A ASN A 1 161 ? -23.64556 11.03895 13.13603  0.597 8.03118  ? 266 ASN A CA  1 
ATOM   1263 C  CA  B ASN A 1 161 ? -23.67698 11.02646 13.13298  0.403 8.38292  ? 266 ASN A CA  1 
ATOM   1264 C  C   A ASN A 1 161 ? -24.17967 10.38181 14.40587  0.597 8.30629  ? 266 ASN A C   1 
ATOM   1265 C  C   B ASN A 1 161 ? -24.17678 10.36832 14.41500  0.403 8.51983  ? 266 ASN A C   1 
ATOM   1266 O  O   A ASN A 1 161 ? -23.39297 10.11265 15.32791  0.597 8.56336  ? 266 ASN A O   1 
ATOM   1267 O  O   B ASN A 1 161 ? -23.39168 10.08928 15.32837  0.403 8.68129  ? 266 ASN A O   1 
ATOM   1268 C  CB  A ASN A 1 161 ? -22.27030 11.64118 13.40691  0.597 8.14999  ? 266 ASN A CB  1 
ATOM   1269 C  CB  B ASN A 1 161 ? -22.30085 11.63970 13.34404  0.403 8.65656  ? 266 ASN A CB  1 
ATOM   1270 C  CG  A ASN A 1 161 ? -21.57600 12.09878 12.15168  0.597 8.47899  ? 266 ASN A CG  1 
ATOM   1271 C  CG  B ASN A 1 161 ? -21.86037 12.44712 12.16047  0.403 9.07582  ? 266 ASN A CG  1 
ATOM   1272 O  OD1 A ASN A 1 161 ? -22.02631 11.80354 11.04036  0.597 8.45720  ? 266 ASN A OD1 1 
ATOM   1273 O  OD1 B ASN A 1 161 ? -22.03263 12.02351 11.01743  0.403 9.10527  ? 266 ASN A OD1 1 
ATOM   1274 N  ND2 A ASN A 1 161 ? -20.47468 12.84606 12.31871  0.597 8.70033  ? 266 ASN A ND2 1 
ATOM   1275 N  ND2 B ASN A 1 161 ? -21.31062 13.63025 12.41232  0.403 9.51555  ? 266 ASN A ND2 1 
ATOM   1276 N  N   . ASN A 1 162 ? -25.47128 10.07810 14.49277  1.000 9.07275  ? 267 ASN A N   1 
ATOM   1277 C  CA  . ASN A 1 162 ? -26.06304 9.60451  15.73115  1.000 9.96131  ? 267 ASN A CA  1 
ATOM   1278 C  C   . ASN A 1 162 ? -26.35517 8.11944  15.72993  1.000 10.45330 ? 267 ASN A C   1 
ATOM   1279 O  O   . ASN A 1 162 ? -26.96579 7.63197  16.68998  1.000 10.63294 ? 267 ASN A O   1 
ATOM   1280 C  CB  . ASN A 1 162 ? -27.37683 10.37865 15.99211  1.000 11.05924 ? 267 ASN A CB  1 
ATOM   1281 C  CG  . ASN A 1 162 ? -27.21350 11.87027 15.70228  1.000 11.94006 ? 267 ASN A CG  1 
ATOM   1282 O  OD1 . ASN A 1 162 ? -27.54753 12.35746 14.63083  1.000 11.97560 ? 267 ASN A OD1 1 
ATOM   1283 N  ND2 . ASN A 1 162 ? -26.62209 12.57132 16.64591  1.000 13.10514 ? 267 ASN A ND2 1 
ATOM   1284 N  N   . ASN A 1 163 ? -26.01681 7.40523  14.65566  1.000 9.69891  ? 268 ASN A N   1 
ATOM   1285 C  CA  . ASN A 1 163 ? -26.39503 6.00441  14.52547  1.000 9.66692  ? 268 ASN A CA  1 
ATOM   1286 C  C   . ASN A 1 163 ? -27.86343 5.80317  14.87634  1.000 9.87734  ? 268 ASN A C   1 
ATOM   1287 O  O   . ASN A 1 163 ? -28.22712 4.88394  15.62199  1.000 9.83651  ? 268 ASN A O   1 
ATOM   1288 C  CB  . ASN A 1 163 ? -25.50242 5.10338  15.38602  1.000 9.48604  ? 268 ASN A CB  1 
ATOM   1289 C  CG  . ASN A 1 163 ? -25.75208 3.64206  15.13182  1.000 10.59915 ? 268 ASN A CG  1 
ATOM   1290 O  OD1 . ASN A 1 163 ? -26.10717 3.23914  14.01511  1.000 10.33328 ? 268 ASN A OD1 1 
ATOM   1291 N  ND2 . ASN A 1 163 ? -25.64657 2.84189  16.18759  1.000 11.26589 ? 268 ASN A ND2 1 
ATOM   1292 N  N   . ALA A 1 164 ? -28.70389 6.69959  14.34610  1.000 10.40878 ? 269 ALA A N   1 
ATOM   1293 C  CA  . ALA A 1 164 ? -30.11492 6.71145  14.66964  1.000 10.56351 ? 269 ALA A CA  1 
ATOM   1294 C  C   . ALA A 1 164 ? -30.91349 7.07269  13.43025  1.000 9.91289  ? 269 ALA A C   1 
ATOM   1295 O  O   . ALA A 1 164 ? -30.35667 7.35504  12.37060  1.000 9.76986  ? 269 ALA A O   1 
ATOM   1296 C  CB  . ALA A 1 164 ? -30.43735 7.68559  15.81533  1.000 11.75406 ? 269 ALA A CB  1 
ATOM   1297 N  N   . ASP A 1 165 ? -32.24106 7.07510  13.55580  1.000 10.16171 ? 270 ASP A N   1 
ATOM   1298 C  CA  . ASP A 1 165 ? -33.04969 7.40526  12.40670  1.000 10.25997 ? 270 ASP A CA  1 
ATOM   1299 C  C   . ASP A 1 165 ? -32.95222 8.90164  12.16138  1.000 10.01835 ? 270 ASP A C   1 
ATOM   1300 O  O   . ASP A 1 165 ? -33.16733 9.69920  13.08072  1.000 10.61932 ? 270 ASP A O   1 
ATOM   1301 C  CB  . ASP A 1 165 ? -34.50343 7.02560  12.66561  1.000 11.24572 ? 270 ASP A CB  1 
ATOM   1302 C  CG  . ASP A 1 165 ? -35.32119 7.01692  11.37541  1.000 11.63211 ? 270 ASP A CG  1 
ATOM   1303 O  OD1 . ASP A 1 165 ? -35.38687 8.04490  10.68739  1.000 11.70684 ? 270 ASP A OD1 1 
ATOM   1304 O  OD2 . ASP A 1 165 ? -35.94863 5.99189  11.02661  1.000 12.65711 ? 270 ASP A OD2 1 
ATOM   1305 N  N   . ALA A 1 166 ? -32.62104 9.28660  10.92541  1.000 9.96062  ? 271 ALA A N   1 
ATOM   1306 C  CA  . ALA A 1 166 ? -32.46975 10.71050 10.57671  1.000 9.74990  ? 271 ALA A CA  1 
ATOM   1307 C  C   . ALA A 1 166 ? -33.77769 11.50222 10.63186  1.000 9.55556  ? 271 ALA A C   1 
ATOM   1308 O  O   . ALA A 1 166 ? -33.73964 12.71440 10.50227  1.000 9.10800  ? 271 ALA A O   1 
ATOM   1309 C  CB  . ALA A 1 166 ? -31.80625 10.83119 9.20806   1.000 10.85600 ? 271 ALA A CB  1 
ATOM   1310 N  N   . ARG A 1 167 ? -34.93754 10.84898 10.81445  1.000 9.70148  ? 272 ARG A N   1 
ATOM   1311 C  CA  . ARG A 1 167 ? -36.20874 11.56853 10.92930  1.000 10.15492 ? 272 ARG A CA  1 
ATOM   1312 C  C   . ARG A 1 167 ? -36.19049 12.56237 12.08988  1.000 9.81232  ? 272 ARG A C   1 
ATOM   1313 O  O   . ARG A 1 167 ? -36.97226 13.51808 12.07372  1.000 9.90044  ? 272 ARG A O   1 
ATOM   1314 C  CB  . ARG A 1 167 ? -37.36447 10.56780 11.12158  1.000 11.77277 ? 272 ARG A CB  1 
ATOM   1315 C  CG  . ARG A 1 167 ? -37.36585 9.83623  12.47658  1.000 13.29911 ? 272 ARG A CG  1 
ATOM   1316 C  CD  . ARG A 1 167 ? -38.26716 8.56512  12.49024  1.000 15.54224 ? 272 ARG A CD  1 
ATOM   1317 N  NE  . ARG A 1 167 ? -39.67141 8.86175  12.23525  1.000 17.49836 ? 272 ARG A NE  1 
ATOM   1318 C  CZ  . ARG A 1 167 ? -40.58054 7.92285  12.00922  1.000 19.39559 ? 272 ARG A CZ  1 
ATOM   1319 N  NH1 . ARG A 1 167 ? -40.25093 6.63757  11.98858  1.000 20.06336 ? 272 ARG A NH1 1 
ATOM   1320 N  NH2 . ARG A 1 167 ? -41.85319 8.28044  11.81487  1.000 19.69551 ? 272 ARG A NH2 1 
ATOM   1321 N  N   . ASN A 1 168 ? -35.29140 12.38778 13.05879  1.000 9.48870  ? 273 ASN A N   1 
ATOM   1322 C  CA  . ASN A 1 168 ? -35.25056 13.21574 14.26051  1.000 9.73564  ? 273 ASN A CA  1 
ATOM   1323 C  C   . ASN A 1 168 ? -34.16838 14.28539 14.20184  1.000 9.39621  ? 273 ASN A C   1 
ATOM   1324 O  O   . ASN A 1 168 ? -33.82854 14.86821 15.24095  1.000 9.43491  ? 273 ASN A O   1 
ATOM   1325 C  CB  . ASN A 1 168 ? -35.05294 12.36133 15.52449  1.000 10.02821 ? 273 ASN A CB  1 
ATOM   1326 C  CG  . ASN A 1 168 ? -36.31212 11.58483 15.89841  1.000 11.12943 ? 273 ASN A CG  1 
ATOM   1327 O  OD1 . ASN A 1 168 ? -36.23963 10.41313 16.32904  1.000 10.92801 ? 273 ASN A OD1 1 
ATOM   1328 N  ND2 . ASN A 1 168 ? -37.46655 12.22053 15.75509  1.000 11.96720 ? 273 ASN A ND2 1 
ATOM   1329 N  N   . TYR A 1 169 ? -33.64929 14.59577 13.01350  1.000 8.85871  ? 274 TYR A N   1 
ATOM   1330 C  CA  . TYR A 1 169 ? -32.53938 15.52799 12.87164  1.000 8.96802  ? 274 TYR A CA  1 
ATOM   1331 C  C   . TYR A 1 169 ? -32.83316 16.47218 11.72382  1.000 7.69847  ? 274 TYR A C   1 
ATOM   1332 O  O   . TYR A 1 169 ? -33.55409 16.11160 10.79880  1.000 8.64346  ? 274 TYR A O   1 
ATOM   1333 C  CB  . TYR A 1 169 ? -31.24731 14.71891 12.61264  1.000 10.44507 ? 274 TYR A CB  1 
ATOM   1334 C  CG  . TYR A 1 169 ? -30.93117 13.89836 13.84012  1.000 11.42373 ? 274 TYR A CG  1 
ATOM   1335 C  CD1 . TYR A 1 169 ? -30.28924 14.48990 14.93203  1.000 11.86862 ? 274 TYR A CD1 1 
ATOM   1336 C  CD2 . TYR A 1 169 ? -31.34744 12.56844 13.95916  1.000 11.59326 ? 274 TYR A CD2 1 
ATOM   1337 C  CE1 . TYR A 1 169 ? -30.03755 13.78273 16.08798  1.000 12.25941 ? 274 TYR A CE1 1 
ATOM   1338 C  CE2 . TYR A 1 169 ? -31.10240 11.84512 15.13895  1.000 11.76304 ? 274 TYR A CE2 1 
ATOM   1339 C  CZ  . TYR A 1 169 ? -30.43921 12.45792 16.19530  1.000 12.28360 ? 274 TYR A CZ  1 
ATOM   1340 O  OH  . TYR A 1 169 ? -30.16659 11.76754 17.35195  1.000 12.86546 ? 274 TYR A OH  1 
ATOM   1341 N  N   . SER A 1 170 ? -32.30369 17.68889 11.79214  1.000 7.59153  ? 275 SER A N   1 
ATOM   1342 C  CA  . SER A 1 170 ? -32.54296 18.64493 10.73207  1.000 7.50239  ? 275 SER A CA  1 
ATOM   1343 C  C   . SER A 1 170 ? -31.22941 19.30839 10.34410  1.000 7.59505  ? 275 SER A C   1 
ATOM   1344 O  O   . SER A 1 170 ? -30.37634 19.54756 11.20141  1.000 8.21840  ? 275 SER A O   1 
ATOM   1345 C  CB  . SER A 1 170 ? -33.51787 19.73879 11.19211  1.000 7.34773  ? 275 SER A CB  1 
ATOM   1346 O  OG  . SER A 1 170 ? -34.80670 19.20128 11.24509  1.000 7.67656  ? 275 SER A OG  1 
ATOM   1347 N  N   . PRO A 1 171 ? -31.05421 19.65212 9.06152   1.000 7.61246  ? 276 PRO A N   1 
ATOM   1348 C  CA  . PRO A 1 171 ? -32.02868 19.51865 7.97158   1.000 6.54635  ? 276 PRO A CA  1 
ATOM   1349 C  C   . PRO A 1 171 ? -32.12468 18.11574 7.40283   1.000 6.09595  ? 276 PRO A C   1 
ATOM   1350 O  O   . PRO A 1 171 ? -32.81861 17.93197 6.42483   1.000 6.82527  ? 276 PRO A O   1 
ATOM   1351 C  CB  . PRO A 1 171 ? -31.51995 20.52269 6.92379   1.000 6.86033  ? 276 PRO A CB  1 
ATOM   1352 C  CG  . PRO A 1 171 ? -30.00318 20.49513 7.16021   1.000 7.60428  ? 276 PRO A CG  1 
ATOM   1353 C  CD  . PRO A 1 171 ? -29.87153 20.42502 8.63794   1.000 7.86549  ? 276 PRO A CD  1 
ATOM   1354 N  N   . ALA A 1 172 ? -31.47170 17.12095 8.02120   1.000 6.34259  ? 277 ALA A N   1 
ATOM   1355 C  CA  . ALA A 1 172 ? -31.51448 15.77227 7.47285   1.000 7.00921  ? 277 ALA A CA  1 
ATOM   1356 C  C   . ALA A 1 172 ? -32.93383 15.32676 7.13298   1.000 6.79364  ? 277 ALA A C   1 
ATOM   1357 O  O   . ALA A 1 172 ? -33.15999 14.68853 6.09646   1.000 5.65694  ? 277 ALA A O   1 
ATOM   1358 C  CB  . ALA A 1 172 ? -30.97134 14.79864 8.52294   1.000 7.82562  ? 277 ALA A CB  1 
ATOM   1359 N  N   . SER A 1 173 ? -33.89180 15.60471 8.00581   1.000 6.81542  ? 278 SER A N   1 
ATOM   1360 C  CA  . SER A 1 173 ? -35.24683 15.09648 7.83832   1.000 7.60333  ? 278 SER A CA  1 
ATOM   1361 C  C   . SER A 1 173 ? -36.09371 15.87501 6.83408   1.000 7.81342  ? 278 SER A C   1 
ATOM   1362 O  O   . SER A 1 173 ? -37.21388 15.47636 6.55719   1.000 8.15195  ? 278 SER A O   1 
ATOM   1363 C  CB  . SER A 1 173 ? -35.94782 15.02887 9.20413   1.000 7.86010  ? 278 SER A CB  1 
ATOM   1364 O  OG  . SER A 1 173 ? -35.99356 16.31641 9.83543   1.000 7.92748  ? 278 SER A OG  1 
ATOM   1365 N  N   . GLU A 1 174 ? -35.60045 16.94980 6.25761   1.000 7.60383  ? 279 GLU A N   1 
ATOM   1366 C  CA  . GLU A 1 174 ? -36.36023 17.60500 5.20177   1.000 7.00411  ? 279 GLU A CA  1 
ATOM   1367 C  C   . GLU A 1 174 ? -36.45015 16.70776 3.96922   1.000 6.75771  ? 279 GLU A C   1 
ATOM   1368 O  O   . GLU A 1 174 ? -35.42785 16.46867 3.31625   1.000 6.50394  ? 279 GLU A O   1 
ATOM   1369 C  CB  . GLU A 1 174 ? -35.76592 18.98491 4.88453   1.000 6.07887  ? 279 GLU A CB  1 
ATOM   1370 C  CG  . GLU A 1 174 ? -36.32742 19.66274 3.61178   1.000 6.52112  ? 279 GLU A CG  1 
ATOM   1371 C  CD  . GLU A 1 174 ? -37.84390 19.69260 3.58284   1.000 7.46329  ? 279 GLU A CD  1 
ATOM   1372 O  OE1 . GLU A 1 174 ? -38.44272 19.90605 4.64709   1.000 8.07498  ? 279 GLU A OE1 1 
ATOM   1373 O  OE2 . GLU A 1 174 ? -38.41209 19.45312 2.50566   1.000 7.51016  ? 279 GLU A OE2 1 
ATOM   1374 N  N   . PRO A 1 175 ? -37.64125 16.26281 3.56051   1.000 7.62212  ? 280 PRO A N   1 
ATOM   1375 C  CA  . PRO A 1 175 ? -37.71869 15.31297 2.42629   1.000 8.13177  ? 280 PRO A CA  1 
ATOM   1376 C  C   . PRO A 1 175 ? -37.17809 15.85937 1.10863   1.000 7.60026  ? 280 PRO A C   1 
ATOM   1377 O  O   . PRO A 1 175 ? -36.60912 15.09786 0.31111   1.000 7.12080  ? 280 PRO A O   1 
ATOM   1378 C  CB  . PRO A 1 175 ? -39.22768 15.02981 2.31220   1.000 9.39105  ? 280 PRO A CB  1 
ATOM   1379 C  CG  . PRO A 1 175 ? -39.73937 15.39503 3.62961   1.000 10.41838 ? 280 PRO A CG  1 
ATOM   1380 C  CD  . PRO A 1 175 ? -38.95162 16.47888 4.19568   1.000 8.24921  ? 280 PRO A CD  1 
ATOM   1381 N  N   . SER A 1 176 ? -37.34755 17.15667 0.85438   1.000 6.93377  ? 281 SER A N   1 
ATOM   1382 C  CA  . SER A 1 176 ? -37.08989 17.64648 -0.47581  1.000 6.48413  ? 281 SER A CA  1 
ATOM   1383 C  C   . SER A 1 176 ? -35.62305 17.88448 -0.78992  1.000 6.41449  ? 281 SER A C   1 
ATOM   1384 O  O   . SER A 1 176 ? -35.33260 18.22589 -1.93612  1.000 7.06959  ? 281 SER A O   1 
ATOM   1385 C  CB  . SER A 1 176 ? -37.89027 18.92514 -0.76415  1.000 7.50374  ? 281 SER A CB  1 
ATOM   1386 O  OG  . SER A 1 176 ? -37.43888 19.98343 0.07912   1.000 7.51540  ? 281 SER A OG  1 
ATOM   1387 N  N   . VAL A 1 177 ? -34.70797 17.77425 0.19049   1.000 6.00456  ? 282 VAL A N   1 
ATOM   1388 C  CA  . VAL A 1 177 ? -33.28666 17.92519 -0.11407  1.000 6.30153  ? 282 VAL A CA  1 
ATOM   1389 C  C   . VAL A 1 177 ? -32.66506 16.53222 -0.25870  1.000 6.21778  ? 282 VAL A C   1 
ATOM   1390 O  O   . VAL A 1 177 ? -33.37815 15.52066 -0.23011  1.000 7.04390  ? 282 VAL A O   1 
ATOM   1391 C  CB  . VAL A 1 177 ? -32.59361 18.75959 0.97576   1.000 6.24059  ? 282 VAL A CB  1 
ATOM   1392 C  CG1 . VAL A 1 177 ? -33.27529 20.13287 1.04329   1.000 6.05467  ? 282 VAL A CG1 1 
ATOM   1393 C  CG2 . VAL A 1 177 ? -32.72220 18.09147 2.34377   1.000 7.40062  ? 282 VAL A CG2 1 
ATOM   1394 N  N   . CYS A 1 178 ? -31.33608 16.46880 -0.43372  1.000 6.32195  ? 283 CYS A N   1 
ATOM   1395 C  CA  . CYS A 1 178 ? -30.61852 15.20867 -0.61653  1.000 6.49890  ? 283 CYS A CA  1 
ATOM   1396 C  C   . CYS A 1 178 ? -29.90123 14.87995 0.69266   1.000 6.59644  ? 283 CYS A C   1 
ATOM   1397 O  O   . CYS A 1 178 ? -28.86665 15.48329 1.01921   1.000 6.71790  ? 283 CYS A O   1 
ATOM   1398 C  CB  . CYS A 1 178 ? -29.63791 15.31362 -1.79400  1.000 6.91519  ? 283 CYS A CB  1 
ATOM   1399 S  SG  . CYS A 1 178 ? -29.29374 13.74936 -2.58276  1.000 7.47025  ? 283 CYS A SG  1 
ATOM   1400 N  N   . THR A 1 179 ? -30.46608 13.93721 1.45895   1.000 6.88939  ? 284 THR A N   1 
ATOM   1401 C  CA  . THR A 1 179 ? -29.92952 13.56094 2.74693   1.000 7.09631  ? 284 THR A CA  1 
ATOM   1402 C  C   . THR A 1 179 ? -28.92622 12.41164 2.58429   1.000 6.35845  ? 284 THR A C   1 
ATOM   1403 O  O   . THR A 1 179 ? -29.24578 11.36166 1.98805   1.000 6.18224  ? 284 THR A O   1 
ATOM   1404 C  CB  . THR A 1 179 ? -31.09358 13.17054 3.65219   1.000 7.67509  ? 284 THR A CB  1 
ATOM   1405 O  OG1 . THR A 1 179 ? -31.98312 14.28555 3.80558   1.000 6.87566  ? 284 THR A OG1 1 
ATOM   1406 C  CG2 . THR A 1 179 ? -30.62672 12.69710 5.00038   1.000 8.53910  ? 284 THR A CG2 1 
ATOM   1407 N  N   . VAL A 1 180 ? -27.70945 12.60219 3.09192   1.000 6.82081  ? 285 VAL A N   1 
ATOM   1408 C  CA  . VAL A 1 180 ? -26.55012 11.77586 2.73073   1.000 6.62844  ? 285 VAL A CA  1 
ATOM   1409 C  C   . VAL A 1 180 ? -26.03528 11.02128 3.95932   1.000 6.15185  ? 285 VAL A C   1 
ATOM   1410 O  O   . VAL A 1 180 ? -25.57012 11.64483 4.91266   1.000 6.64012  ? 285 VAL A O   1 
ATOM   1411 C  CB  . VAL A 1 180 ? -25.43889 12.64276 2.13129   1.000 6.96364  ? 285 VAL A CB  1 
ATOM   1412 C  CG1 . VAL A 1 180 ? -24.25421 11.76981 1.72896   1.000 6.82868  ? 285 VAL A CG1 1 
ATOM   1413 C  CG2 . VAL A 1 180 ? -25.98872 13.48473 0.94019   1.000 7.22713  ? 285 VAL A CG2 1 
ATOM   1414 N  N   . GLY A 1 181 ? -26.09137 9.64561  3.92020   1.000 6.10785  ? 286 GLY A N   1 
ATOM   1415 C  CA  . GLY A 1 181 ? -25.41943 8.80816  4.90568   1.000 6.49078  ? 286 GLY A CA  1 
ATOM   1416 C  C   . GLY A 1 181 ? -23.99472 8.53501  4.52728   1.000 6.40300  ? 286 GLY A C   1 
ATOM   1417 O  O   . GLY A 1 181 ? -23.54846 8.89975  3.46093   1.000 5.94139  ? 286 GLY A O   1 
ATOM   1418 N  N   . ALA A 1 182 ? -23.24966 7.93243  5.45809   1.000 7.02122  ? 287 ALA A N   1 
ATOM   1419 C  CA  . ALA A 1 182 ? -21.80006 7.74090  5.33860   1.000 6.98993  ? 287 ALA A CA  1 
ATOM   1420 C  C   . ALA A 1 182 ? -21.47213 6.25235  5.23388   1.000 6.50700  ? 287 ALA A C   1 
ATOM   1421 O  O   . ALA A 1 182 ? -22.08543 5.43300  5.91988   1.000 7.20739  ? 287 ALA A O   1 
ATOM   1422 C  CB  . ALA A 1 182 ? -21.02631 8.33755  6.54012   1.000 6.87068  ? 287 ALA A CB  1 
ATOM   1423 N  N   . SER A 1 183 ? -20.48132 5.91382  4.38155   1.000 6.23869  ? 288 SER A N   1 
ATOM   1424 C  CA  . SER A 1 183 ? -19.99198 4.55111  4.31336   1.000 7.72012  ? 288 SER A CA  1 
ATOM   1425 C  C   . SER A 1 183 ? -18.48064 4.53758  4.50797   1.000 7.32187  ? 288 SER A C   1 
ATOM   1426 O  O   . SER A 1 183 ? -17.80159 5.57368  4.45022   1.000 7.34647  ? 288 SER A O   1 
ATOM   1427 C  CB  . SER A 1 183 ? -20.31100 3.92966  2.96849   1.000 8.49027  ? 288 SER A CB  1 
ATOM   1428 O  OG  . SER A 1 183 ? -19.67947 4.63993  1.94467   1.000 8.48236  ? 288 SER A OG  1 
ATOM   1429 N  N   . ASP A 1 184 ? -17.92785 3.34034  4.69597   1.000 8.25461  ? 289 ASP A N   1 
ATOM   1430 C  CA  . ASP A 1 184 ? -16.50313 3.22480  4.88760   1.000 7.86777  ? 289 ASP A CA  1 
ATOM   1431 C  C   . ASP A 1 184 ? -15.88486 2.47352  3.72714   1.000 8.57802  ? 289 ASP A C   1 
ATOM   1432 O  O   . ASP A 1 184 ? -16.57260 1.95938  2.85880   1.000 8.46571  ? 289 ASP A O   1 
ATOM   1433 C  CB  . ASP A 1 184 ? -16.17396 2.58735  6.24350   1.000 8.01048  ? 289 ASP A CB  1 
ATOM   1434 C  CG  . ASP A 1 184 ? -16.44493 1.06440  6.32957   1.000 9.00505  ? 289 ASP A CG  1 
ATOM   1435 O  OD1 . ASP A 1 184 ? -16.59994 0.35141  5.32033   1.000 9.63067  ? 289 ASP A OD1 1 
ATOM   1436 O  OD2 . ASP A 1 184 ? -16.46527 0.60538  7.49060   1.000 9.26132  ? 289 ASP A OD2 1 
ATOM   1437 N  N   . ARG A 1 185 ? -14.55727 2.35113  3.77161   1.000 8.94989  ? 290 ARG A N   1 
ATOM   1438 C  CA  . ARG A 1 185 ? -13.86122 1.83613  2.61026   1.000 9.76584  ? 290 ARG A CA  1 
ATOM   1439 C  C   . ARG A 1 185 ? -14.14102 0.36495  2.34435   1.000 9.29918  ? 290 ARG A C   1 
ATOM   1440 O  O   . ARG A 1 185 ? -13.72341 -0.12128 1.28909   1.000 9.19518  ? 290 ARG A O   1 
ATOM   1441 C  CB  . ARG A 1 185 ? -12.35837 2.08122  2.72596   1.000 11.83711 ? 290 ARG A CB  1 
ATOM   1442 C  CG  . ARG A 1 185 ? -11.65050 1.08863  3.58365   1.000 14.22140 ? 290 ARG A CG  1 
ATOM   1443 C  CD  . ARG A 1 185 ? -10.13262 1.25488  3.45535   1.000 16.67190 ? 290 ARG A CD  1 
ATOM   1444 N  NE  . ARG A 1 185 ? -9.64099  2.51415  3.98072   1.000 18.79796 ? 290 ARG A NE  1 
ATOM   1445 C  CZ  . ARG A 1 185 ? -8.80052  3.29765  3.31557   1.000 21.02103 ? 290 ARG A CZ  1 
ATOM   1446 N  NH1 . ARG A 1 185 ? -8.38403  2.98317  2.09001   1.000 21.75867 ? 290 ARG A NH1 1 
ATOM   1447 N  NH2 . ARG A 1 185 ? -8.37010  4.42084  3.89111   1.000 22.02708 ? 290 ARG A NH2 1 
ATOM   1448 N  N   . TYR A 1 186 ? -14.75800 -0.36164 3.27507   1.000 9.77410  ? 291 TYR A N   1 
ATOM   1449 C  CA  . TYR A 1 186 ? -15.16420 -1.73292 3.02655   1.000 11.07507 ? 291 TYR A CA  1 
ATOM   1450 C  C   . TYR A 1 186 ? -16.62592 -1.83548 2.64785   1.000 10.73137 ? 291 TYR A C   1 
ATOM   1451 O  O   . TYR A 1 186 ? -17.18251 -2.92804 2.69218   1.000 10.98987 ? 291 TYR A O   1 
ATOM   1452 C  CB  . TYR A 1 186 ? -14.80598 -2.64241 4.21160   1.000 13.50446 ? 291 TYR A CB  1 
ATOM   1453 C  CG  . TYR A 1 186 ? -13.31732 -2.62391 4.46026   1.000 14.96711 ? 291 TYR A CG  1 
ATOM   1454 C  CD1 . TYR A 1 186 ? -12.46675 -3.47304 3.77930   1.000 15.89469 ? 291 TYR A CD1 1 
ATOM   1455 C  CD2 . TYR A 1 186 ? -12.76595 -1.75019 5.36912   1.000 15.63880 ? 291 TYR A CD2 1 
ATOM   1456 C  CE1 . TYR A 1 186 ? -11.09054 -3.44621 4.01205   1.000 17.00725 ? 291 TYR A CE1 1 
ATOM   1457 C  CE2 . TYR A 1 186 ? -11.41369 -1.69357 5.59985   1.000 16.78889 ? 291 TYR A CE2 1 
ATOM   1458 C  CZ  . TYR A 1 186 ? -10.58431 -2.52980 4.92812   1.000 17.50764 ? 291 TYR A CZ  1 
ATOM   1459 O  OH  . TYR A 1 186 ? -9.23923  -2.46117 5.20357   1.000 18.15809 ? 291 TYR A OH  1 
ATOM   1460 N  N   . ASP A 1 187 ? -17.27039 -0.71186 2.30757   1.000 11.15521 ? 292 ASP A N   1 
ATOM   1461 C  CA  . ASP A 1 187 ? -18.68410 -0.68529 1.91659   1.000 11.23527 ? 292 ASP A CA  1 
ATOM   1462 C  C   . ASP A 1 187 ? -19.61301 -1.08905 3.05071   1.000 11.04724 ? 292 ASP A C   1 
ATOM   1463 O  O   . ASP A 1 187 ? -20.67159 -1.67147 2.80986   1.000 11.62477 ? 292 ASP A O   1 
ATOM   1464 C  CB  . ASP A 1 187 ? -18.95969 -1.54493 0.68717   1.000 11.52368 ? 292 ASP A CB  1 
ATOM   1465 C  CG  . ASP A 1 187 ? -18.64915 -0.84589 -0.60671  1.000 12.23334 ? 292 ASP A CG  1 
ATOM   1466 O  OD1 . ASP A 1 187 ? -18.25841 0.33975  -0.58608  1.000 12.30635 ? 292 ASP A OD1 1 
ATOM   1467 O  OD2 . ASP A 1 187 ? -18.79186 -1.50344 -1.66624  1.000 12.94805 ? 292 ASP A OD2 1 
ATOM   1468 N  N   . ARG A 1 188 ? -19.21184 -0.82332 4.29184   1.000 10.57807 ? 293 ARG A N   1 
ATOM   1469 C  CA  . ARG A 1 188 ? -20.13675 -0.87871 5.41342   1.000 10.92642 ? 293 ARG A CA  1 
ATOM   1470 C  C   . ARG A 1 188 ? -20.70158 0.51572  5.65343   1.000 10.11501 ? 293 ARG A C   1 
ATOM   1471 O  O   . ARG A 1 188 ? -19.99102 1.50838  5.50082   1.000 10.28094 ? 293 ARG A O   1 
ATOM   1472 C  CB  . ARG A 1 188 ? -19.37261 -1.30011 6.67313   1.000 11.80447 ? 293 ARG A CB  1 
ATOM   1473 C  CG  . ARG A 1 188 ? -18.63168 -2.63825 6.51391   1.000 12.96140 ? 293 ARG A CG  1 
ATOM   1474 C  CD  . ARG A 1 188 ? -17.94743 -3.01823 7.79854   1.000 14.01037 ? 293 ARG A CD  1 
ATOM   1475 N  NE  . ARG A 1 188 ? -16.77378 -2.18383 7.99981   1.000 14.59953 ? 293 ARG A NE  1 
ATOM   1476 C  CZ  . ARG A 1 188 ? -15.56060 -2.62898 8.30695   1.000 14.80688 ? 293 ARG A CZ  1 
ATOM   1477 N  NH1 . ARG A 1 188 ? -15.32194 -3.91810 8.51091   1.000 14.79171 ? 293 ARG A NH1 1 
ATOM   1478 N  NH2 . ARG A 1 188 ? -14.56641 -1.75320 8.41149   1.000 14.69326 ? 293 ARG A NH2 1 
ATOM   1479 N  N   . ARG A 1 189 ? -21.97840 0.59116  6.04750   1.000 10.38711 ? 294 ARG A N   1 
ATOM   1480 C  CA  . ARG A 1 189 ? -22.46906 1.83895  6.61997   1.000 10.14443 ? 294 ARG A CA  1 
ATOM   1481 C  C   . ARG A 1 189 ? -21.49946 2.25849  7.70887   1.000 9.64751  ? 294 ARG A C   1 
ATOM   1482 O  O   . ARG A 1 189 ? -21.12243 1.44685  8.55696   1.000 9.98639  ? 294 ARG A O   1 
ATOM   1483 C  CB  . ARG A 1 189 ? -23.84811 1.62496  7.27552   1.000 10.96130 ? 294 ARG A CB  1 
ATOM   1484 C  CG  . ARG A 1 189 ? -24.39970 2.94229  7.90628   1.000 11.60676 ? 294 ARG A CG  1 
ATOM   1485 C  CD  . ARG A 1 189 ? -25.86781 2.84328  8.28226   1.000 12.41615 ? 294 ARG A CD  1 
ATOM   1486 N  NE  . ARG A 1 189 ? -26.07451 1.76189  9.22880   1.000 13.39000 ? 294 ARG A NE  1 
ATOM   1487 C  CZ  . ARG A 1 189 ? -26.03173 1.89393  10.55270  1.000 14.34733 ? 294 ARG A CZ  1 
ATOM   1488 N  NH1 . ARG A 1 189 ? -25.80618 3.07087  11.13136  1.000 14.45033 ? 294 ARG A NH1 1 
ATOM   1489 N  NH2 . ARG A 1 189 ? -26.23270 0.81632  11.31357  1.000 15.07847 ? 294 ARG A NH2 1 
ATOM   1490 N  N   . SER A 1 190 ? -21.09114 3.52829  7.69574   1.000 9.24120  ? 295 SER A N   1 
ATOM   1491 C  CA  . SER A 1 190 ? -20.18848 3.96098  8.75153   1.000 9.05463  ? 295 SER A CA  1 
ATOM   1492 C  C   . SER A 1 190 ? -20.86506 3.77964  10.10264  1.000 9.67022  ? 295 SER A C   1 
ATOM   1493 O  O   . SER A 1 190 ? -22.08466 3.92371  10.23255  1.000 9.49127  ? 295 SER A O   1 
ATOM   1494 C  CB  . SER A 1 190 ? -19.82856 5.43759  8.57759   1.000 8.95690  ? 295 SER A CB  1 
ATOM   1495 O  OG  . SER A 1 190 ? -19.22297 5.66218  7.32440   1.000 9.68456  ? 295 SER A OG  1 
ATOM   1496 N  N   . SER A 1 191 ? -20.05581 3.47049  11.12656  1.000 10.61696 ? 296 SER A N   1 
ATOM   1497 C  CA  . SER A 1 191 ? -20.62654 3.03713  12.39872  1.000 11.40821 ? 296 SER A CA  1 
ATOM   1498 C  C   . SER A 1 191 ? -21.49555 4.12297  13.01673  1.000 10.31124 ? 296 SER A C   1 
ATOM   1499 O  O   . SER A 1 191 ? -22.47233 3.81696  13.71528  1.000 10.14203 ? 296 SER A O   1 
ATOM   1500 C  CB  . SER A 1 191 ? -19.52989 2.58886  13.38187  1.000 12.97803 ? 296 SER A CB  1 
ATOM   1501 O  OG  . SER A 1 191 ? -18.71640 3.68376  13.76274  1.000 13.90295 ? 296 SER A OG  1 
ATOM   1502 N  N   . PHE A 1 192 ? -21.17676 5.39811  12.73988  1.000 9.66970  ? 297 PHE A N   1 
ATOM   1503 C  CA  . PHE A 1 192 ? -21.92116 6.52775  13.29268  1.000 9.95311  ? 297 PHE A CA  1 
ATOM   1504 C  C   . PHE A 1 192 ? -23.07137 6.98758  12.41457  1.000 9.47833  ? 297 PHE A C   1 
ATOM   1505 O  O   . PHE A 1 192 ? -23.83967 7.83931  12.85514  1.000 9.22265  ? 297 PHE A O   1 
ATOM   1506 C  CB  . PHE A 1 192 ? -20.99203 7.73781  13.44594  1.000 10.47474 ? 297 PHE A CB  1 
ATOM   1507 C  CG  . PHE A 1 192 ? -20.13075 7.98134  12.22922  1.000 10.01201 ? 297 PHE A CG  1 
ATOM   1508 C  CD1 . PHE A 1 192 ? -20.63987 8.69357  11.12542  1.000 9.59124  ? 297 PHE A CD1 1 
ATOM   1509 C  CD2 . PHE A 1 192 ? -18.83311 7.41659  12.14116  1.000 9.71814  ? 297 PHE A CD2 1 
ATOM   1510 C  CE1 . PHE A 1 192 ? -19.88329 8.84974  10.00421  1.000 9.73811  ? 297 PHE A CE1 1 
ATOM   1511 C  CE2 . PHE A 1 192 ? -18.06905 7.57291  11.01157  1.000 9.99766  ? 297 PHE A CE2 1 
ATOM   1512 C  CZ  . PHE A 1 192 ? -18.57743 8.27326  9.93314   1.000 10.14765 ? 297 PHE A CZ  1 
ATOM   1513 N  N   . SER A 1 193 ? -23.19028 6.49402  11.18639  1.000 8.17101  ? 298 SER A N   1 
ATOM   1514 C  CA  . SER A 1 193 ? -24.07636 7.14662  10.22981  1.000 7.66556  ? 298 SER A CA  1 
ATOM   1515 C  C   . SER A 1 193 ? -25.52883 6.97620  10.63531  1.000 6.92168  ? 298 SER A C   1 
ATOM   1516 O  O   . SER A 1 193 ? -25.95534 5.89019  11.03719  1.000 7.85284  ? 298 SER A O   1 
ATOM   1517 C  CB  . SER A 1 193 ? -23.90187 6.52256  8.85181   1.000 8.04467  ? 298 SER A CB  1 
ATOM   1518 O  OG  . SER A 1 193 ? -24.75969 7.20248  7.95545   1.000 8.38143  ? 298 SER A OG  1 
ATOM   1519 N  N   . ASN A 1 194 ? -26.30551 8.04504  10.49645  1.000 7.01083  ? 299 ASN A N   1 
ATOM   1520 C  CA  . ASN A 1 194 ? -27.73511 7.86646  10.62415  1.000 7.74062  ? 299 ASN A CA  1 
ATOM   1521 C  C   . ASN A 1 194 ? -28.25537 7.06841  9.44404   1.000 8.25877  ? 299 ASN A C   1 
ATOM   1522 O  O   . ASN A 1 194 ? -27.57132 6.88170  8.44576   1.000 8.72699  ? 299 ASN A O   1 
ATOM   1523 C  CB  . ASN A 1 194 ? -28.43475 9.23161  10.70530  1.000 8.42289  ? 299 ASN A CB  1 
ATOM   1524 C  CG  . ASN A 1 194 ? -28.31733 9.86766  12.06721  1.000 8.54323  ? 299 ASN A CG  1 
ATOM   1525 O  OD1 . ASN A 1 194 ? -27.90491 9.20971  13.03314  1.000 8.38894  ? 299 ASN A OD1 1 
ATOM   1526 N  ND2 . ASN A 1 194 ? -28.67819 11.13122 12.17454  1.000 8.95784  ? 299 ASN A ND2 1 
ATOM   1527 N  N   . TYR A 1 195 ? -29.50948 6.65933  9.56310   1.000 7.89722  ? 300 TYR A N   1 
ATOM   1528 C  CA  . TYR A 1 195 ? -30.16073 5.81145  8.58201   1.000 8.97907  ? 300 TYR A CA  1 
ATOM   1529 C  C   . TYR A 1 195 ? -31.63161 6.22282  8.57555   1.000 9.58353  ? 300 TYR A C   1 
ATOM   1530 O  O   . TYR A 1 195 ? -32.00858 7.24621  9.15451   1.000 9.96521  ? 300 TYR A O   1 
ATOM   1531 C  CB  . TYR A 1 195 ? -29.94942 4.32769  8.93796   1.000 9.84750  ? 300 TYR A CB  1 
ATOM   1532 C  CG  . TYR A 1 195 ? -30.33751 4.01326  10.35377  1.000 10.60048 ? 300 TYR A CG  1 
ATOM   1533 C  CD1 . TYR A 1 195 ? -31.67206 3.74455  10.67680  1.000 11.96288 ? 300 TYR A CD1 1 
ATOM   1534 C  CD2 . TYR A 1 195 ? -29.39397 4.03481  11.38813  1.000 11.83586 ? 300 TYR A CD2 1 
ATOM   1535 C  CE1 . TYR A 1 195 ? -32.05815 3.49205  11.98673  1.000 13.31977 ? 300 TYR A CE1 1 
ATOM   1536 C  CE2 . TYR A 1 195 ? -29.76213 3.76689  12.68215  1.000 12.41566 ? 300 TYR A CE2 1 
ATOM   1537 C  CZ  . TYR A 1 195 ? -31.09809 3.49748  12.99256  1.000 13.76567 ? 300 TYR A CZ  1 
ATOM   1538 O  OH  . TYR A 1 195 ? -31.48446 3.24217  14.31411  1.000 14.17699 ? 300 TYR A OH  1 
ATOM   1539 N  N   . GLY A 1 196 ? -32.47902 5.43626  7.94154   1.000 9.96508  ? 301 GLY A N   1 
ATOM   1540 C  CA  . GLY A 1 196 ? -33.89868 5.73583  7.92621   1.000 10.01618 ? 301 GLY A CA  1 
ATOM   1541 C  C   . GLY A 1 196 ? -34.41112 6.00374  6.52451   1.000 10.38622 ? 301 GLY A C   1 
ATOM   1542 O  O   . GLY A 1 196 ? -33.65712 6.17714  5.57113   1.000 9.63108  ? 301 GLY A O   1 
ATOM   1543 N  N   . SER A 1 197 ? -35.74163 6.05453  6.42921   1.000 11.50853 ? 302 SER A N   1 
ATOM   1544 C  CA  . SER A 1 197 ? -36.40457 6.25318  5.14538   1.000 11.38877 ? 302 SER A CA  1 
ATOM   1545 C  C   . SER A 1 197 ? -36.04719 7.58514  4.48182   1.000 10.28049 ? 302 SER A C   1 
ATOM   1546 O  O   . SER A 1 197 ? -36.13783 7.69368  3.25795   1.000 10.58669 ? 302 SER A O   1 
ATOM   1547 C  CB  . SER A 1 197 ? -37.93113 6.16938  5.31898   1.000 12.43063 ? 302 SER A CB  1 
ATOM   1548 O  OG  . SER A 1 197 ? -38.32467 7.15738  6.26585   1.000 13.88705 ? 302 SER A OG  1 
ATOM   1549 N  N   . VAL A 1 198 ? -35.64174 8.60175  5.24805   1.000 9.19379  ? 303 VAL A N   1 
ATOM   1550 C  CA  . VAL A 1 198 ? -35.39861 9.88674  4.58966   1.000 8.73611  ? 303 VAL A CA  1 
ATOM   1551 C  C   . VAL A 1 198 ? -34.05534 9.95893  3.89100   1.000 8.29105  ? 303 VAL A C   1 
ATOM   1552 O  O   . VAL A 1 198 ? -33.81735 10.89678 3.10457   1.000 8.27139  ? 303 VAL A O   1 
ATOM   1553 C  CB  . VAL A 1 198 ? -35.58790 11.04102 5.59086   1.000 9.26574  ? 303 VAL A CB  1 
ATOM   1554 C  CG1 . VAL A 1 198 ? -34.42372 11.10098 6.57584   1.000 9.60333  ? 303 VAL A CG1 1 
ATOM   1555 C  CG2 . VAL A 1 198 ? -35.85953 12.40269 4.87599   1.000 9.28206  ? 303 VAL A CG2 1 
ATOM   1556 N  N   . LEU A 1 199 ? -33.15025 9.02900  4.16309   1.000 8.36505  ? 304 LEU A N   1 
ATOM   1557 C  CA  . LEU A 1 199 ? -31.88649 9.08829  3.45232   1.000 8.49786  ? 304 LEU A CA  1 
ATOM   1558 C  C   . LEU A 1 199 ? -32.16028 8.89324  1.97964   1.000 7.92819  ? 304 LEU A C   1 
ATOM   1559 O  O   . LEU A 1 199 ? -32.96562 8.03241  1.59692   1.000 8.29593  ? 304 LEU A O   1 
ATOM   1560 C  CB  . LEU A 1 199 ? -30.96327 7.98786  3.92287   1.000 9.09065  ? 304 LEU A CB  1 
ATOM   1561 C  CG  . LEU A 1 199 ? -29.97407 8.46025  4.99248   1.000 9.98651  ? 304 LEU A CG  1 
ATOM   1562 C  CD1 . LEU A 1 199 ? -30.69663 8.75918  6.27712   1.000 10.04907 ? 304 LEU A CD1 1 
ATOM   1563 C  CD2 . LEU A 1 199 ? -28.85211 7.45341  5.18223   1.000 10.38531 ? 304 LEU A CD2 1 
ATOM   1564 N  N   . ASP A 1 200 ? -31.43986 9.64345  1.14598   1.000 7.47113  ? 305 ASP A N   1 
ATOM   1565 C  CA  . ASP A 1 200 ? -31.50076 9.47013  -0.28482  1.000 7.72595  ? 305 ASP A CA  1 
ATOM   1566 C  C   . ASP A 1 200 ? -30.34058 8.66703  -0.81538  1.000 7.08408  ? 305 ASP A C   1 
ATOM   1567 O  O   . ASP A 1 200 ? -30.47845 8.02437  -1.85864  1.000 7.35312  ? 305 ASP A O   1 
ATOM   1568 C  CB  . ASP A 1 200 ? -31.45965 10.82696 -0.99743  1.000 7.91771  ? 305 ASP A CB  1 
ATOM   1569 C  CG  . ASP A 1 200 ? -32.67463 11.67115 -0.66811  1.000 7.13383  ? 305 ASP A CG  1 
ATOM   1570 O  OD1 . ASP A 1 200 ? -33.76847 11.41874 -1.22227  1.000 7.99074  ? 305 ASP A OD1 1 
ATOM   1571 O  OD2 . ASP A 1 200 ? -32.56890 12.59158 0.15302   1.000 7.17858  ? 305 ASP A OD2 1 
ATOM   1572 N  N   . ILE A 1 201 ? -29.19835 8.66879  -0.14416  1.000 7.02127  ? 306 ILE A N   1 
ATOM   1573 C  CA  . ILE A 1 201 ? -27.95843 8.20912  -0.76803  1.000 7.18312  ? 306 ILE A CA  1 
ATOM   1574 C  C   . ILE A 1 201 ? -26.91288 8.09273  0.32220   1.000 7.36095  ? 306 ILE A C   1 
ATOM   1575 O  O   . ILE A 1 201 ? -27.01247 8.74119  1.36100   1.000 7.46548  ? 306 ILE A O   1 
ATOM   1576 C  CB  . ILE A 1 201 ? -27.53947 9.23363  -1.86217  1.000 7.36329  ? 306 ILE A CB  1 
ATOM   1577 C  CG1 . ILE A 1 201 ? -26.38639 8.72763  -2.72891  1.000 8.42080  ? 306 ILE A CG1 1 
ATOM   1578 C  CG2 . ILE A 1 201 ? -27.17460 10.64234 -1.24956  1.000 7.28087  ? 306 ILE A CG2 1 
ATOM   1579 C  CD1 . ILE A 1 201 ? -26.77772 7.54781  -3.55678  1.000 9.26129  ? 306 ILE A CD1 1 
ATOM   1580 N  N   . PHE A 1 202 ? -25.91605 7.24577  0.09584   1.000 7.45723  ? 307 PHE A N   1 
ATOM   1581 C  CA  . PHE A 1 202 ? -24.72046 7.20735  0.91963   1.000 7.19655  ? 307 PHE A CA  1 
ATOM   1582 C  C   . PHE A 1 202 ? -23.51422 7.70106  0.13305   1.000 7.58200  ? 307 PHE A C   1 
ATOM   1583 O  O   . PHE A 1 202 ? -23.45177 7.56473  -1.09007  1.000 8.41456  ? 307 PHE A O   1 
ATOM   1584 C  CB  . PHE A 1 202 ? -24.44819 5.77307  1.37920   1.000 7.65520  ? 307 PHE A CB  1 
ATOM   1585 C  CG  . PHE A 1 202 ? -25.31219 5.36162  2.52227   1.000 8.16563  ? 307 PHE A CG  1 
ATOM   1586 C  CD1 . PHE A 1 202 ? -26.62291 4.92978  2.27250   1.000 8.70715  ? 307 PHE A CD1 1 
ATOM   1587 C  CD2 . PHE A 1 202 ? -24.85593 5.43958  3.84017   1.000 9.03305  ? 307 PHE A CD2 1 
ATOM   1588 C  CE1 . PHE A 1 202 ? -27.47187 4.55830  3.30708   1.000 9.11339  ? 307 PHE A CE1 1 
ATOM   1589 C  CE2 . PHE A 1 202 ? -25.69511 5.05975  4.89312   1.000 9.50788  ? 307 PHE A CE2 1 
ATOM   1590 C  CZ  . PHE A 1 202 ? -27.02166 4.61702  4.61981   1.000 9.75386  ? 307 PHE A CZ  1 
ATOM   1591 N  N   . GLY A 1 203 ? -22.55706 8.29226  0.84070   1.000 7.36189  ? 308 GLY A N   1 
ATOM   1592 C  CA  . GLY A 1 203 ? -21.28315 8.56659  0.21541   1.000 7.57647  ? 308 GLY A CA  1 
ATOM   1593 C  C   . GLY A 1 203 ? -20.15959 8.21708  1.16773   1.000 6.62114  ? 308 GLY A C   1 
ATOM   1594 O  O   . GLY A 1 203 ? -20.39077 7.94736  2.34001   1.000 6.34809  ? 308 GLY A O   1 
ATOM   1595 N  N   . PRO A 1 204 ? -18.92417 8.17812  0.66186   1.000 6.41001  ? 309 PRO A N   1 
ATOM   1596 C  CA  . PRO A 1 204 ? -17.77074 7.87557  1.52704   1.000 6.54790  ? 309 PRO A CA  1 
ATOM   1597 C  C   . PRO A 1 204 ? -17.69660 8.86547  2.67698   1.000 6.24476  ? 309 PRO A C   1 
ATOM   1598 O  O   . PRO A 1 204 ? -17.60862 10.07636 2.45997   1.000 6.59031  ? 309 PRO A O   1 
ATOM   1599 C  CB  . PRO A 1 204 ? -16.57764 8.04430  0.56787   1.000 6.96357  ? 309 PRO A CB  1 
ATOM   1600 C  CG  . PRO A 1 204 ? -17.16851 7.79798  -0.82976  1.000 7.16246  ? 309 PRO A CG  1 
ATOM   1601 C  CD  . PRO A 1 204 ? -18.53412 8.42090  -0.74332  1.000 7.21754  ? 309 PRO A CD  1 
ATOM   1602 N  N   . GLY A 1 205 ? -17.64911 8.34947  3.90081   1.000 6.18837  ? 310 GLY A N   1 
ATOM   1603 C  CA  . GLY A 1 205 ? -17.62416 9.21730  5.07174   1.000 6.19305  ? 310 GLY A CA  1 
ATOM   1604 C  C   . GLY A 1 205 ? -16.61800 8.83096  6.13931   1.000 6.51611  ? 310 GLY A C   1 
ATOM   1605 O  O   . GLY A 1 205 ? -16.38836 9.61766  7.04882   1.000 7.43319  ? 310 GLY A O   1 
ATOM   1606 N  N   . THR A 1 206 ? -16.00720 7.65070  6.08065   1.000 6.20577  ? 311 THR A N   1 
ATOM   1607 C  CA  . THR A 1 206 ? -15.08226 7.24659  7.13488   1.000 6.94296  ? 311 THR A CA  1 
ATOM   1608 C  C   . THR A 1 206 ? -13.65956 7.39638  6.61985   1.000 6.56070  ? 311 THR A C   1 
ATOM   1609 O  O   . THR A 1 206 ? -13.32745 6.87758  5.56031   1.000 6.92590  ? 311 THR A O   1 
ATOM   1610 C  CB  . THR A 1 206 ? -15.33076 5.78479  7.52912   1.000 7.18651  ? 311 THR A CB  1 
ATOM   1611 O  OG1 . THR A 1 206 ? -16.62514 5.66281  8.13472   1.000 8.29468  ? 311 THR A OG1 1 
ATOM   1612 C  CG2 . THR A 1 206 ? -14.28053 5.34222  8.56454   1.000 7.94900  ? 311 THR A CG2 1 
ATOM   1613 N  N   A ASP A 1 207 ? -12.83794 8.14511  7.35323   0.653 7.10768  ? 312 ASP A N   1 
ATOM   1614 N  N   B ASP A 1 207 ? -12.85126 8.17238  7.33934   0.347 7.54379  ? 312 ASP A N   1 
ATOM   1615 C  CA  A ASP A 1 207 ? -11.41727 8.30224  7.05914   0.653 6.57716  ? 312 ASP A CA  1 
ATOM   1616 C  CA  B ASP A 1 207 ? -11.42760 8.28116  7.05692   0.347 7.44289  ? 312 ASP A CA  1 
ATOM   1617 C  C   A ASP A 1 207 ? -11.20618 8.97349  5.70747   0.653 6.76725  ? 312 ASP A C   1 
ATOM   1618 C  C   B ASP A 1 207 ? -11.20670 8.96478  5.70793   0.347 7.01142  ? 312 ASP A C   1 
ATOM   1619 O  O   A ASP A 1 207 ? -10.59928 8.41667  4.78322   0.653 7.35321  ? 312 ASP A O   1 
ATOM   1620 O  O   B ASP A 1 207 ? -10.61816 8.40552  4.77841   0.347 7.34381  ? 312 ASP A O   1 
ATOM   1621 C  CB  A ASP A 1 207 ? -10.67940 6.96948  7.12385   0.653 6.65587  ? 312 ASP A CB  1 
ATOM   1622 C  CB  B ASP A 1 207 ? -10.78227 6.88990  7.11104   0.347 8.31344  ? 312 ASP A CB  1 
ATOM   1623 C  CG  A ASP A 1 207 ? -10.65596 6.38829  8.51182   0.653 7.15821  ? 312 ASP A CG  1 
ATOM   1624 C  CG  B ASP A 1 207 ? -9.27894  6.92446  6.98156   0.347 9.16972  ? 312 ASP A CG  1 
ATOM   1625 O  OD1 A ASP A 1 207 ? -10.78422 7.14615  9.49262   0.653 7.55895  ? 312 ASP A OD1 1 
ATOM   1626 O  OD1 B ASP A 1 207 ? -8.67693  7.95904  7.32507   0.347 9.78066  ? 312 ASP A OD1 1 
ATOM   1627 O  OD2 A ASP A 1 207 ? -10.45905 5.17295  8.63201   0.653 8.37908  ? 312 ASP A OD2 1 
ATOM   1628 O  OD2 B ASP A 1 207 ? -8.70827  5.89124  6.54572   0.347 9.65483  ? 312 ASP A OD2 1 
ATOM   1629 N  N   . ILE A 1 208 ? -11.72262 10.18701 5.60989   1.000 5.77784  ? 313 ILE A N   1 
ATOM   1630 C  CA  . ILE A 1 208 ? -11.68281 10.96817 4.38233   1.000 5.60817  ? 313 ILE A CA  1 
ATOM   1631 C  C   . ILE A 1 208 ? -10.59384 12.02817 4.50013   1.000 5.69899  ? 313 ILE A C   1 
ATOM   1632 O  O   . ILE A 1 208 ? -10.68187 12.92730 5.34219   1.000 6.20849  ? 313 ILE A O   1 
ATOM   1633 C  CB  . ILE A 1 208 ? -13.04737 11.63846 4.15005   1.000 5.79186  ? 313 ILE A CB  1 
ATOM   1634 C  CG1 . ILE A 1 208 ? -14.15607 10.57309 4.19766   1.000 6.41085  ? 313 ILE A CG1 1 
ATOM   1635 C  CG2 . ILE A 1 208 ? -13.03461 12.45353 2.85050   1.000 6.23665  ? 313 ILE A CG2 1 
ATOM   1636 C  CD1 . ILE A 1 208 ? -14.03192 9.45293  3.11982   1.000 7.19911  ? 313 ILE A CD1 1 
ATOM   1637 N  N   . LEU A 1 209 ? -9.60125  11.94764 3.62636   1.000 5.88921  ? 314 LEU A N   1 
ATOM   1638 C  CA  . LEU A 1 209 ? -8.50565  12.90385 3.58372   1.000 6.67912  ? 314 LEU A CA  1 
ATOM   1639 C  C   . LEU A 1 209 ? -8.90793  14.11429 2.77313   1.000 6.26676  ? 314 LEU A C   1 
ATOM   1640 O  O   . LEU A 1 209 ? -9.45002  13.96518 1.67967   1.000 6.85671  ? 314 LEU A O   1 
ATOM   1641 C  CB  . LEU A 1 209 ? -7.31411  12.21055 2.89310   1.000 7.38700  ? 314 LEU A CB  1 
ATOM   1642 C  CG  . LEU A 1 209 ? -6.04534  13.05067 2.62287   1.000 7.86907  ? 314 LEU A CG  1 
ATOM   1643 C  CD1 . LEU A 1 209 ? -5.45604  13.59437 3.93421   1.000 7.62829  ? 314 LEU A CD1 1 
ATOM   1644 C  CD2 . LEU A 1 209 ? -4.99549  12.25860 1.82050   1.000 8.83986  ? 314 LEU A CD2 1 
ATOM   1645 N  N   . SER A 1 210 ? -8.65263  15.30158 3.31216   1.000 5.57418  ? 315 SER A N   1 
ATOM   1646 C  CA  . SER A 1 210 ? -8.97744  16.51171 2.57604   1.000 5.82077  ? 315 SER A CA  1 
ATOM   1647 C  C   . SER A 1 210 ? -8.14269  17.65939 3.11029   1.000 6.39763  ? 315 SER A C   1 
ATOM   1648 O  O   . SER A 1 210 ? -7.29074  17.48103 3.99037   1.000 6.37350  ? 315 SER A O   1 
ATOM   1649 C  CB  . SER A 1 210 ? -10.46841 16.84247 2.68434   1.000 5.88150  ? 315 SER A CB  1 
ATOM   1650 O  OG  . SER A 1 210 ? -10.80632 17.85306 1.76541   1.000 6.12570  ? 315 SER A OG  1 
ATOM   1651 N  N   . THR A 1 211 ? -8.42014  18.85638 2.57539   1.000 6.72747  ? 316 THR A N   1 
ATOM   1652 C  CA  . THR A 1 211 ? -7.75470  20.07349 3.03459   1.000 6.91749  ? 316 THR A CA  1 
ATOM   1653 C  C   . THR A 1 211 ? -8.10397  20.41192 4.48128   1.000 6.38651  ? 316 THR A C   1 
ATOM   1654 O  O   . THR A 1 211 ? -9.15052  20.03298 5.02063   1.000 6.69067  ? 316 THR A O   1 
ATOM   1655 C  CB  . THR A 1 211 ? -8.13335  21.26533 2.14887   1.000 6.95871  ? 316 THR A CB  1 
ATOM   1656 O  OG1 . THR A 1 211 ? -9.55025  21.20616 1.87864   1.000 5.97290  ? 316 THR A OG1 1 
ATOM   1657 C  CG2 . THR A 1 211 ? -7.40889  21.14894 0.82939   1.000 6.68807  ? 316 THR A CG2 1 
ATOM   1658 N  N   . TRP A 1 212 ? -7.18117  21.13035 5.14173   1.000 6.26605  ? 317 TRP A N   1 
ATOM   1659 C  CA  . TRP A 1 212 ? -7.42594  21.63145 6.49525   1.000 6.95143  ? 317 TRP A CA  1 
ATOM   1660 C  C   . TRP A 1 212 ? -6.78769  23.01656 6.57956   1.000 6.49620  ? 317 TRP A C   1 
ATOM   1661 O  O   . TRP A 1 212 ? -5.95634  23.38277 5.74290   1.000 6.91990  ? 317 TRP A O   1 
ATOM   1662 C  CB  . TRP A 1 212 ? -6.79668  20.69888 7.54713   1.000 6.89365  ? 317 TRP A CB  1 
ATOM   1663 C  CG  . TRP A 1 212 ? -7.34987  20.84804 8.93921   1.000 6.61572  ? 317 TRP A CG  1 
ATOM   1664 C  CD1 . TRP A 1 212 ? -6.73089  21.43685 10.01964  1.000 6.72116  ? 317 TRP A CD1 1 
ATOM   1665 C  CD2 . TRP A 1 212 ? -8.63242  20.41050 9.40293   1.000 6.63283  ? 317 TRP A CD2 1 
ATOM   1666 N  NE1 . TRP A 1 212 ? -7.53240  21.37895 11.14439  1.000 7.15087  ? 317 TRP A NE1 1 
ATOM   1667 C  CE2 . TRP A 1 212 ? -8.70576  20.74080 10.79359  1.000 7.15538  ? 317 TRP A CE2 1 
ATOM   1668 C  CE3 . TRP A 1 212 ? -9.71026  19.75252 8.79516   1.000 6.74636  ? 317 TRP A CE3 1 
ATOM   1669 C  CZ2 . TRP A 1 212 ? -9.82433  20.44971 11.55766  1.000 7.44940  ? 317 TRP A CZ2 1 
ATOM   1670 C  CZ3 . TRP A 1 212 ? -10.81657 19.45225 9.57608   1.000 7.50897  ? 317 TRP A CZ3 1 
ATOM   1671 C  CH2 . TRP A 1 212 ? -10.86663 19.79001 10.92276  1.000 7.37395  ? 317 TRP A CH2 1 
ATOM   1672 N  N   . ILE A 1 213 ? -7.14300  23.75956 7.64522   1.000 6.30194  ? 318 ILE A N   1 
ATOM   1673 C  CA  . ILE A 1 213 ? -6.59980  25.09867 7.81818   1.000 7.24810  ? 318 ILE A CA  1 
ATOM   1674 C  C   . ILE A 1 213 ? -5.08976  25.07089 8.05254   1.000 7.70891  ? 318 ILE A C   1 
ATOM   1675 O  O   . ILE A 1 213 ? -4.48098  24.03105 8.31335   1.000 7.25477  ? 318 ILE A O   1 
ATOM   1676 C  CB  . ILE A 1 213 ? -7.36237  25.88003 8.89879   1.000 8.06121  ? 318 ILE A CB  1 
ATOM   1677 C  CG1 . ILE A 1 213 ? -7.47961  25.11433 10.22522  1.000 9.13317  ? 318 ILE A CG1 1 
ATOM   1678 C  CG2 . ILE A 1 213 ? -8.78449  26.18591 8.36357   1.000 7.88418  ? 318 ILE A CG2 1 
ATOM   1679 C  CD1 . ILE A 1 213 ? -7.86509  26.03359 11.37527  1.000 9.13107  ? 318 ILE A CD1 1 
ATOM   1680 N  N   . GLY A 1 214 ? -4.47857  26.23514 7.87761   1.000 7.77750  ? 319 GLY A N   1 
ATOM   1681 C  CA  . GLY A 1 214 ? -3.04576  26.27562 7.91608   1.000 8.17645  ? 319 GLY A CA  1 
ATOM   1682 C  C   . GLY A 1 214 ? -2.38687  25.65971 6.72450   1.000 8.45578  ? 319 GLY A C   1 
ATOM   1683 O  O   . GLY A 1 214 ? -1.22599  25.24078 6.84190   1.000 9.36092  ? 319 GLY A O   1 
ATOM   1684 N  N   . GLY A 1 215 ? -3.06987  25.61201 5.58106   1.000 7.47346  ? 320 GLY A N   1 
ATOM   1685 C  CA  . GLY A 1 215 ? -2.49647  25.03939 4.38171   1.000 7.72174  ? 320 GLY A CA  1 
ATOM   1686 C  C   . GLY A 1 215 ? -2.17796  23.56788 4.54938   1.000 7.58889  ? 320 GLY A C   1 
ATOM   1687 O  O   . GLY A 1 215 ? -1.25330  23.05231 3.92066   1.000 8.56870  ? 320 GLY A O   1 
ATOM   1688 N  N   A SER A 1 216 ? -2.90444  22.87854 5.40859   0.716 7.78200  ? 321 SER A N   1 
ATOM   1689 N  N   B SER A 1 216 ? -2.91744  22.87396 5.39566   0.284 7.46373  ? 321 SER A N   1 
ATOM   1690 C  CA  A SER A 1 216 ? -2.56554  21.50158 5.73591   0.716 7.65245  ? 321 SER A CA  1 
ATOM   1691 C  CA  B SER A 1 216 ? -2.57110  21.50555 5.74128   0.284 7.42720  ? 321 SER A CA  1 
ATOM   1692 C  C   A SER A 1 216 ? -3.58223  20.50383 5.14905   0.716 7.20012  ? 321 SER A C   1 
ATOM   1693 C  C   B SER A 1 216 ? -3.62673  20.52231 5.21908   0.284 7.28659  ? 321 SER A C   1 
ATOM   1694 O  O   A SER A 1 216 ? -4.40437  20.83829 4.29513   0.716 7.18953  ? 321 SER A O   1 
ATOM   1695 O  O   B SER A 1 216 ? -4.53586  20.89227 4.47545   0.284 7.26969  ? 321 SER A O   1 
ATOM   1696 C  CB  A SER A 1 216 ? -2.43378  21.33809 7.24475   0.716 8.17519  ? 321 SER A CB  1 
ATOM   1697 C  CB  B SER A 1 216 ? -2.35087  21.40161 7.24685   0.284 7.58689  ? 321 SER A CB  1 
ATOM   1698 O  OG  A SER A 1 216 ? -3.70994  21.44842 7.85936   0.716 8.25729  ? 321 SER A OG  1 
ATOM   1699 O  OG  B SER A 1 216 ? -1.64581  20.22443 7.56863   0.284 7.50019  ? 321 SER A OG  1 
ATOM   1700 N  N   . THR A 1 217 ? -3.47981  19.25048 5.58929   1.000 7.44390  ? 322 THR A N   1 
ATOM   1701 C  CA  . THR A 1 217 ? -4.43699  18.22256 5.20770   1.000 7.58289  ? 322 THR A CA  1 
ATOM   1702 C  C   . THR A 1 217 ? -4.68549  17.32857 6.41472   1.000 7.52954  ? 322 THR A C   1 
ATOM   1703 O  O   . THR A 1 217 ? -3.85611  17.24571 7.31942   1.000 8.49524  ? 322 THR A O   1 
ATOM   1704 C  CB  . THR A 1 217 ? -3.97691  17.32831 4.03603   1.000 8.21489  ? 322 THR A CB  1 
ATOM   1705 O  OG1 . THR A 1 217 ? -2.84754  16.56896 4.43733   1.000 8.70592  ? 322 THR A OG1 1 
ATOM   1706 C  CG2 . THR A 1 217 ? -3.61748  18.15656 2.80431   1.000 9.10048  ? 322 THR A CG2 1 
ATOM   1707 N  N   . ARG A 1 218 ? -5.84153  16.67334 6.45383   1.000 7.21985  ? 323 ARG A N   1 
ATOM   1708 C  CA  . ARG A 1 218 ? -6.02364  15.64155 7.46907   1.000 8.23092  ? 323 ARG A CA  1 
ATOM   1709 C  C   . ARG A 1 218 ? -7.19847  14.76263 7.07689   1.000 7.51523  ? 323 ARG A C   1 
ATOM   1710 O  O   . ARG A 1 218 ? -7.99082  15.09365 6.18264   1.000 7.58567  ? 323 ARG A O   1 
ATOM   1711 C  CB  . ARG A 1 218 ? -6.19602  16.17105 8.88759   1.000 9.97225  ? 323 ARG A CB  1 
ATOM   1712 C  CG  . ARG A 1 218 ? -7.48896  16.88731 9.11023   1.000 9.77791  ? 323 ARG A CG  1 
ATOM   1713 C  CD  . ARG A 1 218 ? -7.58708  17.29861 10.60353  1.000 9.55890  ? 323 ARG A CD  1 
ATOM   1714 N  NE  . ARG A 1 218 ? -6.46475  18.17534 10.95692  1.000 8.96763  ? 323 ARG A NE  1 
ATOM   1715 C  CZ  . ARG A 1 218 ? -6.24744  18.70491 12.14916  1.000 8.94466  ? 323 ARG A CZ  1 
ATOM   1716 N  NH1 . ARG A 1 218 ? -7.04749  18.44195 13.18309  1.000 9.43370  ? 323 ARG A NH1 1 
ATOM   1717 N  NH2 . ARG A 1 218 ? -5.17106  19.47267 12.32748  1.000 9.10346  ? 323 ARG A NH2 1 
ATOM   1718 N  N   A SER A 1 219 ? -7.30466  13.62206 7.75739   0.502 7.79483  ? 324 SER A N   1 
ATOM   1719 N  N   B SER A 1 219 ? -7.26336  13.61415 7.72876   0.498 7.44382  ? 324 SER A N   1 
ATOM   1720 C  CA  A SER A 1 219 ? -8.34219  12.63339 7.48705   0.502 8.05445  ? 324 SER A CA  1 
ATOM   1721 C  CA  B SER A 1 219 ? -8.34257  12.67304 7.51962   0.498 7.46741  ? 324 SER A CA  1 
ATOM   1722 C  C   A SER A 1 219 ? -9.28497  12.59470 8.68011   0.502 8.27486  ? 324 SER A C   1 
ATOM   1723 C  C   B SER A 1 219 ? -9.26838  12.77372 8.71391   0.498 7.49466  ? 324 SER A C   1 
ATOM   1724 O  O   A SER A 1 219 ? -8.85400  12.29496 9.79582   0.502 8.91079  ? 324 SER A O   1 
ATOM   1725 O  O   B SER A 1 219 ? -8.80757  12.78130 9.85871   0.498 7.29482  ? 324 SER A O   1 
ATOM   1726 C  CB  A SER A 1 219 ? -7.70567  11.25998 7.29227   0.502 7.99847  ? 324 SER A CB  1 
ATOM   1727 C  CB  B SER A 1 219 ? -7.77012  11.26786 7.42896   0.498 7.45297  ? 324 SER A CB  1 
ATOM   1728 O  OG  A SER A 1 219 ? -8.68241  10.22382 7.21963   0.502 7.49564  ? 324 SER A OG  1 
ATOM   1729 O  OG  B SER A 1 219 ? -6.85716  11.20102 6.35446   0.498 7.23781  ? 324 SER A OG  1 
ATOM   1730 N  N   . ILE A 1 220 ? -10.56791 12.88907 8.44780   1.000 7.72428  ? 325 ILE A N   1 
ATOM   1731 C  CA  . ILE A 1 220 ? -11.58076 12.86955 9.50153   1.000 8.42316  ? 325 ILE A CA  1 
ATOM   1732 C  C   . ILE A 1 220 ? -12.78551 12.06586 9.01476   1.000 7.76815  ? 325 ILE A C   1 
ATOM   1733 O  O   . ILE A 1 220 ? -12.88224 11.71926 7.84134   1.000 7.02289  ? 325 ILE A O   1 
ATOM   1734 C  CB  . ILE A 1 220 ? -11.98048 14.28020 10.00853  1.000 9.66738  ? 325 ILE A CB  1 
ATOM   1735 C  CG1 . ILE A 1 220 ? -12.48668 15.16186 8.87998   1.000 9.76419  ? 325 ILE A CG1 1 
ATOM   1736 C  CG2 . ILE A 1 220 ? -10.82449 14.95546 10.68247  1.000 10.63024 ? 325 ILE A CG2 1 
ATOM   1737 C  CD1 . ILE A 1 220 ? -13.07726 16.48981 9.39227   1.000 9.58330  ? 325 ILE A CD1 1 
ATOM   1738 N  N   . SER A 1 221 ? -13.71947 11.78586 9.92447   1.000 7.63789  ? 326 SER A N   1 
ATOM   1739 C  CA  . SER A 1 221 ? -14.87243 10.96374 9.56030   1.000 8.10270  ? 326 SER A CA  1 
ATOM   1740 C  C   . SER A 1 221 ? -16.18978 11.64620 9.90933   1.000 7.92703  ? 326 SER A C   1 
ATOM   1741 O  O   . SER A 1 221 ? -16.29042 12.38880 10.89786  1.000 9.00607  ? 326 SER A O   1 
ATOM   1742 C  CB  . SER A 1 221 ? -14.83586 9.65346  10.33514  1.000 8.85963  ? 326 SER A CB  1 
ATOM   1743 O  OG  . SER A 1 221 ? -13.65901 8.93579  10.02792  1.000 9.24286  ? 326 SER A OG  1 
ATOM   1744 N  N   . GLY A 1 222 ? -17.20273 11.39418 9.10921   1.000 8.20001  ? 327 GLY A N   1 
ATOM   1745 C  CA  . GLY A 1 222 ? -18.53638 11.85093 9.47430   1.000 8.11770  ? 327 GLY A CA  1 
ATOM   1746 C  C   . GLY A 1 222 ? -19.44671 11.85270 8.27274   1.000 7.64437  ? 327 GLY A C   1 
ATOM   1747 O  O   . GLY A 1 222 ? -19.01047 11.83250 7.12070   1.000 7.40967  ? 327 GLY A O   1 
ATOM   1748 N  N   . THR A 1 223 ? -20.74983 11.94372 8.54421   1.000 7.11188  ? 328 THR A N   1 
ATOM   1749 C  CA  . THR A 1 223 ? -21.66888 12.25924 7.45536   1.000 6.93804  ? 328 THR A CA  1 
ATOM   1750 C  C   . THR A 1 223 ? -21.37182 13.62821 6.85227   1.000 6.78293  ? 328 THR A C   1 
ATOM   1751 O  O   . THR A 1 223 ? -21.69378 13.86573 5.67684   1.000 6.81802  ? 328 THR A O   1 
ATOM   1752 C  CB  . THR A 1 223 ? -23.17179 12.13125 7.81574   1.000 6.81644  ? 328 THR A CB  1 
ATOM   1753 O  OG1 . THR A 1 223 ? -23.50365 12.98871 8.92287   1.000 6.31597  ? 328 THR A OG1 1 
ATOM   1754 C  CG2 . THR A 1 223 ? -23.52530 10.63924 8.15579   1.000 7.46460  ? 328 THR A CG2 1 
ATOM   1755 N  N   . SER A 1 224 ? -20.72219 14.50970 7.62172   1.000 7.35079  ? 329 SER A N   1 
ATOM   1756 C  CA  . SER A 1 224 ? -20.18615 15.75748 7.07489   1.000 7.46151  ? 329 SER A CA  1 
ATOM   1757 C  C   . SER A 1 224 ? -19.22454 15.52932 5.92268   1.000 6.92823  ? 329 SER A C   1 
ATOM   1758 O  O   . SER A 1 224 ? -19.04612 16.43217 5.11075   1.000 7.28691  ? 329 SER A O   1 
ATOM   1759 C  CB  . SER A 1 224 ? -19.39335 16.54119 8.11888   1.000 8.57274  ? 329 SER A CB  1 
ATOM   1760 O  OG  . SER A 1 224 ? -20.27847 17.19234 9.00685   1.000 9.33669  ? 329 SER A OG  1 
ATOM   1761 N  N   . MET A 1 225 ? -18.50776 14.40674 5.90147   1.000 6.09325  ? 330 MET A N   1 
ATOM   1762 C  CA  . MET A 1 225 ? -17.54086 14.13966 4.83846   1.000 6.26594  ? 330 MET A CA  1 
ATOM   1763 C  C   . MET A 1 225 ? -18.23181 13.46707 3.66521   1.000 5.37703  ? 330 MET A C   1 
ATOM   1764 O  O   . MET A 1 225 ? -17.77052 13.57546 2.52862   1.000 5.80595  ? 330 MET A O   1 
ATOM   1765 C  CB  . MET A 1 225 ? -16.46950 13.15935 5.35159   1.000 7.03894  ? 330 MET A CB  1 
ATOM   1766 C  CG  . MET A 1 225 ? -15.41712 13.70199 6.32850   1.000 7.95379  ? 330 MET A CG  1 
ATOM   1767 S  SD  . MET A 1 225 ? -16.00303 14.51052 7.82271   1.000 8.04559  ? 330 MET A SD  1 
ATOM   1768 C  CE  . MET A 1 225 ? -16.02005 16.23260 7.29894   1.000 8.61691  ? 330 MET A CE  1 
ATOM   1769 N  N   . ALA A 1 226 ? -19.31405 12.72638 3.93093   1.000 5.91821  ? 331 ALA A N   1 
ATOM   1770 C  CA  . ALA A 1 226 ? -20.02054 12.08819 2.83352   1.000 5.80363  ? 331 ALA A CA  1 
ATOM   1771 C  C   . ALA A 1 226 ? -20.78999 13.10381 2.01735   1.000 5.68824  ? 331 ALA A C   1 
ATOM   1772 O  O   . ALA A 1 226 ? -20.84581 12.99765 0.79069   1.000 6.50745  ? 331 ALA A O   1 
ATOM   1773 C  CB  . ALA A 1 226 ? -20.98952 11.02179 3.34675   1.000 5.39411  ? 331 ALA A CB  1 
ATOM   1774 N  N   . THR A 1 227 ? -21.39433 14.08515 2.70044   1.000 4.95077  ? 332 THR A N   1 
ATOM   1775 C  CA  . THR A 1 227 ? -22.21044 15.10181 2.05278   1.000 4.94907  ? 332 THR A CA  1 
ATOM   1776 C  C   . THR A 1 227 ? -21.46028 15.81261 0.93955   1.000 5.10528  ? 332 THR A C   1 
ATOM   1777 O  O   . THR A 1 227 ? -22.01952 15.93491 -0.16512  1.000 5.77582  ? 332 THR A O   1 
ATOM   1778 C  CB  . THR A 1 227 ? -22.68718 16.09081 3.12025   1.000 5.73719  ? 332 THR A CB  1 
ATOM   1779 O  OG1 . THR A 1 227 ? -23.46648 15.37080 4.08070   1.000 6.62322  ? 332 THR A OG1 1 
ATOM   1780 C  CG2 . THR A 1 227 ? -23.53533 17.23024 2.50443   1.000 6.33837  ? 332 THR A CG2 1 
ATOM   1781 N  N   . PRO A 1 228 ? -20.24940 16.34248 1.14929   1.000 5.04154  ? 333 PRO A N   1 
ATOM   1782 C  CA  . PRO A 1 228 ? -19.56869 17.01497 0.03970   1.000 5.22174  ? 333 PRO A CA  1 
ATOM   1783 C  C   . PRO A 1 228 ? -19.18980 16.08849 -1.10845  1.000 4.73402  ? 333 PRO A C   1 
ATOM   1784 O  O   . PRO A 1 228 ? -18.99701 16.58941 -2.23161  1.000 4.80957  ? 333 PRO A O   1 
ATOM   1785 C  CB  . PRO A 1 228 ? -18.33359 17.63541 0.72241   1.000 5.21272  ? 333 PRO A CB  1 
ATOM   1786 C  CG  . PRO A 1 228 ? -18.08592 16.76029 1.91638   1.000 5.39660  ? 333 PRO A CG  1 
ATOM   1787 C  CD  . PRO A 1 228 ? -19.49746 16.48922 2.39807   1.000 5.65709  ? 333 PRO A CD  1 
ATOM   1788 N  N   . HIS A 1 229 ? -19.08043 14.75592 -0.88372  1.000 4.59152  ? 334 HIS A N   1 
ATOM   1789 C  CA  . HIS A 1 229 ? -18.89153 13.87124 -2.03346  1.000 4.92087  ? 334 HIS A CA  1 
ATOM   1790 C  C   . HIS A 1 229 ? -20.11375 13.96188 -2.92540  1.000 5.59701  ? 334 HIS A C   1 
ATOM   1791 O  O   . HIS A 1 229 ? -19.98996 14.00667 -4.14399  1.000 6.48481  ? 334 HIS A O   1 
ATOM   1792 C  CB  . HIS A 1 229 ? -18.70933 12.40193 -1.58008  1.000 5.94714  ? 334 HIS A CB  1 
ATOM   1793 C  CG  . HIS A 1 229 ? -17.32580 12.05632 -1.08026  1.000 6.71034  ? 334 HIS A CG  1 
ATOM   1794 N  ND1 . HIS A 1 229 ? -16.97914 12.15074 0.24593   1.000 7.16168  ? 334 HIS A ND1 1 
ATOM   1795 C  CD2 . HIS A 1 229 ? -16.22936 11.58328 -1.72350  1.000 6.82301  ? 334 HIS A CD2 1 
ATOM   1796 C  CE1 . HIS A 1 229 ? -15.72135 11.75943 0.40872   1.000 7.18731  ? 334 HIS A CE1 1 
ATOM   1797 N  NE2 . HIS A 1 229 ? -15.24474 11.40095 -0.77174  1.000 6.87087  ? 334 HIS A NE2 1 
ATOM   1798 N  N   . VAL A 1 230 ? -21.30730 13.98596 -2.31503  1.000 5.34044  ? 335 VAL A N   1 
ATOM   1799 C  CA  . VAL A 1 230 ? -22.52381 14.05515 -3.09931  1.000 6.38840  ? 335 VAL A CA  1 
ATOM   1800 C  C   . VAL A 1 230 ? -22.68761 15.43674 -3.71269  1.000 6.05856  ? 335 VAL A C   1 
ATOM   1801 O  O   . VAL A 1 230 ? -23.09867 15.56702 -4.86205  1.000 6.51368  ? 335 VAL A O   1 
ATOM   1802 C  CB  . VAL A 1 230 ? -23.71674 13.63158 -2.22578  1.000 6.68455  ? 335 VAL A CB  1 
ATOM   1803 C  CG1 . VAL A 1 230 ? -25.03689 13.93689 -2.91621  1.000 6.92172  ? 335 VAL A CG1 1 
ATOM   1804 C  CG2 . VAL A 1 230 ? -23.60846 12.09673 -1.90627  1.000 7.19585  ? 335 VAL A CG2 1 
ATOM   1805 N  N   . ALA A 1 231 ? -22.39876 16.49616 -2.94964  1.000 5.73782  ? 336 ALA A N   1 
ATOM   1806 C  CA  . ALA A 1 231 ? -22.52488 17.83664 -3.51003  1.000 6.29209  ? 336 ALA A CA  1 
ATOM   1807 C  C   . ALA A 1 231 ? -21.57370 18.00349 -4.67516  1.000 6.54192  ? 336 ALA A C   1 
ATOM   1808 O  O   . ALA A 1 231 ? -21.95766 18.51226 -5.73673  1.000 6.32930  ? 336 ALA A O   1 
ATOM   1809 C  CB  . ALA A 1 231 ? -22.21829 18.86725 -2.43746  1.000 6.54121  ? 336 ALA A CB  1 
ATOM   1810 N  N   . GLY A 1 232 ? -20.32347 17.56237 -4.49439  1.000 7.09850  ? 337 GLY A N   1 
ATOM   1811 C  CA  . GLY A 1 232 ? -19.36995 17.61585 -5.58086  1.000 7.37214  ? 337 GLY A CA  1 
ATOM   1812 C  C   . GLY A 1 232 ? -19.82174 16.77998 -6.76041  1.000 7.32900  ? 337 GLY A C   1 
ATOM   1813 O  O   . GLY A 1 232 ? -19.67869 17.18758 -7.91796  1.000 7.87973  ? 337 GLY A O   1 
ATOM   1814 N  N   . LEU A 1 233 ? -20.37986 15.59352 -6.48869  1.000 6.96090  ? 338 LEU A N   1 
ATOM   1815 C  CA  . LEU A 1 233 ? -20.86269 14.75208 -7.58805  1.000 6.20114  ? 338 LEU A CA  1 
ATOM   1816 C  C   . LEU A 1 233 ? -21.99356 15.44422 -8.33557  1.000 6.35640  ? 338 LEU A C   1 
ATOM   1817 O  O   . LEU A 1 233 ? -22.03187 15.43354 -9.56342  1.000 6.68257  ? 338 LEU A O   1 
ATOM   1818 C  CB  . LEU A 1 233 ? -21.28518 13.36244 -7.09956  1.000 6.55239  ? 338 LEU A CB  1 
ATOM   1819 C  CG  . LEU A 1 233 ? -21.87440 12.40254 -8.14400  1.000 7.16061  ? 338 LEU A CG  1 
ATOM   1820 C  CD1 . LEU A 1 233 ? -20.84428 12.11295 -9.25012  1.000 8.15273  ? 338 LEU A CD1 1 
ATOM   1821 C  CD2 . LEU A 1 233 ? -22.34852 11.12545 -7.46886  1.000 7.10391  ? 338 LEU A CD2 1 
ATOM   1822 N  N   . ALA A 1 234 ? -22.91728 16.06069 -7.60569  1.000 6.34193  ? 339 ALA A N   1 
ATOM   1823 C  CA  . ALA A 1 234 ? -23.99266 16.79505 -8.25534  1.000 7.11175  ? 339 ALA A CA  1 
ATOM   1824 C  C   . ALA A 1 234 ? -23.41539 17.87019 -9.15077  1.000 6.65365  ? 339 ALA A C   1 
ATOM   1825 O  O   . ALA A 1 234 ? -23.84061 18.02422 -10.29551 1.000 6.54365  ? 339 ALA A O   1 
ATOM   1826 C  CB  . ALA A 1 234 ? -24.92893 17.42552 -7.22357  1.000 6.80342  ? 339 ALA A CB  1 
ATOM   1827 N  N   . ALA A 1 235 ? -22.46830 18.65705 -8.63351  1.000 6.54606  ? 340 ALA A N   1 
ATOM   1828 C  CA  . ALA A 1 235 ? -21.88527 19.71006 -9.46350  1.000 7.65004  ? 340 ALA A CA  1 
ATOM   1829 C  C   . ALA A 1 235 ? -21.24659 19.11997 -10.70525 1.000 7.45029  ? 340 ALA A C   1 
ATOM   1830 O  O   . ALA A 1 235 ? -21.45133 19.62418 -11.81688 1.000 7.46430  ? 340 ALA A O   1 
ATOM   1831 C  CB  . ALA A 1 235 ? -20.86599 20.54157 -8.66825  1.000 8.38327  ? 340 ALA A CB  1 
ATOM   1832 N  N   . TYR A 1 236 ? -20.52345 18.00938 -10.53881 1.000 7.73254  ? 341 TYR A N   1 
ATOM   1833 C  CA  . TYR A 1 236 ? -19.90166 17.32815 -11.65524 1.000 7.77603  ? 341 TYR A CA  1 
ATOM   1834 C  C   . TYR A 1 236 ? -20.93242 16.89402 -12.69041 1.000 8.20492  ? 341 TYR A C   1 
ATOM   1835 O  O   . TYR A 1 236 ? -20.73097 17.08550 -13.89528 1.000 9.03481  ? 341 TYR A O   1 
ATOM   1836 C  CB  . TYR A 1 236 ? -19.12388 16.15687 -11.07639 1.000 7.70184  ? 341 TYR A CB  1 
ATOM   1837 C  CG  . TYR A 1 236 ? -18.63488 15.13226 -12.05083 1.000 8.28028  ? 341 TYR A CG  1 
ATOM   1838 C  CD1 . TYR A 1 236 ? -19.42229 14.02820 -12.38901 1.000 8.35726  ? 341 TYR A CD1 1 
ATOM   1839 C  CD2 . TYR A 1 236 ? -17.38922 15.25356 -12.65477 1.000 9.43238  ? 341 TYR A CD2 1 
ATOM   1840 C  CE1 . TYR A 1 236 ? -18.99651 13.06513 -13.30101 1.000 8.86717  ? 341 TYR A CE1 1 
ATOM   1841 C  CE2 . TYR A 1 236 ? -16.94294 14.30899 -13.53768 1.000 9.81786  ? 341 TYR A CE2 1 
ATOM   1842 C  CZ  . TYR A 1 236 ? -17.73851 13.21251 -13.86936 1.000 9.64949  ? 341 TYR A CZ  1 
ATOM   1843 O  OH  . TYR A 1 236 ? -17.24178 12.27543 -14.75065 1.000 10.70394 ? 341 TYR A OH  1 
ATOM   1844 N  N   . LEU A 1 237 ? -22.04837 16.30459 -12.23852 1.000 7.50092  ? 342 LEU A N   1 
ATOM   1845 C  CA  . LEU A 1 237 ? -23.01913 15.80054 -13.19354 1.000 8.15410  ? 342 LEU A CA  1 
ATOM   1846 C  C   . LEU A 1 237 ? -23.80598 16.93811 -13.83071 1.000 8.53044  ? 342 LEU A C   1 
ATOM   1847 O  O   . LEU A 1 237 ? -24.25848 16.81120 -14.97344 1.000 8.75696  ? 342 LEU A O   1 
ATOM   1848 C  CB  . LEU A 1 237 ? -23.98376 14.85894 -12.47188 1.000 8.10691  ? 342 LEU A CB  1 
ATOM   1849 C  CG  . LEU A 1 237 ? -23.37705 13.53810 -11.96193 1.000 9.16624  ? 342 LEU A CG  1 
ATOM   1850 C  CD1 . LEU A 1 237 ? -24.31922 12.84202 -10.94223 1.000 9.66327  ? 342 LEU A CD1 1 
ATOM   1851 C  CD2 . LEU A 1 237 ? -22.89933 12.57430 -13.09297 1.000 9.54668  ? 342 LEU A CD2 1 
ATOM   1852 N  N   A MET A 1 238 ? -24.03242 18.02689 -13.08183 0.885 8.12011  ? 343 MET A N   1 
ATOM   1853 N  N   B MET A 1 238 ? -24.00239 18.04453 -13.11005 0.115 8.69193  ? 343 MET A N   1 
ATOM   1854 C  CA  A MET A 1 238 ? -24.68077 19.19952 -13.66636 0.885 8.50464  ? 343 MET A CA  1 
ATOM   1855 C  CA  B MET A 1 238 ? -24.69110 19.18435 -13.70734 0.115 8.79055  ? 343 MET A CA  1 
ATOM   1856 C  C   A MET A 1 238 ? -23.82669 19.80366 -14.77063 0.885 8.97767  ? 343 MET A C   1 
ATOM   1857 C  C   B MET A 1 238 ? -23.83073 19.85328 -14.76812 0.115 9.11370  ? 343 MET A C   1 
ATOM   1858 O  O   A MET A 1 238 ? -24.34892 20.19640 -15.82084 0.885 8.64056  ? 343 MET A O   1 
ATOM   1859 O  O   B MET A 1 238 ? -24.34927 20.32322 -15.78786 0.115 8.96719  ? 343 MET A O   1 
ATOM   1860 C  CB  A MET A 1 238 ? -24.97267 20.21428 -12.56047 0.885 9.15343  ? 343 MET A CB  1 
ATOM   1861 C  CB  B MET A 1 238 ? -25.10223 20.18625 -12.63324 0.115 8.67304  ? 343 MET A CB  1 
ATOM   1862 C  CG  A MET A 1 238 ? -26.17276 19.74216 -11.70400 0.885 9.44680  ? 343 MET A CG  1 
ATOM   1863 C  CG  B MET A 1 238 ? -26.23208 19.70030 -11.75004 0.115 8.53819  ? 343 MET A CG  1 
ATOM   1864 S  SD  A MET A 1 238 ? -26.31828 20.43172 -10.03565 0.885 9.19639  ? 343 MET A SD  1 
ATOM   1865 S  SD  B MET A 1 238 ? -27.01195 21.07718 -10.90258 0.115 8.37451  ? 343 MET A SD  1 
ATOM   1866 C  CE  A MET A 1 238 ? -26.75891 22.13303 -10.45963 0.885 9.68285  ? 343 MET A CE  1 
ATOM   1867 C  CE  B MET A 1 238 ? -25.55994 22.00577 -10.42144 0.115 8.17455  ? 343 MET A CE  1 
ATOM   1868 N  N   . THR A 1 239 ? -22.51681 19.92121 -14.54155 1.000 9.34276  ? 344 THR A N   1 
ATOM   1869 C  CA  . THR A 1 239 ? -21.62620 20.39472 -15.59382 1.000 10.43050 ? 344 THR A CA  1 
ATOM   1870 C  C   . THR A 1 239 ? -21.70735 19.49759 -16.81717 1.000 10.97375 ? 344 THR A C   1 
ATOM   1871 O  O   . THR A 1 239 ? -21.65897 19.97765 -17.95331 1.000 11.12662 ? 344 THR A O   1 
ATOM   1872 C  CB  . THR A 1 239 ? -20.19789 20.50230 -15.05052 1.000 10.10103 ? 344 THR A CB  1 
ATOM   1873 O  OG1 . THR A 1 239 ? -20.14556 21.68069 -14.24792 1.000 10.81760 ? 344 THR A OG1 1 
ATOM   1874 C  CG2 . THR A 1 239 ? -19.14290 20.60061 -16.16415 1.000 10.31704 ? 344 THR A CG2 1 
ATOM   1875 N  N   . LEU A 1 240 ? -21.87049 18.19211 -16.60169 1.000 11.55920 ? 345 LEU A N   1 
ATOM   1876 C  CA  . LEU A 1 240 ? -21.99869 17.27464 -17.72767 1.000 12.19819 ? 345 LEU A CA  1 
ATOM   1877 C  C   . LEU A 1 240 ? -23.33779 17.37198 -18.42578 1.000 12.07069 ? 345 LEU A C   1 
ATOM   1878 O  O   . LEU A 1 240 ? -23.52282 16.73364 -19.46779 1.000 12.62314 ? 345 LEU A O   1 
ATOM   1879 C  CB  . LEU A 1 240 ? -21.77217 15.84394 -17.26237 1.000 13.59722 ? 345 LEU A CB  1 
ATOM   1880 C  CG  . LEU A 1 240 ? -20.29068 15.59055 -17.03737 1.000 14.74618 ? 345 LEU A CG  1 
ATOM   1881 C  CD1 . LEU A 1 240 ? -20.11171 14.25994 -16.32629 1.000 15.15519 ? 345 LEU A CD1 1 
ATOM   1882 C  CD2 . LEU A 1 240 ? -19.55785 15.59270 -18.37378 1.000 15.33921 ? 345 LEU A CD2 1 
ATOM   1883 N  N   . GLY A 1 241 ? -24.28333 18.10621 -17.85360 1.000 10.92649 ? 346 GLY A N   1 
ATOM   1884 C  CA  . GLY A 1 241 ? -25.59648 18.21841 -18.46381 1.000 11.41608 ? 346 GLY A CA  1 
ATOM   1885 C  C   . GLY A 1 241 ? -26.47716 17.02108 -18.20587 1.000 11.38210 ? 346 GLY A C   1 
ATOM   1886 O  O   . GLY A 1 241 ? -27.56328 16.91615 -18.79659 1.000 11.63568 ? 346 GLY A O   1 
ATOM   1887 N  N   . LYS A 1 242 ? -26.05080 16.11145 -17.34445 1.000 11.81507 ? 347 LYS A N   1 
ATOM   1888 C  CA  . LYS A 1 242 ? -26.82535 14.90544 -17.11393 1.000 12.68436 ? 347 LYS A CA  1 
ATOM   1889 C  C   . LYS A 1 242 ? -27.99839 15.13030 -16.18830 1.000 11.68500 ? 347 LYS A C   1 
ATOM   1890 O  O   . LYS A 1 242 ? -28.95819 14.34746 -16.21370 1.000 11.62045 ? 347 LYS A O   1 
ATOM   1891 C  CB  . LYS A 1 242 ? -25.91213 13.82492 -16.56066 1.000 15.21111 ? 347 LYS A CB  1 
ATOM   1892 C  CG  . LYS A 1 242 ? -24.87106 13.39407 -17.60566 1.000 17.22905 ? 347 LYS A CG  1 
ATOM   1893 C  CD  . LYS A 1 242 ? -23.92488 12.30801 -17.13122 1.000 19.39376 ? 347 LYS A CD  1 
ATOM   1894 C  CE  . LYS A 1 242 ? -23.08335 11.74672 -18.30750 1.000 21.35035 ? 347 LYS A CE  1 
ATOM   1895 N  NZ  . LYS A 1 242 ? -23.94522 11.05149 -19.31932 1.000 22.43018 ? 347 LYS A NZ  1 
ATOM   1896 N  N   . THR A 1 243 ? -27.96865 16.18229 -15.38664 1.000 11.36278 ? 348 THR A N   1 
ATOM   1897 C  CA  . THR A 1 243 ? -29.05993 16.40918 -14.44571 1.000 11.34113 ? 348 THR A CA  1 
ATOM   1898 C  C   . THR A 1 243 ? -29.12588 17.90065 -14.12592 1.000 11.74613 ? 348 THR A C   1 
ATOM   1899 O  O   . THR A 1 243 ? -28.35654 18.70255 -14.65141 1.000 12.44125 ? 348 THR A O   1 
ATOM   1900 C  CB  . THR A 1 243 ? -28.91419 15.51553 -13.20589 1.000 10.62255 ? 348 THR A CB  1 
ATOM   1901 O  OG1 . THR A 1 243 ? -30.11408 15.51844 -12.41860 1.000 10.31666 ? 348 THR A OG1 1 
ATOM   1902 C  CG2 . THR A 1 243 ? -27.69892 15.95291 -12.35631 1.000 10.07669 ? 348 THR A CG2 1 
ATOM   1903 N  N   . THR A 1 244 ? -30.10082 18.27577 -13.31190 1.000 11.83638 ? 349 THR A N   1 
ATOM   1904 C  CA  . THR A 1 244 ? -30.32102 19.66792 -12.92724 1.000 12.50096 ? 349 THR A CA  1 
ATOM   1905 C  C   . THR A 1 244 ? -30.35183 19.73171 -11.41771 1.000 12.70563 ? 349 THR A C   1 
ATOM   1906 O  O   . THR A 1 244 ? -30.39833 18.70038 -10.74067 1.000 12.87651 ? 349 THR A O   1 
ATOM   1907 C  CB  . THR A 1 244 ? -31.67816 20.18464 -13.44627 1.000 13.49275 ? 349 THR A CB  1 
ATOM   1908 O  OG1 . THR A 1 244 ? -32.74028 19.43073 -12.82807 1.000 13.89210 ? 349 THR A OG1 1 
ATOM   1909 C  CG2 . THR A 1 244 ? -31.76790 20.01786 -14.93698 1.000 14.49851 ? 349 THR A CG2 1 
ATOM   1910 N  N   . ALA A 1 245 ? -30.33707 20.95447 -10.88267 1.000 12.68029 ? 350 ALA A N   1 
ATOM   1911 C  CA  . ALA A 1 245 ? -30.38129 21.10300 -9.43383  1.000 12.33563 ? 350 ALA A CA  1 
ATOM   1912 C  C   . ALA A 1 245 ? -31.63048 20.44993 -8.85460  1.000 11.84460 ? 350 ALA A C   1 
ATOM   1913 O  O   . ALA A 1 245 ? -31.56381 19.81755 -7.79029  1.000 12.27745 ? 350 ALA A O   1 
ATOM   1914 C  CB  . ALA A 1 245 ? -30.29147 22.57276 -9.01479  1.000 12.35225 ? 350 ALA A CB  1 
ATOM   1915 N  N   . ALA A 1 246 ? -32.77782 20.58679 -9.54368  1.000 11.45207 ? 351 ALA A N   1 
ATOM   1916 C  CA  . ALA A 1 246 ? -34.02571 20.01448 -9.04848  1.000 11.24044 ? 351 ALA A CA  1 
ATOM   1917 C  C   . ALA A 1 246 ? -34.01656 18.49244 -9.07261  1.000 11.10521 ? 351 ALA A C   1 
ATOM   1918 O  O   . ALA A 1 246 ? -34.69449 17.86988 -8.25679  1.000 10.93219 ? 351 ALA A O   1 
ATOM   1919 C  CB  . ALA A 1 246 ? -35.21596 20.48998 -9.91425  1.000 12.18664 ? 351 ALA A CB  1 
ATOM   1920 N  N   A SER A 1 247 ? -33.28123 17.87714 -10.00214 0.461 10.37432 ? 352 SER A N   1 
ATOM   1921 N  N   B SER A 1 247 ? -33.27252 17.87979 -9.99198  0.539 10.45559 ? 352 SER A N   1 
ATOM   1922 C  CA  A SER A 1 247 ? -33.37319 16.44016 -10.21373 0.461 10.13172 ? 352 SER A CA  1 
ATOM   1923 C  CA  B SER A 1 247 ? -33.37606 16.44784 -10.20942 0.539 10.12147 ? 352 SER A CA  1 
ATOM   1924 C  C   A SER A 1 247 ? -32.10868 15.67622 -9.83385  0.461 9.62780  ? 352 SER A C   1 
ATOM   1925 C  C   B SER A 1 247 ? -32.11270 15.67853 -9.83353  0.539 9.59695  ? 352 SER A C   1 
ATOM   1926 O  O   A SER A 1 247 ? -32.08072 14.45887 -9.99928  0.461 9.54864  ? 352 SER A O   1 
ATOM   1927 O  O   B SER A 1 247 ? -32.09058 14.46231 -10.00006 0.539 9.47018  ? 352 SER A O   1 
ATOM   1928 C  CB  A SER A 1 247 ? -33.75691 16.13255 -11.67318 0.461 10.45927 ? 352 SER A CB  1 
ATOM   1929 C  CB  B SER A 1 247 ? -33.76124 16.16753 -11.67274 0.539 10.42621 ? 352 SER A CB  1 
ATOM   1930 O  OG  A SER A 1 247 ? -32.78390 16.59556 -12.59581 0.461 10.65472 ? 352 SER A OG  1 
ATOM   1931 O  OG  B SER A 1 247 ? -35.00816 16.77098 -11.99754 0.539 10.52864 ? 352 SER A OG  1 
ATOM   1932 N  N   . ALA A 1 248 ? -31.07657 16.35128 -9.31798  1.000 9.04083  ? 353 ALA A N   1 
ATOM   1933 C  CA  . ALA A 1 248 ? -29.77354 15.70797 -9.18696  1.000 8.86367  ? 353 ALA A CA  1 
ATOM   1934 C  C   . ALA A 1 248 ? -29.78871 14.62172 -8.11984  1.000 8.09738  ? 353 ALA A C   1 
ATOM   1935 O  O   . ALA A 1 248 ? -29.15750 13.57540 -8.28286  1.000 8.06241  ? 353 ALA A O   1 
ATOM   1936 C  CB  . ALA A 1 248 ? -28.71847 16.76327 -8.84435  1.000 8.00817  ? 353 ALA A CB  1 
ATOM   1937 N  N   . CYS A 1 249 ? -30.51032 14.84269 -7.02951  1.000 8.54053  ? 354 CYS A N   1 
ATOM   1938 C  CA  . CYS A 1 249 ? -30.55045 13.83677 -5.98445  1.000 8.38980  ? 354 CYS A CA  1 
ATOM   1939 C  C   . CYS A 1 249 ? -31.17179 12.56569 -6.51760  1.000 9.56272  ? 354 CYS A C   1 
ATOM   1940 O  O   . CYS A 1 249 ? -30.63290 11.46611 -6.35184  1.000 8.81192  ? 354 CYS A O   1 
ATOM   1941 C  CB  . CYS A 1 249 ? -31.29769 14.37551 -4.75408  1.000 8.21111  ? 354 CYS A CB  1 
ATOM   1942 S  SG  . CYS A 1 249 ? -31.15032 13.28680 -3.33992  1.000 7.70504  ? 354 CYS A SG  1 
ATOM   1943 N  N   . ARG A 1 250 ? -32.29476 12.70953 -7.20705  1.000 11.05838 ? 355 ARG A N   1 
ATOM   1944 C  CA  . ARG A 1 250 ? -32.95542 11.55259 -7.79319  1.000 12.33796 ? 355 ARG A CA  1 
ATOM   1945 C  C   . ARG A 1 250 ? -32.07066 10.88820 -8.82560  1.000 10.90818 ? 355 ARG A C   1 
ATOM   1946 O  O   . ARG A 1 250 ? -32.02940 9.66045  -8.92808  1.000 10.86899 ? 355 ARG A O   1 
ATOM   1947 C  CB  . ARG A 1 250 ? -34.25579 12.03493 -8.43461  1.000 14.81405 ? 355 ARG A CB  1 
ATOM   1948 C  CG  . ARG A 1 250 ? -35.12389 10.99808 -9.03500  1.000 18.35545 ? 355 ARG A CG  1 
ATOM   1949 C  CD  . ARG A 1 250 ? -36.28407 11.71912 -9.78502  1.000 21.62153 ? 355 ARG A CD  1 
ATOM   1950 N  NE  . ARG A 1 250 ? -37.19807 12.41002 -8.88166  1.000 25.10944 ? 355 ARG A NE  1 
ATOM   1951 C  CZ  . ARG A 1 250 ? -38.48515 12.10661 -8.74535  1.000 27.93446 ? 355 ARG A CZ  1 
ATOM   1952 N  NH1 . ARG A 1 250 ? -39.06796 11.21201 -9.52603  1.000 29.53149 ? 355 ARG A NH1 1 
ATOM   1953 N  NH2 . ARG A 1 250 ? -39.19538 12.69701 -7.78480  1.000 29.91207 ? 355 ARG A NH2 1 
ATOM   1954 N  N   . TYR A 1 251 ? -31.37508 11.68360 -9.61518  1.000 10.13161 ? 356 TYR A N   1 
ATOM   1955 C  CA  . TYR A 1 251 ? -30.48332 11.10902 -10.61344 1.000 9.99229  ? 356 TYR A CA  1 
ATOM   1956 C  C   . TYR A 1 251 ? -29.36421 10.30654 -9.95698  1.000 9.55801  ? 356 TYR A C   1 
ATOM   1957 O  O   . TYR A 1 251 ? -29.03925 9.19718  -10.39336 1.000 9.73971  ? 356 TYR A O   1 
ATOM   1958 C  CB  . TYR A 1 251 ? -29.93812 12.21949 -11.51829 1.000 10.57691 ? 356 TYR A CB  1 
ATOM   1959 C  CG  . TYR A 1 251 ? -29.00034 11.70889 -12.55640 1.000 10.16557 ? 356 TYR A CG  1 
ATOM   1960 C  CD1 . TYR A 1 251 ? -29.46634 11.34579 -13.83689 1.000 10.89576 ? 356 TYR A CD1 1 
ATOM   1961 C  CD2 . TYR A 1 251 ? -27.62831 11.58709 -12.29102 1.000 10.35194 ? 356 TYR A CD2 1 
ATOM   1962 C  CE1 . TYR A 1 251 ? -28.56111 10.86016 -14.82929 1.000 10.76559 ? 356 TYR A CE1 1 
ATOM   1963 C  CE2 . TYR A 1 251 ? -26.76651 11.12589 -13.25601 1.000 10.49185 ? 356 TYR A CE2 1 
ATOM   1964 C  CZ  . TYR A 1 251 ? -27.22714 10.73506 -14.50037 1.000 10.53229 ? 356 TYR A CZ  1 
ATOM   1965 O  OH  . TYR A 1 251 ? -26.33455 10.29198 -15.44200 1.000 10.94156 ? 356 TYR A OH  1 
ATOM   1966 N  N   . ILE A 1 252 ? -28.75275 10.86817 -8.91800  1.000 9.13609  ? 357 ILE A N   1 
ATOM   1967 C  CA  . ILE A 1 252 ? -27.68791 10.18586 -8.17690  1.000 8.23509  ? 357 ILE A CA  1 
ATOM   1968 C  C   . ILE A 1 252 ? -28.19038 8.88185  -7.56269  1.000 8.01827  ? 357 ILE A C   1 
ATOM   1969 O  O   . ILE A 1 252 ? -27.52591 7.83795  -7.66161  1.000 7.53891  ? 357 ILE A O   1 
ATOM   1970 C  CB  . ILE A 1 252 ? -27.06900 11.14714 -7.13736  1.000 7.46031  ? 357 ILE A CB  1 
ATOM   1971 C  CG1 . ILE A 1 252 ? -26.27573 12.27696 -7.85491  1.000 7.43102  ? 357 ILE A CG1 1 
ATOM   1972 C  CG2 . ILE A 1 252 ? -26.19121 10.35907 -6.14235  1.000 7.71222  ? 357 ILE A CG2 1 
ATOM   1973 C  CD1 . ILE A 1 252 ? -25.67206 13.35134 -6.92457  1.000 8.24214  ? 357 ILE A CD1 1 
ATOM   1974 N  N   . ALA A 1 253 ? -29.40108 8.89432  -7.00429  1.000 8.96901  ? 358 ALA A N   1 
ATOM   1975 C  CA  . ALA A 1 253 ? -29.98082 7.65190  -6.50101  1.000 9.81368  ? 358 ALA A CA  1 
ATOM   1976 C  C   . ALA A 1 253 ? -30.24429 6.65683  -7.62370  1.000 10.90828 ? 358 ALA A C   1 
ATOM   1977 O  O   . ALA A 1 253 ? -29.94503 5.46821  -7.47864  1.000 11.13858 ? 358 ALA A O   1 
ATOM   1978 C  CB  . ALA A 1 253 ? -31.24775 7.94280  -5.70554  1.000 9.90914  ? 358 ALA A CB  1 
ATOM   1979 N  N   A ASP A 1 254 ? -30.79445 7.14981  -8.74546  0.513 11.20472 ? 359 ASP A N   1 
ATOM   1980 N  N   B ASP A 1 254 ? -30.74458 7.11132  -8.76358  0.487 11.33497 ? 359 ASP A N   1 
ATOM   1981 C  CA  A ASP A 1 254 ? -31.07194 6.34010  -9.93241  0.513 11.03292 ? 359 ASP A CA  1 
ATOM   1982 C  CA  B ASP A 1 254 ? -31.06470 6.14485  -9.80481  0.487 11.28830 ? 359 ASP A CA  1 
ATOM   1983 C  C   A ASP A 1 254 ? -29.82956 5.57911  -10.37429 0.513 10.54458 ? 359 ASP A C   1 
ATOM   1984 C  C   B ASP A 1 254 ? -29.82313 5.57531  -10.47502 0.487 10.83172 ? 359 ASP A C   1 
ATOM   1985 O  O   A ASP A 1 254 ? -29.89224 4.38922  -10.71128 0.513 10.23995 ? 359 ASP A O   1 
ATOM   1986 O  O   B ASP A 1 254 ? -29.89770 4.49195  -11.07044 0.487 10.78067 ? 359 ASP A O   1 
ATOM   1987 C  CB  A ASP A 1 254 ? -31.47386 7.27019  -11.08830 0.513 11.33613 ? 359 ASP A CB  1 
ATOM   1988 C  CB  B ASP A 1 254 ? -31.97463 6.77979  -10.83886 0.487 11.84914 ? 359 ASP A CB  1 
ATOM   1989 C  CG  A ASP A 1 254 ? -32.94943 7.66816  -11.08992 0.513 11.99429 ? 359 ASP A CG  1 
ATOM   1990 C  CG  B ASP A 1 254 ? -33.30973 7.18589  -10.25984 0.487 12.33934 ? 359 ASP A CG  1 
ATOM   1991 O  OD1 A ASP A 1 254 ? -33.68716 7.35872  -10.14251 0.513 12.33532 ? 359 ASP A OD1 1 
ATOM   1992 O  OD1 B ASP A 1 254 ? -33.68647 6.67262  -9.17466  0.487 12.25626 ? 359 ASP A OD1 1 
ATOM   1993 O  OD2 A ASP A 1 254 ? -33.33537 8.34379  -12.06219 0.513 12.07945 ? 359 ASP A OD2 1 
ATOM   1994 O  OD2 B ASP A 1 254 ? -33.98289 8.01590  -10.88958 0.487 12.68169 ? 359 ASP A OD2 1 
ATOM   1995 N  N   . THR A 1 255 ? -28.68790 6.27365  -10.39335 1.000 10.68532 ? 360 THR A N   1 
ATOM   1996 C  CA  . THR A 1 255 ? -27.45848 5.79805  -10.99882 1.000 10.83349 ? 360 THR A CA  1 
ATOM   1997 C  C   . THR A 1 255 ? -26.46226 5.26385  -9.98319  1.000 10.28591 ? 360 THR A C   1 
ATOM   1998 O  O   . THR A 1 255 ? -25.33550 4.90492  -10.35737 1.000 10.45648 ? 360 THR A O   1 
ATOM   1999 C  CB  . THR A 1 255 ? -26.80608 6.88770  -11.86155 1.000 11.51121 ? 360 THR A CB  1 
ATOM   2000 O  OG1 . THR A 1 255 ? -26.54575 8.02315  -11.03675 1.000 12.01571 ? 360 THR A OG1 1 
ATOM   2001 C  CG2 . THR A 1 255 ? -27.71114 7.31778  -13.00075 1.000 11.51890 ? 360 THR A CG2 1 
ATOM   2002 N  N   . ALA A 1 256 ? -26.86293 5.13693  -8.72669  1.000 10.52214 ? 361 ALA A N   1 
ATOM   2003 C  CA  . ALA A 1 256 ? -25.96971 4.70886  -7.66034  1.000 10.97514 ? 361 ALA A CA  1 
ATOM   2004 C  C   . ALA A 1 256 ? -25.56456 3.23324  -7.77851  1.000 10.73088 ? 361 ALA A C   1 
ATOM   2005 O  O   . ALA A 1 256 ? -26.21363 2.42294  -8.44296  1.000 11.86804 ? 361 ALA A O   1 
ATOM   2006 C  CB  . ALA A 1 256 ? -26.64194 4.88212  -6.30440  1.000 11.51970 ? 361 ALA A CB  1 
ATOM   2007 N  N   . ASN A 1 257 ? -24.51471 2.85593  -7.04133  1.000 10.61573 ? 362 ASN A N   1 
ATOM   2008 C  CA  . ASN A 1 257 ? -24.29624 1.43836  -6.80953  1.000 11.23629 ? 362 ASN A CA  1 
ATOM   2009 C  C   . ASN A 1 257 ? -25.36386 0.93923  -5.84930  1.000 11.36098 ? 362 ASN A C   1 
ATOM   2010 O  O   . ASN A 1 257 ? -25.53183 1.49719  -4.76070  1.000 10.80659 ? 362 ASN A O   1 
ATOM   2011 C  CB  . ASN A 1 257 ? -22.89952 1.18134  -6.26194  1.000 11.15364 ? 362 ASN A CB  1 
ATOM   2012 C  CG  . ASN A 1 257 ? -21.83840 1.31389  -7.31107  1.000 11.16771 ? 362 ASN A CG  1 
ATOM   2013 O  OD1 . ASN A 1 257 ? -21.89878 0.66004  -8.36525  1.000 11.00755 ? 362 ASN A OD1 1 
ATOM   2014 N  ND2 . ASN A 1 257 ? -20.84058 2.14573  -7.03381  1.000 11.01897 ? 362 ASN A ND2 1 
ATOM   2015 N  N   . LYS A 1 258 ? -26.09859 -0.08313 -6.26223  1.000 12.91727 ? 363 LYS A N   1 
ATOM   2016 C  CA  . LYS A 1 258 ? -27.22175 -0.59238 -5.49573  1.000 13.79440 ? 363 LYS A CA  1 
ATOM   2017 C  C   . LYS A 1 258 ? -26.84704 -1.90351 -4.81681  1.000 13.12016 ? 363 LYS A C   1 
ATOM   2018 O  O   . LYS A 1 258 ? -26.24161 -2.79197 -5.43594  1.000 13.41120 ? 363 LYS A O   1 
ATOM   2019 C  CB  . LYS A 1 258 ? -28.39241 -0.85297 -6.43677  1.000 15.30591 ? 363 LYS A CB  1 
ATOM   2020 C  CG  . LYS A 1 258 ? -28.76575 0.34342  -7.27230  1.000 17.76484 ? 363 LYS A CG  1 
ATOM   2021 C  CD  . LYS A 1 258 ? -30.00523 -0.00785 -8.14358  1.000 20.22587 ? 363 LYS A CD  1 
ATOM   2022 C  CE  . LYS A 1 258 ? -30.53289 1.20500  -8.87462  1.000 22.07260 ? 363 LYS A CE  1 
ATOM   2023 N  NZ  . LYS A 1 258 ? -29.47698 2.26356  -8.84897  1.000 23.00344 ? 363 LYS A NZ  1 
ATOM   2024 N  N   . GLY A 1 259 ? -27.18176 -2.02049 -3.54460  1.000 13.14052 ? 364 GLY A N   1 
ATOM   2025 C  CA  . GLY A 1 259 ? -26.97157 -3.23573 -2.79176  1.000 13.08448 ? 364 GLY A CA  1 
ATOM   2026 C  C   . GLY A 1 259 ? -25.53646 -3.52085 -2.37208  1.000 13.61421 ? 364 GLY A C   1 
ATOM   2027 O  O   . GLY A 1 259 ? -25.27441 -4.60335 -1.83789  1.000 13.30409 ? 364 GLY A O   1 
ATOM   2028 N  N   . ASP A 1 260 ? -24.60217 -2.57416 -2.54854  1.000 13.79196 ? 365 ASP A N   1 
ATOM   2029 C  CA  . ASP A 1 260 ? -23.21967 -2.86009 -2.20744  1.000 13.54835 ? 365 ASP A CA  1 
ATOM   2030 C  C   . ASP A 1 260 ? -22.92242 -2.70846 -0.72278  1.000 12.52101 ? 365 ASP A C   1 
ATOM   2031 O  O   . ASP A 1 260 ? -21.89514 -3.21934 -0.26414  1.000 13.23810 ? 365 ASP A O   1 
ATOM   2032 C  CB  . ASP A 1 260 ? -22.24681 -1.92132 -2.92107  1.000 14.23169 ? 365 ASP A CB  1 
ATOM   2033 C  CG  . ASP A 1 260 ? -21.98155 -2.31258 -4.36926  1.000 15.07689 ? 365 ASP A CG  1 
ATOM   2034 O  OD1 . ASP A 1 260 ? -21.26838 -1.56012 -5.09044  1.000 14.79696 ? 365 ASP A OD1 1 
ATOM   2035 O  OD2 . ASP A 1 260 ? -22.46614 -3.37163 -4.79606  1.000 15.84544 ? 365 ASP A OD2 1 
ATOM   2036 N  N   . LEU A 1 261 ? -23.73206 -1.96377 0.02049   1.000 11.99105 ? 366 LEU A N   1 
ATOM   2037 C  CA  . LEU A 1 261 ? -23.39521 -1.64823 1.39703   1.000 11.72418 ? 366 LEU A CA  1 
ATOM   2038 C  C   . LEU A 1 261 ? -23.89739 -2.73840 2.33932   1.000 12.28951 ? 366 LEU A C   1 
ATOM   2039 O  O   . LEU A 1 261 ? -24.94187 -3.35223 2.10348   1.000 12.95258 ? 366 LEU A O   1 
ATOM   2040 C  CB  . LEU A 1 261 ? -23.98368 -0.27795 1.76204   1.000 11.00727 ? 366 LEU A CB  1 
ATOM   2041 C  CG  . LEU A 1 261 ? -23.46486 0.86204  0.88884   1.000 11.30653 ? 366 LEU A CG  1 
ATOM   2042 C  CD1 . LEU A 1 261 ? -24.20455 2.11146  1.28925   1.000 11.15761 ? 366 LEU A CD1 1 
ATOM   2043 C  CD2 . LEU A 1 261 ? -21.94852 1.04525  1.09610   1.000 11.85076 ? 366 LEU A CD2 1 
ATOM   2044 N  N   . SER A 1 262 ? -23.17012 -2.94262 3.43337   1.000 11.99965 ? 367 SER A N   1 
ATOM   2045 C  CA  . SER A 1 262 ? -23.59547 -3.81922 4.51117   1.000 12.01903 ? 367 SER A CA  1 
ATOM   2046 C  C   . SER A 1 262 ? -24.01557 -2.98019 5.70936   1.000 11.58416 ? 367 SER A C   1 
ATOM   2047 O  O   . SER A 1 262 ? -23.76056 -1.77750 5.75949   1.000 11.35452 ? 367 SER A O   1 
ATOM   2048 C  CB  . SER A 1 262 ? -22.50323 -4.83425 4.88681   1.000 12.23740 ? 367 SER A CB  1 
ATOM   2049 O  OG  . SER A 1 262 ? -21.32203 -4.16794 5.24959   1.000 12.72658 ? 367 SER A OG  1 
ATOM   2050 N  N   A ASN A 1 263 ? -24.67919 -3.64140 6.66158   0.535 11.69473 ? 368 ASN A N   1 
ATOM   2051 N  N   B ASN A 1 263 ? -24.74440 -3.59928 6.62907   0.465 11.91149 ? 368 ASN A N   1 
ATOM   2052 C  CA  A ASN A 1 263 ? -25.28336 -3.00689 7.84604   0.535 11.89829 ? 368 ASN A CA  1 
ATOM   2053 C  CA  B ASN A 1 263 ? -25.20757 -2.92265 7.83350   0.465 12.17314 ? 368 ASN A CA  1 
ATOM   2054 C  C   A ASN A 1 263 ? -26.18765 -1.82581 7.49456   0.535 11.85352 ? 368 ASN A C   1 
ATOM   2055 C  C   B ASN A 1 263 ? -26.26665 -1.86407 7.55830   0.465 11.91281 ? 368 ASN A C   1 
ATOM   2056 O  O   A ASN A 1 263 ? -26.19941 -0.79612 8.17174   0.535 12.12317 ? 368 ASN A O   1 
ATOM   2057 O  O   B ASN A 1 263 ? -26.46510 -0.94891 8.37138   0.465 11.89632 ? 368 ASN A O   1 
ATOM   2058 C  CB  A ASN A 1 263 ? -24.27041 -2.63776 8.93613   0.535 12.62107 ? 368 ASN A CB  1 
ATOM   2059 C  CB  B ASN A 1 263 ? -24.03218 -2.36693 8.64383   0.465 12.93176 ? 368 ASN A CB  1 
ATOM   2060 C  CG  A ASN A 1 263 ? -24.91579 -2.52996 10.33032  0.535 13.14727 ? 368 ASN A CG  1 
ATOM   2061 C  CG  B ASN A 1 263 ? -22.96517 -3.42063 8.86774   0.465 13.83817 ? 368 ASN A CG  1 
ATOM   2062 O  OD1 A ASN A 1 263 ? -25.81812 -3.29541 10.67161  0.535 13.51759 ? 368 ASN A OD1 1 
ATOM   2063 O  OD1 B ASN A 1 263 ? -23.24022 -4.60611 8.71759   0.465 14.19973 ? 368 ASN A OD1 1 
ATOM   2064 N  ND2 A ASN A 1 263 ? -24.44999 -1.58305 11.13060  0.535 12.70489 ? 368 ASN A ND2 1 
ATOM   2065 N  ND2 B ASN A 1 263 ? -21.75037 -3.00087 9.19449   0.465 14.19137 ? 368 ASN A ND2 1 
ATOM   2066 N  N   . ILE A 1 264 ? -26.97872 -1.99609 6.44557   1.000 11.76872 ? 369 ILE A N   1 
ATOM   2067 C  CA  . ILE A 1 264 ? -28.05346 -1.07801 6.08832   1.000 11.22160 ? 369 ILE A CA  1 
ATOM   2068 C  C   . ILE A 1 264 ? -29.34753 -1.64003 6.66114   1.000 11.17237 ? 369 ILE A C   1 
ATOM   2069 O  O   . ILE A 1 264 ? -29.78274 -2.70765 6.22588   1.000 11.71968 ? 369 ILE A O   1 
ATOM   2070 C  CB  . ILE A 1 264 ? -28.17449 -0.95155 4.56473   1.000 11.68864 ? 369 ILE A CB  1 
ATOM   2071 C  CG1 . ILE A 1 264 ? -26.86056 -0.42526 3.97027   1.000 11.83383 ? 369 ILE A CG1 1 
ATOM   2072 C  CG2 . ILE A 1 264 ? -29.43694 -0.10066 4.18565   1.000 12.24439 ? 369 ILE A CG2 1 
ATOM   2073 C  CD1 . ILE A 1 264 ? -26.51678 1.02684  4.39748   1.000 12.31793 ? 369 ILE A CD1 1 
ATOM   2074 N  N   . PRO A 1 265 ? -29.99015 -0.96573 7.60148   1.000 10.91772 ? 370 PRO A N   1 
ATOM   2075 C  CA  . PRO A 1 265 ? -31.24856 -1.49336 8.14277   1.000 11.37964 ? 370 PRO A CA  1 
ATOM   2076 C  C   . PRO A 1 265 ? -32.37188 -1.50953 7.11576   1.000 11.70618 ? 370 PRO A C   1 
ATOM   2077 O  O   . PRO A 1 265 ? -32.44696 -0.66564 6.22427   1.000 12.08388 ? 370 PRO A O   1 
ATOM   2078 C  CB  . PRO A 1 265 ? -31.59665 -0.55109 9.30040   1.000 11.81767 ? 370 PRO A CB  1 
ATOM   2079 C  CG  . PRO A 1 265 ? -30.43322 0.43398  9.43135   1.000 11.95617 ? 370 PRO A CG  1 
ATOM   2080 C  CD  . PRO A 1 265 ? -29.59219 0.33490  8.16712   1.000 11.44402 ? 370 PRO A CD  1 
ATOM   2081 N  N   A PHE A 1 266 ? -33.25073 -2.49847 7.25554   0.616 11.85459 ? 371 PHE A N   1 
ATOM   2082 N  N   B PHE A 1 266 ? -33.25844 -2.49084 7.28108   0.384 12.27905 ? 371 PHE A N   1 
ATOM   2083 C  CA  A PHE A 1 266 ? -34.36930 -2.62555 6.34514   0.616 12.12707 ? 371 PHE A CA  1 
ATOM   2084 C  CA  B PHE A 1 266 ? -34.50770 -2.56355 6.54525   0.384 12.77580 ? 371 PHE A CA  1 
ATOM   2085 C  C   A PHE A 1 266 ? -35.17790 -1.32841 6.35339   0.616 12.77373 ? 371 PHE A C   1 
ATOM   2086 C  C   B PHE A 1 266 ? -35.11899 -1.17791 6.39245   0.384 12.82257 ? 371 PHE A C   1 
ATOM   2087 O  O   A PHE A 1 266 ? -35.48738 -0.78088 7.41099   0.616 13.22874 ? 371 PHE A O   1 
ATOM   2088 O  O   B PHE A 1 266 ? -35.25070 -0.43705 7.36683   0.384 12.68192 ? 371 PHE A O   1 
ATOM   2089 C  CB  A PHE A 1 266 ? -35.23699 -3.82564 6.77784   0.616 11.73377 ? 371 PHE A CB  1 
ATOM   2090 C  CB  B PHE A 1 266 ? -35.47776 -3.45987 7.33373   0.384 13.10523 ? 371 PHE A CB  1 
ATOM   2091 C  CG  A PHE A 1 266 ? -36.19881 -4.28576 5.71995   0.616 11.56320 ? 371 PHE A CG  1 
ATOM   2092 C  CG  B PHE A 1 266 ? -36.91959 -3.18968 7.02783   0.384 13.44945 ? 371 PHE A CG  1 
ATOM   2093 C  CD1 A PHE A 1 266 ? -37.48087 -3.77495 5.66982   0.616 11.82070 ? 371 PHE A CD1 1 
ATOM   2094 C  CD1 B PHE A 1 266 ? -37.46153 -3.61629 5.83352   0.384 13.65075 ? 371 PHE A CD1 1 
ATOM   2095 C  CD2 A PHE A 1 266 ? -35.80597 -5.21516 4.75865   0.616 11.71420 ? 371 PHE A CD2 1 
ATOM   2096 C  CD2 B PHE A 1 266 ? -37.71985 -2.47800 7.90820   0.384 13.67635 ? 371 PHE A CD2 1 
ATOM   2097 C  CE1 A PHE A 1 266 ? -38.39034 -4.19559 4.68189   0.616 11.76194 ? 371 PHE A CE1 1 
ATOM   2098 C  CE1 B PHE A 1 266 ? -38.79234 -3.36731 5.52023   0.384 13.71475 ? 371 PHE A CE1 1 
ATOM   2099 C  CE2 A PHE A 1 266 ? -36.68618 -5.63846 3.77606   0.616 11.78695 ? 371 PHE A CE2 1 
ATOM   2100 C  CE2 B PHE A 1 266 ? -39.05821 -2.22048 7.61332   0.384 13.85101 ? 371 PHE A CE2 1 
ATOM   2101 C  CZ  A PHE A 1 266 ? -37.99460 -5.13698 3.73560   0.616 11.78773 ? 371 PHE A CZ  1 
ATOM   2102 C  CZ  B PHE A 1 266 ? -39.59436 -2.66391 6.41103   0.384 13.84790 ? 371 PHE A CZ  1 
ATOM   2103 N  N   . GLY A 1 267 ? -35.48135 -0.82006 5.16185   1.000 12.91955 ? 372 GLY A N   1 
ATOM   2104 C  CA  . GLY A 1 267 ? -36.16090 0.44786  4.97393   1.000 12.28983 ? 372 GLY A CA  1 
ATOM   2105 C  C   . GLY A 1 267 ? -35.25348 1.63499  4.71516   1.000 11.96168 ? 372 GLY A C   1 
ATOM   2106 O  O   . GLY A 1 267 ? -35.74268 2.75247  4.56515   1.000 12.61393 ? 372 GLY A O   1 
ATOM   2107 N  N   . THR A 1 268 ? -33.94140 1.45069  4.77440   1.000 11.35813 ? 373 THR A N   1 
ATOM   2108 C  CA  . THR A 1 268 ? -32.99991 2.48452  4.37469   1.000 10.70634 ? 373 THR A CA  1 
ATOM   2109 C  C   . THR A 1 268 ? -32.45510 2.11583  3.00050   1.000 10.45176 ? 373 THR A C   1 
ATOM   2110 O  O   . THR A 1 268 ? -32.15367 0.94142  2.73907   1.000 10.78110 ? 373 THR A O   1 
ATOM   2111 C  CB  . THR A 1 268 ? -31.85960 2.52786  5.38680   1.000 10.71718 ? 373 THR A CB  1 
ATOM   2112 O  OG1 . THR A 1 268 ? -32.35861 2.97148  6.64909   1.000 10.55590 ? 373 THR A OG1 1 
ATOM   2113 C  CG2 . THR A 1 268 ? -30.78015 3.50787  4.89691   1.000 10.33816 ? 373 THR A CG2 1 
ATOM   2114 N  N   . VAL A 1 269 ? -32.31332 3.11270  2.11674   1.000 10.26275 ? 374 VAL A N   1 
ATOM   2115 C  CA  . VAL A 1 269 ? -31.79987 2.82222  0.78380   1.000 10.47636 ? 374 VAL A CA  1 
ATOM   2116 C  C   . VAL A 1 269 ? -30.42493 2.19375  0.88687   1.000 10.56669 ? 374 VAL A C   1 
ATOM   2117 O  O   . VAL A 1 269 ? -29.60776 2.56819  1.73920   1.000 10.96153 ? 374 VAL A O   1 
ATOM   2118 C  CB  . VAL A 1 269 ? -31.74221 4.09712  -0.07861  1.000 11.25404 ? 374 VAL A CB  1 
ATOM   2119 C  CG1 . VAL A 1 269 ? -33.13367 4.61871  -0.35977  1.000 11.76025 ? 374 VAL A CG1 1 
ATOM   2120 C  CG2 . VAL A 1 269 ? -30.80802 5.18846  0.52755   1.000 11.73948 ? 374 VAL A CG2 1 
ATOM   2121 N  N   . ASN A 1 270 ? -30.14961 1.24449  0.00189   1.000 9.98794  ? 375 ASN A N   1 
ATOM   2122 C  CA  . ASN A 1 270 ? -28.80904 0.68383  -0.14422  1.000 10.11495 ? 375 ASN A CA  1 
ATOM   2123 C  C   . ASN A 1 270 ? -28.24800 1.22218  -1.44687  1.000 9.52298  ? 375 ASN A C   1 
ATOM   2124 O  O   . ASN A 1 270 ? -28.23298 0.53342  -2.45960  1.000 9.61635  ? 375 ASN A O   1 
ATOM   2125 C  CB  . ASN A 1 270 ? -28.83887 -0.85410 -0.14216  1.000 10.99657 ? 375 ASN A CB  1 
ATOM   2126 C  CG  . ASN A 1 270 ? -27.46677 -1.44705 0.05970   1.000 11.55071 ? 375 ASN A CG  1 
ATOM   2127 O  OD1 . ASN A 1 270 ? -26.47807 -0.90378 -0.41185  1.000 11.51630 ? 375 ASN A OD1 1 
ATOM   2128 N  ND2 . ASN A 1 270 ? -27.39877 -2.55899 0.76422   1.000 11.54002 ? 375 ASN A ND2 1 
ATOM   2129 N  N   . LEU A 1 271 ? -27.80953 2.49010  -1.41939  1.000 9.09894  ? 376 LEU A N   1 
ATOM   2130 C  CA  . LEU A 1 271 ? -27.40053 3.21822  -2.61258  1.000 9.04406  ? 376 LEU A CA  1 
ATOM   2131 C  C   . LEU A 1 271 ? -26.14743 4.00587  -2.28578  1.000 8.99961  ? 376 LEU A C   1 
ATOM   2132 O  O   . LEU A 1 271 ? -26.11459 4.72174  -1.28169  1.000 8.99469  ? 376 LEU A O   1 
ATOM   2133 C  CB  . LEU A 1 271 ? -28.50745 4.19837  -3.03712  1.000 10.17310 ? 376 LEU A CB  1 
ATOM   2134 C  CG  . LEU A 1 271 ? -29.88546 3.56694  -3.36594  1.000 11.21853 ? 376 LEU A CG  1 
ATOM   2135 C  CD1 . LEU A 1 271 ? -30.88994 4.66695  -3.66096  1.000 11.80353 ? 376 LEU A CD1 1 
ATOM   2136 C  CD2 . LEU A 1 271 ? -29.71986 2.65646  -4.57494  1.000 11.67874 ? 376 LEU A CD2 1 
ATOM   2137 N  N   . LEU A 1 272 ? -25.12448 3.85319  -3.10659  1.000 9.06414  ? 377 LEU A N   1 
ATOM   2138 C  CA  . LEU A 1 272 ? -23.83533 4.48334  -2.85346  1.000 9.06525  ? 377 LEU A CA  1 
ATOM   2139 C  C   . LEU A 1 272 ? -23.50178 5.33648  -4.06512  1.000 7.99530  ? 377 LEU A C   1 
ATOM   2140 O  O   . LEU A 1 272 ? -23.47325 4.81721  -5.18830  1.000 7.48428  ? 377 LEU A O   1 
ATOM   2141 C  CB  . LEU A 1 272 ? -22.78450 3.38300  -2.70074  1.000 8.99306  ? 377 LEU A CB  1 
ATOM   2142 C  CG  . LEU A 1 272 ? -21.36409 3.89714  -2.44302  1.000 9.08330  ? 377 LEU A CG  1 
ATOM   2143 C  CD1 . LEU A 1 272 ? -21.29679 4.81460  -1.20925  1.000 9.03251  ? 377 LEU A CD1 1 
ATOM   2144 C  CD2 . LEU A 1 272 ? -20.36673 2.70464  -2.32808  1.000 9.50526  ? 377 LEU A CD2 1 
ATOM   2145 N  N   . ALA A 1 273 ? -23.24451 6.62846  -3.83987  1.000 7.49728  ? 378 ALA A N   1 
ATOM   2146 C  CA  . ALA A 1 273 ? -23.01610 7.56529  -4.93433  1.000 7.75564  ? 378 ALA A CA  1 
ATOM   2147 C  C   . ALA A 1 273 ? -21.93422 7.05806  -5.87537  1.000 8.53667  ? 378 ALA A C   1 
ATOM   2148 O  O   . ALA A 1 273 ? -20.89036 6.59499  -5.44200  1.000 8.29985  ? 378 ALA A O   1 
ATOM   2149 C  CB  . ALA A 1 273 ? -22.55853 8.91709  -4.37120  1.000 7.75621  ? 378 ALA A CB  1 
ATOM   2150 N  N   . TYR A 1 274 ? -22.17140 7.21901  -7.17641  1.000 9.87464  ? 379 TYR A N   1 
ATOM   2151 C  CA  . TYR A 1 274 ? -21.36727 6.60161  -8.22267  1.000 9.47009  ? 379 TYR A CA  1 
ATOM   2152 C  C   . TYR A 1 274 ? -21.45527 7.48219  -9.46056  1.000 9.98954  ? 379 TYR A C   1 
ATOM   2153 O  O   . TYR A 1 274 ? -22.54596 7.87561  -9.86741  1.000 9.96190  ? 379 TYR A O   1 
ATOM   2154 C  CB  . TYR A 1 274 ? -21.90133 5.19158  -8.50145  1.000 9.73162  ? 379 TYR A CB  1 
ATOM   2155 C  CG  . TYR A 1 274 ? -21.23144 4.50667  -9.65980  1.000 10.52151 ? 379 TYR A CG  1 
ATOM   2156 C  CD1 . TYR A 1 274 ? -19.83152 4.48004  -9.76743  1.000 11.43267 ? 379 TYR A CD1 1 
ATOM   2157 C  CD2 . TYR A 1 274 ? -21.99369 3.83118  -10.65091 1.000 11.61967 ? 379 TYR A CD2 1 
ATOM   2158 C  CE1 . TYR A 1 274 ? -19.20813 3.82932  -10.84666 1.000 10.94745 ? 379 TYR A CE1 1 
ATOM   2159 C  CE2 . TYR A 1 274 ? -21.35623 3.18036  -11.73611 1.000 11.94311 ? 379 TYR A CE2 1 
ATOM   2160 C  CZ  . TYR A 1 274 ? -19.96914 3.18959  -11.82489 1.000 11.62678 ? 379 TYR A CZ  1 
ATOM   2161 O  OH  . TYR A 1 274 ? -19.35878 2.54579  -12.88596 1.000 11.68810 ? 379 TYR A OH  1 
ATOM   2162 N  N   . ASN A 1 275 ? -20.30458 7.78302  -10.07404 1.000 10.18506 ? 380 ASN A N   1 
ATOM   2163 C  CA  . ASN A 1 275 ? -20.33585 8.72143  -11.17304 1.000 10.50857 ? 380 ASN A CA  1 
ATOM   2164 C  C   . ASN A 1 275 ? -20.54851 8.05989  -12.51657 1.000 11.53231 ? 380 ASN A C   1 
ATOM   2165 O  O   . ASN A 1 275 ? -20.71742 8.77859  -13.50662 1.000 12.18064 ? 380 ASN A O   1 
ATOM   2166 C  CB  . ASN A 1 275 ? -19.10202 9.65228  -11.17563 1.000 9.97806  ? 380 ASN A CB  1 
ATOM   2167 C  CG  . ASN A 1 275 ? -17.80720 8.95462  -11.55018 1.000 10.78951 ? 380 ASN A CG  1 
ATOM   2168 O  OD1 . ASN A 1 275 ? -17.76465 7.78092  -11.93262 1.000 10.85713 ? 380 ASN A OD1 1 
ATOM   2169 N  ND2 . ASN A 1 275 ? -16.74389 9.71826  -11.45686 1.000 11.14767 ? 380 ASN A ND2 1 
ATOM   2170 N  N   A ASN A 1 276 ? -20.51509 6.72640  -12.58554 0.609 13.07074 ? 381 ASN A N   1 
ATOM   2171 N  N   B ASN A 1 276 ? -20.55234 6.72613  -12.56969 0.391 12.58299 ? 381 ASN A N   1 
ATOM   2172 C  CA  A ASN A 1 276 ? -20.79546 6.02009  -13.82589 0.609 13.76220 ? 381 ASN A CA  1 
ATOM   2173 C  CA  B ASN A 1 276 ? -20.76585 5.99294  -13.81045 0.391 13.02658 ? 381 ASN A CA  1 
ATOM   2174 C  C   A ASN A 1 276 ? -19.87555 6.44719  -14.96322 0.609 14.40748 ? 381 ASN A C   1 
ATOM   2175 C  C   B ASN A 1 276 ? -19.90322 6.53918  -14.94516 0.391 13.84412 ? 381 ASN A C   1 
ATOM   2176 O  O   A ASN A 1 276 ? -20.27265 6.40371  -16.13218 0.609 15.01425 ? 381 ASN A O   1 
ATOM   2177 O  O   B ASN A 1 276 ? -20.35456 6.69011  -16.08175 0.391 14.00989 ? 381 ASN A O   1 
ATOM   2178 C  CB  A ASN A 1 276 ? -22.24820 6.22069  -14.24549 0.609 14.30218 ? 381 ASN A CB  1 
ATOM   2179 C  CB  B ASN A 1 276 ? -22.24121 5.97365  -14.20265 0.391 13.25365 ? 381 ASN A CB  1 
ATOM   2180 C  CG  A ASN A 1 276 ? -23.19691 5.45543  -13.39096 0.609 15.22481 ? 381 ASN A CG  1 
ATOM   2181 C  CG  B ASN A 1 276 ? -22.54580 4.89771  -15.21316 0.391 13.71528 ? 381 ASN A CG  1 
ATOM   2182 O  OD1 A ASN A 1 276 ? -23.52217 4.31135  -13.70486 0.609 15.51716 ? 381 ASN A OD1 1 
ATOM   2183 O  OD1 B ASN A 1 276 ? -22.02561 3.78407  -15.10942 0.391 13.84217 ? 381 ASN A OD1 1 
ATOM   2184 N  ND2 A ASN A 1 276 ? -23.66400 6.06707  -12.31456 0.609 15.42940 ? 381 ASN A ND2 1 
ATOM   2185 N  ND2 B ASN A 1 276 ? -23.36976 5.21925  -16.20687 0.391 14.24890 ? 381 ASN A ND2 1 
ATOM   2186 N  N   . TYR A 1 277 ? -18.65543 6.86594  -14.62535 1.000 14.43271 ? 382 TYR A N   1 
ATOM   2187 C  CA  . TYR A 1 277 ? -17.75930 7.40301  -15.62434 1.000 15.90994 ? 382 TYR A CA  1 
ATOM   2188 C  C   . TYR A 1 277 ? -17.26791 6.26788  -16.50331 1.000 18.21813 ? 382 TYR A C   1 
ATOM   2189 O  O   . TYR A 1 277 ? -16.83679 5.22786  -16.00593 1.000 18.36129 ? 382 TYR A O   1 
ATOM   2190 C  CB  . TYR A 1 277 ? -16.58303 8.12297  -14.97820 1.000 16.91029 ? 382 TYR A CB  1 
ATOM   2191 C  CG  . TYR A 1 277 ? -15.62062 8.64659  -16.01655 1.000 18.08477 ? 382 TYR A CG  1 
ATOM   2192 C  CD1 . TYR A 1 277 ? -16.01308 9.65408  -16.89806 1.000 19.09291 ? 382 TYR A CD1 1 
ATOM   2193 C  CD2 . TYR A 1 277 ? -14.35249 8.12540  -16.14114 1.000 18.63881 ? 382 TYR A CD2 1 
ATOM   2194 C  CE1 . TYR A 1 277 ? -15.14588 10.14358 -17.88637 1.000 19.20242 ? 382 TYR A CE1 1 
ATOM   2195 C  CE2 . TYR A 1 277 ? -13.45196 8.61708  -17.12284 1.000 18.65176 ? 382 TYR A CE2 1 
ATOM   2196 C  CZ  . TYR A 1 277 ? -13.85202 9.62653  -17.97381 1.000 19.05556 ? 382 TYR A CZ  1 
ATOM   2197 O  OH  . TYR A 1 277 ? -12.98937 10.07657 -18.95286 1.000 19.24957 ? 382 TYR A OH  1 
ATOM   2198 N  N   . GLN A 1 278 ? -17.37899 6.45320  -17.80100 1.000 20.78151 ? 383 GLN A N   1 
ATOM   2199 C  CA  . GLN A 1 278 ? -16.82875 5.52756  -18.77885 1.000 23.96764 ? 383 GLN A CA  1 
ATOM   2200 C  C   . GLN A 1 278 ? -15.91416 6.34235  -19.69135 1.000 25.41780 ? 383 GLN A C   1 
ATOM   2201 O  O   . GLN A 1 278 ? -16.37903 7.27132  -20.36548 1.000 25.41704 ? 383 GLN A O   1 
ATOM   2202 C  CB  . GLN A 1 278 ? -17.95849 4.92040  -19.61926 1.000 25.73050 ? 383 GLN A CB  1 
ATOM   2203 C  CG  . GLN A 1 278 ? -19.20975 4.45035  -18.86813 1.000 27.50346 ? 383 GLN A CG  1 
ATOM   2204 C  CD  . GLN A 1 278 ? -18.93637 3.40949  -17.78426 1.000 28.77122 ? 383 GLN A CD  1 
ATOM   2205 O  OE1 . GLN A 1 278 ? -17.96589 2.65396  -17.85010 1.000 29.00338 ? 383 GLN A OE1 1 
ATOM   2206 N  NE2 . GLN A 1 278 ? -19.80742 3.36832  -16.77615 1.000 30.15553 ? 383 GLN A NE2 1 
ATOM   2207 N  N   . ALA A 1 279 ? -14.62503 6.01105  -19.72035 1.000 26.27069 ? 384 ALA A N   1 
ATOM   2208 C  CA  . ALA A 1 279 ? -13.69628 6.69601  -20.65470 1.000 27.25903 ? 384 ALA A CA  1 
ATOM   2209 C  C   . ALA A 1 279 ? -14.09087 6.55163  -22.13537 1.000 27.38282 ? 384 ALA A C   1 
ATOM   2210 O  O   . ALA A 1 279 ? -14.86680 5.66839  -22.48825 1.000 27.67662 ? 384 ALA A O   1 
ATOM   2211 C  CB  . ALA A 1 279 ? -12.26344 6.22174  -20.44935 1.000 27.34474 ? 384 ALA A CB  1 
HETATM 2212 CA CA  . CA  B 2 .   ? -34.81063 13.59481 -0.09515  1.000 7.09396  ? 401 CA  A CA  1 
HETATM 2213 CA CA  . CA  C 2 .   ? -20.82121 -3.32058 -6.60173  1.000 18.30978 ? 402 CA  A CA  1 
HETATM 2214 N  N   . NO3 D 3 .   ? -16.13305 32.56418 15.42375  0.741 9.73117  ? 403 NO3 A N   1 
HETATM 2215 O  O1  . NO3 D 3 .   ? -16.19397 33.75181 15.78816  0.741 10.35739 ? 403 NO3 A O1  1 
HETATM 2216 O  O2  . NO3 D 3 .   ? -16.22917 32.25794 14.25148  0.741 9.13394  ? 403 NO3 A O2  1 
HETATM 2217 O  O3  . NO3 D 3 .   ? -16.05537 31.63436 16.22470  0.741 9.45976  ? 403 NO3 A O3  1 
HETATM 2218 O  O   . HOH E 4 .   ? -16.81818 3.83408  -14.21628 1.000 41.28962 ? 501 HOH A O   1 
HETATM 2219 O  O   . HOH E 4 .   ? -35.54440 33.05236 7.02987   1.000 28.99003 ? 502 HOH A O   1 
HETATM 2220 O  O   . HOH E 4 .   ? -16.15355 1.96323  -19.10321 1.000 29.32730 ? 503 HOH A O   1 
HETATM 2221 O  O   . HOH E 4 .   ? -27.77780 -2.11789 11.30220  1.000 27.53628 ? 504 HOH A O   1 
HETATM 2222 O  O   . HOH E 4 .   ? -16.31952 37.36449 -2.33012  1.000 34.61749 ? 505 HOH A O   1 
HETATM 2223 O  O   . HOH E 4 .   ? -7.73125  29.64757 10.90203  1.000 38.13058 ? 506 HOH A O   1 
HETATM 2224 O  O   . HOH E 4 .   ? -13.14257 40.53358 11.08140  1.000 34.15477 ? 507 HOH A O   1 
HETATM 2225 O  O   . HOH E 4 .   ? -14.19014 27.47450 -11.11186 1.000 32.26156 ? 508 HOH A O   1 
HETATM 2226 O  O   . HOH E 4 .   ? -27.79825 20.69529 -16.02992 1.000 33.56507 ? 509 HOH A O   1 
HETATM 2227 O  O   . HOH E 4 .   ? 0.45209   24.42214 2.72620   1.000 29.85565 ? 510 HOH A O   1 
HETATM 2228 O  O   . HOH E 4 .   ? -10.85887 3.36863  6.93916   1.000 23.83772 ? 511 HOH A O   1 
HETATM 2229 O  O   . HOH E 4 .   ? -35.55743 19.07509 17.93457  1.000 39.76832 ? 512 HOH A O   1 
HETATM 2230 O  O   . HOH E 4 .   ? -29.97203 3.17221  16.33661  1.000 38.87394 ? 513 HOH A O   1 
HETATM 2231 O  O   . HOH E 4 .   ? -36.45371 18.66847 -6.62082  1.000 24.17241 ? 514 HOH A O   1 
HETATM 2232 O  O   . HOH E 4 .   ? -21.09381 -5.16821 1.16046   1.000 28.71994 ? 515 HOH A O   1 
HETATM 2233 O  O   . HOH E 4 .   ? -11.94850 3.81016  -8.74114  1.000 17.74472 ? 516 HOH A O   1 
HETATM 2234 O  O   . HOH E 4 .   ? -21.05526 20.17602 11.23964  1.000 16.55701 ? 517 HOH A O   1 
HETATM 2235 O  O   . HOH E 4 .   ? -34.92945 18.96630 -14.08475 1.000 34.48791 ? 518 HOH A O   1 
HETATM 2236 O  O   . HOH E 4 .   ? -34.48437 1.91187  8.06691   1.000 16.32133 ? 519 HOH A O   1 
HETATM 2237 O  O   . HOH E 4 .   ? -31.54404 9.71448  18.06457  1.000 32.04790 ? 520 HOH A O   1 
HETATM 2238 O  O   . HOH E 4 .   ? -15.88265 27.26907 -12.57287 1.000 35.83357 ? 521 HOH A O   1 
HETATM 2239 O  O   . HOH E 4 .   ? -35.66053 -0.91437 9.99255   1.000 28.23047 ? 522 HOH A O   1 
HETATM 2240 O  O   . HOH E 4 .   ? -34.52110 10.64759 -12.05677 1.000 40.93101 ? 523 HOH A O   1 
HETATM 2241 O  O   . HOH E 4 .   ? -25.37493 27.01189 18.33233  1.000 42.96975 ? 524 HOH A O   1 
HETATM 2242 O  O   . HOH E 4 .   ? -37.20893 5.54610  8.80109   1.000 17.85528 ? 525 HOH A O   1 
HETATM 2243 O  O   . HOH E 4 .   ? -0.43141  20.74434 3.05609   1.000 26.88531 ? 526 HOH A O   1 
HETATM 2244 O  O   . HOH E 4 .   ? -43.16856 19.51885 12.31655  1.000 13.43014 ? 527 HOH A O   1 
HETATM 2245 O  O   . HOH E 4 .   ? -18.96651 27.82914 20.28772  1.000 21.33829 ? 528 HOH A O   1 
HETATM 2246 O  O   . HOH E 4 .   ? -25.02132 0.27215  -2.52114  1.000 10.97109 ? 529 HOH A O   1 
HETATM 2247 O  O   . HOH E 4 .   ? -19.69801 -3.92953 -1.93663  1.000 12.53627 ? 530 HOH A O   1 
HETATM 2248 O  O   . HOH E 4 .   ? -24.88683 2.52525  -12.38852 1.000 29.37835 ? 531 HOH A O   1 
HETATM 2249 O  O   . HOH E 4 .   ? -4.21019  4.39123  -8.38841  1.000 16.67135 ? 532 HOH A O   1 
HETATM 2250 O  O   . HOH E 4 .   ? -20.24892 20.37451 3.18123   1.000 11.11676 ? 533 HOH A O   1 
HETATM 2251 O  O   . HOH E 4 .   ? -12.32908 -3.59675 -6.53980  1.000 17.97564 ? 534 HOH A O   1 
HETATM 2252 O  O   . HOH E 4 .   ? -9.59831  22.92687 14.74730  1.000 25.98711 ? 535 HOH A O   1 
HETATM 2253 O  O   . HOH E 4 .   ? -25.50127 38.44532 -1.73965  1.000 27.22592 ? 536 HOH A O   1 
HETATM 2254 O  O   . HOH E 4 .   ? -11.98796 32.17568 16.61683  1.000 21.36267 ? 537 HOH A O   1 
HETATM 2255 O  O   . HOH E 4 .   ? -22.06700 -0.42937 10.12436  1.000 31.77872 ? 538 HOH A O   1 
HETATM 2256 O  O   . HOH E 4 .   ? -32.46144 -1.61054 2.21438   1.000 28.01339 ? 539 HOH A O   1 
HETATM 2257 O  O   . HOH E 4 .   ? -21.03761 22.45454 4.99422   1.000 8.65599  ? 540 HOH A O   1 
HETATM 2258 O  O   . HOH E 4 .   ? -20.33227 38.55039 -0.80469  1.000 28.37725 ? 541 HOH A O   1 
HETATM 2259 O  O   . HOH E 4 .   ? -3.66493  28.61078 3.25933   1.000 17.81579 ? 542 HOH A O   1 
HETATM 2260 O  O   . HOH E 4 .   ? -9.61291  9.45077  9.99148   1.000 25.23749 ? 543 HOH A O   1 
HETATM 2261 O  O   . HOH E 4 .   ? -13.02714 33.11753 12.37358  1.000 9.93673  ? 544 HOH A O   1 
HETATM 2262 O  O   . HOH E 4 .   ? -35.07789 15.82178 17.35615  1.000 33.20897 ? 545 HOH A O   1 
HETATM 2263 O  O   . HOH E 4 .   ? -4.93049  21.72941 -11.52803 1.000 13.83186 ? 546 HOH A O   1 
HETATM 2264 O  O   . HOH E 4 .   ? -19.27234 10.27998 -15.13151 1.000 23.46165 ? 547 HOH A O   1 
HETATM 2265 O  O   . HOH E 4 .   ? -11.54977 9.45002  0.64621   1.000 49.84029 ? 548 HOH A O   1 
HETATM 2266 O  O   . HOH E 4 .   ? -18.58844 1.07602  9.22876   1.000 19.24636 ? 549 HOH A O   1 
HETATM 2267 O  O   . HOH E 4 .   ? -36.09070 25.67757 15.41110  1.000 27.08251 ? 550 HOH A O   1 
HETATM 2268 O  O   . HOH E 4 .   ? -19.49698 35.48062 19.99669  1.000 29.91354 ? 551 HOH A O   1 
HETATM 2269 O  O   . HOH E 4 .   ? -13.39865 16.44235 -11.04084 1.000 15.65519 ? 552 HOH A O   1 
HETATM 2270 O  O   . HOH E 4 .   ? -2.56189  23.57696 -8.45153  1.000 20.38011 ? 553 HOH A O   1 
HETATM 2271 O  O   . HOH E 4 .   ? -40.45273 19.53327 8.65144   1.000 20.99328 ? 554 HOH A O   1 
HETATM 2272 O  O   . HOH E 4 .   ? -8.85229  12.37925 12.49106  1.000 12.94539 ? 555 HOH A O   1 
HETATM 2273 O  O   . HOH E 4 .   ? -39.36120 25.86137 -7.04256  1.000 29.50006 ? 556 HOH A O   1 
HETATM 2274 O  O   . HOH E 4 .   ? -33.03184 14.50694 17.75820  1.000 23.52932 ? 557 HOH A O   1 
HETATM 2275 O  O   . HOH E 4 .   ? -39.29754 9.16553  4.80645   1.000 18.93489 ? 558 HOH A O   1 
HETATM 2276 O  O   . HOH E 4 .   ? -0.71112  18.05348 6.32418   1.000 35.74778 ? 559 HOH A O   1 
HETATM 2277 O  O   . HOH E 4 .   ? -28.95168 25.66215 -10.11135 1.000 10.43338 ? 560 HOH A O   1 
HETATM 2278 O  O   . HOH E 4 .   ? -27.64720 22.73551 -14.12861 1.000 20.91449 ? 561 HOH A O   1 
HETATM 2279 O  O   . HOH E 4 .   ? -35.06373 -2.10719 2.85437   1.000 31.79203 ? 562 HOH A O   1 
HETATM 2280 O  O   . HOH E 4 .   ? -12.14480 3.17259  -2.68973  1.000 12.27502 ? 563 HOH A O   1 
HETATM 2281 O  O   . HOH E 4 .   ? -15.62117 1.70133  9.78630   1.000 21.26033 ? 564 HOH A O   1 
HETATM 2282 O  O   . HOH E 4 .   ? -21.09871 0.75012  -13.85578 1.000 29.38792 ? 565 HOH A O   1 
HETATM 2283 O  O   . HOH E 4 .   ? -20.00509 14.57153 10.26656  1.000 16.69573 ? 566 HOH A O   1 
HETATM 2284 O  O   . HOH E 4 .   ? -16.07070 14.92174 11.75292  1.000 23.26848 ? 567 HOH A O   1 
HETATM 2285 O  O   . HOH E 4 .   ? -33.59014 5.66607  2.93762   1.000 10.45644 ? 568 HOH A O   1 
HETATM 2286 O  O   . HOH E 4 .   ? -23.99087 9.32900  -14.55225 1.000 21.73181 ? 569 HOH A O   1 
HETATM 2287 O  O   . HOH E 4 .   ? -19.50698 -4.64729 3.32740   1.000 23.69170 ? 570 HOH A O   1 
HETATM 2288 O  O   . HOH E 4 .   ? -11.92919 32.25515 5.22427   1.000 26.94673 ? 571 HOH A O   1 
HETATM 2289 O  O   . HOH E 4 .   ? -19.70214 4.19677  -5.14858  1.000 20.69944 ? 572 HOH A O   1 
HETATM 2290 O  O   . HOH E 4 .   ? -13.10838 1.53676  -4.92122  1.000 13.95332 ? 573 HOH A O   1 
HETATM 2291 O  O   . HOH E 4 .   ? -23.91382 34.54984 14.09472  1.000 32.71117 ? 574 HOH A O   1 
HETATM 2292 O  O   . HOH E 4 .   ? -24.65800 -4.94782 -5.75667  1.000 21.12248 ? 575 HOH A O   1 
HETATM 2293 O  O   . HOH E 4 .   ? -9.73936  30.76423 6.80177   1.000 18.19745 ? 576 HOH A O   1 
HETATM 2294 O  O   . HOH E 4 .   ? -33.47807 29.14878 2.36076   1.000 17.83681 ? 577 HOH A O   1 
HETATM 2295 O  O   . HOH E 4 .   ? -2.21959  18.46115 -1.09527  1.000 16.21464 ? 578 HOH A O   1 
HETATM 2296 O  O   . HOH E 4 .   ? -41.00666 19.73004 1.82321   1.000 24.11014 ? 579 HOH A O   1 
HETATM 2297 O  O   . HOH E 4 .   ? -26.13889 31.49059 -10.25648 1.000 12.28743 ? 580 HOH A O   1 
HETATM 2298 O  O   . HOH E 4 .   ? -35.70639 11.67142 1.33832   1.000 10.70744 ? 581 HOH A O   1 
HETATM 2299 O  O   . HOH E 4 .   ? -40.31162 26.00968 2.92370   1.000 18.59804 ? 582 HOH A O   1 
HETATM 2300 O  O   . HOH E 4 .   ? -7.76095  29.72357 8.21092   1.000 22.07011 ? 583 HOH A O   1 
HETATM 2301 O  O   . HOH E 4 .   ? -36.85953 17.93536 -4.14593  1.000 22.17373 ? 584 HOH A O   1 
HETATM 2302 O  O   . HOH E 4 .   ? -24.07382 9.19463  -11.67821 1.000 15.42153 ? 585 HOH A O   1 
HETATM 2303 O  O   . HOH E 4 .   ? -28.14142 37.21273 6.13320   1.000 18.46424 ? 586 HOH A O   1 
HETATM 2304 O  O   . HOH E 4 .   ? -24.86506 7.86865  -8.19095  1.000 10.11864 ? 587 HOH A O   1 
HETATM 2305 O  O   . HOH E 4 .   ? -30.21151 35.68009 4.91935   1.000 7.18347  ? 588 HOH A O   1 
HETATM 2306 O  O   . HOH E 4 .   ? -37.25907 28.76215 8.00839   1.000 13.50099 ? 589 HOH A O   1 
HETATM 2307 O  O   . HOH E 4 .   ? -5.14245  2.98959  -12.42221 1.000 34.22422 ? 590 HOH A O   1 
HETATM 2308 O  O   . HOH E 4 .   ? -38.02328 22.10969 -1.68504  1.000 11.96773 ? 591 HOH A O   1 
HETATM 2309 O  O   . HOH E 4 .   ? -40.22103 21.89754 5.22736   1.000 16.70258 ? 592 HOH A O   1 
HETATM 2310 O  O   . HOH E 4 .   ? -3.45872  4.19186  -3.61538  1.000 31.28309 ? 593 HOH A O   1 
HETATM 2311 O  O   . HOH E 4 .   ? -33.25045 16.18152 -15.25889 1.000 29.38425 ? 594 HOH A O   1 
HETATM 2312 O  O   . HOH E 4 .   ? -17.91072 27.28680 4.76852   1.000 9.42644  ? 595 HOH A O   1 
HETATM 2313 O  O   . HOH E 4 .   ? -23.95953 18.16271 13.38868  1.000 35.18417 ? 596 HOH A O   1 
HETATM 2314 O  O   . HOH E 4 .   ? -18.17005 2.83799  0.54092   1.000 9.70048  ? 597 HOH A O   1 
HETATM 2315 O  O   . HOH E 4 .   ? -25.58213 6.74803  -15.68384 1.000 38.55375 ? 598 HOH A O   1 
HETATM 2316 O  O   . HOH E 4 .   ? -16.07926 -5.17613 1.57645   1.000 29.31881 ? 599 HOH A O   1 
HETATM 2317 O  O   . HOH E 4 .   ? -40.73277 22.18043 7.87709   1.000 15.55421 ? 600 HOH A O   1 
HETATM 2318 O  O   . HOH E 4 .   ? -18.17775 17.69165 -14.82589 1.000 11.43206 ? 601 HOH A O   1 
HETATM 2319 O  O   . HOH E 4 .   ? -11.70609 14.22729 0.07797   1.000 10.56497 ? 602 HOH A O   1 
HETATM 2320 O  O   . HOH E 4 .   ? -13.94131 20.23361 13.54592  1.000 31.38650 ? 603 HOH A O   1 
HETATM 2321 O  O   . HOH E 4 .   ? -34.39166 22.63197 -7.25911  1.000 30.43002 ? 604 HOH A O   1 
HETATM 2322 O  O   . HOH E 4 .   ? -24.97070 -3.17923 -7.84978  1.000 37.82215 ? 605 HOH A O   1 
HETATM 2323 O  O   . HOH E 4 .   ? -23.62661 21.03913 -19.56659 1.000 27.73136 ? 606 HOH A O   1 
HETATM 2324 O  O   . HOH E 4 .   ? -31.43358 -3.55937 4.18515   1.000 31.73334 ? 607 HOH A O   1 
HETATM 2325 O  O   . HOH E 4 .   ? -8.40705  29.09814 15.32265  1.000 20.56836 ? 608 HOH A O   1 
HETATM 2326 O  O   . HOH E 4 .   ? -34.29039 14.20177 2.22654   1.000 9.18859  ? 609 HOH A O   1 
HETATM 2327 O  O   . HOH E 4 .   ? 0.86552   21.32785 7.25334   1.000 21.76014 ? 610 HOH A O   1 
HETATM 2328 O  O   . HOH E 4 .   ? -28.50186 17.33826 9.05968   1.000 11.87959 ? 611 HOH A O   1 
HETATM 2329 O  O   . HOH E 4 .   ? -15.90387 5.69210  -25.05218 1.000 27.41943 ? 612 HOH A O   1 
HETATM 2330 O  O   . HOH E 4 .   ? -4.05643  19.01085 9.43975   1.000 10.65673 ? 613 HOH A O   1 
HETATM 2331 O  O   . HOH E 4 .   ? -43.43629 22.68372 8.43049   1.000 26.68121 ? 614 HOH A O   1 
HETATM 2332 O  O   . HOH E 4 .   ? -9.11758  29.92823 -3.78011  1.000 10.20120 ? 615 HOH A O   1 
HETATM 2333 O  O   . HOH E 4 .   ? -9.29172  9.32358  2.51766   1.000 10.15812 ? 616 HOH A O   1 
HETATM 2334 O  O   . HOH E 4 .   ? 1.01006   23.82635 6.02329   1.000 26.30609 ? 617 HOH A O   1 
HETATM 2335 O  O   . HOH E 4 .   ? -19.26611 25.67743 20.64514  1.000 41.75830 ? 618 HOH A O   1 
HETATM 2336 O  O   . HOH E 4 .   ? -38.67816 13.12276 6.44324   1.000 23.91101 ? 619 HOH A O   1 
HETATM 2337 O  O   . HOH E 4 .   ? -6.18973  -0.59832 -4.63988  1.000 27.33462 ? 620 HOH A O   1 
HETATM 2338 O  O   . HOH E 4 .   ? -1.00971  21.44033 -9.54547  1.000 20.16134 ? 621 HOH A O   1 
HETATM 2339 O  O   . HOH E 4 .   ? -13.41948 1.00499  -1.23244  1.000 18.74439 ? 622 HOH A O   1 
HETATM 2340 O  O   . HOH E 4 .   ? -31.72979 17.38487 -6.45737  1.000 11.08279 ? 623 HOH A O   1 
HETATM 2341 O  O   . HOH E 4 .   ? -17.22467 12.35353 -10.55506 1.000 14.49376 ? 624 HOH A O   1 
HETATM 2342 O  O   . HOH E 4 .   ? -11.92247 -1.97768 0.26139   1.000 27.61825 ? 625 HOH A O   1 
HETATM 2343 O  O   . HOH E 4 .   ? -33.60988 34.01012 0.00000   0.50  9.36846  ? 626 HOH A O   1 
HETATM 2344 O  O   . HOH E 4 .   ? -10.04005 1.70746  -1.82524  1.000 27.79362 ? 627 HOH A O   1 
HETATM 2345 O  O   . HOH E 4 .   ? -33.53395 16.60720 -3.31944  1.000 13.64024 ? 628 HOH A O   1 
HETATM 2346 O  O   . HOH E 4 .   ? -21.34971 39.32341 2.40770   1.000 39.94257 ? 629 HOH A O   1 
HETATM 2347 O  O   . HOH E 4 .   ? -39.57395 13.75849 11.10151  1.000 17.03540 ? 630 HOH A O   1 
HETATM 2348 O  O   . HOH E 4 .   ? -34.74585 14.27119 -2.31389  1.000 12.28569 ? 631 HOH A O   1 
HETATM 2349 O  O   . HOH E 4 .   ? -13.09626 3.99354  5.48724   1.000 8.50680  ? 632 HOH A O   1 
HETATM 2350 O  O   . HOH E 4 .   ? -10.71096 38.95244 10.06635  1.000 48.73753 ? 633 HOH A O   1 
HETATM 2351 O  O   . HOH E 4 .   ? -8.67455  18.74105 -18.22982 1.000 32.81000 ? 634 HOH A O   1 
HETATM 2352 O  O   . HOH E 4 .   ? -19.00827 21.61700 12.70016  1.000 14.05689 ? 635 HOH A O   1 
HETATM 2353 O  O   . HOH E 4 .   ? -10.77988 34.46720 13.18638  1.000 20.21403 ? 636 HOH A O   1 
HETATM 2354 O  O   . HOH E 4 .   ? -8.10143  21.15969 -10.25616 1.000 26.39359 ? 637 HOH A O   1 
HETATM 2355 O  O   . HOH E 4 .   ? -30.31550 20.86002 17.73293  1.000 25.82618 ? 638 HOH A O   1 
HETATM 2356 O  O   . HOH E 4 .   ? -12.44005 11.50017 -0.69594  1.000 7.40502  ? 639 HOH A O   1 
HETATM 2357 O  O   . HOH E 4 .   ? -22.33506 -2.10784 -8.08572  1.000 16.03172 ? 640 HOH A O   1 
HETATM 2358 O  O   . HOH E 4 .   ? -36.36502 8.60422  8.10512   1.000 14.21175 ? 641 HOH A O   1 
HETATM 2359 O  O   . HOH E 4 .   ? -33.10056 7.64273  -2.82314  1.000 15.23705 ? 642 HOH A O   1 
HETATM 2360 O  O   . HOH E 4 .   ? -23.70349 0.40649  -10.51744 1.000 17.54216 ? 643 HOH A O   1 
HETATM 2361 O  O   . HOH E 4 .   ? -28.47753 38.86266 -1.54859  1.000 29.81146 ? 644 HOH A O   1 
HETATM 2362 O  O   . HOH E 4 .   ? -24.74116 31.04948 16.11597  1.000 26.58981 ? 645 HOH A O   1 
HETATM 2363 O  O   . HOH E 4 .   ? -12.77376 32.31357 -6.52132  1.000 22.43578 ? 646 HOH A O   1 
HETATM 2364 O  O   . HOH E 4 .   ? -36.42588 27.46836 -8.84797  1.000 20.79700 ? 647 HOH A O   1 
HETATM 2365 O  O   . HOH E 4 .   ? -25.40172 25.82049 -19.08828 1.000 32.10660 ? 648 HOH A O   1 
HETATM 2366 O  O   . HOH E 4 .   ? -15.09727 16.30701 3.70170   1.000 8.35495  ? 649 HOH A O   1 
HETATM 2367 O  O   . HOH E 4 .   ? -29.79882 23.28918 -12.40051 1.000 21.97888 ? 650 HOH A O   1 
HETATM 2368 O  O   . HOH E 4 .   ? -17.07939 3.97901  10.37577  1.000 10.48462 ? 651 HOH A O   1 
HETATM 2369 O  O   . HOH E 4 .   ? -39.92550 22.33131 14.94532  1.000 8.65660  ? 652 HOH A O   1 
HETATM 2370 O  O   . HOH E 4 .   ? -34.57738 7.55429  -0.69466  1.000 19.54769 ? 653 HOH A O   1 
HETATM 2371 O  O   . HOH E 4 .   ? -26.60381 24.49540 -17.64901 1.000 29.88657 ? 654 HOH A O   1 
HETATM 2372 O  O   . HOH E 4 .   ? -38.75641 25.34025 14.20604  1.000 22.52901 ? 655 HOH A O   1 
HETATM 2373 O  O   . HOH E 4 .   ? -14.01257 21.30880 16.19358  1.000 32.03036 ? 656 HOH A O   1 
HETATM 2374 O  O   . HOH E 4 .   ? -37.84031 5.09042  12.95946  1.000 39.65349 ? 657 HOH A O   1 
HETATM 2375 O  O   . HOH E 4 .   ? -23.64390 26.30246 -20.63080 1.000 40.48936 ? 658 HOH A O   1 
HETATM 2376 O  O   . HOH E 4 .   ? -35.71035 3.34406  12.06574  1.000 30.39010 ? 659 HOH A O   1 
HETATM 2377 O  O   . HOH E 4 .   ? -18.10307 16.43843 11.06016  1.000 22.01129 ? 660 HOH A O   1 
HETATM 2378 O  O   . HOH E 4 .   ? -27.16084 15.05418 13.75053  1.000 18.00629 ? 661 HOH A O   1 
HETATM 2379 O  O   . HOH E 4 .   ? -1.73377  21.30363 -4.13262  1.000 29.63000 ? 662 HOH A O   1 
HETATM 2380 O  O   . HOH E 4 .   ? -5.03417  12.85231 9.36805   1.000 11.15757 ? 663 HOH A O   1 
HETATM 2381 O  O   . HOH E 4 .   ? -34.90608 7.81950  -6.84030  1.000 38.72993 ? 664 HOH A O   1 
HETATM 2382 O  O   . HOH E 4 .   ? -30.02986 26.43826 17.52584  1.000 23.91935 ? 665 HOH A O   1 
HETATM 2383 O  O   . HOH E 4 .   ? -35.93170 4.41065  2.21880   1.000 31.10756 ? 666 HOH A O   1 
HETATM 2384 O  O   . HOH E 4 .   ? -17.63851 33.98306 -14.35574 1.000 25.14332 ? 667 HOH A O   1 
HETATM 2385 O  O   . HOH E 4 .   ? -33.57132 9.21957  15.89226  1.000 16.10345 ? 668 HOH A O   1 
HETATM 2386 O  O   . HOH E 4 .   ? -9.91287  32.85402 2.21780   1.000 41.92780 ? 669 HOH A O   1 
HETATM 2387 O  O   . HOH E 4 .   ? -18.48788 6.07111  15.37003  1.000 36.68427 ? 670 HOH A O   1 
HETATM 2388 O  O   . HOH E 4 .   ? -27.94482 36.99979 -0.23065  1.000 29.40141 ? 671 HOH A O   1 
HETATM 2389 O  O   . HOH E 4 .   ? -13.88597 37.24663 0.19770   1.000 34.87289 ? 672 HOH A O   1 
HETATM 2390 O  O   . HOH E 4 .   ? -28.91591 13.07484 19.61227  1.000 21.34137 ? 673 HOH A O   1 
HETATM 2391 O  O   . HOH E 4 .   ? -14.88752 34.86067 13.45402  1.000 11.85296 ? 674 HOH A O   1 
HETATM 2392 O  O   . HOH E 4 .   ? -27.20427 -4.24382 4.63191   1.000 23.36594 ? 675 HOH A O   1 
HETATM 2393 O  O   . HOH E 4 .   ? -2.05753  13.66881 -0.32573  1.000 32.27264 ? 676 HOH A O   1 
HETATM 2394 O  O   . HOH E 4 .   ? -13.09900 12.15585 12.72999  1.000 14.80294 ? 677 HOH A O   1 
HETATM 2395 O  O   . HOH E 4 .   ? -31.13579 17.90972 -3.69227  1.000 9.44185  ? 678 HOH A O   1 
HETATM 2396 O  O   . HOH E 4 .   ? -18.66519 30.30644 -14.18528 1.000 27.53962 ? 679 HOH A O   1 
HETATM 2397 O  O   . HOH E 4 .   ? -32.73199 33.72112 10.01356  1.000 32.79640 ? 680 HOH A O   1 
HETATM 2398 O  O   . HOH E 4 .   ? -1.69050  3.38100  -9.47467  1.000 37.95933 ? 681 HOH A O   1 
HETATM 2399 O  O   . HOH E 4 .   ? -3.23861  9.05900  -13.79595 1.000 28.39320 ? 682 HOH A O   1 
HETATM 2400 O  O   . HOH E 4 .   ? -24.34566 23.64530 16.37811  1.000 28.66112 ? 683 HOH A O   1 
HETATM 2401 O  O   . HOH E 4 .   ? -24.43036 14.78196 13.61513  1.000 15.09046 ? 684 HOH A O   1 
HETATM 2402 O  O   . HOH E 4 .   ? -7.90682  25.14602 -11.24471 1.000 35.57529 ? 685 HOH A O   1 
HETATM 2403 O  O   . HOH E 4 .   ? -7.00062  22.32412 13.86266  1.000 12.60115 ? 686 HOH A O   1 
HETATM 2404 O  O   . HOH E 4 .   ? 1.06754   3.36721  -5.57382  1.000 32.55290 ? 687 HOH A O   1 
HETATM 2405 O  O   . HOH E 4 .   ? -1.76674  11.41886 -8.33571  1.000 29.50631 ? 688 HOH A O   1 
HETATM 2406 O  O   . HOH E 4 .   ? -29.22332 -5.48826 6.96117   1.000 33.73808 ? 689 HOH A O   1 
HETATM 2407 O  O   . HOH E 4 .   ? -32.47800 3.08121  -11.15799 1.000 32.30953 ? 690 HOH A O   1 
HETATM 2408 O  O   . HOH E 4 .   ? -11.40249 34.75734 4.59277   1.000 35.91214 ? 691 HOH A O   1 
HETATM 2409 O  O   . HOH E 4 .   ? -8.96261  32.91576 -4.61377  1.000 25.90646 ? 692 HOH A O   1 
HETATM 2410 O  O   . HOH E 4 .   ? -7.18015  0.05900  -7.91317  1.000 38.29680 ? 693 HOH A O   1 
HETATM 2411 O  O   . HOH E 4 .   ? -25.56452 -6.16205 9.61574   1.000 37.92615 ? 694 HOH A O   1 
HETATM 2412 O  O   . HOH E 4 .   ? -12.39053 24.36630 18.68515  1.000 40.50999 ? 695 HOH A O   1 
HETATM 2413 O  O   . HOH E 4 .   ? -32.88256 -4.47670 9.43707   1.000 27.58257 ? 696 HOH A O   1 
HETATM 2414 O  O   . HOH E 4 .   ? -37.04704 18.88608 -12.39338 1.000 28.54717 ? 697 HOH A O   1 
HETATM 2415 O  O   . HOH E 4 .   ? -8.76165  17.75618 -13.52588 1.000 33.94705 ? 698 HOH A O   1 
HETATM 2416 O  O   . HOH E 4 .   ? -18.48560 33.64436 17.67687  1.000 34.51808 ? 699 HOH A O   1 
HETATM 2417 O  O   . HOH E 4 .   ? -22.28484 8.18789  17.32618  1.000 31.61740 ? 700 HOH A O   1 
HETATM 2418 O  O   . HOH E 4 .   ? -19.27756 -4.18220 -5.42562  1.000 22.22875 ? 701 HOH A O   1 
HETATM 2419 O  O   . HOH E 4 .   ? -2.85930  14.18800 6.22617   1.000 28.72516 ? 702 HOH A O   1 
HETATM 2420 O  O   . HOH E 4 .   ? -31.91733 29.70457 16.74990  1.000 21.98035 ? 703 HOH A O   1 
HETATM 2421 O  O   . HOH E 4 .   ? -33.78638 15.49180 -6.69628  1.000 18.81005 ? 704 HOH A O   1 
HETATM 2422 O  O   . HOH E 4 .   ? -34.10690 10.03094 -3.84660  1.000 31.22363 ? 705 HOH A O   1 
HETATM 2423 O  O   . HOH E 4 .   ? -25.78965 11.05140 19.08209  1.000 35.25246 ? 706 HOH A O   1 
HETATM 2424 O  O   . HOH E 4 .   ? -9.59563  16.96350 13.69885  1.000 18.22955 ? 707 HOH A O   1 
HETATM 2425 O  O   . HOH E 4 .   ? 1.34295   17.42259 -5.15974  1.000 38.68047 ? 708 HOH A O   1 
HETATM 2426 O  O   . HOH E 4 .   ? -35.40387 5.57116  -11.87259 1.000 26.64548 ? 709 HOH A O   1 
HETATM 2427 O  O   . HOH E 4 .   ? -16.92672 11.42176 13.65893  1.000 39.70019 ? 710 HOH A O   1 
HETATM 2428 O  O   . HOH E 4 .   ? -7.79076  32.23716 3.17263   1.000 20.61108 ? 711 HOH A O   1 
HETATM 2429 O  O   . HOH E 4 .   ? -2.42819  23.18919 -5.94772  1.000 31.94955 ? 712 HOH A O   1 
HETATM 2430 O  O   . HOH E 4 .   ? -12.15471 34.86762 0.26422   1.000 21.91366 ? 713 HOH A O   1 
HETATM 2431 O  O   . HOH E 4 .   ? -18.03537 28.23127 -12.08478 1.000 27.76997 ? 714 HOH A O   1 
HETATM 2432 O  O   . HOH E 4 .   ? -11.06822 26.96903 17.21863  1.000 39.69267 ? 715 HOH A O   1 
HETATM 2433 O  O   . HOH E 4 .   ? -5.91613  13.63717 -12.59786 1.000 20.22539 ? 716 HOH A O   1 
HETATM 2434 O  O   . HOH E 4 .   ? -3.45922  11.55047 -5.41551  1.000 20.14717 ? 717 HOH A O   1 
HETATM 2435 O  O   . HOH E 4 .   ? -20.18762 38.87901 5.45572   1.000 16.00583 ? 718 HOH A O   1 
HETATM 2436 O  O   . HOH E 4 .   ? -9.26120  0.69022  0.29611   1.000 44.58695 ? 719 HOH A O   1 
HETATM 2437 O  O   . HOH E 4 .   ? -33.33121 22.67437 -11.68400 1.000 16.10445 ? 720 HOH A O   1 
HETATM 2438 O  O   . HOH E 4 .   ? -0.33354  18.21731 3.96247   1.000 38.01707 ? 721 HOH A O   1 
HETATM 2439 O  O   . HOH E 4 .   ? -20.74875 10.94516 16.58946  1.000 46.04488 ? 722 HOH A O   1 
HETATM 2440 O  O   . HOH E 4 .   ? -22.55362 12.45190 17.08980  1.000 32.91512 ? 723 HOH A O   1 
HETATM 2441 O  O   . HOH E 4 .   ? -42.97756 24.73572 5.21801   1.000 42.35593 ? 724 HOH A O   1 
HETATM 2442 O  O   . HOH E 4 .   ? -33.85388 6.24631  16.01337  1.000 20.31926 ? 725 HOH A O   1 
HETATM 2443 O  O   . HOH E 4 .   ? -25.45456 -6.56154 6.20698   1.000 34.03190 ? 726 HOH A O   1 
HETATM 2444 O  O   . HOH E 4 .   ? -32.17438 0.67515  -2.21549  1.000 24.67053 ? 727 HOH A O   1 
HETATM 2445 O  O   . HOH E 4 .   ? -27.71089 2.34505  -11.38183 1.000 32.00513 ? 728 HOH A O   1 
HETATM 2446 O  O   . HOH E 4 .   ? -11.11354 31.14768 -10.39037 1.000 29.65475 ? 729 HOH A O   1 
HETATM 2447 O  O   . HOH E 4 .   ? -9.35152  36.73401 11.59055  1.000 29.29074 ? 730 HOH A O   1 
HETATM 2448 O  O   . HOH E 4 .   ? -14.11084 37.67884 3.11818   1.000 37.36232 ? 731 HOH A O   1 
HETATM 2449 O  O   . HOH E 4 .   ? -22.45791 30.05480 17.65597  1.000 34.59370 ? 732 HOH A O   1 
HETATM 2450 O  O   . HOH E 4 .   ? -7.47870  7.04686  1.39550   1.000 18.16373 ? 733 HOH A O   1 
HETATM 2451 O  O   . HOH E 4 .   ? -31.93780 14.12637 -14.50181 1.000 17.39934 ? 734 HOH A O   1 
HETATM 2452 O  O   . HOH E 4 .   ? -5.71943  12.73274 -15.69736 1.000 33.20740 ? 735 HOH A O   1 
HETATM 2453 O  O   . HOH E 4 .   ? -22.26982 -5.22098 -7.28290  1.000 29.85027 ? 736 HOH A O   1 
HETATM 2454 O  O   . HOH E 4 .   ? -8.83709  30.11125 -10.54365 1.000 24.99627 ? 737 HOH A O   1 
HETATM 2455 O  O   . HOH E 4 .   ? -33.43413 12.77062 -12.25203 1.000 26.87129 ? 738 HOH A O   1 
HETATM 2456 O  O   . HOH E 4 .   ? -36.75429 12.58363 -1.54940  1.000 11.62670 ? 739 HOH A O   1 
HETATM 2457 O  O   . HOH E 4 .   ? -35.89093 9.03812  0.43866   1.000 35.33577 ? 740 HOH A O   1 
HETATM 2458 O  O   . HOH E 4 .   ? -25.87168 32.07065 -13.57755 1.000 30.41512 ? 741 HOH A O   1 
HETATM 2459 O  O   . HOH E 4 .   ? -25.64589 -1.00500 -9.22473  1.000 23.50573 ? 742 HOH A O   1 
HETATM 2460 O  O   . HOH E 4 .   ? -28.34498 15.49175 11.03051  1.000 26.53236 ? 743 HOH A O   1 
HETATM 2461 O  O   . HOH E 4 .   ? -27.67569 23.71685 16.21370  1.000 42.20420 ? 744 HOH A O   1 
HETATM 2462 O  O   . HOH E 4 .   ? -4.70630  7.29189  -1.03490  1.000 33.09649 ? 745 HOH A O   1 
HETATM 2463 O  O   . HOH E 4 .   ? -28.25910 40.68733 -9.33419  1.000 28.13531 ? 746 HOH A O   1 
HETATM 2464 O  O   . HOH E 4 .   ? -8.10400  1.74976  -9.52704  1.000 34.43356 ? 747 HOH A O   1 
HETATM 2465 O  O   . HOH E 4 .   ? -13.00103 38.88297 7.71503   1.000 26.83899 ? 748 HOH A O   1 
HETATM 2466 O  O   . HOH E 4 .   ? -19.56313 -4.58302 -8.66331  1.000 29.34715 ? 749 HOH A O   1 
HETATM 2467 O  O   . HOH E 4 .   ? -2.54351  11.40579 -10.94119 1.000 22.58869 ? 750 HOH A O   1 
HETATM 2468 O  O   . HOH E 4 .   ? -29.43423 -3.97970 2.78371   1.000 25.74376 ? 751 HOH A O   1 
HETATM 2469 O  O   . HOH E 4 .   ? -11.95913 -3.59699 8.70063   1.000 30.67136 ? 752 HOH A O   1 
HETATM 2470 O  O   . HOH E 4 .   ? -28.72945 40.51292 -4.19416  1.000 40.61073 ? 753 HOH A O   1 
HETATM 2471 O  O   . HOH E 4 .   ? -21.34517 17.89878 11.96612  1.000 43.06792 ? 754 HOH A O   1 
HETATM 2472 O  O   . HOH E 4 .   ? -12.22518 0.46772  8.38119   1.000 27.04796 ? 755 HOH A O   1 
HETATM 2473 O  O   . HOH E 4 .   ? -26.91149 15.80729 16.33706  1.000 28.61385 ? 756 HOH A O   1 
HETATM 2474 O  O   . HOH E 4 .   ? -23.27453 20.20535 12.96332  1.000 26.55585 ? 757 HOH A O   1 
HETATM 2475 O  O   . HOH E 4 .   ? -26.05748 23.22366 14.52879  1.000 29.02747 ? 758 HOH A O   1 
HETATM 2476 O  O   . HOH E 4 .   ? -10.36057 35.79528 6.33564   1.000 40.75790 ? 759 HOH A O   1 
HETATM 2477 O  O   . HOH E 4 .   ? -14.87470 30.19779 -14.07922 1.000 34.56622 ? 760 HOH A O   1 
HETATM 2478 O  O   . HOH E 4 .   ? -9.37684  -3.60406 -6.44473  1.000 31.76390 ? 761 HOH A O   1 
HETATM 2479 O  O   . HOH E 4 .   ? -9.15976  31.44006 16.59892  1.000 40.08155 ? 762 HOH A O   1 
HETATM 2480 O  O   . HOH E 4 .   ? -17.26123 37.23355 3.37832   1.000 24.05978 ? 763 HOH A O   1 
HETATM 2481 O  O   . HOH E 4 .   ? -24.23050 22.54000 12.43550  1.000 38.73271 ? 764 HOH A O   1 
HETATM 2482 O  O   . HOH E 4 .   ? -38.40889 5.61333  1.89018   1.000 37.19664 ? 765 HOH A O   1 
HETATM 2483 O  O   . HOH E 4 .   ? -40.58339 10.47282 9.38056   1.000 31.48312 ? 766 HOH A O   1 
HETATM 2484 O  O   . HOH E 4 .   ? -28.34171 25.83101 -14.99059 1.000 37.77740 ? 767 HOH A O   1 
HETATM 2485 O  O   . HOH E 4 .   ? -35.12191 28.52599 14.86405  1.000 27.28515 ? 768 HOH A O   1 
HETATM 2486 O  O   . HOH E 4 .   ? -35.62999 9.91519  -14.05834 1.000 32.05565 ? 769 HOH A O   1 
HETATM 2487 O  O   . HOH E 4 .   ? -23.30753 16.06743 10.45493  1.000 23.10114 ? 770 HOH A O   1 
HETATM 2488 O  O   . HOH E 4 .   ? -14.98910 33.45436 -11.18778 1.000 49.40696 ? 771 HOH A O   1 
HETATM 2489 O  O   . HOH E 4 .   ? -29.34378 35.10561 12.33118  1.000 39.39458 ? 772 HOH A O   1 
HETATM 2490 O  O   . HOH E 4 .   ? -30.58342 -3.91516 0.50959   1.000 39.10514 ? 773 HOH A O   1 
HETATM 2491 O  O   . HOH E 4 .   ? -40.05261 25.75547 0.01878   1.000 23.23789 ? 774 HOH A O   1 
HETATM 2492 O  O   . HOH E 4 .   ? -40.03421 16.11929 -1.11583  1.000 17.37855 ? 775 HOH A O   1 
HETATM 2493 O  O   . HOH E 4 .   ? -40.26640 23.39450 -5.42307  1.000 32.45928 ? 776 HOH A O   1 
HETATM 2494 O  O   . HOH E 4 .   ? -36.73417 21.34528 -6.03966  1.000 29.27490 ? 777 HOH A O   1 
HETATM 2495 O  O   . HOH E 4 .   ? -42.15754 25.00011 -2.78712  1.000 41.23241 ? 778 HOH A O   1 
HETATM 2496 O  O   . HOH E 4 .   ? -30.94607 16.12695 18.82637  1.000 23.44087 ? 779 HOH A O   1 
HETATM 2497 O  O   . HOH E 4 .   ? -4.50800  9.57950  -0.59217  1.000 37.12031 ? 780 HOH A O   1 
HETATM 2498 O  O   . HOH E 4 .   ? -12.60889 29.87897 -15.06291 1.000 29.82774 ? 781 HOH A O   1 
HETATM 2499 O  O   . HOH E 4 .   ? -5.07373  0.44186  -9.72145  1.000 29.65228 ? 782 HOH A O   1 
HETATM 2500 O  O   . HOH E 4 .   ? -15.78126 5.34077  12.47286  1.000 26.95093 ? 783 HOH A O   1 
HETATM 2501 O  O   . HOH E 4 .   ? -7.73674  33.46600 -1.58179  1.000 27.59847 ? 784 HOH A O   1 
HETATM 2502 O  O   . HOH E 4 .   ? -35.49719 1.70188  1.03662   1.000 35.52069 ? 785 HOH A O   1 
HETATM 2503 O  O   . HOH E 4 .   ? -28.61207 16.54876 18.07226  1.000 31.34133 ? 786 HOH A O   1 
HETATM 2504 O  O   . HOH E 4 .   ? -37.24065 31.84303 8.69465   1.000 30.39185 ? 787 HOH A O   1 
HETATM 2505 O  O   . HOH E 4 .   ? -33.76414 21.78296 17.86361  1.000 35.51651 ? 788 HOH A O   1 
HETATM 2506 O  O   . HOH E 4 .   ? -3.84670  11.87807 -1.86121  1.000 29.70791 ? 789 HOH A O   1 
HETATM 2507 O  O   . HOH E 4 .   ? -19.98328 13.07305 16.02336  1.000 42.00097 ? 790 HOH A O   1 
HETATM 2508 O  O   . HOH E 4 .   ? -17.74083 28.65567 -16.41735 1.000 33.74209 ? 791 HOH A O   1 
HETATM 2509 O  O   . HOH E 4 .   ? -39.10757 -0.73450 4.12480   1.000 26.63712 ? 792 HOH A O   1 
HETATM 2510 O  O   . HOH E 4 .   ? -22.93676 14.54891 15.69161  1.000 31.94092 ? 793 HOH A O   1 
HETATM 2511 O  O   . HOH E 4 .   ? -40.60975 24.45158 15.95836  1.000 27.92145 ? 794 HOH A O   1 
HETATM 2512 O  O   . HOH E 4 .   ? -15.28937 39.65099 6.47361   1.000 37.12638 ? 795 HOH A O   1 
HETATM 2513 O  O   . HOH E 4 .   ? -39.52421 12.80381 -0.67448  1.000 24.16528 ? 796 HOH A O   1 
HETATM 2514 O  O   . HOH E 4 .   ? -12.04622 -5.23502 6.98990   1.000 31.82811 ? 797 HOH A O   1 
HETATM 2515 O  O   . HOH E 4 .   ? -10.51177 24.40113 16.81571  1.000 28.72875 ? 798 HOH A O   1 
HETATM 2516 O  O   . HOH E 4 .   ? -37.59175 8.25739  -7.53374  1.000 30.81189 ? 799 HOH A O   1 
HETATM 2517 O  O   . HOH E 4 .   ? -8.34449  34.34362 1.28686   1.000 33.76371 ? 800 HOH A O   1 
HETATM 2518 O  O   . HOH E 4 .   ? -1.12195  22.47514 -0.38009  1.000 32.20066 ? 801 HOH A O   1 
HETATM 2519 O  O   . HOH E 4 .   ? -36.77298 9.39792  -2.67966  1.000 34.08706 ? 802 HOH A O   1 
HETATM 2520 O  O   . HOH E 4 .   ? -44.58467 20.69276 10.27889  1.000 34.52717 ? 803 HOH A O   1 
HETATM 2521 O  O   . HOH E 4 .   ? -32.57918 0.04194  12.34107  1.000 36.28245 ? 804 HOH A O   1 
HETATM 2522 O  O   . HOH E 4 .   ? -19.09462 26.64761 -17.92415 1.000 36.94409 ? 805 HOH A O   1 
HETATM 2523 O  O   . HOH E 4 .   ? -12.90109 36.15788 14.79487  1.000 15.36478 ? 806 HOH A O   1 
HETATM 2524 O  O   . HOH E 4 .   ? -34.38855 1.09123  10.89138  1.000 23.27068 ? 807 HOH A O   1 
HETATM 2525 O  O   . HOH E 4 .   ? -40.76523 23.37798 -0.90184  1.000 26.73977 ? 808 HOH A O   1 
HETATM 2526 O  O   . HOH E 4 .   ? 2.61583   18.00493 -7.17868  1.000 28.07512 ? 809 HOH A O   1 
HETATM 2527 O  O   . HOH E 4 .   ? -41.54822 23.49031 3.25425   1.000 30.24129 ? 810 HOH A O   1 
HETATM 2528 O  O   . HOH E 4 .   ? -37.31813 6.69683  15.22833  1.000 33.69884 ? 811 HOH A O   1 
HETATM 2529 O  O   . HOH E 4 .   ? -14.82243 10.44580 14.10145  1.000 31.79761 ? 812 HOH A O   1 
HETATM 2530 O  O   . HOH E 4 .   ? -38.17723 10.78169 8.04461   1.000 20.73869 ? 813 HOH A O   1 
HETATM 2531 O  O   . HOH E 4 .   ? -40.86276 17.38405 7.02419   1.000 32.45285 ? 814 HOH A O   1 
HETATM 2532 O  O   . HOH E 4 .   ? -38.62854 21.80453 -4.31914  1.000 14.86473 ? 815 HOH A O   1 
HETATM 2533 O  O   . HOH E 4 .   ? -37.73224 -1.85874 1.94929   1.000 29.13589 ? 816 HOH A O   1 
HETATM 2534 O  O   . HOH E 4 .   ? -10.74293 10.47717 12.90157  1.000 29.66649 ? 817 HOH A O   1 
HETATM 2535 O  O   . HOH E 4 .   ? -28.76879 30.50138 -10.15263 1.000 33.82055 ? 818 HOH A O   1 
HETATM 2536 O  O   . HOH E 4 .   ? -1.78899  20.31352 0.82617   1.000 25.00557 ? 819 HOH A O   1 
HETATM 2537 O  O   . HOH E 4 .   ? -33.53461 -2.60696 11.41917  1.000 35.33529 ? 820 HOH A O   1 
HETATM 2538 O  O   . HOH E 4 .   ? 1.10262   27.05658 3.91319   1.000 34.70701 ? 821 HOH A O   1 
HETATM 2539 O  O   . HOH E 4 .   ? -23.50447 40.45727 2.11165   1.000 36.51773 ? 822 HOH A O   1 
HETATM 2540 O  O   . HOH E 4 .   ? -38.41171 11.54485 1.72022   1.000 26.89737 ? 823 HOH A O   1 
HETATM 2541 O  O   . HOH E 4 .   ? 1.08176   20.94766 -4.52552  1.000 35.02448 ? 824 HOH A O   1 
HETATM 2542 O  O   . HOH E 4 .   ? -20.97423 27.55706 -20.04926 1.000 22.24955 ? 825 HOH A O   1 
HETATM 2543 O  O   . HOH E 4 .   ? -3.82718  13.75292 -10.90946 1.000 17.43449 ? 826 HOH A O   1 
HETATM 2544 O  O   . HOH E 4 .   ? -11.57905 -4.32891 -0.46952  1.000 29.67595 ? 827 HOH A O   1 
HETATM 2545 O  O   . HOH E 4 .   ? -1.05714  28.46917 3.11296   1.000 32.08087 ? 828 HOH A O   1 
HETATM 2546 O  O   . HOH E 4 .   ? -7.77096  19.84615 -12.00496 1.000 25.97996 ? 829 HOH A O   1 
HETATM 2547 O  O   . HOH E 4 .   ? -34.83850 34.01401 9.40466   1.000 25.81379 ? 830 HOH A O   1 
HETATM 2548 O  O   . HOH E 4 .   ? -33.44388 -6.78006 7.70062   1.000 35.98438 ? 831 HOH A O   1 
HETATM 2549 O  O   . HOH E 4 .   ? -17.20142 39.60411 1.92959   1.000 30.13508 ? 832 HOH A O   1 
HETATM 2550 O  O   . HOH E 4 .   ? -35.32245 9.94763  -5.78974  1.000 41.71105 ? 833 HOH A O   1 
HETATM 2551 O  O   . HOH E 4 .   ? -23.55653 -0.00229 -13.03959 1.000 46.57405 ? 834 HOH A O   1 
HETATM 2552 O  O   . HOH E 4 .   ? -1.20077  12.98498 1.83914   1.000 29.62418 ? 835 HOH A O   1 
HETATM 2553 O  O   . HOH E 4 .   ? -17.95013 -5.74748 -0.56672  1.000 25.00995 ? 836 HOH A O   1 
HETATM 2554 O  O   . HOH E 4 .   ? 0.30060   14.62918 -1.84568  1.000 25.40278 ? 837 HOH A O   1 
HETATM 2555 O  O   . HOH E 4 .   ? -35.53543 24.25246 -9.81725  1.000 29.27257 ? 838 HOH A O   1 
HETATM 2556 O  O   . HOH E 4 .   ? -33.40434 20.13764 19.60611  1.000 42.08699 ? 839 HOH A O   1 
HETATM 2557 O  O   . HOH E 4 .   ? 0.71963   17.53891 -1.11109  1.000 34.64345 ? 840 HOH A O   1 
HETATM 2558 O  O   . HOH E 4 .   ? -16.24085 31.90366 -12.95737 1.000 39.18556 ? 841 HOH A O   1 
HETATM 2559 O  O   . HOH E 4 .   ? -9.40169  28.50874 -12.19265 1.000 33.82008 ? 842 HOH A O   1 
HETATM 2560 O  O   . HOH E 4 .   ? -16.99619 20.11989 13.90824  1.000 23.47259 ? 843 HOH A O   1 
HETATM 2561 O  O   . HOH E 4 .   ? -6.39310  9.05885  1.69567   1.000 27.61299 ? 844 HOH A O   1 
HETATM 2562 O  O   . HOH E 4 .   ? -33.73162 3.92455  -13.31832 1.000 28.60644 ? 845 HOH A O   1 
HETATM 2563 O  O   . HOH E 4 .   ? -32.15376 18.09909 20.54613  1.000 39.69481 ? 846 HOH A O   1 
HETATM 2564 O  O   . HOH E 4 .   ? -28.22828 30.91000 -14.80481 1.000 43.05396 ? 847 HOH A O   1 
HETATM 2565 O  O   . HOH E 4 .   ? -13.80360 -5.05039 0.56660   1.000 39.32692 ? 848 HOH A O   1 
HETATM 2566 O  O   . HOH E 4 .   ? -41.86492 17.49909 0.32452   1.000 34.16004 ? 849 HOH A O   1 
HETATM 2567 O  O   . HOH E 4 .   ? -27.53354 -6.54341 4.07718   1.000 36.72403 ? 850 HOH A O   1 
HETATM 2568 O  O   . HOH E 4 .   ? 2.66565   21.00274 5.10630   1.000 38.45711 ? 851 HOH A O   1 
HETATM 2569 O  O   . HOH E 4 .   ? -1.65758  12.82002 -3.88553  1.000 37.29774 ? 852 HOH A O   1 
HETATM 2570 O  O   . HOH E 4 .   ? -33.21691 -2.02701 -1.01076  1.000 42.97731 ? 853 HOH A O   1 
HETATM 2571 O  O   . HOH E 4 .   ? -40.06125 1.32260  3.57038   1.000 36.59996 ? 854 HOH A O   1 
HETATM 2572 O  O   . HOH E 4 .   ? -41.95660 22.05103 0.88105   1.000 27.92044 ? 855 HOH A O   1 
HETATM 2573 O  O   . HOH E 4 .   ? -15.18577 40.04291 -1.79436  1.000 35.46758 ? 856 HOH A O   1 
HETATM 2574 O  O   . HOH E 4 .   ? -24.17283 -7.84657 4.29319   1.000 42.25549 ? 857 HOH A O   1 
HETATM 2575 O  O   . HOH E 4 .   ? -25.04852 40.32889 -0.10005  1.000 32.04868 ? 858 HOH A O   1 
HETATM 2576 O  O   . HOH E 4 .   ? -29.80936 23.70882 18.04529  1.000 41.99102 ? 859 HOH A O   1 
HETATM 2577 O  O   . HOH E 4 .   ? -2.26939  11.88214 5.12496   1.000 30.51557 ? 860 HOH A O   1 
HETATM 2578 O  O   . HOH E 4 .   ? -39.31570 11.46031 4.12282   1.000 26.42815 ? 861 HOH A O   1 
HETATM 2579 O  O   . HOH E 4 .   ? -8.34170  -2.19395 -8.87436  1.000 34.39394 ? 862 HOH A O   1 
HETATM 2580 O  O   . HOH E 4 .   ? -18.81176 41.52736 1.29077   1.000 37.39124 ? 863 HOH A O   1 
HETATM 2581 O  O   . HOH E 4 .   ? -17.34201 -6.49727 -5.80960  1.000 41.77369 ? 864 HOH A O   1 
HETATM 2582 O  O   . HOH E 4 .   ? 0.84964   27.04121 1.67280   1.000 33.65823 ? 865 HOH A O   1 
HETATM 2583 O  O   . HOH E 4 .   ? -34.28717 5.49320  -4.15038  1.000 23.54252 ? 866 HOH A O   1 
HETATM 2584 O  O   . HOH E 4 .   ? -29.91122 32.12516 -13.03954 1.000 49.08749 ? 867 HOH A O   1 
HETATM 2585 O  O   . HOH E 4 .   ? -12.55676 17.77083 13.55192  1.000 23.36778 ? 868 HOH A O   1 
HETATM 2586 O  O   . HOH E 4 .   ? -42.53017 22.51965 -3.09666  1.000 30.87160 ? 869 HOH A O   1 
HETATM 2587 O  O   . HOH E 4 .   ? -32.17564 25.30670 18.91899  1.000 30.19856 ? 870 HOH A O   1 
HETATM 2588 O  O   . HOH E 4 .   ? -43.26532 15.34693 2.33002   1.000 42.57179 ? 871 HOH A O   1 
HETATM 2589 O  O   . HOH E 4 .   ? -42.25746 13.10757 1.45485   1.000 36.31243 ? 872 HOH A O   1 
HETATM 2590 O  O   . HOH E 4 .   ? -42.26717 12.35440 3.67787   1.000 31.30246 ? 873 HOH A O   1 
HETATM 2591 O  O   . HOH E 4 .   ? -40.33151 25.94708 17.89254  1.000 37.32626 ? 874 HOH A O   1 
HETATM 2592 O  O   . HOH E 4 .   ? -32.80167 38.48983 11.35149  1.000 37.74334 ? 875 HOH A O   1 
# 
loop_
_atom_site_anisotrop.id 
_atom_site_anisotrop.type_symbol 
_atom_site_anisotrop.pdbx_label_atom_id 
_atom_site_anisotrop.pdbx_label_alt_id 
_atom_site_anisotrop.pdbx_label_comp_id 
_atom_site_anisotrop.pdbx_label_asym_id 
_atom_site_anisotrop.pdbx_label_seq_id 
_atom_site_anisotrop.pdbx_PDB_ins_code 
_atom_site_anisotrop.U[1][1] 
_atom_site_anisotrop.U[2][2] 
_atom_site_anisotrop.U[3][3] 
_atom_site_anisotrop.U[1][2] 
_atom_site_anisotrop.U[1][3] 
_atom_site_anisotrop.U[2][3] 
_atom_site_anisotrop.pdbx_auth_seq_id 
_atom_site_anisotrop.pdbx_auth_comp_id 
_atom_site_anisotrop.pdbx_auth_asym_id 
_atom_site_anisotrop.pdbx_auth_atom_id 
1    N  N   . ALA A 1   ? 0.10405 0.26642 0.19885 -0.02378 0.01498  -0.08239 106 ALA A N   
2    C  CA  . ALA A 1   ? 0.12031 0.27264 0.20430 -0.02004 0.01663  -0.08397 106 ALA A CA  
3    C  C   . ALA A 1   ? 0.11674 0.27736 0.20153 -0.01374 0.00881  -0.08152 106 ALA A C   
4    O  O   . ALA A 1   ? 0.11495 0.26800 0.20506 -0.00959 0.00465  -0.08239 106 ALA A O   
5    C  CB  . ALA A 1   ? 0.12284 0.26901 0.20288 -0.03564 0.01957  -0.09571 106 ALA A CB  
6    N  N   . ALA A 2   ? 0.12984 0.29413 0.20485 -0.01298 0.00221  -0.07448 107 ALA A N   
7    C  CA  . ALA A 2   ? 0.13281 0.30118 0.19876 -0.01654 -0.00313 -0.07076 107 ALA A CA  
8    C  C   . ALA A 2   ? 0.12531 0.29547 0.20034 -0.01399 -0.00472 -0.06558 107 ALA A C   
9    O  O   . ALA A 2   ? 0.13680 0.32184 0.19948 -0.01860 -0.02198 -0.06014 107 ALA A O   
10   C  CB  . ALA A 2   ? 0.14227 0.30763 0.20931 -0.01968 -0.01005 -0.06750 107 ALA A CB  
11   N  N   . GLN A 3   ? 0.10960 0.25293 0.18272 0.00570  0.01316  -0.06519 108 GLN A N   
12   C  CA  . GLN A 3   ? 0.10728 0.21676 0.17344 0.01728  0.02271  -0.05868 108 GLN A CA  
13   C  C   . GLN A 3   ? 0.11939 0.22324 0.18456 0.02404  0.02666  -0.04524 108 GLN A C   
14   O  O   . GLN A 3   ? 0.13468 0.22163 0.18573 0.01380  0.01638  -0.04896 108 GLN A O   
15   C  CB  . GLN A 3   ? 0.10472 0.19442 0.16211 0.00928  0.02163  -0.05253 108 GLN A CB  
16   C  CG  . GLN A 3   ? 0.10313 0.18282 0.15698 0.00858  0.01301  -0.04628 108 GLN A CG  
17   C  CD  . GLN A 3   ? 0.10297 0.15213 0.14979 0.00931  0.01116  -0.04083 108 GLN A CD  
18   O  OE1 . GLN A 3   ? 0.10316 0.15269 0.14564 0.00310  0.01256  -0.04628 108 GLN A OE1 
19   N  NE2 . GLN A 3   ? 0.11146 0.13644 0.15033 -0.01302 0.01539  -0.03328 108 GLN A NE2 
20   N  N   A THR A 4   ? 0.12984 0.23073 0.18995 0.02777  0.03344  -0.04205 109 THR A N   
21   N  N   B THR A 4   ? 0.12418 0.21877 0.18255 0.02276  0.02806  -0.03731 109 THR A N   
22   C  CA  A THR A 4   ? 0.14044 0.23359 0.18605 0.04052  0.03583  -0.03876 109 THR A CA  
23   C  CA  B THR A 4   ? 0.13032 0.21611 0.18723 0.02415  0.02757  -0.02994 109 THR A CA  
24   C  C   A THR A 4   ? 0.11615 0.22075 0.19558 0.04221  0.03125  -0.03350 109 THR A C   
25   C  C   B THR A 4   ? 0.11404 0.21487 0.18883 0.02924  0.02785  -0.02722 109 THR A C   
26   O  O   A THR A 4   ? 0.10134 0.21835 0.18957 0.03525  0.02672  -0.03421 109 THR A O   
27   O  O   B THR A 4   ? 0.10939 0.20941 0.19048 0.02733  0.02794  -0.02731 109 THR A O   
28   C  CB  A THR A 4   ? 0.16931 0.24484 0.19466 0.04560  0.04733  -0.04836 109 THR A CB  
29   C  CB  B THR A 4   ? 0.15236 0.21638 0.17886 0.02000  0.02704  -0.02919 109 THR A CB  
30   O  OG1 A THR A 4   ? 0.16821 0.25053 0.18685 0.05041  0.05737  -0.05054 109 THR A OG1 
31   O  OG1 B THR A 4   ? 0.15934 0.21736 0.17925 0.02111  0.02656  -0.03101 109 THR A OG1 
32   C  CG2 A THR A 4   ? 0.18091 0.24816 0.18839 0.05488  0.05129  -0.05866 109 THR A CG2 
33   C  CG2 B THR A 4   ? 0.15909 0.21690 0.17882 0.01844  0.02757  -0.02852 109 THR A CG2 
34   N  N   . ASN A 5   ? 0.10624 0.22509 0.19399 0.03384  0.02615  -0.02388 110 ASN A N   
35   C  CA  . ASN A 5   ? 0.09953 0.24003 0.19565 0.03444  0.01492  -0.02164 110 ASN A CA  
36   C  C   . ASN A 5   ? 0.08234 0.21486 0.19142 0.04395  -0.00578 -0.01412 110 ASN A C   
37   O  O   . ASN A 5   ? 0.07625 0.21013 0.18773 0.04302  -0.00225 -0.01269 110 ASN A O   
38   C  CB  . ASN A 5   ? 0.11733 0.26543 0.20718 0.03742  0.01310  -0.02514 110 ASN A CB  
39   C  CG  . ASN A 5   ? 0.15040 0.30214 0.21617 0.02471  0.01486  -0.01809 110 ASN A CG  
40   O  OD1 . ASN A 5   ? 0.15495 0.30446 0.21718 0.03267  0.01034  -0.02014 110 ASN A OD1 
41   N  ND2 . ASN A 5   ? 0.16462 0.31983 0.22369 0.01666  0.02399  -0.01576 110 ASN A ND2 
42   N  N   . ALA A 6   ? 0.07993 0.19900 0.18048 0.03416  -0.01232 -0.00876 111 ALA A N   
43   C  CA  . ALA A 6   ? 0.08456 0.17551 0.17184 0.01111  -0.00002 -0.00447 111 ALA A CA  
44   C  C   . ALA A 6   ? 0.08509 0.15961 0.16253 0.01686  -0.00607 0.00135  111 ALA A C   
45   O  O   . ALA A 6   ? 0.07471 0.16602 0.16829 0.00809  -0.00565 0.00500  111 ALA A O   
46   C  CB  . ALA A 6   ? 0.08477 0.18121 0.16947 -0.02555 -0.00106 0.00658  111 ALA A CB  
47   N  N   . PRO A 7   ? 0.09614 0.13294 0.14596 0.00313  -0.00106 -0.00400 112 PRO A N   
48   C  CA  . PRO A 7   ? 0.08347 0.11766 0.12944 0.00060  0.00929  0.00110  112 PRO A CA  
49   C  C   . PRO A 7   ? 0.07911 0.11425 0.11046 0.01119  0.00504  -0.00281 112 PRO A C   
50   O  O   . PRO A 7   ? 0.06761 0.12420 0.10981 0.01660  0.01030  0.00018  112 PRO A O   
51   C  CB  . PRO A 7   ? 0.09332 0.10618 0.13411 -0.02458 0.01140  0.00394  112 PRO A CB  
52   C  CG  . PRO A 7   ? 0.11571 0.11656 0.13900 -0.01424 0.00779  0.00342  112 PRO A CG  
53   C  CD  . PRO A 7   ? 0.10443 0.12097 0.14180 0.00497  0.00394  -0.00363 112 PRO A CD  
54   N  N   . TRP A 8   ? 0.08072 0.10911 0.10371 0.01545  0.01332  -0.01199 113 TRP A N   
55   C  CA  . TRP A 8   ? 0.07706 0.10855 0.10005 0.01587  -0.00187 -0.01800 113 TRP A CA  
56   C  C   . TRP A 8   ? 0.06820 0.11426 0.09074 0.02490  -0.00687 -0.01670 113 TRP A C   
57   O  O   . TRP A 8   ? 0.06322 0.10771 0.09601 0.01097  0.00222  -0.02212 113 TRP A O   
58   C  CB  . TRP A 8   ? 0.10247 0.10715 0.09978 0.00662  -0.00890 -0.02060 113 TRP A CB  
59   C  CG  . TRP A 8   ? 0.10272 0.08906 0.10390 0.00661  -0.01747 -0.01811 113 TRP A CG  
60   C  CD1 . TRP A 8   ? 0.09201 0.07050 0.10061 0.00542  -0.00871 -0.00690 113 TRP A CD1 
61   C  CD2 . TRP A 8   ? 0.10357 0.09523 0.10489 0.00209  -0.02215 -0.01748 113 TRP A CD2 
62   N  NE1 . TRP A 8   ? 0.08533 0.07495 0.10048 -0.00334 -0.00826 -0.00423 113 TRP A NE1 
63   C  CE2 . TRP A 8   ? 0.09754 0.08493 0.10603 0.00685  -0.01767 -0.00492 113 TRP A CE2 
64   C  CE3 . TRP A 8   ? 0.11475 0.08840 0.11219 -0.02068 -0.01534 -0.01327 113 TRP A CE3 
65   C  CZ2 . TRP A 8   ? 0.10880 0.05922 0.10686 0.00389  -0.01125 -0.00690 113 TRP A CZ2 
66   C  CZ3 . TRP A 8   ? 0.10476 0.06164 0.10494 0.00289  -0.00560 -0.00410 113 TRP A CZ3 
67   C  CH2 . TRP A 8   ? 0.11932 0.06655 0.10713 0.00481  -0.01406 -0.00237 113 TRP A CH2 
68   N  N   . GLY A 9   ? 0.07636 0.11809 0.08319 0.02254  0.00570  -0.02017 114 GLY A N   
69   C  CA  . GLY A 9   ? 0.08306 0.11957 0.08178 0.03394  0.00729  -0.03971 114 GLY A CA  
70   C  C   . GLY A 9   ? 0.08508 0.12855 0.09034 0.01913  -0.01056 -0.04510 114 GLY A C   
71   O  O   . GLY A 9   ? 0.06963 0.14705 0.09271 0.00891  -0.01363 -0.04647 114 GLY A O   
72   N  N   . LEU A 10  ? 0.07776 0.12489 0.10073 -0.00045 -0.00437 -0.03746 115 LEU A N   
73   C  CA  . LEU A 10  ? 0.08078 0.12099 0.11769 -0.00908 -0.00639 -0.03802 115 LEU A CA  
74   C  C   . LEU A 10  ? 0.07818 0.12831 0.13122 0.00631  0.00397  -0.03881 115 LEU A C   
75   O  O   . LEU A 10  ? 0.09750 0.14607 0.13242 0.01404  0.00516  -0.04363 115 LEU A O   
76   C  CB  . LEU A 10  ? 0.07148 0.11412 0.12336 -0.01619 0.00098  -0.04131 115 LEU A CB  
77   C  CG  . LEU A 10  ? 0.07621 0.10262 0.12732 -0.01014 0.00512  -0.04113 115 LEU A CG  
78   C  CD1 . LEU A 10  ? 0.10408 0.09440 0.13391 -0.04485 0.00803  -0.04400 115 LEU A CD1 
79   C  CD2 . LEU A 10  ? 0.08207 0.10731 0.12490 0.02429  -0.00017 -0.02755 115 LEU A CD2 
80   N  N   . ALA A 11  ? 0.05817 0.13069 0.14552 0.01064  0.00842  -0.03736 116 ALA A N   
81   C  CA  . ALA A 11  ? 0.05629 0.14448 0.15714 0.02318  0.00172  -0.04323 116 ALA A CA  
82   C  C   . ALA A 11  ? 0.05615 0.16052 0.17229 0.01172  0.00792  -0.04595 116 ALA A C   
83   O  O   . ALA A 11  ? 0.05583 0.16586 0.17662 -0.00491 0.00742  -0.04935 116 ALA A O   
84   C  CB  . ALA A 11  ? 0.06392 0.15254 0.16305 0.02851  -0.00473 -0.03281 116 ALA A CB  
85   N  N   . ARG A 12  ? 0.06102 0.14313 0.17754 0.02333  0.00201  -0.04747 117 ARG A N   
86   C  CA  . ARG A 12  ? 0.06785 0.13066 0.18171 0.03013  -0.01243 -0.04859 117 ARG A CA  
87   C  C   . ARG A 12  ? 0.07599 0.13412 0.18084 0.01537  -0.01387 -0.05778 117 ARG A C   
88   O  O   . ARG A 12  ? 0.07646 0.11839 0.17833 0.00906  -0.01114 -0.08350 117 ARG A O   
89   C  CB  . ARG A 12  ? 0.08412 0.11864 0.18454 0.01942  -0.00755 -0.04118 117 ARG A CB  
90   C  CG  . ARG A 12  ? 0.08381 0.11693 0.18058 0.01409  0.00024  -0.03689 117 ARG A CG  
91   C  CD  . ARG A 12  ? 0.09333 0.11555 0.17963 0.00991  0.00711  -0.04184 117 ARG A CD  
92   N  NE  . ARG A 12  ? 0.10932 0.10725 0.17525 0.01655  0.01220  -0.03678 117 ARG A NE  
93   C  CZ  . ARG A 12  ? 0.11417 0.11037 0.18140 0.03407  0.02002  -0.02550 117 ARG A CZ  
94   N  NH1 . ARG A 12  ? 0.11053 0.13202 0.17456 0.03777  0.02731  -0.02501 117 ARG A NH1 
95   N  NH2 . ARG A 12  ? 0.13268 0.10284 0.18261 0.05633  0.02606  -0.02829 117 ARG A NH2 
96   N  N   A ILE A 13  ? 0.08097 0.12954 0.17360 -0.00149 -0.01292 -0.05682 118 ILE A N   
97   N  N   B ILE A 13  ? 0.09197 0.14107 0.17870 0.01353  -0.00786 -0.05468 118 ILE A N   
98   C  CA  A ILE A 13  ? 0.09506 0.12052 0.16599 -0.01456 -0.02071 -0.05442 118 ILE A CA  
99   C  CA  B ILE A 13  ? 0.10707 0.14464 0.17638 0.01346  -0.00782 -0.05273 118 ILE A CA  
100  C  C   A ILE A 13  ? 0.08574 0.11939 0.17259 -0.00472 -0.01961 -0.06255 118 ILE A C   
101  C  C   B ILE A 13  ? 0.09754 0.13646 0.17802 0.01745  -0.01127 -0.06244 118 ILE A C   
102  O  O   A ILE A 13  ? 0.07570 0.10808 0.16682 -0.00262 -0.03078 -0.06054 118 ILE A O   
103  O  O   B ILE A 13  ? 0.09470 0.13132 0.17517 0.02772  -0.01580 -0.06352 118 ILE A O   
104  C  CB  A ILE A 13  ? 0.11176 0.11349 0.15310 -0.02329 -0.01380 -0.05105 118 ILE A CB  
105  C  CB  B ILE A 13  ? 0.12694 0.15191 0.17375 0.01820  0.00272  -0.04818 118 ILE A CB  
106  C  CG1 A ILE A 13  ? 0.12756 0.10495 0.15015 -0.03555 -0.00674 -0.04544 118 ILE A CG1 
107  C  CG1 B ILE A 13  ? 0.13704 0.15456 0.17026 0.01406  0.00992  -0.04492 118 ILE A CG1 
108  C  CG2 A ILE A 13  ? 0.09894 0.12071 0.14630 -0.01823 -0.01332 -0.05494 118 ILE A CG2 
109  C  CG2 B ILE A 13  ? 0.13679 0.15577 0.17414 0.01755  0.00688  -0.04577 118 ILE A CG2 
110  C  CD1 A ILE A 13  ? 0.13631 0.11854 0.15025 -0.02205 -0.00061 -0.04003 118 ILE A CD1 
111  C  CD1 B ILE A 13  ? 0.14252 0.16012 0.16934 0.00879  0.01606  -0.04181 118 ILE A CD1 
112  N  N   . SER A 14  ? 0.09819 0.13868 0.17504 0.01704  -0.01713 -0.06929 119 SER A N   
113  C  CA  . SER A 14  ? 0.10220 0.15374 0.18994 0.02152  -0.02820 -0.05578 119 SER A CA  
114  C  C   . SER A 14  ? 0.11730 0.15014 0.18912 0.02866  -0.02351 -0.06195 119 SER A C   
115  O  O   . SER A 14  ? 0.13793 0.17212 0.19108 0.02458  -0.00872 -0.04969 119 SER A O   
116  C  CB  . SER A 14  ? 0.06993 0.16442 0.19246 0.02557  -0.03853 -0.02877 119 SER A CB  
117  O  OG  . SER A 14  ? 0.06584 0.17391 0.18649 0.01940  -0.04142 -0.00134 119 SER A OG  
118  N  N   . SER A 15  ? 0.11470 0.13818 0.18973 0.03490  -0.02162 -0.06370 120 SER A N   
119  C  CA  . SER A 15  ? 0.12068 0.13623 0.19033 0.02613  -0.03029 -0.06939 120 SER A CA  
120  C  C   . SER A 15  ? 0.13480 0.13412 0.19130 0.02162  -0.02668 -0.08913 120 SER A C   
121  O  O   . SER A 15  ? 0.13245 0.13267 0.18735 0.01499  -0.02227 -0.09084 120 SER A O   
122  C  CB  . SER A 15  ? 0.12302 0.15074 0.19245 0.01750  -0.03809 -0.06107 120 SER A CB  
123  O  OG  . SER A 15  ? 0.12308 0.16270 0.19933 0.00863  -0.03666 -0.05423 120 SER A OG  
124  N  N   . THR A 16  ? 0.14096 0.13616 0.19090 0.01287  -0.02559 -0.08921 121 THR A N   
125  C  CA  . THR A 16  ? 0.15490 0.14609 0.19364 0.00794  -0.01248 -0.08893 121 THR A CA  
126  C  C   . THR A 16  ? 0.15126 0.15076 0.19201 0.00751  -0.00899 -0.07528 121 THR A C   
127  O  O   . THR A 16  ? 0.15874 0.16543 0.19747 -0.01119 -0.01048 -0.06007 121 THR A O   
128  C  CB  . THR A 16  ? 0.16868 0.15532 0.19540 -0.00039 -0.00955 -0.09838 121 THR A CB  
129  O  OG1 . THR A 16  ? 0.17695 0.15557 0.19870 -0.00189 -0.00423 -0.10393 121 THR A OG1 
130  C  CG2 . THR A 16  ? 0.17794 0.15826 0.19164 0.00442  -0.00511 -0.10354 121 THR A CG2 
131  N  N   . SER A 17  ? 0.15707 0.14112 0.18652 0.03676  -0.00228 -0.08642 122 SER A N   
132  C  CA  . SER A 17  ? 0.17711 0.15736 0.18539 0.03326  0.00043  -0.08106 122 SER A CA  
133  C  C   . SER A 17  ? 0.15631 0.14893 0.18087 0.03580  -0.01346 -0.07106 122 SER A C   
134  O  O   . SER A 17  ? 0.14912 0.14782 0.17866 0.05449  -0.02477 -0.06916 122 SER A O   
135  C  CB  . SER A 17  ? 0.19731 0.17271 0.18523 0.03508  0.00210  -0.07655 122 SER A CB  
136  O  OG  . SER A 17  ? 0.20464 0.18399 0.18664 0.02844  -0.00823 -0.08216 122 SER A OG  
137  N  N   . PRO A 18  ? 0.15313 0.14097 0.18127 0.03251  -0.01040 -0.06893 123 PRO A N   
138  C  CA  . PRO A 18  ? 0.14405 0.13924 0.18572 0.04861  -0.00363 -0.05077 123 PRO A CA  
139  C  C   . PRO A 18  ? 0.13816 0.14138 0.18166 0.05085  0.00273  -0.03910 123 PRO A C   
140  O  O   . PRO A 18  ? 0.14945 0.14508 0.18299 0.04481  0.00197  -0.03466 123 PRO A O   
141  C  CB  . PRO A 18  ? 0.15815 0.13675 0.18487 0.02949  -0.00520 -0.06040 123 PRO A CB  
142  C  CG  . PRO A 18  ? 0.16367 0.13770 0.18529 0.02531  -0.01679 -0.06304 123 PRO A CG  
143  C  CD  . PRO A 18  ? 0.16554 0.14255 0.18124 0.02470  -0.01611 -0.06931 123 PRO A CD  
144  N  N   . GLY A 19  ? 0.14394 0.14684 0.18351 0.04364  -0.01097 -0.03976 124 GLY A N   
145  C  CA  . GLY A 19  ? 0.14876 0.16144 0.18410 0.03848  -0.01483 -0.03664 124 GLY A CA  
146  C  C   . GLY A 19  ? 0.15263 0.16428 0.19177 0.02442  -0.01307 -0.04002 124 GLY A C   
147  O  O   . GLY A 19  ? 0.15480 0.16288 0.19723 0.01298  -0.00911 -0.03244 124 GLY A O   
148  N  N   . THR A 20  ? 0.15764 0.16451 0.18663 0.01874  -0.01934 -0.04541 125 THR A N   
149  C  CA  . THR A 20  ? 0.14198 0.18059 0.18554 0.02709  -0.01697 -0.05284 125 THR A CA  
150  C  C   . THR A 20  ? 0.13853 0.19859 0.19445 0.01450  -0.01477 -0.03619 125 THR A C   
151  O  O   . THR A 20  ? 0.15383 0.19250 0.19573 -0.00073 -0.02624 -0.04210 125 THR A O   
152  C  CB  . THR A 20  ? 0.15220 0.18814 0.18128 0.03323  -0.01406 -0.05724 125 THR A CB  
153  O  OG1 . THR A 20  ? 0.14846 0.16738 0.17170 0.04426  -0.01224 -0.07081 125 THR A OG1 
154  C  CG2 . THR A 20  ? 0.16660 0.19859 0.18350 0.03170  -0.01693 -0.05982 125 THR A CG2 
155  N  N   . SER A 21  ? 0.13133 0.22365 0.19984 0.01590  -0.00519 -0.02584 126 SER A N   
156  C  CA  . SER A 21  ? 0.13358 0.23266 0.20308 0.02852  -0.00529 -0.02888 126 SER A CA  
157  C  C   . SER A 21  ? 0.13843 0.21950 0.19707 0.03241  -0.00342 -0.03699 126 SER A C   
158  O  O   . SER A 21  ? 0.13831 0.22298 0.19176 0.02857  -0.00954 -0.04421 126 SER A O   
159  C  CB  . SER A 21  ? 0.12001 0.24797 0.21250 0.02862  -0.00754 -0.03154 126 SER A CB  
160  O  OG  . SER A 21  ? 0.10906 0.25358 0.21967 0.03768  -0.01515 -0.03266 126 SER A OG  
161  N  N   . THR A 22  ? 0.13207 0.20216 0.19279 0.04690  -0.00311 -0.04083 127 THR A N   
162  C  CA  . THR A 22  ? 0.11955 0.19793 0.18699 0.05135  -0.00285 -0.04836 127 THR A CA  
163  C  C   . THR A 22  ? 0.10667 0.18718 0.17789 0.05031  -0.00527 -0.05174 127 THR A C   
164  O  O   . THR A 22  ? 0.11688 0.18216 0.18351 0.04764  -0.01494 -0.05101 127 THR A O   
165  C  CB  . THR A 22  ? 0.13334 0.20047 0.19625 0.04889  0.00145  -0.05370 127 THR A CB  
166  O  OG1 . THR A 22  ? 0.15329 0.20054 0.20218 0.05112  0.00859  -0.05938 127 THR A OG1 
167  C  CG2 . THR A 22  ? 0.13883 0.20199 0.19726 0.03205  0.00508  -0.05136 127 THR A CG2 
168  N  N   . TYR A 23  ? 0.09595 0.17065 0.15599 0.05121  0.00147  -0.06108 128 TYR A N   
169  C  CA  . TYR A 23  ? 0.08889 0.16087 0.14348 0.04633  -0.00032 -0.05645 128 TYR A CA  
170  C  C   . TYR A 23  ? 0.10182 0.18323 0.14690 0.03829  -0.00631 -0.06584 128 TYR A C   
171  O  O   . TYR A 23  ? 0.10312 0.18588 0.15312 0.03867  -0.01322 -0.06712 128 TYR A O   
172  C  CB  . TYR A 23  ? 0.07365 0.15057 0.12877 0.04095  0.00120  -0.04839 128 TYR A CB  
173  C  CG  . TYR A 23  ? 0.07761 0.15315 0.12395 0.03321  -0.00191 -0.04576 128 TYR A CG  
174  C  CD1 . TYR A 23  ? 0.07608 0.14476 0.12096 0.04183  -0.00806 -0.05558 128 TYR A CD1 
175  C  CD2 . TYR A 23  ? 0.09026 0.15865 0.11901 0.03709  -0.00007 -0.05223 128 TYR A CD2 
176  C  CE1 . TYR A 23  ? 0.08402 0.14817 0.11891 0.03203  -0.01303 -0.06199 128 TYR A CE1 
177  C  CE2 . TYR A 23  ? 0.08414 0.16876 0.11983 0.02732  0.00362  -0.05062 128 TYR A CE2 
178  C  CZ  . TYR A 23  ? 0.08327 0.15792 0.12028 0.01207  -0.00129 -0.05915 128 TYR A CZ  
179  O  OH  . TYR A 23  ? 0.09648 0.15929 0.11908 -0.00740 0.00075  -0.05918 128 TYR A OH  
180  N  N   A TYR A 24  ? 0.10876 0.19773 0.14818 0.03768  -0.00754 -0.06860 129 TYR A N   
181  N  N   B TYR A 24  ? 0.10523 0.19332 0.14662 0.03522  -0.00487 -0.06944 129 TYR A N   
182  C  CA  A TYR A 24  ? 0.10986 0.20968 0.14697 0.03188  -0.01058 -0.06368 129 TYR A CA  
183  C  CA  B TYR A 24  ? 0.10346 0.20263 0.14419 0.02941  -0.00512 -0.06836 129 TYR A CA  
184  C  C   A TYR A 24  ? 0.10236 0.21433 0.13481 0.03066  -0.00463 -0.06483 129 TYR A C   
185  C  C   B TYR A 24  ? 0.10127 0.20810 0.13359 0.02843  -0.00335 -0.06782 129 TYR A C   
186  O  O   A TYR A 24  ? 0.10253 0.22553 0.13356 0.01632  -0.00518 -0.06509 129 TYR A O   
187  O  O   B TYR A 24  ? 0.10247 0.21524 0.13214 0.01698  -0.00569 -0.06857 129 TYR A O   
188  C  CB  A TYR A 24  ? 0.11694 0.20404 0.15311 0.03378  -0.01600 -0.05990 129 TYR A CB  
189  C  CB  B TYR A 24  ? 0.10396 0.19848 0.14965 0.02936  -0.00430 -0.06926 129 TYR A CB  
190  C  CG  A TYR A 24  ? 0.13007 0.20035 0.15871 0.04321  -0.01885 -0.04505 129 TYR A CG  
191  C  CG  B TYR A 24  ? 0.11064 0.19402 0.15442 0.03868  -0.00137 -0.06435 129 TYR A CG  
192  C  CD1 A TYR A 24  ? 0.13990 0.20083 0.16157 0.04515  -0.01469 -0.03735 129 TYR A CD1 
193  C  CD1 B TYR A 24  ? 0.11220 0.19448 0.15421 0.04036  0.00328  -0.06277 129 TYR A CD1 
194  C  CD2 A TYR A 24  ? 0.13682 0.19043 0.15954 0.04832  -0.02119 -0.03922 129 TYR A CD2 
195  C  CD2 B TYR A 24  ? 0.11366 0.19124 0.15708 0.04479  0.00055  -0.05938 129 TYR A CD2 
196  C  CE1 A TYR A 24  ? 0.14730 0.19466 0.16381 0.04998  -0.02080 -0.03069 129 TYR A CE1 
197  C  CE1 B TYR A 24  ? 0.10496 0.19001 0.15510 0.04215  0.00617  -0.06382 129 TYR A CE1 
198  C  CE2 A TYR A 24  ? 0.14259 0.18848 0.16250 0.04713  -0.02546 -0.03402 129 TYR A CE2 
199  C  CE2 B TYR A 24  ? 0.10630 0.19590 0.15737 0.04368  0.00181  -0.05914 129 TYR A CE2 
200  C  CZ  A TYR A 24  ? 0.14071 0.18261 0.16474 0.05943  -0.02935 -0.02857 129 TYR A CZ  
201  C  CZ  B TYR A 24  ? 0.10061 0.19337 0.15582 0.04658  0.00457  -0.06036 129 TYR A CZ  
202  O  OH  A TYR A 24  ? 0.13864 0.17477 0.16698 0.06762  -0.03468 -0.03285 129 TYR A OH  
203  O  OH  B TYR A 24  ? 0.10127 0.19118 0.15534 0.04889  0.00560  -0.06251 129 TYR A OH  
204  N  N   . TYR A 25  ? 0.10209 0.20813 0.12905 0.02532  -0.00066 -0.06868 130 TYR A N   
205  C  CA  . TYR A 25  ? 0.08819 0.21575 0.12044 0.01981  0.00229  -0.05938 130 TYR A CA  
206  C  C   . TYR A 25  ? 0.09788 0.22227 0.13119 0.00919  0.00479  -0.04553 130 TYR A C   
207  O  O   . TYR A 25  ? 0.09848 0.24161 0.13561 0.01438  0.00789  -0.04344 130 TYR A O   
208  C  CB  . TYR A 25  ? 0.09058 0.22022 0.11350 0.01488  0.00393  -0.06055 130 TYR A CB  
209  C  CG  . TYR A 25  ? 0.09834 0.21442 0.10253 0.02743  0.00260  -0.04741 130 TYR A CG  
210  C  CD1 . TYR A 25  ? 0.10751 0.21237 0.10688 0.03372  -0.00098 -0.03713 130 TYR A CD1 
211  C  CD2 . TYR A 25  ? 0.09526 0.19404 0.10154 0.02991  0.01346  -0.04276 130 TYR A CD2 
212  C  CE1 . TYR A 25  ? 0.11539 0.20189 0.10097 0.03516  0.00721  -0.04206 130 TYR A CE1 
213  C  CE2 . TYR A 25  ? 0.09702 0.18608 0.10446 0.04167  0.02101  -0.04212 130 TYR A CE2 
214  C  CZ  . TYR A 25  ? 0.11368 0.19918 0.10434 0.04129  0.01254  -0.04753 130 TYR A CZ  
215  O  OH  . TYR A 25  ? 0.11749 0.19551 0.10533 0.03666  0.01194  -0.05520 130 TYR A OH  
216  N  N   . ASP A 26  ? 0.11135 0.21880 0.13297 0.00117  0.00237  -0.03195 131 ASP A N   
217  C  CA  . ASP A 26  ? 0.11045 0.22526 0.13460 0.00788  0.00472  -0.01938 131 ASP A CA  
218  C  C   . ASP A 26  ? 0.12390 0.21858 0.15082 0.00445  0.00106  -0.01873 131 ASP A C   
219  O  O   . ASP A 26  ? 0.11826 0.20594 0.14089 -0.00346 -0.00159 -0.03094 131 ASP A O   
220  C  CB  . ASP A 26  ? 0.10863 0.23932 0.13032 0.01331  0.01081  -0.01084 131 ASP A CB  
221  C  CG  . ASP A 26  ? 0.14168 0.25426 0.12319 0.02767  0.01860  -0.01462 131 ASP A CG  
222  O  OD1 . ASP A 26  ? 0.17352 0.26545 0.12576 0.03192  0.01898  -0.01302 131 ASP A OD1 
223  O  OD2 . ASP A 26  ? 0.13910 0.25817 0.12257 0.01958  0.03131  -0.00771 131 ASP A OD2 
224  N  N   A GLU A 27  ? 0.13059 0.21738 0.15575 0.01261  0.00639  -0.01577 132 GLU A N   
225  N  N   B GLU A 27  ? 0.13164 0.22709 0.15711 0.00761  0.00357  -0.01367 132 GLU A N   
226  C  CA  A GLU A 27  ? 0.13547 0.21790 0.16613 0.01644  0.01466  -0.01485 132 GLU A CA  
227  C  CA  B GLU A 27  ? 0.13940 0.23648 0.16714 0.00584  0.01460  -0.01116 132 GLU A CA  
228  C  C   A GLU A 27  ? 0.12360 0.21463 0.15586 0.00867  0.01194  -0.00689 132 GLU A C   
229  C  C   B GLU A 27  ? 0.12450 0.22393 0.15568 0.00390  0.01265  -0.00453 132 GLU A C   
230  O  O   A GLU A 27  ? 0.12500 0.21304 0.16061 0.01581  0.01008  -0.00639 132 GLU A O   
231  O  O   B GLU A 27  ? 0.12450 0.22276 0.16017 0.01527  0.01274  -0.00236 132 GLU A O   
232  C  CB  A GLU A 27  ? 0.15501 0.22042 0.17382 0.02915  0.02507  -0.02079 132 GLU A CB  
233  C  CB  B GLU A 27  ? 0.16606 0.25515 0.17615 0.00738  0.02941  -0.01219 132 GLU A CB  
234  C  CG  A GLU A 27  ? 0.17961 0.22546 0.18407 0.04099  0.03018  -0.02464 132 GLU A CG  
235  C  CG  B GLU A 27  ? 0.19978 0.27526 0.18510 0.00523  0.03754  -0.01032 132 GLU A CG  
236  C  CD  A GLU A 27  ? 0.19978 0.23279 0.18624 0.04785  0.03693  -0.02456 132 GLU A CD  
237  C  CD  B GLU A 27  ? 0.22733 0.29429 0.19296 -0.00064 0.03764  -0.00968 132 GLU A CD  
238  O  OE1 A GLU A 27  ? 0.20208 0.23517 0.18678 0.04836  0.03777  -0.02510 132 GLU A OE1 
239  O  OE1 B GLU A 27  ? 0.23930 0.30412 0.19706 -0.00116 0.03711  -0.00869 132 GLU A OE1 
240  O  OE2 A GLU A 27  ? 0.20903 0.23342 0.18850 0.04846  0.04199  -0.02454 132 GLU A OE2 
241  O  OE2 B GLU A 27  ? 0.24204 0.29961 0.19473 -0.00010 0.03847  -0.01103 132 GLU A OE2 
242  N  N   . SER A 28  ? 0.11256 0.21562 0.15295 0.00206  0.01374  0.00131  133 SER A N   
243  C  CA  . SER A 28  ? 0.10423 0.21141 0.14011 -0.00095 -0.00718 0.01645  133 SER A CA  
244  C  C   . SER A 28  ? 0.08545 0.19756 0.12963 0.00271  -0.00486 0.02431  133 SER A C   
245  O  O   . SER A 28  ? 0.08321 0.19908 0.12461 0.01763  -0.00193 0.03360  133 SER A O   
246  C  CB  . SER A 28  ? 0.11061 0.22440 0.14426 -0.01227 -0.01849 0.01274  133 SER A CB  
247  O  OG  . SER A 28  ? 0.11193 0.22676 0.14302 -0.01552 -0.03241 0.00728  133 SER A OG  
248  N  N   . ALA A 29  ? 0.06064 0.18302 0.12028 0.01392  -0.00645 0.02280  134 ALA A N   
249  C  CA  . ALA A 29  ? 0.06011 0.17622 0.11741 0.01986  0.00176  0.01312  134 ALA A CA  
250  C  C   . ALA A 29  ? 0.05969 0.16174 0.10528 0.01492  0.00901  0.02308  134 ALA A C   
251  O  O   . ALA A 29  ? 0.06939 0.14526 0.09727 -0.00824 0.01372  0.01941  134 ALA A O   
252  C  CB  . ALA A 29  ? 0.06698 0.17892 0.12120 0.02607  -0.00405 0.00611  134 ALA A CB  
253  N  N   . GLY A 30  ? 0.06383 0.16312 0.10425 0.02153  0.03085  0.02997  135 GLY A N   
254  C  CA  . GLY A 30  ? 0.07768 0.16850 0.10776 0.01220  0.02325  0.01595  135 GLY A CA  
255  C  C   . GLY A 30  ? 0.08756 0.17712 0.10930 0.00744  0.01306  0.00883  135 GLY A C   
256  O  O   . GLY A 30  ? 0.07647 0.16304 0.11506 0.01165  0.01945  0.01295  135 GLY A O   
257  N  N   A GLN A 31  ? 0.09890 0.19171 0.11480 0.01660  -0.00103 0.00683  136 GLN A N   
258  N  N   B GLN A 31  ? 0.09101 0.17927 0.10633 0.01290  0.00595  0.00695  136 GLN A N   
259  C  CA  A GLN A 31  ? 0.11796 0.20235 0.12213 0.02127  -0.00077 0.00786  136 GLN A CA  
260  C  CA  B GLN A 31  ? 0.10016 0.18080 0.10406 0.01519  0.00585  0.00614  136 GLN A CA  
261  C  C   A GLN A 31  ? 0.11635 0.20098 0.11550 0.02211  -0.00035 0.00696  136 GLN A C   
262  C  C   B GLN A 31  ? 0.10695 0.18868 0.10405 0.01963  0.00318  0.00722  136 GLN A C   
263  O  O   A GLN A 31  ? 0.12718 0.20531 0.11942 0.01368  -0.00051 0.00350  136 GLN A O   
264  O  O   B GLN A 31  ? 0.11368 0.19086 0.10497 0.01251  0.00331  0.00615  136 GLN A O   
265  C  CB  A GLN A 31  ? 0.15406 0.21045 0.13545 0.01836  0.00297  0.01175  136 GLN A CB  
266  C  CB  B GLN A 31  ? 0.11249 0.17402 0.10153 0.00661  0.00953  0.00419  136 GLN A CB  
267  C  CG  A GLN A 31  ? 0.17668 0.22362 0.14919 0.01911  0.00839  0.01544  136 GLN A CG  
268  C  CG  B GLN A 31  ? 0.11938 0.17326 0.10107 0.00140  0.01510  0.00248  136 GLN A CG  
269  C  CD  A GLN A 31  ? 0.19659 0.24000 0.16497 0.02961  0.00650  0.01017  136 GLN A CD  
270  C  CD  B GLN A 31  ? 0.13189 0.18030 0.10532 -0.00827 0.01639  0.00253  136 GLN A CD  
271  O  OE1 A GLN A 31  ? 0.20294 0.25062 0.17169 0.03254  0.00804  0.00910  136 GLN A OE1 
272  O  OE1 B GLN A 31  ? 0.13171 0.18283 0.10720 -0.00812 0.01863  0.00525  136 GLN A OE1 
273  N  NE2 A GLN A 31  ? 0.20727 0.24039 0.16956 0.03114  0.00652  0.00763  136 GLN A NE2 
274  N  NE2 B GLN A 31  ? 0.13994 0.18435 0.10579 -0.01475 0.01672  0.00217  136 GLN A NE2 
275  N  N   . GLY A 32  ? 0.11023 0.19288 0.10387 0.02613  0.00260  0.00736  137 GLY A N   
276  C  CA  . GLY A 32  ? 0.11329 0.18388 0.09084 0.02409  0.00290  0.00751  137 GLY A CA  
277  C  C   . GLY A 32  ? 0.11815 0.18018 0.07533 -0.00284 0.00909  0.00926  137 GLY A C   
278  O  O   . GLY A 32  ? 0.13516 0.19370 0.06948 0.00259  0.02059  0.01734  137 GLY A O   
279  N  N   . SER A 33  ? 0.11641 0.17592 0.07101 -0.02233 -0.00344 -0.00765 138 SER A N   
280  C  CA  . SER A 33  ? 0.09954 0.16850 0.07187 -0.02201 0.00318  0.00062  138 SER A CA  
281  C  C   . SER A 33  ? 0.08461 0.15330 0.07611 -0.00830 0.01014  0.00456  138 SER A C   
282  O  O   . SER A 33  ? 0.08564 0.14872 0.07537 0.00578  0.02045  -0.00101 138 SER A O   
283  C  CB  . SER A 33  ? 0.09819 0.16716 0.07261 -0.00989 -0.01680 0.00365  138 SER A CB  
284  O  OG  . SER A 33  ? 0.11293 0.15940 0.06774 -0.01401 -0.02362 -0.00157 138 SER A OG  
285  N  N   A CYS A 34  ? 0.09188 0.14462 0.06793 -0.00019 0.01387  0.00244  139 CYS A N   
286  N  N   B CYS A 34  ? 0.08761 0.15001 0.07083 -0.00827 0.00524  0.00836  139 CYS A N   
287  C  CA  A CYS A 34  ? 0.09184 0.13630 0.07324 -0.00153 -0.00114 0.02136  139 CYS A CA  
288  C  CA  B CYS A 34  ? 0.08875 0.14157 0.07289 -0.00364 0.00107  0.01421  139 CYS A CA  
289  C  C   A CYS A 34  ? 0.07523 0.12661 0.07426 0.01493  -0.00064 0.02135  139 CYS A C   
290  C  C   B CYS A 34  ? 0.07820 0.12628 0.06955 0.00008  0.00154  0.01192  139 CYS A C   
291  O  O   A CYS A 34  ? 0.07457 0.13507 0.08141 0.01964  -0.00357 0.03395  139 CYS A O   
292  O  O   B CYS A 34  ? 0.07495 0.12662 0.07058 -0.00490 0.00183  0.00960  139 CYS A O   
293  C  CB  A CYS A 34  ? 0.11954 0.13853 0.07117 -0.01780 0.00665  0.03376  139 CYS A CB  
294  C  CB  B CYS A 34  ? 0.10426 0.14679 0.07576 -0.00205 0.00212  0.01919  139 CYS A CB  
295  S  SG  A CYS A 34  ? 0.12697 0.14474 0.06692 -0.01209 0.00275  0.03830  139 CYS A SG  
296  S  SG  B CYS A 34  ? 0.12073 0.15510 0.07561 -0.00502 0.00077  0.02247  139 CYS A SG  
297  N  N   . VAL A 35  ? 0.07510 0.10896 0.06978 0.00500  0.00286  0.01228  140 VAL A N   
298  C  CA  . VAL A 35  ? 0.07054 0.08720 0.06837 0.00910  0.00089  0.01005  140 VAL A CA  
299  C  C   . VAL A 35  ? 0.06952 0.09084 0.06179 -0.00491 -0.00894 0.00720  140 VAL A C   
300  O  O   . VAL A 35  ? 0.08744 0.08507 0.06095 -0.01120 0.00989  0.00691  140 VAL A O   
301  C  CB  . VAL A 35  ? 0.09163 0.08365 0.07929 0.01344  -0.00237 0.00270  140 VAL A CB  
302  C  CG1 . VAL A 35  ? 0.09436 0.07740 0.08449 0.02120  0.00190  0.00773  140 VAL A CG1 
303  C  CG2 . VAL A 35  ? 0.07887 0.08487 0.07987 0.00050  -0.00440 -0.00851 140 VAL A CG2 
304  N  N   . TYR A 36  ? 0.06408 0.09525 0.06123 0.00276  -0.01083 0.00903  141 TYR A N   
305  C  CA  . TYR A 36  ? 0.06270 0.09287 0.06736 0.01227  -0.00818 0.01405  141 TYR A CA  
306  C  C   . TYR A 36  ? 0.05889 0.08601 0.06839 -0.00389 -0.01549 0.00149  141 TYR A C   
307  O  O   . TYR A 36  ? 0.05972 0.08075 0.07132 -0.01742 -0.03129 0.00842  141 TYR A O   
308  C  CB  . TYR A 36  ? 0.07073 0.08973 0.06994 0.02029  -0.00020 0.03127  141 TYR A CB  
309  C  CG  . TYR A 36  ? 0.08414 0.10836 0.07088 0.01307  0.00775  0.03928  141 TYR A CG  
310  C  CD1 . TYR A 36  ? 0.08685 0.11966 0.07304 0.00826  0.01953  0.03085  141 TYR A CD1 
311  C  CD2 . TYR A 36  ? 0.09198 0.11423 0.07267 -0.00076 0.01499  0.04581  141 TYR A CD2 
312  C  CE1 . TYR A 36  ? 0.08262 0.11829 0.07822 -0.00905 0.01677  0.02846  141 TYR A CE1 
313  C  CE2 . TYR A 36  ? 0.09269 0.10877 0.07175 0.00203  0.01361  0.04898  141 TYR A CE2 
314  C  CZ  . TYR A 36  ? 0.09964 0.11341 0.07292 -0.00207 0.00541  0.04327  141 TYR A CZ  
315  O  OH  . TYR A 36  ? 0.09826 0.12110 0.06671 0.00528  -0.00922 0.04705  141 TYR A OH  
316  N  N   . VAL A 37  ? 0.06700 0.09150 0.06056 0.01985  -0.02089 -0.00642 142 VAL A N   
317  C  CA  . VAL A 37  ? 0.06138 0.09627 0.06309 0.01987  -0.02273 0.00518  142 VAL A CA  
318  C  C   . VAL A 37  ? 0.07220 0.09460 0.07237 0.01169  -0.00886 0.01026  142 VAL A C   
319  O  O   . VAL A 37  ? 0.08283 0.09480 0.08185 -0.00740 -0.01374 0.00643  142 VAL A O   
320  C  CB  . VAL A 37  ? 0.06908 0.10376 0.06091 0.02551  -0.01543 0.00292  142 VAL A CB  
321  C  CG1 . VAL A 37  ? 0.08441 0.10297 0.06837 0.02892  -0.03296 0.01182  142 VAL A CG1 
322  C  CG2 . VAL A 37  ? 0.09208 0.12317 0.06850 0.02074  0.00424  -0.00148 142 VAL A CG2 
323  N  N   . ILE A 38  ? 0.07224 0.10265 0.07835 0.01201  -0.00103 0.01345  143 ILE A N   
324  C  CA  . ILE A 38  ? 0.07218 0.08630 0.07483 0.00445  0.00090  0.01210  143 ILE A CA  
325  C  C   . ILE A 38  ? 0.08861 0.06090 0.07604 0.00720  0.00031  0.01019  143 ILE A C   
326  O  O   . ILE A 38  ? 0.11489 0.04922 0.07466 -0.00209 0.00351  0.02048  143 ILE A O   
327  C  CB  . ILE A 38  ? 0.07822 0.10806 0.07866 0.00643  -0.01224 0.00663  143 ILE A CB  
328  C  CG1 . ILE A 38  ? 0.07225 0.09954 0.07945 0.00664  -0.01560 0.02725  143 ILE A CG1 
329  C  CG2 . ILE A 38  ? 0.10543 0.12186 0.08554 0.00802  0.00162  -0.00871 143 ILE A CG2 
330  C  CD1 . ILE A 38  ? 0.08430 0.09017 0.08184 0.00296  -0.02213 0.02302  143 ILE A CD1 
331  N  N   . ASP A 39  ? 0.09350 0.07041 0.06752 0.03796  -0.00113 -0.00846 144 ASP A N   
332  C  CA  . ASP A 39  ? 0.08688 0.07030 0.06073 0.02916  -0.00435 -0.01018 144 ASP A CA  
333  C  C   . ASP A 39  ? 0.09107 0.07107 0.05441 0.02433  0.00011  0.00165  144 ASP A C   
334  O  O   . ASP A 39  ? 0.09612 0.08274 0.06728 -0.00010 0.00028  0.00438  144 ASP A O   
335  C  CB  . ASP A 39  ? 0.09773 0.07440 0.06597 0.03384  -0.00854 0.00370  144 ASP A CB  
336  C  CG  . ASP A 39  ? 0.10911 0.07887 0.07728 0.00337  -0.01282 0.01617  144 ASP A CG  
337  O  OD1 . ASP A 39  ? 0.11280 0.08402 0.07723 -0.02797 -0.01381 0.01997  144 ASP A OD1 
338  O  OD2 . ASP A 39  ? 0.12993 0.09346 0.07721 0.00789  -0.02160 0.03721  144 ASP A OD2 
339  N  N   . THR A 40  ? 0.09460 0.09351 0.04310 0.00637  0.00655  0.00649  145 THR A N   
340  C  CA  . THR A 40  ? 0.08676 0.08556 0.02720 0.00046  -0.00603 0.00688  145 THR A CA  
341  C  C   . THR A 40  ? 0.09725 0.08073 0.03111 0.01006  -0.00892 0.01428  145 THR A C   
342  O  O   . THR A 40  ? 0.09991 0.08307 0.03188 0.00144  -0.01531 0.01259  145 THR A O   
343  C  CB  . THR A 40  ? 0.08361 0.08193 0.02230 -0.00556 -0.00307 -0.00116 145 THR A CB  
344  O  OG1 . THR A 40  ? 0.08700 0.07981 0.03332 0.00006  -0.00255 -0.02455 145 THR A OG1 
345  C  CG2 . THR A 40  ? 0.08829 0.09092 0.02688 0.00090  -0.01494 0.00548  145 THR A CG2 
346  N  N   . GLY A 41  ? 0.08992 0.07699 0.03163 0.00712  -0.00942 0.01828  146 GLY A N   
347  C  CA  . GLY A 41  ? 0.09806 0.07436 0.03649 -0.00008 0.00054  0.01082  146 GLY A CA  
348  C  C   . GLY A 41  ? 0.08168 0.06937 0.04580 -0.01146 0.00277  0.00087  146 GLY A C   
349  O  O   . GLY A 41  ? 0.08929 0.06787 0.04035 0.00120  -0.00103 -0.00662 146 GLY A O   
350  N  N   . ILE A 42  ? 0.08373 0.07749 0.06574 -0.01288 0.01163  -0.01520 147 ILE A N   
351  C  CA  . ILE A 42  ? 0.07215 0.10498 0.07784 -0.00901 0.00525  -0.01961 147 ILE A CA  
352  C  C   . ILE A 42  ? 0.05843 0.09336 0.09348 0.00830  0.00705  0.00019  147 ILE A C   
353  O  O   . ILE A 42  ? 0.07012 0.08950 0.09906 0.01444  0.00947  -0.01832 147 ILE A O   
354  C  CB  . ILE A 42  ? 0.07960 0.11878 0.07371 -0.00969 0.02304  -0.02399 147 ILE A CB  
355  C  CG1 . ILE A 42  ? 0.07368 0.12474 0.06442 -0.00464 0.01328  -0.02677 147 ILE A CG1 
356  C  CG2 . ILE A 42  ? 0.08349 0.12577 0.08330 -0.00488 0.02997  -0.01295 147 ILE A CG2 
357  C  CD1 . ILE A 42  ? 0.09091 0.11968 0.05838 -0.00787 0.00900  -0.02257 147 ILE A CD1 
358  N  N   . GLU A 43  ? 0.06400 0.10656 0.09889 0.01084  -0.00713 0.00307  148 GLU A N   
359  C  CA  . GLU A 43  ? 0.07650 0.09249 0.11122 -0.00677 -0.01215 0.02043  148 GLU A CA  
360  C  C   . GLU A 43  ? 0.09583 0.10721 0.11724 -0.01507 -0.01725 0.04202  148 GLU A C   
361  O  O   . GLU A 43  ? 0.08629 0.10865 0.11630 0.00344  -0.02342 0.04362  148 GLU A O   
362  C  CB  . GLU A 43  ? 0.08323 0.07309 0.12076 -0.01381 -0.01287 0.01696  148 GLU A CB  
363  C  CG  . GLU A 43  ? 0.10322 0.08626 0.12894 -0.01682 -0.01803 0.00865  148 GLU A CG  
364  C  CD  . GLU A 43  ? 0.12476 0.09022 0.13825 0.00032  -0.01930 0.01551  148 GLU A CD  
365  O  OE1 . GLU A 43  ? 0.13277 0.09222 0.13123 0.00241  -0.03437 0.02062  148 GLU A OE1 
366  O  OE2 . GLU A 43  ? 0.13965 0.11061 0.15130 0.02303  -0.02049 0.02105  148 GLU A OE2 
367  N  N   . ALA A 44  ? 0.11652 0.11509 0.12648 -0.03568 -0.00872 0.04368  149 ALA A N   
368  C  CA  . ALA A 44  ? 0.13576 0.12109 0.13074 -0.01100 -0.00464 0.04269  149 ALA A CA  
369  C  C   . ALA A 44  ? 0.12481 0.11874 0.13484 -0.02711 0.00069  0.03693  149 ALA A C   
370  O  O   . ALA A 44  ? 0.13372 0.12132 0.13257 -0.02237 0.00059  0.03696  149 ALA A O   
371  C  CB  . ALA A 44  ? 0.16614 0.12263 0.13521 0.02304  0.00305  0.03762  149 ALA A CB  
372  N  N   . SER A 45  ? 0.11702 0.11963 0.14454 -0.04614 -0.00105 0.03432  150 SER A N   
373  C  CA  . SER A 45  ? 0.11620 0.12935 0.14831 -0.06015 -0.00336 0.02652  150 SER A CA  
374  C  C   . SER A 45  ? 0.11459 0.13847 0.15342 -0.04966 -0.00037 0.03094  150 SER A C   
375  O  O   . SER A 45  ? 0.12071 0.14472 0.16136 -0.06582 0.00929  0.03065  150 SER A O   
376  C  CB  . SER A 45  ? 0.13000 0.15248 0.14968 -0.06241 -0.01107 0.02376  150 SER A CB  
377  O  OG  . SER A 45  ? 0.13284 0.17988 0.14716 -0.04221 -0.01691 0.01888  150 SER A OG  
378  N  N   . HIS A 46  ? 0.08797 0.13491 0.15019 -0.03035 -0.00616 0.03337  151 HIS A N   
379  C  CA  . HIS A 46  ? 0.07448 0.12051 0.14241 -0.03150 -0.01215 0.03453  151 HIS A CA  
380  C  C   . HIS A 46  ? 0.06993 0.12294 0.13612 -0.03564 -0.00914 0.02526  151 HIS A C   
381  O  O   . HIS A 46  ? 0.06449 0.11862 0.13289 -0.03887 -0.00539 0.02307  151 HIS A O   
382  C  CB  . HIS A 46  ? 0.06891 0.11868 0.14777 -0.02539 -0.01733 0.04115  151 HIS A CB  
383  C  CG  . HIS A 46  ? 0.06903 0.12591 0.15404 -0.01237 -0.01655 0.04623  151 HIS A CG  
384  N  ND1 . HIS A 46  ? 0.07063 0.11260 0.15741 0.00116  -0.02201 0.04349  151 HIS A ND1 
385  C  CD2 . HIS A 46  ? 0.06691 0.12782 0.15824 0.00388  -0.02777 0.04525  151 HIS A CD2 
386  C  CE1 . HIS A 46  ? 0.07642 0.12599 0.16237 -0.00523 -0.01878 0.03932  151 HIS A CE1 
387  N  NE2 . HIS A 46  ? 0.07371 0.13310 0.16106 -0.00419 -0.02870 0.03766  151 HIS A NE2 
388  N  N   . PRO A 47  ? 0.06976 0.12728 0.13013 -0.04769 -0.00537 0.02413  152 PRO A N   
389  C  CA  . PRO A 47  ? 0.08480 0.14924 0.13360 -0.01927 0.00051  0.02138  152 PRO A CA  
390  C  C   . PRO A 47  ? 0.07549 0.13434 0.12173 -0.01213 0.00009  0.02560  152 PRO A C   
391  O  O   . PRO A 47  ? 0.06572 0.13501 0.11513 -0.02521 0.00620  0.02747  152 PRO A O   
392  C  CB  . PRO A 47  ? 0.07953 0.16693 0.13760 -0.02064 -0.00470 0.01406  152 PRO A CB  
393  C  CG  . PRO A 47  ? 0.06534 0.16884 0.13622 -0.03132 -0.01283 0.02355  152 PRO A CG  
394  C  CD  . PRO A 47  ? 0.06759 0.14630 0.13594 -0.04718 -0.01160 0.02215  152 PRO A CD  
395  N  N   . GLU A 48  ? 0.07490 0.11775 0.12427 0.00366  -0.00387 0.02142  153 GLU A N   
396  C  CA  . GLU A 48  ? 0.08321 0.10835 0.11885 0.01372  -0.00944 0.03406  153 GLU A CA  
397  C  C   . GLU A 48  ? 0.08390 0.10807 0.10922 0.02180  -0.00263 0.02239  153 GLU A C   
398  O  O   . GLU A 48  ? 0.08281 0.11777 0.11441 0.01987  0.00623  0.02179  153 GLU A O   
399  C  CB  . GLU A 48  ? 0.10942 0.11746 0.12694 0.02968  -0.00181 0.04137  153 GLU A CB  
400  C  CG  . GLU A 48  ? 0.13034 0.13421 0.13034 0.05558  0.01692  0.03297  153 GLU A CG  
401  C  CD  . GLU A 48  ? 0.13395 0.12854 0.12621 0.05102  0.02387  0.03522  153 GLU A CD  
402  O  OE1 . GLU A 48  ? 0.13568 0.12930 0.12217 0.05170  0.02823  0.03457  153 GLU A OE1 
403  O  OE2 . GLU A 48  ? 0.14718 0.13186 0.12041 0.04428  0.03162  0.04545  153 GLU A OE2 
404  N  N   . PHE A 49  ? 0.08057 0.10105 0.11124 0.02835  0.00315  0.01848  154 PHE A N   
405  C  CA  . PHE A 49  ? 0.08745 0.09951 0.11219 0.00619  0.00292  0.01297  154 PHE A CA  
406  C  C   . PHE A 49  ? 0.08043 0.10049 0.11613 -0.00254 0.00165  0.01376  154 PHE A C   
407  O  O   . PHE A 49  ? 0.07363 0.09216 0.11767 -0.00450 -0.00340 0.01118  154 PHE A O   
408  C  CB  . PHE A 49  ? 0.09455 0.10790 0.10582 -0.00854 0.02222  0.01765  154 PHE A CB  
409  C  CG  . PHE A 49  ? 0.08203 0.09800 0.10437 -0.02174 0.02302  0.01638  154 PHE A CG  
410  C  CD1 . PHE A 49  ? 0.05930 0.08464 0.10092 -0.01938 0.03479  0.01172  154 PHE A CD1 
411  C  CD2 . PHE A 49  ? 0.07057 0.10186 0.10003 -0.01612 -0.00135 0.02071  154 PHE A CD2 
412  C  CE1 . PHE A 49  ? 0.06881 0.08957 0.10147 -0.01925 0.02831  0.00489  154 PHE A CE1 
413  C  CE2 . PHE A 49  ? 0.07347 0.09228 0.09767 -0.00748 0.00407  0.02491  154 PHE A CE2 
414  C  CZ  . PHE A 49  ? 0.07750 0.10220 0.10035 -0.01404 0.01511  0.00934  154 PHE A CZ  
415  N  N   . GLU A 50  ? 0.08834 0.09861 0.12057 0.00261  0.00306  0.01851  155 GLU A N   
416  C  CA  . GLU A 50  ? 0.10565 0.09242 0.12818 0.01515  -0.00564 0.01342  155 GLU A CA  
417  C  C   . GLU A 50  ? 0.11552 0.09789 0.12874 0.00188  -0.00979 0.00983  155 GLU A C   
418  O  O   . GLU A 50  ? 0.13921 0.11163 0.13305 0.00580  -0.01297 -0.00530 155 GLU A O   
419  C  CB  . GLU A 50  ? 0.12041 0.10363 0.12926 0.02677  -0.01340 0.00674  155 GLU A CB  
420  C  CG  . GLU A 50  ? 0.12795 0.11660 0.12602 0.02327  -0.01549 0.00421  155 GLU A CG  
421  C  CD  . GLU A 50  ? 0.11834 0.12319 0.12284 0.01056  -0.01802 0.00892  155 GLU A CD  
422  O  OE1 . GLU A 50  ? 0.11376 0.12655 0.11655 -0.00811 -0.02202 0.01132  155 GLU A OE1 
423  O  OE2 . GLU A 50  ? 0.12509 0.15180 0.12555 0.00345  -0.00451 0.01325  155 GLU A OE2 
424  N  N   . GLY A 51  ? 0.09949 0.10300 0.12461 0.00464  0.01195  0.01562  156 GLY A N   
425  C  CA  . GLY A 51  ? 0.09270 0.11814 0.11557 0.01686  0.01097  0.01539  156 GLY A CA  
426  C  C   . GLY A 51  ? 0.09742 0.12105 0.10081 0.01527  0.00858  0.01668  156 GLY A C   
427  O  O   . GLY A 51  ? 0.11114 0.11899 0.10188 0.01469  0.00796  0.02714  156 GLY A O   
428  N  N   . ARG A 52  ? 0.09524 0.12922 0.08829 0.00603  0.00988  0.01470  157 ARG A N   
429  C  CA  . ARG A 52  ? 0.10410 0.12204 0.07279 -0.00648 0.00319  0.01229  157 ARG A CA  
430  C  C   . ARG A 52  ? 0.09742 0.13583 0.06985 0.00406  0.00303  0.01469  157 ARG A C   
431  O  O   . ARG A 52  ? 0.08216 0.15741 0.06207 -0.00226 0.00817  0.01468  157 ARG A O   
432  C  CB  . ARG A 52  ? 0.10977 0.11581 0.06751 -0.01091 0.01433  0.00506  157 ARG A CB  
433  C  CG  . ARG A 52  ? 0.11465 0.12468 0.06912 -0.02151 0.01262  0.01833  157 ARG A CG  
434  C  CD  . ARG A 52  ? 0.12284 0.12325 0.07558 -0.01167 -0.00901 0.01110  157 ARG A CD  
435  N  NE  . ARG A 52  ? 0.11872 0.11720 0.07931 0.00312  -0.02764 0.01001  157 ARG A NE  
436  C  CZ  . ARG A 52  ? 0.11621 0.12211 0.08768 0.01598  -0.02774 -0.01399 157 ARG A CZ  
437  N  NH1 . ARG A 52  ? 0.12160 0.10864 0.08820 0.01579  -0.02491 -0.03852 157 ARG A NH1 
438  N  NH2 . ARG A 52  ? 0.11289 0.14514 0.09645 0.01709  -0.03280 -0.01680 157 ARG A NH2 
439  N  N   . ALA A 53  ? 0.12236 0.12875 0.07972 -0.00010 0.00553  0.02585  158 ALA A N   
440  C  CA  . ALA A 53  ? 0.13651 0.11975 0.08741 -0.01386 0.00978  0.03099  158 ALA A CA  
441  C  C   . ALA A 53  ? 0.14512 0.11953 0.10316 -0.03265 0.02251  0.03055  158 ALA A C   
442  O  O   . ALA A 53  ? 0.16914 0.11839 0.10108 -0.04019 0.02425  0.04199  158 ALA A O   
443  C  CB  . ALA A 53  ? 0.13047 0.11464 0.08889 -0.03118 0.00616  0.04215  158 ALA A CB  
444  N  N   . GLN A 54  ? 0.14820 0.12882 0.11650 -0.02889 0.02646  0.02544  159 GLN A N   
445  C  CA  . GLN A 54  ? 0.14918 0.14484 0.12742 -0.03157 0.02456  0.03536  159 GLN A CA  
446  C  C   . GLN A 54  ? 0.13105 0.11724 0.12402 -0.00944 0.02059  0.03116  159 GLN A C   
447  O  O   . GLN A 54  ? 0.13781 0.10133 0.12291 -0.02950 0.02774  0.03180  159 GLN A O   
448  C  CB  . GLN A 54  ? 0.17924 0.19096 0.14041 -0.03421 0.01584  0.04111  159 GLN A CB  
449  C  CG  . GLN A 54  ? 0.20944 0.24990 0.15285 -0.03577 0.01226  0.04494  159 GLN A CG  
450  C  CD  . GLN A 54  ? 0.23209 0.28718 0.16395 -0.04102 0.01883  0.04249  159 GLN A CD  
451  O  OE1 . GLN A 54  ? 0.23369 0.30038 0.16532 -0.03884 0.01548  0.04437  159 GLN A OE1 
452  N  NE2 . GLN A 54  ? 0.24300 0.30214 0.17185 -0.04288 0.01907  0.03204  159 GLN A NE2 
453  N  N   . MET A 55  ? 0.11206 0.10179 0.11929 0.00950  0.01221  0.02935  160 MET A N   
454  C  CA  . MET A 55  ? 0.10804 0.08182 0.12229 0.01303  0.00217  0.02437  160 MET A CA  
455  C  C   . MET A 55  ? 0.10360 0.08882 0.12987 -0.00085 0.00663  0.02674  160 MET A C   
456  O  O   . MET A 55  ? 0.12180 0.12309 0.13769 -0.00139 0.01452  0.03144  160 MET A O   
457  C  CB  . MET A 55  ? 0.11131 0.07397 0.11621 0.00183  0.00133  0.00381  160 MET A CB  
458  C  CG  . MET A 55  ? 0.10984 0.07822 0.10708 -0.01407 0.00383  0.01893  160 MET A CG  
459  S  SD  . MET A 55  ? 0.10410 0.08773 0.09954 0.01204  0.00723  0.02474  160 MET A SD  
460  C  CE  . MET A 55  ? 0.13363 0.07218 0.10709 0.02190  0.02093  0.01560  160 MET A CE  
461  N  N   . VAL A 56  ? 0.09702 0.09676 0.13901 0.00027  0.00098  0.01731  161 VAL A N   
462  C  CA  . VAL A 56  ? 0.10648 0.10070 0.14155 0.00966  -0.00207 0.02207  161 VAL A CA  
463  C  C   . VAL A 56  ? 0.11267 0.10617 0.14804 0.00514  -0.00384 0.02056  161 VAL A C   
464  O  O   . VAL A 56  ? 0.11672 0.10569 0.15596 0.00186  -0.00361 0.02181  161 VAL A O   
465  C  CB  . VAL A 56  ? 0.10009 0.12465 0.14629 0.00845  -0.01303 0.02469  161 VAL A CB  
466  C  CG1 . VAL A 56  ? 0.11388 0.14922 0.14912 -0.00867 0.00018  0.02507  161 VAL A CG1 
467  C  CG2 . VAL A 56  ? 0.10650 0.13360 0.14953 0.00361  -0.02351 0.02012  161 VAL A CG2 
468  N  N   . LYS A 57  ? 0.11938 0.10960 0.14787 -0.00942 -0.00312 0.01112  162 LYS A N   
469  C  CA  . LYS A 57  ? 0.11992 0.10335 0.14225 -0.00628 0.00648  0.00080  162 LYS A CA  
470  C  C   . LYS A 57  ? 0.11356 0.09211 0.14146 0.00682  -0.00614 -0.01076 162 LYS A C   
471  O  O   . LYS A 57  ? 0.08682 0.09828 0.14230 0.00891  0.00317  -0.01273 162 LYS A O   
472  C  CB  . LYS A 57  ? 0.13672 0.10508 0.14794 -0.00573 0.01903  -0.00257 162 LYS A CB  
473  C  CG  . LYS A 57  ? 0.17495 0.09830 0.15042 -0.00250 0.03795  -0.00646 162 LYS A CG  
474  C  CD  . LYS A 57  ? 0.21408 0.10722 0.16058 0.00037  0.05456  -0.00957 162 LYS A CD  
475  C  CE  . LYS A 57  ? 0.24586 0.11398 0.16274 0.00677  0.06778  -0.01604 162 LYS A CE  
476  N  NZ  . LYS A 57  ? 0.26399 0.11645 0.16224 0.00879  0.07673  -0.01804 162 LYS A NZ  
477  N  N   . THR A 58  ? 0.12420 0.08155 0.14313 -0.00061 -0.02272 -0.02091 163 THR A N   
478  C  CA  . THR A 58  ? 0.12388 0.07910 0.14076 0.01082  -0.01821 -0.01953 163 THR A CA  
479  C  C   . THR A 58  ? 0.14094 0.08407 0.14227 0.01047  -0.00478 -0.02747 163 THR A C   
480  O  O   . THR A 58  ? 0.15824 0.09617 0.15044 0.01431  0.00542  0.00357  163 THR A O   
481  C  CB  . THR A 58  ? 0.13238 0.06921 0.14012 -0.00830 -0.02372 -0.00862 163 THR A CB  
482  O  OG1 . THR A 58  ? 0.15427 0.07132 0.13503 0.03052  -0.00523 -0.00892 163 THR A OG1 
483  C  CG2 . THR A 58  ? 0.14774 0.07449 0.14557 -0.02604 -0.02086 -0.01668 163 THR A CG2 
484  N  N   . TYR A 59  ? 0.12917 0.09121 0.13471 -0.00240 -0.01193 -0.04538 164 TYR A N   
485  C  CA  . TYR A 59  ? 0.12187 0.09863 0.13214 -0.02532 -0.01541 -0.04413 164 TYR A CA  
486  C  C   . TYR A 59  ? 0.13660 0.08915 0.13252 -0.01916 -0.01758 -0.03729 164 TYR A C   
487  O  O   . TYR A 59  ? 0.14157 0.11152 0.13305 -0.00619 -0.02498 -0.04288 164 TYR A O   
488  C  CB  . TYR A 59  ? 0.11200 0.11081 0.13018 -0.02094 -0.01282 -0.05004 164 TYR A CB  
489  C  CG  . TYR A 59  ? 0.10504 0.10055 0.13073 -0.00444 -0.00666 -0.04889 164 TYR A CG  
490  C  CD1 . TYR A 59  ? 0.10899 0.11415 0.13571 0.01327  -0.00505 -0.04557 164 TYR A CD1 
491  C  CD2 . TYR A 59  ? 0.10077 0.09735 0.13390 -0.01402 0.00274  -0.03297 164 TYR A CD2 
492  C  CE1 . TYR A 59  ? 0.10518 0.11538 0.13728 0.01252  -0.00285 -0.04019 164 TYR A CE1 
493  C  CE2 . TYR A 59  ? 0.10512 0.10558 0.13437 -0.01440 0.00063  -0.02496 164 TYR A CE2 
494  C  CZ  . TYR A 59  ? 0.09959 0.11865 0.14144 -0.01095 0.00073  -0.03648 164 TYR A CZ  
495  O  OH  . TYR A 59  ? 0.10175 0.14607 0.14119 -0.00863 0.00432  -0.02736 164 TYR A OH  
496  N  N   . TYR A 60  ? 0.13980 0.07396 0.13773 -0.01184 -0.01816 -0.02136 165 TYR A N   
497  C  CA  . TYR A 60  ? 0.15403 0.08549 0.15407 -0.01286 -0.01462 -0.01199 165 TYR A CA  
498  C  C   . TYR A 60  ? 0.15671 0.09513 0.15179 -0.01934 -0.01628 -0.01693 165 TYR A C   
499  O  O   . TYR A 60  ? 0.16148 0.11621 0.15286 -0.01792 -0.01084 -0.02613 165 TYR A O   
500  C  CB  . TYR A 60  ? 0.17169 0.10867 0.17186 -0.00197 -0.00860 -0.00132 165 TYR A CB  
501  C  CG  . TYR A 60  ? 0.18090 0.10718 0.18985 -0.00973 -0.00683 -0.01192 165 TYR A CG  
502  C  CD1 . TYR A 60  ? 0.17978 0.09986 0.19660 -0.00563 -0.00651 -0.01270 165 TYR A CD1 
503  C  CD2 . TYR A 60  ? 0.18704 0.10741 0.19696 -0.01442 0.00181  -0.02108 165 TYR A CD2 
504  C  CE1 . TYR A 60  ? 0.17056 0.10938 0.20391 0.00015  -0.00752 -0.00415 165 TYR A CE1 
505  C  CE2 . TYR A 60  ? 0.17796 0.11751 0.20197 -0.01385 0.00180  -0.01785 165 TYR A CE2 
506  C  CZ  . TYR A 60  ? 0.17097 0.12061 0.20896 -0.00551 0.00302  -0.00843 165 TYR A CZ  
507  O  OH  . TYR A 60  ? 0.17974 0.14058 0.21841 -0.00852 0.00452  0.00413  165 TYR A OH  
508  N  N   . TYR A 61  ? 0.15919 0.08318 0.14047 -0.02240 -0.02765 -0.03204 166 TYR A N   
509  C  CA  . TYR A 61  ? 0.16959 0.09147 0.13899 -0.02769 -0.03061 -0.02364 166 TYR A CA  
510  C  C   . TYR A 61  ? 0.17317 0.09132 0.13838 -0.01062 -0.01867 -0.02628 166 TYR A C   
511  O  O   . TYR A 61  ? 0.19110 0.09945 0.14092 -0.00566 -0.01984 -0.03390 166 TYR A O   
512  C  CB  . TYR A 61  ? 0.17750 0.10455 0.13552 -0.02220 -0.03376 -0.01764 166 TYR A CB  
513  C  CG  . TYR A 61  ? 0.17397 0.12320 0.13627 -0.01192 -0.02448 -0.00889 166 TYR A CG  
514  C  CD1 . TYR A 61  ? 0.18039 0.12368 0.13591 -0.00368 -0.01451 -0.01215 166 TYR A CD1 
515  C  CD2 . TYR A 61  ? 0.17279 0.13050 0.13750 -0.00803 -0.02171 -0.00103 166 TYR A CD2 
516  C  CE1 . TYR A 61  ? 0.18642 0.12346 0.13675 -0.00399 -0.00734 -0.01040 166 TYR A CE1 
517  C  CE2 . TYR A 61  ? 0.18592 0.13739 0.13615 -0.00608 -0.01165 -0.00191 166 TYR A CE2 
518  C  CZ  . TYR A 61  ? 0.19003 0.13098 0.13697 -0.00430 -0.00409 -0.00622 166 TYR A CZ  
519  O  OH  . TYR A 61  ? 0.19706 0.15960 0.14083 -0.00246 -0.00241 -0.01370 166 TYR A OH  
520  N  N   . SER A 62  ? 0.15452 0.09870 0.13054 0.00617  -0.01048 -0.03476 167 SER A N   
521  C  CA  . SER A 62  ? 0.15183 0.11414 0.13600 -0.00185 -0.00591 -0.03725 167 SER A CA  
522  C  C   . SER A 62  ? 0.14373 0.11459 0.13223 -0.01202 -0.00416 -0.03102 167 SER A C   
523  O  O   . SER A 62  ? 0.14781 0.11688 0.12910 -0.02038 -0.00147 -0.02960 167 SER A O   
524  C  CB  . SER A 62  ? 0.14947 0.12291 0.13424 -0.00280 0.00338  -0.04300 167 SER A CB  
525  O  OG  . SER A 62  ? 0.16127 0.12717 0.13908 -0.00701 0.01422  -0.04798 167 SER A OG  
526  N  N   . SER A 63  ? 0.14404 0.11419 0.13203 0.00450  -0.00647 -0.03153 168 SER A N   
527  C  CA  . SER A 63  ? 0.13833 0.11002 0.13424 0.01358  0.00488  -0.03081 168 SER A CA  
528  C  C   . SER A 63  ? 0.12700 0.09540 0.13310 0.00871  -0.00252 -0.02429 168 SER A C   
529  O  O   . SER A 63  ? 0.14959 0.10702 0.13884 0.00739  -0.00488 -0.02581 168 SER A O   
530  C  CB  . SER A 63  ? 0.15986 0.14026 0.14517 0.00528  0.00790  -0.02293 168 SER A CB  
531  O  OG  . SER A 63  ? 0.17130 0.16652 0.15520 0.01471  0.00902  -0.02690 168 SER A OG  
532  N  N   . ARG A 64  ? 0.12706 0.09815 0.14532 -0.00318 -0.00427 -0.01357 169 ARG A N   
533  C  CA  . ARG A 64  ? 0.13812 0.08670 0.15200 -0.00412 -0.01571 -0.00485 169 ARG A CA  
534  C  C   . ARG A 64  ? 0.14130 0.07049 0.14448 -0.00142 -0.01047 -0.01152 169 ARG A C   
535  O  O   . ARG A 64  ? 0.14932 0.09005 0.15439 0.01677  -0.01143 -0.01389 169 ARG A O   
536  C  CB  . ARG A 64  ? 0.14412 0.11911 0.16417 0.00209  -0.03273 -0.01642 169 ARG A CB  
537  C  CG  . ARG A 64  ? 0.15964 0.15005 0.17609 -0.01691 -0.04753 -0.01889 169 ARG A CG  
538  C  CD  . ARG A 64  ? 0.18626 0.20290 0.18645 -0.01599 -0.06579 -0.02044 169 ARG A CD  
539  N  NE  . ARG A 64  ? 0.22558 0.25260 0.20270 -0.01344 -0.06028 -0.02175 169 ARG A NE  
540  C  CZ  . ARG A 64  ? 0.25534 0.28475 0.21656 -0.00552 -0.06157 -0.01947 169 ARG A CZ  
541  N  NH1 . ARG A 64  ? 0.26162 0.29644 0.22181 0.00031  -0.05325 -0.02082 169 ARG A NH1 
542  N  NH2 . ARG A 64  ? 0.26592 0.29511 0.22189 -0.00250 -0.06908 -0.02557 169 ARG A NH2 
543  N  N   . ASP A 65  ? 0.13419 0.05202 0.12921 -0.02193 -0.01552 -0.01994 170 ASP A N   
544  C  CA  . ASP A 65  ? 0.11194 0.05285 0.12039 -0.01398 -0.01623 -0.01465 170 ASP A CA  
545  C  C   . ASP A 65  ? 0.10896 0.07375 0.11257 -0.01402 -0.01895 -0.02209 170 ASP A C   
546  O  O   . ASP A 65  ? 0.10182 0.08066 0.11831 -0.00229 -0.02001 -0.02564 170 ASP A O   
547  C  CB  . ASP A 65  ? 0.12689 0.05574 0.12024 -0.01250 -0.01880 -0.01578 170 ASP A CB  
548  C  CG  . ASP A 65  ? 0.11259 0.05510 0.11177 -0.00122 -0.02937 -0.01231 170 ASP A CG  
549  O  OD1 . ASP A 65  ? 0.11034 0.07100 0.11613 -0.00730 -0.02547 -0.00419 170 ASP A OD1 
550  O  OD2 . ASP A 65  ? 0.10200 0.05160 0.10506 -0.01234 -0.04223 -0.01330 170 ASP A OD2 
551  N  N   . GLY A 66  ? 0.11764 0.07617 0.09498 -0.03713 -0.02910 -0.01224 171 GLY A N   
552  C  CA  . GLY A 66  ? 0.13238 0.09083 0.08514 -0.02074 -0.01851 -0.00091 171 GLY A CA  
553  C  C   . GLY A 66  ? 0.11371 0.09462 0.08014 -0.03404 -0.01408 -0.00484 171 GLY A C   
554  O  O   . GLY A 66  ? 0.11545 0.10121 0.07200 -0.04471 -0.03222 -0.00657 171 GLY A O   
555  N  N   . ASN A 67  ? 0.11142 0.08533 0.07849 -0.02888 0.01112  0.00138  172 ASN A N   
556  C  CA  . ASN A 67  ? 0.11301 0.10018 0.06494 -0.01871 0.01480  0.00003  172 ASN A CA  
557  C  C   . ASN A 67  ? 0.11122 0.10666 0.05172 -0.00492 -0.00113 -0.01707 172 ASN A C   
558  O  O   . ASN A 67  ? 0.13073 0.10638 0.04429 0.00213  -0.00629 -0.02831 172 ASN A O   
559  C  CB  . ASN A 67  ? 0.11358 0.10023 0.06136 -0.03119 0.00897  0.03022  172 ASN A CB  
560  C  CG  . ASN A 67  ? 0.13073 0.09802 0.05613 -0.02264 0.00324  0.03259  172 ASN A CG  
561  O  OD1 . ASN A 67  ? 0.14569 0.13174 0.05570 -0.03613 -0.01279 0.02830  172 ASN A OD1 
562  N  ND2 . ASN A 67  ? 0.13256 0.11024 0.04835 0.00931  -0.00244 0.01535  172 ASN A ND2 
563  N  N   . GLY A 68  ? 0.09822 0.11471 0.04754 -0.01034 -0.02058 -0.01385 173 GLY A N   
564  C  CA  . GLY A 68  ? 0.07981 0.10714 0.04119 -0.00486 -0.01704 -0.01052 173 GLY A CA  
565  C  C   . GLY A 68  ? 0.06893 0.10728 0.04174 -0.00109 -0.00005 0.00310  173 GLY A C   
566  O  O   . GLY A 68  ? 0.08336 0.09242 0.04399 -0.00046 -0.00098 0.01250  173 GLY A O   
567  N  N   . HIS A 69  ? 0.06118 0.11038 0.05162 -0.01533 0.00399  0.00585  174 HIS A N   
568  C  CA  . HIS A 69  ? 0.07722 0.11629 0.06027 -0.03084 0.00074  0.00946  174 HIS A CA  
569  C  C   . HIS A 69  ? 0.09282 0.09923 0.05890 -0.02088 -0.00591 -0.00683 174 HIS A C   
570  O  O   . HIS A 69  ? 0.08844 0.09072 0.05160 -0.01407 0.00975  -0.00941 174 HIS A O   
571  C  CB  . HIS A 69  ? 0.08947 0.13879 0.07705 -0.04411 -0.00031 0.01891  174 HIS A CB  
572  C  CG  . HIS A 69  ? 0.10833 0.11867 0.09194 -0.05200 -0.00015 0.03336  174 HIS A CG  
573  N  ND1 . HIS A 69  ? 0.10020 0.12145 0.09729 -0.04489 0.00238  0.02701  174 HIS A ND1 
574  C  CD2 . HIS A 69  ? 0.13556 0.11911 0.10749 -0.05593 -0.00361 0.02261  174 HIS A CD2 
575  C  CE1 . HIS A 69  ? 0.11767 0.12621 0.10560 -0.04689 0.00429  0.02478  174 HIS A CE1 
576  N  NE2 . HIS A 69  ? 0.14065 0.12695 0.10854 -0.05498 0.00246  0.02704  174 HIS A NE2 
577  N  N   . GLY A 70  ? 0.09959 0.09281 0.06766 -0.00581 -0.00723 0.00282  175 GLY A N   
578  C  CA  . GLY A 70  ? 0.09479 0.09336 0.07141 0.00100  -0.00250 0.00111  175 GLY A CA  
579  C  C   . GLY A 70  ? 0.08707 0.08516 0.07882 0.01507  -0.00378 0.00385  175 GLY A C   
580  O  O   . GLY A 70  ? 0.09243 0.07403 0.07595 0.02506  0.01661  0.00809  175 GLY A O   
581  N  N   . THR A 71  ? 0.08493 0.08187 0.08824 0.01119  -0.00545 0.00381  176 THR A N   
582  C  CA  . THR A 71  ? 0.07853 0.07167 0.09028 0.00805  -0.01262 0.00219  176 THR A CA  
583  C  C   . THR A 71  ? 0.07862 0.07492 0.08605 0.01066  -0.00914 0.00528  176 THR A C   
584  O  O   . THR A 71  ? 0.08231 0.07591 0.08105 0.00897  -0.00543 0.00857  176 THR A O   
585  C  CB  . THR A 71  ? 0.08014 0.07450 0.09588 0.00669  -0.00790 -0.00550 176 THR A CB  
586  O  OG1 . THR A 71  ? 0.08845 0.06851 0.10409 0.00222  -0.01027 0.00663  176 THR A OG1 
587  C  CG2 . THR A 71  ? 0.08393 0.07860 0.09400 0.00883  -0.00392 -0.01765 176 THR A CG2 
588  N  N   . HIS A 72  ? 0.04820 0.08962 0.09077 0.01251  -0.01339 0.00717  177 HIS A N   
589  C  CA  . HIS A 72  ? 0.04804 0.08291 0.09005 0.00077  -0.01645 0.00185  177 HIS A CA  
590  C  C   . HIS A 72  ? 0.04118 0.07832 0.08345 -0.01760 -0.01509 0.00750  177 HIS A C   
591  O  O   . HIS A 72  ? 0.04816 0.09386 0.07824 -0.02998 -0.00667 0.00921  177 HIS A O   
592  C  CB  . HIS A 72  ? 0.06891 0.06379 0.09654 0.01174  -0.02275 -0.00363 177 HIS A CB  
593  C  CG  . HIS A 72  ? 0.07821 0.06780 0.09776 0.00144  -0.03474 -0.00242 177 HIS A CG  
594  N  ND1 . HIS A 72  ? 0.09365 0.08601 0.09656 -0.01550 -0.02535 0.00838  177 HIS A ND1 
595  C  CD2 . HIS A 72  ? 0.08265 0.08261 0.08919 0.00860  -0.03502 0.00361  177 HIS A CD2 
596  C  CE1 . HIS A 72  ? 0.09988 0.10430 0.09367 -0.00137 -0.02965 0.01256  177 HIS A CE1 
597  N  NE2 . HIS A 72  ? 0.10476 0.10509 0.09167 -0.00868 -0.03431 0.00979  177 HIS A NE2 
598  N  N   . CYS A 73  ? 0.03227 0.07473 0.08090 -0.01840 -0.01083 0.01569  178 CYS A N   
599  C  CA  . CYS A 73  ? 0.05295 0.07857 0.08290 -0.01870 -0.00025 0.00402  178 CYS A CA  
600  C  C   . CYS A 73  ? 0.04354 0.07049 0.07666 -0.00609 -0.00126 -0.00002 178 CYS A C   
601  O  O   . CYS A 73  ? 0.04883 0.06967 0.07278 0.00071  0.00195  -0.00906 178 CYS A O   
602  C  CB  . CYS A 73  ? 0.06267 0.09207 0.08356 -0.02156 0.00995  0.01269  178 CYS A CB  
603  S  SG  . CYS A 73  ? 0.08090 0.10370 0.09449 -0.02045 0.01358  0.00550  178 CYS A SG  
604  N  N   . ALA A 74  ? 0.04739 0.07133 0.08046 -0.00480 -0.00563 0.00779  179 ALA A N   
605  C  CA  . ALA A 74  ? 0.06600 0.07565 0.07764 -0.00317 -0.00787 0.01008  179 ALA A CA  
606  C  C   . ALA A 74  ? 0.05249 0.08304 0.06573 -0.00503 -0.01491 0.01581  179 ALA A C   
607  O  O   . ALA A 74  ? 0.05869 0.07545 0.05555 -0.00112 -0.01152 0.02294  179 ALA A O   
608  C  CB  . ALA A 74  ? 0.08968 0.08895 0.08334 -0.00879 -0.02554 -0.00070 179 ALA A CB  
609  N  N   . GLY A 75  ? 0.04950 0.09696 0.07227 -0.00204 -0.00706 0.01749  180 GLY A N   
610  C  CA  . GLY A 75  ? 0.05562 0.10374 0.06903 0.00393  -0.00033 0.01270  180 GLY A CA  
611  C  C   . GLY A 75  ? 0.05773 0.08957 0.05976 0.00015  0.00738  0.01588  180 GLY A C   
612  O  O   . GLY A 75  ? 0.05774 0.10487 0.04154 0.00564  0.01010  0.02588  180 GLY A O   
613  N  N   . THR A 76  ? 0.05080 0.06096 0.06990 -0.01491 -0.01758 0.02756  181 THR A N   
614  C  CA  . THR A 76  ? 0.04876 0.05277 0.07044 -0.01928 -0.01899 0.03230  181 THR A CA  
615  C  C   . THR A 76  ? 0.06329 0.07192 0.06575 -0.01403 -0.01182 0.03482  181 THR A C   
616  O  O   . THR A 76  ? 0.08530 0.08709 0.07475 -0.01223 -0.01057 0.03449  181 THR A O   
617  C  CB  . THR A 76  ? 0.06169 0.06029 0.07363 -0.02874 -0.01035 0.02294  181 THR A CB  
618  O  OG1 . THR A 76  ? 0.07070 0.07910 0.07787 -0.02154 -0.00985 0.02429  181 THR A OG1 
619  C  CG2 . THR A 76  ? 0.06743 0.08125 0.07688 -0.04195 -0.01167 0.01639  181 THR A CG2 
620  N  N   . VAL A 77  ? 0.04815 0.08772 0.06844 -0.01095 -0.00212 0.03492  182 VAL A N   
621  C  CA  . VAL A 77  ? 0.05848 0.09752 0.07136 0.00958  0.00851  0.01921  182 VAL A CA  
622  C  C   . VAL A 77  ? 0.05883 0.09980 0.08295 -0.00955 0.01264  0.02457  182 VAL A C   
623  O  O   . VAL A 77  ? 0.09152 0.10823 0.08269 -0.01371 0.01777  0.02849  182 VAL A O   
624  C  CB  . VAL A 77  ? 0.05789 0.09465 0.06095 0.02447  0.00779  0.00580  182 VAL A CB  
625  C  CG1 . VAL A 77  ? 0.07788 0.10119 0.05591 0.02216  -0.01594 0.01196  182 VAL A CG1 
626  C  CG2 . VAL A 77  ? 0.06827 0.09753 0.05636 0.00822  0.01926  -0.01011 182 VAL A CG2 
627  N  N   . GLY A 78  ? 0.05049 0.07579 0.09304 0.00328  0.02661  0.02490  183 GLY A N   
628  C  CA  . GLY A 78  ? 0.05400 0.09452 0.09859 -0.00875 0.02620  0.01785  183 GLY A CA  
629  C  C   . GLY A 78  ? 0.05893 0.09296 0.10209 -0.00041 0.01833  0.00415  183 GLY A C   
630  O  O   . GLY A 78  ? 0.06709 0.11093 0.09454 -0.00589 0.01807  0.00879  183 GLY A O   
631  N  N   . SER A 79  ? 0.07400 0.08502 0.09843 0.01394  0.01763  -0.00296 184 SER A N   
632  C  CA  . SER A 79  ? 0.07108 0.09518 0.09961 0.01034  0.01183  0.00523  184 SER A CA  
633  C  C   . SER A 79  ? 0.05607 0.08924 0.09873 0.00844  0.00869  0.01428  184 SER A C   
634  O  O   . SER A 79  ? 0.03463 0.06613 0.09285 0.01785  0.01062  0.01370  184 SER A O   
635  C  CB  . SER A 79  ? 0.07684 0.09295 0.09611 -0.00187 0.01613  0.00316  184 SER A CB  
636  O  OG  . SER A 79  ? 0.08326 0.09042 0.09520 0.00947  0.01110  -0.00475 184 SER A OG  
637  N  N   . ARG A 80  ? 0.05145 0.10325 0.09996 0.01754  0.02179  0.01249  185 ARG A N   
638  C  CA  . ARG A 80  ? 0.04808 0.10711 0.10398 0.00972  0.03439  0.00453  185 ARG A CA  
639  C  C   . ARG A 80  ? 0.05954 0.10881 0.11709 -0.00580 0.01615  0.00993  185 ARG A C   
640  O  O   . ARG A 80  ? 0.06235 0.10164 0.12679 -0.01682 0.00920  0.00232  185 ARG A O   
641  C  CB  . ARG A 80  ? 0.05851 0.12880 0.10765 0.01131  0.04163  -0.00697 185 ARG A CB  
642  C  CG  . ARG A 80  ? 0.06939 0.15971 0.11937 0.02487  0.04062  -0.00477 185 ARG A CG  
643  C  CD  . ARG A 80  ? 0.09532 0.21356 0.12979 0.03716  0.02454  0.00569  185 ARG A CD  
644  N  NE  . ARG A 80  ? 0.12854 0.24298 0.14045 0.04367  0.01424  0.00300  185 ARG A NE  
645  C  CZ  . ARG A 80  ? 0.13876 0.26213 0.14631 0.05285  0.01570  0.00365  185 ARG A CZ  
646  N  NH1 . ARG A 80  ? 0.14268 0.26898 0.15147 0.03900  0.02579  -0.00610 185 ARG A NH1 
647  N  NH2 . ARG A 80  ? 0.15570 0.27260 0.14657 0.06943  0.00296  0.01088  185 ARG A NH2 
648  N  N   . THR A 81  ? 0.04275 0.11371 0.12098 -0.00524 0.01095  0.01569  186 THR A N   
649  C  CA  . THR A 81  ? 0.05100 0.10629 0.11523 -0.01868 -0.00444 0.01854  186 THR A CA  
650  C  C   . THR A 81  ? 0.05662 0.09616 0.10489 -0.00324 0.00072  -0.00097 186 THR A C   
651  O  O   . THR A 81  ? 0.08697 0.08850 0.10739 0.00633  0.00663  -0.01872 186 THR A O   
652  C  CB  . THR A 81  ? 0.06521 0.13128 0.11851 0.00037  -0.01951 0.02514  186 THR A CB  
653  O  OG1 . THR A 81  ? 0.06050 0.14082 0.12163 -0.00050 -0.02322 0.03469  186 THR A OG1 
654  C  CG2 . THR A 81  ? 0.06589 0.14922 0.12305 0.01593  -0.02749 0.01965  186 THR A CG2 
655  N  N   . TYR A 82  ? 0.04318 0.11308 0.09620 0.00964  -0.01012 -0.01733 187 TYR A N   
656  C  CA  . TYR A 82  ? 0.05489 0.13224 0.10136 0.00782  -0.03158 -0.01754 187 TYR A CA  
657  C  C   . TYR A 82  ? 0.05736 0.11885 0.10719 0.01418  -0.02686 -0.02851 187 TYR A C   
658  O  O   . TYR A 82  ? 0.06621 0.11146 0.11241 0.00305  -0.02184 -0.03752 187 TYR A O   
659  C  CB  . TYR A 82  ? 0.07076 0.14415 0.10733 0.00375  -0.03025 -0.01744 187 TYR A CB  
660  C  CG  . TYR A 82  ? 0.05858 0.13040 0.10538 -0.00709 -0.02303 -0.00826 187 TYR A CG  
661  C  CD1 . TYR A 82  ? 0.05051 0.11712 0.09512 -0.00526 -0.01381 -0.01075 187 TYR A CD1 
662  C  CD2 . TYR A 82  ? 0.07414 0.14165 0.10398 -0.01292 -0.03425 -0.00772 187 TYR A CD2 
663  C  CE1 . TYR A 82  ? 0.04886 0.12171 0.09672 -0.01492 -0.01333 -0.02544 187 TYR A CE1 
664  C  CE2 . TYR A 82  ? 0.07116 0.14576 0.10736 -0.01653 -0.04346 -0.00566 187 TYR A CE2 
665  C  CZ  . TYR A 82  ? 0.06017 0.13493 0.10287 -0.00978 -0.02304 -0.01502 187 TYR A CZ  
666  O  OH  . TYR A 82  ? 0.08259 0.15001 0.10908 -0.00567 -0.02904 -0.02068 187 TYR A OH  
667  N  N   . GLY A 83  ? 0.06907 0.11427 0.10848 0.02997  -0.02858 -0.02275 188 GLY A N   
668  C  CA  . GLY A 83  ? 0.05934 0.09943 0.10482 0.01507  -0.03488 -0.01365 188 GLY A CA  
669  C  C   . GLY A 83  ? 0.05773 0.09899 0.11168 0.01655  -0.01561 -0.01513 188 GLY A C   
670  O  O   . GLY A 83  ? 0.06928 0.09014 0.11701 0.03442  -0.00978 -0.01138 188 GLY A O   
671  N  N   . VAL A 84  ? 0.03915 0.11888 0.11316 -0.00124 -0.02673 -0.00102 189 VAL A N   
672  C  CA  . VAL A 84  ? 0.05603 0.12706 0.11001 0.00458  -0.01437 -0.00013 189 VAL A CA  
673  C  C   . VAL A 84  ? 0.06266 0.12383 0.11266 0.03211  -0.00053 0.00198  189 VAL A C   
674  O  O   . VAL A 84  ? 0.05969 0.12197 0.11229 0.04436  0.00186  -0.00571 189 VAL A O   
675  C  CB  . VAL A 84  ? 0.07186 0.13256 0.10666 0.00351  -0.02765 -0.01024 189 VAL A CB  
676  C  CG1 . VAL A 84  ? 0.07471 0.13469 0.10640 -0.00385 -0.05162 -0.00478 189 VAL A CG1 
677  C  CG2 . VAL A 84  ? 0.08518 0.12911 0.10435 0.02503  -0.03367 -0.02527 189 VAL A CG2 
678  N  N   . ALA A 85  ? 0.05912 0.10953 0.11439 0.01661  0.00346  0.01527  190 ALA A N   
679  C  CA  . ALA A 85  ? 0.05524 0.13454 0.11433 -0.00503 0.00540  0.02704  190 ALA A CA  
680  C  C   . ALA A 85  ? 0.06069 0.12295 0.10612 -0.00898 0.00999  0.04386  190 ALA A C   
681  O  O   . ALA A 85  ? 0.05972 0.11970 0.09027 -0.00483 0.01064  0.05386  190 ALA A O   
682  C  CB  . ALA A 85  ? 0.03844 0.14724 0.11357 -0.00126 -0.00294 0.01543  190 ALA A CB  
683  N  N   . LYS A 86  ? 0.05550 0.12572 0.11322 -0.01917 0.01044  0.02947  191 LYS A N   
684  C  CA  . LYS A 86  ? 0.06406 0.12231 0.11563 -0.00673 0.01566  0.02099  191 LYS A CA  
685  C  C   . LYS A 86  ? 0.07269 0.12577 0.11404 0.00677  0.00174  0.02841  191 LYS A C   
686  O  O   . LYS A 86  ? 0.07351 0.12941 0.11236 0.00929  0.00629  0.02495  191 LYS A O   
687  C  CB  . LYS A 86  ? 0.07222 0.11242 0.12023 0.00601  0.02840  0.00498  191 LYS A CB  
688  C  CG  . LYS A 86  ? 0.07566 0.12131 0.12518 0.01561  0.02887  -0.01019 191 LYS A CG  
689  C  CD  . LYS A 86  ? 0.08068 0.13194 0.12480 0.02971  0.02801  -0.02068 191 LYS A CD  
690  C  CE  . LYS A 86  ? 0.07919 0.13136 0.11991 0.00786  0.02759  -0.02655 191 LYS A CE  
691  N  NZ  . LYS A 86  ? 0.06851 0.12939 0.11481 -0.02568 0.01509  -0.02884 191 LYS A NZ  
692  N  N   . LYS A 87  ? 0.07943 0.13528 0.10575 0.00619  0.00337  0.02907  192 LYS A N   
693  C  CA  . LYS A 87  ? 0.08821 0.13335 0.09472 -0.00819 0.01446  0.02542  192 LYS A CA  
694  C  C   . LYS A 87  ? 0.09481 0.12709 0.08614 -0.00108 -0.00079 0.02703  192 LYS A C   
695  O  O   . LYS A 87  ? 0.08231 0.13593 0.07953 0.01996  -0.00961 0.01623  192 LYS A O   
696  C  CB  . LYS A 87  ? 0.10038 0.17101 0.10253 0.00078  0.02817  0.01635  192 LYS A CB  
697  C  CG  . LYS A 87  ? 0.13103 0.22065 0.11100 0.01586  0.04693  -0.00422 192 LYS A CG  
698  C  CD  . LYS A 87  ? 0.16643 0.27397 0.11865 0.02317  0.05910  -0.00198 192 LYS A CD  
699  C  CE  . LYS A 87  ? 0.19897 0.31271 0.13007 0.02511  0.06000  -0.00585 192 LYS A CE  
700  N  NZ  . LYS A 87  ? 0.20776 0.32690 0.13674 0.02393  0.06128  -0.00269 192 LYS A NZ  
701  N  N   . THR A 88  ? 0.08873 0.11401 0.08012 0.00251  -0.00001 0.03762  193 THR A N   
702  C  CA  . THR A 88  ? 0.08945 0.11393 0.08805 0.00959  0.01071  0.03523  193 THR A CA  
703  C  C   . THR A 88  ? 0.10143 0.11237 0.09108 0.01067  0.00693  0.02437  193 THR A C   
704  O  O   . THR A 88  ? 0.11142 0.10881 0.09312 0.00747  0.01846  0.01891  193 THR A O   
705  C  CB  . THR A 88  ? 0.08063 0.09626 0.08912 0.02876  0.02121  0.03267  193 THR A CB  
706  O  OG1 . THR A 88  ? 0.06361 0.09081 0.08131 0.01872  0.03860  0.02061  193 THR A OG1 
707  C  CG2 . THR A 88  ? 0.10128 0.10701 0.09636 0.03649  0.02286  0.03837  193 THR A CG2 
708  N  N   A GLN A 89  ? 0.10257 0.11182 0.09570 0.00856  0.00788  0.02105  194 GLN A N   
709  N  N   B GLN A 89  ? 0.10144 0.11669 0.09123 0.00920  -0.00364 0.02336  194 GLN A N   
710  C  CA  A GLN A 89  ? 0.10800 0.11385 0.09984 0.00290  0.01816  0.02709  194 GLN A CA  
711  C  CA  B GLN A 89  ? 0.10777 0.12372 0.08979 0.00168  -0.00488 0.03045  194 GLN A CA  
712  C  C   A GLN A 89  ? 0.09087 0.11998 0.09836 -0.00332 0.01043  0.02140  194 GLN A C   
713  C  C   B GLN A 89  ? 0.08944 0.12213 0.09605 0.00016  -0.00200 0.02378  194 GLN A C   
714  O  O   A GLN A 89  ? 0.08941 0.13244 0.09783 -0.00980 0.00767  0.02024  194 GLN A O   
715  O  O   B GLN A 89  ? 0.08270 0.12988 0.09777 -0.00157 -0.00591 0.02427  194 GLN A O   
716  C  CB  A GLN A 89  ? 0.12329 0.11404 0.10857 0.00588  0.03662  0.03063  194 GLN A CB  
717  C  CB  B GLN A 89  ? 0.12560 0.13697 0.08837 -0.00417 -0.00850 0.03522  194 GLN A CB  
718  C  CG  A GLN A 89  ? 0.14662 0.12331 0.11789 0.00497  0.04909  0.03905  194 GLN A CG  
719  C  CG  B GLN A 89  ? 0.14855 0.15845 0.08708 -0.01272 -0.01414 0.04197  194 GLN A CG  
720  C  CD  A GLN A 89  ? 0.15525 0.13018 0.12595 0.02014  0.06005  0.04781  194 GLN A CD  
721  C  CD  B GLN A 89  ? 0.16864 0.17490 0.08879 -0.00889 -0.02369 0.05029  194 GLN A CD  
722  O  OE1 A GLN A 89  ? 0.17194 0.14170 0.13352 0.01766  0.05934  0.04801  194 GLN A OE1 
723  O  OE1 B GLN A 89  ? 0.18174 0.18306 0.09075 -0.00562 -0.02546 0.05386  194 GLN A OE1 
724  N  NE2 A GLN A 89  ? 0.14495 0.12181 0.12325 0.03220  0.05944  0.05808  194 GLN A NE2 
725  N  NE2 B GLN A 89  ? 0.16748 0.17359 0.08990 0.00642  -0.02908 0.05240  194 GLN A NE2 
726  N  N   . LEU A 90  ? 0.08610 0.10916 0.10195 0.01205  0.00193  0.01630  195 LEU A N   
727  C  CA  . LEU A 90  ? 0.08730 0.09755 0.11696 0.00606  0.00148  0.00408  195 LEU A CA  
728  C  C   . LEU A 90  ? 0.06839 0.08818 0.11697 0.00089  0.00991  -0.01752 195 LEU A C   
729  O  O   . LEU A 90  ? 0.08045 0.10062 0.12376 -0.00997 0.01858  -0.04198 195 LEU A O   
730  C  CB  . LEU A 90  ? 0.08460 0.09469 0.12681 0.00210  -0.00898 0.00826  195 LEU A CB  
731  C  CG  . LEU A 90  ? 0.09234 0.10553 0.13688 0.00660  -0.01758 0.02152  195 LEU A CG  
732  C  CD1 . LEU A 90  ? 0.11252 0.13786 0.14835 0.01929  -0.02783 0.02519  195 LEU A CD1 
733  C  CD2 . LEU A 90  ? 0.07652 0.11318 0.13226 -0.00548 -0.01257 0.02225  195 LEU A CD2 
734  N  N   . PHE A 91  ? 0.06843 0.09947 0.11646 0.01261  0.00193  -0.00559 196 PHE A N   
735  C  CA  . PHE A 91  ? 0.07570 0.11200 0.11868 -0.00232 -0.00237 0.00331  196 PHE A CA  
736  C  C   . PHE A 91  ? 0.08939 0.11406 0.12406 -0.01113 0.00802  0.00699  196 PHE A C   
737  O  O   . PHE A 91  ? 0.10422 0.12095 0.13760 -0.02754 -0.00437 0.01237  196 PHE A O   
738  C  CB  . PHE A 91  ? 0.08661 0.12789 0.12377 0.00627  -0.00076 0.02399  196 PHE A CB  
739  C  CG  . PHE A 91  ? 0.10643 0.14940 0.13211 0.00069  -0.00403 0.04049  196 PHE A CG  
740  C  CD1 . PHE A 91  ? 0.11885 0.16153 0.13179 0.00515  -0.00118 0.06338  196 PHE A CD1 
741  C  CD2 . PHE A 91  ? 0.12674 0.15822 0.13553 -0.00506 -0.00322 0.02982  196 PHE A CD2 
742  C  CE1 . PHE A 91  ? 0.12185 0.18032 0.13352 -0.00050 -0.00643 0.06045  196 PHE A CE1 
743  C  CE2 . PHE A 91  ? 0.13241 0.17737 0.13838 -0.01189 -0.00151 0.03606  196 PHE A CE2 
744  C  CZ  . PHE A 91  ? 0.13504 0.18794 0.13763 -0.01707 -0.00670 0.04960  196 PHE A CZ  
745  N  N   . GLY A 92  ? 0.08724 0.08803 0.11781 -0.00294 0.01461  -0.00721 197 GLY A N   
746  C  CA  . GLY A 92  ? 0.07860 0.09467 0.10966 0.00909  0.01374  -0.01076 197 GLY A CA  
747  C  C   . GLY A 92  ? 0.06691 0.08873 0.10162 0.02021  0.01672  -0.00562 197 GLY A C   
748  O  O   . GLY A 92  ? 0.07041 0.08847 0.10009 0.03228  0.01719  0.00231  197 GLY A O   
749  N  N   . VAL A 93  ? 0.06943 0.09922 0.09043 0.02090  0.02346  -0.00979 198 VAL A N   
750  C  CA  . VAL A 93  ? 0.08702 0.10535 0.09057 0.02015  0.01218  -0.00173 198 VAL A CA  
751  C  C   . VAL A 93  ? 0.09808 0.09791 0.10038 0.00499  0.00806  -0.00642 198 VAL A C   
752  O  O   . VAL A 93  ? 0.08949 0.09777 0.10420 -0.00582 0.01442  -0.00777 198 VAL A O   
753  C  CB  . VAL A 93  ? 0.09804 0.11486 0.08927 0.00317  0.01371  0.00303  198 VAL A CB  
754  C  CG1 . VAL A 93  ? 0.10126 0.12266 0.09954 0.02578  0.02049  -0.00589 198 VAL A CG1 
755  C  CG2 . VAL A 93  ? 0.11324 0.11749 0.08101 -0.01234 0.00239  0.01161  198 VAL A CG2 
756  N  N   . LYS A 94  ? 0.09703 0.09519 0.09995 0.00923  0.00712  -0.01673 199 LYS A N   
757  C  CA  . LYS A 94  ? 0.08709 0.09656 0.09487 0.00800  -0.01575 -0.02530 199 LYS A CA  
758  C  C   . LYS A 94  ? 0.09755 0.10822 0.09088 0.00094  -0.01185 -0.01786 199 LYS A C   
759  O  O   . LYS A 94  ? 0.11682 0.10788 0.09974 -0.00337 -0.01093 -0.00859 199 LYS A O   
760  C  CB  . LYS A 94  ? 0.07918 0.08523 0.09091 -0.00307 -0.03783 -0.02649 199 LYS A CB  
761  C  CG  . LYS A 94  ? 0.08089 0.09004 0.08774 -0.00823 -0.04599 -0.01663 199 LYS A CG  
762  C  CD  . LYS A 94  ? 0.09855 0.08840 0.08770 -0.01066 -0.04748 -0.02110 199 LYS A CD  
763  C  CE  . LYS A 94  ? 0.12247 0.06431 0.09621 0.00940  -0.05764 -0.02181 199 LYS A CE  
764  N  NZ  . LYS A 94  ? 0.13765 0.05585 0.10120 0.00681  -0.05678 -0.01870 199 LYS A NZ  
765  N  N   . VAL A 95  ? 0.08104 0.11623 0.07929 -0.01459 -0.01555 -0.00805 200 VAL A N   
766  C  CA  . VAL A 95  ? 0.08215 0.09715 0.07101 0.00265  -0.00723 -0.00119 200 VAL A CA  
767  C  C   . VAL A 95  ? 0.08581 0.08245 0.06887 0.00137  -0.00996 0.00485  200 VAL A C   
768  O  O   . VAL A 95  ? 0.08308 0.07108 0.06852 -0.01321 -0.01478 0.01000  200 VAL A O   
769  C  CB  . VAL A 95  ? 0.10369 0.09372 0.07061 0.02490  -0.00067 -0.01304 200 VAL A CB  
770  C  CG1 . VAL A 95  ? 0.12317 0.09125 0.07056 0.03150  0.00503  0.00187  200 VAL A CG1 
771  C  CG2 . VAL A 95  ? 0.10800 0.08496 0.06884 0.03789  -0.01330 -0.02700 200 VAL A CG2 
772  N  N   . LEU A 96  ? 0.10816 0.08805 0.07366 0.00418  -0.01409 -0.01421 201 LEU A N   
773  C  CA  . LEU A 96  ? 0.10767 0.08886 0.07380 0.00035  -0.01223 -0.02400 201 LEU A CA  
774  C  C   . LEU A 96  ? 0.09877 0.09306 0.07781 -0.01178 -0.01221 -0.02700 201 LEU A C   
775  O  O   . LEU A 96  ? 0.10247 0.08109 0.08054 -0.01185 -0.01365 -0.02760 201 LEU A O   
776  C  CB  . LEU A 96  ? 0.11071 0.09768 0.07638 -0.00928 -0.01066 -0.02111 201 LEU A CB  
777  C  CG  . LEU A 96  ? 0.11488 0.11382 0.08283 -0.01834 -0.00320 -0.01201 201 LEU A CG  
778  C  CD1 . LEU A 96  ? 0.11901 0.12220 0.08314 -0.01316 -0.00636 -0.01376 201 LEU A CD1 
779  C  CD2 . LEU A 96  ? 0.12385 0.12849 0.08841 -0.02720 0.01092  0.00712  201 LEU A CD2 
780  N  N   . ASP A 97  ? 0.11412 0.10034 0.08303 -0.01621 -0.02177 -0.02577 202 ASP A N   
781  C  CA  . ASP A 97  ? 0.11442 0.11244 0.08465 -0.01504 -0.02720 -0.03264 202 ASP A CA  
782  C  C   . ASP A 97  ? 0.11528 0.10750 0.10016 -0.02468 -0.02838 -0.01100 202 ASP A C   
783  O  O   . ASP A 97  ? 0.10686 0.09403 0.09862 -0.02492 -0.02575 0.00584  202 ASP A O   
784  C  CB  . ASP A 97  ? 0.13997 0.13316 0.08860 -0.00325 -0.00876 -0.03210 202 ASP A CB  
785  C  CG  . ASP A 97  ? 0.15466 0.14797 0.08645 -0.01015 -0.01150 -0.02821 202 ASP A CG  
786  O  OD1 . ASP A 97  ? 0.14519 0.13894 0.08983 -0.02999 -0.03118 -0.02192 202 ASP A OD1 
787  O  OD2 . ASP A 97  ? 0.17568 0.16890 0.08150 -0.00329 0.01100  -0.00757 202 ASP A OD2 
788  N  N   . ASP A 98  ? 0.11655 0.12044 0.10815 -0.01687 -0.04052 -0.00935 203 ASP A N   
789  C  CA  . ASP A 98  ? 0.12666 0.11084 0.12390 -0.03024 -0.04173 -0.01232 203 ASP A CA  
790  C  C   . ASP A 98  ? 0.14466 0.11326 0.13931 -0.03168 -0.04680 -0.01366 203 ASP A C   
791  O  O   . ASP A 98  ? 0.13844 0.11465 0.14710 -0.03149 -0.04526 -0.02363 203 ASP A O   
792  C  CB  . ASP A 98  ? 0.12569 0.10770 0.12115 -0.03691 -0.02802 -0.00484 203 ASP A CB  
793  C  CG  . ASP A 98  ? 0.12109 0.10848 0.11947 -0.02982 -0.02242 -0.00851 203 ASP A CG  
794  O  OD1 . ASP A 98  ? 0.11753 0.11111 0.12050 -0.00673 -0.02417 -0.01094 203 ASP A OD1 
795  O  OD2 . ASP A 98  ? 0.13433 0.13025 0.12247 -0.04758 -0.01676 -0.00947 203 ASP A OD2 
796  N  N   . ASN A 99  ? 0.17684 0.12396 0.14734 -0.03696 -0.03839 -0.00590 204 ASN A N   
797  C  CA  . ASN A 99  ? 0.19975 0.12889 0.15455 -0.02957 -0.03974 -0.01164 204 ASN A CA  
798  C  C   . ASN A 99  ? 0.18654 0.10890 0.15520 -0.03248 -0.03235 -0.00338 204 ASN A C   
799  O  O   . ASN A 99  ? 0.19471 0.11135 0.15638 -0.03445 -0.03353 0.00064  204 ASN A O   
800  C  CB  . ASN A 99  ? 0.22973 0.18232 0.16053 -0.01943 -0.03238 -0.00865 204 ASN A CB  
801  C  CG  . ASN A 99  ? 0.26410 0.22102 0.16242 -0.00723 -0.03261 -0.01557 204 ASN A CG  
802  O  OD1 . ASN A 99  ? 0.28175 0.22988 0.15371 -0.00323 -0.03502 -0.01309 204 ASN A OD1 
803  N  ND2 . ASN A 99  ? 0.27577 0.23370 0.17024 -0.00007 -0.03324 -0.02460 204 ASN A ND2 
804  N  N   . GLY A 100 ? 0.16748 0.10494 0.15846 -0.03187 -0.01949 -0.00099 205 GLY A N   
805  C  CA  . GLY A 100 ? 0.16482 0.10167 0.16376 -0.02499 -0.01343 0.00870  205 GLY A CA  
806  C  C   . GLY A 100 ? 0.17209 0.11953 0.17194 -0.02126 -0.00677 0.01082  205 GLY A C   
807  O  O   . GLY A 100 ? 0.18650 0.13183 0.16516 -0.03154 -0.01940 0.01137  205 GLY A O   
808  N  N   . SER A 101 ? 0.16823 0.14713 0.18701 -0.00512 0.00130  0.00822  206 SER A N   
809  C  CA  . SER A 101 ? 0.16621 0.17848 0.19882 0.00474  0.01160  0.00694  206 SER A CA  
810  C  C   . SER A 101 ? 0.14231 0.18081 0.20422 0.01637  0.00402  0.00301  206 SER A C   
811  O  O   . SER A 101 ? 0.13905 0.18663 0.20363 0.01979  0.00198  0.01198  206 SER A O   
812  C  CB  . SER A 101 ? 0.18055 0.20863 0.20286 0.01390  0.01185  0.00680  206 SER A CB  
813  O  OG  . SER A 101 ? 0.18132 0.22878 0.20343 0.02200  0.02075  0.00230  206 SER A OG  
814  N  N   . GLY A 102 ? 0.14477 0.18125 0.20696 0.02060  0.01085  -0.00699 207 GLY A N   
815  C  CA  . GLY A 102 ? 0.14112 0.18119 0.21295 0.01698  0.01041  -0.01305 207 GLY A CA  
816  C  C   . GLY A 102 ? 0.15813 0.18195 0.23101 0.00270  0.00305  -0.01538 207 GLY A C   
817  O  O   . GLY A 102 ? 0.16524 0.17695 0.23408 0.01032  0.01313  -0.00062 207 GLY A O   
818  N  N   A GLN A 103 ? 0.17622 0.18985 0.24475 0.00103  -0.00219 -0.01909 208 GLN A N   
819  N  N   B GLN A 103 ? 0.17651 0.18985 0.24462 0.00119  -0.00007 -0.01620 208 GLN A N   
820  C  CA  A GLN A 103 ? 0.18398 0.19317 0.25778 -0.00139 -0.00871 -0.02267 208 GLN A CA  
821  C  CA  B GLN A 103 ? 0.18411 0.19550 0.25764 -0.00087 -0.00572 -0.01695 208 GLN A CA  
822  C  C   A GLN A 103 ? 0.17339 0.17230 0.23681 -0.00770 -0.00597 -0.02032 208 GLN A C   
823  C  C   B GLN A 103 ? 0.17344 0.17299 0.23653 -0.00780 -0.00411 -0.01781 208 GLN A C   
824  O  O   A GLN A 103 ? 0.17684 0.17771 0.23253 -0.01435 -0.00768 -0.02162 208 GLN A O   
825  O  O   B GLN A 103 ? 0.17646 0.17822 0.23232 -0.01485 -0.00575 -0.01939 208 GLN A O   
826  C  CB  A GLN A 103 ? 0.20954 0.22144 0.28653 0.00347  -0.01140 -0.03229 208 GLN A CB  
827  C  CB  B GLN A 103 ? 0.20950 0.22868 0.28627 0.00377  -0.00612 -0.02073 208 GLN A CB  
828  C  CG  A GLN A 103 ? 0.25926 0.26146 0.29935 0.00418  -0.01388 -0.03745 208 GLN A CG  
829  C  CG  B GLN A 103 ? 0.26061 0.26454 0.29897 0.00267  -0.00879 -0.01898 208 GLN A CG  
830  C  CD  A GLN A 103 ? 0.29341 0.29452 0.31832 0.00445  -0.01587 -0.04060 208 GLN A CD  
831  C  CD  B GLN A 103 ? 0.29393 0.29713 0.31950 0.00249  -0.00879 -0.01753 208 GLN A CD  
832  O  OE1 A GLN A 103 ? 0.33478 0.33478 0.33478 0.00226  -0.01781 -0.04093 208 GLN A OE1 
833  O  OE1 B GLN A 103 ? 0.33478 0.33478 0.33478 0.00078  -0.00666 -0.01818 208 GLN A OE1 
834  N  NE2 A GLN A 103 ? 0.31565 0.31565 0.31565 0.00887  -0.01796 -0.04270 208 GLN A NE2 
835  N  NE2 B GLN A 103 ? 0.31565 0.31565 0.31565 0.00535  -0.00898 -0.01621 208 GLN A NE2 
836  N  N   . TYR A 104 ? 0.15749 0.15472 0.22262 -0.00702 -0.00603 -0.01043 209 TYR A N   
837  C  CA  . TYR A 104 ? 0.12518 0.12766 0.19726 -0.00448 0.00857  0.00415  209 TYR A CA  
838  C  C   . TYR A 104 ? 0.11822 0.11165 0.18698 0.00721  0.01191  -0.00608 209 TYR A C   
839  O  O   . TYR A 104 ? 0.11653 0.09230 0.18561 0.01748  0.00763  -0.00295 209 TYR A O   
840  C  CB  . TYR A 104 ? 0.11091 0.13014 0.19689 -0.00430 0.00471  0.01449  209 TYR A CB  
841  C  CG  . TYR A 104 ? 0.13647 0.14594 0.20192 0.01045  0.00875  0.02090  209 TYR A CG  
842  C  CD1 . TYR A 104 ? 0.15119 0.15442 0.20652 0.01229  0.01412  0.02704  209 TYR A CD1 
843  C  CD2 . TYR A 104 ? 0.14789 0.13361 0.20927 0.00918  0.00935  0.02684  209 TYR A CD2 
844  C  CE1 . TYR A 104 ? 0.15351 0.16511 0.20581 0.01665  0.02030  0.03330  209 TYR A CE1 
845  C  CE2 . TYR A 104 ? 0.15401 0.14841 0.20967 0.02154  0.01085  0.03231  209 TYR A CE2 
846  C  CZ  . TYR A 104 ? 0.15517 0.15706 0.21089 0.02222  0.01810  0.03443  209 TYR A CZ  
847  O  OH  . TYR A 104 ? 0.14812 0.16892 0.21108 0.03744  0.02272  0.02711  209 TYR A OH  
848  N  N   . SER A 105 ? 0.11284 0.11840 0.17792 0.01044  0.02984  -0.01363 210 SER A N   
849  C  CA  . SER A 105 ? 0.12194 0.12119 0.16622 0.00776  0.04181  -0.02410 210 SER A CA  
850  C  C   . SER A 105 ? 0.11024 0.12026 0.15545 0.00063  0.03552  -0.02192 210 SER A C   
851  O  O   . SER A 105 ? 0.10300 0.12906 0.14627 0.01026  0.02668  -0.01935 210 SER A O   
852  C  CB  . SER A 105 ? 0.12786 0.13148 0.17183 0.02319  0.03693  -0.04259 210 SER A CB  
853  O  OG  . SER A 105 ? 0.14590 0.14901 0.17480 0.01463  0.03199  -0.05203 210 SER A OG  
854  N  N   . THR A 106 ? 0.11026 0.10828 0.15056 -0.00956 0.03715  -0.02878 211 THR A N   
855  C  CA  . THR A 106 ? 0.10463 0.09723 0.14281 -0.01278 0.02244  -0.02564 211 THR A CA  
856  C  C   . THR A 106 ? 0.10258 0.08487 0.13561 0.00926  0.01161  -0.01748 211 THR A C   
857  O  O   . THR A 106 ? 0.10224 0.08501 0.13185 -0.00076 0.01959  -0.01282 211 THR A O   
858  C  CB  . THR A 106 ? 0.11125 0.11156 0.14231 -0.02115 0.01793  -0.02844 211 THR A CB  
859  O  OG1 . THR A 106 ? 0.14054 0.14415 0.13954 -0.01025 0.03720  -0.03401 211 THR A OG1 
860  C  CG2 . THR A 106 ? 0.10263 0.11370 0.14671 -0.02408 -0.00116 -0.02970 211 THR A CG2 
861  N  N   . ILE A 107 ? 0.08563 0.06567 0.12852 0.01883  -0.00463 -0.01647 212 ILE A N   
862  C  CA  . ILE A 107 ? 0.10111 0.06612 0.12678 0.02740  -0.02443 -0.01400 212 ILE A CA  
863  C  C   . ILE A 107 ? 0.09989 0.07061 0.13005 0.02182  -0.02097 -0.01978 212 ILE A C   
864  O  O   . ILE A 107 ? 0.09657 0.08234 0.12917 0.01757  -0.03355 -0.02062 212 ILE A O   
865  C  CB  . ILE A 107 ? 0.11209 0.06496 0.12039 0.03359  -0.03732 -0.02600 212 ILE A CB  
866  C  CG1 . ILE A 107 ? 0.11642 0.08101 0.11883 0.02742  -0.05251 -0.03320 212 ILE A CG1 
867  C  CG2 . ILE A 107 ? 0.13842 0.08213 0.12266 0.02257  -0.03402 -0.02544 212 ILE A CG2 
868  C  CD1 . ILE A 107 ? 0.11730 0.09535 0.12373 0.02486  -0.05269 -0.02702 212 ILE A CD1 
869  N  N   . ILE A 108 ? 0.09376 0.05757 0.13027 0.02135  -0.01320 -0.01330 213 ILE A N   
870  C  CA  . ILE A 108 ? 0.08032 0.06729 0.13306 0.00054  -0.00287 0.00491  213 ILE A CA  
871  C  C   . ILE A 108 ? 0.07924 0.06893 0.12994 -0.00412 0.00360  0.00102  213 ILE A C   
872  O  O   . ILE A 108 ? 0.08076 0.07062 0.12899 -0.00356 0.00658  0.00001  213 ILE A O   
873  C  CB  . ILE A 108 ? 0.05789 0.06857 0.13567 -0.00783 -0.00821 0.01515  213 ILE A CB  
874  C  CG1 . ILE A 108 ? 0.07594 0.08351 0.13496 -0.01580 0.00099  0.01508  213 ILE A CG1 
875  C  CG2 . ILE A 108 ? 0.07292 0.08510 0.14702 0.01108  -0.01918 0.01845  213 ILE A CG2 
876  C  CD1 . ILE A 108 ? 0.07429 0.09917 0.13158 -0.02862 0.00758  0.01247  213 ILE A CD1 
877  N  N   . ALA A 109 ? 0.09129 0.04748 0.12623 -0.00107 0.01140  -0.00017 214 ALA A N   
878  C  CA  . ALA A 109 ? 0.10635 0.05189 0.11891 -0.00869 0.00551  -0.00283 214 ALA A CA  
879  C  C   . ALA A 109 ? 0.10481 0.06865 0.10734 0.01397  0.01097  0.00069  214 ALA A C   
880  O  O   . ALA A 109 ? 0.11121 0.07351 0.10466 0.01578  0.03377  -0.00333 214 ALA A O   
881  C  CB  . ALA A 109 ? 0.12633 0.04145 0.12535 -0.02031 -0.00799 -0.00254 214 ALA A CB  
882  N  N   . GLY A 110 ? 0.09136 0.08010 0.10469 0.00859  -0.00687 -0.00500 215 GLY A N   
883  C  CA  . GLY A 110 ? 0.09409 0.09206 0.10050 0.00363  -0.01206 -0.00406 215 GLY A CA  
884  C  C   . GLY A 110 ? 0.09910 0.10096 0.10343 0.00705  -0.01859 0.00657  215 GLY A C   
885  O  O   . GLY A 110 ? 0.11224 0.11709 0.10474 0.00650  -0.02734 0.01534  215 GLY A O   
886  N  N   . MET A 111 ? 0.10045 0.07890 0.10676 0.01303  -0.02273 0.01167  216 MET A N   
887  C  CA  . MET A 111 ? 0.10545 0.07170 0.10951 0.01096  -0.01187 0.01714  216 MET A CA  
888  C  C   . MET A 111 ? 0.10088 0.07328 0.10818 0.02317  0.00601  0.01788  216 MET A C   
889  O  O   . MET A 111 ? 0.11260 0.08984 0.11117 0.01402  0.01232  0.02468  216 MET A O   
890  C  CB  . MET A 111 ? 0.11443 0.07481 0.11791 0.01294  -0.00861 0.01913  216 MET A CB  
891  C  CG  . MET A 111 ? 0.11261 0.07633 0.13012 0.00030  -0.00600 0.02134  216 MET A CG  
892  S  SD  . MET A 111 ? 0.11725 0.09569 0.14798 -0.00112 -0.01021 0.02106  216 MET A SD  
893  C  CE  . MET A 111 ? 0.13886 0.10766 0.15174 -0.00108 -0.00669 0.02053  216 MET A CE  
894  N  N   . ASP A 112 ? 0.09714 0.09063 0.10797 0.02096  0.01557  0.00873  217 ASP A N   
895  C  CA  . ASP A 112 ? 0.11107 0.10343 0.10381 0.03009  0.02603  0.01004  217 ASP A CA  
896  C  C   . ASP A 112 ? 0.09543 0.10134 0.10788 0.01353  0.01087  0.00887  217 ASP A C   
897  O  O   . ASP A 112 ? 0.09644 0.10317 0.10542 0.00369  0.01447  -0.00035 217 ASP A O   
898  C  CB  . ASP A 112 ? 0.14360 0.13548 0.10573 0.02896  0.05438  0.02385  217 ASP A CB  
899  C  CG  . ASP A 112 ? 0.15602 0.16929 0.11747 0.03101  0.05204  0.03570  217 ASP A CG  
900  O  OD1 . ASP A 112 ? 0.14723 0.17689 0.13129 -0.00020 0.05254  0.04290  217 ASP A OD1 
901  O  OD2 . ASP A 112 ? 0.16619 0.19595 0.10660 0.04115  0.05615  0.05148  217 ASP A OD2 
902  N  N   . PHE A 113 ? 0.09042 0.09766 0.11386 0.00229  -0.00486 0.00199  218 PHE A N   
903  C  CA  . PHE A 113 ? 0.08776 0.11900 0.11414 -0.00213 -0.00065 0.01038  218 PHE A CA  
904  C  C   . PHE A 113 ? 0.08259 0.11684 0.10199 -0.00263 0.00061  0.00589  218 PHE A C   
905  O  O   . PHE A 113 ? 0.08384 0.10436 0.09513 -0.01583 0.00863  0.00945  218 PHE A O   
906  C  CB  . PHE A 113 ? 0.08110 0.14795 0.13119 -0.02932 -0.00295 0.02205  218 PHE A CB  
907  C  CG  . PHE A 113 ? 0.07647 0.17953 0.14553 -0.04275 -0.00463 0.03790  218 PHE A CG  
908  C  CD1 . PHE A 113 ? 0.09451 0.20473 0.15035 -0.04058 -0.00795 0.05489  218 PHE A CD1 
909  C  CD2 . PHE A 113 ? 0.08928 0.20670 0.15278 -0.04273 -0.01534 0.03841  218 PHE A CD2 
910  C  CE1 . PHE A 113 ? 0.09804 0.22350 0.15574 -0.03321 -0.00703 0.06382  218 PHE A CE1 
911  C  CE2 . PHE A 113 ? 0.10831 0.22623 0.15616 -0.03651 -0.01268 0.05027  218 PHE A CE2 
912  C  CZ  . PHE A 113 ? 0.10767 0.23246 0.15650 -0.03460 -0.00756 0.05966  218 PHE A CZ  
913  N  N   . VAL A 114 ? 0.08721 0.11978 0.09808 0.00782  -0.01165 0.00016  219 VAL A N   
914  C  CA  . VAL A 114 ? 0.09809 0.11449 0.08942 0.02069  0.00129  0.00464  219 VAL A CA  
915  C  C   . VAL A 114 ? 0.08210 0.10653 0.08595 0.01638  0.00446  0.00470  219 VAL A C   
916  O  O   . VAL A 114 ? 0.09070 0.09004 0.07400 0.01007  -0.00150 -0.01516 219 VAL A O   
917  C  CB  . VAL A 114 ? 0.11582 0.12671 0.08352 0.00624  0.00706  0.00066  219 VAL A CB  
918  C  CG1 . VAL A 114 ? 0.11809 0.13020 0.08276 -0.01833 0.01740  -0.00536 219 VAL A CG1 
919  C  CG2 . VAL A 114 ? 0.10288 0.12635 0.07887 0.02985  0.00254  0.00299  219 VAL A CG2 
920  N  N   . ALA A 115 ? 0.07692 0.11054 0.09332 0.02799  -0.00247 0.00648  220 ALA A N   
921  C  CA  . ALA A 115 ? 0.06511 0.11785 0.09099 0.00981  -0.00195 0.00740  220 ALA A CA  
922  C  C   . ALA A 115 ? 0.08871 0.11972 0.09134 0.01014  -0.01017 0.00842  220 ALA A C   
923  O  O   . ALA A 115 ? 0.10598 0.13329 0.08976 0.01532  -0.00804 0.00707  220 ALA A O   
924  C  CB  . ALA A 115 ? 0.04268 0.12499 0.08935 -0.01555 0.00304  0.00993  220 ALA A CB  
925  N  N   . SER A 116 ? 0.09364 0.12000 0.09733 0.00046  -0.00422 0.00536  221 SER A N   
926  C  CA  . SER A 116 ? 0.08506 0.12138 0.10663 0.02345  0.00634  0.00805  221 SER A CA  
927  C  C   . SER A 116 ? 0.07639 0.12400 0.10742 0.02551  0.00615  0.00792  221 SER A C   
928  O  O   . SER A 116 ? 0.08125 0.12158 0.10988 0.03779  0.01247  0.01249  221 SER A O   
929  C  CB  . SER A 116 ? 0.09774 0.11284 0.11528 0.02811  0.02403  0.00024  221 SER A CB  
930  O  OG  . SER A 116 ? 0.09695 0.09922 0.11617 0.05129  0.02896  -0.00365 221 SER A OG  
931  N  N   . ASP A 117 ? 0.05901 0.12273 0.10849 0.02891  -0.00174 0.00660  222 ASP A N   
932  C  CA  . ASP A 117 ? 0.06807 0.12272 0.11593 0.02678  -0.00691 0.01257  222 ASP A CA  
933  C  C   . ASP A 117 ? 0.08941 0.13776 0.13488 0.01684  -0.00828 0.01389  222 ASP A C   
934  O  O   . ASP A 117 ? 0.10559 0.13583 0.13531 0.01657  -0.00451 0.03305  222 ASP A O   
935  C  CB  . ASP A 117 ? 0.06304 0.12151 0.11362 0.01451  -0.02070 0.00983  222 ASP A CB  
936  C  CG  . ASP A 117 ? 0.08628 0.13174 0.11460 -0.00767 -0.00866 0.00338  222 ASP A CG  
937  O  OD1 . ASP A 117 ? 0.11105 0.14433 0.11302 -0.01291 -0.00243 -0.00601 222 ASP A OD1 
938  O  OD2 . ASP A 117 ? 0.08403 0.13121 0.11810 -0.02714 -0.00287 0.00869  222 ASP A OD2 
939  N  N   . LYS A 118 ? 0.08412 0.14169 0.14781 0.03089  -0.01129 0.01128  223 LYS A N   
940  C  CA  . LYS A 118 ? 0.10551 0.17512 0.16904 0.03139  -0.00980 0.00854  223 LYS A CA  
941  C  C   . LYS A 118 ? 0.13089 0.20922 0.17658 0.06936  -0.00899 0.00634  223 LYS A C   
942  O  O   . LYS A 118 ? 0.13550 0.21631 0.18138 0.07086  -0.00551 0.00231  223 LYS A O   
943  C  CB  . LYS A 118 ? 0.10491 0.19467 0.17787 -0.00765 -0.00725 -0.00263 223 LYS A CB  
944  C  CG  . LYS A 118 ? 0.11405 0.21839 0.18615 -0.02693 -0.00177 -0.00591 223 LYS A CG  
945  C  CD  . LYS A 118 ? 0.12305 0.21834 0.18967 -0.04437 0.00159  -0.00793 223 LYS A CD  
946  C  CE  . LYS A 118 ? 0.10878 0.21671 0.19004 -0.04969 0.01698  -0.00960 223 LYS A CE  
947  N  NZ  . LYS A 118 ? 0.12134 0.23107 0.19292 -0.04800 0.01282  -0.01357 223 LYS A NZ  
948  N  N   . ASN A 119 ? 0.16267 0.23064 0.18654 0.10426  -0.01348 0.01048  224 ASN A N   
949  C  CA  . ASN A 119 ? 0.21231 0.25759 0.19839 0.12430  -0.00840 0.01040  224 ASN A CA  
950  C  C   . ASN A 119 ? 0.23526 0.26552 0.20207 0.11988  0.00996  0.01916  224 ASN A C   
951  O  O   . ASN A 119 ? 0.24853 0.28011 0.20218 0.12204  0.00960  0.01614  224 ASN A O   
952  C  CB  . ASN A 119 ? 0.22605 0.26727 0.19147 0.13971  -0.02238 -0.00160 224 ASN A CB  
953  C  CG  . ASN A 119 ? 0.23094 0.28260 0.19184 0.14564  -0.04270 -0.01654 224 ASN A CG  
954  O  OD1 . ASN A 119 ? 0.23278 0.30306 0.18735 0.14207  -0.05984 -0.02433 224 ASN A OD1 
955  N  ND2 . ASN A 119 ? 0.22554 0.27157 0.18732 0.14024  -0.04419 -0.01550 224 ASN A ND2 
956  N  N   . ASN A 120 ? 0.24455 0.26245 0.21327 0.09629  0.03052  0.02231  225 ASN A N   
957  C  CA  . ASN A 120 ? 0.27048 0.26142 0.22517 0.06151  0.03955  0.03502  225 ASN A CA  
958  C  C   . ASN A 120 ? 0.24823 0.23953 0.21157 0.04210  0.04443  0.03775  225 ASN A C   
959  O  O   . ASN A 120 ? 0.25285 0.24725 0.21801 0.03077  0.03900  0.03094  225 ASN A O   
960  C  CB  . ASN A 120 ? 0.30400 0.28347 0.23339 0.04564  0.04406  0.04162  225 ASN A CB  
961  C  CG  . ASN A 120 ? 0.34543 0.30913 0.24461 0.02981  0.04302  0.04283  225 ASN A CG  
962  O  OD1 . ASN A 120 ? 0.36156 0.32258 0.25053 0.02779  0.04295  0.04634  225 ASN A OD1 
963  N  ND2 . ASN A 120 ? 0.36042 0.31366 0.24592 0.01990  0.04761  0.03106  225 ASN A ND2 
964  N  N   . ARG A 121 ? 0.22337 0.21941 0.21006 0.04156  0.04371  0.04047  226 ARG A N   
965  C  CA  . ARG A 121 ? 0.20477 0.21893 0.20538 0.01824  0.03950  0.04347  226 ARG A CA  
966  C  C   . ARG A 121 ? 0.19941 0.21305 0.19355 0.00720  0.05222  0.03806  226 ARG A C   
967  O  O   . ARG A 121 ? 0.20681 0.21816 0.19498 0.01990  0.05311  0.03675  226 ARG A O   
968  C  CB  . ARG A 121 ? 0.18940 0.22276 0.21459 0.01734  0.01978  0.04879  226 ARG A CB  
969  C  CG  . ARG A 121 ? 0.18371 0.22777 0.22050 0.00623  0.00965  0.04874  226 ARG A CG  
970  C  CD  . ARG A 121 ? 0.18118 0.23765 0.22283 0.00336  0.00077  0.05247  226 ARG A CD  
971  N  NE  . ARG A 121 ? 0.17373 0.23572 0.21819 -0.00491 -0.00236 0.06305  226 ARG A NE  
972  C  CZ  . ARG A 121 ? 0.17014 0.23007 0.21474 -0.01562 -0.00448 0.07396  226 ARG A CZ  
973  N  NH1 . ARG A 121 ? 0.16592 0.23226 0.21842 -0.02675 -0.00670 0.07426  226 ARG A NH1 
974  N  NH2 . ARG A 121 ? 0.16617 0.22044 0.20766 -0.01874 -0.00568 0.08045  226 ARG A NH2 
975  N  N   A ASN A 122 ? 0.19994 0.20991 0.18680 -0.00357 0.05069  0.03763  227 ASN A N   
976  N  N   B ASN A 122 ? 0.19165 0.20656 0.18505 0.00029  0.05023  0.03458  227 ASN A N   
977  C  CA  A ASN A 122 ? 0.19793 0.20425 0.17914 -0.01551 0.04640  0.04266  227 ASN A CA  
978  C  CA  B ASN A 122 ? 0.18399 0.20175 0.17453 -0.00753 0.04702  0.03329  227 ASN A CA  
979  C  C   A ASN A 122 ? 0.17940 0.20258 0.16133 -0.01558 0.03883  0.03788  227 ASN A C   
980  C  C   B ASN A 122 ? 0.16929 0.19741 0.15927 -0.01101 0.04117  0.03563  227 ASN A C   
981  O  O   A ASN A 122 ? 0.17900 0.21276 0.16674 -0.01548 0.03496  0.03812  227 ASN A O   
982  O  O   B ASN A 122 ? 0.16266 0.20052 0.16147 -0.00833 0.04026  0.03909  227 ASN A O   
983  C  CB  A ASN A 122 ? 0.20539 0.19521 0.17712 -0.02563 0.05327  0.05215  227 ASN A CB  
984  C  CB  B ASN A 122 ? 0.18499 0.19757 0.17391 -0.00971 0.05265  0.02993  227 ASN A CB  
985  C  CG  A ASN A 122 ? 0.21108 0.18382 0.17933 -0.03493 0.05489  0.05877  227 ASN A CG  
986  C  CG  B ASN A 122 ? 0.18525 0.19241 0.17434 -0.00954 0.05424  0.02641  227 ASN A CG  
987  O  OD1 A ASN A 122 ? 0.20733 0.18128 0.17765 -0.04098 0.05736  0.05931  227 ASN A OD1 
988  O  OD1 B ASN A 122 ? 0.19202 0.19714 0.17541 -0.01161 0.05146  0.02976  227 ASN A OD1 
989  N  ND2 A ASN A 122 ? 0.21208 0.17718 0.17845 -0.03409 0.05493  0.05861  227 ASN A ND2 
990  N  ND2 B ASN A 122 ? 0.18660 0.18899 0.17267 -0.00536 0.05472  0.02248  227 ASN A ND2 
991  N  N   . CYS A 123 ? 0.16111 0.18937 0.14824 -0.01314 0.03624  0.03544  228 CYS A N   
992  C  CA  . CYS A 123 ? 0.12183 0.17644 0.11725 -0.00206 0.01749  0.02975  228 CYS A CA  
993  C  C   . CYS A 123 ? 0.09692 0.18348 0.10155 0.00163  0.00803  0.02089  228 CYS A C   
994  O  O   . CYS A 123 ? 0.08872 0.18701 0.10139 0.00555  -0.00247 0.01936  228 CYS A O   
995  C  CB  . CYS A 123 ? 0.13285 0.17450 0.09605 -0.00646 0.00392  0.02419  228 CYS A CB  
996  S  SG  . CYS A 123 ? 0.13794 0.15751 0.08627 -0.00557 0.00128  0.02643  228 CYS A SG  
997  N  N   . PRO A 124 ? 0.09099 0.20330 0.09651 0.01024  0.00044  0.01288  229 PRO A N   
998  C  CA  . PRO A 124 ? 0.10568 0.22449 0.10207 0.00044  0.00511  0.00938  229 PRO A CA  
999  C  C   . PRO A 124 ? 0.10234 0.22401 0.09558 0.00460  0.01018  0.00937  229 PRO A C   
1000 O  O   . PRO A 124 ? 0.11593 0.22803 0.09085 0.00872  0.00285  0.00805  229 PRO A O   
1001 C  CB  . PRO A 124 ? 0.11807 0.23897 0.10552 0.00604  0.01379  0.00154  229 PRO A CB  
1002 C  CG  . PRO A 124 ? 0.11975 0.23909 0.10614 0.00305  0.00935  0.00078  229 PRO A CG  
1003 C  CD  . PRO A 124 ? 0.10596 0.22080 0.09581 -0.00046 0.00403  0.00550  229 PRO A CD  
1004 N  N   . LYS A 125 ? 0.08979 0.21870 0.09730 0.00854  0.02557  0.01768  230 LYS A N   
1005 C  CA  . LYS A 125 ? 0.10031 0.22592 0.09992 0.02162  0.02509  0.01167  230 LYS A CA  
1006 C  C   . LYS A 125 ? 0.09866 0.21419 0.09710 0.03125  0.02027  0.02528  230 LYS A C   
1007 O  O   . LYS A 125 ? 0.11053 0.22470 0.10151 0.00543  0.03810  0.02651  230 LYS A O   
1008 C  CB  . LYS A 125 ? 0.10622 0.24287 0.09803 0.02551  0.01646  -0.00145 230 LYS A CB  
1009 C  CG  . LYS A 125 ? 0.11841 0.26119 0.09935 0.01512  0.00634  -0.01412 230 LYS A CG  
1010 C  CD  . LYS A 125 ? 0.13458 0.27263 0.10064 0.01220  0.01215  -0.02444 230 LYS A CD  
1011 C  CE  . LYS A 125 ? 0.15655 0.29561 0.11053 0.01150  0.01351  -0.02317 230 LYS A CE  
1012 N  NZ  . LYS A 125 ? 0.17651 0.30843 0.11204 0.02193  0.01718  -0.02212 230 LYS A NZ  
1013 N  N   . GLY A 126 ? 0.09676 0.20399 0.10327 0.02797  0.00914  0.03050  231 GLY A N   
1014 C  CA  . GLY A 126 ? 0.08342 0.19566 0.10509 0.02299  0.01001  0.03237  231 GLY A CA  
1015 C  C   . GLY A 126 ? 0.08149 0.17036 0.10889 0.01330  0.02156  0.02906  231 GLY A C   
1016 O  O   . GLY A 126 ? 0.09519 0.17235 0.11004 0.02947  0.02014  0.02536  231 GLY A O   
1017 N  N   . VAL A 127 ? 0.09563 0.15300 0.11004 -0.00524 0.01850  0.03435  232 VAL A N   
1018 C  CA  . VAL A 127 ? 0.08529 0.13568 0.10569 0.00096  0.01119  0.02307  232 VAL A CA  
1019 C  C   . VAL A 127 ? 0.07407 0.11262 0.10706 0.01989  0.00249  0.02374  232 VAL A C   
1020 O  O   . VAL A 127 ? 0.06052 0.11283 0.10850 0.03529  0.00148  0.03295  232 VAL A O   
1021 C  CB  . VAL A 127 ? 0.08171 0.14114 0.10326 0.00989  -0.00362 0.01868  232 VAL A CB  
1022 C  CG1 . VAL A 127 ? 0.08262 0.14219 0.10394 -0.00507 -0.01322 0.00838  232 VAL A CG1 
1023 C  CG2 . VAL A 127 ? 0.08973 0.15106 0.10238 0.01527  0.02223  0.02310  232 VAL A CG2 
1024 N  N   . VAL A 128 ? 0.06601 0.08158 0.10906 0.01828  0.00205  0.00698  233 VAL A N   
1025 C  CA  . VAL A 128 ? 0.08554 0.07420 0.11243 0.01193  -0.00207 0.00008  233 VAL A CA  
1026 C  C   . VAL A 128 ? 0.08398 0.07107 0.11186 0.01495  -0.00900 0.00473  233 VAL A C   
1027 O  O   . VAL A 128 ? 0.09198 0.06558 0.11522 0.03125  -0.02802 0.00482  233 VAL A O   
1028 C  CB  . VAL A 128 ? 0.07742 0.06589 0.11380 0.00574  -0.00495 -0.00645 233 VAL A CB  
1029 C  CG1 . VAL A 128 ? 0.06797 0.05538 0.11471 0.00354  -0.00585 -0.00196 233 VAL A CG1 
1030 C  CG2 . VAL A 128 ? 0.07657 0.08334 0.11751 -0.00533 -0.00800 -0.00639 233 VAL A CG2 
1031 N  N   . ALA A 129 ? 0.07785 0.08441 0.10645 0.02967  -0.00707 0.01399  234 ALA A N   
1032 C  CA  . ALA A 129 ? 0.07320 0.06626 0.10232 0.03430  -0.00291 0.01736  234 ALA A CA  
1033 C  C   . ALA A 129 ? 0.06090 0.06979 0.11403 0.01045  -0.01118 0.02335  234 ALA A C   
1034 O  O   . ALA A 129 ? 0.08338 0.08310 0.12085 -0.00242 -0.01782 0.01731  234 ALA A O   
1035 C  CB  . ALA A 129 ? 0.07236 0.06706 0.09221 0.03904  0.01647  0.01025  234 ALA A CB  
1036 N  N   . SER A 130 ? 0.06002 0.07822 0.11856 0.02094  -0.01682 0.01088  235 SER A N   
1037 C  CA  . SER A 130 ? 0.07358 0.07638 0.12505 0.02735  0.00347  0.01033  235 SER A CA  
1038 C  C   . SER A 130 ? 0.05742 0.05441 0.11926 0.01232  0.00912  0.00989  235 SER A C   
1039 O  O   . SER A 130 ? 0.05472 0.04346 0.11131 0.00768  0.00157  0.00858  235 SER A O   
1040 C  CB  . SER A 130 ? 0.07675 0.06563 0.13818 0.03365  0.00663  0.00534  235 SER A CB  
1041 O  OG  . SER A 130 ? 0.10175 0.05350 0.14497 0.03135  0.01459  0.00653  235 SER A OG  
1042 N  N   A LEU A 131 ? 0.07057 0.07254 0.11782 0.00722  0.01172  0.01701  236 LEU A N   
1043 N  N   B LEU A 131 ? 0.06602 0.06811 0.12169 0.00596  0.00316  0.00944  236 LEU A N   
1044 C  CA  A LEU A 131 ? 0.08489 0.07945 0.11754 0.01244  0.00770  0.01409  236 LEU A CA  
1045 C  CA  B LEU A 131 ? 0.07553 0.07734 0.12597 0.00397  -0.00769 0.00209  236 LEU A CA  
1046 C  C   A LEU A 131 ? 0.07992 0.08966 0.11719 0.01430  -0.00074 0.00797  236 LEU A C   
1047 C  C   B LEU A 131 ? 0.07473 0.08851 0.12204 0.00920  -0.01025 0.00066  236 LEU A C   
1048 O  O   A LEU A 131 ? 0.08471 0.09388 0.11595 0.00858  -0.00048 0.01210  236 LEU A O   
1049 O  O   B LEU A 131 ? 0.07527 0.09007 0.12192 0.00460  -0.01161 0.00183  236 LEU A O   
1050 C  CB  A LEU A 131 ? 0.09247 0.07094 0.11429 0.02586  0.01658  0.01458  236 LEU A CB  
1051 C  CB  B LEU A 131 ? 0.07903 0.07217 0.13110 0.00391  -0.01304 -0.00596 236 LEU A CB  
1052 C  CG  A LEU A 131 ? 0.09662 0.08767 0.11208 0.01724  0.02292  0.01479  236 LEU A CG  
1053 C  CG  B LEU A 131 ? 0.08237 0.08124 0.13649 -0.00959 -0.01983 -0.01321 236 LEU A CG  
1054 C  CD1 A LEU A 131 ? 0.10752 0.10504 0.11316 0.01446  0.01594  0.00754  236 LEU A CD1 
1055 C  CD1 B LEU A 131 ? 0.08461 0.09069 0.13911 -0.00860 -0.03114 -0.01809 236 LEU A CD1 
1056 C  CD2 A LEU A 131 ? 0.08460 0.09487 0.10879 0.01194  0.03511  0.01878  236 LEU A CD2 
1057 C  CD2 B LEU A 131 ? 0.08609 0.08585 0.13864 -0.02412 -0.01870 -0.01700 236 LEU A CD2 
1058 N  N   . SER A 132 ? 0.08146 0.09711 0.11740 0.01679  -0.01149 0.00134  237 SER A N   
1059 C  CA  . SER A 132 ? 0.07694 0.10838 0.11393 0.00535  -0.01629 -0.00084 237 SER A CA  
1060 C  C   . SER A 132 ? 0.08124 0.12703 0.11372 -0.01842 -0.01197 0.01272  237 SER A C   
1061 O  O   . SER A 132 ? 0.08433 0.15319 0.11330 -0.01186 -0.01875 0.00393  237 SER A O   
1062 C  CB  . SER A 132 ? 0.06726 0.09406 0.10593 0.02785  -0.00995 0.00134  237 SER A CB  
1063 O  OG  . SER A 132 ? 0.07609 0.08522 0.09841 0.02683  -0.00571 -0.00127 237 SER A OG  
1064 N  N   . LEU A 133 ? 0.09816 0.12833 0.11448 -0.00251 0.00269  0.02568  238 LEU A N   
1065 C  CA  . LEU A 133 ? 0.10481 0.14820 0.11841 -0.01002 0.01633  0.02655  238 LEU A CA  
1066 C  C   . LEU A 133 ? 0.10735 0.18497 0.10306 -0.01567 0.03061  0.02000  238 LEU A C   
1067 O  O   . LEU A 133 ? 0.11593 0.18663 0.08986 -0.00866 0.03747  0.01456  238 LEU A O   
1068 C  CB  . LEU A 133 ? 0.12980 0.14226 0.13584 -0.01924 0.01810  0.03100  238 LEU A CB  
1069 C  CG  . LEU A 133 ? 0.13005 0.14362 0.15390 -0.03844 0.02191  0.03554  238 LEU A CG  
1070 C  CD1 . LEU A 133 ? 0.13358 0.15639 0.16157 -0.03257 0.01050  0.03082  238 LEU A CD1 
1071 C  CD2 . LEU A 133 ? 0.14111 0.14810 0.15819 -0.03801 0.02740  0.02233  238 LEU A CD2 
1072 N  N   . GLY A 134 ? 0.11777 0.23416 0.11082 -0.02725 0.03648  0.01009  239 GLY A N   
1073 C  CA  . GLY A 134 ? 0.12391 0.25428 0.11583 -0.03409 0.03343  0.01763  239 GLY A CA  
1074 C  C   . GLY A 134 ? 0.10984 0.24468 0.11469 -0.02160 0.01898  0.03064  239 GLY A C   
1075 O  O   . GLY A 134 ? 0.10016 0.25442 0.11630 -0.02426 0.02022  0.03501  239 GLY A O   
1076 N  N   . GLY A 135 ? 0.09983 0.22290 0.11424 -0.01632 0.01002  0.03257  240 GLY A N   
1077 C  CA  . GLY A 135 ? 0.09470 0.20882 0.11917 -0.02677 0.00682  0.05472  240 GLY A CA  
1078 C  C   . GLY A 135 ? 0.08746 0.19227 0.12435 -0.02393 0.00578  0.06784  240 GLY A C   
1079 O  O   . GLY A 135 ? 0.06401 0.18206 0.12361 -0.00329 0.00756  0.07646  240 GLY A O   
1080 N  N   . GLY A 136 ? 0.10558 0.18466 0.13080 -0.00699 -0.00387 0.05932  241 GLY A N   
1081 C  CA  . GLY A 136 ? 0.09943 0.15685 0.13167 -0.02196 -0.01727 0.05654  241 GLY A CA  
1082 C  C   . GLY A 136 ? 0.10305 0.14295 0.13037 -0.02573 -0.01500 0.04884  241 GLY A C   
1083 O  O   . GLY A 136 ? 0.11519 0.15015 0.12713 -0.02544 -0.02178 0.05144  241 GLY A O   
1084 N  N   . TYR A 137 ? 0.09818 0.12654 0.13228 -0.01613 -0.02109 0.04602  242 TYR A N   
1085 C  CA  . TYR A 137 ? 0.11347 0.11228 0.13163 -0.00967 -0.02109 0.04777  242 TYR A CA  
1086 C  C   . TYR A 137 ? 0.12725 0.11161 0.11841 -0.00467 -0.01855 0.06083  242 TYR A C   
1087 O  O   . TYR A 137 ? 0.13693 0.12517 0.11865 0.00818  -0.02327 0.04712  242 TYR A O   
1088 C  CB  . TYR A 137 ? 0.11152 0.11943 0.14245 -0.01052 -0.01676 0.04848  242 TYR A CB  
1089 C  CG  . TYR A 137 ? 0.10941 0.11052 0.14706 -0.00473 -0.01003 0.03989  242 TYR A CG  
1090 C  CD1 . TYR A 137 ? 0.11536 0.11820 0.14120 0.00079  0.00650  0.04458  242 TYR A CD1 
1091 C  CD2 . TYR A 137 ? 0.10335 0.09981 0.14868 -0.00851 -0.00544 0.03691  242 TYR A CD2 
1092 C  CE1 . TYR A 137 ? 0.12300 0.13050 0.14536 -0.00203 0.02140  0.04532  242 TYR A CE1 
1093 C  CE2 . TYR A 137 ? 0.12089 0.11165 0.14718 -0.00846 -0.00222 0.03574  242 TYR A CE2 
1094 C  CZ  . TYR A 137 ? 0.12948 0.12924 0.14342 0.00309  0.01755  0.03899  242 TYR A CZ  
1095 O  OH  . TYR A 137 ? 0.14840 0.13804 0.14369 0.00321  0.01398  0.03320  242 TYR A OH  
1096 N  N   . SER A 138 ? 0.11460 0.08916 0.10367 -0.00280 -0.00539 0.05720  243 SER A N   
1097 C  CA  . SER A 138 ? 0.11314 0.08878 0.09700 -0.00603 0.00528  0.05490  243 SER A CA  
1098 C  C   . SER A 138 ? 0.12091 0.10811 0.10614 0.00915  0.01769  0.04822  243 SER A C   
1099 O  O   . SER A 138 ? 0.12563 0.10294 0.09401 0.01006  0.01193  0.04825  243 SER A O   
1100 C  CB  . SER A 138 ? 0.11204 0.09524 0.10104 -0.01204 0.00447  0.05375  243 SER A CB  
1101 O  OG  . SER A 138 ? 0.11878 0.11646 0.10617 -0.00685 -0.00191 0.04956  243 SER A OG  
1102 N  N   A SER A 139 ? 0.12338 0.10024 0.10283 0.02191  0.02479  0.04166  244 SER A N   
1103 N  N   B SER A 139 ? 0.11887 0.11242 0.10421 0.00960  0.02517  0.03911  244 SER A N   
1104 C  CA  A SER A 139 ? 0.11017 0.10099 0.10118 0.03142  0.03291  0.03477  244 SER A CA  
1105 C  CA  B SER A 139 ? 0.10831 0.11741 0.10486 0.01021  0.03601  0.02847  244 SER A CA  
1106 C  C   A SER A 139 ? 0.11439 0.09703 0.10273 0.02847  0.03230  0.02617  244 SER A C   
1107 C  C   B SER A 139 ? 0.10158 0.10272 0.10199 0.01808  0.03346  0.01880  244 SER A C   
1108 O  O   A SER A 139 ? 0.10681 0.09695 0.10525 0.03055  0.02853  0.02701  244 SER A O   
1109 O  O   B SER A 139 ? 0.09860 0.10387 0.10243 0.01583  0.03233  0.01884  244 SER A O   
1110 C  CB  A SER A 139 ? 0.09521 0.10882 0.09983 0.05351  0.03713  0.03977  244 SER A CB  
1111 C  CB  B SER A 139 ? 0.10541 0.13727 0.10759 0.01095  0.04750  0.02947  244 SER A CB  
1112 O  OG  A SER A 139 ? 0.09148 0.10416 0.09535 0.05347  0.02906  0.03324  244 SER A OG  
1113 O  OG  B SER A 139 ? 0.10099 0.14793 0.11048 0.01181  0.05267  0.02712  244 SER A OG  
1114 N  N   A SER A 140 ? 0.12403 0.10426 0.10165 0.02328  0.03780  0.01584  245 SER A N   
1115 N  N   B SER A 140 ? 0.09705 0.09447 0.09874 0.02998  0.03325  0.00765  245 SER A N   
1116 C  CA  A SER A 140 ? 0.13879 0.10512 0.09812 0.01718  0.02541  0.00555  245 SER A CA  
1117 C  CA  B SER A 140 ? 0.09884 0.08668 0.09385 0.03949  0.02076  -0.00375 245 SER A CA  
1118 C  C   A SER A 140 ? 0.12012 0.10518 0.09428 0.02000  0.01283  -0.00112 245 SER A C   
1119 C  C   B SER A 140 ? 0.10104 0.09289 0.09264 0.03077  0.01266  -0.00618 245 SER A C   
1120 O  O   A SER A 140 ? 0.11015 0.10745 0.09212 0.01455  0.00533  0.00766  245 SER A O   
1121 O  O   B SER A 140 ? 0.09310 0.08981 0.09197 0.02462  0.00873  -0.00067 245 SER A O   
1122 C  CB  A SER A 140 ? 0.16064 0.11287 0.09789 0.01437  0.01872  0.00233  245 SER A CB  
1123 C  CB  B SER A 140 ? 0.08691 0.07521 0.08956 0.04540  0.00962  -0.01068 245 SER A CB  
1124 O  OG  A SER A 140 ? 0.17230 0.13870 0.10269 0.00574  0.01356  0.00539  245 SER A OG  
1125 O  OG  B SER A 140 ? 0.08026 0.08105 0.08799 0.04523  0.00653  -0.01402 245 SER A OG  
1126 N  N   . VAL A 141 ? 0.10885 0.09961 0.09214 0.02245  0.01204  -0.01127 246 VAL A N   
1127 C  CA  . VAL A 141 ? 0.09823 0.08540 0.08911 -0.00097 0.00111  -0.01072 246 VAL A CA  
1128 C  C   . VAL A 141 ? 0.09834 0.07977 0.09322 -0.03350 -0.00713 -0.01219 246 VAL A C   
1129 O  O   . VAL A 141 ? 0.09418 0.06718 0.08957 -0.04140 -0.01236 -0.01427 246 VAL A O   
1130 C  CB  . VAL A 141 ? 0.09889 0.10422 0.08164 0.03397  0.01758  -0.00674 246 VAL A CB  
1131 C  CG1 . VAL A 141 ? 0.11534 0.12115 0.08586 0.04737  0.03418  -0.01199 246 VAL A CG1 
1132 C  CG2 . VAL A 141 ? 0.10652 0.10018 0.07233 0.02931  0.01673  0.00470  246 VAL A CG2 
1133 N  N   . ASN A 142 ? 0.09089 0.07904 0.10585 -0.02036 0.00541  -0.00077 247 ASN A N   
1134 C  CA  . ASN A 142 ? 0.08588 0.08400 0.12222 -0.01163 0.01682  0.01706  247 ASN A CA  
1135 C  C   . ASN A 142 ? 0.08266 0.08707 0.11738 0.00552  0.01236  0.00329  247 ASN A C   
1136 O  O   . ASN A 142 ? 0.07733 0.09771 0.12398 -0.00062 0.01923  0.00241  247 ASN A O   
1137 C  CB  . ASN A 142 ? 0.08716 0.06731 0.12006 -0.00628 0.02550  0.03181  247 ASN A CB  
1138 C  CG  . ASN A 142 ? 0.09632 0.07790 0.12303 -0.00736 0.02025  0.01995  247 ASN A CG  
1139 O  OD1 . ASN A 142 ? 0.10817 0.07840 0.12666 -0.02596 0.01940  0.00742  247 ASN A OD1 
1140 N  ND2 . ASN A 142 ? 0.10488 0.09266 0.12059 -0.01263 0.02455  0.02033  247 ASN A ND2 
1141 N  N   A SER A 143 ? 0.08667 0.09454 0.11953 0.01340  0.01289  0.00339  248 SER A N   
1142 N  N   B SER A 143 ? 0.08688 0.08405 0.12162 0.00997  0.01337  -0.00006 248 SER A N   
1143 C  CA  A SER A 143 ? 0.10204 0.08954 0.11151 0.00473  0.02151  0.00853  248 SER A CA  
1144 C  CA  B SER A 143 ? 0.09547 0.07535 0.11881 0.00821  0.02076  -0.00074 248 SER A CA  
1145 C  C   A SER A 143 ? 0.08990 0.06587 0.11047 -0.00066 0.01818  0.01579  248 SER A C   
1146 C  C   B SER A 143 ? 0.08463 0.06031 0.11600 0.00543  0.01920  0.00515  248 SER A C   
1147 O  O   A SER A 143 ? 0.11579 0.05745 0.11231 0.00136  0.01514  0.02384  248 SER A O   
1148 O  O   B SER A 143 ? 0.10073 0.05607 0.11716 0.00484  0.01957  0.00723  248 SER A O   
1149 C  CB  A SER A 143 ? 0.11661 0.09435 0.11314 0.01488  0.02703  0.00936  248 SER A CB  
1150 C  CB  B SER A 143 ? 0.10848 0.07460 0.12424 0.01548  0.02722  -0.00585 248 SER A CB  
1151 O  OG  A SER A 143 ? 0.12997 0.09504 0.10773 0.01149  0.03122  0.01762  248 SER A OG  
1152 O  OG  B SER A 143 ? 0.11916 0.07025 0.12481 0.01466  0.03267  -0.00704 248 SER A OG  
1153 N  N   . ALA A 144 ? 0.06787 0.04821 0.10799 0.01531  0.01653  0.00096  249 ALA A N   
1154 C  CA  . ALA A 144 ? 0.07711 0.05230 0.10368 0.01960  0.00379  -0.00240 249 ALA A CA  
1155 C  C   . ALA A 144 ? 0.07836 0.05745 0.10674 -0.00655 0.00179  -0.00827 249 ALA A C   
1156 O  O   . ALA A 144 ? 0.08059 0.05926 0.11382 -0.03026 0.00895  0.00380  249 ALA A O   
1157 C  CB  . ALA A 144 ? 0.09445 0.04492 0.10557 0.01010  -0.00357 -0.00609 249 ALA A CB  
1158 N  N   . ALA A 145 ? 0.07593 0.07540 0.10870 0.00476  -0.00454 -0.01336 250 ALA A N   
1159 C  CA  . ALA A 145 ? 0.07641 0.07286 0.11052 0.01833  -0.00261 -0.01154 250 ALA A CA  
1160 C  C   . ALA A 145 ? 0.06571 0.07957 0.10663 0.00460  0.00345  -0.00702 250 ALA A C   
1161 O  O   . ALA A 145 ? 0.06698 0.08827 0.11190 0.01767  0.00607  -0.00088 250 ALA A O   
1162 C  CB  . ALA A 145 ? 0.08606 0.07716 0.11592 0.03748  0.00032  -0.00448 250 ALA A CB  
1163 N  N   . ALA A 146 ? 0.04929 0.07801 0.10325 0.01418  -0.00777 -0.00446 251 ALA A N   
1164 C  CA  . ALA A 146 ? 0.05693 0.07856 0.09208 -0.01297 -0.01162 -0.00868 251 ALA A CA  
1165 C  C   . ALA A 146 ? 0.06522 0.06373 0.07699 0.00139  -0.01407 -0.00392 251 ALA A C   
1166 O  O   . ALA A 146 ? 0.04925 0.06301 0.06925 -0.00302 -0.02343 -0.00242 251 ALA A O   
1167 C  CB  . ALA A 146 ? 0.04087 0.09550 0.08937 -0.01975 -0.00353 -0.02143 251 ALA A CB  
1168 N  N   . ARG A 147 ? 0.08516 0.06743 0.08030 0.01244  -0.00064 0.00022  252 ARG A N   
1169 C  CA  . ARG A 147 ? 0.09389 0.07450 0.08240 0.02990  0.01396  -0.01202 252 ARG A CA  
1170 C  C   . ARG A 147 ? 0.09034 0.07524 0.06926 0.01897  0.02007  -0.02011 252 ARG A C   
1171 O  O   . ARG A 147 ? 0.09158 0.07939 0.06543 0.01017  0.01295  -0.01276 252 ARG A O   
1172 C  CB  . ARG A 147 ? 0.09650 0.09546 0.08980 0.05353  0.00036  -0.00983 252 ARG A CB  
1173 C  CG  . ARG A 147 ? 0.11181 0.10662 0.10555 0.04454  -0.00200 -0.01726 252 ARG A CG  
1174 C  CD  . ARG A 147 ? 0.12245 0.09854 0.12069 0.04992  -0.01992 -0.02741 252 ARG A CD  
1175 N  NE  . ARG A 147 ? 0.12569 0.08841 0.13078 0.05286  -0.02847 -0.01889 252 ARG A NE  
1176 C  CZ  . ARG A 147 ? 0.12587 0.08766 0.14192 0.05740  -0.02455 -0.00830 252 ARG A CZ  
1177 N  NH1 . ARG A 147 ? 0.12465 0.09063 0.14446 0.05993  -0.01675 -0.01185 252 ARG A NH1 
1178 N  NH2 . ARG A 147 ? 0.12273 0.08949 0.14229 0.05246  -0.03602 0.00051  252 ARG A NH2 
1179 N  N   . LEU A 148 ? 0.10613 0.07182 0.05987 0.02002  0.01592  -0.02821 253 LEU A N   
1180 C  CA  . LEU A 148 ? 0.10871 0.08742 0.05399 0.01206  0.02523  -0.01736 253 LEU A CA  
1181 C  C   . LEU A 148 ? 0.09728 0.08476 0.05566 0.00571  0.01799  -0.02529 253 LEU A C   
1182 O  O   . LEU A 148 ? 0.08540 0.09021 0.05303 -0.00810 0.00882  -0.01601 253 LEU A O   
1183 C  CB  . LEU A 148 ? 0.10139 0.09676 0.05780 0.01868  0.03165  -0.00271 253 LEU A CB  
1184 C  CG  . LEU A 148 ? 0.10822 0.09002 0.06791 0.01700  0.03176  0.01795  253 LEU A CG  
1185 C  CD1 . LEU A 148 ? 0.12164 0.08280 0.07840 0.00889  0.03398  0.02318  253 LEU A CD1 
1186 C  CD2 . LEU A 148 ? 0.09979 0.07495 0.07564 0.03173  0.00925  0.02274  253 LEU A CD2 
1187 N  N   . GLN A 149 ? 0.09011 0.06451 0.05343 0.00785  0.01340  -0.02640 254 GLN A N   
1188 C  CA  . GLN A 149 ? 0.09416 0.08167 0.05782 0.00413  0.00524  -0.01406 254 GLN A CA  
1189 C  C   . GLN A 149 ? 0.07380 0.09782 0.06482 0.02350  -0.00229 -0.00027 254 GLN A C   
1190 O  O   . GLN A 149 ? 0.05990 0.11278 0.07417 0.03115  -0.00419 0.01338  254 GLN A O   
1191 C  CB  . GLN A 149 ? 0.09540 0.07635 0.05466 -0.00528 0.02426  -0.01892 254 GLN A CB  
1192 C  CG  . GLN A 149 ? 0.09304 0.09843 0.05815 0.00845  0.02329  -0.02990 254 GLN A CG  
1193 C  CD  . GLN A 149 ? 0.10789 0.12004 0.06754 0.00054  0.03303  -0.03034 254 GLN A CD  
1194 O  OE1 . GLN A 149 ? 0.09297 0.09842 0.07583 -0.01198 0.02650  -0.01256 254 GLN A OE1 
1195 N  NE2 . GLN A 149 ? 0.12843 0.14357 0.07875 0.00757  0.04069  -0.03914 254 GLN A NE2 
1196 N  N   . SER A 150 ? 0.07201 0.10801 0.06491 0.02025  -0.00393 0.00704  255 SER A N   
1197 C  CA  . SER A 150 ? 0.07162 0.14598 0.06809 0.02166  0.00356  0.02538  255 SER A CA  
1198 C  C   . SER A 150 ? 0.07723 0.14679 0.07125 0.03497  0.01330  0.01825  255 SER A C   
1199 O  O   . SER A 150 ? 0.08802 0.16620 0.07465 0.02406  0.02100  0.02216  255 SER A O   
1200 C  CB  . SER A 150 ? 0.06884 0.16460 0.06721 0.03170  0.00109  0.04009  255 SER A CB  
1201 O  OG  . SER A 150 ? 0.07963 0.18133 0.06868 0.03751  0.00585  0.04313  255 SER A OG  
1202 N  N   . SER A 151 ? 0.06582 0.12220 0.07989 0.03102  0.01700  0.00897  256 SER A N   
1203 C  CA  . SER A 151 ? 0.07044 0.12220 0.08758 0.03245  -0.00279 0.01339  256 SER A CA  
1204 C  C   . SER A 151 ? 0.06786 0.13053 0.08810 0.04402  -0.00241 0.02139  256 SER A C   
1205 O  O   . SER A 151 ? 0.05816 0.12881 0.08527 0.03661  -0.00106 0.02515  256 SER A O   
1206 C  CB  . SER A 151 ? 0.08860 0.11877 0.09271 0.02270  -0.01372 0.01163  256 SER A CB  
1207 O  OG  . SER A 151 ? 0.09790 0.11629 0.09281 0.00339  -0.01883 0.00939  256 SER A OG  
1208 N  N   . GLY A 152 ? 0.07282 0.15560 0.09315 0.04816  0.00741  0.02098  257 GLY A N   
1209 C  CA  . GLY A 152 ? 0.07533 0.17790 0.09130 0.05237  0.01134  0.03393  257 GLY A CA  
1210 C  C   . GLY A 152 ? 0.06735 0.17398 0.10375 0.03196  0.01075  0.05112  257 GLY A C   
1211 O  O   . GLY A 152 ? 0.07383 0.19045 0.10155 0.03485  0.01099  0.06762  257 GLY A O   
1212 N  N   . VAL A 153 ? 0.06027 0.15588 0.10935 0.02308  0.00555  0.04434  258 VAL A N   
1213 C  CA  . VAL A 153 ? 0.06723 0.12798 0.10651 0.01950  -0.00492 0.04956  258 VAL A CA  
1214 C  C   . VAL A 153 ? 0.05740 0.10338 0.10263 0.02446  0.00399  0.03215  258 VAL A C   
1215 O  O   . VAL A 153 ? 0.04583 0.09509 0.10198 0.02611  0.01202  0.01211  258 VAL A O   
1216 C  CB  . VAL A 153 ? 0.07582 0.11720 0.10849 0.01927  -0.01519 0.05367  258 VAL A CB  
1217 C  CG1 . VAL A 153 ? 0.07401 0.11689 0.10595 0.01763  -0.01986 0.04978  258 VAL A CG1 
1218 C  CG2 . VAL A 153 ? 0.07156 0.11802 0.10836 0.01810  0.00530  0.05641  258 VAL A CG2 
1219 N  N   . MET A 154 ? 0.06636 0.08924 0.09159 0.01090  0.00287  0.02561  259 MET A N   
1220 C  CA  . MET A 154 ? 0.07063 0.09241 0.07881 0.01683  0.00058  0.02621  259 MET A CA  
1221 C  C   . MET A 154 ? 0.06314 0.07263 0.08360 0.00588  0.02048  0.03310  259 MET A C   
1222 O  O   . MET A 154 ? 0.05826 0.07401 0.08126 0.01298  0.00631  0.01945  259 MET A O   
1223 C  CB  . MET A 154 ? 0.07387 0.11080 0.08339 0.02223  -0.01310 -0.00231 259 MET A CB  
1224 C  CG  . MET A 154 ? 0.07983 0.11645 0.08153 0.02230  -0.01343 0.00062  259 MET A CG  
1225 S  SD  . MET A 154 ? 0.09042 0.09977 0.08780 0.00384  0.00218  -0.01729 259 MET A SD  
1226 C  CE  . MET A 154 ? 0.12207 0.09319 0.08377 0.00565  0.01630  -0.02966 259 MET A CE  
1227 N  N   . VAL A 155 ? 0.08480 0.07885 0.08811 0.00526  0.03429  0.02506  260 VAL A N   
1228 C  CA  . VAL A 155 ? 0.09210 0.08836 0.09298 0.01840  0.03035  0.02672  260 VAL A CA  
1229 C  C   . VAL A 155 ? 0.08490 0.07822 0.09895 0.03015  0.01836  0.02370  260 VAL A C   
1230 O  O   . VAL A 155 ? 0.09669 0.06427 0.09803 0.03894  0.01764  0.01464  260 VAL A O   
1231 C  CB  . VAL A 155 ? 0.10308 0.10190 0.09534 -0.00017 0.03663  0.01764  260 VAL A CB  
1232 C  CG1 . VAL A 155 ? 0.11357 0.11759 0.09472 -0.01832 0.02810  0.01577  260 VAL A CG1 
1233 C  CG2 . VAL A 155 ? 0.10691 0.09870 0.10040 0.00234  0.03170  0.02218  260 VAL A CG2 
1234 N  N   . ALA A 156 ? 0.09328 0.09357 0.10243 0.03378  0.02058  0.01612  261 ALA A N   
1235 C  CA  . ALA A 156 ? 0.08340 0.09931 0.10492 0.01618  0.02419  0.00888  261 ALA A CA  
1236 C  C   . ALA A 156 ? 0.07938 0.09340 0.10099 0.00099  0.01595  0.01836  261 ALA A C   
1237 O  O   . ALA A 156 ? 0.09815 0.09384 0.09182 -0.02296 0.01651  0.01323  261 ALA A O   
1238 C  CB  . ALA A 156 ? 0.08365 0.10479 0.10611 0.03210  0.02377  0.00230  261 ALA A CB  
1239 N  N   . VAL A 157 ? 0.06615 0.09107 0.10538 0.01572  0.01278  0.02017  262 VAL A N   
1240 C  CA  . VAL A 157 ? 0.07192 0.07785 0.10662 0.00221  0.01849  0.00698  262 VAL A CA  
1241 C  C   . VAL A 157 ? 0.06648 0.09225 0.11182 0.00300  0.01865  0.00212  262 VAL A C   
1242 O  O   . VAL A 157 ? 0.07487 0.09225 0.11321 -0.00456 0.01529  -0.02172 262 VAL A O   
1243 C  CB  . VAL A 157 ? 0.09295 0.06982 0.10358 0.01149  0.01817  0.00339  262 VAL A CB  
1244 C  CG1 . VAL A 157 ? 0.08626 0.05081 0.09863 0.00719  -0.00428 0.00418  262 VAL A CG1 
1245 C  CG2 . VAL A 157 ? 0.10540 0.07644 0.10428 0.00856  0.02811  0.01340  262 VAL A CG2 
1246 N  N   . ALA A 158 ? 0.05538 0.09763 0.10072 0.00747  0.01882  0.01661  263 ALA A N   
1247 C  CA  . ALA A 158 ? 0.07878 0.09449 0.10718 -0.00998 0.00855  0.01995  263 ALA A CA  
1248 C  C   . ALA A 158 ? 0.07304 0.07185 0.11184 -0.00186 0.00347  0.02285  263 ALA A C   
1249 O  O   . ALA A 158 ? 0.08147 0.09257 0.11624 -0.00406 0.00227  0.02752  263 ALA A O   
1250 C  CB  . ALA A 158 ? 0.09512 0.11134 0.11239 -0.03486 0.00258  0.01668  263 ALA A CB  
1251 N  N   . ALA A 159 ? 0.07726 0.05911 0.11794 -0.01476 0.01185  0.02447  264 ALA A N   
1252 C  CA  . ALA A 159 ? 0.08478 0.06637 0.11903 -0.02288 0.01246  0.00425  264 ALA A CA  
1253 C  C   . ALA A 159 ? 0.09034 0.08186 0.11139 -0.01144 0.01925  0.01231  264 ALA A C   
1254 O  O   . ALA A 159 ? 0.08439 0.09119 0.10176 -0.02656 0.02147  0.01997  264 ALA A O   
1255 C  CB  . ALA A 159 ? 0.09149 0.06028 0.12122 -0.03921 0.01140  -0.00967 264 ALA A CB  
1256 N  N   . GLY A 160 ? 0.10951 0.07305 0.10929 0.00117  0.00655  0.01469  265 GLY A N   
1257 C  CA  . GLY A 160 ? 0.10745 0.08403 0.11768 0.01392  0.00802  0.01991  265 GLY A CA  
1258 C  C   . GLY A 160 ? 0.08181 0.09182 0.11726 0.01775  0.01683  0.01359  265 GLY A C   
1259 O  O   . GLY A 160 ? 0.07376 0.08764 0.12205 -0.00040 0.01273  0.00846  265 GLY A O   
1260 N  N   A ASN A 161 ? 0.08086 0.10537 0.12060 0.02391  0.02337  0.01061  266 ASN A N   
1261 N  N   B ASN A 161 ? 0.08918 0.10059 0.12400 0.01569  0.01841  0.01103  266 ASN A N   
1262 C  CA  A ASN A 161 ? 0.07348 0.10783 0.12384 0.01118  0.02883  0.01515  266 ASN A CA  
1263 C  CA  B ASN A 161 ? 0.08986 0.09890 0.12976 0.00082  0.01876  0.01500  266 ASN A CA  
1264 C  C   A ASN A 161 ? 0.08493 0.10001 0.13066 0.00483  0.02948  0.02116  266 ASN A C   
1265 C  C   B ASN A 161 ? 0.09274 0.09678 0.13419 0.00474  0.02366  0.01905  266 ASN A C   
1266 O  O   A ASN A 161 ? 0.08240 0.10862 0.13435 -0.00519 0.03429  0.02590  266 ASN A O   
1267 O  O   B ASN A 161 ? 0.08768 0.10455 0.13762 0.00615  0.02554  0.02173  266 ASN A O   
1268 C  CB  A ASN A 161 ? 0.06601 0.12552 0.11814 -0.00841 0.03072  0.01316  266 ASN A CB  
1269 C  CB  B ASN A 161 ? 0.09492 0.10453 0.12946 -0.02732 0.01158  0.01386  266 ASN A CB  
1270 C  CG  A ASN A 161 ? 0.07024 0.13642 0.11550 -0.00512 0.03377  0.00852  266 ASN A CG  
1271 C  CG  B ASN A 161 ? 0.10805 0.10523 0.13156 -0.03941 0.00515  0.01163  266 ASN A CG  
1272 O  OD1 A ASN A 161 ? 0.06895 0.14140 0.11098 -0.00030 0.03874  0.00950  266 ASN A OD1 
1273 O  OD1 B ASN A 161 ? 0.11278 0.10341 0.12977 -0.04307 0.00708  0.01124  266 ASN A OD1 
1274 N  ND2 A ASN A 161 ? 0.06882 0.14338 0.11837 0.01091  0.03934  0.00216  266 ASN A ND2 
1275 N  ND2 B ASN A 161 ? 0.11674 0.10955 0.13526 -0.03645 0.00533  0.00886  266 ASN A ND2 
1276 N  N   . ASN A 162 ? 0.10346 0.09756 0.14370 0.01143  0.03113  0.01771  267 ASN A N   
1277 C  CA  . ASN A 162 ? 0.11151 0.10895 0.15803 0.00004  0.03552  0.01003  267 ASN A CA  
1278 C  C   . ASN A 162 ? 0.11614 0.11552 0.16552 -0.00314 0.02448  0.02734  267 ASN A C   
1279 O  O   . ASN A 162 ? 0.13071 0.11379 0.15951 -0.02765 0.01700  0.03760  267 ASN A O   
1280 C  CB  . ASN A 162 ? 0.12261 0.12681 0.17078 -0.00841 0.04356  -0.01108 267 ASN A CB  
1281 C  CG  . ASN A 162 ? 0.14650 0.13389 0.17327 -0.01452 0.04011  -0.02388 267 ASN A CG  
1282 O  OD1 . ASN A 162 ? 0.15096 0.12694 0.17712 -0.02728 0.03774  -0.03354 267 ASN A OD1 
1283 N  ND2 . ASN A 162 ? 0.16943 0.15280 0.17571 -0.02301 0.03474  -0.02496 267 ASN A ND2 
1284 N  N   . ASN A 163 ? 0.09131 0.10879 0.16841 0.00712  0.01800  0.03269  268 ASN A N   
1285 C  CA  . ASN A 163 ? 0.08599 0.10506 0.17625 0.00955  0.00845  0.04279  268 ASN A CA  
1286 C  C   . ASN A 163 ? 0.07835 0.11988 0.17707 0.01722  0.01553  0.04909  268 ASN A C   
1287 O  O   . ASN A 163 ? 0.07834 0.12328 0.17212 0.02715  0.02536  0.03998  268 ASN A O   
1288 C  CB  . ASN A 163 ? 0.09167 0.08827 0.18048 0.00716  -0.00347 0.04243  268 ASN A CB  
1289 C  CG  . ASN A 163 ? 0.10612 0.11177 0.18483 0.01328  -0.01303 0.04455  268 ASN A CG  
1290 O  OD1 . ASN A 163 ? 0.09035 0.11547 0.18679 0.01983  -0.01629 0.04948  268 ASN A OD1 
1291 N  ND2 . ASN A 163 ? 0.11577 0.12749 0.18480 0.01169  -0.02157 0.05316  268 ASN A ND2 
1292 N  N   . ALA A 164 ? 0.07316 0.13694 0.18538 0.01953  0.01256  0.05234  269 ALA A N   
1293 C  CA  . ALA A 164 ? 0.07349 0.13752 0.19036 0.02679  0.01713  0.05987  269 ALA A CA  
1294 C  C   . ALA A 164 ? 0.06764 0.12213 0.18687 0.02669  0.01120  0.05537  269 ALA A C   
1295 O  O   . ALA A 164 ? 0.06751 0.12350 0.18020 0.02855  0.00878  0.05305  269 ALA A O   
1296 C  CB  . ALA A 164 ? 0.10194 0.14727 0.19740 0.03843  0.01135  0.05494  269 ALA A CB  
1297 N  N   . ASP A 165 ? 0.06383 0.12404 0.19822 0.01792  0.01411  0.06119  270 ASP A N   
1298 C  CA  . ASP A 165 ? 0.06966 0.12055 0.19963 -0.00921 0.01261  0.06841  270 ASP A CA  
1299 C  C   . ASP A 165 ? 0.08107 0.10579 0.19379 0.00429  0.02021  0.06289  270 ASP A C   
1300 O  O   . ASP A 165 ? 0.09393 0.12289 0.18667 0.00406  0.01557  0.06303  270 ASP A O   
1301 C  CB  . ASP A 165 ? 0.07650 0.14813 0.20266 -0.02057 0.01351  0.06674  270 ASP A CB  
1302 C  CG  . ASP A 165 ? 0.08671 0.14921 0.20605 -0.02816 0.00635  0.07460  270 ASP A CG  
1303 O  OD1 . ASP A 165 ? 0.08940 0.14934 0.20607 -0.02901 -0.00301 0.08298  270 ASP A OD1 
1304 O  OD2 . ASP A 165 ? 0.09902 0.16428 0.21761 -0.01287 -0.00049 0.06947  270 ASP A OD2 
1305 N  N   . ALA A 166 ? 0.08834 0.09656 0.19356 0.00709  0.02348  0.05188  271 ALA A N   
1306 C  CA  . ALA A 166 ? 0.09205 0.08631 0.19209 0.01158  0.02441  0.02717  271 ALA A CA  
1307 C  C   . ALA A 166 ? 0.09696 0.08290 0.18321 0.01640  0.02030  0.02057  271 ALA A C   
1308 O  O   . ALA A 166 ? 0.09790 0.06980 0.17837 0.03430  0.01622  -0.00030 271 ALA A O   
1309 C  CB  . ALA A 166 ? 0.12025 0.09620 0.19602 0.00146  0.02837  0.01699  271 ALA A CB  
1310 N  N   . ARG A 167 ? 0.09587 0.09021 0.18253 0.00372  0.02049  0.01904  272 ARG A N   
1311 C  CA  . ARG A 167 ? 0.10218 0.10709 0.17657 0.00578  0.02254  0.00838  272 ARG A CA  
1312 C  C   . ARG A 167 ? 0.09895 0.11513 0.15874 0.02326  0.03573  0.01726  272 ARG A C   
1313 O  O   . ARG A 167 ? 0.10237 0.11893 0.15487 0.00954  0.03551  0.02723  272 ARG A O   
1314 C  CB  . ARG A 167 ? 0.11740 0.14611 0.18380 0.00374  0.01607  0.01070  272 ARG A CB  
1315 C  CG  . ARG A 167 ? 0.13477 0.17929 0.19125 0.00017  0.00996  0.01069  272 ARG A CG  
1316 C  CD  . ARG A 167 ? 0.16219 0.22903 0.19931 0.00150  0.02038  0.01462  272 ARG A CD  
1317 N  NE  . ARG A 167 ? 0.20048 0.26203 0.20235 -0.00366 0.03203  0.01479  272 ARG A NE  
1318 C  CZ  . ARG A 167 ? 0.24477 0.28236 0.20981 -0.00581 0.03519  0.01525  272 ARG A CZ  
1319 N  NH1 . ARG A 167 ? 0.27117 0.28707 0.20407 -0.00606 0.03175  0.01627  272 ARG A NH1 
1320 N  NH2 . ARG A 167 ? 0.25063 0.28592 0.21179 -0.01426 0.04134  0.01911  272 ARG A NH2 
1321 N  N   . ASN A 168 ? 0.09138 0.11260 0.15655 0.03184  0.04346  0.03751  273 ASN A N   
1322 C  CA  . ASN A 168 ? 0.09685 0.12347 0.14959 0.02232  0.03856  0.04619  273 ASN A CA  
1323 C  C   . ASN A 168 ? 0.08770 0.12341 0.14591 0.01522  0.03116  0.04722  273 ASN A C   
1324 O  O   . ASN A 168 ? 0.08357 0.12949 0.14542 0.01698  0.02120  0.05524  273 ASN A O   
1325 C  CB  . ASN A 168 ? 0.10781 0.12159 0.15163 0.01171  0.05042  0.06573  273 ASN A CB  
1326 C  CG  . ASN A 168 ? 0.11466 0.14849 0.15972 0.02490  0.05255  0.08024  273 ASN A CG  
1327 O  OD1 . ASN A 168 ? 0.11199 0.13521 0.16801 0.02584  0.04819  0.08246  273 ASN A OD1 
1328 N  ND2 . ASN A 168 ? 0.13036 0.16432 0.16002 0.02977  0.05867  0.08277  273 ASN A ND2 
1329 N  N   . TYR A 169 ? 0.07177 0.11919 0.14563 0.01288  0.03709  0.04677  274 TYR A N   
1330 C  CA  . TYR A 169 ? 0.06863 0.12853 0.14358 0.02581  0.03063  0.04335  274 TYR A CA  
1331 C  C   . TYR A 169 ? 0.05559 0.10952 0.12740 0.02324  0.03075  0.02829  274 TYR A C   
1332 O  O   . TYR A 169 ? 0.07135 0.12893 0.12813 0.02412  0.02560  0.01669  274 TYR A O   
1333 C  CB  . TYR A 169 ? 0.09255 0.15239 0.15192 0.02964  0.02794  0.04238  274 TYR A CB  
1334 C  CG  . TYR A 169 ? 0.11950 0.16327 0.15127 0.04325  0.01185  0.04048  274 TYR A CG  
1335 C  CD1 . TYR A 169 ? 0.12380 0.17177 0.15538 0.04414  -0.00414 0.03429  274 TYR A CD1 
1336 C  CD2 . TYR A 169 ? 0.12240 0.16548 0.15260 0.06463  0.00298  0.05002  274 TYR A CD2 
1337 C  CE1 . TYR A 169 ? 0.14092 0.16806 0.15683 0.05425  0.00115  0.02831  274 TYR A CE1 
1338 C  CE2 . TYR A 169 ? 0.12859 0.16627 0.15208 0.06570  0.00229  0.04384  274 TYR A CE2 
1339 C  CZ  . TYR A 169 ? 0.14073 0.16909 0.15690 0.06678  0.01423  0.02982  274 TYR A CZ  
1340 O  OH  . TYR A 169 ? 0.14329 0.18604 0.15950 0.08334  0.02852  0.02323  274 TYR A OH  
1341 N  N   . SER A 170 ? 0.06143 0.11359 0.11343 0.01516  0.03336  0.02427  275 SER A N   
1342 C  CA  . SER A 170 ? 0.07410 0.10658 0.10438 0.01665  0.02194  0.01456  275 SER A CA  
1343 C  C   . SER A 170 ? 0.08738 0.10779 0.09341 0.00526  0.01233  0.00596  275 SER A C   
1344 O  O   . SER A 170 ? 0.09380 0.12549 0.09298 0.01280  0.00051  0.00513  275 SER A O   
1345 C  CB  . SER A 170 ? 0.09431 0.08188 0.10299 -0.00310 0.03065  0.01870  275 SER A CB  
1346 O  OG  . SER A 170 ? 0.10387 0.08387 0.10394 -0.01699 0.03377  0.02275  275 SER A OG  
1347 N  N   . PRO A 171 ? 0.10121 0.10432 0.08371 -0.00527 0.00506  0.00470  276 PRO A N   
1348 C  CA  . PRO A 171 ? 0.08684 0.08932 0.07258 -0.01300 0.00226  0.00130  276 PRO A CA  
1349 C  C   . PRO A 171 ? 0.08295 0.08718 0.06148 -0.00372 0.00976  0.00304  276 PRO A C   
1350 O  O   . PRO A 171 ? 0.08290 0.10853 0.06790 -0.00511 0.01167  0.00898  276 PRO A O   
1351 C  CB  . PRO A 171 ? 0.08247 0.09976 0.07843 -0.02114 0.01195  0.00585  276 PRO A CB  
1352 C  CG  . PRO A 171 ? 0.08780 0.12496 0.07616 -0.02584 0.00457  0.01814  276 PRO A CG  
1353 C  CD  . PRO A 171 ? 0.10056 0.12216 0.07613 -0.01429 0.01783  0.01708  276 PRO A CD  
1354 N  N   . ALA A 172 ? 0.08957 0.09042 0.06100 -0.01337 0.01993  0.00599  277 ALA A N   
1355 C  CA  . ALA A 172 ? 0.09034 0.10791 0.06807 0.00488  0.00616  0.00594  277 ALA A CA  
1356 C  C   . ALA A 172 ? 0.08176 0.11235 0.06402 0.00361  0.00219  0.01084  277 ALA A C   
1357 O  O   . ALA A 172 ? 0.06517 0.10835 0.04142 0.00301  -0.00462 0.02895  277 ALA A O   
1358 C  CB  . ALA A 172 ? 0.09984 0.12136 0.07613 0.03755  0.00308  0.01384  277 ALA A CB  
1359 N  N   . SER A 173 ? 0.09218 0.10393 0.06285 -0.01027 0.00914  0.02152  278 SER A N   
1360 C  CA  . SER A 173 ? 0.10750 0.10738 0.07402 -0.00584 -0.00115 0.03040  278 SER A CA  
1361 C  C   . SER A 173 ? 0.11973 0.10328 0.07386 -0.00363 0.00575  0.02841  278 SER A C   
1362 O  O   . SER A 173 ? 0.13211 0.09726 0.08037 -0.00121 0.01281  0.02265  278 SER A O   
1363 C  CB  . SER A 173 ? 0.10774 0.10912 0.08179 0.00142  0.00238  0.03864  278 SER A CB  
1364 O  OG  . SER A 173 ? 0.10947 0.10151 0.09023 0.00246  0.00720  0.05163  278 SER A OG  
1365 N  N   . GLU A 174 ? 0.11085 0.10657 0.07149 0.00120  0.00487  0.02362  279 GLU A N   
1366 C  CA  . GLU A 174 ? 0.08179 0.11572 0.06861 -0.01029 -0.00434 0.01782  279 GLU A CA  
1367 C  C   . GLU A 174 ? 0.06503 0.12997 0.06176 -0.02223 -0.00381 0.00007  279 GLU A C   
1368 O  O   . GLU A 174 ? 0.05377 0.13148 0.06188 -0.02023 -0.01134 -0.01676 279 GLU A O   
1369 C  CB  . GLU A 174 ? 0.05959 0.10991 0.06146 0.01020  0.00305  0.01756  279 GLU A CB  
1370 C  CG  . GLU A 174 ? 0.06126 0.12560 0.06091 0.01446  0.00243  0.00443  279 GLU A CG  
1371 C  CD  . GLU A 174 ? 0.08307 0.13265 0.06785 0.00905  -0.00043 -0.01390 279 GLU A CD  
1372 O  OE1 . GLU A 174 ? 0.09180 0.14434 0.07068 -0.00167 0.00226  -0.00694 279 GLU A OE1 
1373 O  OE2 . GLU A 174 ? 0.08573 0.12964 0.06998 0.01401  -0.00124 -0.02337 279 GLU A OE2 
1374 N  N   . PRO A 175 ? 0.06685 0.15037 0.07239 -0.03528 0.00613  0.00014  280 PRO A N   
1375 C  CA  . PRO A 175 ? 0.07156 0.16181 0.07560 -0.03107 -0.00755 0.00721  280 PRO A CA  
1376 C  C   . PRO A 175 ? 0.07500 0.13837 0.07540 -0.01983 -0.00331 0.01394  280 PRO A C   
1377 O  O   . PRO A 175 ? 0.07051 0.13095 0.06910 -0.00255 0.00300  0.01674  280 PRO A O   
1378 C  CB  . PRO A 175 ? 0.07852 0.20115 0.07715 -0.03771 0.00413  0.00399  280 PRO A CB  
1379 C  CG  . PRO A 175 ? 0.09983 0.20669 0.08933 -0.04026 0.00751  -0.00699 280 PRO A CG  
1380 C  CD  . PRO A 175 ? 0.06553 0.16763 0.08028 -0.04750 0.00453  -0.00934 280 PRO A CD  
1381 N  N   . SER A 176 ? 0.06664 0.11710 0.07971 -0.00729 -0.03029 0.02269  281 SER A N   
1382 C  CA  . SER A 176 ? 0.05649 0.10317 0.08671 -0.00667 -0.01341 0.01152  281 SER A CA  
1383 C  C   . SER A 176 ? 0.06080 0.09862 0.08430 0.00327  -0.02826 0.01099  281 SER A C   
1384 O  O   . SER A 176 ? 0.07865 0.10534 0.08462 0.01058  -0.03596 0.01064  281 SER A O   
1385 C  CB  . SER A 176 ? 0.07149 0.11335 0.10026 0.00868  -0.00647 0.00012  281 SER A CB  
1386 O  OG  . SER A 176 ? 0.07370 0.10431 0.10754 0.01621  -0.00686 -0.01849 281 SER A OG  
1387 N  N   . VAL A 177 ? 0.05966 0.06904 0.09945 0.00706  -0.02278 -0.00805 282 VAL A N   
1388 C  CA  . VAL A 177 ? 0.07833 0.05616 0.10495 0.00492  -0.00990 -0.00619 282 VAL A CA  
1389 C  C   . VAL A 177 ? 0.06840 0.05504 0.11280 -0.00590 0.00844  -0.00635 282 VAL A C   
1390 O  O   . VAL A 177 ? 0.07877 0.07060 0.11826 -0.01470 -0.00358 0.00276  282 VAL A O   
1391 C  CB  . VAL A 177 ? 0.08949 0.04714 0.10049 0.00532  -0.01803 0.00752  282 VAL A CB  
1392 C  CG1 . VAL A 177 ? 0.09247 0.03866 0.09892 0.00358  -0.02645 0.01425  282 VAL A CG1 
1393 C  CG2 . VAL A 177 ? 0.09991 0.07666 0.10462 -0.00682 0.00110  0.00313  282 VAL A CG2 
1394 N  N   . CYS A 178 ? 0.06150 0.06916 0.10955 0.01083  0.01387  -0.00238 283 CYS A N   
1395 C  CA  . CYS A 178 ? 0.05985 0.07752 0.10956 0.01807  0.01915  -0.00247 283 CYS A CA  
1396 C  C   . CYS A 178 ? 0.06892 0.07134 0.11037 0.00946  0.02479  0.02380  283 CYS A C   
1397 O  O   . CYS A 178 ? 0.07697 0.06909 0.10918 0.00251  0.02788  0.00953  283 CYS A O   
1398 C  CB  . CYS A 178 ? 0.08730 0.06886 0.10659 0.01057  0.01704  -0.01320 283 CYS A CB  
1399 S  SG  . CYS A 178 ? 0.09856 0.07670 0.10857 0.00227  0.01774  -0.01177 283 CYS A SG  
1400 N  N   . THR A 179 ? 0.08226 0.06148 0.11803 0.02619  0.02059  0.03287  284 THR A N   
1401 C  CA  . THR A 179 ? 0.07507 0.07233 0.12224 0.03283  0.01177  0.01545  284 THR A CA  
1402 C  C   . THR A 179 ? 0.05841 0.05989 0.12329 0.02186  0.01042  0.00341  284 THR A C   
1403 O  O   . THR A 179 ? 0.04903 0.05724 0.12863 0.01193  0.01075  -0.00505 284 THR A O   
1404 C  CB  . THR A 179 ? 0.08231 0.08406 0.12524 0.02070  -0.00116 0.01562  284 THR A CB  
1405 O  OG1 . THR A 179 ? 0.06920 0.07526 0.11678 -0.00744 -0.01773 0.00092  284 THR A OG1 
1406 C  CG2 . THR A 179 ? 0.10424 0.09229 0.12791 0.04665  -0.00692 0.03486  284 THR A CG2 
1407 N  N   . VAL A 180 ? 0.07131 0.07165 0.11620 0.01373  0.00305  0.00335  285 VAL A N   
1408 C  CA  . VAL A 180 ? 0.07022 0.06818 0.11345 0.00584  0.00636  0.00701  285 VAL A CA  
1409 C  C   . VAL A 180 ? 0.05740 0.06901 0.10734 0.00579  0.00842  0.00615  285 VAL A C   
1410 O  O   . VAL A 180 ? 0.07712 0.07154 0.10364 0.00074  0.02091  -0.00321 285 VAL A O   
1411 C  CB  . VAL A 180 ? 0.06802 0.08238 0.11418 0.01565  0.00630  0.00669  285 VAL A CB  
1412 C  CG1 . VAL A 180 ? 0.06812 0.07746 0.11388 0.02906  0.00866  0.00914  285 VAL A CG1 
1413 C  CG2 . VAL A 180 ? 0.07288 0.08566 0.11606 0.00028  -0.00085 -0.00255 285 VAL A CG2 
1414 N  N   . GLY A 181 ? 0.04891 0.06953 0.11363 0.01274  0.00184  0.01401  286 GLY A N   
1415 C  CA  . GLY A 181 ? 0.06114 0.06727 0.11820 0.01294  -0.00246 0.00849  286 GLY A CA  
1416 C  C   . GLY A 181 ? 0.07446 0.05261 0.11622 -0.00600 0.00518  0.00246  286 GLY A C   
1417 O  O   . GLY A 181 ? 0.07935 0.03354 0.11286 -0.00337 0.01581  0.00746  286 GLY A O   
1418 N  N   . ALA A 182 ? 0.08515 0.06710 0.11452 -0.00805 -0.00086 -0.00296 287 ALA A N   
1419 C  CA  . ALA A 182 ? 0.07765 0.07027 0.11767 -0.00771 -0.00760 -0.01520 287 ALA A CA  
1420 C  C   . ALA A 182 ? 0.06131 0.06208 0.12385 -0.00931 -0.00638 -0.02223 287 ALA A C   
1421 O  O   . ALA A 182 ? 0.07366 0.06844 0.13175 -0.00417 -0.01910 -0.03653 287 ALA A O   
1422 C  CB  . ALA A 182 ? 0.07228 0.07492 0.11386 -0.02109 -0.01905 -0.00695 287 ALA A CB  
1423 N  N   . SER A 183 ? 0.05712 0.05900 0.12091 -0.00271 -0.00527 -0.02110 288 SER A N   
1424 C  CA  . SER A 183 ? 0.08470 0.07558 0.13305 0.00117  -0.00166 -0.01300 288 SER A CA  
1425 C  C   . SER A 183 ? 0.08884 0.05489 0.13447 0.00654  -0.00658 0.00121  288 SER A C   
1426 O  O   . SER A 183 ? 0.09258 0.05634 0.13022 -0.01318 -0.00383 0.01906  288 SER A O   
1427 C  CB  . SER A 183 ? 0.10633 0.08892 0.12735 -0.00307 -0.00701 -0.01368 288 SER A CB  
1428 O  OG  . SER A 183 ? 0.11283 0.08562 0.12384 -0.00260 -0.02578 -0.00882 288 SER A OG  
1429 N  N   . ASP A 184 ? 0.09958 0.07458 0.13948 0.01098  -0.00980 0.02075  289 ASP A N   
1430 C  CA  . ASP A 184 ? 0.08112 0.07052 0.14730 0.01162  -0.01132 0.01453  289 ASP A CA  
1431 C  C   . ASP A 184 ? 0.08323 0.08375 0.15895 0.01292  -0.00120 0.00987  289 ASP A C   
1432 O  O   . ASP A 184 ? 0.08389 0.07803 0.15974 -0.00058 -0.00065 0.01769  289 ASP A O   
1433 C  CB  . ASP A 184 ? 0.09210 0.06268 0.14957 -0.00484 -0.02666 0.02340  289 ASP A CB  
1434 C  CG  . ASP A 184 ? 0.10955 0.07360 0.15900 -0.00724 -0.02935 0.02277  289 ASP A CG  
1435 O  OD1 . ASP A 184 ? 0.12270 0.08481 0.15840 -0.01011 -0.02757 0.01568  289 ASP A OD1 
1436 O  OD2 . ASP A 184 ? 0.12504 0.06631 0.16053 0.00525  -0.02089 0.02270  289 ASP A OD2 
1437 N  N   . ARG A 185 ? 0.08494 0.08014 0.17498 0.01811  -0.00360 0.00505  290 ARG A N   
1438 C  CA  . ARG A 185 ? 0.09605 0.09048 0.18453 0.01065  -0.00511 -0.01330 290 ARG A CA  
1439 C  C   . ARG A 185 ? 0.08618 0.08153 0.18562 0.01527  0.00627  -0.00721 290 ARG A C   
1440 O  O   . ARG A 185 ? 0.08605 0.08095 0.18237 0.02598  0.01461  -0.01441 290 ARG A O   
1441 C  CB  . ARG A 185 ? 0.12270 0.12494 0.20212 0.00388  -0.01805 -0.01189 290 ARG A CB  
1442 C  CG  . ARG A 185 ? 0.15302 0.16646 0.22086 -0.01195 -0.02948 -0.00337 290 ARG A CG  
1443 C  CD  . ARG A 185 ? 0.18753 0.20497 0.24096 -0.00344 -0.03103 0.00585  290 ARG A CD  
1444 N  NE  . ARG A 185 ? 0.22194 0.23625 0.25605 -0.00593 -0.03292 0.01923  290 ARG A NE  
1445 C  CZ  . ARG A 185 ? 0.26368 0.27055 0.26447 -0.00449 -0.03750 0.02350  290 ARG A CZ  
1446 N  NH1 . ARG A 185 ? 0.27121 0.28406 0.27146 0.00030  -0.03028 0.03197  290 ARG A NH1 
1447 N  NH2 . ARG A 185 ? 0.28174 0.28584 0.26935 -0.01136 -0.04627 0.01952  290 ARG A NH2 
1448 N  N   . TYR A 186 ? 0.08783 0.08816 0.19538 0.00789  -0.00252 -0.00276 291 TYR A N   
1449 C  CA  . TYR A 186 ? 0.11201 0.10656 0.20223 0.00236  -0.00968 0.00266  291 TYR A CA  
1450 C  C   . TYR A 186 ? 0.11664 0.08520 0.20591 -0.00907 -0.00221 -0.00083 291 TYR A C   
1451 O  O   . TYR A 186 ? 0.12570 0.08039 0.21147 -0.02381 0.00016  0.00168  291 TYR A O   
1452 C  CB  . TYR A 186 ? 0.14040 0.15483 0.21788 0.00692  -0.01290 0.00511  291 TYR A CB  
1453 C  CG  . TYR A 186 ? 0.14748 0.19846 0.22274 0.01523  -0.01858 0.00247  291 TYR A CG  
1454 C  CD1 . TYR A 186 ? 0.15214 0.22893 0.22285 0.02040  -0.02662 -0.01203 291 TYR A CD1 
1455 C  CD2 . TYR A 186 ? 0.15228 0.22151 0.22042 0.02084  -0.02511 0.01319  291 TYR A CD2 
1456 C  CE1 . TYR A 186 ? 0.15941 0.25740 0.22939 0.03798  -0.03243 -0.00879 291 TYR A CE1 
1457 C  CE2 . TYR A 186 ? 0.16472 0.24808 0.22510 0.03592  -0.02725 0.01210  291 TYR A CE2 
1458 C  CZ  . TYR A 186 ? 0.16753 0.27020 0.22748 0.04270  -0.03099 0.00439  291 TYR A CZ  
1459 O  OH  . TYR A 186 ? 0.16641 0.28663 0.23689 0.04353  -0.02710 0.00671  291 TYR A OH  
1460 N  N   . ASP A 187 ? 0.13135 0.09199 0.20051 0.00162  0.00098  -0.01725 292 ASP A N   
1461 C  CA  . ASP A 187 ? 0.13763 0.08996 0.19930 -0.00928 0.00303  -0.02373 292 ASP A CA  
1462 C  C   . ASP A 187 ? 0.13691 0.08505 0.19779 -0.01429 0.00743  -0.01361 292 ASP A C   
1463 O  O   . ASP A 187 ? 0.13746 0.10577 0.19845 -0.02131 0.00950  -0.01546 292 ASP A O   
1464 C  CB  . ASP A 187 ? 0.13885 0.09422 0.20477 -0.00310 -0.00093 -0.03928 292 ASP A CB  
1465 C  CG  . ASP A 187 ? 0.13812 0.11266 0.21403 -0.00058 -0.00275 -0.04980 292 ASP A CG  
1466 O  OD1 . ASP A 187 ? 0.13715 0.11285 0.21758 -0.00354 -0.00329 -0.04623 292 ASP A OD1 
1467 O  OD2 . ASP A 187 ? 0.14972 0.12890 0.21334 0.01643  -0.00458 -0.06453 292 ASP A OD2 
1468 N  N   . ARG A 188 ? 0.14162 0.06886 0.19143 0.00789  0.01269  -0.00280 293 ARG A N   
1469 C  CA  . ARG A 188 ? 0.13357 0.08804 0.19355 0.01525  0.01114  -0.00434 293 ARG A CA  
1470 C  C   . ARG A 188 ? 0.10398 0.09426 0.18609 0.03014  0.00434  -0.01120 293 ARG A C   
1471 O  O   . ARG A 188 ? 0.09576 0.10738 0.18749 0.04584  -0.00311 -0.01440 293 ARG A O   
1472 C  CB  . ARG A 188 ? 0.15161 0.10549 0.19142 0.00680  0.00915  0.00773  293 ARG A CB  
1473 C  CG  . ARG A 188 ? 0.17210 0.12586 0.19451 -0.00638 0.00046  0.00956  293 ARG A CG  
1474 C  CD  . ARG A 188 ? 0.18449 0.14732 0.20053 -0.01077 -0.01303 0.00135  293 ARG A CD  
1475 N  NE  . ARG A 188 ? 0.19356 0.16206 0.19910 -0.00999 -0.02438 -0.01140 293 ARG A NE  
1476 C  CZ  . ARG A 188 ? 0.20631 0.16263 0.19365 -0.00107 -0.03372 -0.01916 293 ARG A CZ  
1477 N  NH1 . ARG A 188 ? 0.21788 0.15590 0.18824 -0.00395 -0.03573 -0.01322 293 ARG A NH1 
1478 N  NH2 . ARG A 188 ? 0.20802 0.15933 0.19092 -0.01666 -0.03498 -0.02601 293 ARG A NH2 
1479 N  N   . ARG A 189 ? 0.10841 0.10236 0.18389 0.01621  0.01104  -0.01669 294 ARG A N   
1480 C  CA  . ARG A 189 ? 0.10005 0.10787 0.17753 0.00985  0.02073  -0.01868 294 ARG A CA  
1481 C  C   . ARG A 189 ? 0.10412 0.08519 0.17725 -0.01355 0.01402  -0.01436 294 ARG A C   
1482 O  O   . ARG A 189 ? 0.11073 0.09323 0.17548 -0.00834 0.01014  -0.00463 294 ARG A O   
1483 C  CB  . ARG A 189 ? 0.10508 0.13672 0.17468 0.01427  0.02653  -0.01643 294 ARG A CB  
1484 C  CG  . ARG A 189 ? 0.11066 0.15579 0.17455 0.01850  0.02319  -0.01718 294 ARG A CG  
1485 C  CD  . ARG A 189 ? 0.12329 0.17252 0.17594 -0.00720 0.01843  -0.01689 294 ARG A CD  
1486 N  NE  . ARG A 189 ? 0.13745 0.18915 0.18216 -0.01737 0.03110  -0.01450 294 ARG A NE  
1487 C  CZ  . ARG A 189 ? 0.15337 0.20351 0.18826 -0.01500 0.03631  -0.00537 294 ARG A CZ  
1488 N  NH1 . ARG A 189 ? 0.15294 0.21067 0.18544 -0.00850 0.02671  -0.01743 294 ARG A NH1 
1489 N  NH2 . ARG A 189 ? 0.16623 0.21006 0.19662 -0.01140 0.04964  0.00787  294 ARG A NH2 
1490 N  N   . SER A 190 ? 0.09181 0.07937 0.17994 -0.02792 0.01594  -0.01228 295 SER A N   
1491 C  CA  . SER A 190 ? 0.08779 0.08006 0.17619 -0.01211 0.00530  0.00103  295 SER A CA  
1492 C  C   . SER A 190 ? 0.10405 0.08735 0.17602 0.01023  0.00376  0.00970  295 SER A C   
1493 O  O   . SER A 190 ? 0.09967 0.07852 0.18244 0.01476  -0.00458 0.00302  295 SER A O   
1494 C  CB  . SER A 190 ? 0.09873 0.06279 0.17880 -0.02411 -0.00497 0.00251  295 SER A CB  
1495 O  OG  . SER A 190 ? 0.11913 0.06012 0.18872 -0.01612 -0.00760 0.00584  295 SER A OG  
1496 N  N   . SER A 191 ? 0.12711 0.10464 0.17164 0.02202  0.00130  0.01824  296 SER A N   
1497 C  CA  . SER A 191 ? 0.14394 0.12181 0.16771 0.03126  0.00206  0.02225  296 SER A CA  
1498 C  C   . SER A 191 ? 0.12574 0.10888 0.15715 0.03634  -0.00027 0.01528  296 SER A C   
1499 O  O   . SER A 191 ? 0.11953 0.11060 0.15521 0.03187  0.00865  0.00843  296 SER A O   
1500 C  CB  . SER A 191 ? 0.16676 0.15446 0.17188 0.03908  0.00399  0.02691  296 SER A CB  
1501 O  OG  . SER A 191 ? 0.17818 0.17426 0.17581 0.04480  0.00053  0.02844  296 SER A OG  
1502 N  N   . PHE A 192 ? 0.12129 0.09596 0.15016 0.02057  -0.01472 0.00246  297 PHE A N   
1503 C  CA  . PHE A 192 ? 0.12393 0.10921 0.14504 0.01275  -0.00720 -0.00345 297 PHE A CA  
1504 C  C   . PHE A 192 ? 0.12332 0.10344 0.13337 0.01277  0.00711  0.00457  297 PHE A C   
1505 O  O   . PHE A 192 ? 0.11517 0.10107 0.13417 0.03047  0.02957  0.00985  297 PHE A O   
1506 C  CB  . PHE A 192 ? 0.12769 0.11914 0.15117 0.00357  -0.00199 0.00501  297 PHE A CB  
1507 C  CG  . PHE A 192 ? 0.12237 0.10102 0.15702 0.00761  0.00687  0.01030  297 PHE A CG  
1508 C  CD1 . PHE A 192 ? 0.12428 0.08251 0.15763 0.00177  0.00227  0.00903  297 PHE A CD1 
1509 C  CD2 . PHE A 192 ? 0.12717 0.08429 0.15778 0.01707  0.01178  0.01280  297 PHE A CD2 
1510 C  CE1 . PHE A 192 ? 0.13241 0.07842 0.15918 0.00735  -0.00276 0.00912  297 PHE A CE1 
1511 C  CE2 . PHE A 192 ? 0.13876 0.07797 0.16313 0.01338  0.00608  0.00929  297 PHE A CE2 
1512 C  CZ  . PHE A 192 ? 0.14961 0.07430 0.16165 0.01364  -0.00447 0.00707  297 PHE A CZ  
1513 N  N   . SER A 193 ? 0.10818 0.08501 0.11727 -0.00336 0.00065  0.00243  298 SER A N   
1514 C  CA  . SER A 193 ? 0.09680 0.08479 0.10967 0.00752  0.00368  -0.00026 298 SER A CA  
1515 C  C   . SER A 193 ? 0.07743 0.07404 0.11152 0.01465  0.01288  0.00972  298 SER A C   
1516 O  O   . SER A 193 ? 0.08970 0.09278 0.11590 0.01103  0.00224  0.00658  298 SER A O   
1517 C  CB  . SER A 193 ? 0.12130 0.08353 0.10083 0.01624  0.00926  -0.00184 298 SER A CB  
1518 O  OG  . SER A 193 ? 0.13222 0.09126 0.09498 0.01830  0.01386  -0.00046 298 SER A OG  
1519 N  N   . ASN A 194 ? 0.06998 0.07479 0.12161 0.00350  0.01720  0.01361  299 ASN A N   
1520 C  CA  . ASN A 194 ? 0.08906 0.07525 0.12979 -0.00902 0.00825  0.00199  299 ASN A CA  
1521 C  C   . ASN A 194 ? 0.09888 0.07568 0.13924 -0.01655 -0.01186 0.00617  299 ASN A C   
1522 O  O   . ASN A 194 ? 0.11144 0.08267 0.13747 -0.02077 -0.02596 -0.00620 299 ASN A O   
1523 C  CB  . ASN A 194 ? 0.10739 0.07697 0.13568 0.00912  0.00952  0.01629  299 ASN A CB  
1524 C  CG  . ASN A 194 ? 0.10635 0.07509 0.14316 -0.00394 0.01065  0.03271  299 ASN A CG  
1525 O  OD1 . ASN A 194 ? 0.10991 0.06593 0.14290 0.01072  0.00717  0.04824  299 ASN A OD1 
1526 N  ND2 . ASN A 194 ? 0.09854 0.09195 0.14987 -0.00259 0.00815  0.03304  299 ASN A ND2 
1527 N  N   . TYR A 195 ? 0.08850 0.06478 0.14678 -0.01689 -0.01879 0.02767  300 TYR A N   
1528 C  CA  . TYR A 195 ? 0.09317 0.08695 0.16105 -0.01214 -0.01456 0.03312  300 TYR A CA  
1529 C  C   . TYR A 195 ? 0.10304 0.10226 0.15883 -0.01398 -0.00203 0.03828  300 TYR A C   
1530 O  O   . TYR A 195 ? 0.11487 0.10116 0.16260 -0.02874 0.02178  0.03559  300 TYR A O   
1531 C  CB  . TYR A 195 ? 0.11469 0.09365 0.16582 -0.00500 -0.02526 0.03620  300 TYR A CB  
1532 C  CG  . TYR A 195 ? 0.14725 0.09065 0.16487 -0.00869 -0.03182 0.04492  300 TYR A CG  
1533 C  CD1 . TYR A 195 ? 0.16672 0.11521 0.17260 -0.01457 -0.02143 0.05576  300 TYR A CD1 
1534 C  CD2 . TYR A 195 ? 0.17571 0.10043 0.17357 -0.02068 -0.03526 0.04074  300 TYR A CD2 
1535 C  CE1 . TYR A 195 ? 0.18992 0.14549 0.17068 -0.02032 -0.02817 0.06447  300 TYR A CE1 
1536 C  CE2 . TYR A 195 ? 0.18324 0.12202 0.16648 -0.01608 -0.03915 0.05071  300 TYR A CE2 
1537 C  CZ  . TYR A 195 ? 0.19788 0.14632 0.17883 -0.02122 -0.02905 0.06331  300 TYR A CZ  
1538 O  OH  . TYR A 195 ? 0.21097 0.15189 0.17581 -0.02546 -0.01991 0.07224  300 TYR A OH  
1539 N  N   . GLY A 196 ? 0.10017 0.11329 0.16516 -0.01812 0.00101  0.05144  301 GLY A N   
1540 C  CA  . GLY A 196 ? 0.09123 0.12537 0.16396 -0.02214 -0.00434 0.04864  301 GLY A CA  
1541 C  C   . GLY A 196 ? 0.10248 0.12077 0.17138 -0.02681 -0.01098 0.03569  301 GLY A C   
1542 O  O   . GLY A 196 ? 0.08370 0.11425 0.16800 -0.01679 -0.01717 0.02755  301 GLY A O   
1543 N  N   . SER A 197 ? 0.12652 0.13705 0.17371 -0.02282 -0.00566 0.03190  302 SER A N   
1544 C  CA  . SER A 197 ? 0.11592 0.13989 0.17691 -0.00858 0.00355  0.03093  302 SER A CA  
1545 C  C   . SER A 197 ? 0.10229 0.11818 0.17014 -0.01223 0.00711  0.02488  302 SER A C   
1546 O  O   . SER A 197 ? 0.09846 0.12356 0.18023 -0.00928 -0.00282 0.02083  302 SER A O   
1547 C  CB  . SER A 197 ? 0.11699 0.17179 0.18352 -0.01136 0.00470  0.02343  302 SER A CB  
1548 O  OG  . SER A 197 ? 0.13266 0.20536 0.18963 -0.01075 0.00329  0.02344  302 SER A OG  
1549 N  N   . VAL A 198 ? 0.07782 0.10942 0.16209 -0.00695 0.01183  0.01782  303 VAL A N   
1550 C  CA  . VAL A 198 ? 0.07434 0.10249 0.15510 -0.00466 0.01571  0.01755  303 VAL A CA  
1551 C  C   . VAL A 198 ? 0.08171 0.08116 0.15215 -0.00623 0.00749  0.01551  303 VAL A C   
1552 O  O   . VAL A 198 ? 0.10407 0.06266 0.14754 -0.00892 0.00878  0.02012  303 VAL A O   
1553 C  CB  . VAL A 198 ? 0.08323 0.10864 0.16018 0.00537  0.00729  0.03297  303 VAL A CB  
1554 C  CG1 . VAL A 198 ? 0.08566 0.12292 0.15630 0.00386  0.00784  0.02128  303 VAL A CG1 
1555 C  CG2 . VAL A 198 ? 0.07639 0.11121 0.16508 0.03026  0.00166  0.04937  303 VAL A CG2 
1556 N  N   . LEU A 199 ? 0.07567 0.08745 0.15471 0.00260  0.01055  -0.00469 304 LEU A N   
1557 C  CA  . LEU A 199 ? 0.07621 0.08717 0.15950 0.01111  0.01407  -0.01413 304 LEU A CA  
1558 C  C   . LEU A 199 ? 0.07428 0.07659 0.15036 0.00660  0.00487  -0.00607 304 LEU A C   
1559 O  O   . LEU A 199 ? 0.07373 0.09232 0.14916 -0.00594 0.00775  0.00600  304 LEU A O   
1560 C  CB  . LEU A 199 ? 0.07523 0.10542 0.16475 0.03084  0.00103  -0.02318 304 LEU A CB  
1561 C  CG  . LEU A 199 ? 0.09307 0.11911 0.16727 0.03724  -0.01249 -0.01410 304 LEU A CG  
1562 C  CD1 . LEU A 199 ? 0.08549 0.12688 0.16945 0.02714  0.00113  0.00768  304 LEU A CD1 
1563 C  CD2 . LEU A 199 ? 0.09222 0.13353 0.16884 0.05479  -0.01794 -0.01670 304 LEU A CD2 
1564 N  N   . ASP A 200 ? 0.06945 0.07070 0.14373 0.02603  0.00100  -0.00168 305 ASP A N   
1565 C  CA  . ASP A 200 ? 0.08119 0.07295 0.13941 0.02348  -0.00364 -0.00532 305 ASP A CA  
1566 C  C   . ASP A 200 ? 0.08509 0.06088 0.12319 0.02443  0.01041  -0.02075 305 ASP A C   
1567 O  O   . ASP A 200 ? 0.09099 0.07394 0.11445 0.00870  0.01373  -0.04138 305 ASP A O   
1568 C  CB  . ASP A 200 ? 0.08335 0.07417 0.14332 0.01509  -0.00096 -0.01065 305 ASP A CB  
1569 C  CG  . ASP A 200 ? 0.06007 0.07049 0.14049 0.00038  -0.00165 -0.00890 305 ASP A CG  
1570 O  OD1 . ASP A 200 ? 0.06267 0.10347 0.13747 0.02716  0.00026  -0.02112 305 ASP A OD1 
1571 O  OD2 . ASP A 200 ? 0.06638 0.06765 0.13872 0.00744  -0.00407 0.00091  305 ASP A OD2 
1572 N  N   . ILE A 201 ? 0.09073 0.06084 0.11520 0.03607  0.00061  -0.01838 306 ILE A N   
1573 C  CA  . ILE A 201 ? 0.08022 0.07945 0.11325 0.02324  0.00549  -0.01398 306 ILE A CA  
1574 C  C   . ILE A 201 ? 0.07291 0.07958 0.12719 0.01350  -0.00158 -0.00672 306 ILE A C   
1575 O  O   . ILE A 201 ? 0.06259 0.08479 0.13628 0.03162  -0.00368 0.00284  306 ILE A O   
1576 C  CB  . ILE A 201 ? 0.09730 0.08750 0.09497 0.00773  0.02434  -0.01815 306 ILE A CB  
1577 C  CG1 . ILE A 201 ? 0.11942 0.10332 0.09721 0.01137  0.02954  -0.02768 306 ILE A CG1 
1578 C  CG2 . ILE A 201 ? 0.10251 0.09010 0.08403 0.00701  0.01532  -0.00835 306 ILE A CG2 
1579 C  CD1 . ILE A 201 ? 0.14024 0.11164 0.10000 0.00299  0.02401  -0.03645 306 ILE A CD1 
1580 N  N   . PHE A 202 ? 0.07970 0.06910 0.13454 0.00543  -0.00592 -0.00157 307 PHE A N   
1581 C  CA  . PHE A 202 ? 0.07061 0.06573 0.13709 0.00990  -0.01512 -0.00057 307 PHE A CA  
1582 C  C   . PHE A 202 ? 0.05795 0.09748 0.13265 0.00692  -0.01098 0.00001  307 PHE A C   
1583 O  O   . PHE A 202 ? 0.06672 0.10922 0.14377 0.00661  -0.00494 -0.00343 307 PHE A O   
1584 C  CB  . PHE A 202 ? 0.10075 0.04446 0.14565 -0.00191 -0.02499 0.00807  307 PHE A CB  
1585 C  CG  . PHE A 202 ? 0.10654 0.04731 0.15640 -0.01242 -0.02750 0.00485  307 PHE A CG  
1586 C  CD1 . PHE A 202 ? 0.11105 0.06041 0.15938 -0.01971 -0.02409 0.01666  307 PHE A CD1 
1587 C  CD2 . PHE A 202 ? 0.11901 0.06242 0.16178 -0.01766 -0.02527 0.00530  307 PHE A CD2 
1588 C  CE1 . PHE A 202 ? 0.12198 0.05834 0.16595 -0.01318 -0.02280 0.01992  307 PHE A CE1 
1589 C  CE2 . PHE A 202 ? 0.13023 0.06403 0.16700 -0.01811 -0.02387 0.01227  307 PHE A CE2 
1590 C  CZ  . PHE A 202 ? 0.13296 0.07172 0.16592 -0.01722 -0.01574 0.01243  307 PHE A CZ  
1591 N  N   . GLY A 203 ? 0.05555 0.10132 0.12285 0.01487  -0.01338 0.00449  308 GLY A N   
1592 C  CA  . GLY A 203 ? 0.05725 0.11492 0.11570 0.00746  -0.01067 0.00053  308 GLY A CA  
1593 C  C   . GLY A 203 ? 0.05625 0.09383 0.10149 0.01247  -0.00609 0.00553  308 GLY A C   
1594 O  O   . GLY A 203 ? 0.07405 0.06892 0.09823 -0.00921 0.00156  0.00637  308 GLY A O   
1595 N  N   . PRO A 204 ? 0.05466 0.09700 0.09189 0.02756  0.00890  0.00692  309 PRO A N   
1596 C  CA  . PRO A 204 ? 0.06450 0.08715 0.09715 0.04243  0.01164  -0.00202 309 PRO A CA  
1597 C  C   . PRO A 204 ? 0.06642 0.07261 0.09824 0.02700  0.00559  -0.00312 309 PRO A C   
1598 O  O   . PRO A 204 ? 0.06888 0.07367 0.10785 0.01376  -0.00158 -0.00392 309 PRO A O   
1599 C  CB  . PRO A 204 ? 0.06751 0.10204 0.09504 0.04519  0.01104  0.00475  309 PRO A CB  
1600 C  CG  . PRO A 204 ? 0.06553 0.11567 0.09094 0.03799  0.00965  -0.01689 309 PRO A CG  
1601 C  CD  . PRO A 204 ? 0.05390 0.12704 0.09330 0.02963  0.01927  -0.01335 309 PRO A CD  
1602 N  N   . GLY A 205 ? 0.06139 0.07561 0.09813 0.02690  0.00755  -0.01380 310 GLY A N   
1603 C  CA  . GLY A 205 ? 0.05521 0.08214 0.09796 0.02782  -0.00010 -0.00288 310 GLY A CA  
1604 C  C   . GLY A 205 ? 0.07121 0.07232 0.10404 0.01966  0.00031  0.01748  310 GLY A C   
1605 O  O   . GLY A 205 ? 0.08316 0.09508 0.10419 0.00779  -0.01009 0.01866  310 GLY A O   
1606 N  N   . THR A 206 ? 0.07468 0.05812 0.10298 0.01660  0.00972  0.01686  311 THR A N   
1607 C  CA  . THR A 206 ? 0.08019 0.06351 0.12010 0.00548  0.00762  0.01971  311 THR A CA  
1608 C  C   . THR A 206 ? 0.08133 0.07976 0.08819 0.01865  0.00535  0.01039  311 THR A C   
1609 O  O   . THR A 206 ? 0.07555 0.08359 0.10402 0.01994  0.00460  0.00373  311 THR A O   
1610 C  CB  . THR A 206 ? 0.08451 0.07415 0.11440 -0.00168 0.00535  0.02821  311 THR A CB  
1611 O  OG1 . THR A 206 ? 0.10024 0.09651 0.11841 0.00081  0.01297  0.01624  311 THR A OG1 
1612 C  CG2 . THR A 206 ? 0.08920 0.09215 0.12067 0.02041  -0.00691 0.03640  311 THR A CG2 
1613 N  N   A ASP A 207 ? 0.07477 0.08688 0.10841 0.00281  0.00802  0.00457  312 ASP A N   
1614 N  N   B ASP A 207 ? 0.08655 0.08832 0.11176 0.01536  0.00994  0.00720  312 ASP A N   
1615 C  CA  A ASP A 207 ? 0.07887 0.07306 0.09797 -0.01420 0.01439  0.00200  312 ASP A CA  
1616 C  CA  B ASP A 207 ? 0.09549 0.08228 0.10502 0.01022  0.01696  0.00600  312 ASP A CA  
1617 C  C   A ASP A 207 ? 0.08345 0.07248 0.10120 0.00037  0.01152  0.00313  312 ASP A C   
1618 C  C   B ASP A 207 ? 0.08965 0.07234 0.10442 0.00986  0.01378  0.00636  312 ASP A C   
1619 O  O   A ASP A 207 ? 0.08722 0.09167 0.10049 0.00181  0.00729  -0.00218 312 ASP A O   
1620 O  O   B ASP A 207 ? 0.09180 0.08390 0.10334 0.01202  0.01146  0.00299  312 ASP A O   
1621 C  CB  A ASP A 207 ? 0.08259 0.06581 0.10449 -0.02245 0.00668  -0.01051 312 ASP A CB  
1622 C  CB  B ASP A 207 ? 0.10993 0.08776 0.11819 0.01597  0.01793  0.00034  312 ASP A CB  
1623 C  CG  A ASP A 207 ? 0.09166 0.07789 0.10243 -0.01808 -0.00423 -0.02465 312 ASP A CG  
1624 C  CG  B ASP A 207 ? 0.12504 0.09997 0.12340 0.02720  0.01552  -0.00652 312 ASP A CG  
1625 O  OD1 A ASP A 207 ? 0.09951 0.08500 0.10270 0.00095  -0.01584 -0.03234 312 ASP A OD1 
1626 O  OD1 B ASP A 207 ? 0.13550 0.10760 0.12852 0.03471  0.00941  -0.00915 312 ASP A OD1 
1627 O  OD2 A ASP A 207 ? 0.11274 0.09789 0.10774 -0.01310 -0.00638 -0.02550 312 ASP A OD2 
1628 O  OD2 B ASP A 207 ? 0.12798 0.11385 0.12500 0.03155  0.01819  -0.00579 312 ASP A OD2 
1629 N  N   . ILE A 208 ? 0.07985 0.05269 0.08700 0.00216  0.00989  0.00885  313 ILE A N   
1630 C  CA  . ILE A 208 ? 0.07345 0.05451 0.08513 -0.01813 0.01326  0.02054  313 ILE A CA  
1631 C  C   . ILE A 208 ? 0.07286 0.05622 0.08746 -0.02204 0.00768  0.01615  313 ILE A C   
1632 O  O   . ILE A 208 ? 0.08136 0.06336 0.09118 -0.01935 0.00122  0.02265  313 ILE A O   
1633 C  CB  . ILE A 208 ? 0.08048 0.06046 0.07912 -0.01149 0.00289  0.01145  313 ILE A CB  
1634 C  CG1 . ILE A 208 ? 0.08274 0.06839 0.09245 -0.01948 0.00200  -0.00653 313 ILE A CG1 
1635 C  CG2 . ILE A 208 ? 0.10490 0.06445 0.06762 0.00436  0.00292  0.02566  313 ILE A CG2 
1636 C  CD1 . ILE A 208 ? 0.09063 0.08429 0.09861 0.00179  -0.00115 -0.01303 313 ILE A CD1 
1637 N  N   . LEU A 209 ? 0.06504 0.07078 0.08795 0.00074  0.00860  0.01785  314 LEU A N   
1638 C  CA  . LEU A 209 ? 0.08210 0.07898 0.09270 -0.00084 0.02646  0.00686  314 LEU A CA  
1639 C  C   . LEU A 209 ? 0.07788 0.06813 0.09210 0.00066  0.01812  -0.00533 314 LEU A C   
1640 O  O   . LEU A 209 ? 0.10238 0.06799 0.09015 0.01182  0.01687  -0.01157 314 LEU A O   
1641 C  CB  . LEU A 209 ? 0.08166 0.09751 0.10150 -0.00411 0.03877  -0.00027 314 LEU A CB  
1642 C  CG  . LEU A 209 ? 0.07080 0.12305 0.10514 -0.00327 0.02397  -0.01556 314 LEU A CG  
1643 C  CD1 . LEU A 209 ? 0.06089 0.12300 0.10595 -0.00988 0.00487  -0.02450 314 LEU A CD1 
1644 C  CD2 . LEU A 209 ? 0.08083 0.14765 0.10740 0.01507  0.03372  -0.01912 314 LEU A CD2 
1645 N  N   . SER A 210 ? 0.06638 0.05726 0.08815 -0.00695 0.01558  0.00191  315 SER A N   
1646 C  CA  . SER A 210 ? 0.05301 0.07522 0.09293 0.00853  0.00250  0.01339  315 SER A CA  
1647 C  C   . SER A 210 ? 0.06438 0.08583 0.09287 0.00206  0.01351  0.01215  315 SER A C   
1648 O  O   . SER A 210 ? 0.05015 0.09564 0.09637 -0.00056 0.02226  0.02947  315 SER A O   
1649 C  CB  . SER A 210 ? 0.04438 0.07555 0.10355 0.02032  -0.00782 0.02484  315 SER A CB  
1650 O  OG  . SER A 210 ? 0.03806 0.08285 0.11183 -0.00221 -0.00621 0.03537  315 SER A OG  
1651 N  N   . THR A 211 ? 0.08435 0.08391 0.08735 0.01365  0.01021  -0.00021 316 THR A N   
1652 C  CA  . THR A 211 ? 0.09115 0.09051 0.08117 0.00158  0.00167  0.00468  316 THR A CA  
1653 C  C   . THR A 211 ? 0.08401 0.08596 0.07268 -0.01400 -0.00612 0.01270  316 THR A C   
1654 O  O   . THR A 211 ? 0.08517 0.09346 0.07559 -0.01207 -0.00139 -0.00905 316 THR A O   
1655 C  CB  . THR A 211 ? 0.09031 0.09975 0.07434 0.01042  0.00133  0.01336  316 THR A CB  
1656 O  OG1 . THR A 211 ? 0.08428 0.07489 0.06777 -0.00132 -0.01861 0.03183  316 THR A OG1 
1657 C  CG2 . THR A 211 ? 0.08667 0.10131 0.06614 0.02035  0.02472  0.00649  316 THR A CG2 
1658 N  N   . TRP A 212 ? 0.09208 0.07699 0.06901 -0.01282 -0.01435 0.00147  317 TRP A N   
1659 C  CA  . TRP A 212 ? 0.10136 0.09036 0.07240 -0.00632 -0.01264 0.00255  317 TRP A CA  
1660 C  C   . TRP A 212 ? 0.08480 0.08006 0.08197 -0.01358 -0.02708 -0.00544 317 TRP A C   
1661 O  O   . TRP A 212 ? 0.09777 0.08461 0.08054 -0.00757 -0.03935 -0.01033 317 TRP A O   
1662 C  CB  . TRP A 212 ? 0.09163 0.09904 0.07126 0.00711  -0.00075 0.00801  317 TRP A CB  
1663 C  CG  . TRP A 212 ? 0.09217 0.08880 0.07040 -0.00020 -0.00110 0.00270  317 TRP A CG  
1664 C  CD1 . TRP A 212 ? 0.10283 0.08280 0.06975 0.00427  -0.00233 0.01210  317 TRP A CD1 
1665 C  CD2 . TRP A 212 ? 0.09548 0.09315 0.06339 0.00654  -0.01156 0.00956  317 TRP A CD2 
1666 N  NE1 . TRP A 212 ? 0.10949 0.08732 0.07490 0.01038  -0.00825 0.01698  317 TRP A NE1 
1667 C  CE2 . TRP A 212 ? 0.10181 0.09752 0.07254 0.01084  -0.01184 0.00655  317 TRP A CE2 
1668 C  CE3 . TRP A 212 ? 0.09948 0.08962 0.06723 0.00637  -0.00822 0.01051  317 TRP A CE3 
1669 C  CZ2 . TRP A 212 ? 0.10862 0.09721 0.07721 0.01128  -0.02552 0.02938  317 TRP A CZ2 
1670 C  CZ3 . TRP A 212 ? 0.10673 0.10667 0.07191 0.01480  -0.00988 0.01000  317 TRP A CZ3 
1671 C  CH2 . TRP A 212 ? 0.10809 0.09773 0.07435 0.01499  -0.02675 0.01481  317 TRP A CH2 
1672 N  N   . ILE A 213 ? 0.07164 0.08025 0.08755 -0.01428 -0.03157 -0.01191 318 ILE A N   
1673 C  CA  . ILE A 213 ? 0.07859 0.10736 0.08944 -0.01807 -0.02358 -0.01435 318 ILE A CA  
1674 C  C   . ILE A 213 ? 0.09081 0.12554 0.07655 -0.02690 -0.03696 -0.01496 318 ILE A C   
1675 O  O   . ILE A 213 ? 0.07853 0.12641 0.07071 -0.02158 -0.03052 -0.01962 318 ILE A O   
1676 C  CB  . ILE A 213 ? 0.08995 0.11929 0.09705 0.00208  -0.01233 -0.01499 318 ILE A CB  
1677 C  CG1 . ILE A 213 ? 0.11782 0.12765 0.10156 -0.00940 0.00239  -0.03237 318 ILE A CG1 
1678 C  CG2 . ILE A 213 ? 0.07675 0.12579 0.09702 0.00802  -0.01801 -0.00987 318 ILE A CG2 
1679 C  CD1 . ILE A 213 ? 0.12405 0.12184 0.10105 -0.02161 0.01566  -0.03777 318 ILE A CD1 
1680 N  N   . GLY A 214 ? 0.08823 0.12517 0.08211 -0.03550 -0.03370 -0.01530 319 GLY A N   
1681 C  CA  . GLY A 214 ? 0.09930 0.12473 0.08664 -0.02254 -0.03210 -0.00304 319 GLY A CA  
1682 C  C   . GLY A 214 ? 0.11230 0.11199 0.09699 -0.03323 -0.02341 0.02327  319 GLY A C   
1683 O  O   . GLY A 214 ? 0.13129 0.12409 0.10030 -0.03961 -0.01328 0.02520  319 GLY A O   
1684 N  N   . GLY A 215 ? 0.10139 0.08898 0.09359 -0.03840 -0.02804 0.03315  320 GLY A N   
1685 C  CA  . GLY A 215 ? 0.09765 0.09547 0.10027 -0.00214 -0.03202 0.03929  320 GLY A CA  
1686 C  C   . GLY A 215 ? 0.08435 0.10539 0.09860 -0.00820 -0.01772 0.04827  320 GLY A C   
1687 O  O   . GLY A 215 ? 0.09533 0.13152 0.09872 -0.01486 -0.00583 0.04526  320 GLY A O   
1688 N  N   A SER A 216 ? 0.09090 0.09999 0.10479 -0.02401 -0.02113 0.05207  321 SER A N   
1689 N  N   B SER A 216 ? 0.08442 0.09782 0.10134 -0.02259 -0.01799 0.04770  321 SER A N   
1690 C  CA  A SER A 216 ? 0.08380 0.09845 0.10852 -0.01624 -0.02548 0.05041  321 SER A CA  
1691 C  CA  B SER A 216 ? 0.08347 0.09494 0.10380 -0.02291 -0.01805 0.04647  321 SER A CA  
1692 C  C   A SER A 216 ? 0.07026 0.09709 0.10623 -0.00857 -0.01993 0.03577  321 SER A C   
1693 C  C   B SER A 216 ? 0.07783 0.09574 0.10328 -0.01233 -0.01501 0.03775  321 SER A C   
1694 O  O   A SER A 216 ? 0.06761 0.09463 0.11093 -0.01084 -0.01950 0.03053  321 SER A O   
1695 O  O   B SER A 216 ? 0.07774 0.09319 0.10529 -0.01240 -0.01667 0.03763  321 SER A O   
1696 C  CB  A SER A 216 ? 0.09142 0.10876 0.11045 -0.00592 -0.03290 0.04227  321 SER A CB  
1697 C  CB  B SER A 216 ? 0.08893 0.09597 0.10337 -0.02804 -0.02007 0.04659  321 SER A CB  
1698 O  OG  A SER A 216 ? 0.09198 0.11023 0.11153 0.00970  -0.03005 0.03976  321 SER A OG  
1699 O  OG  B SER A 216 ? 0.08926 0.09237 0.10335 -0.03046 -0.01674 0.04895  321 SER A OG  
1700 N  N   . THR A 217 ? 0.07980 0.09908 0.10395 -0.00531 -0.00797 0.03111  322 THR A N   
1701 C  CA  . THR A 217 ? 0.08476 0.09790 0.10545 -0.00868 -0.01202 0.01759  322 THR A CA  
1702 C  C   . THR A 217 ? 0.08308 0.09195 0.11106 -0.02451 -0.02713 0.01509  322 THR A C   
1703 O  O   . THR A 217 ? 0.09623 0.11585 0.11070 -0.01258 -0.03031 0.01492  322 THR A O   
1704 C  CB  . THR A 217 ? 0.09358 0.11090 0.10764 -0.00189 0.00239  0.01794  322 THR A CB  
1705 O  OG1 . THR A 217 ? 0.09256 0.13260 0.10563 0.00821  0.01119  0.01612  322 THR A OG1 
1706 C  CG2 . THR A 217 ? 0.10526 0.12368 0.11684 -0.03454 -0.00754 0.01724  322 THR A CG2 
1707 N  N   . ARG A 218 ? 0.08777 0.07481 0.11174 -0.02646 -0.02424 0.01937  323 ARG A N   
1708 C  CA  . ARG A 218 ? 0.10646 0.09211 0.11416 -0.03445 -0.01804 0.00631  323 ARG A CA  
1709 C  C   . ARG A 218 ? 0.09296 0.08517 0.10741 -0.03428 -0.00370 0.01018  323 ARG A C   
1710 O  O   . ARG A 218 ? 0.09482 0.08955 0.10385 -0.03755 0.00835  0.00882  323 ARG A O   
1711 C  CB  . ARG A 218 ? 0.13278 0.11212 0.13400 -0.01177 -0.02607 -0.01188 323 ARG A CB  
1712 C  CG  . ARG A 218 ? 0.12234 0.11071 0.13847 0.00135  -0.03625 -0.01286 323 ARG A CG  
1713 C  CD  . ARG A 218 ? 0.12474 0.09272 0.14574 0.00251  -0.03809 -0.01980 323 ARG A CD  
1714 N  NE  . ARG A 218 ? 0.12264 0.06865 0.14943 0.00604  -0.05098 -0.00133 323 ARG A NE  
1715 C  CZ  . ARG A 218 ? 0.12327 0.06789 0.14870 0.01207  -0.03808 0.00895  323 ARG A CZ  
1716 N  NH1 . ARG A 218 ? 0.13272 0.07461 0.15111 0.02946  -0.02896 0.00393  323 ARG A NH1 
1717 N  NH2 . ARG A 218 ? 0.13013 0.06364 0.15213 0.01618  -0.03684 0.01896  323 ARG A NH2 
1718 N  N   A SER A 219 ? 0.09826 0.09130 0.10662 -0.03459 0.00726  0.00362  324 SER A N   
1719 N  N   B SER A 219 ? 0.08863 0.08955 0.10465 -0.03223 0.01092  0.00629  324 SER A N   
1720 C  CA  A SER A 219 ? 0.09804 0.10427 0.10373 -0.01404 0.01756  -0.00028 324 SER A CA  
1721 C  CA  B SER A 219 ? 0.08037 0.10368 0.09967 -0.01077 0.02633  0.00809  324 SER A CA  
1722 C  C   A SER A 219 ? 0.09700 0.11371 0.10369 -0.01175 0.01424  -0.00025 324 SER A C   
1723 C  C   B SER A 219 ? 0.08022 0.10539 0.09916 -0.01790 0.02190  0.00956  324 SER A C   
1724 O  O   A SER A 219 ? 0.10305 0.12941 0.10611 -0.00220 0.00859  -0.00110 324 SER A O   
1725 O  O   B SER A 219 ? 0.07281 0.10734 0.09702 -0.02012 0.02276  0.01534  324 SER A O   
1726 C  CB  A SER A 219 ? 0.09867 0.10550 0.09973 0.00159  0.02787  -0.00449 324 SER A CB  
1727 C  CB  B SER A 219 ? 0.07452 0.11376 0.09490 0.01401  0.04225  0.00864  324 SER A CB  
1728 O  OG  A SER A 219 ? 0.09414 0.09775 0.09290 0.00217  0.03873  -0.01079 324 SER A OG  
1729 O  OG  B SER A 219 ? 0.07112 0.11390 0.08998 0.01632  0.04450  0.00417  324 SER A OG  
1730 N  N   . ILE A 220 ? 0.08462 0.10643 0.10243 -0.01831 0.01112  0.00347  325 ILE A N   
1731 C  CA  . ILE A 220 ? 0.09042 0.11924 0.11038 -0.01610 0.00523  -0.01050 325 ILE A CA  
1732 C  C   . ILE A 220 ? 0.07759 0.10830 0.10926 -0.01074 0.00588  -0.00227 325 ILE A C   
1733 O  O   . ILE A 220 ? 0.06616 0.10276 0.09792 -0.01707 0.02339  -0.00906 325 ILE A O   
1734 C  CB  . ILE A 220 ? 0.10232 0.15290 0.11209 -0.00550 -0.00167 -0.01703 325 ILE A CB  
1735 C  CG1 . ILE A 220 ? 0.09467 0.16306 0.11327 0.00701  0.00970  -0.02169 325 ILE A CG1 
1736 C  CG2 . ILE A 220 ? 0.11783 0.16736 0.11871 -0.01164 -0.01979 -0.01472 325 ILE A CG2 
1737 C  CD1 . ILE A 220 ? 0.09993 0.15411 0.11009 -0.00615 0.00696  -0.02384 325 ILE A CD1 
1738 N  N   . SER A 221 ? 0.07721 0.09664 0.11636 0.00689  -0.00025 0.00461  326 SER A N   
1739 C  CA  . SER A 221 ? 0.07837 0.10935 0.12015 0.00978  0.00774  0.01138  326 SER A CA  
1740 C  C   . SER A 221 ? 0.07708 0.10788 0.11624 0.01295  0.01762  0.01360  326 SER A C   
1741 O  O   . SER A 221 ? 0.08556 0.13979 0.11684 0.02650  0.01409  0.02374  326 SER A O   
1742 C  CB  . SER A 221 ? 0.09345 0.12140 0.12177 -0.00000 0.00954  0.01594  326 SER A CB  
1743 O  OG  . SER A 221 ? 0.10148 0.13178 0.11793 0.00039  0.00325  0.01222  326 SER A OG  
1744 N  N   . GLY A 222 ? 0.09215 0.10514 0.11427 0.00299  0.02058  0.01269  327 GLY A N   
1745 C  CA  . GLY A 222 ? 0.08980 0.11006 0.10858 0.00543  0.01445  0.00745  327 GLY A CA  
1746 C  C   . GLY A 222 ? 0.08189 0.09794 0.11062 -0.00135 0.00951  0.00718  327 GLY A C   
1747 O  O   . GLY A 222 ? 0.08478 0.08218 0.11457 -0.00189 0.00017  0.00660  327 GLY A O   
1748 N  N   . THR A 223 ? 0.07473 0.09215 0.10334 0.00035  0.01802  0.00859  328 THR A N   
1749 C  CA  . THR A 223 ? 0.08043 0.07865 0.10453 0.00844  0.02247  0.01357  328 THR A CA  
1750 C  C   . THR A 223 ? 0.07880 0.08665 0.09226 0.00975  0.02498  0.00186  328 THR A C   
1751 O  O   . THR A 223 ? 0.06724 0.10074 0.09107 0.02525  0.01387  -0.01172 328 THR A O   
1752 C  CB  . THR A 223 ? 0.08572 0.06342 0.10985 0.00059  0.02927  0.01633  328 THR A CB  
1753 O  OG1 . THR A 223 ? 0.07977 0.04297 0.11725 -0.00674 0.02713  0.01477  328 THR A OG1 
1754 C  CG2 . THR A 223 ? 0.09186 0.07759 0.11417 0.00564  0.01939  0.02919  328 THR A CG2 
1755 N  N   . SER A 224 ? 0.10819 0.08336 0.08774 0.00079  0.02899  -0.01426 329 SER A N   
1756 C  CA  . SER A 224 ? 0.11281 0.09200 0.07870 -0.00802 0.01452  -0.02120 329 SER A CA  
1757 C  C   . SER A 224 ? 0.09518 0.09399 0.07407 0.00533  0.00893  -0.01658 329 SER A C   
1758 O  O   . SER A 224 ? 0.10014 0.10205 0.07468 0.00276  0.00350  -0.00857 329 SER A O   
1759 C  CB  . SER A 224 ? 0.12941 0.10887 0.08745 -0.00238 0.00704  -0.02672 329 SER A CB  
1760 O  OG  . SER A 224 ? 0.13652 0.12638 0.09185 0.01231  0.00676  -0.02486 329 SER A OG  
1761 N  N   . MET A 225 ? 0.06782 0.09256 0.07114 0.01396  -0.00564 -0.02427 330 MET A N   
1762 C  CA  . MET A 225 ? 0.07923 0.09063 0.06821 -0.00824 -0.01146 -0.01820 330 MET A CA  
1763 C  C   . MET A 225 ? 0.06041 0.07622 0.06768 0.00371  -0.00648 -0.00298 330 MET A C   
1764 O  O   . MET A 225 ? 0.07787 0.07618 0.06656 -0.00156 -0.01892 -0.00656 330 MET A O   
1765 C  CB  . MET A 225 ? 0.09519 0.09802 0.07424 -0.00789 -0.01095 -0.02652 330 MET A CB  
1766 C  CG  . MET A 225 ? 0.11726 0.10648 0.07847 0.00415  -0.00558 -0.02251 330 MET A CG  
1767 S  SD  . MET A 225 ? 0.12877 0.09853 0.07840 0.01582  -0.00741 0.00925  330 MET A SD  
1768 C  CE  . MET A 225 ? 0.14163 0.10735 0.07843 0.01764  -0.01326 0.02853  330 MET A CE  
1769 N  N   . ALA A 226 ? 0.06247 0.08011 0.08229 0.01412  0.00661  -0.00247 331 ALA A N   
1770 C  CA  . ALA A 226 ? 0.07274 0.06584 0.08193 0.00164  0.00995  0.00533  331 ALA A CA  
1771 C  C   . ALA A 226 ? 0.06846 0.06799 0.07968 0.01230  0.01521  0.00523  331 ALA A C   
1772 O  O   . ALA A 226 ? 0.08655 0.08263 0.07808 0.00094  0.01978  0.00678  331 ALA A O   
1773 C  CB  . ALA A 226 ? 0.07536 0.04512 0.08447 -0.02331 0.02645  0.00376  331 ALA A CB  
1774 N  N   . THR A 227 ? 0.05637 0.05700 0.07474 0.01031  0.01764  -0.00018 332 THR A N   
1775 C  CA  . THR A 227 ? 0.05355 0.06612 0.06837 0.00504  0.01504  -0.00278 332 THR A CA  
1776 C  C   . THR A 227 ? 0.06313 0.07029 0.06056 -0.00872 0.01278  0.00499  332 THR A C   
1777 O  O   . THR A 227 ? 0.07111 0.08383 0.06452 -0.00738 0.00884  0.00178  332 THR A O   
1778 C  CB  . THR A 227 ? 0.06971 0.06970 0.07858 0.01342  0.01202  -0.00623 332 THR A CB  
1779 O  OG1 . THR A 227 ? 0.07694 0.09714 0.07758 -0.01112 0.02899  -0.00647 332 THR A OG1 
1780 C  CG2 . THR A 227 ? 0.08260 0.07418 0.08405 0.02317  -0.00892 -0.01070 332 THR A CG2 
1781 N  N   . PRO A 228 ? 0.06120 0.07200 0.05835 -0.00413 0.00505  0.00617  333 PRO A N   
1782 C  CA  . PRO A 228 ? 0.05560 0.08679 0.05600 -0.01433 0.01245  0.00332  333 PRO A CA  
1783 C  C   . PRO A 228 ? 0.04918 0.06880 0.06189 0.00481  0.01780  0.00302  333 PRO A C   
1784 O  O   . PRO A 228 ? 0.06229 0.06566 0.05479 -0.00353 0.02088  -0.00987 333 PRO A O   
1785 C  CB  . PRO A 228 ? 0.05497 0.09182 0.05128 -0.01213 -0.01097 0.02000  333 PRO A CB  
1786 C  CG  . PRO A 228 ? 0.05174 0.10166 0.05165 -0.01175 0.00485  0.02440  333 PRO A CG  
1787 C  CD  . PRO A 228 ? 0.05810 0.09745 0.05938 -0.00660 0.00919  0.00893  333 PRO A CD  
1788 N  N   . HIS A 229 ? 0.03220 0.06990 0.07236 0.00522  0.00923  -0.01100 334 HIS A N   
1789 C  CA  . HIS A 229 ? 0.03481 0.07159 0.08057 0.01518  0.00802  0.00110  334 HIS A CA  
1790 C  C   . HIS A 229 ? 0.04776 0.08004 0.08486 0.01485  -0.00201 0.00944  334 HIS A C   
1791 O  O   . HIS A 229 ? 0.05948 0.09766 0.08925 0.01781  -0.01270 0.02454  334 HIS A O   
1792 C  CB  . HIS A 229 ? 0.05130 0.07684 0.09782 0.03288  0.00035  0.00967  334 HIS A CB  
1793 C  CG  . HIS A 229 ? 0.05929 0.08521 0.11046 0.02177  0.02061  0.01636  334 HIS A CG  
1794 N  ND1 . HIS A 229 ? 0.06351 0.10505 0.10355 0.00496  0.02783  0.01823  334 HIS A ND1 
1795 C  CD2 . HIS A 229 ? 0.06379 0.08122 0.11424 0.02409  0.01505  0.01403  334 HIS A CD2 
1796 C  CE1 . HIS A 229 ? 0.06519 0.10618 0.10172 0.01753  0.02440  0.01743  334 HIS A CE1 
1797 N  NE2 . HIS A 229 ? 0.06029 0.08920 0.11157 0.02693  0.02119  0.00358  334 HIS A NE2 
1798 N  N   . VAL A 230 ? 0.04706 0.06640 0.08946 0.02804  -0.01358 0.00791  335 VAL A N   
1799 C  CA  . VAL A 230 ? 0.06578 0.07833 0.09862 0.02018  -0.00723 0.00747  335 VAL A CA  
1800 C  C   . VAL A 230 ? 0.06635 0.06770 0.09615 0.01096  -0.00150 -0.00947 335 VAL A C   
1801 O  O   . VAL A 230 ? 0.07419 0.07714 0.09616 0.01100  -0.00216 -0.02144 335 VAL A O   
1802 C  CB  . VAL A 230 ? 0.06265 0.08873 0.10260 0.00604  -0.00981 0.01059  335 VAL A CB  
1803 C  CG1 . VAL A 230 ? 0.05468 0.10343 0.10488 0.00106  -0.00529 -0.00520 335 VAL A CG1 
1804 C  CG2 . VAL A 230 ? 0.07571 0.09547 0.10223 0.02385  -0.03231 0.01377  335 VAL A CG2 
1805 N  N   . ALA A 231 ? 0.06151 0.06273 0.09377 0.00704  -0.00164 -0.01372 336 ALA A N   
1806 C  CA  . ALA A 231 ? 0.06703 0.07704 0.09500 -0.00446 -0.01488 -0.01317 336 ALA A CA  
1807 C  C   . ALA A 231 ? 0.06243 0.09312 0.09301 -0.00054 -0.02175 -0.00877 336 ALA A C   
1808 O  O   . ALA A 231 ? 0.05946 0.09133 0.08969 0.00555  -0.01910 0.00378  336 ALA A O   
1809 C  CB  . ALA A 231 ? 0.08079 0.06697 0.10077 -0.02355 -0.02332 -0.01733 336 ALA A CB  
1810 N  N   . GLY A 232 ? 0.06044 0.11326 0.09602 -0.01023 -0.03246 -0.02139 337 GLY A N   
1811 C  CA  . GLY A 232 ? 0.05608 0.12709 0.09694 0.00120  -0.03362 -0.02322 337 GLY A CA  
1812 C  C   . GLY A 232 ? 0.06537 0.11933 0.09377 0.01231  -0.01261 -0.02684 337 GLY A C   
1813 O  O   . GLY A 232 ? 0.08144 0.12474 0.09321 0.00920  -0.01850 -0.02741 337 GLY A O   
1814 N  N   . LEU A 233 ? 0.06253 0.11614 0.08581 0.00625  -0.00089 -0.03073 338 LEU A N   
1815 C  CA  . LEU A 233 ? 0.05801 0.10332 0.07429 -0.00533 -0.00166 -0.03300 338 LEU A CA  
1816 C  C   . LEU A 233 ? 0.06242 0.10818 0.07091 -0.00359 0.00563  -0.02891 338 LEU A C   
1817 O  O   . LEU A 233 ? 0.07260 0.10953 0.07178 -0.00162 0.02672  -0.03858 338 LEU A O   
1818 C  CB  . LEU A 233 ? 0.06884 0.11521 0.06491 -0.00490 0.00860  -0.03921 338 LEU A CB  
1819 C  CG  . LEU A 233 ? 0.08057 0.12664 0.06486 0.00717  0.00147  -0.03077 338 LEU A CG  
1820 C  CD1 . LEU A 233 ? 0.09393 0.14724 0.06861 0.02310  0.01077  -0.02424 338 LEU A CD1 
1821 C  CD2 . LEU A 233 ? 0.08436 0.12151 0.06405 -0.00762 -0.00096 -0.03025 338 LEU A CD2 
1822 N  N   . ALA A 234 ? 0.06135 0.10692 0.07269 -0.00195 0.00464  -0.02641 339 ALA A N   
1823 C  CA  . ALA A 234 ? 0.08253 0.11621 0.07147 0.00632  0.00556  -0.02804 339 ALA A CA  
1824 C  C   . ALA A 234 ? 0.08203 0.10466 0.06613 -0.00904 0.00571  -0.02771 339 ALA A C   
1825 O  O   . ALA A 234 ? 0.07709 0.10485 0.06668 -0.01131 -0.01231 -0.03070 339 ALA A O   
1826 C  CB  . ALA A 234 ? 0.07059 0.11995 0.06796 0.01535  0.01057  -0.04221 339 ALA A CB  
1827 N  N   . ALA A 235 ? 0.08198 0.09738 0.06936 -0.00870 0.02886  -0.02888 340 ALA A N   
1828 C  CA  . ALA A 235 ? 0.10154 0.11514 0.07398 -0.00858 0.01477  -0.02302 340 ALA A CA  
1829 C  C   . ALA A 235 ? 0.09522 0.11591 0.07195 -0.00090 0.00592  -0.03536 340 ALA A C   
1830 O  O   . ALA A 235 ? 0.10115 0.10952 0.07294 0.00631  0.00512  -0.04569 340 ALA A O   
1831 C  CB  . ALA A 235 ? 0.10820 0.13264 0.07768 -0.00710 0.00544  -0.01263 340 ALA A CB  
1832 N  N   . TYR A 236 ? 0.08997 0.13221 0.07162 -0.00902 0.00301  -0.04425 341 TYR A N   
1833 C  CA  . TYR A 236 ? 0.07741 0.14164 0.07641 0.00778  0.00064  -0.03612 341 TYR A CA  
1834 C  C   . TYR A 236 ? 0.07470 0.15208 0.08496 0.01171  0.00242  -0.02869 341 TYR A C   
1835 O  O   . TYR A 236 ? 0.09507 0.16038 0.08783 0.01055  -0.00583 -0.02478 341 TYR A O   
1836 C  CB  . TYR A 236 ? 0.07807 0.14514 0.06942 0.02496  0.00053  -0.04255 341 TYR A CB  
1837 C  CG  . TYR A 236 ? 0.09145 0.15256 0.07060 0.00928  -0.00578 -0.05257 341 TYR A CG  
1838 C  CD1 . TYR A 236 ? 0.09328 0.15734 0.06692 0.00325  -0.00757 -0.04899 341 TYR A CD1 
1839 C  CD2 . TYR A 236 ? 0.11356 0.17217 0.07265 0.00748  -0.00763 -0.05342 341 TYR A CD2 
1840 C  CE1 . TYR A 236 ? 0.09268 0.17289 0.07134 0.01971  -0.00396 -0.05136 341 TYR A CE1 
1841 C  CE2 . TYR A 236 ? 0.11305 0.18222 0.07776 0.01465  -0.00480 -0.05723 341 TYR A CE2 
1842 C  CZ  . TYR A 236 ? 0.10634 0.18381 0.07648 0.01989  -0.00688 -0.05552 341 TYR A CZ  
1843 O  OH  . TYR A 236 ? 0.13333 0.19551 0.07785 0.01333  0.00119  -0.05611 341 TYR A OH  
1844 N  N   . LEU A 237 ? 0.05296 0.14334 0.08870 0.00780  -0.00507 -0.01831 342 LEU A N   
1845 C  CA  . LEU A 237 ? 0.06509 0.14951 0.09523 0.00261  -0.00380 -0.00825 342 LEU A CA  
1846 C  C   . LEU A 237 ? 0.07764 0.15254 0.09393 0.00985  0.00924  -0.01298 342 LEU A C   
1847 O  O   . LEU A 237 ? 0.08357 0.15216 0.09700 -0.00055 0.01326  -0.01160 342 LEU A O   
1848 C  CB  . LEU A 237 ? 0.06058 0.15317 0.09428 0.00940  -0.00399 0.00004  342 LEU A CB  
1849 C  CG  . LEU A 237 ? 0.09037 0.15994 0.09796 0.01208  0.01331  -0.01258 342 LEU A CG  
1850 C  CD1 . LEU A 237 ? 0.09554 0.16524 0.10638 0.00255  0.01741  -0.01776 342 LEU A CD1 
1851 C  CD2 . LEU A 237 ? 0.10354 0.16387 0.09532 -0.00249 0.02064  -0.01259 342 LEU A CD2 
1852 N  N   A MET A 238 ? 0.06563 0.14913 0.09376 0.02695  0.02003  -0.01973 343 MET A N   
1853 N  N   B MET A 238 ? 0.08069 0.15327 0.09629 0.00962  0.01146  -0.01384 343 MET A N   
1854 C  CA  A MET A 238 ? 0.07891 0.15216 0.09207 0.01881  0.01082  -0.02034 343 MET A CA  
1855 C  CA  B MET A 238 ? 0.08614 0.15225 0.09561 0.00555  0.00941  -0.01393 343 MET A CA  
1856 C  C   A MET A 238 ? 0.08195 0.16419 0.09497 0.01591  0.01373  -0.01156 343 MET A C   
1857 C  C   B MET A 238 ? 0.08731 0.16108 0.09790 0.00777  0.00815  -0.00872 343 MET A C   
1858 O  O   A MET A 238 ? 0.06892 0.16199 0.09739 0.01460  0.01256  -0.00564 343 MET A O   
1859 O  O   B MET A 238 ? 0.08222 0.15941 0.09907 0.00872  0.00663  -0.00682 343 MET A O   
1860 C  CB  A MET A 238 ? 0.10075 0.15130 0.09573 0.01912  -0.00342 -0.02831 343 MET A CB  
1861 C  CB  B MET A 238 ? 0.09068 0.14400 0.09485 -0.00273 0.00765  -0.01939 343 MET A CB  
1862 C  CG  A MET A 238 ? 0.10664 0.15418 0.09811 0.01962  -0.00495 -0.02773 343 MET A CG  
1863 C  CG  B MET A 238 ? 0.09353 0.13790 0.09299 -0.01162 0.00905  -0.02485 343 MET A CG  
1864 S  SD  A MET A 238 ? 0.10706 0.14523 0.09714 0.03676  -0.01195 -0.01127 343 MET A SD  
1865 S  SD  B MET A 238 ? 0.09409 0.13315 0.09095 -0.01849 0.01071  -0.02806 343 MET A SD  
1866 C  CE  A MET A 238 ? 0.12552 0.13799 0.10440 0.04476  -0.00500 -0.00016 343 MET A CE  
1867 C  CE  B MET A 238 ? 0.09260 0.12842 0.08958 -0.02001 0.01184  -0.02930 343 MET A CE  
1868 N  N   . THR A 239 ? 0.08905 0.17039 0.09555 0.00852  0.00590  -0.00549 344 THR A N   
1869 C  CA  . THR A 239 ? 0.08002 0.20668 0.10961 -0.00773 -0.00950 -0.01322 344 THR A CA  
1870 C  C   . THR A 239 ? 0.07940 0.22235 0.11521 0.00394  -0.00540 -0.01696 344 THR A C   
1871 O  O   . THR A 239 ? 0.06707 0.23843 0.11726 0.00773  -0.01966 -0.01564 344 THR A O   
1872 C  CB  . THR A 239 ? 0.06693 0.21425 0.10261 -0.01066 -0.01923 -0.00749 344 THR A CB  
1873 O  OG1 . THR A 239 ? 0.08077 0.22569 0.10456 -0.01064 -0.03054 -0.00507 344 THR A OG1 
1874 C  CG2 . THR A 239 ? 0.07665 0.20792 0.10744 -0.01169 -0.01979 -0.00864 344 THR A CG2 
1875 N  N   . LEU A 240 ? 0.08509 0.22399 0.13012 0.00469  0.00505  -0.02394 345 LEU A N   
1876 C  CA  . LEU A 240 ? 0.08970 0.23210 0.14167 0.00913  -0.01099 -0.02403 345 LEU A CA  
1877 C  C   . LEU A 240 ? 0.08638 0.22973 0.14253 0.00919  -0.01826 -0.02130 345 LEU A C   
1878 O  O   . LEU A 240 ? 0.10117 0.23129 0.14716 0.00707  -0.01586 -0.03786 345 LEU A O   
1879 C  CB  . LEU A 240 ? 0.11504 0.25025 0.15134 0.01708  -0.01609 -0.01919 345 LEU A CB  
1880 C  CG  . LEU A 240 ? 0.14001 0.26015 0.16013 0.03271  -0.02614 -0.02079 345 LEU A CG  
1881 C  CD1 . LEU A 240 ? 0.15710 0.25894 0.15978 0.05532  -0.02662 -0.01446 345 LEU A CD1 
1882 C  CD2 . LEU A 240 ? 0.14758 0.26843 0.16681 0.02913  -0.01542 -0.02363 345 LEU A CD2 
1883 N  N   . GLY A 241 ? 0.05670 0.21039 0.14806 0.01156  -0.01661 -0.00765 346 GLY A N   
1884 C  CA  . GLY A 241 ? 0.06596 0.21211 0.15569 0.00206  -0.02560 -0.01167 346 GLY A CA  
1885 C  C   . GLY A 241 ? 0.07245 0.19943 0.16058 -0.00794 -0.02539 -0.03216 346 GLY A C   
1886 O  O   . GLY A 241 ? 0.07889 0.20124 0.16197 -0.01309 -0.02248 -0.04560 346 GLY A O   
1887 N  N   . LYS A 242 ? 0.08387 0.20158 0.16347 -0.00533 -0.02212 -0.02855 347 LYS A N   
1888 C  CA  . LYS A 242 ? 0.09977 0.21129 0.17089 0.00916  -0.02144 -0.02952 347 LYS A CA  
1889 C  C   . LYS A 242 ? 0.08904 0.19627 0.15867 0.00739  -0.02173 -0.03827 347 LYS A C   
1890 O  O   . LYS A 242 ? 0.08218 0.19850 0.16085 0.00441  -0.02290 -0.04775 347 LYS A O   
1891 C  CB  . LYS A 242 ? 0.13795 0.24644 0.19357 0.02196  -0.01311 -0.02290 347 LYS A CB  
1892 C  CG  . LYS A 242 ? 0.16552 0.27847 0.21064 0.03096  0.00005  -0.01703 347 LYS A CG  
1893 C  CD  . LYS A 242 ? 0.20229 0.30973 0.22486 0.03071  0.00602  -0.01549 347 LYS A CD  
1894 C  CE  . LYS A 242 ? 0.24241 0.33454 0.23426 0.03683  0.00941  -0.01738 347 LYS A CE  
1895 N  NZ  . LYS A 242 ? 0.26615 0.34514 0.24096 0.04645  0.00542  -0.01194 347 LYS A NZ  
1896 N  N   . THR A 243 ? 0.09477 0.18435 0.15261 0.01860  -0.02076 -0.04041 348 THR A N   
1897 C  CA  . THR A 243 ? 0.09506 0.18782 0.14803 0.00509  -0.02012 -0.03899 348 THR A CA  
1898 C  C   . THR A 243 ? 0.10618 0.19076 0.14935 0.01044  -0.01863 -0.04172 348 THR A C   
1899 O  O   . THR A 243 ? 0.12386 0.19474 0.15412 0.02068  -0.02589 -0.04060 348 THR A O   
1900 C  CB  . THR A 243 ? 0.09191 0.16878 0.14291 0.00555  -0.01363 -0.03516 348 THR A CB  
1901 O  OG1 . THR A 243 ? 0.09352 0.16388 0.13459 0.01215  -0.00507 -0.03405 348 THR A OG1 
1902 C  CG2 . THR A 243 ? 0.08221 0.15614 0.14452 -0.01037 -0.02555 -0.04419 348 THR A CG2 
1903 N  N   . THR A 244 ? 0.11457 0.18525 0.14991 0.00888  -0.01053 -0.04673 349 THR A N   
1904 C  CA  . THR A 244 ? 0.12822 0.19256 0.15420 0.00940  -0.01067 -0.03451 349 THR A CA  
1905 C  C   . THR A 244 ? 0.13739 0.18722 0.15814 0.01692  -0.01355 -0.03555 349 THR A C   
1906 O  O   . THR A 244 ? 0.14613 0.18594 0.15717 0.01399  -0.02211 -0.03469 349 THR A O   
1907 C  CB  . THR A 244 ? 0.14224 0.22095 0.14947 0.00754  -0.00950 -0.02011 349 THR A CB  
1908 O  OG1 . THR A 244 ? 0.14226 0.23849 0.14708 0.00533  0.00356  -0.01921 349 THR A OG1 
1909 C  CG2 . THR A 244 ? 0.16242 0.23429 0.15416 0.00926  -0.01593 -0.02112 349 THR A CG2 
1910 N  N   . ALA A 245 ? 0.14154 0.18134 0.15892 0.03566  -0.00805 -0.03509 350 ALA A N   
1911 C  CA  . ALA A 245 ? 0.14280 0.16970 0.15620 0.04096  -0.00368 -0.03293 350 ALA A CA  
1912 C  C   . ALA A 245 ? 0.13268 0.17207 0.14529 0.03393  -0.00405 -0.03518 350 ALA A C   
1913 O  O   . ALA A 245 ? 0.14087 0.18085 0.14477 0.02524  -0.00231 -0.04024 350 ALA A O   
1914 C  CB  . ALA A 245 ? 0.15270 0.15905 0.15758 0.04611  -0.00011 -0.03351 350 ALA A CB  
1915 N  N   . ALA A 246 ? 0.12524 0.16759 0.14229 0.03598  -0.01196 -0.03502 351 ALA A N   
1916 C  CA  . ALA A 246 ? 0.12578 0.16440 0.13690 0.04716  -0.02099 -0.02906 351 ALA A CA  
1917 C  C   . ALA A 246 ? 0.12239 0.16751 0.13205 0.03240  -0.01441 -0.03216 351 ALA A C   
1918 O  O   . ALA A 246 ? 0.12277 0.16695 0.12565 0.03012  0.00057  -0.03465 351 ALA A O   
1919 C  CB  . ALA A 246 ? 0.13640 0.17939 0.14725 0.04562  -0.03181 -0.02426 351 ALA A CB  
1920 N  N   A SER A 247 ? 0.10152 0.16463 0.12802 0.02913  -0.02064 -0.03485 352 SER A N   
1921 N  N   B SER A 247 ? 0.10816 0.16344 0.12567 0.03383  -0.02011 -0.02962 352 SER A N   
1922 C  CA  A SER A 247 ? 0.08888 0.16680 0.12927 0.01805  -0.02009 -0.03833 352 SER A CA  
1923 C  CA  B SER A 247 ? 0.09801 0.16302 0.12353 0.02579  -0.02031 -0.02604 352 SER A CA  
1924 C  C   A SER A 247 ? 0.07468 0.16393 0.12720 0.01207  -0.02063 -0.03145 352 SER A C   
1925 C  C   B SER A 247 ? 0.07901 0.16084 0.12479 0.01719  -0.02067 -0.02421 352 SER A C   
1926 O  O   A SER A 247 ? 0.07768 0.16398 0.12115 0.00384  -0.02066 -0.03378 352 SER A O   
1927 O  O   B SER A 247 ? 0.08047 0.16001 0.11935 0.01225  -0.02063 -0.02439 352 SER A O   
1928 C  CB  A SER A 247 ? 0.09234 0.17238 0.13269 0.00966  -0.00617 -0.05321 352 SER A CB  
1929 C  CB  B SER A 247 ? 0.10842 0.16532 0.12241 0.02295  -0.00909 -0.02746 352 SER A CB  
1930 O  OG  A SER A 247 ? 0.09451 0.17498 0.13534 0.00358  -0.00409 -0.05974 352 SER A OG  
1931 O  OG  B SER A 247 ? 0.11606 0.16416 0.11982 0.02303  -0.00712 -0.02217 352 SER A OG  
1932 N  N   . ALA A 248 ? 0.06673 0.15423 0.12255 0.01069  -0.01815 -0.02654 353 ALA A N   
1933 C  CA  . ALA A 248 ? 0.07039 0.13743 0.12896 0.00665  -0.00810 -0.02481 353 ALA A CA  
1934 C  C   . ALA A 248 ? 0.07414 0.11349 0.12003 0.00578  -0.00415 -0.03665 353 ALA A C   
1935 O  O   . ALA A 248 ? 0.08619 0.09807 0.12207 0.01840  -0.00285 -0.04819 353 ALA A O   
1936 C  CB  . ALA A 248 ? 0.05073 0.12954 0.12401 0.00526  -0.01060 -0.02382 353 ALA A CB  
1937 N  N   . CYS A 249 ? 0.07940 0.12428 0.12082 -0.01464 -0.00286 -0.03094 354 CYS A N   
1938 C  CA  . CYS A 249 ? 0.08000 0.11831 0.12046 -0.00985 -0.00204 -0.02516 354 CYS A CA  
1939 C  C   . CYS A 249 ? 0.08696 0.14305 0.13333 0.00364  0.00056  -0.03004 354 CYS A C   
1940 O  O   . CYS A 249 ? 0.06561 0.13037 0.13883 0.01919  0.00588  -0.03377 354 CYS A O   
1941 C  CB  . CYS A 249 ? 0.09159 0.09968 0.12071 0.00082  0.00598  -0.01117 354 CYS A CB  
1942 S  SG  . CYS A 249 ? 0.09746 0.08182 0.11348 -0.00154 0.01470  -0.01321 354 CYS A SG  
1943 N  N   . ARG A 250 ? 0.09942 0.17933 0.14142 -0.00473 -0.00598 -0.04801 355 ARG A N   
1944 C  CA  . ARG A 250 ? 0.12155 0.19294 0.15429 -0.00147 -0.01142 -0.07042 355 ARG A CA  
1945 C  C   . ARG A 250 ? 0.10016 0.17556 0.13874 -0.00223 -0.01451 -0.06654 355 ARG A C   
1946 O  O   . ARG A 250 ? 0.08079 0.18205 0.15014 -0.01205 -0.01663 -0.05660 355 ARG A O   
1947 C  CB  . ARG A 250 ? 0.15142 0.22402 0.18742 0.00243  -0.01131 -0.09419 355 ARG A CB  
1948 C  CG  . ARG A 250 ? 0.19380 0.26942 0.23421 0.00333  -0.00342 -0.09954 355 ARG A CG  
1949 C  CD  . ARG A 250 ? 0.23410 0.30757 0.27985 0.01602  -0.00133 -0.09815 355 ARG A CD  
1950 N  NE  . ARG A 250 ? 0.29034 0.34728 0.31642 0.00615  -0.00081 -0.09616 355 ARG A NE  
1951 C  CZ  . ARG A 250 ? 0.33098 0.38029 0.35011 0.00270  0.00222  -0.09391 355 ARG A CZ  
1952 N  NH1 . ARG A 250 ? 0.36378 0.39450 0.36378 0.00109  -0.00153 -0.09336 355 ARG A NH1 
1953 N  NH2 . ARG A 250 ? 0.36897 0.39857 0.36897 -0.00080 0.00547  -0.09247 355 ARG A NH2 
1954 N  N   . TYR A 251 ? 0.08653 0.17600 0.12242 0.00716  -0.01110 -0.06779 356 TYR A N   
1955 C  CA  . TYR A 251 ? 0.09033 0.17855 0.11077 0.01580  -0.00804 -0.05923 356 TYR A CA  
1956 C  C   . TYR A 251 ? 0.09421 0.16271 0.10624 0.00515  -0.00906 -0.04696 356 TYR A C   
1957 O  O   . TYR A 251 ? 0.10558 0.15942 0.10507 0.00388  -0.01105 -0.05574 356 TYR A O   
1958 C  CB  . TYR A 251 ? 0.10202 0.19118 0.10868 0.01082  -0.01112 -0.06664 356 TYR A CB  
1959 C  CG  . TYR A 251 ? 0.08601 0.19696 0.10328 0.02373  -0.01370 -0.07240 356 TYR A CG  
1960 C  CD1 . TYR A 251 ? 0.10649 0.20250 0.10500 0.03594  -0.00904 -0.07404 356 TYR A CD1 
1961 C  CD2 . TYR A 251 ? 0.08339 0.20069 0.10925 0.01299  -0.02478 -0.06866 356 TYR A CD2 
1962 C  CE1 . TYR A 251 ? 0.10232 0.20398 0.10275 0.04094  -0.00660 -0.06602 356 TYR A CE1 
1963 C  CE2 . TYR A 251 ? 0.08790 0.20824 0.10251 0.03156  -0.01801 -0.06240 356 TYR A CE2 
1964 C  CZ  . TYR A 251 ? 0.09285 0.20159 0.10574 0.04009  -0.01625 -0.06629 356 TYR A CZ  
1965 O  OH  . TYR A 251 ? 0.10477 0.21396 0.09700 0.03389  -0.01836 -0.06369 356 TYR A OH  
1966 N  N   . ILE A 252 ? 0.08940 0.15662 0.10110 -0.01165 -0.00724 -0.04230 357 ILE A N   
1967 C  CA  . ILE A 252 ? 0.09216 0.12703 0.09371 -0.02245 -0.01185 -0.04225 357 ILE A CA  
1968 C  C   . ILE A 252 ? 0.08344 0.11847 0.10274 -0.00117 0.00065  -0.04460 357 ILE A C   
1969 O  O   . ILE A 252 ? 0.06685 0.11815 0.10144 0.02558  -0.00502 -0.04066 357 ILE A O   
1970 C  CB  . ILE A 252 ? 0.09677 0.10550 0.08119 -0.02481 -0.00407 -0.04622 357 ILE A CB  
1971 C  CG1 . ILE A 252 ? 0.10124 0.09693 0.08418 -0.02845 0.00073  -0.04729 357 ILE A CG1 
1972 C  CG2 . ILE A 252 ? 0.10238 0.11528 0.07537 -0.01080 -0.00494 -0.03501 357 ILE A CG2 
1973 C  CD1 . ILE A 252 ? 0.10794 0.11294 0.09228 -0.02374 0.00992  -0.05795 357 ILE A CD1 
1974 N  N   . ALA A 253 ? 0.09657 0.12715 0.11705 -0.00926 0.00918  -0.04692 358 ALA A N   
1975 C  CA  . ALA A 253 ? 0.10403 0.13391 0.13493 -0.01560 0.00950  -0.04243 358 ALA A CA  
1976 C  C   . ALA A 253 ? 0.11328 0.15062 0.15056 -0.02199 -0.00037 -0.04219 358 ALA A C   
1977 O  O   . ALA A 253 ? 0.11149 0.15557 0.15616 -0.01531 0.00310  -0.04183 358 ALA A O   
1978 C  CB  . ALA A 253 ? 0.10327 0.13624 0.13699 -0.02024 0.01275  -0.02553 358 ALA A CB  
1979 N  N   A ASP A 254 ? 0.11948 0.15037 0.15588 -0.02103 -0.01258 -0.04885 359 ASP A N   
1980 N  N   B ASP A 254 ? 0.11867 0.15439 0.15761 -0.02141 -0.00996 -0.04440 359 ASP A N   
1981 C  CA  A ASP A 254 ? 0.11972 0.14597 0.15351 -0.00464 -0.02088 -0.05077 359 ASP A CA  
1982 C  CA  B ASP A 254 ? 0.11786 0.15431 0.15673 -0.00597 -0.01768 -0.04325 359 ASP A CA  
1983 C  C   A ASP A 254 ? 0.10742 0.13517 0.15805 -0.00011 -0.03398 -0.06070 359 ASP A C   
1984 C  C   B ASP A 254 ? 0.11048 0.14233 0.15875 0.00116  -0.03134 -0.05342 359 ASP A C   
1985 O  O   A ASP A 254 ? 0.10143 0.13158 0.15606 -0.00658 -0.03922 -0.06413 359 ASP A O   
1986 O  O   B ASP A 254 ? 0.11220 0.14223 0.15518 -0.00019 -0.03481 -0.05368 359 ASP A O   
1987 C  CB  A ASP A 254 ? 0.12534 0.14997 0.15541 0.00325  -0.01848 -0.04080 359 ASP A CB  
1988 C  CB  B ASP A 254 ? 0.11971 0.16907 0.16144 0.00108  -0.01549 -0.02980 359 ASP A CB  
1989 C  CG  A ASP A 254 ? 0.14317 0.15612 0.15643 0.00729  -0.01111 -0.03543 359 ASP A CG  
1990 C  CG  B ASP A 254 ? 0.12916 0.17726 0.16242 -0.00108 -0.00908 -0.01528 359 ASP A CG  
1991 O  OD1 A ASP A 254 ? 0.14907 0.15699 0.16262 0.00326  -0.00819 -0.02935 359 ASP A OD1 
1992 O  OD1 B ASP A 254 ? 0.12861 0.17868 0.15839 0.00608  -0.01005 -0.01054 359 ASP A OD1 
1993 O  OD2 A ASP A 254 ? 0.14756 0.15768 0.15372 0.00327  -0.01067 -0.03671 359 ASP A OD2 
1994 O  OD2 B ASP A 254 ? 0.13415 0.18286 0.16483 -0.00563 -0.01276 -0.01211 359 ASP A OD2 
1995 N  N   . THR A 255 ? 0.10534 0.13896 0.16169 0.00471  -0.03206 -0.06123 360 THR A N   
1996 C  CA  . THR A 255 ? 0.09703 0.14063 0.17396 0.00720  -0.04355 -0.06390 360 THR A CA  
1997 C  C   . THR A 255 ? 0.09939 0.11514 0.17630 0.02163  -0.04964 -0.06676 360 THR A C   
1998 O  O   . THR A 255 ? 0.10430 0.11959 0.17341 0.01263  -0.04823 -0.06642 360 THR A O   
1999 C  CB  . THR A 255 ? 0.10222 0.14922 0.18593 -0.00229 -0.04832 -0.05950 360 THR A CB  
2000 O  OG1 . THR A 255 ? 0.10285 0.16122 0.19247 -0.01764 -0.05037 -0.05932 360 THR A OG1 
2001 C  CG2 . THR A 255 ? 0.10465 0.14655 0.18647 0.00185  -0.04749 -0.05703 360 THR A CG2 
2002 N  N   . ALA A 256 ? 0.10842 0.11016 0.18121 0.02054  -0.03690 -0.07026 361 ALA A N   
2003 C  CA  . ALA A 256 ? 0.12062 0.10989 0.18649 0.03511  -0.03300 -0.06990 361 ALA A CA  
2004 C  C   . ALA A 256 ? 0.11703 0.10005 0.19065 0.03048  -0.03362 -0.06785 361 ALA A C   
2005 O  O   . ALA A 256 ? 0.14541 0.11634 0.18918 0.03574  -0.02717 -0.07498 361 ALA A O   
2006 C  CB  . ALA A 256 ? 0.13688 0.11801 0.18280 0.03553  -0.02955 -0.07090 361 ALA A CB  
2007 N  N   . ASN A 257 ? 0.11159 0.09102 0.20073 0.02249  -0.02538 -0.05634 362 ASN A N   
2008 C  CA  . ASN A 257 ? 0.11091 0.10396 0.21206 0.01722  -0.01902 -0.04758 362 ASN A CA  
2009 C  C   . ASN A 257 ? 0.11247 0.10328 0.21591 0.01106  -0.02180 -0.05497 362 ASN A C   
2010 O  O   . ASN A 257 ? 0.10440 0.08873 0.21747 0.00379  -0.02591 -0.06126 362 ASN A O   
2011 C  CB  . ASN A 257 ? 0.11460 0.10405 0.20514 0.01631  -0.02878 -0.04685 362 ASN A CB  
2012 C  CG  . ASN A 257 ? 0.12049 0.09771 0.20613 0.01465  -0.02983 -0.03620 362 ASN A CG  
2013 O  OD1 . ASN A 257 ? 0.11700 0.09199 0.20924 0.01672  -0.02510 -0.03573 362 ASN A OD1 
2014 N  ND2 . ASN A 257 ? 0.11434 0.09930 0.20503 0.01250  -0.02943 -0.01266 362 ASN A ND2 
2015 N  N   . LYS A 258 ? 0.14223 0.12432 0.22425 0.00955  -0.03128 -0.04716 363 LYS A N   
2016 C  CA  . LYS A 258 ? 0.15252 0.13691 0.23469 0.01236  -0.03557 -0.04096 363 LYS A CA  
2017 C  C   . LYS A 258 ? 0.13411 0.12544 0.23896 0.03073  -0.04078 -0.04294 363 LYS A C   
2018 O  O   . LYS A 258 ? 0.14530 0.11777 0.24649 0.03611  -0.04273 -0.04931 363 LYS A O   
2019 C  CB  . LYS A 258 ? 0.18618 0.16330 0.23208 0.00951  -0.04761 -0.02356 363 LYS A CB  
2020 C  CG  . LYS A 258 ? 0.22330 0.20924 0.24244 0.00852  -0.04982 -0.00504 363 LYS A CG  
2021 C  CD  . LYS A 258 ? 0.26516 0.25343 0.24989 0.00459  -0.05105 0.01199  363 LYS A CD  
2022 C  CE  . LYS A 258 ? 0.29609 0.27912 0.26344 -0.00775 -0.04837 0.01975  363 LYS A CE  
2023 N  NZ  . LYS A 258 ? 0.30591 0.29375 0.27437 -0.02766 -0.04571 0.02282  363 LYS A NZ  
2024 N  N   . GLY A 259 ? 0.12653 0.12546 0.24730 0.02427  -0.04921 -0.03815 364 GLY A N   
2025 C  CA  . GLY A 259 ? 0.13803 0.11196 0.24716 0.01733  -0.04541 -0.03064 364 GLY A CA  
2026 C  C   . GLY A 259 ? 0.15516 0.11648 0.24564 0.02109  -0.03587 -0.03198 364 GLY A C   
2027 O  O   . GLY A 259 ? 0.14544 0.11839 0.24167 0.02666  -0.03480 -0.03101 364 GLY A O   
2028 N  N   . ASP A 260 ? 0.16800 0.11769 0.23834 0.01004  -0.03223 -0.02903 365 ASP A N   
2029 C  CA  . ASP A 260 ? 0.17091 0.11202 0.23185 0.00586  -0.03072 -0.02911 365 ASP A CA  
2030 C  C   . ASP A 260 ? 0.16067 0.09001 0.22506 0.00584  -0.02933 -0.03104 365 ASP A C   
2031 O  O   . ASP A 260 ? 0.17179 0.10016 0.23104 0.00804  -0.02118 -0.02910 365 ASP A O   
2032 C  CB  . ASP A 260 ? 0.18773 0.12642 0.22660 0.00731  -0.02835 -0.02834 365 ASP A CB  
2033 C  CG  . ASP A 260 ? 0.20732 0.14117 0.22436 0.01876  -0.01830 -0.02804 365 ASP A CG  
2034 O  OD1 . ASP A 260 ? 0.20612 0.13677 0.21933 0.02478  -0.03065 -0.02612 365 ASP A OD1 
2035 O  OD2 . ASP A 260 ? 0.22143 0.16140 0.21922 0.00760  -0.00465 -0.03294 365 ASP A OD2 
2036 N  N   . LEU A 261 ? 0.15445 0.08178 0.21937 -0.00288 -0.03165 -0.03826 366 LEU A N   
2037 C  CA  . LEU A 261 ? 0.15192 0.07369 0.21986 -0.00609 -0.02327 -0.03278 366 LEU A CA  
2038 C  C   . LEU A 261 ? 0.15852 0.09103 0.21740 0.00712  -0.03461 -0.02873 366 LEU A C   
2039 O  O   . LEU A 261 ? 0.16878 0.09516 0.22819 -0.01140 -0.03928 -0.03090 366 LEU A O   
2040 C  CB  . LEU A 261 ? 0.13736 0.06548 0.21539 -0.02445 -0.01237 -0.01983 366 LEU A CB  
2041 C  CG  . LEU A 261 ? 0.13147 0.07442 0.22371 -0.02227 -0.01211 -0.00677 366 LEU A CG  
2042 C  CD1 . LEU A 261 ? 0.14407 0.05809 0.22177 -0.01317 -0.00827 -0.00709 366 LEU A CD1 
2043 C  CD2 . LEU A 261 ? 0.13344 0.09286 0.22397 -0.02693 -0.01324 -0.00338 366 LEU A CD2 
2044 N  N   . SER A 262 ? 0.15186 0.09794 0.20613 0.03379  -0.02572 -0.02721 367 SER A N   
2045 C  CA  . SER A 262 ? 0.14947 0.11274 0.19446 0.03416  -0.02355 -0.01408 367 SER A CA  
2046 C  C   . SER A 262 ? 0.14332 0.11955 0.17727 0.01673  -0.03536 -0.00491 367 SER A C   
2047 O  O   . SER A 262 ? 0.13836 0.11495 0.17812 -0.00278 -0.02928 -0.00302 367 SER A O   
2048 C  CB  . SER A 262 ? 0.15389 0.11762 0.19346 0.02038  -0.01748 0.00304  367 SER A CB  
2049 O  OG  . SER A 262 ? 0.15899 0.12980 0.19476 0.01682  -0.02121 0.00720  367 SER A OG  
2050 N  N   A ASN A 263 ? 0.14206 0.12453 0.17776 0.02030  -0.04774 0.00257  368 ASN A N   
2051 N  N   B ASN A 263 ? 0.14472 0.13168 0.17618 0.01613  -0.04172 0.00515  368 ASN A N   
2052 C  CA  A ASN A 263 ? 0.14348 0.13451 0.17409 0.01779  -0.05331 0.00568  368 ASN A CA  
2053 C  CA  B ASN A 263 ? 0.14711 0.14394 0.17147 0.01077  -0.04230 0.00999  368 ASN A CA  
2054 C  C   A ASN A 263 ? 0.14254 0.13590 0.17194 0.00072  -0.04232 0.00719  368 ASN A C   
2055 C  C   B ASN A 263 ? 0.14283 0.13932 0.17049 0.00103  -0.03749 0.00806  368 ASN A C   
2056 O  O   A ASN A 263 ? 0.14290 0.14602 0.17170 -0.01295 -0.04864 0.01250  368 ASN A O   
2057 O  O   B ASN A 263 ? 0.13703 0.14367 0.17130 -0.00735 -0.04380 0.01041  368 ASN A O   
2058 C  CB  A ASN A 263 ? 0.15735 0.14198 0.18021 0.03297  -0.05633 0.01131  368 ASN A CB  
2059 C  CB  B ASN A 263 ? 0.16031 0.15819 0.17284 0.01437  -0.03720 0.01975  368 ASN A CB  
2060 C  CG  A ASN A 263 ? 0.17824 0.13702 0.18428 0.04036  -0.05059 0.01824  368 ASN A CG  
2061 C  CG  B ASN A 263 ? 0.18182 0.17115 0.17282 0.00942  -0.02647 0.02633  368 ASN A CG  
2062 O  OD1 A ASN A 263 ? 0.18792 0.13715 0.18854 0.03564  -0.04173 0.02247  368 ASN A OD1 
2063 O  OD1 B ASN A 263 ? 0.18783 0.17676 0.17493 0.00194  -0.02653 0.02589  368 ASN A OD1 
2064 N  ND2 A ASN A 263 ? 0.17875 0.12062 0.18335 0.05030  -0.05240 0.01911  368 ASN A ND2 
2065 N  ND2 B ASN A 263 ? 0.18798 0.17951 0.17172 0.00454  -0.01994 0.03177  368 ASN A ND2 
2066 N  N   . ILE A 264 ? 0.13930 0.13862 0.16923 -0.00289 -0.03305 0.00873  369 ILE A N   
2067 C  CA  . ILE A 264 ? 0.13289 0.12896 0.16451 -0.00172 -0.02285 0.00377  369 ILE A CA  
2068 C  C   . ILE A 264 ? 0.14141 0.11801 0.16507 -0.01860 -0.02326 0.01084  369 ILE A C   
2069 O  O   . ILE A 264 ? 0.15725 0.12217 0.16587 -0.01500 -0.02812 0.01741  369 ILE A O   
2070 C  CB  . ILE A 264 ? 0.14288 0.13207 0.16916 0.03227  -0.02396 0.00044  369 ILE A CB  
2071 C  CG1 . ILE A 264 ? 0.14806 0.13191 0.16966 0.02685  -0.01968 -0.00852 369 ILE A CG1 
2072 C  CG2 . ILE A 264 ? 0.15717 0.13791 0.17014 0.04041  -0.02639 -0.00156 369 ILE A CG2 
2073 C  CD1 . ILE A 264 ? 0.16568 0.13064 0.17170 0.01500  -0.01569 -0.01991 369 ILE A CD1 
2074 N  N   . PRO A 265 ? 0.15149 0.10602 0.15731 -0.02968 -0.02009 0.01059  370 PRO A N   
2075 C  CA  . PRO A 265 ? 0.15145 0.11748 0.16344 -0.03201 -0.02832 0.01913  370 PRO A CA  
2076 C  C   . PRO A 265 ? 0.15021 0.12799 0.16658 -0.05696 -0.02571 0.04435  370 PRO A C   
2077 O  O   . PRO A 265 ? 0.15425 0.13351 0.17137 -0.07322 -0.02271 0.04097  370 PRO A O   
2078 C  CB  . PRO A 265 ? 0.16170 0.12675 0.16057 -0.02624 -0.02597 0.02087  370 PRO A CB  
2079 C  CG  . PRO A 265 ? 0.17101 0.12344 0.15983 -0.04171 -0.01581 0.01998  370 PRO A CG  
2080 C  CD  . PRO A 265 ? 0.16786 0.10992 0.15704 -0.03380 -0.01416 0.01401  370 PRO A CD  
2081 N  N   A PHE A 266 ? 0.15127 0.12797 0.17118 -0.04711 -0.02193 0.04941  371 PHE A N   
2082 N  N   B PHE A 266 ? 0.15182 0.14166 0.17308 -0.05085 -0.02484 0.04787  371 PHE A N   
2083 C  CA  A PHE A 266 ? 0.15872 0.13169 0.17036 -0.04983 -0.01906 0.05468  371 PHE A CA  
2084 C  CA  B PHE A 266 ? 0.15481 0.15684 0.17377 -0.05213 -0.02534 0.05442  371 PHE A CA  
2085 C  C   A PHE A 266 ? 0.15455 0.15454 0.17625 -0.03674 -0.02356 0.05931  371 PHE A C   
2086 C  C   B PHE A 266 ? 0.14953 0.15910 0.17856 -0.04729 -0.02669 0.06489  371 PHE A C   
2087 O  O   A PHE A 266 ? 0.15577 0.16769 0.17917 -0.02511 -0.02059 0.05593  371 PHE A O   
2088 O  O   B PHE A 266 ? 0.14664 0.15679 0.17842 -0.04388 -0.02478 0.07479  371 PHE A O   
2089 C  CB  A PHE A 266 ? 0.16245 0.12013 0.16325 -0.05216 -0.00903 0.05235  371 PHE A CB  
2090 C  CB  B PHE A 266 ? 0.15545 0.16955 0.17293 -0.04949 -0.02224 0.05041  371 PHE A CB  
2091 C  CG  A PHE A 266 ? 0.16685 0.11634 0.15616 -0.05465 -0.00364 0.05222  371 PHE A CG  
2092 C  CG  B PHE A 266 ? 0.15924 0.18137 0.17041 -0.04299 -0.01915 0.04504  371 PHE A CG  
2093 C  CD1 A PHE A 266 ? 0.17515 0.12224 0.15174 -0.05875 -0.00406 0.05673  371 PHE A CD1 
2094 C  CD1 B PHE A 266 ? 0.16418 0.18603 0.16845 -0.03999 -0.01785 0.04046  371 PHE A CD1 
2095 C  CD2 A PHE A 266 ? 0.17100 0.12193 0.15216 -0.05290 0.00089  0.05168  371 PHE A CD2 
2096 C  CD2 B PHE A 266 ? 0.16206 0.18843 0.16915 -0.03724 -0.01937 0.04006  371 PHE A CD2 
2097 C  CE1 A PHE A 266 ? 0.16897 0.12780 0.15013 -0.04727 -0.00899 0.05756  371 PHE A CE1 
2098 C  CE1 B PHE A 266 ? 0.16276 0.19072 0.16762 -0.03260 -0.01732 0.03671  371 PHE A CE1 
2099 C  CE2 A PHE A 266 ? 0.17110 0.12409 0.15267 -0.04632 -0.00178 0.04731  371 PHE A CE2 
2100 C  CE2 B PHE A 266 ? 0.16603 0.19139 0.16886 -0.02990 -0.01791 0.03564  371 PHE A CE2 
2101 C  CZ  A PHE A 266 ? 0.17013 0.12715 0.15060 -0.04309 -0.00785 0.05356  371 PHE A CZ  
2102 C  CZ  B PHE A 266 ? 0.16514 0.19291 0.16811 -0.02891 -0.01764 0.03520  371 PHE A CZ  
2103 N  N   . GLY A 267 ? 0.14503 0.16188 0.18397 -0.05274 -0.02804 0.05949  372 GLY A N   
2104 C  CA  . GLY A 267 ? 0.12706 0.15163 0.18827 -0.05410 -0.02746 0.05891  372 GLY A CA  
2105 C  C   . GLY A 267 ? 0.11019 0.15493 0.18936 -0.04358 -0.01661 0.05837  372 GLY A C   
2106 O  O   . GLY A 267 ? 0.10798 0.18105 0.19024 -0.02189 -0.00221 0.06383  372 GLY A O   
2107 N  N   . THR A 268 ? 0.10683 0.13932 0.18541 -0.04565 -0.02007 0.04326  373 THR A N   
2108 C  CA  . THR A 268 ? 0.10726 0.12110 0.17844 -0.02707 -0.02171 0.02771  373 THR A CA  
2109 C  C   . THR A 268 ? 0.10979 0.11239 0.17494 -0.01115 -0.02310 0.01929  373 THR A C   
2110 O  O   . THR A 268 ? 0.10711 0.12639 0.17614 -0.00146 -0.02747 0.02235  373 THR A O   
2111 C  CB  . THR A 268 ? 0.11390 0.11859 0.17472 -0.03099 -0.02410 0.01667  373 THR A CB  
2112 O  OG1 . THR A 268 ? 0.12517 0.10688 0.16902 0.00206  -0.03621 0.00626  373 THR A OG1 
2113 C  CG2 . THR A 268 ? 0.10022 0.11612 0.17646 -0.05242 -0.02322 0.02075  373 THR A CG2 
2114 N  N   . VAL A 269 ? 0.11287 0.10256 0.17451 -0.00026 -0.01934 0.00609  374 VAL A N   
2115 C  CA  . VAL A 269 ? 0.11890 0.10207 0.17708 0.01131  -0.02145 0.00028  374 VAL A CA  
2116 C  C   . VAL A 269 ? 0.11213 0.10349 0.18587 0.00040  -0.01678 -0.00998 374 VAL A C   
2117 O  O   . VAL A 269 ? 0.11831 0.11507 0.18310 -0.01928 -0.01668 -0.00911 374 VAL A O   
2118 C  CB  . VAL A 269 ? 0.13415 0.11325 0.18020 0.01115  -0.03546 0.00454  374 VAL A CB  
2119 C  CG1 . VAL A 269 ? 0.14353 0.12317 0.18014 0.02734  -0.04820 0.00496  374 VAL A CG1 
2120 C  CG2 . VAL A 269 ? 0.13947 0.12356 0.18302 -0.00243 -0.03808 0.01337  374 VAL A CG2 
2121 N  N   . ASN A 270 ? 0.10443 0.07941 0.19566 0.01084  -0.00490 -0.01066 375 ASN A N   
2122 C  CA  . ASN A 270 ? 0.10153 0.08153 0.20126 0.01711  0.00106  -0.01154 375 ASN A CA  
2123 C  C   . ASN A 270 ? 0.08299 0.07967 0.19916 -0.00994 -0.00281 -0.02065 375 ASN A C   
2124 O  O   . ASN A 270 ? 0.07920 0.08522 0.20095 -0.02621 0.00176  -0.01880 375 ASN A O   
2125 C  CB  . ASN A 270 ? 0.11757 0.09040 0.20985 0.02882  0.00812  -0.02053 375 ASN A CB  
2126 C  CG  . ASN A 270 ? 0.12781 0.09792 0.21315 0.03371  0.01566  -0.03155 375 ASN A CG  
2127 O  OD1 . ASN A 270 ? 0.12843 0.09795 0.21119 0.04174  0.02589  -0.03621 375 ASN A OD1 
2128 N  ND2 . ASN A 270 ? 0.13637 0.08994 0.21216 0.03795  0.01450  -0.03076 375 ASN A ND2 
2129 N  N   . LEU A 271 ? 0.07230 0.07910 0.19432 -0.00873 -0.01580 -0.02634 376 LEU A N   
2130 C  CA  . LEU A 271 ? 0.05790 0.09708 0.18866 -0.00199 -0.02679 -0.03279 376 LEU A CA  
2131 C  C   . LEU A 271 ? 0.05640 0.10790 0.17765 -0.01401 -0.01869 -0.02980 376 LEU A C   
2132 O  O   . LEU A 271 ? 0.05251 0.10280 0.18645 -0.01210 -0.00450 -0.02683 376 LEU A O   
2133 C  CB  . LEU A 271 ? 0.06550 0.12417 0.19686 0.01258  -0.03705 -0.03775 376 LEU A CB  
2134 C  CG  . LEU A 271 ? 0.07494 0.13163 0.21968 0.01627  -0.04297 -0.04671 376 LEU A CG  
2135 C  CD1 . LEU A 271 ? 0.08707 0.13550 0.22591 0.03371  -0.04818 -0.03427 376 LEU A CD1 
2136 C  CD2 . LEU A 271 ? 0.08572 0.13300 0.22502 0.00443  -0.04340 -0.05115 376 LEU A CD2 
2137 N  N   . LEU A 272 ? 0.06271 0.11417 0.16752 -0.01519 -0.01467 -0.03806 377 LEU A N   
2138 C  CA  . LEU A 272 ? 0.06874 0.11982 0.15587 -0.01758 0.00240  -0.03971 377 LEU A CA  
2139 C  C   . LEU A 272 ? 0.06743 0.10257 0.13378 -0.01078 0.00799  -0.03663 377 LEU A C   
2140 O  O   . LEU A 272 ? 0.04211 0.11751 0.12475 -0.00042 0.01175  -0.03099 377 LEU A O   
2141 C  CB  . LEU A 272 ? 0.05543 0.13260 0.15366 -0.00748 0.00468  -0.03554 377 LEU A CB  
2142 C  CG  . LEU A 272 ? 0.04960 0.14228 0.15324 0.00870  0.02345  -0.02117 377 LEU A CG  
2143 C  CD1 . LEU A 272 ? 0.04851 0.14217 0.15251 0.00188  0.02128  -0.01726 377 LEU A CD1 
2144 C  CD2 . LEU A 272 ? 0.05503 0.15155 0.15458 0.01897  0.02556  -0.02119 377 LEU A CD2 
2145 N  N   . ALA A 273 ? 0.07208 0.09043 0.12235 -0.01303 0.00575  -0.04179 378 ALA A N   
2146 C  CA  . ALA A 273 ? 0.08275 0.10268 0.10925 -0.02681 0.01112  -0.05136 378 ALA A CA  
2147 C  C   . ALA A 273 ? 0.09866 0.12325 0.10244 -0.01856 -0.00847 -0.05308 378 ALA A C   
2148 O  O   . ALA A 273 ? 0.08636 0.13622 0.09277 -0.01397 -0.02249 -0.04576 378 ALA A O   
2149 C  CB  . ALA A 273 ? 0.09624 0.09995 0.09851 -0.01636 0.02440  -0.05662 378 ALA A CB  
2150 N  N   . TYR A 274 ? 0.11449 0.14177 0.11894 0.00030  -0.01034 -0.05918 379 TYR A N   
2151 C  CA  . TYR A 274 ? 0.10498 0.12670 0.12814 0.00827  -0.01717 -0.06846 379 TYR A CA  
2152 C  C   . TYR A 274 ? 0.10205 0.14635 0.13115 0.00732  -0.00411 -0.05802 379 TYR A C   
2153 O  O   . TYR A 274 ? 0.10262 0.15138 0.12451 0.00849  -0.00158 -0.05934 379 TYR A O   
2154 C  CB  . TYR A 274 ? 0.10103 0.12774 0.14098 0.01486  -0.02627 -0.07370 379 TYR A CB  
2155 C  CG  . TYR A 274 ? 0.09934 0.14789 0.15254 0.02179  -0.02317 -0.07821 379 TYR A CG  
2156 C  CD1 . TYR A 274 ? 0.10164 0.17016 0.16260 0.02177  -0.01747 -0.07005 379 TYR A CD1 
2157 C  CD2 . TYR A 274 ? 0.12156 0.15713 0.16281 0.01510  -0.01843 -0.08801 379 TYR A CD2 
2158 C  CE1 . TYR A 274 ? 0.09494 0.16037 0.16064 0.03348  -0.01125 -0.07981 379 TYR A CE1 
2159 C  CE2 . TYR A 274 ? 0.11656 0.17323 0.16400 0.02646  -0.01368 -0.08293 379 TYR A CE2 
2160 C  CZ  . TYR A 274 ? 0.10608 0.16786 0.16782 0.03312  -0.00737 -0.08378 379 TYR A CZ  
2161 O  OH  . TYR A 274 ? 0.10706 0.16972 0.16731 0.02514  -0.00772 -0.08271 379 TYR A OH  
2162 N  N   . ASN A 275 ? 0.09706 0.15237 0.13756 -0.00273 -0.01151 -0.04809 380 ASN A N   
2163 C  CA  . ASN A 275 ? 0.08899 0.15513 0.15517 0.00093  -0.02341 -0.05634 380 ASN A CA  
2164 C  C   . ASN A 275 ? 0.10906 0.16865 0.16047 0.00612  -0.03402 -0.06268 380 ASN A C   
2165 O  O   . ASN A 275 ? 0.11684 0.17128 0.17469 0.01750  -0.03916 -0.06404 380 ASN A O   
2166 C  CB  . ASN A 275 ? 0.06264 0.16482 0.15166 0.02281  -0.02189 -0.04674 380 ASN A CB  
2167 C  CG  . ASN A 275 ? 0.06977 0.18479 0.15539 0.02315  -0.01998 -0.04019 380 ASN A CG  
2168 O  OD1 . ASN A 275 ? 0.07025 0.18698 0.15530 0.01762  -0.00468 -0.04012 380 ASN A OD1 
2169 N  ND2 . ASN A 275 ? 0.07068 0.19945 0.15343 0.02599  -0.03452 -0.03400 380 ASN A ND2 
2170 N  N   A ASN A 276 ? 0.12777 0.19014 0.17872 0.00284  -0.03358 -0.06077 381 ASN A N   
2171 N  N   B ASN A 276 ? 0.11810 0.17939 0.18060 0.00291  -0.02797 -0.06271 381 ASN A N   
2172 C  CA  A ASN A 276 ? 0.13826 0.20159 0.18305 -0.00595 -0.03517 -0.06358 381 ASN A CA  
2173 C  CA  B ASN A 276 ? 0.12488 0.18500 0.18507 -0.00580 -0.02430 -0.06644 381 ASN A CA  
2174 C  C   A ASN A 276 ? 0.14768 0.20537 0.19437 -0.00525 -0.01881 -0.07628 381 ASN A C   
2175 C  C   B ASN A 276 ? 0.13736 0.19318 0.19548 -0.00647 -0.01308 -0.07785 381 ASN A C   
2176 O  O   A ASN A 276 ? 0.15640 0.21248 0.20160 0.00504  -0.01381 -0.07005 381 ASN A O   
2177 O  O   B ASN A 276 ? 0.13970 0.19421 0.19840 0.00220  -0.00983 -0.07440 381 ASN A O   
2178 C  CB  A ASN A 276 ? 0.14920 0.21180 0.18242 -0.00469 -0.04392 -0.05461 381 ASN A CB  
2179 C  CB  B ASN A 276 ? 0.12762 0.18570 0.19026 -0.00808 -0.02587 -0.06005 381 ASN A CB  
2180 C  CG  A ASN A 276 ? 0.17168 0.22464 0.18215 -0.00581 -0.04839 -0.04437 381 ASN A CG  
2181 C  CG  B ASN A 276 ? 0.13988 0.18936 0.19188 -0.00869 -0.02538 -0.05485 381 ASN A CG  
2182 O  OD1 A ASN A 276 ? 0.18310 0.22880 0.17769 -0.01060 -0.05151 -0.04258 381 ASN A OD1 
2183 O  OD1 B ASN A 276 ? 0.14273 0.18958 0.19363 -0.01047 -0.02666 -0.05160 381 ASN A OD1 
2184 N  ND2 A ASN A 276 ? 0.17671 0.22476 0.18478 -0.00572 -0.05243 -0.04190 381 ASN A ND2 
2185 N  ND2 B ASN A 276 ? 0.15337 0.19478 0.19325 -0.01276 -0.02165 -0.05207 381 ASN A ND2 
2186 N  N   . TYR A 277 ? 0.14654 0.20161 0.20022 -0.01611 0.00025  -0.08742 382 TYR A N   
2187 C  CA  . TYR A 277 ? 0.17095 0.22029 0.21326 -0.04316 0.02365  -0.08736 382 TYR A CA  
2188 C  C   . TYR A 277 ? 0.20632 0.24821 0.23767 -0.02335 0.03166  -0.08464 382 TYR A C   
2189 O  O   . TYR A 277 ? 0.21668 0.24683 0.23414 -0.01675 0.03351  -0.08937 382 TYR A O   
2190 C  CB  . TYR A 277 ? 0.18659 0.23814 0.21778 -0.06763 0.03785  -0.08507 382 TYR A CB  
2191 C  CG  . TYR A 277 ? 0.20603 0.26396 0.21715 -0.07828 0.05376  -0.07441 382 TYR A CG  
2192 C  CD1 . TYR A 277 ? 0.22080 0.27478 0.22986 -0.08360 0.06637  -0.06765 382 TYR A CD1 
2193 C  CD2 . TYR A 277 ? 0.20171 0.28446 0.22202 -0.08767 0.05063  -0.06813 382 TYR A CD2 
2194 C  CE1 . TYR A 277 ? 0.21936 0.28091 0.22933 -0.08840 0.07274  -0.06430 382 TYR A CE1 
2195 C  CE2 . TYR A 277 ? 0.19500 0.29097 0.22271 -0.09945 0.05731  -0.06186 382 TYR A CE2 
2196 C  CZ  . TYR A 277 ? 0.20253 0.28954 0.23196 -0.10250 0.06749  -0.06221 382 TYR A CZ  
2197 O  OH  . TYR A 277 ? 0.20514 0.29678 0.22948 -0.10410 0.06757  -0.06464 382 TYR A OH  
2198 N  N   . GLN A 278 ? 0.24627 0.28658 0.25676 -0.01843 0.03158  -0.07789 383 GLN A N   
2199 C  CA  . GLN A 278 ? 0.29702 0.33183 0.28181 -0.02470 0.03377  -0.06903 383 GLN A CA  
2200 C  C   . GLN A 278 ? 0.31608 0.35542 0.29426 -0.01743 0.03746  -0.06852 383 GLN A C   
2201 O  O   . GLN A 278 ? 0.32148 0.35303 0.29122 -0.01048 0.03684  -0.06925 383 GLN A O   
2202 C  CB  . GLN A 278 ? 0.32656 0.35896 0.29212 -0.03248 0.03049  -0.05540 383 GLN A CB  
2203 C  CG  . GLN A 278 ? 0.35501 0.38353 0.30646 -0.02715 0.02545  -0.04188 383 GLN A CG  
2204 C  CD  . GLN A 278 ? 0.37411 0.40250 0.31657 -0.02544 0.02294  -0.02781 383 GLN A CD  
2205 O  OE1 . GLN A 278 ? 0.37483 0.40454 0.32263 -0.02073 0.01951  -0.02436 383 GLN A OE1 
2206 N  NE2 . GLN A 278 ? 0.39200 0.41595 0.33782 -0.02697 0.02417  -0.02531 383 GLN A NE2 
2207 N  N   . ALA A 279 ? 0.32415 0.37557 0.29845 -0.02115 0.03585  -0.06595 384 ALA A N   
2208 C  CA  . ALA A 279 ? 0.33223 0.39040 0.31309 -0.02301 0.03949  -0.06453 384 ALA A CA  
2209 C  C   . ALA A 279 ? 0.33446 0.39814 0.30782 -0.01652 0.04286  -0.06799 384 ALA A C   
2210 O  O   . ALA A 279 ? 0.33108 0.40851 0.31199 -0.01288 0.04733  -0.06832 384 ALA A O   
2211 C  CB  . ALA A 279 ? 0.33446 0.39493 0.30959 -0.02296 0.03612  -0.06292 384 ALA A CB  
2212 CA CA  . CA  B .   ? 0.04485 0.05550 0.16919 -0.00555 -0.00079 -0.00656 401 CA  A CA  
2213 CA CA  . CA  C .   ? 0.20402 0.13835 0.35331 0.01555  -0.00019 -0.09816 402 CA  A CA  
2214 N  N   . NO3 D .   ? 0.13239 0.12445 0.11290 0.00391  -0.02099 -0.05104 403 NO3 A N   
2215 O  O1  . NO3 D .   ? 0.13970 0.13640 0.11744 -0.00203 -0.02631 -0.06243 403 NO3 A O1  
2216 O  O2  . NO3 D .   ? 0.11943 0.12151 0.10611 -0.00893 -0.02589 -0.03442 403 NO3 A O2  
2217 O  O3  . NO3 D .   ? 0.12835 0.11799 0.11309 0.01634  -0.01669 -0.04504 403 NO3 A O3  
2218 O  O   . HOH E .   ? 0.72453 0.52077 0.32352 0.20869  -0.00356 -0.15359 501 HOH A O   
2219 O  O   . HOH E .   ? 0.45086 0.46000 0.19063 0.01164  0.10405  -0.09672 502 HOH A O   
2220 O  O   . HOH E .   ? 0.64400 0.25594 0.21436 0.02851  -0.05722 0.06022  503 HOH A O   
2221 O  O   . HOH E .   ? 0.48562 0.32248 0.23815 -0.02319 -0.07426 0.00960  504 HOH A O   
2222 O  O   . HOH E .   ? 0.67323 0.30772 0.33436 -0.11155 -0.16562 0.12097  505 HOH A O   
2223 O  O   . HOH E .   ? 0.32836 0.48607 0.63435 0.22589  -0.00235 0.03398  506 HOH A O   
2224 O  O   . HOH E .   ? 0.74401 0.22042 0.33329 -0.00461 -0.20187 -0.02466 507 HOH A O   
2225 O  O   . HOH E .   ? 0.53672 0.41739 0.27169 -0.11552 0.09767  0.11832  508 HOH A O   
2226 O  O   . HOH E .   ? 0.56198 0.50938 0.20395 -0.04111 0.05303  0.12969  509 HOH A O   
2227 O  O   . HOH E .   ? 0.38043 0.44673 0.30722 0.04761  0.19748  -0.00860 510 HOH A O   
2228 O  O   . HOH E .   ? 0.41674 0.22118 0.26781 0.12433  -0.17655 -0.08796 511 HOH A O   
2229 O  O   . HOH E .   ? 0.51055 0.51081 0.48965 0.28631  -0.14977 -0.11431 512 HOH A O   
2230 O  O   . HOH E .   ? 0.30416 0.41500 0.75788 -0.11226 0.16934  -0.19862 513 HOH A O   
2231 O  O   . HOH E .   ? 0.25268 0.27196 0.39380 0.00572  -0.04543 -0.16676 514 HOH A O   
2232 O  O   . HOH E .   ? 0.19031 0.23044 0.67048 0.02289  -0.06011 -0.14060 515 HOH A O   
2233 O  O   . HOH E .   ? 0.15467 0.21882 0.30072 0.07323  -0.08236 -0.11289 516 HOH A O   
2234 O  O   . HOH E .   ? 0.14860 0.21470 0.26579 -0.03469 0.07574  -0.11629 517 HOH A O   
2235 O  O   . HOH E .   ? 0.35483 0.64837 0.30719 -0.02479 -0.16071 0.05724  518 HOH A O   
2236 O  O   . HOH E .   ? 0.19870 0.23591 0.18552 -0.12606 -0.01328 0.03524  519 HOH A O   
2237 O  O   . HOH E .   ? 0.36490 0.25039 0.60239 -0.06318 0.25241  -0.11922 520 HOH A O   
2238 O  O   . HOH E .   ? 0.60348 0.50180 0.25623 -0.00762 -0.00551 -0.19051 521 HOH A O   
2239 O  O   . HOH E .   ? 0.45680 0.35407 0.26176 -0.13833 -0.08891 0.14465  522 HOH A O   
2240 O  O   . HOH E .   ? 0.39972 0.70488 0.45059 -0.23045 0.15177  -0.03745 523 HOH A O   
2241 O  O   . HOH E .   ? 0.63875 0.67423 0.31968 0.09830  0.17157  -0.13618 524 HOH A O   
2242 O  O   . HOH E .   ? 0.13531 0.27599 0.26712 -0.03929 -0.00733 0.14713  525 HOH A O   
2243 O  O   . HOH E .   ? 0.45598 0.34506 0.22048 -0.04133 -0.10845 0.11505  526 HOH A O   
2244 O  O   . HOH E .   ? 0.12542 0.21906 0.16580 -0.03580 0.07447  -0.03800 527 HOH A O   
2245 O  O   . HOH E .   ? 0.41543 0.24650 0.14883 -0.12350 -0.08153 0.03713  528 HOH A O   
2246 O  O   . HOH E .   ? 0.15301 0.09200 0.17184 -0.00700 -0.04213 -0.05700 529 HOH A O   
2247 O  O   . HOH E .   ? 0.17154 0.21622 0.08856 -0.02475 -0.01672 -0.05790 530 HOH A O   
2248 O  O   . HOH E .   ? 0.35882 0.22120 0.53623 0.05843  -0.09637 -0.14893 531 HOH A O   
2249 O  O   . HOH E .   ? 0.26913 0.26236 0.10195 0.04811  0.01702  -0.05567 532 HOH A O   
2250 O  O   . HOH E .   ? 0.06271 0.15992 0.19976 -0.00470 -0.02932 -0.03278 533 HOH A O   
2251 O  O   . HOH E .   ? 0.14032 0.19143 0.35124 0.02487  0.01267  -0.11442 534 HOH A O   
2252 O  O   . HOH E .   ? 0.21640 0.24320 0.52779 0.07847  -0.07460 -0.11771 535 HOH A O   
2253 O  O   . HOH E .   ? 0.40371 0.28286 0.34789 -0.06589 0.06043  -0.02611 536 HOH A O   
2254 O  O   . HOH E .   ? 0.43966 0.12330 0.24873 -0.04258 0.03547  -0.02909 537 HOH A O   
2255 O  O   . HOH E .   ? 0.46474 0.48248 0.26023 -0.26652 0.08100  -0.03614 538 HOH A O   
2256 O  O   . HOH E .   ? 0.46592 0.31159 0.28687 0.19732  -0.08437 0.00757  539 HOH A O   
2257 O  O   . HOH E .   ? 0.12473 0.09321 0.11095 -0.04742 0.05040  -0.00713 540 HOH A O   
2258 O  O   . HOH E .   ? 0.54044 0.23414 0.30363 0.09910  0.03709  0.10736  541 HOH A O   
2259 O  O   . HOH E .   ? 0.15660 0.26841 0.25191 0.00742  0.05005  0.04438  542 HOH A O   
2260 O  O   . HOH E .   ? 0.51645 0.20560 0.23686 -0.13934 -0.11217 0.03808  543 HOH A O   
2261 O  O   . HOH E .   ? 0.14683 0.06162 0.16910 -0.00729 -0.00037 -0.03276 544 HOH A O   
2262 O  O   . HOH E .   ? 0.19423 0.40765 0.65991 -0.00386 -0.07135 0.13696  545 HOH A O   
2263 O  O   . HOH E .   ? 0.18180 0.22395 0.11979 0.02048  0.05963  0.02379  546 HOH A O   
2264 O  O   . HOH E .   ? 0.23172 0.28771 0.37201 0.10251  -0.13687 -0.17275 547 HOH A O   
2265 O  O   . HOH E .   ? 0.52062 0.80566 0.56742 0.13678  0.27028  -0.12225 548 HOH A O   
2266 O  O   . HOH E .   ? 0.30900 0.31683 0.10544 -0.08253 -0.03393 0.01558  549 HOH A O   
2267 O  O   . HOH E .   ? 0.28783 0.35663 0.38455 0.18570  0.04547  0.01480  550 HOH A O   
2268 O  O   . HOH E .   ? 0.41943 0.23811 0.47904 -0.09909 0.14485  0.06158  551 HOH A O   
2269 O  O   . HOH E .   ? 0.15505 0.14200 0.29778 0.01997  -0.08776 -0.07646 552 HOH A O   
2270 O  O   . HOH E .   ? 0.21028 0.32189 0.24219 -0.10848 0.02814  -0.02155 553 HOH A O   
2271 O  O   . HOH E .   ? 0.13008 0.18842 0.47915 0.00822  0.04746  0.05300  554 HOH A O   
2272 O  O   . HOH E .   ? 0.19166 0.21982 0.08038 0.03099  -0.03078 0.03692  555 HOH A O   
2273 O  O   . HOH E .   ? 0.16487 0.49042 0.46558 0.05665  -0.04048 -0.12656 556 HOH A O   
2274 O  O   . HOH E .   ? 0.24401 0.15959 0.49041 0.04551  0.12815  0.06046  557 HOH A O   
2275 O  O   . HOH E .   ? 0.23692 0.37560 0.10692 0.05064  -0.01590 -0.04270 558 HOH A O   
2276 O  O   . HOH E .   ? 0.27638 0.49985 0.58202 0.16158  -0.11902 0.02970  559 HOH A O   
2277 O  O   . HOH E .   ? 0.05335 0.16479 0.17828 -0.01439 -0.02051 -0.00965 560 HOH A O   
2278 O  O   . HOH E .   ? 0.30049 0.36779 0.12638 -0.08109 -0.05712 0.03674  561 HOH A O   
2279 O  O   . HOH E .   ? 0.38609 0.41565 0.40621 -0.13332 -0.18417 -0.03889 562 HOH A O   
2280 O  O   . HOH E .   ? 0.13483 0.10667 0.22489 -0.01485 -0.00098 0.00314  563 HOH A O   
2281 O  O   . HOH E .   ? 0.40302 0.20741 0.19737 0.13078  0.04797  0.00262  564 HOH A O   
2282 O  O   . HOH E .   ? 0.45855 0.21685 0.44121 0.07399  0.03061  0.14316  565 HOH A O   
2283 O  O   . HOH E .   ? 0.27372 0.12144 0.23920 0.03858  0.07046  0.04454  566 HOH A O   
2284 O  O   . HOH E .   ? 0.34733 0.33730 0.19947 -0.14345 -0.10311 0.01480  567 HOH A O   
2285 O  O   . HOH E .   ? 0.10670 0.06554 0.22506 -0.01548 0.04363  -0.00823 568 HOH A O   
2286 O  O   . HOH E .   ? 0.22178 0.36231 0.24162 0.13281  0.02877  -0.06775 569 HOH A O   
2287 O  O   . HOH E .   ? 0.35259 0.18092 0.36666 -0.12106 0.06365  0.01026  570 HOH A O   
2288 O  O   . HOH E .   ? 0.23003 0.37482 0.41901 -0.01582 -0.07387 -0.11743 571 HOH A O   
2289 O  O   . HOH E .   ? 0.16163 0.14490 0.47995 0.02058  -0.10307 -0.06917 572 HOH A O   
2290 O  O   . HOH E .   ? 0.16026 0.16382 0.20608 0.07425  0.03027  -0.05445 573 HOH A O   
2291 O  O   . HOH E .   ? 0.54047 0.44544 0.25696 0.03447  0.03305  -0.18186 574 HOH A O   
2292 O  O   . HOH E .   ? 0.39491 0.29125 0.11641 0.05743  -0.01605 0.03946  575 HOH A O   
2293 O  O   . HOH E .   ? 0.12469 0.20485 0.36188 0.00121  0.05655  -0.09730 576 HOH A O   
2294 O  O   . HOH E .   ? 0.11564 0.17386 0.38821 -0.03470 -0.01934 0.04025  577 HOH A O   
2295 O  O   . HOH E .   ? 0.13336 0.23345 0.24928 0.00354  0.01612  0.02692  578 HOH A O   
2296 O  O   . HOH E .   ? 0.17266 0.29450 0.44892 0.09845  -0.01863 -0.04808 579 HOH A O   
2297 O  O   . HOH E .   ? 0.20932 0.20387 0.05368 -0.00159 0.01073  0.00756  580 HOH A O   
2298 O  O   . HOH E .   ? 0.09834 0.08586 0.22264 -0.00181 0.01053  -0.00440 581 HOH A O   
2299 O  O   . HOH E .   ? 0.23866 0.25267 0.21531 0.09506  -0.02560 0.09347  582 HOH A O   
2300 O  O   . HOH E .   ? 0.34334 0.35544 0.13978 0.02739  -0.07099 -0.07004 583 HOH A O   
2301 O  O   . HOH E .   ? 0.14627 0.46685 0.22938 -0.06792 -0.03258 0.10662  584 HOH A O   
2302 O  O   . HOH E .   ? 0.14680 0.14177 0.29738 -0.00660 0.04587  0.03549  585 HOH A O   
2303 O  O   . HOH E .   ? 0.11845 0.13590 0.44721 -0.00336 -0.00944 0.07842  586 HOH A O   
2304 O  O   . HOH E .   ? 0.07804 0.10567 0.20076 0.00636  -0.05016 -0.04274 587 HOH A O   
2305 O  O   . HOH E .   ? 0.12094 0.11903 0.03297 -0.00085 0.00521  0.01433  588 HOH A O   
2306 O  O   . HOH E .   ? 0.17340 0.25357 0.08601 0.07285  -0.00976 -0.04065 589 HOH A O   
2307 O  O   . HOH E .   ? 0.31784 0.45666 0.52586 0.06362  0.18276  -0.11803 590 HOH A O   
2308 O  O   . HOH E .   ? 0.14927 0.17368 0.13177 0.02688  -0.05773 -0.07147 591 HOH A O   
2309 O  O   . HOH E .   ? 0.24236 0.22413 0.16812 0.07157  0.09799  -0.00407 592 HOH A O   
2310 O  O   . HOH E .   ? 0.44388 0.54841 0.19633 -0.11914 -0.02390 0.11257  593 HOH A O   
2311 O  O   . HOH E .   ? 0.44437 0.37885 0.29324 -0.22370 -0.16314 0.14176  594 HOH A O   
2312 O  O   . HOH E .   ? 0.16507 0.12387 0.06923 -0.06307 -0.03653 0.02668  595 HOH A O   
2313 O  O   . HOH E .   ? 0.50699 0.48189 0.34796 0.15487  0.16944  -0.07445 596 HOH A O   
2314 O  O   . HOH E .   ? 0.06829 0.15039 0.14990 0.02242  0.00944  -0.00094 597 HOH A O   
2315 O  O   . HOH E .   ? 0.63565 0.62540 0.20382 0.01645  0.06058  -0.11903 598 HOH A O   
2316 O  O   . HOH E .   ? 0.36027 0.17279 0.58092 0.04315  -0.09308 -0.06911 599 HOH A O   
2317 O  O   . HOH E .   ? 0.14547 0.11663 0.32889 -0.00431 0.07762  0.04981  600 HOH A O   
2318 O  O   . HOH E .   ? 0.11178 0.12222 0.20037 0.02315  -0.02607 -0.05249 601 HOH A O   
2319 O  O   . HOH E .   ? 0.11127 0.06991 0.22024 -0.00170 0.07454  0.01107  602 HOH A O   
2320 O  O   . HOH E .   ? 0.56882 0.41436 0.20936 -0.01251 -0.01612 0.13375  603 HOH A O   
2321 O  O   . HOH E .   ? 0.67010 0.29028 0.19581 0.21366  -0.03482 -0.01382 604 HOH A O   
2322 O  O   . HOH E .   ? 0.49309 0.44467 0.49931 0.07041  -0.14680 0.21817  605 HOH A O   
2323 O  O   . HOH E .   ? 0.45955 0.39900 0.19511 -0.04146 -0.08594 -0.10791 606 HOH A O   
2324 O  O   . HOH E .   ? 0.27073 0.32857 0.60642 -0.06278 -0.07280 -0.16495 607 HOH A O   
2325 O  O   . HOH E .   ? 0.25605 0.24187 0.28359 -0.10988 -0.13793 0.08895  608 HOH A O   
2326 O  O   . HOH E .   ? 0.07074 0.06952 0.20887 -0.00468 0.04514  0.00142  609 HOH A O   
2327 O  O   . HOH E .   ? 0.17277 0.32942 0.32460 -0.07360 -0.10210 0.09196  610 HOH A O   
2328 O  O   . HOH E .   ? 0.10440 0.20213 0.14483 0.04979  0.02763  0.04967  611 HOH A O   
2329 O  O   . HOH E .   ? 0.47927 0.31861 0.24393 -0.13430 -0.12926 0.11420  612 HOH A O   
2330 O  O   . HOH E .   ? 0.08962 0.17106 0.14423 -0.00849 -0.02432 0.06321  613 HOH A O   
2331 O  O   . HOH E .   ? 0.36501 0.44962 0.19913 0.05925  -0.02314 -0.14276 614 HOH A O   
2332 O  O   . HOH E .   ? 0.12190 0.14477 0.12093 -0.07242 -0.03583 0.04882  615 HOH A O   
2333 O  O   . HOH E .   ? 0.10184 0.09278 0.19134 0.00696  -0.03516 -0.03589 616 HOH A O   
2334 O  O   . HOH E .   ? 0.40654 0.43273 0.16024 0.01611  -0.10631 0.05096  617 HOH A O   
2335 O  O   . HOH E .   ? 0.29808 0.94173 0.34682 -0.03500 0.02452  -0.00207 618 HOH A O   
2336 O  O   . HOH E .   ? 0.19220 0.15825 0.55806 0.00482  0.13044  0.01964  619 HOH A O   
2337 O  O   . HOH E .   ? 0.32013 0.30091 0.41755 0.15110  -0.06038 0.02157  620 HOH A O   
2338 O  O   . HOH E .   ? 0.20664 0.15486 0.40455 -0.01745 0.05664  -0.00074 621 HOH A O   
2339 O  O   . HOH E .   ? 0.12490 0.24137 0.34593 0.01424  -0.02708 -0.16437 622 HOH A O   
2340 O  O   . HOH E .   ? 0.18437 0.15813 0.07859 0.04925  -0.04237 -0.03448 623 HOH A O   
2341 O  O   . HOH E .   ? 0.13589 0.19627 0.21853 0.02753  0.09274  0.04240  624 HOH A O   
2342 O  O   . HOH E .   ? 0.36770 0.39558 0.28608 0.21701  -0.03409 0.02842  625 HOH A O   
2343 O  O   . HOH E .   ? 0.08931 0.08931 0.17734 0.03254  0.01816  -0.01816 626 HOH A O   
2344 O  O   . HOH E .   ? 0.26271 0.30498 0.48834 0.07325  -0.07394 -0.20889 627 HOH A O   
2345 O  O   . HOH E .   ? 0.15741 0.07944 0.28142 0.01016  0.03833  -0.02493 628 HOH A O   
2346 O  O   . HOH E .   ? 0.78103 0.40084 0.33577 0.18760  0.04009  -0.10800 629 HOH A O   
2347 O  O   . HOH E .   ? 0.21192 0.20734 0.22801 0.11018  0.07962  0.04274  630 HOH A O   
2348 O  O   . HOH E .   ? 0.21142 0.13821 0.11717 0.00617  -0.00634 0.07346  631 HOH A O   
2349 O  O   . HOH E .   ? 0.09964 0.10219 0.12139 -0.01798 0.01360  -0.04620 632 HOH A O   
2350 O  O   . HOH E .   ? 0.79092 0.56226 0.49863 -0.28954 0.20845  -0.18274 633 HOH A O   
2351 O  O   . HOH E .   ? 0.61881 0.35873 0.26909 0.04311  0.11124  0.12785  634 HOH A O   
2352 O  O   . HOH E .   ? 0.23727 0.17334 0.12348 0.04549  -0.08556 -0.00521 635 HOH A O   
2353 O  O   . HOH E .   ? 0.25921 0.39259 0.11624 -0.03860 -0.02774 -0.04477 636 HOH A O   
2354 O  O   . HOH E .   ? 0.16003 0.22951 0.61329 -0.01653 -0.01807 0.06559  637 HOH A O   
2355 O  O   . HOH E .   ? 0.54932 0.21566 0.21629 -0.13645 0.13795  -0.05380 638 HOH A O   
2356 O  O   . HOH E .   ? 0.14000 0.09794 0.04342 0.01334  0.00839  -0.01910 639 HOH A O   
2357 O  O   . HOH E .   ? 0.17379 0.32197 0.11338 0.07238  -0.02288 -0.06846 640 HOH A O   
2358 O  O   . HOH E .   ? 0.22020 0.11284 0.20695 -0.05491 0.12061  -0.05210 641 HOH A O   
2359 O  O   . HOH E .   ? 0.14786 0.11566 0.31542 0.00006  -0.01079 -0.01965 642 HOH A O   
2360 O  O   . HOH E .   ? 0.23072 0.20756 0.22824 -0.00018 -0.10960 -0.07844 643 HOH A O   
2361 O  O   . HOH E .   ? 0.31304 0.19127 0.62839 0.06706  0.00859  -0.04080 644 HOH A O   
2362 O  O   . HOH E .   ? 0.30611 0.24554 0.45865 -0.14792 -0.04288 0.03338  645 HOH A O   
2363 O  O   . HOH E .   ? 0.13413 0.27178 0.44655 -0.03407 0.03364  0.07125  646 HOH A O   
2364 O  O   . HOH E .   ? 0.30025 0.37541 0.11453 -0.05370 0.04973  -0.01561 647 HOH A O   
2365 O  O   . HOH E .   ? 0.46116 0.54744 0.21130 0.22573  -0.01948 -0.04498 648 HOH A O   
2366 O  O   . HOH E .   ? 0.04864 0.08490 0.18391 -0.00222 -0.01502 0.01556  649 HOH A O   
2367 O  O   . HOH E .   ? 0.18542 0.21244 0.43724 0.05799  0.04746  0.13158  650 HOH A O   
2368 O  O   . HOH E .   ? 0.17498 0.14556 0.07783 -0.02299 0.00733  0.05109  651 HOH A O   
2369 O  O   . HOH E .   ? 0.13204 0.15017 0.04670 0.00641  0.02769  0.00356  652 HOH A O   
2370 O  O   . HOH E .   ? 0.22756 0.26023 0.25494 -0.08118 -0.07356 0.14374  653 HOH A O   
2371 O  O   . HOH E .   ? 0.34953 0.56649 0.21953 0.04291  -0.04034 0.14152  654 HOH A O   
2372 O  O   . HOH E .   ? 0.35455 0.18405 0.31740 0.02880  0.11682  -0.03897 655 HOH A O   
2373 O  O   . HOH E .   ? 0.54513 0.22321 0.44867 -0.01375 0.00026  0.16339  656 HOH A O   
2374 O  O   . HOH E .   ? 0.62283 0.62654 0.25729 -0.33324 0.06486  -0.03487 657 HOH A O   
2375 O  O   . HOH E .   ? 0.53425 0.43447 0.56969 -0.17416 -0.23405 -0.04617 658 HOH A O   
2376 O  O   . HOH E .   ? 0.25506 0.24929 0.65034 0.08391  -0.02736 0.03844  659 HOH A O   
2377 O  O   . HOH E .   ? 0.24052 0.17529 0.42051 -0.08068 -0.08399 0.06734  660 HOH A O   
2378 O  O   . HOH E .   ? 0.17494 0.16186 0.34735 -0.07484 0.00716  0.03885  661 HOH A O   
2379 O  O   . HOH E .   ? 0.25444 0.63029 0.24108 0.05997  -0.07126 -0.11997 662 HOH A O   
2380 O  O   . HOH E .   ? 0.10783 0.13851 0.17760 -0.04148 -0.04128 0.08685  663 HOH A O   
2381 O  O   . HOH E .   ? 0.43903 0.54354 0.48899 -0.18243 -0.23836 0.18212  664 HOH A O   
2382 O  O   . HOH E .   ? 0.25840 0.41841 0.23203 -0.05652 -0.05167 0.16461  665 HOH A O   
2383 O  O   . HOH E .   ? 0.25249 0.65809 0.27136 -0.00037 0.09387  0.04351  666 HOH A O   
2384 O  O   . HOH E .   ? 0.17131 0.45452 0.32950 0.03189  0.02554  0.22591  667 HOH A O   
2385 O  O   . HOH E .   ? 0.14181 0.13962 0.33043 0.05373  -0.03071 0.00876  668 HOH A O   
2386 O  O   . HOH E .   ? 0.64963 0.63700 0.30644 -0.28219 -0.15642 0.11857  669 HOH A O   
2387 O  O   . HOH E .   ? 0.49777 0.65676 0.23930 0.30055  -0.02007 0.01927  670 HOH A O   
2388 O  O   . HOH E .   ? 0.44429 0.53293 0.13990 -0.04661 -0.01878 0.01327  671 HOH A O   
2389 O  O   . HOH E .   ? 0.33020 0.21810 0.77671 -0.04731 -0.07671 0.05842  672 HOH A O   
2390 O  O   . HOH E .   ? 0.31679 0.36345 0.13064 0.13342  0.04162  0.03841  673 HOH A O   
2391 O  O   . HOH E .   ? 0.10863 0.25450 0.08722 -0.02963 -0.00321 -0.05257 674 HOH A O   
2392 O  O   . HOH E .   ? 0.36969 0.25305 0.26506 0.02540  -0.04618 -0.14755 675 HOH A O   
2393 O  O   . HOH E .   ? 0.21743 0.35697 0.65182 0.00372  -0.06792 0.20713  676 HOH A O   
2394 O  O   . HOH E .   ? 0.25428 0.23548 0.07269 0.04047  0.01282  0.00360  677 HOH A O   
2395 O  O   . HOH E .   ? 0.10796 0.19586 0.05493 0.00737  -0.00410 -0.02566 678 HOH A O   
2396 O  O   . HOH E .   ? 0.28203 0.59648 0.16787 0.03635  -0.02287 -0.07364 679 HOH A O   
2397 O  O   . HOH E .   ? 0.46470 0.25924 0.52217 0.15430  -0.06591 0.09597  680 HOH A O   
2398 O  O   . HOH E .   ? 0.36907 0.36561 0.70761 0.13238  0.18908  0.01519  681 HOH A O   
2399 O  O   . HOH E .   ? 0.40506 0.19788 0.47587 0.00271  0.22195  0.05800  682 HOH A O   
2400 O  O   . HOH E .   ? 0.23315 0.29772 0.55812 -0.02928 0.00266  0.21066  683 HOH A O   
2401 O  O   . HOH E .   ? 0.19373 0.14792 0.23172 -0.00106 -0.00477 -0.03218 684 HOH A O   
2402 O  O   . HOH E .   ? 0.44883 0.54173 0.36114 0.02481  0.13567  0.21379  685 HOH A O   
2403 O  O   . HOH E .   ? 0.13299 0.15854 0.18725 0.01711  -0.08360 -0.02485 686 HOH A O   
2404 O  O   . HOH E .   ? 0.47424 0.55293 0.20969 -0.02780 -0.13758 -0.05883 687 HOH A O   
2405 O  O   . HOH E .   ? 0.19011 0.49733 0.43367 0.02230  -0.13710 -0.00488 688 HOH A O   
2406 O  O   . HOH E .   ? 0.59574 0.48216 0.20399 0.04708  -0.13348 -0.01512 689 HOH A O   
2407 O  O   . HOH E .   ? 0.43062 0.26052 0.53648 -0.13723 -0.09690 -0.07959 690 HOH A O   
2408 O  O   . HOH E .   ? 0.39725 0.37038 0.59687 -0.04799 0.21498  0.12953  691 HOH A O   
2409 O  O   . HOH E .   ? 0.20717 0.48812 0.28904 0.10578  0.02242  -0.12063 692 HOH A O   
2410 O  O   . HOH E .   ? 0.58257 0.53009 0.34244 0.09506  -0.11446 -0.21688 693 HOH A O   
2411 O  O   . HOH E .   ? 0.68867 0.23012 0.52222 -0.14945 -0.01179 0.03046  694 HOH A O   
2412 O  O   . HOH E .   ? 0.50189 0.35947 0.67784 0.16949  -0.21562 -0.20302 695 HOH A O   
2413 O  O   . HOH E .   ? 0.44932 0.35825 0.24044 -0.19519 -0.11599 0.11839  696 HOH A O   
2414 O  O   . HOH E .   ? 0.25902 0.62473 0.20091 -0.00481 0.03120  -0.11376 697 HOH A O   
2415 O  O   . HOH E .   ? 0.46453 0.22832 0.59698 0.05180  0.25310  -0.00669 698 HOH A O   
2416 O  O   . HOH E .   ? 0.50830 0.45738 0.34585 -0.06262 -0.23697 0.00281  699 HOH A O   
2417 O  O   . HOH E .   ? 0.77469 0.20407 0.22256 0.04878  0.09846  0.01088  700 HOH A O   
2418 O  O   . HOH E .   ? 0.14189 0.22117 0.48154 0.00196  -0.07782 -0.01657 701 HOH A O   
2419 O  O   . HOH E .   ? 0.30948 0.29176 0.49019 -0.04840 -0.20314 -0.02585 702 HOH A O   
2420 O  O   . HOH E .   ? 0.55363 0.13890 0.14262 -0.00723 0.02122  -0.00079 703 HOH A O   
2421 O  O   . HOH E .   ? 0.29833 0.25778 0.15859 0.07453  0.06700  0.09203  704 HOH A O   
2422 O  O   . HOH E .   ? 0.16784 0.51345 0.50507 0.09765  -0.04726 0.01968  705 HOH A O   
2423 O  O   . HOH E .   ? 0.57604 0.40242 0.36097 0.19451  -0.22126 -0.06424 706 HOH A O   
2424 O  O   . HOH E .   ? 0.13205 0.25009 0.31049 -0.08812 0.02433  0.02557  707 HOH A O   
2425 O  O   . HOH E .   ? 0.28303 0.87422 0.31243 -0.15921 0.04164  -0.02886 708 HOH A O   
2426 O  O   . HOH E .   ? 0.41217 0.42357 0.17667 -0.04194 -0.08422 -0.09400 709 HOH A O   
2427 O  O   . HOH E .   ? 0.39118 0.46620 0.65105 -0.07301 0.22943  0.04883  710 HOH A O   
2428 O  O   . HOH E .   ? 0.26440 0.38452 0.13421 -0.16943 -0.01982 0.03845  711 HOH A O   
2429 O  O   . HOH E .   ? 0.23025 0.62964 0.35405 -0.13169 -0.05739 0.18714  712 HOH A O   
2430 O  O   . HOH E .   ? 0.33795 0.34885 0.14582 -0.13947 0.02495  -0.06685 713 HOH A O   
2431 O  O   . HOH E .   ? 0.30373 0.56178 0.18963 -0.11686 -0.02661 -0.07795 714 HOH A O   
2432 O  O   . HOH E .   ? 0.35005 0.74532 0.41277 -0.07925 -0.14700 0.20436  715 HOH A O   
2433 O  O   . HOH E .   ? 0.20812 0.22180 0.33855 -0.01485 0.09552  0.04636  716 HOH A O   
2434 O  O   . HOH E .   ? 0.11695 0.26882 0.37973 0.00948  -0.04812 -0.08504 717 HOH A O   
2435 O  O   . HOH E .   ? 0.23161 0.10427 0.27227 -0.00644 -0.08601 0.05136  718 HOH A O   
2436 O  O   . HOH E .   ? 0.41174 0.77901 0.50335 0.22310  0.18829  0.20848  719 HOH A O   
2437 O  O   . HOH E .   ? 0.26439 0.26013 0.08737 0.00965  0.03715  -0.04673 720 HOH A O   
2438 O  O   . HOH E .   ? 0.22836 0.60093 0.61519 -0.05158 -0.06598 0.24881  721 HOH A O   
2439 O  O   . HOH E .   ? 0.94035 0.41160 0.39755 0.06035  -0.25024 -0.10006 722 HOH A O   
2440 O  O   . HOH E .   ? 0.54487 0.42392 0.28184 -0.00222 -0.05249 -0.18987 723 HOH A O   
2441 O  O   . HOH E .   ? 0.53851 0.70998 0.36084 -0.13266 -0.17385 0.20009  724 HOH A O   
2442 O  O   . HOH E .   ? 0.33558 0.23999 0.19646 -0.02811 0.10032  0.07727  725 HOH A O   
2443 O  O   . HOH E .   ? 0.42457 0.27396 0.59452 -0.14937 0.08679  -0.11457 726 HOH A O   
2444 O  O   . HOH E .   ? 0.20643 0.43830 0.29264 -0.13386 0.05197  -0.13849 727 HOH A O   
2445 O  O   . HOH E .   ? 0.41437 0.22446 0.57721 0.08055  -0.23067 -0.10227 728 HOH A O   
2446 O  O   . HOH E .   ? 0.32692 0.28962 0.51021 -0.15596 -0.05611 0.09049  729 HOH A O   
2447 O  O   . HOH E .   ? 0.39949 0.32169 0.39174 0.09033  -0.21266 -0.13699 730 HOH A O   
2448 O  O   . HOH E .   ? 0.19927 0.60308 0.61725 -0.05114 -0.03929 -0.13039 731 HOH A O   
2449 O  O   . HOH E .   ? 0.53515 0.53610 0.24316 -0.05419 -0.12676 -0.12608 732 HOH A O   
2450 O  O   . HOH E .   ? 0.11016 0.42276 0.15721 -0.02043 -0.01099 0.03498  733 HOH A O   
2451 O  O   . HOH E .   ? 0.16371 0.12149 0.37589 -0.00473 0.08237  -0.05891 734 HOH A O   
2452 O  O   . HOH E .   ? 0.31211 0.41291 0.53670 -0.02497 0.11062  -0.25428 735 HOH A O   
2453 O  O   . HOH E .   ? 0.26360 0.36189 0.50868 -0.04515 0.03868  0.01506  736 HOH A O   
2454 O  O   . HOH E .   ? 0.42408 0.29199 0.23368 -0.05182 0.04292  0.13530  737 HOH A O   
2455 O  O   . HOH E .   ? 0.34589 0.45659 0.21850 0.07170  -0.13614 0.00079  738 HOH A O   
2456 O  O   . HOH E .   ? 0.14048 0.18252 0.11876 0.00338  -0.03801 -0.07334 739 HOH A O   
2457 O  O   . HOH E .   ? 0.49427 0.28921 0.55912 -0.11140 0.15194  -0.18156 740 HOH A O   
2458 O  O   . HOH E .   ? 0.20095 0.41890 0.53578 -0.10443 0.01341  0.10783  741 HOH A O   
2459 O  O   . HOH E .   ? 0.31005 0.40547 0.17759 0.02171  -0.06633 -0.11247 742 HOH A O   
2460 O  O   . HOH E .   ? 0.18921 0.53819 0.28071 0.10867  0.05286  0.11482  743 HOH A O   
2461 O  O   . HOH E .   ? 0.53316 0.61248 0.45792 -0.10413 -0.21717 -0.16961 744 HOH A O   
2462 O  O   . HOH E .   ? 0.53080 0.46078 0.26593 0.00378  -0.18545 0.06777  745 HOH A O   
2463 O  O   . HOH E .   ? 0.30674 0.57456 0.18772 0.16137  -0.03458 0.02364  746 HOH A O   
2464 O  O   . HOH E .   ? 0.58079 0.30319 0.42434 -0.12724 0.27998  -0.10493 747 HOH A O   
2465 O  O   . HOH E .   ? 0.61092 0.21615 0.19269 -0.07452 0.05912  0.02570  748 HOH A O   
2466 O  O   . HOH E .   ? 0.33074 0.30662 0.47769 -0.08908 0.15870  -0.19802 749 HOH A O   
2467 O  O   . HOH E .   ? 0.20676 0.16993 0.48158 0.01321  0.09599  -0.07453 750 HOH A O   
2468 O  O   . HOH E .   ? 0.53703 0.24922 0.19189 -0.18048 0.00022  -0.01674 751 HOH A O   
2469 O  O   . HOH E .   ? 0.44403 0.27893 0.44242 0.13538  -0.25109 -0.13235 752 HOH A O   
2470 O  O   . HOH E .   ? 0.46261 0.66607 0.41434 -0.00901 0.09929  0.08588  753 HOH A O   
2471 O  O   . HOH E .   ? 0.83482 0.54626 0.25530 -0.02067 0.11980  -0.07766 754 HOH A O   
2472 O  O   . HOH E .   ? 0.42720 0.35703 0.24347 -0.17531 0.08616  -0.09676 755 HOH A O   
2473 O  O   . HOH E .   ? 0.48190 0.40906 0.19623 -0.15324 -0.11008 0.03828  756 HOH A O   
2474 O  O   . HOH E .   ? 0.43856 0.41698 0.15346 -0.05069 -0.09392 0.01810  757 HOH A O   
2475 O  O   . HOH E .   ? 0.44746 0.40516 0.25028 0.00715  -0.10181 0.14934  758 HOH A O   
2476 O  O   . HOH E .   ? 0.67518 0.69708 0.17635 0.00920  0.01996  -0.01442 759 HOH A O   
2477 O  O   . HOH E .   ? 0.38123 0.43709 0.49504 0.12642  -0.02888 0.22261  760 HOH A O   
2478 O  O   . HOH E .   ? 0.33732 0.46136 0.40820 0.06034  -0.11838 -0.23669 761 HOH A O   
2479 O  O   . HOH E .   ? 0.47451 0.44339 0.60501 0.23693  -0.17895 -0.10991 762 HOH A O   
2480 O  O   . HOH E .   ? 0.15619 0.26334 0.49463 0.01846  -0.05872 -0.15407 763 HOH A O   
2481 O  O   . HOH E .   ? 0.51281 0.36867 0.59019 0.00504  -0.11624 0.24486  764 HOH A O   
2482 O  O   . HOH E .   ? 0.63669 0.52187 0.25474 0.20068  -0.12894 -0.00224 765 HOH A O   
2483 O  O   . HOH E .   ? 0.41799 0.51502 0.26320 0.05103  0.17387  -0.05571 766 HOH A O   
2484 O  O   . HOH E .   ? 0.41624 0.65776 0.36137 0.06798  -0.12467 0.18327  767 HOH A O   
2485 O  O   . HOH E .   ? 0.34676 0.38784 0.30212 0.14856  -0.05141 -0.14602 768 HOH A O   
2486 O  O   . HOH E .   ? 0.59087 0.33713 0.28997 0.22804  -0.18175 -0.10532 769 HOH A O   
2487 O  O   . HOH E .   ? 0.35086 0.34899 0.17789 -0.02078 0.08600  -0.10188 770 HOH A O   
2488 O  O   . HOH E .   ? 0.66468 0.59608 0.61648 0.04627  -0.38171 -0.01606 771 HOH A O   
2489 O  O   . HOH E .   ? 0.66044 0.33162 0.50475 0.02234  0.01628  -0.23418 772 HOH A O   
2490 O  O   . HOH E .   ? 0.56398 0.53111 0.39073 -0.11138 0.17046  0.17569  773 HOH A O   
2491 O  O   . HOH E .   ? 0.14405 0.29690 0.44199 0.00252  0.06178  -0.03480 774 HOH A O   
2492 O  O   . HOH E .   ? 0.22555 0.33841 0.09634 -0.06237 -0.02049 0.02329  775 HOH A O   
2493 O  O   . HOH E .   ? 0.21441 0.67795 0.34095 -0.08707 0.05364  -0.17694 776 HOH A O   
2494 O  O   . HOH E .   ? 0.57817 0.18382 0.35032 0.09366  0.09457  -0.01066 777 HOH A O   
2495 O  O   . HOH E .   ? 0.47011 0.71628 0.38025 -0.03718 0.23726  -0.00218 778 HOH A O   
2496 O  O   . HOH E .   ? 0.50870 0.23321 0.14873 0.17171  0.01594  0.00809  779 HOH A O   
2497 O  O   . HOH E .   ? 0.32550 0.61409 0.47081 0.06011  -0.10261 -0.29533 780 HOH A O   
2498 O  O   . HOH E .   ? 0.61458 0.35042 0.16832 0.07533  -0.05623 -0.02144 781 HOH A O   
2499 O  O   . HOH E .   ? 0.20395 0.23192 0.69078 0.00093  -0.06087 0.12626  782 HOH A O   
2500 O  O   . HOH E .   ? 0.15131 0.36554 0.50717 -0.04127 -0.06415 0.06037  783 HOH A O   
2501 O  O   . HOH E .   ? 0.43450 0.38862 0.22550 -0.06710 -0.12466 -0.08464 784 HOH A O   
2502 O  O   . HOH E .   ? 0.29204 0.51157 0.54601 -0.18776 -0.08012 0.04194  785 HOH A O   
2503 O  O   . HOH E .   ? 0.22391 0.55614 0.41078 0.07088  0.06922  -0.12190 786 HOH A O   
2504 O  O   . HOH E .   ? 0.46769 0.43200 0.25506 0.25308  -0.12083 -0.12160 787 HOH A O   
2505 O  O   . HOH E .   ? 0.48788 0.56185 0.29974 -0.07638 0.16017  0.12732  788 HOH A O   
2506 O  O   . HOH E .   ? 0.24687 0.18449 0.69740 -0.00045 0.14111  -0.00093 789 HOH A O   
2507 O  O   . HOH E .   ? 0.54448 0.51706 0.53430 -0.19410 -0.16168 -0.16881 790 HOH A O   
2508 O  O   . HOH E .   ? 0.54527 0.44266 0.29412 -0.07989 -0.08629 0.18395  791 HOH A O   
2509 O  O   . HOH E .   ? 0.19099 0.33210 0.48900 -0.03566 -0.13338 0.01187  792 HOH A O   
2510 O  O   . HOH E .   ? 0.45756 0.46978 0.28628 0.06950  -0.05331 0.18635  793 HOH A O   
2511 O  O   . HOH E .   ? 0.43519 0.46956 0.15613 0.01063  -0.07532 -0.07014 794 HOH A O   
2512 O  O   . HOH E .   ? 0.40204 0.39336 0.61524 -0.19907 -0.13337 0.00127  795 HOH A O   
2513 O  O   . HOH E .   ? 0.15413 0.32031 0.44373 0.03989  -0.03524 -0.18049 796 HOH A O   
2514 O  O   . HOH E .   ? 0.40760 0.51030 0.29142 -0.01317 -0.06067 0.20480  797 HOH A O   
2515 O  O   . HOH E .   ? 0.28964 0.60052 0.20140 0.03068  0.03282  -0.11569 798 HOH A O   
2516 O  O   . HOH E .   ? 0.25243 0.47794 0.44034 -0.05996 -0.10719 -0.15472 799 HOH A O   
2517 O  O   . HOH E .   ? 0.54526 0.52607 0.21154 -0.03041 -0.09690 -0.12348 800 HOH A O   
2518 O  O   . HOH E .   ? 0.29772 0.39839 0.52737 0.12157  -0.03884 0.17477  801 HOH A O   
2519 O  O   . HOH E .   ? 0.30627 0.33054 0.65835 -0.09700 0.19905  -0.11364 802 HOH A O   
2520 O  O   . HOH E .   ? 0.28776 0.71250 0.31161 0.01590  0.06851  -0.17403 803 HOH A O   
2521 O  O   . HOH E .   ? 0.64963 0.30617 0.42276 0.04643  0.06308  0.18187  804 HOH A O   
2522 O  O   . HOH E .   ? 0.60748 0.56965 0.22658 0.18247  0.07210  -0.04670 805 HOH A O   
2523 O  O   . HOH E .   ? 0.23090 0.08462 0.26827 -0.03499 -0.03172 0.03047  806 HOH A O   
2524 O  O   . HOH E .   ? 0.14236 0.48880 0.25302 -0.06061 0.00368  0.07403  807 HOH A O   
2525 O  O   . HOH E .   ? 0.31371 0.53022 0.17206 -0.03437 -0.07155 0.06071  808 HOH A O   
2526 O  O   . HOH E .   ? 0.47987 0.42454 0.16232 0.01416  0.05956  -0.09221 809 HOH A O   
2527 O  O   . HOH E .   ? 0.29964 0.48944 0.35995 0.11025  0.07267  -0.15690 810 HOH A O   
2528 O  O   . HOH E .   ? 0.38465 0.36907 0.52668 0.17342  0.20199  0.18230  811 HOH A O   
2529 O  O   . HOH E .   ? 0.52281 0.53526 0.15010 -0.04892 -0.04315 -0.00166 812 HOH A O   
2530 O  O   . HOH E .   ? 0.26144 0.38115 0.14538 0.07950  0.01631  0.09324  813 HOH A O   
2531 O  O   . HOH E .   ? 0.49523 0.55550 0.18234 0.15771  0.04918  0.04377  814 HOH A O   
2532 O  O   . HOH E .   ? 0.27090 0.22028 0.07361 -0.01920 0.01114  -0.02307 815 HOH A O   
2533 O  O   . HOH E .   ? 0.21026 0.21652 0.68025 0.01359  -0.11031 -0.09990 816 HOH A O   
2534 O  O   . HOH E .   ? 0.50229 0.31767 0.30724 0.01181  0.02919  -0.01362 817 HOH A O   
2535 O  O   . HOH E .   ? 0.42157 0.46682 0.39664 0.19279  -0.19493 -0.08477 818 HOH A O   
2536 O  O   . HOH E .   ? 0.33389 0.21534 0.40087 -0.03991 0.20555  -0.04377 819 HOH A O   
2537 O  O   . HOH E .   ? 0.43044 0.47808 0.43406 -0.15849 -0.01255 0.22633  820 HOH A O   
2538 O  O   . HOH E .   ? 0.23479 0.37949 0.70443 -0.09045 0.07936  0.01741  821 HOH A O   
2539 O  O   . HOH E .   ? 0.42136 0.22496 0.74119 -0.03411 -0.02622 0.12447  822 HOH A O   
2540 O  O   . HOH E .   ? 0.24797 0.17575 0.59826 0.02043  0.06660  -0.05282 823 HOH A O   
2541 O  O   . HOH E .   ? 0.54833 0.56788 0.21457 -0.02139 -0.13928 -0.07373 824 HOH A O   
2542 O  O   . HOH E .   ? 0.37117 0.31409 0.16012 0.16194  -0.04146 -0.06855 825 HOH A O   
2543 O  O   . HOH E .   ? 0.25244 0.31152 0.09847 -0.05911 0.01522  0.03827  826 HOH A O   
2544 O  O   . HOH E .   ? 0.63103 0.32468 0.17185 -0.07444 0.05606  0.00661  827 HOH A O   
2545 O  O   . HOH E .   ? 0.36386 0.57084 0.28422 -0.11414 -0.12595 0.15893  828 HOH A O   
2546 O  O   . HOH E .   ? 0.28519 0.53146 0.17047 0.15782  -0.01547 -0.06941 829 HOH A O   
2547 O  O   . HOH E .   ? 0.36653 0.47962 0.13466 0.06931  0.01953  -0.03337 830 HOH A O   
2548 O  O   . HOH E .   ? 0.58637 0.25738 0.52349 0.10196  -0.32546 -0.09192 831 HOH A O   
2549 O  O   . HOH E .   ? 0.49604 0.45083 0.19812 -0.06604 0.06861  0.10946  832 HOH A O   
2550 O  O   . HOH E .   ? 0.54060 0.57924 0.46498 -0.00704 0.19034  0.23517  833 HOH A O   
2551 O  O   . HOH E .   ? 0.45848 0.70696 0.60416 -0.29095 -0.12282 -0.03775 834 HOH A O   
2552 O  O   . HOH E .   ? 0.14504 0.48175 0.49879 0.07811  0.02344  -0.00998 835 HOH A O   
2553 O  O   . HOH E .   ? 0.48170 0.24607 0.22250 0.01023  -0.12900 -0.05917 836 HOH A O   
2554 O  O   . HOH E .   ? 0.37447 0.42313 0.16759 -0.00632 0.11094  -0.05085 837 HOH A O   
2555 O  O   . HOH E .   ? 0.54923 0.37517 0.18783 -0.15628 0.08254  -0.05901 838 HOH A O   
2556 O  O   . HOH E .   ? 0.65309 0.54855 0.39748 0.10214  -0.14274 0.21557  839 HOH A O   
2557 O  O   . HOH E .   ? 0.56828 0.47981 0.26820 -0.25438 -0.09125 0.12538  840 HOH A O   
2558 O  O   . HOH E .   ? 0.55322 0.65697 0.27867 -0.02999 -0.18085 -0.09170 841 HOH A O   
2559 O  O   . HOH E .   ? 0.59087 0.49819 0.19595 0.10897  0.10211  0.02995  842 HOH A O   
2560 O  O   . HOH E .   ? 0.46595 0.27538 0.15052 0.06981  -0.01755 0.05818  843 HOH A O   
2561 O  O   . HOH E .   ? 0.25963 0.58956 0.19997 0.18721  -0.01711 -0.00331 844 HOH A O   
2562 O  O   . HOH E .   ? 0.44611 0.27327 0.36753 -0.15598 -0.22206 0.13108  845 HOH A O   
2563 O  O   . HOH E .   ? 0.67229 0.57140 0.26453 0.00565  -0.00936 -0.19505 846 HOH A O   
2564 O  O   . HOH E .   ? 0.71029 0.61909 0.30648 -0.05418 0.12111  0.18635  847 HOH A O   
2565 O  O   . HOH E .   ? 0.31803 0.44007 0.73615 0.13692  -0.02966 -0.16557 848 HOH A O   
2566 O  O   . HOH E .   ? 0.36533 0.34237 0.59022 -0.18664 -0.08173 -0.00955 849 HOH A O   
2567 O  O   . HOH E .   ? 0.60224 0.61088 0.18222 -0.01274 0.04962  0.09181  850 HOH A O   
2568 O  O   . HOH E .   ? 0.61036 0.61054 0.24030 -0.08873 -0.05983 -0.13900 851 HOH A O   
2569 O  O   . HOH E .   ? 0.37779 0.41270 0.62666 0.21357  0.07942  -0.04821 852 HOH A O   
2570 O  O   . HOH E .   ? 0.58708 0.75524 0.29063 -0.02266 -0.19920 0.00468  853 HOH A O   
2571 O  O   . HOH E .   ? 0.58604 0.28241 0.52218 -0.12645 -0.04427 -0.16243 854 HOH A O   
2572 O  O   . HOH E .   ? 0.26006 0.19871 0.60207 -0.05806 0.12151  -0.05674 855 HOH A O   
2573 O  O   . HOH E .   ? 0.53805 0.41259 0.39697 -0.24251 0.22922  -0.17978 856 HOH A O   
2574 O  O   . HOH E .   ? 0.65073 0.38626 0.56853 -0.14023 -0.10268 -0.21461 857 HOH A O   
2575 O  O   . HOH E .   ? 0.54219 0.44036 0.23515 0.04918  -0.07546 0.14396  858 HOH A O   
2576 O  O   . HOH E .   ? 0.72919 0.61629 0.24999 0.27938  0.03970  -0.01686 859 HOH A O   
2577 O  O   . HOH E .   ? 0.31922 0.61451 0.22572 0.21662  -0.05369 -0.04569 860 HOH A O   
2578 O  O   . HOH E .   ? 0.26806 0.38645 0.34963 -0.14700 -0.11853 0.19498  861 HOH A O   
2579 O  O   . HOH E .   ? 0.38251 0.34314 0.58117 0.02294  0.23412  -0.10371 862 HOH A O   
2580 O  O   . HOH E .   ? 0.74972 0.39053 0.28045 -0.09869 0.17817  -0.07570 863 HOH A O   
2581 O  O   . HOH E .   ? 0.39241 0.32475 0.87005 -0.01849 0.00440  0.07848  864 HOH A O   
2582 O  O   . HOH E .   ? 0.39477 0.35891 0.52517 0.02139  -0.25789 0.04753  865 HOH A O   
2583 O  O   . HOH E .   ? 0.14998 0.34700 0.39753 0.00757  -0.06815 -0.13032 866 HOH A O   
2584 O  O   . HOH E .   ? 0.41376 0.81151 0.63982 -0.29210 -0.10353 0.07643  867 HOH A O   
2585 O  O   . HOH E .   ? 0.40034 0.29580 0.19173 -0.07774 0.01850  0.10818  868 HOH A O   
2586 O  O   . HOH E .   ? 0.35182 0.57063 0.25052 -0.12470 0.06475  0.10777  869 HOH A O   
2587 O  O   . HOH E .   ? 0.26908 0.68659 0.19174 -0.09894 -0.02266 -0.03404 870 HOH A O   
2588 O  O   . HOH E .   ? 0.35534 0.59171 0.67049 -0.16503 -0.18422 -0.07527 871 HOH A O   
2589 O  O   . HOH E .   ? 0.40534 0.41969 0.55468 -0.23209 -0.09156 0.05496  872 HOH A O   
2590 O  O   . HOH E .   ? 0.23127 0.43792 0.52016 0.07105  -0.01754 -0.07400 873 HOH A O   
2591 O  O   . HOH E .   ? 0.46947 0.39428 0.55448 0.00103  0.15713  0.23314  874 HOH A O   
2592 O  O   . HOH E .   ? 0.37481 0.65437 0.40489 -0.19858 -0.04559 -0.15972 875 HOH A O   
# 
