data_8W40
# 
_entry.id   8W40 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.402 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   8W40         pdb_00008w40 10.2210/pdb8w40/pdb 
WWPDB D_1000281669 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-02-26 
_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                        8W40 
_pdbx_database_status.recvd_initial_deposition_date   2024-02-22 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              jeremy.mills@asu.edu 
_pdbx_contact_author.name_first         Jeremy 
_pdbx_contact_author.name_last          Mills 
_pdbx_contact_author.name_mi            H 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0003-2017-1846 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Kelly, P.I.'     1 0000-0002-7022-8209 
'Henderson, J.H.' 2 0000-0002-9969-4895 
'Mills, J.H.'     3 0000-0003-2017-1846 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     
'Computational design of a fluorogenic metalloprotein containing the non-canonical amino acid 3-(8-hydroxyquinolin-3-yl)-L-alanine' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Kelly, P.I.'     1 0000-0002-7022-8209 
primary 'Henderson, J.N.' 2 0000-0002-9969-4895 
primary 'Mills, J.H.'     3 0000-0003-2017-1846 
# 
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 'Hydroxyquinonline fluorescent protein' 29805.121 1   ? ? ? ? 
2 non-polymer syn 'SULFATE ION'                           96.063    4   ? ? ? ? 
3 non-polymer syn 'ZINC ION'                              65.409    1   ? ? ? ? 
4 water       nat water                                   18.015    313 ? ? ? ? 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   yes 
_entity_poly.pdbx_seq_one_letter_code       
;MPRYLKGWLEDVVQLSLRRPSVRASRQRPIISLNERILEFNKRNITAIIAEYKRKSPSGLDVERDPIEYAKFMERYAVGL
SILTEEKYFNGSYETLRKIASSVSIPILM(HQA)DFIVKESQIDDAYNLGADTVALIVKILTERELESLLEYARSYGMEP
LIEINDENDLDIALRIGARFIGITSRDEETLEINKENQRKLISMIPSNVVKVAESGISERNEIEELRKLGVNAFLIGSSL
MRNPEKIKELIEGSLEHHHHHH
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MPRYLKGWLEDVVQLSLRRPSVRASRQRPIISLNERILEFNKRNITAIIAEYKRKSPSGLDVERDPIEYAKFMERYAVGL
SILTEEKYFNGSYETLRKIASSVSIPILMADFIVKESQIDDAYNLGADTVALIVKILTERELESLLEYARSYGMEPLIEI
NDENDLDIALRIGARFIGITSRDEETLEINKENQRKLISMIPSNVVKVAESGISERNEIEELRKLGVNAFLIGSSLMRNP
EKIKELIEGSLEHHHHHH
;
_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 'SULFATE ION' SO4 
3 'ZINC ION'    ZN  
4 water         HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   PRO n 
1 3   ARG n 
1 4   TYR n 
1 5   LEU n 
1 6   LYS n 
1 7   GLY n 
1 8   TRP n 
1 9   LEU n 
1 10  GLU n 
1 11  ASP n 
1 12  VAL n 
1 13  VAL n 
1 14  GLN n 
1 15  LEU n 
1 16  SER n 
1 17  LEU n 
1 18  ARG n 
1 19  ARG n 
1 20  PRO n 
1 21  SER n 
1 22  VAL n 
1 23  ARG n 
1 24  ALA n 
1 25  SER n 
1 26  ARG n 
1 27  GLN n 
1 28  ARG n 
1 29  PRO n 
1 30  ILE n 
1 31  ILE n 
1 32  SER n 
1 33  LEU n 
1 34  ASN n 
1 35  GLU n 
1 36  ARG n 
1 37  ILE n 
1 38  LEU n 
1 39  GLU n 
1 40  PHE n 
1 41  ASN n 
1 42  LYS n 
1 43  ARG n 
1 44  ASN n 
1 45  ILE n 
1 46  THR n 
1 47  ALA n 
1 48  ILE n 
1 49  ILE n 
1 50  ALA n 
1 51  GLU n 
1 52  TYR n 
1 53  LYS n 
1 54  ARG n 
1 55  LYS n 
1 56  SER n 
1 57  PRO n 
1 58  SER n 
1 59  GLY n 
1 60  LEU n 
1 61  ASP n 
1 62  VAL n 
1 63  GLU n 
1 64  ARG n 
1 65  ASP n 
1 66  PRO n 
1 67  ILE n 
1 68  GLU n 
1 69  TYR n 
1 70  ALA n 
1 71  LYS n 
1 72  PHE n 
1 73  MET n 
1 74  GLU n 
1 75  ARG n 
1 76  TYR n 
1 77  ALA n 
1 78  VAL n 
1 79  GLY n 
1 80  LEU n 
1 81  SER n 
1 82  ILE n 
1 83  LEU n 
1 84  THR n 
1 85  GLU n 
1 86  GLU n 
1 87  LYS n 
1 88  TYR n 
1 89  PHE n 
1 90  ASN n 
1 91  GLY n 
1 92  SER n 
1 93  TYR n 
1 94  GLU n 
1 95  THR n 
1 96  LEU n 
1 97  ARG n 
1 98  LYS n 
1 99  ILE n 
1 100 ALA n 
1 101 SER n 
1 102 SER n 
1 103 VAL n 
1 104 SER n 
1 105 ILE n 
1 106 PRO n 
1 107 ILE n 
1 108 LEU n 
1 109 MET n 
1 110 HQA n 
1 111 ASP n 
1 112 PHE n 
1 113 ILE n 
1 114 VAL n 
1 115 LYS n 
1 116 GLU n 
1 117 SER n 
1 118 GLN n 
1 119 ILE n 
1 120 ASP n 
1 121 ASP n 
1 122 ALA n 
1 123 TYR n 
1 124 ASN n 
1 125 LEU n 
1 126 GLY n 
1 127 ALA n 
1 128 ASP n 
1 129 THR n 
1 130 VAL n 
1 131 ALA n 
1 132 LEU n 
1 133 ILE n 
1 134 VAL n 
1 135 LYS n 
1 136 ILE n 
1 137 LEU n 
1 138 THR n 
1 139 GLU n 
1 140 ARG n 
1 141 GLU n 
1 142 LEU n 
1 143 GLU n 
1 144 SER n 
1 145 LEU n 
1 146 LEU n 
1 147 GLU n 
1 148 TYR n 
1 149 ALA n 
1 150 ARG n 
1 151 SER n 
1 152 TYR n 
1 153 GLY n 
1 154 MET n 
1 155 GLU n 
1 156 PRO n 
1 157 LEU n 
1 158 ILE n 
1 159 GLU n 
1 160 ILE n 
1 161 ASN n 
1 162 ASP n 
1 163 GLU n 
1 164 ASN n 
1 165 ASP n 
1 166 LEU n 
1 167 ASP n 
1 168 ILE n 
1 169 ALA n 
1 170 LEU n 
1 171 ARG n 
1 172 ILE n 
1 173 GLY n 
1 174 ALA n 
1 175 ARG n 
1 176 PHE n 
1 177 ILE n 
1 178 GLY n 
1 179 ILE n 
1 180 THR n 
1 181 SER n 
1 182 ARG n 
1 183 ASP n 
1 184 GLU n 
1 185 GLU n 
1 186 THR n 
1 187 LEU n 
1 188 GLU n 
1 189 ILE n 
1 190 ASN n 
1 191 LYS n 
1 192 GLU n 
1 193 ASN n 
1 194 GLN n 
1 195 ARG n 
1 196 LYS n 
1 197 LEU n 
1 198 ILE n 
1 199 SER n 
1 200 MET n 
1 201 ILE n 
1 202 PRO n 
1 203 SER n 
1 204 ASN n 
1 205 VAL n 
1 206 VAL n 
1 207 LYS n 
1 208 VAL n 
1 209 ALA n 
1 210 GLU n 
1 211 SER n 
1 212 GLY n 
1 213 ILE n 
1 214 SER n 
1 215 GLU n 
1 216 ARG n 
1 217 ASN n 
1 218 GLU n 
1 219 ILE n 
1 220 GLU n 
1 221 GLU n 
1 222 LEU n 
1 223 ARG n 
1 224 LYS n 
1 225 LEU n 
1 226 GLY n 
1 227 VAL n 
1 228 ASN n 
1 229 ALA n 
1 230 PHE n 
1 231 LEU n 
1 232 ILE n 
1 233 GLY n 
1 234 SER n 
1 235 SER n 
1 236 LEU n 
1 237 MET n 
1 238 ARG n 
1 239 ASN n 
1 240 PRO n 
1 241 GLU n 
1 242 LYS n 
1 243 ILE n 
1 244 LYS n 
1 245 GLU n 
1 246 LEU n 
1 247 ILE n 
1 248 GLU n 
1 249 GLY n 
1 250 SER n 
1 251 LEU n 
1 252 GLU n 
1 253 HIS n 
1 254 HIS n 
1 255 HIS n 
1 256 HIS n 
1 257 HIS n 
1 258 HIS 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                   258 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 ? 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Saccharolobus solfataricus' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     2287 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     562 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          plasmid 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       'pET29b(+)' 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE                                ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE                               ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE                             ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID'                        ? 'C4 H7 N O4'     133.103 
GLN 'L-peptide linking' y GLUTAMINE                              ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'                        ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE                                ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE                              ? 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER                                  ? 'H2 O'           18.015  
HQA 'L-peptide linking' n '3-(8-hydroxyquinolin-3-yl)-L-alanine' ? 'C12 H12 N2 O3'  232.235 
ILE 'L-peptide linking' y ISOLEUCINE                             ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE                                ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE                                 ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE                             ? 'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE                          ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE                                ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE                                 ? 'C3 H7 N O3'     105.093 
SO4 non-polymer         . 'SULFATE ION'                          ? 'O4 S -2'        96.063  
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 
ZN  non-polymer         . 'ZINC ION'                             ? 'Zn 2'           65.409  
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   MET 1   1   ?   ?   ?   A . n 
A 1 2   PRO 2   2   2   PRO PRO A . n 
A 1 3   ARG 3   3   3   ARG ARG A . n 
A 1 4   TYR 4   4   4   TYR TYR A . n 
A 1 5   LEU 5   5   5   LEU LEU A . n 
A 1 6   LYS 6   6   6   LYS LYS A . n 
A 1 7   GLY 7   7   7   GLY GLY A . n 
A 1 8   TRP 8   8   8   TRP TRP A . n 
A 1 9   LEU 9   9   9   LEU LEU A . n 
A 1 10  GLU 10  10  10  GLU GLU A . n 
A 1 11  ASP 11  11  11  ASP ASP A . n 
A 1 12  VAL 12  12  12  VAL VAL A . n 
A 1 13  VAL 13  13  13  VAL VAL A . n 
A 1 14  GLN 14  14  14  GLN GLN A . n 
A 1 15  LEU 15  15  15  LEU LEU A . n 
A 1 16  SER 16  16  16  SER SER A . n 
A 1 17  LEU 17  17  17  LEU LEU A . n 
A 1 18  ARG 18  18  18  ARG ARG A . n 
A 1 19  ARG 19  19  19  ARG ARG A . n 
A 1 20  PRO 20  20  20  PRO PRO A . n 
A 1 21  SER 21  21  21  SER SER A . n 
A 1 22  VAL 22  22  22  VAL VAL A . n 
A 1 23  ARG 23  23  23  ARG ARG A . n 
A 1 24  ALA 24  24  24  ALA ALA A . n 
A 1 25  SER 25  25  25  SER SER A . n 
A 1 26  ARG 26  26  26  ARG ARG A . n 
A 1 27  GLN 27  27  27  GLN GLN A . n 
A 1 28  ARG 28  28  28  ARG ARG A . n 
A 1 29  PRO 29  29  29  PRO PRO A . n 
A 1 30  ILE 30  30  30  ILE ILE A . n 
A 1 31  ILE 31  31  31  ILE ILE A . n 
A 1 32  SER 32  32  32  SER SER A . n 
A 1 33  LEU 33  33  33  LEU LEU A . n 
A 1 34  ASN 34  34  34  ASN ASN A . n 
A 1 35  GLU 35  35  35  GLU GLU A . n 
A 1 36  ARG 36  36  36  ARG ARG A . n 
A 1 37  ILE 37  37  37  ILE ILE A . n 
A 1 38  LEU 38  38  38  LEU LEU A . n 
A 1 39  GLU 39  39  39  GLU GLU A . n 
A 1 40  PHE 40  40  40  PHE PHE A . n 
A 1 41  ASN 41  41  41  ASN ASN A . n 
A 1 42  LYS 42  42  42  LYS LYS A . n 
A 1 43  ARG 43  43  43  ARG ARG A . n 
A 1 44  ASN 44  44  44  ASN ASN A . n 
A 1 45  ILE 45  45  45  ILE ILE A . n 
A 1 46  THR 46  46  46  THR THR A . n 
A 1 47  ALA 47  47  47  ALA ALA A . n 
A 1 48  ILE 48  48  48  ILE ILE A . n 
A 1 49  ILE 49  49  49  ILE ILE A . n 
A 1 50  ALA 50  50  50  ALA ALA A . n 
A 1 51  GLU 51  51  51  GLU GLU A . n 
A 1 52  TYR 52  52  52  TYR TYR A . n 
A 1 53  LYS 53  53  53  LYS LYS A . n 
A 1 54  ARG 54  54  54  ARG ARG A . n 
A 1 55  LYS 55  55  55  LYS LYS A . n 
A 1 56  SER 56  56  56  SER SER A . n 
A 1 57  PRO 57  57  57  PRO PRO A . n 
A 1 58  SER 58  58  58  SER SER A . n 
A 1 59  GLY 59  59  59  GLY GLY A . n 
A 1 60  LEU 60  60  60  LEU LEU A . n 
A 1 61  ASP 61  61  61  ASP ASP A . n 
A 1 62  VAL 62  62  62  VAL VAL A . n 
A 1 63  GLU 63  63  63  GLU GLU A . n 
A 1 64  ARG 64  64  64  ARG ARG A . n 
A 1 65  ASP 65  65  65  ASP ASP A . n 
A 1 66  PRO 66  66  66  PRO PRO A . n 
A 1 67  ILE 67  67  67  ILE ILE A . n 
A 1 68  GLU 68  68  68  GLU GLU A . n 
A 1 69  TYR 69  69  69  TYR TYR A . n 
A 1 70  ALA 70  70  70  ALA ALA A . n 
A 1 71  LYS 71  71  71  LYS LYS A . n 
A 1 72  PHE 72  72  72  PHE PHE A . n 
A 1 73  MET 73  73  73  MET MET A . n 
A 1 74  GLU 74  74  74  GLU GLU A . n 
A 1 75  ARG 75  75  75  ARG ARG A . n 
A 1 76  TYR 76  76  76  TYR TYR A . n 
A 1 77  ALA 77  77  77  ALA ALA A . n 
A 1 78  VAL 78  78  78  VAL VAL A . n 
A 1 79  GLY 79  79  79  GLY GLY A . n 
A 1 80  LEU 80  80  80  LEU LEU A . n 
A 1 81  SER 81  81  81  SER SER A . n 
A 1 82  ILE 82  82  82  ILE ILE A . n 
A 1 83  LEU 83  83  83  LEU LEU A . n 
A 1 84  THR 84  84  84  THR THR A . n 
A 1 85  GLU 85  85  85  GLU GLU A . n 
A 1 86  GLU 86  86  86  GLU GLU A . n 
A 1 87  LYS 87  87  87  LYS LYS A . n 
A 1 88  TYR 88  88  88  TYR TYR A . n 
A 1 89  PHE 89  89  89  PHE PHE A . n 
A 1 90  ASN 90  90  90  ASN ASN A . n 
A 1 91  GLY 91  91  91  GLY GLY A . n 
A 1 92  SER 92  92  92  SER SER A . n 
A 1 93  TYR 93  93  93  TYR TYR A . n 
A 1 94  GLU 94  94  94  GLU GLU A . n 
A 1 95  THR 95  95  95  THR THR A . n 
A 1 96  LEU 96  96  96  LEU LEU A . n 
A 1 97  ARG 97  97  97  ARG ARG A . n 
A 1 98  LYS 98  98  98  LYS LYS A . n 
A 1 99  ILE 99  99  99  ILE ILE A . n 
A 1 100 ALA 100 100 100 ALA ALA A . n 
A 1 101 SER 101 101 101 SER SER A . n 
A 1 102 SER 102 102 102 SER SER A . n 
A 1 103 VAL 103 103 103 VAL VAL A . n 
A 1 104 SER 104 104 104 SER SER A . n 
A 1 105 ILE 105 105 105 ILE ILE A . n 
A 1 106 PRO 106 106 106 PRO PRO A . n 
A 1 107 ILE 107 107 107 ILE ILE A . n 
A 1 108 LEU 108 108 108 LEU LEU A . n 
A 1 109 MET 109 109 109 MET MET A . n 
A 1 110 HQA 110 110 110 HQA HQA A . n 
A 1 111 ASP 111 111 111 ASP ASP A . n 
A 1 112 PHE 112 112 112 PHE PHE A . n 
A 1 113 ILE 113 113 113 ILE ILE A . n 
A 1 114 VAL 114 114 114 VAL VAL A . n 
A 1 115 LYS 115 115 115 LYS LYS A . n 
A 1 116 GLU 116 116 116 GLU GLU A . n 
A 1 117 SER 117 117 117 SER SER A . n 
A 1 118 GLN 118 118 118 GLN GLN A . n 
A 1 119 ILE 119 119 119 ILE ILE A . n 
A 1 120 ASP 120 120 120 ASP ASP A . n 
A 1 121 ASP 121 121 121 ASP ASP A . n 
A 1 122 ALA 122 122 122 ALA ALA A . n 
A 1 123 TYR 123 123 123 TYR TYR A . n 
A 1 124 ASN 124 124 124 ASN ASN A . n 
A 1 125 LEU 125 125 125 LEU LEU A . n 
A 1 126 GLY 126 126 126 GLY GLY A . n 
A 1 127 ALA 127 127 127 ALA ALA A . n 
A 1 128 ASP 128 128 128 ASP ASP A . n 
A 1 129 THR 129 129 129 THR THR A . n 
A 1 130 VAL 130 130 130 VAL VAL A . n 
A 1 131 ALA 131 131 131 ALA ALA A . n 
A 1 132 LEU 132 132 132 LEU LEU A . n 
A 1 133 ILE 133 133 133 ILE ILE A . n 
A 1 134 VAL 134 134 134 VAL VAL A . n 
A 1 135 LYS 135 135 135 LYS LYS A . n 
A 1 136 ILE 136 136 136 ILE ILE A . n 
A 1 137 LEU 137 137 137 LEU LEU A . n 
A 1 138 THR 138 138 138 THR THR A . n 
A 1 139 GLU 139 139 139 GLU GLU A . n 
A 1 140 ARG 140 140 140 ARG ARG A . n 
A 1 141 GLU 141 141 141 GLU GLU A . n 
A 1 142 LEU 142 142 142 LEU LEU A . n 
A 1 143 GLU 143 143 143 GLU GLU A . n 
A 1 144 SER 144 144 144 SER SER A . n 
A 1 145 LEU 145 145 145 LEU LEU A . n 
A 1 146 LEU 146 146 146 LEU LEU A . n 
A 1 147 GLU 147 147 147 GLU GLU A . n 
A 1 148 TYR 148 148 148 TYR TYR A . n 
A 1 149 ALA 149 149 149 ALA ALA A . n 
A 1 150 ARG 150 150 150 ARG ARG A . n 
A 1 151 SER 151 151 151 SER SER A . n 
A 1 152 TYR 152 152 152 TYR TYR A . n 
A 1 153 GLY 153 153 153 GLY GLY A . n 
A 1 154 MET 154 154 154 MET MET A . n 
A 1 155 GLU 155 155 155 GLU GLU A . n 
A 1 156 PRO 156 156 156 PRO PRO A . n 
A 1 157 LEU 157 157 157 LEU LEU A . n 
A 1 158 ILE 158 158 158 ILE ILE A . n 
A 1 159 GLU 159 159 159 GLU GLU A . n 
A 1 160 ILE 160 160 160 ILE ILE A . n 
A 1 161 ASN 161 161 161 ASN ASN A . n 
A 1 162 ASP 162 162 162 ASP ASP A . n 
A 1 163 GLU 163 163 163 GLU GLU A . n 
A 1 164 ASN 164 164 164 ASN ASN A . n 
A 1 165 ASP 165 165 165 ASP ASP A . n 
A 1 166 LEU 166 166 166 LEU LEU A . n 
A 1 167 ASP 167 167 167 ASP ASP A . n 
A 1 168 ILE 168 168 168 ILE ILE A . n 
A 1 169 ALA 169 169 169 ALA ALA A . n 
A 1 170 LEU 170 170 170 LEU LEU A . n 
A 1 171 ARG 171 171 171 ARG ARG A . n 
A 1 172 ILE 172 172 172 ILE ILE A . n 
A 1 173 GLY 173 173 173 GLY GLY A . n 
A 1 174 ALA 174 174 174 ALA ALA A . n 
A 1 175 ARG 175 175 175 ARG ARG A . n 
A 1 176 PHE 176 176 176 PHE PHE A . n 
A 1 177 ILE 177 177 177 ILE ILE A . n 
A 1 178 GLY 178 178 178 GLY GLY A . n 
A 1 179 ILE 179 179 179 ILE ILE A . n 
A 1 180 THR 180 180 180 THR THR A . n 
A 1 181 SER 181 181 181 SER SER A . n 
A 1 182 ARG 182 182 182 ARG ARG A . n 
A 1 183 ASP 183 183 183 ASP ASP A . n 
A 1 184 GLU 184 184 184 GLU GLU A . n 
A 1 185 GLU 185 185 185 GLU GLU A . n 
A 1 186 THR 186 186 186 THR THR A . n 
A 1 187 LEU 187 187 187 LEU LEU A . n 
A 1 188 GLU 188 188 188 GLU GLU A . n 
A 1 189 ILE 189 189 189 ILE ILE A . n 
A 1 190 ASN 190 190 190 ASN ASN A . n 
A 1 191 LYS 191 191 191 LYS LYS A . n 
A 1 192 GLU 192 192 192 GLU GLU A . n 
A 1 193 ASN 193 193 193 ASN ASN A . n 
A 1 194 GLN 194 194 194 GLN GLN A . n 
A 1 195 ARG 195 195 195 ARG ARG A . n 
A 1 196 LYS 196 196 196 LYS LYS A . n 
A 1 197 LEU 197 197 197 LEU LEU A . n 
A 1 198 ILE 198 198 198 ILE ILE A . n 
A 1 199 SER 199 199 199 SER SER A . n 
A 1 200 MET 200 200 200 MET MET A . n 
A 1 201 ILE 201 201 201 ILE ILE A . n 
A 1 202 PRO 202 202 202 PRO PRO A . n 
A 1 203 SER 203 203 203 SER SER A . n 
A 1 204 ASN 204 204 204 ASN ASN A . n 
A 1 205 VAL 205 205 205 VAL VAL A . n 
A 1 206 VAL 206 206 206 VAL VAL A . n 
A 1 207 LYS 207 207 207 LYS LYS A . n 
A 1 208 VAL 208 208 208 VAL VAL A . n 
A 1 209 ALA 209 209 209 ALA ALA A . n 
A 1 210 GLU 210 210 210 GLU GLU A . n 
A 1 211 SER 211 211 211 SER SER A . n 
A 1 212 GLY 212 212 212 GLY GLY A . n 
A 1 213 ILE 213 213 213 ILE ILE A . n 
A 1 214 SER 214 214 214 SER SER A . n 
A 1 215 GLU 215 215 215 GLU GLU A . n 
A 1 216 ARG 216 216 216 ARG ARG A . n 
A 1 217 ASN 217 217 217 ASN ASN A . n 
A 1 218 GLU 218 218 218 GLU GLU A . n 
A 1 219 ILE 219 219 219 ILE ILE A . n 
A 1 220 GLU 220 220 220 GLU GLU A . n 
A 1 221 GLU 221 221 221 GLU GLU A . n 
A 1 222 LEU 222 222 222 LEU LEU A . n 
A 1 223 ARG 223 223 223 ARG ARG A . n 
A 1 224 LYS 224 224 224 LYS LYS A . n 
A 1 225 LEU 225 225 225 LEU LEU A . n 
A 1 226 GLY 226 226 226 GLY GLY A . n 
A 1 227 VAL 227 227 227 VAL VAL A . n 
A 1 228 ASN 228 228 228 ASN ASN A . n 
A 1 229 ALA 229 229 229 ALA ALA A . n 
A 1 230 PHE 230 230 230 PHE PHE A . n 
A 1 231 LEU 231 231 231 LEU LEU A . n 
A 1 232 ILE 232 232 232 ILE ILE A . n 
A 1 233 GLY 233 233 233 GLY GLY A . n 
A 1 234 SER 234 234 234 SER SER A . n 
A 1 235 SER 235 235 235 SER SER A . n 
A 1 236 LEU 236 236 236 LEU LEU A . n 
A 1 237 MET 237 237 237 MET MET A . n 
A 1 238 ARG 238 238 238 ARG ARG A . n 
A 1 239 ASN 239 239 239 ASN ASN A . n 
A 1 240 PRO 240 240 240 PRO PRO A . n 
A 1 241 GLU 241 241 241 GLU GLU A . n 
A 1 242 LYS 242 242 242 LYS LYS A . n 
A 1 243 ILE 243 243 243 ILE ILE A . n 
A 1 244 LYS 244 244 244 LYS LYS A . n 
A 1 245 GLU 245 245 245 GLU GLU A . n 
A 1 246 LEU 246 246 246 LEU LEU A . n 
A 1 247 ILE 247 247 247 ILE ILE A . n 
A 1 248 GLU 248 248 248 GLU GLU A . n 
A 1 249 GLY 249 249 ?   ?   ?   A . n 
A 1 250 SER 250 250 ?   ?   ?   A . n 
A 1 251 LEU 251 251 ?   ?   ?   A . n 
A 1 252 GLU 252 252 ?   ?   ?   A . n 
A 1 253 HIS 253 253 ?   ?   ?   A . n 
A 1 254 HIS 254 254 ?   ?   ?   A . n 
A 1 255 HIS 255 255 ?   ?   ?   A . n 
A 1 256 HIS 256 256 ?   ?   ?   A . n 
A 1 257 HIS 257 257 ?   ?   ?   A . n 
A 1 258 HIS 258 258 ?   ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        HQA 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   HQA 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
B 2 SO4 1   301 1   SO4 SO4 A . 
C 2 SO4 1   302 2   SO4 SO4 A . 
D 2 SO4 1   303 3   SO4 SO4 A . 
E 2 SO4 1   304 6   SO4 SO4 A . 
F 3 ZN  1   305 1   ZN  ZN  A . 
G 4 HOH 1   401 244 HOH HOH A . 
G 4 HOH 2   402 342 HOH HOH A . 
G 4 HOH 3   403 171 HOH HOH A . 
G 4 HOH 4   404 343 HOH HOH A . 
G 4 HOH 5   405 330 HOH HOH A . 
G 4 HOH 6   406 133 HOH HOH A . 
G 4 HOH 7   407 169 HOH HOH A . 
G 4 HOH 8   408 111 HOH HOH A . 
G 4 HOH 9   409 104 HOH HOH A . 
G 4 HOH 10  410 255 HOH HOH A . 
G 4 HOH 11  411 230 HOH HOH A . 
G 4 HOH 12  412 288 HOH HOH A . 
G 4 HOH 13  413 75  HOH HOH A . 
G 4 HOH 14  414 25  HOH HOH A . 
G 4 HOH 15  415 208 HOH HOH A . 
G 4 HOH 16  416 165 HOH HOH A . 
G 4 HOH 17  417 146 HOH HOH A . 
G 4 HOH 18  418 195 HOH HOH A . 
G 4 HOH 19  419 107 HOH HOH A . 
G 4 HOH 20  420 275 HOH HOH A . 
G 4 HOH 21  421 245 HOH HOH A . 
G 4 HOH 22  422 130 HOH HOH A . 
G 4 HOH 23  423 137 HOH HOH A . 
G 4 HOH 24  424 313 HOH HOH A . 
G 4 HOH 25  425 157 HOH HOH A . 
G 4 HOH 26  426 315 HOH HOH A . 
G 4 HOH 27  427 226 HOH HOH A . 
G 4 HOH 28  428 52  HOH HOH A . 
G 4 HOH 29  429 264 HOH HOH A . 
G 4 HOH 30  430 15  HOH HOH A . 
G 4 HOH 31  431 147 HOH HOH A . 
G 4 HOH 32  432 312 HOH HOH A . 
G 4 HOH 33  433 50  HOH HOH A . 
G 4 HOH 34  434 40  HOH HOH A . 
G 4 HOH 35  435 153 HOH HOH A . 
G 4 HOH 36  436 182 HOH HOH A . 
G 4 HOH 37  437 24  HOH HOH A . 
G 4 HOH 38  438 64  HOH HOH A . 
G 4 HOH 39  439 54  HOH HOH A . 
G 4 HOH 40  440 300 HOH HOH A . 
G 4 HOH 41  441 185 HOH HOH A . 
G 4 HOH 42  442 45  HOH HOH A . 
G 4 HOH 43  443 14  HOH HOH A . 
G 4 HOH 44  444 71  HOH HOH A . 
G 4 HOH 45  445 154 HOH HOH A . 
G 4 HOH 46  446 184 HOH HOH A . 
G 4 HOH 47  447 94  HOH HOH A . 
G 4 HOH 48  448 181 HOH HOH A . 
G 4 HOH 49  449 177 HOH HOH A . 
G 4 HOH 50  450 82  HOH HOH A . 
G 4 HOH 51  451 96  HOH HOH A . 
G 4 HOH 52  452 80  HOH HOH A . 
G 4 HOH 53  453 66  HOH HOH A . 
G 4 HOH 54  454 4   HOH HOH A . 
G 4 HOH 55  455 53  HOH HOH A . 
G 4 HOH 56  456 145 HOH HOH A . 
G 4 HOH 57  457 2   HOH HOH A . 
G 4 HOH 58  458 18  HOH HOH A . 
G 4 HOH 59  459 69  HOH HOH A . 
G 4 HOH 60  460 135 HOH HOH A . 
G 4 HOH 61  461 89  HOH HOH A . 
G 4 HOH 62  462 32  HOH HOH A . 
G 4 HOH 63  463 12  HOH HOH A . 
G 4 HOH 64  464 176 HOH HOH A . 
G 4 HOH 65  465 6   HOH HOH A . 
G 4 HOH 66  466 291 HOH HOH A . 
G 4 HOH 67  467 197 HOH HOH A . 
G 4 HOH 68  468 121 HOH HOH A . 
G 4 HOH 69  469 16  HOH HOH A . 
G 4 HOH 70  470 106 HOH HOH A . 
G 4 HOH 71  471 1   HOH HOH A . 
G 4 HOH 72  472 200 HOH HOH A . 
G 4 HOH 73  473 17  HOH HOH A . 
G 4 HOH 74  474 73  HOH HOH A . 
G 4 HOH 75  475 117 HOH HOH A . 
G 4 HOH 76  476 103 HOH HOH A . 
G 4 HOH 77  477 136 HOH HOH A . 
G 4 HOH 78  478 210 HOH HOH A . 
G 4 HOH 79  479 180 HOH HOH A . 
G 4 HOH 80  480 173 HOH HOH A . 
G 4 HOH 81  481 271 HOH HOH A . 
G 4 HOH 82  482 151 HOH HOH A . 
G 4 HOH 83  483 302 HOH HOH A . 
G 4 HOH 84  484 87  HOH HOH A . 
G 4 HOH 85  485 21  HOH HOH A . 
G 4 HOH 86  486 28  HOH HOH A . 
G 4 HOH 87  487 150 HOH HOH A . 
G 4 HOH 88  488 19  HOH HOH A . 
G 4 HOH 89  489 144 HOH HOH A . 
G 4 HOH 90  490 199 HOH HOH A . 
G 4 HOH 91  491 11  HOH HOH A . 
G 4 HOH 92  492 320 HOH HOH A . 
G 4 HOH 93  493 74  HOH HOH A . 
G 4 HOH 94  494 30  HOH HOH A . 
G 4 HOH 95  495 325 HOH HOH A . 
G 4 HOH 96  496 192 HOH HOH A . 
G 4 HOH 97  497 43  HOH HOH A . 
G 4 HOH 98  498 331 HOH HOH A . 
G 4 HOH 99  499 127 HOH HOH A . 
G 4 HOH 100 500 56  HOH HOH A . 
G 4 HOH 101 501 158 HOH HOH A . 
G 4 HOH 102 502 42  HOH HOH A . 
G 4 HOH 103 503 187 HOH HOH A . 
G 4 HOH 104 504 193 HOH HOH A . 
G 4 HOH 105 505 60  HOH HOH A . 
G 4 HOH 106 506 268 HOH HOH A . 
G 4 HOH 107 507 7   HOH HOH A . 
G 4 HOH 108 508 3   HOH HOH A . 
G 4 HOH 109 509 41  HOH HOH A . 
G 4 HOH 110 510 152 HOH HOH A . 
G 4 HOH 111 511 174 HOH HOH A . 
G 4 HOH 112 512 261 HOH HOH A . 
G 4 HOH 113 513 9   HOH HOH A . 
G 4 HOH 114 514 33  HOH HOH A . 
G 4 HOH 115 515 116 HOH HOH A . 
G 4 HOH 116 516 101 HOH HOH A . 
G 4 HOH 117 517 61  HOH HOH A . 
G 4 HOH 118 518 170 HOH HOH A . 
G 4 HOH 119 519 47  HOH HOH A . 
G 4 HOH 120 520 129 HOH HOH A . 
G 4 HOH 121 521 10  HOH HOH A . 
G 4 HOH 122 522 305 HOH HOH A . 
G 4 HOH 123 523 191 HOH HOH A . 
G 4 HOH 124 524 65  HOH HOH A . 
G 4 HOH 125 525 22  HOH HOH A . 
G 4 HOH 126 526 20  HOH HOH A . 
G 4 HOH 127 527 68  HOH HOH A . 
G 4 HOH 128 528 125 HOH HOH A . 
G 4 HOH 129 529 243 HOH HOH A . 
G 4 HOH 130 530 114 HOH HOH A . 
G 4 HOH 131 531 36  HOH HOH A . 
G 4 HOH 132 532 124 HOH HOH A . 
G 4 HOH 133 533 128 HOH HOH A . 
G 4 HOH 134 534 207 HOH HOH A . 
G 4 HOH 135 535 70  HOH HOH A . 
G 4 HOH 136 536 46  HOH HOH A . 
G 4 HOH 137 537 232 HOH HOH A . 
G 4 HOH 138 538 79  HOH HOH A . 
G 4 HOH 139 539 160 HOH HOH A . 
G 4 HOH 140 540 143 HOH HOH A . 
G 4 HOH 141 541 202 HOH HOH A . 
G 4 HOH 142 542 5   HOH HOH A . 
G 4 HOH 143 543 59  HOH HOH A . 
G 4 HOH 144 544 308 HOH HOH A . 
G 4 HOH 145 545 44  HOH HOH A . 
G 4 HOH 146 546 259 HOH HOH A . 
G 4 HOH 147 547 161 HOH HOH A . 
G 4 HOH 148 548 222 HOH HOH A . 
G 4 HOH 149 549 283 HOH HOH A . 
G 4 HOH 150 550 260 HOH HOH A . 
G 4 HOH 151 551 48  HOH HOH A . 
G 4 HOH 152 552 8   HOH HOH A . 
G 4 HOH 153 553 323 HOH HOH A . 
G 4 HOH 154 554 95  HOH HOH A . 
G 4 HOH 155 555 84  HOH HOH A . 
G 4 HOH 156 556 26  HOH HOH A . 
G 4 HOH 157 557 29  HOH HOH A . 
G 4 HOH 158 558 148 HOH HOH A . 
G 4 HOH 159 559 37  HOH HOH A . 
G 4 HOH 160 560 90  HOH HOH A . 
G 4 HOH 161 561 13  HOH HOH A . 
G 4 HOH 162 562 72  HOH HOH A . 
G 4 HOH 163 563 206 HOH HOH A . 
G 4 HOH 164 564 273 HOH HOH A . 
G 4 HOH 165 565 55  HOH HOH A . 
G 4 HOH 166 566 246 HOH HOH A . 
G 4 HOH 167 567 233 HOH HOH A . 
G 4 HOH 168 568 248 HOH HOH A . 
G 4 HOH 169 569 102 HOH HOH A . 
G 4 HOH 170 570 296 HOH HOH A . 
G 4 HOH 171 571 78  HOH HOH A . 
G 4 HOH 172 572 314 HOH HOH A . 
G 4 HOH 173 573 284 HOH HOH A . 
G 4 HOH 174 574 58  HOH HOH A . 
G 4 HOH 175 575 23  HOH HOH A . 
G 4 HOH 176 576 242 HOH HOH A . 
G 4 HOH 177 577 76  HOH HOH A . 
G 4 HOH 178 578 263 HOH HOH A . 
G 4 HOH 179 579 240 HOH HOH A . 
G 4 HOH 180 580 132 HOH HOH A . 
G 4 HOH 181 581 327 HOH HOH A . 
G 4 HOH 182 582 219 HOH HOH A . 
G 4 HOH 183 583 49  HOH HOH A . 
G 4 HOH 184 584 51  HOH HOH A . 
G 4 HOH 185 585 31  HOH HOH A . 
G 4 HOH 186 586 217 HOH HOH A . 
G 4 HOH 187 587 164 HOH HOH A . 
G 4 HOH 188 588 201 HOH HOH A . 
G 4 HOH 189 589 120 HOH HOH A . 
G 4 HOH 190 590 229 HOH HOH A . 
G 4 HOH 191 591 279 HOH HOH A . 
G 4 HOH 192 592 168 HOH HOH A . 
G 4 HOH 193 593 77  HOH HOH A . 
G 4 HOH 194 594 189 HOH HOH A . 
G 4 HOH 195 595 27  HOH HOH A . 
G 4 HOH 196 596 34  HOH HOH A . 
G 4 HOH 197 597 63  HOH HOH A . 
G 4 HOH 198 598 215 HOH HOH A . 
G 4 HOH 199 599 334 HOH HOH A . 
G 4 HOH 200 600 281 HOH HOH A . 
G 4 HOH 201 601 105 HOH HOH A . 
G 4 HOH 202 602 35  HOH HOH A . 
G 4 HOH 203 603 113 HOH HOH A . 
G 4 HOH 204 604 231 HOH HOH A . 
G 4 HOH 205 605 270 HOH HOH A . 
G 4 HOH 206 606 213 HOH HOH A . 
G 4 HOH 207 607 205 HOH HOH A . 
G 4 HOH 208 608 337 HOH HOH A . 
G 4 HOH 209 609 97  HOH HOH A . 
G 4 HOH 210 610 39  HOH HOH A . 
G 4 HOH 211 611 67  HOH HOH A . 
G 4 HOH 212 612 234 HOH HOH A . 
G 4 HOH 213 613 100 HOH HOH A . 
G 4 HOH 214 614 216 HOH HOH A . 
G 4 HOH 215 615 250 HOH HOH A . 
G 4 HOH 216 616 83  HOH HOH A . 
G 4 HOH 217 617 252 HOH HOH A . 
G 4 HOH 218 618 156 HOH HOH A . 
G 4 HOH 219 619 253 HOH HOH A . 
G 4 HOH 220 620 224 HOH HOH A . 
G 4 HOH 221 621 258 HOH HOH A . 
G 4 HOH 222 622 285 HOH HOH A . 
G 4 HOH 223 623 311 HOH HOH A . 
G 4 HOH 224 624 287 HOH HOH A . 
G 4 HOH 225 625 134 HOH HOH A . 
G 4 HOH 226 626 304 HOH HOH A . 
G 4 HOH 227 627 175 HOH HOH A . 
G 4 HOH 228 628 220 HOH HOH A . 
G 4 HOH 229 629 108 HOH HOH A . 
G 4 HOH 230 630 204 HOH HOH A . 
G 4 HOH 231 631 286 HOH HOH A . 
G 4 HOH 232 632 138 HOH HOH A . 
G 4 HOH 233 633 178 HOH HOH A . 
G 4 HOH 234 634 249 HOH HOH A . 
G 4 HOH 235 635 167 HOH HOH A . 
G 4 HOH 236 636 214 HOH HOH A . 
G 4 HOH 237 637 115 HOH HOH A . 
G 4 HOH 238 638 290 HOH HOH A . 
G 4 HOH 239 639 194 HOH HOH A . 
G 4 HOH 240 640 329 HOH HOH A . 
G 4 HOH 241 641 309 HOH HOH A . 
G 4 HOH 242 642 280 HOH HOH A . 
G 4 HOH 243 643 155 HOH HOH A . 
G 4 HOH 244 644 292 HOH HOH A . 
G 4 HOH 245 645 303 HOH HOH A . 
G 4 HOH 246 646 269 HOH HOH A . 
G 4 HOH 247 647 227 HOH HOH A . 
G 4 HOH 248 648 159 HOH HOH A . 
G 4 HOH 249 649 247 HOH HOH A . 
G 4 HOH 250 650 142 HOH HOH A . 
G 4 HOH 251 651 93  HOH HOH A . 
G 4 HOH 252 652 166 HOH HOH A . 
G 4 HOH 253 653 212 HOH HOH A . 
G 4 HOH 254 654 123 HOH HOH A . 
G 4 HOH 255 655 254 HOH HOH A . 
G 4 HOH 256 656 319 HOH HOH A . 
G 4 HOH 257 657 322 HOH HOH A . 
G 4 HOH 258 658 172 HOH HOH A . 
G 4 HOH 259 659 265 HOH HOH A . 
G 4 HOH 260 660 289 HOH HOH A . 
G 4 HOH 261 661 317 HOH HOH A . 
G 4 HOH 262 662 223 HOH HOH A . 
G 4 HOH 263 663 341 HOH HOH A . 
G 4 HOH 264 664 190 HOH HOH A . 
G 4 HOH 265 665 251 HOH HOH A . 
G 4 HOH 266 666 238 HOH HOH A . 
G 4 HOH 267 667 278 HOH HOH A . 
G 4 HOH 268 668 324 HOH HOH A . 
G 4 HOH 269 669 339 HOH HOH A . 
G 4 HOH 270 670 141 HOH HOH A . 
G 4 HOH 271 671 267 HOH HOH A . 
G 4 HOH 272 672 299 HOH HOH A . 
G 4 HOH 273 673 301 HOH HOH A . 
G 4 HOH 274 674 297 HOH HOH A . 
G 4 HOH 275 675 262 HOH HOH A . 
G 4 HOH 276 676 277 HOH HOH A . 
G 4 HOH 277 677 332 HOH HOH A . 
G 4 HOH 278 678 293 HOH HOH A . 
G 4 HOH 279 679 126 HOH HOH A . 
G 4 HOH 280 680 122 HOH HOH A . 
G 4 HOH 281 681 239 HOH HOH A . 
G 4 HOH 282 682 333 HOH HOH A . 
G 4 HOH 283 683 186 HOH HOH A . 
G 4 HOH 284 684 336 HOH HOH A . 
G 4 HOH 285 685 162 HOH HOH A . 
G 4 HOH 286 686 274 HOH HOH A . 
G 4 HOH 287 687 196 HOH HOH A . 
G 4 HOH 288 688 256 HOH HOH A . 
G 4 HOH 289 689 86  HOH HOH A . 
G 4 HOH 290 690 38  HOH HOH A . 
G 4 HOH 291 691 344 HOH HOH A . 
G 4 HOH 292 692 221 HOH HOH A . 
G 4 HOH 293 693 183 HOH HOH A . 
G 4 HOH 294 694 218 HOH HOH A . 
G 4 HOH 295 695 118 HOH HOH A . 
G 4 HOH 296 696 203 HOH HOH A . 
G 4 HOH 297 697 316 HOH HOH A . 
G 4 HOH 298 698 306 HOH HOH A . 
G 4 HOH 299 699 98  HOH HOH A . 
G 4 HOH 300 700 119 HOH HOH A . 
G 4 HOH 301 701 235 HOH HOH A . 
G 4 HOH 302 702 85  HOH HOH A . 
G 4 HOH 303 703 335 HOH HOH A . 
G 4 HOH 304 704 211 HOH HOH A . 
G 4 HOH 305 705 294 HOH HOH A . 
G 4 HOH 306 706 237 HOH HOH A . 
G 4 HOH 307 707 318 HOH HOH A . 
G 4 HOH 308 708 298 HOH HOH A . 
G 4 HOH 309 709 99  HOH HOH A . 
G 4 HOH 310 710 163 HOH HOH A . 
G 4 HOH 311 711 110 HOH HOH A . 
G 4 HOH 312 712 307 HOH HOH A . 
G 4 HOH 313 713 109 HOH HOH A . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX  ? ? ? '(1.20.1_4487: ???)' 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? .                    2 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS     ? ? ? .                    3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER  ? ? ? .                    4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.00 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8W40 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     62.593 
_cell.length_a_esd                 ? 
_cell.length_b                     62.593 
_cell.length_b_esd                 ? 
_cell.length_c                     121.416 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        6 
_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                         8W40 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                152 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 31 2 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   8W40 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.32 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          46.93 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              5.5 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '0.2 M ammonium sulfate, 0.1 M Bis-Tris, pH 5.5, 20% w/v PEG3350, 50 uM zinc chloride' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            277 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2021-06-25 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.033167 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'APS BEAMLINE 23-ID-B' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.033167 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   23-ID-B 
_diffrn_source.pdbx_synchrotron_site       APS 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       8W40 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.37 
_reflns.d_resolution_low                               49.50 
_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                                     54798 
_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                           92.5 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                5.7 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          11.4 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               0.88 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.073 
_reflns.pdbx_Rpim_I_all                                0.029 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       311870 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.997 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.067 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.37 
_reflns_shell.d_res_low                                     1.39 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           1630 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             936 
_reflns_shell.percent_possible_obs                          32.1 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               1.7 
_reflns_shell.pdbx_chi_squared                              0.63 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     0.4 
_reflns_shell.pdbx_Rrim_I_all                               1.691 
_reflns_shell.pdbx_Rpim_I_all                               1.070 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.218 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  1.294 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               ? 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 8W40 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.45 
_refine.ls_d_res_low                             49.50 
_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                     48787 
_refine.ls_number_reflns_R_free                  1761 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    98.32 
_refine.ls_percent_reflns_R_free                 3.61 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1309 
_refine.ls_R_factor_R_free                       0.1635 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1297 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.34 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      'PDB entry 1LBL' 
_refine.pdbx_stereochemistry_target_values       ML 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.10 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.90 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 17.30 
_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                            0.17 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.45 
_refine_hist.d_res_low                        49.50 
_refine_hist.number_atoms_solvent             313 
_refine_hist.number_atoms_total               2333 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        1999 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         21 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.009 ? 2106 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 1.086 ? 2856 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 5.961 ? 302  ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.078 ? 325  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.019 ? 365  ? f_plane_restr      ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.45 1.49  . . 119 3103 86.00  . . . . 0.2577 . . . . . . . . . . . 0.3054 
'X-RAY DIFFRACTION' 1.49 1.53  . . 130 3476 95.00  . . . . 0.2067 . . . . . . . . . . . 0.2667 
'X-RAY DIFFRACTION' 1.53 1.58  . . 132 3597 100.00 . . . . 0.1592 . . . . . . . . . . . 0.2319 
'X-RAY DIFFRACTION' 1.58 1.64  . . 138 3646 100.00 . . . . 0.1350 . . . . . . . . . . . 0.1940 
'X-RAY DIFFRACTION' 1.64 1.70  . . 137 3644 100.00 . . . . 0.1304 . . . . . . . . . . . 0.1996 
'X-RAY DIFFRACTION' 1.70 1.78  . . 134 3649 100.00 . . . . 0.1313 . . . . . . . . . . . 0.1959 
'X-RAY DIFFRACTION' 1.78 1.88  . . 138 3642 100.00 . . . . 0.1348 . . . . . . . . . . . 0.1892 
'X-RAY DIFFRACTION' 1.88 1.99  . . 136 3651 100.00 . . . . 0.1235 . . . . . . . . . . . 0.1664 
'X-RAY DIFFRACTION' 1.99 2.15  . . 139 3677 100.00 . . . . 0.1089 . . . . . . . . . . . 0.1797 
'X-RAY DIFFRACTION' 2.15 2.36  . . 141 3671 100.00 . . . . 0.1219 . . . . . . . . . . . 0.1641 
'X-RAY DIFFRACTION' 2.36 2.71  . . 134 3700 100.00 . . . . 0.1253 . . . . . . . . . . . 0.1303 
'X-RAY DIFFRACTION' 2.71 3.41  . . 137 3736 100.00 . . . . 0.1280 . . . . . . . . . . . 0.1434 
'X-RAY DIFFRACTION' 3.41 49.50 . . 146 3834 98.00  . . . . 0.1289 . . . . . . . . . . . 0.1565 
# 
_struct.entry_id                     8W40 
_struct.title                        
;Crystal structure of a computationally designed metalloprotein containing the metal-chelating, fluorogenic, non-canonical amino acid 3-(8-hydroxyquinolin-3-yl)-L-alanine: zinc-bound form
;
_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        8W40 
_struct_keywords.text            
'Unnatural amino acids, non-canonical amino acids, metalloprotein, FLUORESCENT PROTEIN, METAL BINDING PROTEIN' 
_struct_keywords.pdbx_keywords   'FLUORESCENT PROTEIN, METAL BINDING PROTEIN' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 2 ? 
D N N 2 ? 
E N N 2 ? 
F N N 3 ? 
G N N 4 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    PDB 
_struct_ref.db_code                    8W40 
_struct_ref.pdbx_db_accession          8W40 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   ? 
_struct_ref.pdbx_align_begin           1 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              8W40 
_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                 258 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             8W40 
_struct_ref_seq.db_align_beg                  1 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  258 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       1 
_struct_ref_seq.pdbx_auth_seq_align_end       258 
# 
_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,F,G 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'mass spectrometry' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 LYS A 6   ? ARG A 18  ? LYS A 6   ARG A 18  1 ? 13 
HELX_P HELX_P2  AA2 SER A 32  ? ARG A 43  ? SER A 32  ARG A 43  1 ? 12 
HELX_P HELX_P3  AA3 ASP A 65  ? ARG A 75  ? ASP A 65  ARG A 75  1 ? 11 
HELX_P HELX_P4  AA4 SER A 92  ? SER A 101 ? SER A 92  SER A 101 1 ? 10 
HELX_P HELX_P5  AA5 LYS A 115 ? GLY A 126 ? LYS A 115 GLY A 126 1 ? 12 
HELX_P HELX_P6  AA6 LYS A 135 ? LEU A 137 ? LYS A 135 LEU A 137 5 ? 3  
HELX_P HELX_P7  AA7 THR A 138 ? TYR A 152 ? THR A 138 TYR A 152 1 ? 15 
HELX_P HELX_P8  AA8 ASP A 162 ? ILE A 172 ? ASP A 162 ILE A 172 1 ? 11 
HELX_P HELX_P9  AA9 ASN A 190 ? MET A 200 ? ASN A 190 MET A 200 1 ? 11 
HELX_P HELX_P10 AB1 GLU A 215 ? LEU A 225 ? GLU A 215 LEU A 225 1 ? 11 
HELX_P HELX_P11 AB2 GLY A 233 ? ASN A 239 ? GLY A 233 ASN A 239 1 ? 7  
HELX_P HELX_P12 AB3 GLU A 241 ? GLU A 248 ? GLU A 241 GLU A 248 1 ? 8  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
covale1 covale both ? A MET 109 C   ? ? ? 1_555 A HQA 110 N  ? ? A MET 109 A HQA 110 1_555 ? ? ? ? ? ? ? 1.339 ? ? 
covale2 covale both ? A HQA 110 C   ? ? ? 1_555 A ASP 111 N  ? ? A HQA 110 A ASP 111 1_555 ? ? ? ? ? ? ? 1.339 ? ? 
metalc1 metalc ?    ? A HQA 110 N06 ? ? ? 1_555 F ZN  .   ZN ? ? A HQA 110 A ZN  305 1_555 ? ? ? ? ? ? ? 2.036 ? ? 
metalc2 metalc ?    ? A HQA 110 O09 ? ? ? 1_555 F ZN  .   ZN ? ? A HQA 110 A ZN  305 1_555 ? ? ? ? ? ? ? 1.961 ? ? 
metalc3 metalc ?    ? A GLU 159 OE1 ? ? ? 1_555 F ZN  .   ZN ? ? A GLU 159 A ZN  305 1_555 ? ? ? ? ? ? ? 2.277 ? ? 
metalc4 metalc ?    ? A GLU 159 OE2 ? ? ? 1_555 F ZN  .   ZN ? ? A GLU 159 A ZN  305 1_555 ? ? ? ? ? ? ? 2.017 ? ? 
metalc5 metalc ?    ? A GLU 210 OE1 ? ? ? 1_555 F ZN  .   ZN ? ? A GLU 210 A ZN  305 1_555 ? ? ? ? ? ? ? 2.421 ? ? 
metalc6 metalc ?    ? A GLU 210 OE2 ? ? ? 1_555 F ZN  .   ZN ? ? A GLU 210 A ZN  305 1_555 ? ? ? ? ? ? ? 2.145 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
covale ? ? 
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  N06 ? A HQA 110 ? A HQA 110 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 O09 ? A HQA 110 ? A HQA 110 ? 1_555 91.9  ? 
2  N06 ? A HQA 110 ? A HQA 110 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE1 ? A GLU 159 ? A GLU 159 ? 1_555 96.3  ? 
3  O09 ? A HQA 110 ? A HQA 110 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE1 ? A GLU 159 ? A GLU 159 ? 1_555 146.5 ? 
4  N06 ? A HQA 110 ? A HQA 110 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE2 ? A GLU 159 ? A GLU 159 ? 1_555 117.7 ? 
5  O09 ? A HQA 110 ? A HQA 110 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE2 ? A GLU 159 ? A GLU 159 ? 1_555 86.5  ? 
6  OE1 ? A GLU 159 ? A GLU 159 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE2 ? A GLU 159 ? A GLU 159 ? 1_555 60.9  ? 
7  N06 ? A HQA 110 ? A HQA 110 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE1 ? A GLU 210 ? A GLU 210 ? 1_555 91.7  ? 
8  O09 ? A HQA 110 ? A HQA 110 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE1 ? A GLU 210 ? A GLU 210 ? 1_555 88.6  ? 
9  OE1 ? A GLU 159 ? A GLU 159 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE1 ? A GLU 210 ? A GLU 210 ? 1_555 123.5 ? 
10 OE2 ? A GLU 159 ? A GLU 159 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE1 ? A GLU 210 ? A GLU 210 ? 1_555 150.3 ? 
11 N06 ? A HQA 110 ? A HQA 110 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE2 ? A GLU 210 ? A GLU 210 ? 1_555 145.1 ? 
12 O09 ? A HQA 110 ? A HQA 110 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE2 ? A GLU 210 ? A GLU 210 ? 1_555 102.4 ? 
13 OE1 ? A GLU 159 ? A GLU 159 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE2 ? A GLU 210 ? A GLU 210 ? 1_555 89.1  ? 
14 OE2 ? A GLU 159 ? A GLU 159 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE2 ? A GLU 210 ? A GLU 210 ? 1_555 95.1  ? 
15 OE1 ? A GLU 210 ? A GLU 210 ? 1_555 ZN ? F ZN . ? A ZN 305 ? 1_555 OE2 ? A GLU 210 ? A GLU 210 ? 1_555 57.5  ? 
# 
_pdbx_modification_feature.ordinal                            1 
_pdbx_modification_feature.label_comp_id                      HQA 
_pdbx_modification_feature.label_asym_id                      A 
_pdbx_modification_feature.label_seq_id                       110 
_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                       HQA 
_pdbx_modification_feature.auth_asym_id                       A 
_pdbx_modification_feature.auth_seq_id                        110 
_pdbx_modification_feature.PDB_ins_code                       ? 
_pdbx_modification_feature.symmetry                           1_555 
_pdbx_modification_feature.modified_residue_auth_comp_id      . 
_pdbx_modification_feature.modified_residue_auth_asym_id      . 
_pdbx_modification_feature.modified_residue_auth_seq_id       . 
_pdbx_modification_feature.modified_residue_PDB_ins_code      . 
_pdbx_modification_feature.modified_residue_symmetry          . 
_pdbx_modification_feature.comp_id_linking_atom               . 
_pdbx_modification_feature.modified_residue_id_linking_atom   . 
_pdbx_modification_feature.modified_residue_id                ? 
_pdbx_modification_feature.ref_pcm_id                         1 
_pdbx_modification_feature.ref_comp_id                        HQA 
_pdbx_modification_feature.type                               None 
_pdbx_modification_feature.category                           'Non-standard residue' 
# 
_struct_sheet.id               AA1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   9 
_struct_sheet.details          ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? parallel 
AA1 2 3 ? parallel 
AA1 3 4 ? parallel 
AA1 4 5 ? parallel 
AA1 5 6 ? parallel 
AA1 6 7 ? parallel 
AA1 7 8 ? parallel 
AA1 8 9 ? 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 ILE A 48  ? TYR A 52  ? ILE A 48  TYR A 52  
AA1 2 GLY A 79  ? LEU A 83  ? GLY A 79  LEU A 83  
AA1 3 ILE A 107 ? HQA A 110 ? ILE A 107 HQA A 110 
AA1 4 THR A 129 ? ILE A 133 ? THR A 129 ILE A 133 
AA1 5 LEU A 157 ? ILE A 160 ? LEU A 157 ILE A 160 
AA1 6 PHE A 176 ? THR A 180 ? PHE A 176 THR A 180 
AA1 7 VAL A 206 ? GLU A 210 ? VAL A 206 GLU A 210 
AA1 8 ALA A 229 ? ILE A 232 ? ALA A 229 ILE A 232 
AA1 9 ILE A 48  ? TYR A 52  ? ILE A 48  TYR A 52  
# 
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 TYR A 52  ? N TYR A 52  O SER A 81  ? O SER A 81  
AA1 2 3 N LEU A 80  ? N LEU A 80  O LEU A 108 ? O LEU A 108 
AA1 3 4 N MET A 109 ? N MET A 109 O THR A 129 ? O THR A 129 
AA1 4 5 N LEU A 132 ? N LEU A 132 O GLU A 159 ? O GLU A 159 
AA1 5 6 N ILE A 160 ? N ILE A 160 O GLY A 178 ? O GLY A 178 
AA1 6 7 N ILE A 179 ? N ILE A 179 O VAL A 208 ? O VAL A 208 
AA1 7 8 N ALA A 209 ? N ALA A 209 O LEU A 231 ? O LEU A 231 
AA1 8 9 O PHE A 230 ? O PHE A 230 N ILE A 49  ? N ILE A 49  
# 
_pdbx_entry_details.entry_id                   8W40 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 ASP A 61  ? ? -156.57 89.24  
2 1 SER A 211 ? ? 93.29   132.37 
# 
_pdbx_validate_planes.id              1 
_pdbx_validate_planes.PDB_model_num   1 
_pdbx_validate_planes.auth_comp_id    ARG 
_pdbx_validate_planes.auth_asym_id    A 
_pdbx_validate_planes.auth_seq_id     216 
_pdbx_validate_planes.PDB_ins_code    ? 
_pdbx_validate_planes.label_alt_id    ? 
_pdbx_validate_planes.rmsd            0.249 
_pdbx_validate_planes.type            'SIDE CHAIN' 
# 
_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     404 
_pdbx_struct_special_symmetry.PDB_ins_code    ? 
_pdbx_struct_special_symmetry.label_asym_id   G 
_pdbx_struct_special_symmetry.label_comp_id   HOH 
_pdbx_struct_special_symmetry.label_seq_id    . 
# 
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 711 ? 6.11 . 
2 1 O ? A HOH 712 ? 6.62 . 
3 1 O ? A HOH 713 ? 8.31 . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 A MET 1   ? A MET 1   
2  1 Y 1 A GLY 249 ? A GLY 249 
3  1 Y 1 A SER 250 ? A SER 250 
4  1 Y 1 A LEU 251 ? A LEU 251 
5  1 Y 1 A GLU 252 ? A GLU 252 
6  1 Y 1 A HIS 253 ? A HIS 253 
7  1 Y 1 A HIS 254 ? A HIS 254 
8  1 Y 1 A HIS 255 ? A HIS 255 
9  1 Y 1 A HIS 256 ? A HIS 256 
10 1 Y 1 A HIS 257 ? A HIS 257 
11 1 Y 1 A HIS 258 ? A HIS 258 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N  N N 1   
ALA CA   C  N S 2   
ALA C    C  N N 3   
ALA O    O  N N 4   
ALA CB   C  N N 5   
ALA OXT  O  N N 6   
ALA H    H  N N 7   
ALA H2   H  N N 8   
ALA HA   H  N N 9   
ALA HB1  H  N N 10  
ALA HB2  H  N N 11  
ALA HB3  H  N N 12  
ALA HXT  H  N N 13  
ARG N    N  N N 14  
ARG CA   C  N S 15  
ARG C    C  N N 16  
ARG O    O  N N 17  
ARG CB   C  N N 18  
ARG CG   C  N N 19  
ARG CD   C  N N 20  
ARG NE   N  N N 21  
ARG CZ   C  N N 22  
ARG NH1  N  N N 23  
ARG NH2  N  N N 24  
ARG OXT  O  N N 25  
ARG H    H  N N 26  
ARG H2   H  N N 27  
ARG HA   H  N N 28  
ARG HB2  H  N N 29  
ARG HB3  H  N N 30  
ARG HG2  H  N N 31  
ARG HG3  H  N N 32  
ARG HD2  H  N N 33  
ARG HD3  H  N N 34  
ARG HE   H  N N 35  
ARG HH11 H  N N 36  
ARG HH12 H  N N 37  
ARG HH21 H  N N 38  
ARG HH22 H  N N 39  
ARG HXT  H  N N 40  
ASN N    N  N N 41  
ASN CA   C  N S 42  
ASN C    C  N N 43  
ASN O    O  N N 44  
ASN CB   C  N N 45  
ASN CG   C  N N 46  
ASN OD1  O  N N 47  
ASN ND2  N  N N 48  
ASN OXT  O  N N 49  
ASN H    H  N N 50  
ASN H2   H  N N 51  
ASN HA   H  N N 52  
ASN HB2  H  N N 53  
ASN HB3  H  N N 54  
ASN HD21 H  N N 55  
ASN HD22 H  N N 56  
ASN HXT  H  N N 57  
ASP N    N  N N 58  
ASP CA   C  N S 59  
ASP C    C  N N 60  
ASP O    O  N N 61  
ASP CB   C  N N 62  
ASP CG   C  N N 63  
ASP OD1  O  N N 64  
ASP OD2  O  N N 65  
ASP OXT  O  N N 66  
ASP H    H  N N 67  
ASP H2   H  N N 68  
ASP HA   H  N N 69  
ASP HB2  H  N N 70  
ASP HB3  H  N N 71  
ASP HD2  H  N N 72  
ASP HXT  H  N N 73  
GLN N    N  N N 74  
GLN CA   C  N S 75  
GLN C    C  N N 76  
GLN O    O  N N 77  
GLN CB   C  N N 78  
GLN CG   C  N N 79  
GLN CD   C  N N 80  
GLN OE1  O  N N 81  
GLN NE2  N  N N 82  
GLN OXT  O  N N 83  
GLN H    H  N N 84  
GLN H2   H  N N 85  
GLN HA   H  N N 86  
GLN HB2  H  N N 87  
GLN HB3  H  N N 88  
GLN HG2  H  N N 89  
GLN HG3  H  N N 90  
GLN HE21 H  N N 91  
GLN HE22 H  N N 92  
GLN HXT  H  N N 93  
GLU N    N  N N 94  
GLU CA   C  N S 95  
GLU C    C  N N 96  
GLU O    O  N N 97  
GLU CB   C  N N 98  
GLU CG   C  N N 99  
GLU CD   C  N N 100 
GLU OE1  O  N N 101 
GLU OE2  O  N N 102 
GLU OXT  O  N N 103 
GLU H    H  N N 104 
GLU H2   H  N N 105 
GLU HA   H  N N 106 
GLU HB2  H  N N 107 
GLU HB3  H  N N 108 
GLU HG2  H  N N 109 
GLU HG3  H  N N 110 
GLU HE2  H  N N 111 
GLU HXT  H  N N 112 
GLY N    N  N N 113 
GLY CA   C  N N 114 
GLY C    C  N N 115 
GLY O    O  N N 116 
GLY OXT  O  N N 117 
GLY H    H  N N 118 
GLY H2   H  N N 119 
GLY HA2  H  N N 120 
GLY HA3  H  N N 121 
GLY HXT  H  N N 122 
HIS N    N  N N 123 
HIS CA   C  N S 124 
HIS C    C  N N 125 
HIS O    O  N N 126 
HIS CB   C  N N 127 
HIS CG   C  Y N 128 
HIS ND1  N  Y N 129 
HIS CD2  C  Y N 130 
HIS CE1  C  Y N 131 
HIS NE2  N  Y N 132 
HIS OXT  O  N N 133 
HIS H    H  N N 134 
HIS H2   H  N N 135 
HIS HA   H  N N 136 
HIS HB2  H  N N 137 
HIS HB3  H  N N 138 
HIS HD1  H  N N 139 
HIS HD2  H  N N 140 
HIS HE1  H  N N 141 
HIS HE2  H  N N 142 
HIS HXT  H  N N 143 
HOH O    O  N N 144 
HOH H1   H  N N 145 
HOH H2   H  N N 146 
HQA OXT  O  N N 147 
HQA C    C  N N 148 
HQA O    O  N N 149 
HQA CA   C  N S 150 
HQA N    N  N N 151 
HQA C03  C  N N 152 
HQA C04  C  Y N 153 
HQA C05  C  Y N 154 
HQA N06  N  Y N 155 
HQA C07  C  Y N 156 
HQA C08  C  Y N 157 
HQA O09  O  N N 158 
HQA C10  C  Y N 159 
HQA C11  C  Y N 160 
HQA C12  C  Y N 161 
HQA C13  C  Y N 162 
HQA C14  C  Y N 163 
HQA HXT  H  N N 164 
HQA HA   H  N N 165 
HQA H    H  N N 166 
HQA H2   H  N N 167 
HQA H03  H  N N 168 
HQA H03A H  N N 169 
HQA H05  H  N N 170 
HQA HO09 H  N N 171 
HQA H10  H  N N 172 
HQA H11  H  N N 173 
HQA H12  H  N N 174 
HQA H14  H  N N 175 
ILE N    N  N N 176 
ILE CA   C  N S 177 
ILE C    C  N N 178 
ILE O    O  N N 179 
ILE CB   C  N S 180 
ILE CG1  C  N N 181 
ILE CG2  C  N N 182 
ILE CD1  C  N N 183 
ILE OXT  O  N N 184 
ILE H    H  N N 185 
ILE H2   H  N N 186 
ILE HA   H  N N 187 
ILE HB   H  N N 188 
ILE HG12 H  N N 189 
ILE HG13 H  N N 190 
ILE HG21 H  N N 191 
ILE HG22 H  N N 192 
ILE HG23 H  N N 193 
ILE HD11 H  N N 194 
ILE HD12 H  N N 195 
ILE HD13 H  N N 196 
ILE HXT  H  N N 197 
LEU N    N  N N 198 
LEU CA   C  N S 199 
LEU C    C  N N 200 
LEU O    O  N N 201 
LEU CB   C  N N 202 
LEU CG   C  N N 203 
LEU CD1  C  N N 204 
LEU CD2  C  N N 205 
LEU OXT  O  N N 206 
LEU H    H  N N 207 
LEU H2   H  N N 208 
LEU HA   H  N N 209 
LEU HB2  H  N N 210 
LEU HB3  H  N N 211 
LEU HG   H  N N 212 
LEU HD11 H  N N 213 
LEU HD12 H  N N 214 
LEU HD13 H  N N 215 
LEU HD21 H  N N 216 
LEU HD22 H  N N 217 
LEU HD23 H  N N 218 
LEU HXT  H  N N 219 
LYS N    N  N N 220 
LYS CA   C  N S 221 
LYS C    C  N N 222 
LYS O    O  N N 223 
LYS CB   C  N N 224 
LYS CG   C  N N 225 
LYS CD   C  N N 226 
LYS CE   C  N N 227 
LYS NZ   N  N N 228 
LYS OXT  O  N N 229 
LYS H    H  N N 230 
LYS H2   H  N N 231 
LYS HA   H  N N 232 
LYS HB2  H  N N 233 
LYS HB3  H  N N 234 
LYS HG2  H  N N 235 
LYS HG3  H  N N 236 
LYS HD2  H  N N 237 
LYS HD3  H  N N 238 
LYS HE2  H  N N 239 
LYS HE3  H  N N 240 
LYS HZ1  H  N N 241 
LYS HZ2  H  N N 242 
LYS HZ3  H  N N 243 
LYS HXT  H  N N 244 
MET N    N  N N 245 
MET CA   C  N S 246 
MET C    C  N N 247 
MET O    O  N N 248 
MET CB   C  N N 249 
MET CG   C  N N 250 
MET SD   S  N N 251 
MET CE   C  N N 252 
MET OXT  O  N N 253 
MET H    H  N N 254 
MET H2   H  N N 255 
MET HA   H  N N 256 
MET HB2  H  N N 257 
MET HB3  H  N N 258 
MET HG2  H  N N 259 
MET HG3  H  N N 260 
MET HE1  H  N N 261 
MET HE2  H  N N 262 
MET HE3  H  N N 263 
MET HXT  H  N N 264 
PHE N    N  N N 265 
PHE CA   C  N S 266 
PHE C    C  N N 267 
PHE O    O  N N 268 
PHE CB   C  N N 269 
PHE CG   C  Y N 270 
PHE CD1  C  Y N 271 
PHE CD2  C  Y N 272 
PHE CE1  C  Y N 273 
PHE CE2  C  Y N 274 
PHE CZ   C  Y N 275 
PHE OXT  O  N N 276 
PHE H    H  N N 277 
PHE H2   H  N N 278 
PHE HA   H  N N 279 
PHE HB2  H  N N 280 
PHE HB3  H  N N 281 
PHE HD1  H  N N 282 
PHE HD2  H  N N 283 
PHE HE1  H  N N 284 
PHE HE2  H  N N 285 
PHE HZ   H  N N 286 
PHE HXT  H  N N 287 
PRO N    N  N N 288 
PRO CA   C  N S 289 
PRO C    C  N N 290 
PRO O    O  N N 291 
PRO CB   C  N N 292 
PRO CG   C  N N 293 
PRO CD   C  N N 294 
PRO OXT  O  N N 295 
PRO H    H  N N 296 
PRO HA   H  N N 297 
PRO HB2  H  N N 298 
PRO HB3  H  N N 299 
PRO HG2  H  N N 300 
PRO HG3  H  N N 301 
PRO HD2  H  N N 302 
PRO HD3  H  N N 303 
PRO HXT  H  N N 304 
SER N    N  N N 305 
SER CA   C  N S 306 
SER C    C  N N 307 
SER O    O  N N 308 
SER CB   C  N N 309 
SER OG   O  N N 310 
SER OXT  O  N N 311 
SER H    H  N N 312 
SER H2   H  N N 313 
SER HA   H  N N 314 
SER HB2  H  N N 315 
SER HB3  H  N N 316 
SER HG   H  N N 317 
SER HXT  H  N N 318 
SO4 S    S  N N 319 
SO4 O1   O  N N 320 
SO4 O2   O  N N 321 
SO4 O3   O  N N 322 
SO4 O4   O  N N 323 
THR N    N  N N 324 
THR CA   C  N S 325 
THR C    C  N N 326 
THR O    O  N N 327 
THR CB   C  N R 328 
THR OG1  O  N N 329 
THR CG2  C  N N 330 
THR OXT  O  N N 331 
THR H    H  N N 332 
THR H2   H  N N 333 
THR HA   H  N N 334 
THR HB   H  N N 335 
THR HG1  H  N N 336 
THR HG21 H  N N 337 
THR HG22 H  N N 338 
THR HG23 H  N N 339 
THR HXT  H  N N 340 
TRP N    N  N N 341 
TRP CA   C  N S 342 
TRP C    C  N N 343 
TRP O    O  N N 344 
TRP CB   C  N N 345 
TRP CG   C  Y N 346 
TRP CD1  C  Y N 347 
TRP CD2  C  Y N 348 
TRP NE1  N  Y N 349 
TRP CE2  C  Y N 350 
TRP CE3  C  Y N 351 
TRP CZ2  C  Y N 352 
TRP CZ3  C  Y N 353 
TRP CH2  C  Y N 354 
TRP OXT  O  N N 355 
TRP H    H  N N 356 
TRP H2   H  N N 357 
TRP HA   H  N N 358 
TRP HB2  H  N N 359 
TRP HB3  H  N N 360 
TRP HD1  H  N N 361 
TRP HE1  H  N N 362 
TRP HE3  H  N N 363 
TRP HZ2  H  N N 364 
TRP HZ3  H  N N 365 
TRP HH2  H  N N 366 
TRP HXT  H  N N 367 
TYR N    N  N N 368 
TYR CA   C  N S 369 
TYR C    C  N N 370 
TYR O    O  N N 371 
TYR CB   C  N N 372 
TYR CG   C  Y N 373 
TYR CD1  C  Y N 374 
TYR CD2  C  Y N 375 
TYR CE1  C  Y N 376 
TYR CE2  C  Y N 377 
TYR CZ   C  Y N 378 
TYR OH   O  N N 379 
TYR OXT  O  N N 380 
TYR H    H  N N 381 
TYR H2   H  N N 382 
TYR HA   H  N N 383 
TYR HB2  H  N N 384 
TYR HB3  H  N N 385 
TYR HD1  H  N N 386 
TYR HD2  H  N N 387 
TYR HE1  H  N N 388 
TYR HE2  H  N N 389 
TYR HH   H  N N 390 
TYR HXT  H  N N 391 
VAL N    N  N N 392 
VAL CA   C  N S 393 
VAL C    C  N N 394 
VAL O    O  N N 395 
VAL CB   C  N N 396 
VAL CG1  C  N N 397 
VAL CG2  C  N N 398 
VAL OXT  O  N N 399 
VAL H    H  N N 400 
VAL H2   H  N N 401 
VAL HA   H  N N 402 
VAL HB   H  N N 403 
VAL HG11 H  N N 404 
VAL HG12 H  N N 405 
VAL HG13 H  N N 406 
VAL HG21 H  N N 407 
VAL HG22 H  N N 408 
VAL HG23 H  N N 409 
VAL HXT  H  N N 410 
ZN  ZN   ZN N N 411 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
GLN N   CA   sing N N 70  
GLN N   H    sing N N 71  
GLN N   H2   sing N N 72  
GLN CA  C    sing N N 73  
GLN CA  CB   sing N N 74  
GLN CA  HA   sing N N 75  
GLN C   O    doub N N 76  
GLN C   OXT  sing N N 77  
GLN CB  CG   sing N N 78  
GLN CB  HB2  sing N N 79  
GLN CB  HB3  sing N N 80  
GLN CG  CD   sing N N 81  
GLN CG  HG2  sing N N 82  
GLN CG  HG3  sing N N 83  
GLN CD  OE1  doub N N 84  
GLN CD  NE2  sing N N 85  
GLN NE2 HE21 sing N N 86  
GLN NE2 HE22 sing N N 87  
GLN OXT HXT  sing N N 88  
GLU N   CA   sing N N 89  
GLU N   H    sing N N 90  
GLU N   H2   sing N N 91  
GLU CA  C    sing N N 92  
GLU CA  CB   sing N N 93  
GLU CA  HA   sing N N 94  
GLU C   O    doub N N 95  
GLU C   OXT  sing N N 96  
GLU CB  CG   sing N N 97  
GLU CB  HB2  sing N N 98  
GLU CB  HB3  sing N N 99  
GLU CG  CD   sing N N 100 
GLU CG  HG2  sing N N 101 
GLU CG  HG3  sing N N 102 
GLU CD  OE1  doub N N 103 
GLU CD  OE2  sing N N 104 
GLU OE2 HE2  sing N N 105 
GLU OXT HXT  sing N N 106 
GLY N   CA   sing N N 107 
GLY N   H    sing N N 108 
GLY N   H2   sing N N 109 
GLY CA  C    sing N N 110 
GLY CA  HA2  sing N N 111 
GLY CA  HA3  sing N N 112 
GLY C   O    doub N N 113 
GLY C   OXT  sing N N 114 
GLY OXT HXT  sing N N 115 
HIS N   CA   sing N N 116 
HIS N   H    sing N N 117 
HIS N   H2   sing N N 118 
HIS CA  C    sing N N 119 
HIS CA  CB   sing N N 120 
HIS CA  HA   sing N N 121 
HIS C   O    doub N N 122 
HIS C   OXT  sing N N 123 
HIS CB  CG   sing N N 124 
HIS CB  HB2  sing N N 125 
HIS CB  HB3  sing N N 126 
HIS CG  ND1  sing Y N 127 
HIS CG  CD2  doub Y N 128 
HIS ND1 CE1  doub Y N 129 
HIS ND1 HD1  sing N N 130 
HIS CD2 NE2  sing Y N 131 
HIS CD2 HD2  sing N N 132 
HIS CE1 NE2  sing Y N 133 
HIS CE1 HE1  sing N N 134 
HIS NE2 HE2  sing N N 135 
HIS OXT HXT  sing N N 136 
HOH O   H1   sing N N 137 
HOH O   H2   sing N N 138 
HQA C   OXT  sing N N 139 
HQA OXT HXT  sing N N 140 
HQA CA  C    sing N N 141 
HQA C   O    doub N N 142 
HQA N   CA   sing N N 143 
HQA CA  C03  sing N N 144 
HQA CA  HA   sing N N 145 
HQA N   H    sing N N 146 
HQA N   H2   sing N N 147 
HQA C04 C03  sing N N 148 
HQA C03 H03  sing N N 149 
HQA C03 H03A sing N N 150 
HQA C14 C04  doub Y N 151 
HQA C05 C04  sing Y N 152 
HQA N06 C05  doub Y N 153 
HQA C05 H05  sing N N 154 
HQA C07 N06  sing Y N 155 
HQA C08 C07  doub Y N 156 
HQA C07 C13  sing Y N 157 
HQA C10 C08  sing Y N 158 
HQA O09 C08  sing N N 159 
HQA O09 HO09 sing N N 160 
HQA C10 C11  doub Y N 161 
HQA C10 H10  sing N N 162 
HQA C11 C12  sing Y N 163 
HQA C11 H11  sing N N 164 
HQA C12 C13  doub Y N 165 
HQA C12 H12  sing N N 166 
HQA C13 C14  sing Y N 167 
HQA C14 H14  sing N N 168 
ILE N   CA   sing N N 169 
ILE N   H    sing N N 170 
ILE N   H2   sing N N 171 
ILE CA  C    sing N N 172 
ILE CA  CB   sing N N 173 
ILE CA  HA   sing N N 174 
ILE C   O    doub N N 175 
ILE C   OXT  sing N N 176 
ILE CB  CG1  sing N N 177 
ILE CB  CG2  sing N N 178 
ILE CB  HB   sing N N 179 
ILE CG1 CD1  sing N N 180 
ILE CG1 HG12 sing N N 181 
ILE CG1 HG13 sing N N 182 
ILE CG2 HG21 sing N N 183 
ILE CG2 HG22 sing N N 184 
ILE CG2 HG23 sing N N 185 
ILE CD1 HD11 sing N N 186 
ILE CD1 HD12 sing N N 187 
ILE CD1 HD13 sing N N 188 
ILE OXT HXT  sing N N 189 
LEU N   CA   sing N N 190 
LEU N   H    sing N N 191 
LEU N   H2   sing N N 192 
LEU CA  C    sing N N 193 
LEU CA  CB   sing N N 194 
LEU CA  HA   sing N N 195 
LEU C   O    doub N N 196 
LEU C   OXT  sing N N 197 
LEU CB  CG   sing N N 198 
LEU CB  HB2  sing N N 199 
LEU CB  HB3  sing N N 200 
LEU CG  CD1  sing N N 201 
LEU CG  CD2  sing N N 202 
LEU CG  HG   sing N N 203 
LEU CD1 HD11 sing N N 204 
LEU CD1 HD12 sing N N 205 
LEU CD1 HD13 sing N N 206 
LEU CD2 HD21 sing N N 207 
LEU CD2 HD22 sing N N 208 
LEU CD2 HD23 sing N N 209 
LEU OXT HXT  sing N N 210 
LYS N   CA   sing N N 211 
LYS N   H    sing N N 212 
LYS N   H2   sing N N 213 
LYS CA  C    sing N N 214 
LYS CA  CB   sing N N 215 
LYS CA  HA   sing N N 216 
LYS C   O    doub N N 217 
LYS C   OXT  sing N N 218 
LYS CB  CG   sing N N 219 
LYS CB  HB2  sing N N 220 
LYS CB  HB3  sing N N 221 
LYS CG  CD   sing N N 222 
LYS CG  HG2  sing N N 223 
LYS CG  HG3  sing N N 224 
LYS CD  CE   sing N N 225 
LYS CD  HD2  sing N N 226 
LYS CD  HD3  sing N N 227 
LYS CE  NZ   sing N N 228 
LYS CE  HE2  sing N N 229 
LYS CE  HE3  sing N N 230 
LYS NZ  HZ1  sing N N 231 
LYS NZ  HZ2  sing N N 232 
LYS NZ  HZ3  sing N N 233 
LYS OXT HXT  sing N N 234 
MET N   CA   sing N N 235 
MET N   H    sing N N 236 
MET N   H2   sing N N 237 
MET CA  C    sing N N 238 
MET CA  CB   sing N N 239 
MET CA  HA   sing N N 240 
MET C   O    doub N N 241 
MET C   OXT  sing N N 242 
MET CB  CG   sing N N 243 
MET CB  HB2  sing N N 244 
MET CB  HB3  sing N N 245 
MET CG  SD   sing N N 246 
MET CG  HG2  sing N N 247 
MET CG  HG3  sing N N 248 
MET SD  CE   sing N N 249 
MET CE  HE1  sing N N 250 
MET CE  HE2  sing N N 251 
MET CE  HE3  sing N N 252 
MET OXT HXT  sing N N 253 
PHE N   CA   sing N N 254 
PHE N   H    sing N N 255 
PHE N   H2   sing N N 256 
PHE CA  C    sing N N 257 
PHE CA  CB   sing N N 258 
PHE CA  HA   sing N N 259 
PHE C   O    doub N N 260 
PHE C   OXT  sing N N 261 
PHE CB  CG   sing N N 262 
PHE CB  HB2  sing N N 263 
PHE CB  HB3  sing N N 264 
PHE CG  CD1  doub Y N 265 
PHE CG  CD2  sing Y N 266 
PHE CD1 CE1  sing Y N 267 
PHE CD1 HD1  sing N N 268 
PHE CD2 CE2  doub Y N 269 
PHE CD2 HD2  sing N N 270 
PHE CE1 CZ   doub Y N 271 
PHE CE1 HE1  sing N N 272 
PHE CE2 CZ   sing Y N 273 
PHE CE2 HE2  sing N N 274 
PHE CZ  HZ   sing N N 275 
PHE OXT HXT  sing N N 276 
PRO N   CA   sing N N 277 
PRO N   CD   sing N N 278 
PRO N   H    sing N N 279 
PRO CA  C    sing N N 280 
PRO CA  CB   sing N N 281 
PRO CA  HA   sing N N 282 
PRO C   O    doub N N 283 
PRO C   OXT  sing N N 284 
PRO CB  CG   sing N N 285 
PRO CB  HB2  sing N N 286 
PRO CB  HB3  sing N N 287 
PRO CG  CD   sing N N 288 
PRO CG  HG2  sing N N 289 
PRO CG  HG3  sing N N 290 
PRO CD  HD2  sing N N 291 
PRO CD  HD3  sing N N 292 
PRO OXT HXT  sing N N 293 
SER N   CA   sing N N 294 
SER N   H    sing N N 295 
SER N   H2   sing N N 296 
SER CA  C    sing N N 297 
SER CA  CB   sing N N 298 
SER CA  HA   sing N N 299 
SER C   O    doub N N 300 
SER C   OXT  sing N N 301 
SER CB  OG   sing N N 302 
SER CB  HB2  sing N N 303 
SER CB  HB3  sing N N 304 
SER OG  HG   sing N N 305 
SER OXT HXT  sing N N 306 
SO4 S   O1   doub N N 307 
SO4 S   O2   doub N N 308 
SO4 S   O3   sing N N 309 
SO4 S   O4   sing N N 310 
THR N   CA   sing N N 311 
THR N   H    sing N N 312 
THR N   H2   sing N N 313 
THR CA  C    sing N N 314 
THR CA  CB   sing N N 315 
THR CA  HA   sing N N 316 
THR C   O    doub N N 317 
THR C   OXT  sing N N 318 
THR CB  OG1  sing N N 319 
THR CB  CG2  sing N N 320 
THR CB  HB   sing N N 321 
THR OG1 HG1  sing N N 322 
THR CG2 HG21 sing N N 323 
THR CG2 HG22 sing N N 324 
THR CG2 HG23 sing N N 325 
THR OXT HXT  sing N N 326 
TRP N   CA   sing N N 327 
TRP N   H    sing N N 328 
TRP N   H2   sing N N 329 
TRP CA  C    sing N N 330 
TRP CA  CB   sing N N 331 
TRP CA  HA   sing N N 332 
TRP C   O    doub N N 333 
TRP C   OXT  sing N N 334 
TRP CB  CG   sing N N 335 
TRP CB  HB2  sing N N 336 
TRP CB  HB3  sing N N 337 
TRP CG  CD1  doub Y N 338 
TRP CG  CD2  sing Y N 339 
TRP CD1 NE1  sing Y N 340 
TRP CD1 HD1  sing N N 341 
TRP CD2 CE2  doub Y N 342 
TRP CD2 CE3  sing Y N 343 
TRP NE1 CE2  sing Y N 344 
TRP NE1 HE1  sing N N 345 
TRP CE2 CZ2  sing Y N 346 
TRP CE3 CZ3  doub Y N 347 
TRP CE3 HE3  sing N N 348 
TRP CZ2 CH2  doub Y N 349 
TRP CZ2 HZ2  sing N N 350 
TRP CZ3 CH2  sing Y N 351 
TRP CZ3 HZ3  sing N N 352 
TRP CH2 HH2  sing N N 353 
TRP OXT HXT  sing N N 354 
TYR N   CA   sing N N 355 
TYR N   H    sing N N 356 
TYR N   H2   sing N N 357 
TYR CA  C    sing N N 358 
TYR CA  CB   sing N N 359 
TYR CA  HA   sing N N 360 
TYR C   O    doub N N 361 
TYR C   OXT  sing N N 362 
TYR CB  CG   sing N N 363 
TYR CB  HB2  sing N N 364 
TYR CB  HB3  sing N N 365 
TYR CG  CD1  doub Y N 366 
TYR CG  CD2  sing Y N 367 
TYR CD1 CE1  sing Y N 368 
TYR CD1 HD1  sing N N 369 
TYR CD2 CE2  doub Y N 370 
TYR CD2 HD2  sing N N 371 
TYR CE1 CZ   doub Y N 372 
TYR CE1 HE1  sing N N 373 
TYR CE2 CZ   sing Y N 374 
TYR CE2 HE2  sing N N 375 
TYR CZ  OH   sing N N 376 
TYR OH  HH   sing N N 377 
TYR OXT HXT  sing N N 378 
VAL N   CA   sing N N 379 
VAL N   H    sing N N 380 
VAL N   H2   sing N N 381 
VAL CA  C    sing N N 382 
VAL CA  CB   sing N N 383 
VAL CA  HA   sing N N 384 
VAL C   O    doub N N 385 
VAL C   OXT  sing N N 386 
VAL CB  CG1  sing N N 387 
VAL CB  CG2  sing N N 388 
VAL CB  HB   sing N N 389 
VAL CG1 HG11 sing N N 390 
VAL CG1 HG12 sing N N 391 
VAL CG1 HG13 sing N N 392 
VAL CG2 HG21 sing N N 393 
VAL CG2 HG22 sing N N 394 
VAL CG2 HG23 sing N N 395 
VAL OXT HXT  sing N N 396 
# 
_pdbx_audit_support.funding_organization   
'National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)' 
_pdbx_audit_support.country                'United States' 
_pdbx_audit_support.grant_number           GM136996-04 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   1LBL 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    8W40 
_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]   0.015976 
_atom_sites.fract_transf_matrix[1][2]   0.009224 
_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]   0.018448 
_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]   0.008236 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C  
H  
N  
O  
S  
ZN 
# 
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    . PRO A 1 2   ? -36.707 23.405  -1.292  1.00 27.01  ? 2   PRO A N    1 
ATOM   2    C  CA   . PRO A 1 2   ? -36.117 22.084  -1.550  1.00 25.20  ? 2   PRO A CA   1 
ATOM   3    C  C    . PRO A 1 2   ? -36.306 21.655  -2.981  1.00 26.02  ? 2   PRO A C    1 
ATOM   4    O  O    . PRO A 1 2   ? -36.897 22.368  -3.787  1.00 28.88  ? 2   PRO A O    1 
ATOM   5    C  CB   . PRO A 1 2   ? -36.911 21.143  -0.634  1.00 27.05  ? 2   PRO A CB   1 
ATOM   6    C  CG   . PRO A 1 2   ? -37.515 22.016  0.379   1.00 30.47  ? 2   PRO A CG   1 
ATOM   7    C  CD   . PRO A 1 2   ? -37.696 23.366  -0.203  1.00 29.26  ? 2   PRO A CD   1 
ATOM   8    H  HA   . PRO A 1 2   ? -35.178 22.077  -1.305  1.00 30.25  ? 2   PRO A HA   1 
ATOM   9    H  HB2  . PRO A 1 2   ? -37.594 20.683  -1.146  1.00 32.47  ? 2   PRO A HB2  1 
ATOM   10   H  HB3  . PRO A 1 2   ? -36.313 20.499  -0.224  1.00 32.47  ? 2   PRO A HB3  1 
ATOM   11   H  HG2  . PRO A 1 2   ? -38.374 21.649  0.641   1.00 36.57  ? 2   PRO A HG2  1 
ATOM   12   H  HG3  . PRO A 1 2   ? -36.926 22.062  1.148   1.00 36.57  ? 2   PRO A HG3  1 
ATOM   13   H  HD2  . PRO A 1 2   ? -38.595 23.473  -0.551  1.00 35.13  ? 2   PRO A HD2  1 
ATOM   14   H  HD3  . PRO A 1 2   ? -37.510 24.053  0.455   1.00 35.13  ? 2   PRO A HD3  1 
ATOM   15   N  N    . ARG A 1 3   ? -35.825 20.465  -3.292  1.00 25.53  ? 3   ARG A N    1 
ATOM   16   C  CA   . ARG A 1 3   ? -36.034 19.946  -4.625  1.00 26.40  ? 3   ARG A CA   1 
ATOM   17   C  C    . ARG A 1 3   ? -37.433 19.386  -4.775  1.00 29.97  ? 3   ARG A C    1 
ATOM   18   O  O    . ARG A 1 3   ? -38.106 19.048  -3.793  1.00 29.81  ? 3   ARG A O    1 
ATOM   19   C  CB   . ARG A 1 3   ? -35.071 18.817  -4.922  1.00 27.73  ? 3   ARG A CB   1 
ATOM   20   C  CG   . ARG A 1 3   ? -33.668 19.248  -5.058  1.00 30.28  ? 3   ARG A CG   1 
ATOM   21   C  CD   . ARG A 1 3   ? -32.823 18.035  -5.285  0.04 34.35  ? 3   ARG A CD   1 
ATOM   22   N  NE   . ARG A 1 3   ? -31.414 18.360  -5.175  1.00 38.27  ? 3   ARG A NE   1 
ATOM   23   C  CZ   . ARG A 1 3   ? -30.438 17.634  -5.688  0.15 39.76  ? 3   ARG A CZ   1 
ATOM   24   N  NH1  . ARG A 1 3   ? -30.688 16.579  -6.448  1.00 41.99  ? 3   ARG A NH1  1 
ATOM   25   N  NH2  . ARG A 1 3   ? -29.182 17.964  -5.415  1.00 38.60  ? 3   ARG A NH2  1 
ATOM   26   H  H    . ARG A 1 3   ? -35.385 19.953  -2.760  1.00 30.65  ? 3   ARG A H    1 
ATOM   27   H  HA   . ARG A 1 3   ? -35.897 20.674  -5.252  1.00 31.69  ? 3   ARG A HA   1 
ATOM   28   H  HB2  . ARG A 1 3   ? -35.114 18.173  -4.198  1.00 33.29  ? 3   ARG A HB2  1 
ATOM   29   H  HB3  . ARG A 1 3   ? -35.333 18.396  -5.756  1.00 33.29  ? 3   ARG A HB3  1 
ATOM   30   H  HG2  . ARG A 1 3   ? -33.575 19.847  -5.815  1.00 36.35  ? 3   ARG A HG2  1 
ATOM   31   H  HG3  . ARG A 1 3   ? -33.376 19.691  -4.246  1.00 36.35  ? 3   ARG A HG3  1 
ATOM   32   H  HD2  . ARG A 1 3   ? -33.036 17.362  -4.620  0.39 41.23  ? 3   ARG A HD2  1 
ATOM   33   H  HD3  . ARG A 1 3   ? -32.990 17.687  -6.175  1.00 41.23  ? 3   ARG A HD3  1 
ATOM   34   H  HE   . ARG A 1 3   ? -31.199 19.074  -4.746  1.00 45.94  ? 3   ARG A HE   1 
ATOM   35   H  HH11 . ARG A 1 3   ? -31.500 16.353  -6.617  1.00 50.39  ? 3   ARG A HH11 1 
ATOM   36   H  HH12 . ARG A 1 3   ? -30.038 16.119  -6.773  1.00 50.39  ? 3   ARG A HH12 1 
ATOM   37   H  HH21 . ARG A 1 3   ? -29.015 18.641  -4.912  1.00 46.33  ? 3   ARG A HH21 1 
ATOM   38   H  HH22 . ARG A 1 3   ? -28.535 17.501  -5.742  1.00 46.33  ? 3   ARG A HH22 1 
ATOM   39   N  N    . TYR A 1 4   ? -37.846 19.264  -6.038  1.00 35.66  ? 4   TYR A N    1 
ATOM   40   C  CA   . TYR A 1 4   ? -39.084 18.594  -6.394  1.00 40.86  ? 4   TYR A CA   1 
ATOM   41   C  C    . TYR A 1 4   ? -38.803 17.103  -6.478  1.00 38.52  ? 4   TYR A C    1 
ATOM   42   O  O    . TYR A 1 4   ? -38.011 16.659  -7.311  1.00 40.84  ? 4   TYR A O    1 
ATOM   43   C  CB   . TYR A 1 4   ? -39.551 19.120  -7.750  1.00 48.06  ? 4   TYR A CB   1 
ATOM   44   C  CG   . TYR A 1 4   ? -40.116 20.516  -7.678  1.00 55.33  ? 4   TYR A CG   1 
ATOM   45   C  CD1  . TYR A 1 4   ? -39.288 21.629  -7.784  1.00 58.34  ? 4   TYR A CD1  1 
ATOM   46   C  CD2  . TYR A 1 4   ? -41.471 20.726  -7.478  1.00 58.87  ? 4   TYR A CD2  1 
ATOM   47   C  CE1  . TYR A 1 4   ? -39.800 22.914  -7.701  1.00 61.34  ? 4   TYR A CE1  1 
ATOM   48   C  CE2  . TYR A 1 4   ? -41.994 22.005  -7.402  1.00 62.08  ? 4   TYR A CE2  1 
ATOM   49   C  CZ   . TYR A 1 4   ? -41.156 23.094  -7.512  1.00 63.33  ? 4   TYR A CZ   1 
ATOM   50   O  OH   . TYR A 1 4   ? -41.682 24.366  -7.436  1.00 66.05  ? 4   TYR A OH   1 
ATOM   51   H  H    . TYR A 1 4   ? -37.414 19.570  -6.716  1.00 42.80  ? 4   TYR A H    1 
ATOM   52   H  HA   . TYR A 1 4   ? -39.776 18.754  -5.733  1.00 49.05  ? 4   TYR A HA   1 
ATOM   53   H  HB2  . TYR A 1 4   ? -38.796 19.134  -8.359  1.00 57.69  ? 4   TYR A HB2  1 
ATOM   54   H  HB3  . TYR A 1 4   ? -40.244 18.534  -8.094  1.00 57.69  ? 4   TYR A HB3  1 
ATOM   55   H  HD1  . TYR A 1 4   ? -38.375 21.509  -7.914  1.00 70.02  ? 4   TYR A HD1  1 
ATOM   56   H  HD2  . TYR A 1 4   ? -42.039 19.994  -7.393  1.00 70.66  ? 4   TYR A HD2  1 
ATOM   57   H  HE1  . TYR A 1 4   ? -39.235 23.649  -7.771  1.00 73.62  ? 4   TYR A HE1  1 
ATOM   58   H  HE2  . TYR A 1 4   ? -42.907 22.129  -7.278  1.00 74.51  ? 4   TYR A HE2  1 
ATOM   59   H  HH   . TYR A 1 4   ? -42.513 24.326  -7.323  1.00 79.27  ? 4   TYR A HH   1 
ATOM   60   N  N    . LEU A 1 5   ? -39.450 16.334  -5.635  1.00 36.71  ? 5   LEU A N    1 
ATOM   61   C  CA   . LEU A 1 5   ? -39.215 14.915  -5.496  1.00 35.78  ? 5   LEU A CA   1 
ATOM   62   C  C    . LEU A 1 5   ? -40.517 14.182  -5.772  1.00 36.94  ? 5   LEU A C    1 
ATOM   63   O  O    . LEU A 1 5   ? -41.527 14.786  -6.128  1.00 38.27  ? 5   LEU A O    1 
ATOM   64   C  CB   . LEU A 1 5   ? -38.734 14.620  -4.073  1.00 35.35  ? 5   LEU A CB   1 
ATOM   65   C  CG   . LEU A 1 5   ? -37.514 15.442  -3.626  1.00 34.92  ? 5   LEU A CG   1 
ATOM   66   C  CD1  . LEU A 1 5   ? -37.316 15.385  -2.107  1.00 37.43  ? 5   LEU A CD1  1 
ATOM   67   C  CD2  . LEU A 1 5   ? -36.277 14.958  -4.358  1.00 36.62  ? 5   LEU A CD2  1 
ATOM   68   H  H    . LEU A 1 5   ? -40.062 16.625  -5.104  1.00 44.07  ? 5   LEU A H    1 
ATOM   69   H  HA   . LEU A 1 5   ? -38.544 14.617  -6.131  1.00 42.94  ? 5   LEU A HA   1 
ATOM   70   H  HB2  . LEU A 1 5   ? -39.458 14.812  -3.457  1.00 42.43  ? 5   LEU A HB2  1 
ATOM   71   H  HB3  . LEU A 1 5   ? -38.491 13.682  -4.018  1.00 42.43  ? 5   LEU A HB3  1 
ATOM   72   H  HG   . LEU A 1 5   ? -37.663 16.374  -3.849  1.00 41.91  ? 5   LEU A HG   1 
ATOM   73   H  HD11 . LEU A 1 5   ? -38.160 15.580  -1.671  1.00 44.93  ? 5   LEU A HD11 1 
ATOM   74   H  HD12 . LEU A 1 5   ? -37.014 14.496  -1.861  1.00 44.93  ? 5   LEU A HD12 1 
ATOM   75   H  HD13 . LEU A 1 5   ? -36.651 16.043  -1.851  1.00 44.93  ? 5   LEU A HD13 1 
ATOM   76   H  HD21 . LEU A 1 5   ? -35.508 15.456  -4.041  1.00 43.96  ? 5   LEU A HD21 1 
ATOM   77   H  HD22 . LEU A 1 5   ? -36.155 14.012  -4.181  1.00 43.96  ? 5   LEU A HD22 1 
ATOM   78   H  HD23 . LEU A 1 5   ? -36.397 15.103  -5.310  1.00 43.96  ? 5   LEU A HD23 1 
ATOM   79   N  N    . LYS A 1 6   ? -40.491 12.869  -5.608  1.00 37.37  ? 6   LYS A N    1 
ATOM   80   C  CA   . LYS A 1 6   ? -41.689 12.068  -5.776  1.00 39.74  ? 6   LYS A CA   1 
ATOM   81   C  C    . LYS A 1 6   ? -41.766 11.042  -4.657  1.00 37.66  ? 6   LYS A C    1 
ATOM   82   O  O    . LYS A 1 6   ? -40.827 10.862  -3.864  1.00 39.18  ? 6   LYS A O    1 
ATOM   83   C  CB   . LYS A 1 6   ? -41.720 11.406  -7.151  1.00 44.87  ? 6   LYS A CB   1 
ATOM   84   C  CG   . LYS A 1 6   ? -40.491 10.588  -7.482  1.00 50.17  ? 6   LYS A CG   1 
ATOM   85   C  CD   . LYS A 1 6   ? -40.685 9.862   -8.816  1.00 55.82  ? 6   LYS A CD   1 
ATOM   86   C  CE   . LYS A 1 6   ? -39.587 8.837   -9.074  1.00 59.86  ? 6   LYS A CE   1 
ATOM   87   N  NZ   . LYS A 1 6   ? -38.936 9.028   -10.402 1.00 63.49  ? 6   LYS A NZ   1 
ATOM   88   H  H    . LYS A 1 6   ? -39.789 12.418  -5.398  1.00 44.85  ? 6   LYS A H    1 
ATOM   89   H  HA   . LYS A 1 6   ? -42.474 12.633  -5.701  1.00 47.70  ? 6   LYS A HA   1 
ATOM   90   H  HB2  . LYS A 1 6   ? -42.486 10.813  -7.191  1.00 53.86  ? 6   LYS A HB2  1 
ATOM   91   H  HB3  . LYS A 1 6   ? -41.800 12.099  -7.825  1.00 53.86  ? 6   LYS A HB3  1 
ATOM   92   H  HG2  . LYS A 1 6   ? -39.720 11.171  -7.555  1.00 60.22  ? 6   LYS A HG2  1 
ATOM   93   H  HG3  . LYS A 1 6   ? -40.343 9.927   -6.788  1.00 60.22  ? 6   LYS A HG3  1 
ATOM   94   H  HD2  . LYS A 1 6   ? -41.536 9.398   -8.806  1.00 67.00  ? 6   LYS A HD2  1 
ATOM   95   H  HD3  . LYS A 1 6   ? -40.669 10.511  -9.537  1.00 67.00  ? 6   LYS A HD3  1 
ATOM   96   H  HE2  . LYS A 1 6   ? -38.905 8.922   -8.390  1.00 71.85  ? 6   LYS A HE2  1 
ATOM   97   H  HE3  . LYS A 1 6   ? -39.971 7.947   -9.052  1.00 71.85  ? 6   LYS A HE3  1 
ATOM   98   H  HZ1  . LYS A 1 6   ? -38.302 8.416   -10.521 1.00 76.20  ? 6   LYS A HZ1  1 
ATOM   99   H  HZ2  . LYS A 1 6   ? -39.540 8.949   -11.051 1.00 76.20  ? 6   LYS A HZ2  1 
ATOM   100  H  HZ3  . LYS A 1 6   ? -38.569 9.838   -10.447 1.00 76.20  ? 6   LYS A HZ3  1 
ATOM   101  N  N    . GLY A 1 7   ? -42.925 10.413  -4.564  1.00 35.40  ? 7   GLY A N    1 
ATOM   102  C  CA   . GLY A 1 7   ? -43.112 9.374   -3.589  1.00 32.39  ? 7   GLY A CA   1 
ATOM   103  C  C    . GLY A 1 7   ? -42.912 9.853   -2.163  1.00 30.60  ? 7   GLY A C    1 
ATOM   104  O  O    . GLY A 1 7   ? -43.198 11.001  -1.793  1.00 30.93  ? 7   GLY A O    1 
ATOM   105  H  H    . GLY A 1 7   ? -43.613 10.572  -5.055  1.00 42.49  ? 7   GLY A H    1 
ATOM   106  H  HA2  . GLY A 1 7   ? -44.012 9.022   -3.666  1.00 38.87  ? 7   GLY A HA2  1 
ATOM   107  H  HA3  . GLY A 1 7   ? -42.478 8.659   -3.759  1.00 38.87  ? 7   GLY A HA3  1 
ATOM   108  N  N    . TRP A 1 8   ? -42.391 8.943   -1.342  1.00 28.19  ? 8   TRP A N    1 
ATOM   109  C  CA   . TRP A 1 8   ? -42.319 9.199   0.085   1.00 28.14  ? 8   TRP A CA   1 
ATOM   110  C  C    . TRP A 1 8   ? -41.377 10.349  0.408   1.00 27.23  ? 8   TRP A C    1 
ATOM   111  O  O    . TRP A 1 8   ? -41.604 11.051  1.398   1.00 26.91  ? 8   TRP A O    1 
ATOM   112  C  CB   . TRP A 1 8   ? -41.956 7.913   0.836   1.00 27.55  ? 8   TRP A CB   1 
ATOM   113  C  CG   . TRP A 1 8   ? -40.489 7.597   0.879   1.00 24.52  ? 8   TRP A CG   1 
ATOM   114  C  CD1  . TRP A 1 8   ? -39.760 6.952   -0.073  1.00 25.02  ? 8   TRP A CD1  1 
ATOM   115  C  CD2  . TRP A 1 8   ? -39.576 7.914   1.931   1.00 22.79  ? 8   TRP A CD2  1 
ATOM   116  N  NE1  . TRP A 1 8   ? -38.457 6.838   0.327   1.00 24.65  ? 8   TRP A NE1  1 
ATOM   117  C  CE2  . TRP A 1 8   ? -38.312 7.434   1.551   1.00 21.79  ? 8   TRP A CE2  1 
ATOM   118  C  CE3  . TRP A 1 8   ? -39.701 8.570   3.151   1.00 22.81  ? 8   TRP A CE3  1 
ATOM   119  C  CZ2  . TRP A 1 8   ? -37.179 7.588   2.355   1.00 21.46  ? 8   TRP A CZ2  1 
ATOM   120  C  CZ3  . TRP A 1 8   ? -38.583 8.724   3.945   1.00 22.91  ? 8   TRP A CZ3  1 
ATOM   121  C  CH2  . TRP A 1 8   ? -37.335 8.243   3.541   1.00 23.00  ? 8   TRP A CH2  1 
ATOM   122  H  H    . TRP A 1 8   ? -42.078 8.180   -1.586  1.00 33.84  ? 8   TRP A H    1 
ATOM   123  H  HA   . TRP A 1 8   ? -43.194 9.466   0.407   1.00 33.78  ? 8   TRP A HA   1 
ATOM   124  H  HB2  . TRP A 1 8   ? -42.262 7.995   1.752   1.00 33.07  ? 8   TRP A HB2  1 
ATOM   125  H  HB3  . TRP A 1 8   ? -42.401 7.168   0.403   1.00 33.07  ? 8   TRP A HB3  1 
ATOM   126  H  HD1  . TRP A 1 8   ? -40.099 6.636   -0.879  1.00 30.03  ? 8   TRP A HD1  1 
ATOM   127  H  HE1  . TRP A 1 8   ? -37.829 6.454   -0.119  1.00 29.60  ? 8   TRP A HE1  1 
ATOM   128  H  HE3  . TRP A 1 8   ? -40.526 8.901   3.428   1.00 27.39  ? 8   TRP A HE3  1 
ATOM   129  H  HZ2  . TRP A 1 8   ? -36.351 7.257   2.092   1.00 25.77  ? 8   TRP A HZ2  1 
ATOM   130  H  HZ3  . TRP A 1 8   ? -38.661 9.156   4.765   1.00 27.51  ? 8   TRP A HZ3  1 
ATOM   131  H  HH2  . TRP A 1 8   ? -36.597 8.371   4.091   1.00 27.62  ? 8   TRP A HH2  1 
ATOM   132  N  N    . LEU A 1 9   ? -40.325 10.567  -0.391  1.00 27.88  ? 9   LEU A N    1 
ATOM   133  C  CA   . LEU A 1 9   ? -39.427 11.692  -0.112  1.00 27.79  ? 9   LEU A CA   1 
ATOM   134  C  C    . LEU A 1 9   ? -40.120 13.027  -0.344  1.00 28.15  ? 9   LEU A C    1 
ATOM   135  O  O    . LEU A 1 9   ? -39.884 13.994  0.396   1.00 27.52  ? 9   LEU A O    1 
ATOM   136  C  CB   . LEU A 1 9   ? -38.178 11.628  -0.982  1.00 28.58  ? 9   LEU A CB   1 
ATOM   137  C  CG   . LEU A 1 9   ? -37.037 10.765  -0.507  1.00 28.50  ? 9   LEU A CG   1 
ATOM   138  C  CD1  . LEU A 1 9   ? -35.889 10.918  -1.502  1.00 27.74  ? 9   LEU A CD1  1 
ATOM   139  C  CD2  . LEU A 1 9   ? -36.586 11.130  0.907   1.00 27.46  ? 9   LEU A CD2  1 
ATOM   140  H  H    . LEU A 1 9   ? -40.116 10.094  -1.078  1.00 33.47  ? 9   LEU A H    1 
ATOM   141  H  HA   . LEU A 1 9   ? -39.160 11.623  0.817   1.00 33.36  ? 9   LEU A HA   1 
ATOM   142  H  HB2  . LEU A 1 9   ? -38.440 11.291  -1.852  1.00 34.31  ? 9   LEU A HB2  1 
ATOM   143  H  HB3  . LEU A 1 9   ? -37.830 12.530  -1.066  1.00 34.31  ? 9   LEU A HB3  1 
ATOM   144  H  HG   . LEU A 1 9   ? -37.323 9.839   -0.463  1.00 34.22  ? 9   LEU A HG   1 
ATOM   145  H  HD11 . LEU A 1 9   ? -36.196 10.651  -2.383  1.00 33.30  ? 9   LEU A HD11 1 
ATOM   146  H  HD12 . LEU A 1 9   ? -35.606 11.846  -1.518  1.00 33.30  ? 9   LEU A HD12 1 
ATOM   147  H  HD13 . LEU A 1 9   ? -35.152 10.352  -1.223  1.00 33.30  ? 9   LEU A HD13 1 
ATOM   148  H  HD21 . LEU A 1 9   ? -37.247 10.811  1.542   1.00 32.97  ? 9   LEU A HD21 1 
ATOM   149  H  HD22 . LEU A 1 9   ? -35.729 10.710  1.083   1.00 32.97  ? 9   LEU A HD22 1 
ATOM   150  H  HD23 . LEU A 1 9   ? -36.501 12.094  0.974   1.00 32.97  ? 9   LEU A HD23 1 
ATOM   151  N  N    . GLU A 1 10  ? -40.977 13.109  -1.369  1.00 27.01  ? 10  GLU A N    1 
ATOM   152  C  CA   . GLU A 1 10  ? -41.756 14.327  -1.557  1.00 29.27  ? 10  GLU A CA   1 
ATOM   153  C  C    . GLU A 1 10  ? -42.622 14.563  -0.338  1.00 26.57  ? 10  GLU A C    1 
ATOM   154  O  O    . GLU A 1 10  ? -42.701 15.684  0.172   1.00 28.15  ? 10  GLU A O    1 
ATOM   155  C  CB   . GLU A 1 10  ? -42.595 14.231  -2.831  1.00 32.54  ? 10  GLU A CB   1 
ATOM   156  C  CG   . GLU A 1 10  ? -43.150 15.567  -3.365  1.00 36.66  ? 10  GLU A CG   1 
ATOM   157  C  CD   . GLU A 1 10  ? -44.379 15.389  -4.268  0.64 38.28  ? 10  GLU A CD   1 
ATOM   158  O  OE1  . GLU A 1 10  ? -44.923 16.408  -4.741  0.51 39.93  ? 10  GLU A OE1  1 
ATOM   159  O  OE2  . GLU A 1 10  ? -44.811 14.239  -4.492  0.53 38.47  ? 10  GLU A OE2  1 
ATOM   160  H  H    . GLU A 1 10  ? -41.119 12.490  -1.950  1.00 32.42  ? 10  GLU A H    1 
ATOM   161  H  HA   . GLU A 1 10  ? -41.165 15.088  -1.672  1.00 35.14  ? 10  GLU A HA   1 
ATOM   162  H  HB2  . GLU A 1 10  ? -42.044 13.847  -3.531  1.00 39.06  ? 10  GLU A HB2  1 
ATOM   163  H  HB3  . GLU A 1 10  ? -43.354 13.654  -2.653  1.00 39.06  ? 10  GLU A HB3  1 
ATOM   164  H  HG2  . GLU A 1 10  ? -43.410 16.123  -2.614  1.00 44.01  ? 10  GLU A HG2  1 
ATOM   165  H  HG3  . GLU A 1 10  ? -42.461 16.010  -3.884  1.00 44.01  ? 10  GLU A HG3  1 
ATOM   166  N  N    . ASP A 1 11  ? -43.224 13.492  0.189   1.00 25.45  ? 11  ASP A N    1 
ATOM   167  C  CA   . ASP A 1 11  ? -44.076 13.622  1.363   1.00 24.78  ? 11  ASP A CA   1 
ATOM   168  C  C    . ASP A 1 11  ? -43.280 14.083  2.579   1.00 23.80  ? 11  ASP A C    1 
ATOM   169  O  O    . ASP A 1 11  ? -43.695 14.997  3.290   1.00 22.41  ? 11  ASP A O    1 
ATOM   170  C  CB   . ASP A 1 11  ? -44.765 12.289  1.664   1.00 26.33  ? 11  ASP A CB   1 
ATOM   171  C  CG   . ASP A 1 11  ? -45.816 12.400  2.746   1.00 29.24  ? 11  ASP A CG   1 
ATOM   172  O  OD1  . ASP A 1 11  ? -46.667 13.328  2.678   1.00 31.16  ? 11  ASP A OD1  1 
ATOM   173  O  OD2  . ASP A 1 11  ? -45.814 11.543  3.650   1.00 29.75  ? 11  ASP A OD2  1 
ATOM   174  H  H    . ASP A 1 11  ? -43.153 12.690  -0.113  1.00 30.55  ? 11  ASP A H    1 
ATOM   175  H  HA   . ASP A 1 11  ? -44.756 14.286  1.172   1.00 29.75  ? 11  ASP A HA   1 
ATOM   176  H  HB2  . ASP A 1 11  ? -45.198 11.969  0.858   1.00 31.61  ? 11  ASP A HB2  1 
ATOM   177  H  HB3  . ASP A 1 11  ? -44.099 11.649  1.959   1.00 31.61  ? 11  ASP A HB3  1 
ATOM   178  N  N    . VAL A 1 12  ? -42.138 13.458  2.849   1.00 23.26  ? 12  VAL A N    1 
ATOM   179  C  CA   . VAL A 1 12  ? -41.394 13.831  4.049   1.00 23.11  ? 12  VAL A CA   1 
ATOM   180  C  C    . VAL A 1 12  ? -40.849 15.253  3.942   1.00 21.85  ? 12  VAL A C    1 
ATOM   181  O  O    . VAL A 1 12  ? -40.782 15.970  4.948   1.00 21.82  ? 12  VAL A O    1 
ATOM   182  C  CB   . VAL A 1 12  ? -40.306 12.786  4.380   1.00 25.91  ? 12  VAL A CB   1 
ATOM   183  C  CG1  . VAL A 1 12  ? -39.095 12.992  3.505   1.00 27.47  ? 12  VAL A CG1  1 
ATOM   184  C  CG2  . VAL A 1 12  ? -39.948 12.840  5.863   1.00 28.25  ? 12  VAL A CG2  1 
ATOM   185  H  H    . VAL A 1 12  ? -41.783 12.837  2.371   1.00 27.93  ? 12  VAL A H    1 
ATOM   186  H  HA   . VAL A 1 12  ? -42.010 13.826  4.799   1.00 27.74  ? 12  VAL A HA   1 
ATOM   187  H  HB   . VAL A 1 12  ? -40.649 11.897  4.197   1.00 31.11  ? 12  VAL A HB   1 
ATOM   188  H  HG11 . VAL A 1 12  ? -38.530 12.205  3.558   1.00 32.97  ? 12  VAL A HG11 1 
ATOM   189  H  HG12 . VAL A 1 12  ? -39.386 13.128  2.590   1.00 32.97  ? 12  VAL A HG12 1 
ATOM   190  H  HG13 . VAL A 1 12  ? -38.608 13.771  3.817   1.00 32.97  ? 12  VAL A HG13 1 
ATOM   191  H  HG21 . VAL A 1 12  ? -39.263 12.178  6.046   1.00 33.91  ? 12  VAL A HG21 1 
ATOM   192  H  HG22 . VAL A 1 12  ? -39.617 13.726  6.076   1.00 33.91  ? 12  VAL A HG22 1 
ATOM   193  H  HG23 . VAL A 1 12  ? -40.741 12.648  6.387   1.00 33.91  ? 12  VAL A HG23 1 
ATOM   194  N  N    . VAL A 1 13  ? -40.491 15.709  2.737   1.00 23.34  ? 13  VAL A N    1 
ATOM   195  C  CA   . VAL A 1 13  ? -40.046 17.095  2.571   1.00 25.07  ? 13  VAL A CA   1 
ATOM   196  C  C    . VAL A 1 13  ? -41.177 18.083  2.870   1.00 23.78  ? 13  VAL A C    1 
ATOM   197  O  O    . VAL A 1 13  ? -40.968 19.098  3.547   1.00 23.84  ? 13  VAL A O    1 
ATOM   198  C  CB   . VAL A 1 13  ? -39.422 17.299  1.181   1.00 27.69  ? 13  VAL A CB   1 
ATOM   199  C  CG1  . VAL A 1 13  ? -39.293 18.773  0.854   1.00 29.87  ? 13  VAL A CG1  1 
ATOM   200  C  CG2  . VAL A 1 13  ? -38.068 16.608  1.151   1.00 28.55  ? 13  VAL A CG2  1 
ATOM   201  H  H    . VAL A 1 13  ? -40.497 15.245  2.013   1.00 28.03  ? 13  VAL A H    1 
ATOM   202  H  HA   . VAL A 1 13  ? -39.351 17.271  3.225   1.00 30.09  ? 13  VAL A HA   1 
ATOM   203  H  HB   . VAL A 1 13  ? -39.993 16.910  0.500   1.00 33.24  ? 13  VAL A HB   1 
ATOM   204  H  HG11 . VAL A 1 13  ? -38.715 18.876  0.081   1.00 35.86  ? 13  VAL A HG11 1 
ATOM   205  H  HG12 . VAL A 1 13  ? -40.173 19.132  0.659   1.00 35.86  ? 13  VAL A HG12 1 
ATOM   206  H  HG13 . VAL A 1 13  ? -38.910 19.234  1.617   1.00 35.86  ? 13  VAL A HG13 1 
ATOM   207  H  HG21 . VAL A 1 13  ? -37.868 16.267  2.037   1.00 34.27  ? 13  VAL A HG21 1 
ATOM   208  H  HG22 . VAL A 1 13  ? -38.101 15.877  0.514   1.00 34.27  ? 13  VAL A HG22 1 
ATOM   209  H  HG23 . VAL A 1 13  ? -37.392 17.250  0.883   1.00 34.27  ? 13  VAL A HG23 1 
ATOM   210  N  N    . GLN A 1 14  ? -42.394 17.807  2.396   1.00 22.67  ? 14  GLN A N    1 
ATOM   211  C  CA   . GLN A 1 14  ? -43.490 18.728  2.695   1.00 24.47  ? 14  GLN A CA   1 
ATOM   212  C  C    . GLN A 1 14  ? -43.813 18.720  4.180   1.00 22.66  ? 14  GLN A C    1 
ATOM   213  O  O    . GLN A 1 14  ? -44.110 19.768  4.760   1.00 23.62  ? 14  GLN A O    1 
ATOM   214  C  CB   . GLN A 1 14  ? -44.719 18.447  1.842   1.00 26.89  ? 14  GLN A CB   1 
ATOM   215  C  CG   . GLN A 1 14  ? -45.378 17.121  2.016   0.35 26.05  ? 14  GLN A CG   1 
ATOM   216  C  CD   . GLN A 1 14  ? -46.471 17.158  3.066   0.43 25.35  ? 14  GLN A CD   1 
ATOM   217  O  OE1  . GLN A 1 14  ? -47.016 18.220  3.398   0.32 24.33  ? 14  GLN A OE1  1 
ATOM   218  N  NE2  . GLN A 1 14  ? -46.806 15.990  3.590   0.35 24.74  ? 14  GLN A NE2  1 
ATOM   219  H  H    . GLN A 1 14  ? -42.603 17.122  1.920   1.00 27.21  ? 14  GLN A H    1 
ATOM   220  H  HA   . GLN A 1 14  ? -43.208 19.624  2.453   1.00 29.37  ? 14  GLN A HA   1 
ATOM   221  H  HB2  . GLN A 1 14  ? -45.385 19.122  2.048   1.00 32.28  ? 14  GLN A HB2  1 
ATOM   222  H  HB3  . GLN A 1 14  ? -44.458 18.512  0.911   1.00 32.28  ? 14  GLN A HB3  1 
ATOM   223  H  HG2  . GLN A 1 14  ? -45.776 16.851  1.174   0.41 31.28  ? 14  GLN A HG2  1 
ATOM   224  H  HG3  . GLN A 1 14  ? -44.715 16.470  2.293   0.66 31.28  ? 14  GLN A HG3  1 
ATOM   225  H  HE21 . GLN A 1 14  ? -46.409 15.273  3.330   0.64 29.70  ? 14  GLN A HE21 1 
ATOM   226  H  HE22 . GLN A 1 14  ? -47.420 15.948  4.191   0.52 29.70  ? 14  GLN A HE22 1 
ATOM   227  N  N    . LEU A 1 15  ? -43.740 17.550  4.814   1.00 23.12  ? 15  LEU A N    1 
ATOM   228  C  CA   . LEU A 1 15  ? -43.909 17.474  6.260   1.00 24.66  ? 15  LEU A CA   1 
ATOM   229  C  C    . LEU A 1 15  ? -42.862 18.307  6.985   1.00 21.75  ? 15  LEU A C    1 
ATOM   230  O  O    . LEU A 1 15  ? -43.169 19.026  7.957   1.00 22.21  ? 15  LEU A O    1 
ATOM   231  C  CB   . LEU A 1 15  ? -43.776 16.024  6.702   1.00 27.66  ? 15  LEU A CB   1 
ATOM   232  C  CG   . LEU A 1 15  ? -44.975 15.112  6.744   1.00 32.81  ? 15  LEU A CG   1 
ATOM   233  C  CD1  . LEU A 1 15  ? -44.428 13.727  7.083   1.00 33.28  ? 15  LEU A CD1  1 
ATOM   234  C  CD2  . LEU A 1 15  ? -45.943 15.621  7.787   0.70 32.59  ? 15  LEU A CD2  1 
ATOM   235  H  H    . LEU A 1 15  ? -43.595 16.793  4.432   1.00 27.75  ? 15  LEU A H    1 
ATOM   236  H  HA   . LEU A 1 15  ? -44.790 17.811  6.486   1.00 29.60  ? 15  LEU A HA   1 
ATOM   237  H  HB2  . LEU A 1 15  ? -43.143 15.602  6.100   1.00 33.21  ? 15  LEU A HB2  1 
ATOM   238  H  HB3  . LEU A 1 15  ? -43.419 16.035  7.604   1.00 33.21  ? 15  LEU A HB3  1 
ATOM   239  H  HG   . LEU A 1 15  ? -45.468 15.073  5.910   1.00 39.39  ? 15  LEU A HG   1 
ATOM   240  H  HD11 . LEU A 1 15  ? -45.165 13.099  7.135   1.00 39.94  ? 15  LEU A HD11 1 
ATOM   241  H  HD12 . LEU A 1 15  ? -43.809 13.453  6.388   1.00 39.94  ? 15  LEU A HD12 1 
ATOM   242  H  HD13 . LEU A 1 15  ? -43.968 13.769  7.936   1.00 39.94  ? 15  LEU A HD13 1 
ATOM   243  H  HD21 . LEU A 1 15  ? -46.718 15.037  7.811   0.60 39.12  ? 15  LEU A HD21 1 
ATOM   244  H  HD22 . LEU A 1 15  ? -45.504 15.623  8.652   0.89 39.12  ? 15  LEU A HD22 1 
ATOM   245  H  HD23 . LEU A 1 15  ? -46.215 16.522  7.552   0.84 39.12  ? 15  LEU A HD23 1 
ATOM   246  N  N    . SER A 1 16  ? -41.606 18.176  6.565   1.00 21.42  ? 16  SER A N    1 
ATOM   247  C  CA   . SER A 1 16  ? -40.525 18.891  7.227   1.00 20.11  ? 16  SER A CA   1 
ATOM   248  C  C    . SER A 1 16  ? -40.678 20.392  7.088   1.00 20.16  ? 16  SER A C    1 
ATOM   249  O  O    . SER A 1 16  ? -40.363 21.133  8.015   1.00 21.65  ? 16  SER A O    1 
ATOM   250  C  CB   . SER A 1 16  ? -39.175 18.424  6.695   1.00 21.00  ? 16  SER A CB   1 
ATOM   251  O  OG   . SER A 1 16  ? -38.986 17.049  6.982   1.00 24.61  ? 16  SER A OG   1 
ATOM   252  H  H    . SER A 1 16  ? -41.356 17.684  5.906   1.00 25.71  ? 16  SER A H    1 
ATOM   253  H  HA   . SER A 1 16  ? -40.555 18.682  8.174   1.00 24.14  ? 16  SER A HA   1 
ATOM   254  H  HB2  . SER A 1 16  ? -39.149 18.556  5.734   1.00 25.22  ? 16  SER A HB2  1 
ATOM   255  H  HB3  . SER A 1 16  ? -38.471 18.938  7.120   1.00 25.22  ? 16  SER A HB3  1 
ATOM   256  H  HG   . SER A 1 16  ? -39.604 16.596  6.638   1.00 29.55  ? 16  SER A HG   1 
ATOM   257  N  N    . LEU A 1 17  ? -41.184 20.863  5.952   1.00 21.45  ? 17  LEU A N    1 
ATOM   258  C  CA   . LEU A 1 17  ? -41.366 22.294  5.793   1.00 22.47  ? 17  LEU A CA   1 
ATOM   259  C  C    . LEU A 1 17  ? -42.311 22.864  6.836   1.00 23.79  ? 17  LEU A C    1 
ATOM   260  O  O    . LEU A 1 17  ? -42.190 24.042  7.197   1.00 24.72  ? 17  LEU A O    1 
ATOM   261  C  CB   . LEU A 1 17  ? -41.909 22.603  4.402   1.00 23.96  ? 17  LEU A CB   1 
ATOM   262  C  CG   . LEU A 1 17  ? -40.833 22.581  3.329   1.00 26.20  ? 17  LEU A CG   1 
ATOM   263  C  CD1  . LEU A 1 17  ? -41.482 22.599  1.980   1.00 27.11  ? 17  LEU A CD1  1 
ATOM   264  C  CD2  . LEU A 1 17  ? -39.878 23.753  3.483   1.00 27.21  ? 17  LEU A CD2  1 
ATOM   265  H  H    . LEU A 1 17  ? -41.422 20.386  5.278   1.00 25.75  ? 17  LEU A H    1 
ATOM   266  H  HA   . LEU A 1 17  ? -40.501 22.720  5.894   1.00 26.98  ? 17  LEU A HA   1 
ATOM   267  H  HB2  . LEU A 1 17  ? -42.578 21.940  4.170   1.00 28.76  ? 17  LEU A HB2  1 
ATOM   268  H  HB3  . LEU A 1 17  ? -42.307 23.488  4.409   1.00 28.76  ? 17  LEU A HB3  1 
ATOM   269  H  HG   . LEU A 1 17  ? -40.306 21.772  3.417   1.00 31.46  ? 17  LEU A HG   1 
ATOM   270  H  HD11 . LEU A 1 17  ? -42.015 23.405  1.897   1.00 32.54  ? 17  LEU A HD11 1 
ATOM   271  H  HD12 . LEU A 1 17  ? -40.792 22.587  1.298   1.00 32.54  ? 17  LEU A HD12 1 
ATOM   272  H  HD13 . LEU A 1 17  ? -42.049 21.817  1.891   1.00 32.54  ? 17  LEU A HD13 1 
ATOM   273  H  HD21 . LEU A 1 17  ? -39.323 23.815  2.689   1.00 32.67  ? 17  LEU A HD21 1 
ATOM   274  H  HD22 . LEU A 1 17  ? -40.392 24.568  3.591   1.00 32.67  ? 17  LEU A HD22 1 
ATOM   275  H  HD23 . LEU A 1 17  ? -39.322 23.607  4.264   1.00 32.67  ? 17  LEU A HD23 1 
ATOM   276  N  N    . ARG A 1 18  ? -43.264 22.065  7.310   1.00 25.00  ? 18  ARG A N    1 
ATOM   277  C  CA   . ARG A 1 18  ? -44.234 22.520  8.294   1.00 25.53  ? 18  ARG A CA   1 
ATOM   278  C  C    . ARG A 1 18  ? -43.922 22.054  9.715   1.00 24.82  ? 18  ARG A C    1 
ATOM   279  O  O    . ARG A 1 18  ? -44.754 22.227  10.611  1.00 26.38  ? 18  ARG A O    1 
ATOM   280  C  CB   . ARG A 1 18  ? -45.659 22.137  7.877   1.00 29.25  ? 18  ARG A CB   1 
ATOM   281  C  CG   . ARG A 1 18  ? -46.001 20.665  7.784   0.59 33.65  ? 18  ARG A CG   1 
ATOM   282  C  CD   . ARG A 1 18  ? -47.493 20.500  7.425   1.00 39.66  ? 18  ARG A CD   1 
ATOM   283  N  NE   . ARG A 1 18  ? -47.925 19.108  7.349   1.00 44.24  ? 18  ARG A NE   1 
ATOM   284  C  CZ   . ARG A 1 18  ? -48.412 18.418  8.371   0.05 48.47  ? 18  ARG A CZ   1 
ATOM   285  N  NH1  . ARG A 1 18  ? -48.379 18.895  9.602   1.00 50.81  ? 18  ARG A NH1  1 
ATOM   286  N  NH2  . ARG A 1 18  ? -48.945 17.219  8.152   0.61 50.05  ? 18  ARG A NH2  1 
ATOM   287  H  H    . ARG A 1 18  ? -43.368 21.246  7.072   1.00 30.01  ? 18  ARG A H    1 
ATOM   288  H  HA   . ARG A 1 18  ? -44.205 23.490  8.312   1.00 30.65  ? 18  ARG A HA   1 
ATOM   289  H  HB2  . ARG A 1 18  ? -46.270 22.524  8.524   1.00 35.12  ? 18  ARG A HB2  1 
ATOM   290  H  HB3  . ARG A 1 18  ? -45.822 22.517  6.999   1.00 35.12  ? 18  ARG A HB3  1 
ATOM   291  H  HG2  . ARG A 1 18  ? -45.466 20.247  7.092   0.49 40.39  ? 18  ARG A HG2  1 
ATOM   292  H  HG3  . ARG A 1 18  ? -45.836 20.235  8.637   0.52 40.39  ? 18  ARG A HG3  1 
ATOM   293  H  HD2  . ARG A 1 18  ? -48.028 20.940  8.104   1.00 47.61  ? 18  ARG A HD2  1 
ATOM   294  H  HD3  . ARG A 1 18  ? -47.654 20.908  6.560   1.00 47.61  ? 18  ARG A HD3  1 
ATOM   295  H  HE   . ARG A 1 18  ? -47.859 18.709  6.590   1.00 53.09  ? 18  ARG A HE   1 
ATOM   296  H  HH11 . ARG A 1 18  ? -48.036 19.669  9.755   1.00 60.98  ? 18  ARG A HH11 1 
ATOM   297  H  HH12 . ARG A 1 18  ? -48.700 18.432  10.251  1.00 60.98  ? 18  ARG A HH12 1 
ATOM   298  H  HH21 . ARG A 1 18  ? -48.971 16.899  7.354   0.74 60.07  ? 18  ARG A HH21 1 
ATOM   299  H  HH22 . ARG A 1 18  ? -49.263 16.764  8.809   1.00 60.07  ? 18  ARG A HH22 1 
ATOM   300  N  N    . ARG A 1 19  ? -42.744 21.506  9.948   1.00 23.78  ? 19  ARG A N    1 
ATOM   301  C  CA   . ARG A 1 19  ? -42.379 21.026  11.271  1.00 23.28  ? 19  ARG A CA   1 
ATOM   302  C  C    . ARG A 1 19  ? -42.371 22.165  12.287  1.00 21.27  ? 19  ARG A C    1 
ATOM   303  O  O    . ARG A 1 19  ? -41.588 23.107  12.131  1.00 21.62  ? 19  ARG A O    1 
ATOM   304  C  CB   . ARG A 1 19  ? -40.975 20.418  11.204  1.00 24.80  ? 19  ARG A CB   1 
ATOM   305  C  CG   . ARG A 1 19  ? -40.554 19.635  12.428  1.00 25.82  ? 19  ARG A CG   1 
ATOM   306  C  CD   . ARG A 1 19  ? -41.165 18.242  12.408  1.00 26.13  ? 19  ARG A CD   1 
ATOM   307  N  NE   . ARG A 1 19  ? -40.829 17.516  13.611  1.00 24.76  ? 19  ARG A NE   1 
ATOM   308  C  CZ   . ARG A 1 19  ? -39.862 16.614  13.685  1.00 23.36  ? 19  ARG A CZ   1 
ATOM   309  N  NH1  . ARG A 1 19  ? -39.126 16.296  12.626  1.00 24.00  ? 19  ARG A NH1  1 
ATOM   310  N  NH2  . ARG A 1 19  ? -39.642 16.009  14.845  1.00 22.64  ? 19  ARG A NH2  1 
ATOM   311  H  H    . ARG A 1 19  ? -42.131 21.398  9.354   1.00 28.55  ? 19  ARG A H    1 
ATOM   312  H  HA   . ARG A 1 19  ? -43.027 20.364  11.559  1.00 27.94  ? 19  ARG A HA   1 
ATOM   313  H  HB2  . ARG A 1 19  ? -40.939 19.814  10.446  1.00 29.77  ? 19  ARG A HB2  1 
ATOM   314  H  HB3  . ARG A 1 19  ? -40.335 21.138  11.085  1.00 29.77  ? 19  ARG A HB3  1 
ATOM   315  H  HG2  . ARG A 1 19  ? -39.588 19.549  12.442  1.00 30.99  ? 19  ARG A HG2  1 
ATOM   316  H  HG3  . ARG A 1 19  ? -40.858 20.094  13.227  1.00 30.99  ? 19  ARG A HG3  1 
ATOM   317  H  HD2  . ARG A 1 19  ? -42.130 18.312  12.351  1.00 31.36  ? 19  ARG A HD2  1 
ATOM   318  H  HD3  . ARG A 1 19  ? -40.822 17.749  11.646  1.00 31.36  ? 19  ARG A HD3  1 
ATOM   319  H  HE   . ARG A 1 19  ? -41.284 17.679  14.322  1.00 29.73  ? 19  ARG A HE   1 
ATOM   320  H  HH11 . ARG A 1 19  ? -39.272 16.678  11.870  1.00 28.81  ? 19  ARG A HH11 1 
ATOM   321  H  HH12 . ARG A 1 19  ? -38.503 15.707  12.697  1.00 28.81  ? 19  ARG A HH12 1 
ATOM   322  H  HH21 . ARG A 1 19  ? -40.123 16.205  15.530  1.00 27.19  ? 19  ARG A HH21 1 
ATOM   323  H  HH22 . ARG A 1 19  ? -39.018 15.421  14.912  1.00 27.19  ? 19  ARG A HH22 1 
ATOM   324  N  N    . PRO A 1 20  ? -43.159 22.093  13.365  1.00 21.93  ? 20  PRO A N    1 
ATOM   325  C  CA   . PRO A 1 20  ? -43.110 23.159  14.378  1.00 21.21  ? 20  PRO A CA   1 
ATOM   326  C  C    . PRO A 1 20  ? -41.790 23.153  15.134  1.00 19.62  ? 20  PRO A C    1 
ATOM   327  O  O    . PRO A 1 20  ? -41.304 22.100  15.573  1.00 22.43  ? 20  PRO A O    1 
ATOM   328  C  CB   . PRO A 1 20  ? -44.277 22.828  15.315  1.00 22.62  ? 20  PRO A CB   1 
ATOM   329  C  CG   . PRO A 1 20  ? -45.087 21.815  14.631  1.00 24.21  ? 20  PRO A CG   1 
ATOM   330  C  CD   . PRO A 1 20  ? -44.206 21.102  13.669  1.00 24.18  ? 20  PRO A CD   1 
ATOM   331  H  HA   . PRO A 1 20  ? -43.248 24.022  13.957  1.00 25.46  ? 20  PRO A HA   1 
ATOM   332  H  HB2  . PRO A 1 20  ? -43.931 22.480  16.152  1.00 27.15  ? 20  PRO A HB2  1 
ATOM   333  H  HB3  . PRO A 1 20  ? -44.798 23.629  15.479  1.00 27.15  ? 20  PRO A HB3  1 
ATOM   334  H  HG2  . PRO A 1 20  ? -45.442 21.194  15.286  1.00 29.06  ? 20  PRO A HG2  1 
ATOM   335  H  HG3  . PRO A 1 20  ? -45.815 22.252  14.161  1.00 29.06  ? 20  PRO A HG3  1 
ATOM   336  H  HD2  . PRO A 1 20  ? -43.823 20.309  14.075  1.00 29.02  ? 20  PRO A HD2  1 
ATOM   337  H  HD3  . PRO A 1 20  ? -44.696 20.861  12.867  1.00 29.02  ? 20  PRO A HD3  1 
ATOM   338  N  N    . SER A 1 21  ? -41.220 24.336  15.298  1.00 18.96  ? 21  SER A N    1 
ATOM   339  C  CA   . SER A 1 21  ? -39.944 24.470  15.975  1.00 19.12  ? 21  SER A CA   1 
ATOM   340  C  C    . SER A 1 21  ? -40.124 24.474  17.494  1.00 18.02  ? 21  SER A C    1 
ATOM   341  O  O    . SER A 1 21  ? -41.233 24.622  18.023  1.00 18.34  ? 21  SER A O    1 
ATOM   342  C  CB   . SER A 1 21  ? -39.275 25.769  15.540  1.00 22.01  ? 21  SER A CB   1 
ATOM   343  O  OG   . SER A 1 21  ? -40.130 26.875  15.794  1.00 23.01  ? 21  SER A OG   1 
ATOM   344  H  H    . SER A 1 21  ? -41.555 25.079  15.024  1.00 22.76  ? 21  SER A H    1 
ATOM   345  H  HA   . SER A 1 21  ? -39.379 23.717  15.742  1.00 22.95  ? 21  SER A HA   1 
ATOM   346  H  HB2  . SER A 1 21  ? -38.450 25.884  16.038  1.00 26.42  ? 21  SER A HB2  1 
ATOM   347  H  HB3  . SER A 1 21  ? -39.085 25.726  14.590  1.00 26.42  ? 21  SER A HB3  1 
ATOM   348  H  HG   . SER A 1 21  ? -40.822 26.818  15.321  1.00 27.63  ? 21  SER A HG   1 
ATOM   349  N  N    . VAL A 1 22  ? -39.003 24.306  18.190  1.00 18.55  ? 22  VAL A N    1 
ATOM   350  C  CA   . VAL A 1 22  ? -38.983 24.175  19.638  1.00 17.74  ? 22  VAL A CA   1 
ATOM   351  C  C    . VAL A 1 22  ? -38.321 25.386  20.268  1.00 18.89  ? 22  VAL A C    1 
ATOM   352  O  O    . VAL A 1 22  ? -37.621 26.154  19.611  1.00 20.07  ? 22  VAL A O    1 
ATOM   353  C  CB   . VAL A 1 22  ? -38.305 22.875  20.113  1.00 19.34  ? 22  VAL A CB   1 
ATOM   354  C  CG1  . VAL A 1 22  ? -38.930 21.661  19.480  1.00 21.11  ? 22  VAL A CG1  1 
ATOM   355  C  CG2  . VAL A 1 22  ? -36.804 22.928  19.849  1.00 19.44  ? 22  VAL A CG2  1 
ATOM   356  H  H    . VAL A 1 22  ? -38.222 24.265  17.834  1.00 22.27  ? 22  VAL A H    1 
ATOM   357  H  HA   . VAL A 1 22  ? -39.908 24.159  19.932  1.00 21.30  ? 22  VAL A HA   1 
ATOM   358  H  HB   . VAL A 1 22  ? -38.438 22.792  21.071  1.00 23.22  ? 22  VAL A HB   1 
ATOM   359  H  HG11 . VAL A 1 22  ? -38.517 20.865  19.848  1.00 25.34  ? 22  VAL A HG11 1 
ATOM   360  H  HG12 . VAL A 1 22  ? -39.881 21.659  19.672  1.00 25.34  ? 22  VAL A HG12 1 
ATOM   361  H  HG13 . VAL A 1 22  ? -38.786 21.696  18.522  1.00 25.34  ? 22  VAL A HG13 1 
ATOM   362  H  HG21 . VAL A 1 22  ? -36.433 22.038  19.954  1.00 23.34  ? 22  VAL A HG21 1 
ATOM   363  H  HG22 . VAL A 1 22  ? -36.653 23.245  18.945  1.00 23.34  ? 22  VAL A HG22 1 
ATOM   364  H  HG23 . VAL A 1 22  ? -36.393 23.535  20.484  1.00 23.34  ? 22  VAL A HG23 1 
ATOM   365  N  N    . ARG A 1 23  ? -38.509 25.515  21.583  1.00 18.42  ? 23  ARG A N    1 
ATOM   366  C  CA   . ARG A 1 23  ? -37.867 26.542  22.393  1.00 19.71  ? 23  ARG A CA   1 
ATOM   367  C  C    . ARG A 1 23  ? -37.216 25.882  23.606  1.00 19.88  ? 23  ARG A C    1 
ATOM   368  O  O    . ARG A 1 23  ? -37.863 25.115  24.322  1.00 21.38  ? 23  ARG A O    1 
ATOM   369  C  CB   . ARG A 1 23  ? -38.903 27.585  22.855  1.00 20.95  ? 23  ARG A CB   1 
ATOM   370  C  CG   . ARG A 1 23  ? -39.710 28.224  21.722  1.00 20.82  ? 23  ARG A CG   1 
ATOM   371  C  CD   . ARG A 1 23  ? -38.883 29.164  20.854  1.00 22.00  ? 23  ARG A CD   1 
ATOM   372  N  NE   . ARG A 1 23  ? -39.691 29.774  19.801  1.00 22.88  ? 23  ARG A NE   1 
ATOM   373  C  CZ   . ARG A 1 23  ? -39.998 29.195  18.649  1.00 22.32  ? 23  ARG A CZ   1 
ATOM   374  N  NH1  . ARG A 1 23  ? -39.497 28.012  18.322  1.00 20.53  ? 23  ARG A NH1  1 
ATOM   375  N  NH2  . ARG A 1 23  ? -40.856 29.798  17.823  1.00 25.89  ? 23  ARG A NH2  1 
ATOM   376  H  H    . ARG A 1 23  ? -39.022 24.999  22.041  1.00 22.11  ? 23  ARG A H    1 
ATOM   377  H  HA   . ARG A 1 23  ? -37.176 26.989  21.880  1.00 23.67  ? 23  ARG A HA   1 
ATOM   378  H  HB2  . ARG A 1 23  ? -39.531 27.151  23.453  1.00 25.15  ? 23  ARG A HB2  1 
ATOM   379  H  HB3  . ARG A 1 23  ? -38.437 28.297  23.321  1.00 25.15  ? 23  ARG A HB3  1 
ATOM   380  H  HG2  . ARG A 1 23  ? -40.061 27.523  21.151  1.00 25.00  ? 23  ARG A HG2  1 
ATOM   381  H  HG3  . ARG A 1 23  ? -40.439 28.737  22.105  1.00 25.00  ? 23  ARG A HG3  1 
ATOM   382  H  HD2  . ARG A 1 23  ? -38.517 29.872  21.406  1.00 26.41  ? 23  ARG A HD2  1 
ATOM   383  H  HD3  . ARG A 1 23  ? -38.164 28.664  20.435  1.00 26.41  ? 23  ARG A HD3  1 
ATOM   384  H  HE   . ARG A 1 23  ? -39.989 30.569  19.939  1.00 27.47  ? 23  ARG A HE   1 
ATOM   385  H  HH11 . ARG A 1 23  ? -38.962 27.608  18.860  1.00 24.65  ? 23  ARG A HH11 1 
ATOM   386  H  HH12 . ARG A 1 23  ? -39.706 27.649  17.570  1.00 24.65  ? 23  ARG A HH12 1 
ATOM   387  H  HH21 . ARG A 1 23  ? -41.202 30.555  18.041  1.00 31.08  ? 23  ARG A HH21 1 
ATOM   388  H  HH22 . ARG A 1 23  ? -41.062 29.431  17.074  1.00 31.08  ? 23  ARG A HH22 1 
ATOM   389  N  N    . ALA A 1 24  ? -35.946 26.193  23.851  1.00 20.55  ? 24  ALA A N    1 
ATOM   390  C  CA   . ALA A 1 24  ? -35.234 25.645  25.002  1.00 22.91  ? 24  ALA A CA   1 
ATOM   391  C  C    . ALA A 1 24  ? -33.872 26.315  25.065  1.00 25.48  ? 24  ALA A C    1 
ATOM   392  O  O    . ALA A 1 24  ? -33.354 26.772  24.043  1.00 26.45  ? 24  ALA A O    1 
ATOM   393  C  CB   . ALA A 1 24  ? -35.063 24.130  24.878  1.00 26.07  ? 24  ALA A CB   1 
ATOM   394  H  H    . ALA A 1 24  ? -35.474 26.722  23.364  1.00 24.67  ? 24  ALA A H    1 
ATOM   395  H  HA   . ALA A 1 24  ? -35.724 25.839  25.816  1.00 27.51  ? 24  ALA A HA   1 
ATOM   396  H  HB1  . ALA A 1 24  ? -34.568 23.805  25.645  1.00 31.30  ? 24  ALA A HB1  1 
ATOM   397  H  HB2  . ALA A 1 24  ? -35.939 23.715  24.849  1.00 31.30  ? 24  ALA A HB2  1 
ATOM   398  H  HB3  . ALA A 1 24  ? -34.577 23.933  24.062  1.00 31.30  ? 24  ALA A HB3  1 
ATOM   399  N  N    . SER A 1 25  ? -33.289 26.334  26.270  1.00 27.35  ? 25  SER A N    1 
ATOM   400  C  CA   A SER A 1 25  ? -31.955 26.874  26.501  0.50 28.80  ? 25  SER A CA   1 
ATOM   401  C  CA   B SER A 1 25  ? -31.954 26.872  26.499  0.50 28.80  ? 25  SER A CA   1 
ATOM   402  C  C    . SER A 1 25  ? -30.969 25.712  26.545  1.00 29.06  ? 25  SER A C    1 
ATOM   403  O  O    . SER A 1 25  ? -31.032 24.868  27.441  1.00 31.44  ? 25  SER A O    1 
ATOM   404  C  CB   A SER A 1 25  ? -31.908 27.648  27.818  0.50 30.10  ? 25  SER A CB   1 
ATOM   405  C  CB   B SER A 1 25  ? -31.877 27.656  27.807  0.50 30.39  ? 25  SER A CB   1 
ATOM   406  O  OG   A SER A 1 25  ? -32.728 28.798  27.763  0.50 32.26  ? 25  SER A OG   1 
ATOM   407  O  OG   B SER A 1 25  ? -30.542 28.102  28.023  0.50 32.54  ? 25  SER A OG   1 
ATOM   408  H  H    . SER A 1 25  ? -33.663 26.032  26.983  1.00 32.83  ? 25  SER A H    1 
ATOM   409  H  HA   . SER A 1 25  ? -31.713 27.474  25.779  1.00 34.57  ? 25  SER A HA   1 
ATOM   410  H  HB2  A SER A 1 25  ? -32.222 27.072  28.533  0.50 36.14  ? 25  SER A HB2  1 
ATOM   411  H  HB2  B SER A 1 25  ? -32.467 28.425  27.754  0.50 36.48  ? 25  SER A HB2  1 
ATOM   412  H  HB3  A SER A 1 25  ? -30.994 27.922  27.990  0.50 36.14  ? 25  SER A HB3  1 
ATOM   413  H  HB3  B SER A 1 25  ? -32.146 27.082  28.541  0.50 36.48  ? 25  SER A HB3  1 
ATOM   414  H  HG   A SER A 1 25  ? -33.525 28.576  27.617  0.50 38.72  ? 25  SER A HG   1 
ATOM   415  H  HG   B SER A 1 25  ? -30.301 28.601  27.393  0.50 39.06  ? 25  SER A HG   1 
ATOM   416  N  N    . ARG A 1 26  ? -30.059 25.677  25.591  1.00 31.59  ? 26  ARG A N    1 
ATOM   417  C  CA   . ARG A 1 26  ? -29.112 24.581  25.533  1.00 34.07  ? 26  ARG A CA   1 
ATOM   418  C  C    . ARG A 1 26  ? -28.194 24.580  26.762  1.00 34.55  ? 26  ARG A C    1 
ATOM   419  O  O    . ARG A 1 26  ? -27.841 25.626  27.308  1.00 33.84  ? 26  ARG A O    1 
ATOM   420  C  CB   . ARG A 1 26  ? -28.307 24.752  24.264  1.00 35.97  ? 26  ARG A CB   1 
ATOM   421  C  CG   . ARG A 1 26  ? -27.537 23.599  23.918  1.00 35.36  ? 26  ARG A CG   1 
ATOM   422  C  CD   . ARG A 1 26  ? -26.524 24.042  22.950  1.00 30.46  ? 26  ARG A CD   1 
ATOM   423  N  NE   . ARG A 1 26  ? -25.527 23.007  22.864  1.00 26.64  ? 26  ARG A NE   1 
ATOM   424  C  CZ   . ARG A 1 26  ? -25.618 21.962  22.065  1.00 24.41  ? 26  ARG A CZ   1 
ATOM   425  N  NH1  . ARG A 1 26  ? -26.599 21.849  21.181  1.00 24.65  ? 26  ARG A NH1  1 
ATOM   426  N  NH2  . ARG A 1 26  ? -24.685 21.031  22.135  1.00 23.48  ? 26  ARG A NH2  1 
ATOM   427  H  H    . ARG A 1 26  ? -29.969 26.267  24.971  1.00 37.92  ? 26  ARG A H    1 
ATOM   428  H  HA   . ARG A 1 26  ? -29.565 23.724  25.528  1.00 40.89  ? 26  ARG A HA   1 
ATOM   429  H  HB2  . ARG A 1 26  ? -28.914 24.935  23.530  1.00 43.18  ? 26  ARG A HB2  1 
ATOM   430  H  HB3  . ARG A 1 26  ? -27.693 25.495  24.380  1.00 43.18  ? 26  ARG A HB3  1 
ATOM   431  H  HG2  . ARG A 1 26  ? -27.099 23.235  24.704  1.00 42.45  ? 26  ARG A HG2  1 
ATOM   432  H  HG3  . ARG A 1 26  ? -28.102 22.923  23.512  1.00 42.45  ? 26  ARG A HG3  1 
ATOM   433  H  HD2  . ARG A 1 26  ? -26.927 24.173  22.077  1.00 36.56  ? 26  ARG A HD2  1 
ATOM   434  H  HD3  . ARG A 1 26  ? -26.108 24.865  23.251  1.00 36.56  ? 26  ARG A HD3  1 
ATOM   435  H  HE   . ARG A 1 26  ? -24.830 23.074  23.364  1.00 31.98  ? 26  ARG A HE   1 
ATOM   436  H  HH11 . ARG A 1 26  ? -27.195 22.466  21.119  1.00 29.60  ? 26  ARG A HH11 1 
ATOM   437  H  HH12 . ARG A 1 26  ? -26.639 21.159  20.670  1.00 29.60  ? 26  ARG A HH12 1 
ATOM   438  H  HH21 . ARG A 1 26  ? -24.036 21.114  22.693  1.00 28.18  ? 26  ARG A HH21 1 
ATOM   439  H  HH22 . ARG A 1 26  ? -24.726 20.341  21.623  1.00 28.18  ? 26  ARG A HH22 1 
ATOM   440  N  N    . GLN A 1 27  ? -27.809 23.382  27.201  1.00 36.22  ? 27  GLN A N    1 
ATOM   441  C  CA   . GLN A 1 27  ? -27.027 23.239  28.428  1.00 39.57  ? 27  GLN A CA   1 
ATOM   442  C  C    . GLN A 1 27  ? -25.525 23.111  28.202  1.00 39.52  ? 27  GLN A C    1 
ATOM   443  O  O    . GLN A 1 27  ? -24.746 23.766  28.899  1.00 40.89  ? 27  GLN A O    1 
ATOM   444  C  CB   . GLN A 1 27  ? -27.519 22.045  29.257  1.00 45.13  ? 27  GLN A CB   1 
ATOM   445  C  CG   . GLN A 1 27  ? -28.892 22.259  29.860  1.00 50.01  ? 27  GLN A CG   1 
ATOM   446  C  CD   . GLN A 1 27  ? -29.521 20.977  30.357  1.00 54.57  ? 27  GLN A CD   1 
ATOM   447  O  OE1  . GLN A 1 27  ? -29.173 20.475  31.427  1.00 56.19  ? 27  GLN A OE1  1 
ATOM   448  N  NE2  . GLN A 1 27  ? -30.482 20.460  29.602  1.00 56.45  ? 27  GLN A NE2  1 
ATOM   449  H  H    . GLN A 1 27  ? -27.989 22.639  26.806  1.00 43.48  ? 27  GLN A H    1 
ATOM   450  H  HA   . GLN A 1 27  ? -27.173 24.048  28.943  1.00 47.50  ? 27  GLN A HA   1 
ATOM   451  H  HB2  . GLN A 1 27  ? -27.563 21.263  28.685  1.00 54.17  ? 27  GLN A HB2  1 
ATOM   452  H  HB3  . GLN A 1 27  ? -26.896 21.890  29.984  1.00 54.17  ? 27  GLN A HB3  1 
ATOM   453  H  HG2  . GLN A 1 27  ? -28.815 22.867  30.612  1.00 60.03  ? 27  GLN A HG2  1 
ATOM   454  H  HG3  . GLN A 1 27  ? -29.477 22.638  29.185  1.00 60.03  ? 27  GLN A HG3  1 
ATOM   455  H  HE21 . GLN A 1 27  ? -30.715 20.853  28.874  1.00 67.75  ? 27  GLN A HE21 1 
ATOM   456  H  HE22 . GLN A 1 27  ? -30.871 19.731  29.842  1.00 67.75  ? 27  GLN A HE22 1 
ATOM   457  N  N    . ARG A 1 28  ? -25.102 22.267  27.280  1.00 38.38  ? 28  ARG A N    1 
ATOM   458  C  CA   . ARG A 1 28  ? -23.686 21.962  27.124  1.00 37.64  ? 28  ARG A CA   1 
ATOM   459  C  C    . ARG A 1 28  ? -23.136 22.557  25.832  1.00 32.49  ? 28  ARG A C    1 
ATOM   460  O  O    . ARG A 1 28  ? -23.848 22.603  24.824  1.00 31.89  ? 28  ARG A O    1 
ATOM   461  C  CB   . ARG A 1 28  ? -23.479 20.437  27.071  1.00 41.74  ? 28  ARG A CB   1 
ATOM   462  C  CG   . ARG A 1 28  ? -23.880 19.676  28.328  1.00 46.41  ? 28  ARG A CG   1 
ATOM   463  C  CD   . ARG A 1 28  ? -22.811 19.758  29.401  0.59 51.18  ? 28  ARG A CD   1 
ATOM   464  N  NE   . ARG A 1 28  ? -22.831 18.589  30.273  0.71 54.31  ? 28  ARG A NE   1 
ATOM   465  C  CZ   . ARG A 1 28  ? -23.859 18.231  31.030  0.46 56.70  ? 28  ARG A CZ   1 
ATOM   466  N  NH1  . ARG A 1 28  ? -24.946 18.985  31.125  0.65 57.39  ? 28  ARG A NH1  1 
ATOM   467  N  NH2  . ARG A 1 28  ? -23.800 17.082  31.700  0.76 57.55  ? 28  ARG A NH2  1 
ATOM   468  H  H    . ARG A 1 28  ? -25.615 21.854  26.727  1.00 46.06  ? 28  ARG A H    1 
ATOM   469  H  HA   . ARG A 1 28  ? -23.193 22.335  27.872  1.00 45.18  ? 28  ARG A HA   1 
ATOM   470  H  HB2  . ARG A 1 28  ? -24.008 20.083  26.339  1.00 50.11  ? 28  ARG A HB2  1 
ATOM   471  H  HB3  . ARG A 1 28  ? -22.538 20.262  26.916  1.00 50.11  ? 28  ARG A HB3  1 
ATOM   472  H  HG2  . ARG A 1 28  ? -24.698 20.056  28.685  1.00 55.70  ? 28  ARG A HG2  1 
ATOM   473  H  HG3  . ARG A 1 28  ? -24.016 18.742  28.107  1.00 55.70  ? 28  ARG A HG3  1 
ATOM   474  H  HD2  . ARG A 1 28  ? -21.939 19.810  28.980  0.84 61.43  ? 28  ARG A HD2  1 
ATOM   475  H  HD3  . ARG A 1 28  ? -22.964 20.547  29.945  0.75 61.43  ? 28  ARG A HD3  1 
ATOM   476  H  HE   . ARG A 1 28  ? -22.125 18.097  30.299  0.85 65.19  ? 28  ARG A HE   1 
ATOM   477  H  HH11 . ARG A 1 28  ? -24.995 19.725  30.691  0.79 68.89  ? 28  ARG A HH11 1 
ATOM   478  H  HH12 . ARG A 1 28  ? -25.602 18.733  31.622  0.81 68.89  ? 28  ARG A HH12 1 
ATOM   479  H  HH21 . ARG A 1 28  ? -23.102 16.585  31.639  0.84 69.08  ? 28  ARG A HH21 1 
ATOM   480  H  HH22 . ARG A 1 28  ? -24.461 16.838  32.194  0.82 69.08  ? 28  ARG A HH22 1 
ATOM   481  N  N    . PRO A 1 29  ? -21.885 23.022  25.831  1.00 30.00  ? 29  PRO A N    1 
ATOM   482  C  CA   . PRO A 1 29  ? -21.257 23.424  24.571  1.00 28.59  ? 29  PRO A CA   1 
ATOM   483  C  C    . PRO A 1 29  ? -21.237 22.274  23.578  1.00 27.28  ? 29  PRO A C    1 
ATOM   484  O  O    . PRO A 1 29  ? -21.233 21.101  23.946  1.00 29.16  ? 29  PRO A O    1 
ATOM   485  C  CB   . PRO A 1 29  ? -19.826 23.795  24.986  1.00 29.64  ? 29  PRO A CB   1 
ATOM   486  C  CG   . PRO A 1 29  ? -19.926 24.149  26.403  1.00 30.94  ? 29  PRO A CG   1 
ATOM   487  C  CD   . PRO A 1 29  ? -20.988 23.234  26.983  1.00 30.48  ? 29  PRO A CD   1 
ATOM   488  H  HA   . PRO A 1 29  ? -21.709 24.194  24.191  1.00 34.32  ? 29  PRO A HA   1 
ATOM   489  H  HB2  . PRO A 1 29  ? -19.237 23.035  24.858  1.00 35.58  ? 29  PRO A HB2  1 
ATOM   490  H  HB3  . PRO A 1 29  ? -19.514 24.548  24.460  1.00 35.58  ? 29  PRO A HB3  1 
ATOM   491  H  HG2  . PRO A 1 29  ? -19.072 24.003  26.838  1.00 37.13  ? 29  PRO A HG2  1 
ATOM   492  H  HG3  . PRO A 1 29  ? -20.189 25.078  26.491  1.00 37.13  ? 29  PRO A HG3  1 
ATOM   493  H  HD2  . PRO A 1 29  ? -20.601 22.396  27.283  1.00 36.59  ? 29  PRO A HD2  1 
ATOM   494  H  HD3  . PRO A 1 29  ? -21.457 23.663  27.716  1.00 36.59  ? 29  PRO A HD3  1 
ATOM   495  N  N    . ILE A 1 30  ? -21.189 22.638  22.297  1.00 25.89  ? 30  ILE A N    1 
ATOM   496  C  CA   . ILE A 1 30  ? -21.049 21.655  21.240  1.00 25.10  ? 30  ILE A CA   1 
ATOM   497  C  C    . ILE A 1 30  ? -19.717 20.930  21.379  1.00 27.05  ? 30  ILE A C    1 
ATOM   498  O  O    . ILE A 1 30  ? -18.673 21.531  21.691  1.00 29.28  ? 30  ILE A O    1 
ATOM   499  C  CB   . ILE A 1 30  ? -21.190 22.342  19.874  1.00 25.12  ? 30  ILE A CB   1 
ATOM   500  C  CG1  . ILE A 1 30  ? -22.654 22.718  19.639  1.00 28.10  ? 30  ILE A CG1  1 
ATOM   501  C  CG2  . ILE A 1 30  ? -20.652 21.436  18.752  1.00 26.43  ? 30  ILE A CG2  1 
ATOM   502  C  CD1  . ILE A 1 30  ? -22.860 23.550  18.399  1.00 29.30  ? 30  ILE A CD1  1 
ATOM   503  H  H    . ILE A 1 30  ? -21.236 23.450  22.017  1.00 31.08  ? 30  ILE A H    1 
ATOM   504  H  HA   . ILE A 1 30  ? -21.751 20.991  21.320  1.00 30.13  ? 30  ILE A HA   1 
ATOM   505  H  HB   . ILE A 1 30  ? -20.659 23.153  19.870  1.00 30.16  ? 30  ILE A HB   1 
ATOM   506  H  HG12 . ILE A 1 30  ? -23.176 21.906  19.544  1.00 33.74  ? 30  ILE A HG12 1 
ATOM   507  H  HG13 . ILE A 1 30  ? -22.972 23.231  20.399  1.00 33.74  ? 30  ILE A HG13 1 
ATOM   508  H  HG21 . ILE A 1 30  ? -19.683 21.420  18.796  1.00 31.73  ? 30  ILE A HG21 1 
ATOM   509  H  HG22 . ILE A 1 30  ? -21.004 20.540  18.873  1.00 31.73  ? 30  ILE A HG22 1 
ATOM   510  H  HG23 . ILE A 1 30  ? -20.939 21.791  17.896  1.00 31.73  ? 30  ILE A HG23 1 
ATOM   511  H  HD11 . ILE A 1 30  ? -23.738 23.960  18.437  1.00 35.17  ? 30  ILE A HD11 1 
ATOM   512  H  HD12 . ILE A 1 30  ? -22.176 24.237  18.362  1.00 35.17  ? 30  ILE A HD12 1 
ATOM   513  H  HD13 . ILE A 1 30  ? -22.796 22.976  17.620  1.00 35.17  ? 30  ILE A HD13 1 
ATOM   514  N  N    . ILE A 1 31  ? -19.752 19.625  21.167  1.00 26.53  ? 31  ILE A N    1 
ATOM   515  C  CA   . ILE A 1 31  ? -18.544 18.819  21.063  1.00 27.94  ? 31  ILE A CA   1 
ATOM   516  C  C    . ILE A 1 31  ? -18.538 18.167  19.686  1.00 27.35  ? 31  ILE A C    1 
ATOM   517  O  O    . ILE A 1 31  ? -19.562 17.663  19.208  1.00 28.55  ? 31  ILE A O    1 
ATOM   518  C  CB   . ILE A 1 31  ? -18.403 17.782  22.198  1.00 31.45  ? 31  ILE A CB   1 
ATOM   519  C  CG1  . ILE A 1 31  ? -19.610 16.851  22.249  1.00 32.29  ? 31  ILE A CG1  1 
ATOM   520  C  CG2  . ILE A 1 31  ? -18.244 18.477  23.530  1.00 32.95  ? 31  ILE A CG2  1 
ATOM   521  C  CD1  . ILE A 1 31  ? -19.422 15.673  23.171  1.00 34.46  ? 31  ILE A CD1  1 
ATOM   522  H  H    . ILE A 1 31  ? -20.478 19.173  21.077  1.00 31.85  ? 31  ILE A H    1 
ATOM   523  H  HA   . ILE A 1 31  ? -17.768 19.397  21.134  1.00 33.54  ? 31  ILE A HA   1 
ATOM   524  H  HB   . ILE A 1 31  ? -17.611 17.253  22.012  1.00 37.75  ? 31  ILE A HB   1 
ATOM   525  H  HG12 . ILE A 1 31  ? -20.380 17.353  22.560  1.00 38.76  ? 31  ILE A HG12 1 
ATOM   526  H  HG13 . ILE A 1 31  ? -19.778 16.507  21.357  1.00 38.76  ? 31  ILE A HG13 1 
ATOM   527  H  HG21 . ILE A 1 31  ? -18.034 17.816  24.208  1.00 39.56  ? 31  ILE A HG21 1 
ATOM   528  H  HG22 . ILE A 1 31  ? -17.525 19.124  23.465  1.00 39.56  ? 31  ILE A HG22 1 
ATOM   529  H  HG23 . ILE A 1 31  ? -19.075 18.926  23.753  1.00 39.56  ? 31  ILE A HG23 1 
ATOM   530  H  HD11 . ILE A 1 31  ? -20.183 15.078  23.082  1.00 41.36  ? 31  ILE A HD11 1 
ATOM   531  H  HD12 . ILE A 1 31  ? -18.607 15.208  22.927  1.00 41.36  ? 31  ILE A HD12 1 
ATOM   532  H  HD13 . ILE A 1 31  ? -19.358 15.994  24.084  1.00 41.36  ? 31  ILE A HD13 1 
ATOM   533  N  N    . SER A 1 32  ? -17.391 18.201  19.038  1.00 24.61  ? 32  SER A N    1 
ATOM   534  C  CA   . SER A 1 32  ? -17.323 17.874  17.621  1.00 22.59  ? 32  SER A CA   1 
ATOM   535  C  C    . SER A 1 32  ? -17.327 16.371  17.368  1.00 22.05  ? 32  SER A C    1 
ATOM   536  O  O    . SER A 1 32  ? -16.480 15.642  17.882  1.00 24.40  ? 32  SER A O    1 
ATOM   537  C  CB   . SER A 1 32  ? -16.048 18.492  17.054  1.00 23.59  ? 32  SER A CB   1 
ATOM   538  O  OG   . SER A 1 32  ? -15.836 18.083  15.724  1.00 24.90  ? 32  SER A OG   1 
ATOM   539  H  H    . SER A 1 32  ? -16.636 18.409  19.392  1.00 29.54  ? 32  SER A H    1 
ATOM   540  H  HA   . SER A 1 32  ? -18.109 18.226  17.174  1.00 27.12  ? 32  SER A HA   1 
ATOM   541  H  HB2  . SER A 1 32  ? -16.129 19.459  17.077  1.00 28.32  ? 32  SER A HB2  1 
ATOM   542  H  HB3  . SER A 1 32  ? -15.293 18.210  17.595  1.00 28.32  ? 32  SER A HB3  1 
ATOM   543  H  HG   . SER A 1 32  ? -16.495 18.297  15.250  1.00 29.89  ? 32  SER A HG   1 
ATOM   544  N  N    . LEU A 1 33  ? -18.254 15.924  16.518  1.00 19.84  ? 33  LEU A N    1 
ATOM   545  C  CA   . LEU A 1 33  ? -18.271 14.528  16.104  1.00 18.98  ? 33  LEU A CA   1 
ATOM   546  C  C    . LEU A 1 33  ? -17.141 14.246  15.120  1.00 18.62  ? 33  LEU A C    1 
ATOM   547  O  O    . LEU A 1 33  ? -16.432 13.247  15.254  1.00 18.58  ? 33  LEU A O    1 
ATOM   548  C  CB   . LEU A 1 33  ? -19.621 14.185  15.479  1.00 18.61  ? 33  LEU A CB   1 
ATOM   549  C  CG   . LEU A 1 33  ? -19.755 12.784  14.907  1.00 18.47  ? 33  LEU A CG   1 
ATOM   550  C  CD1  . LEU A 1 33  ? -19.449 11.704  15.927  1.00 19.44  ? 33  LEU A CD1  1 
ATOM   551  C  CD2  . LEU A 1 33  ? -21.126 12.579  14.289  1.00 19.25  ? 33  LEU A CD2  1 
ATOM   552  H  H    . LEU A 1 33  ? -18.877 16.405  16.171  1.00 23.82  ? 33  LEU A H    1 
ATOM   553  H  HA   . LEU A 1 33  ? -18.148 13.965  16.884  1.00 22.79  ? 33  LEU A HA   1 
ATOM   554  H  HB2  . LEU A 1 33  ? -20.303 14.282  16.162  1.00 22.35  ? 33  LEU A HB2  1 
ATOM   555  H  HB3  . LEU A 1 33  ? -19.785 14.807  14.754  1.00 22.35  ? 33  LEU A HB3  1 
ATOM   556  H  HG   . LEU A 1 33  ? -19.090 12.693  14.207  1.00 22.18  ? 33  LEU A HG   1 
ATOM   557  H  HD11 . LEU A 1 33  ? -19.621 10.836  15.530  1.00 23.34  ? 33  LEU A HD11 1 
ATOM   558  H  HD12 . LEU A 1 33  ? -18.517 11.770  16.187  1.00 23.34  ? 33  LEU A HD12 1 
ATOM   559  H  HD13 . LEU A 1 33  ? -20.018 11.832  16.702  1.00 23.34  ? 33  LEU A HD13 1 
ATOM   560  H  HD21 . LEU A 1 33  ? -21.180 11.678  13.933  1.00 23.12  ? 33  LEU A HD21 1 
ATOM   561  H  HD22 . LEU A 1 33  ? -21.803 12.705  14.973  1.00 23.12  ? 33  LEU A HD22 1 
ATOM   562  H  HD23 . LEU A 1 33  ? -21.251 13.225  13.576  1.00 23.12  ? 33  LEU A HD23 1 
ATOM   563  N  N    . ASN A 1 34  ? -16.932 15.117  14.135  1.00 19.54  ? 34  ASN A N    1 
ATOM   564  C  CA   . ASN A 1 34  ? -15.872 14.823  13.178  1.00 20.27  ? 34  ASN A CA   1 
ATOM   565  C  C    . ASN A 1 34  ? -14.499 14.822  13.834  1.00 21.01  ? 34  ASN A C    1 
ATOM   566  O  O    . ASN A 1 34  ? -13.633 14.025  13.455  1.00 21.52  ? 34  ASN A O    1 
ATOM   567  C  CB   . ASN A 1 34  ? -15.911 15.737  11.967  1.00 22.44  ? 34  ASN A CB   1 
ATOM   568  C  CG   . ASN A 1 34  ? -15.949 17.162  12.326  1.00 25.56  ? 34  ASN A CG   1 
ATOM   569  O  OD1  . ASN A 1 34  ? -16.848 17.581  13.041  1.00 28.47  ? 34  ASN A OD1  1 
ATOM   570  N  ND2  . ASN A 1 34  ? -14.945 17.920  11.899  1.00 29.04  ? 34  ASN A ND2  1 
ATOM   571  H  H    . ASN A 1 34  ? -17.367 15.847  14.006  1.00 23.46  ? 34  ASN A H    1 
ATOM   572  H  HA   . ASN A 1 34  ? -16.038 13.930  12.838  1.00 24.33  ? 34  ASN A HA   1 
ATOM   573  H  HB2  . ASN A 1 34  ? -15.116 15.585  11.432  1.00 26.94  ? 34  ASN A HB2  1 
ATOM   574  H  HB3  . ASN A 1 34  ? -16.705 15.537  11.447  1.00 26.94  ? 34  ASN A HB3  1 
ATOM   575  H  HD21 . ASN A 1 34  ? -14.930 18.759  12.087  1.00 34.86  ? 34  ASN A HD21 1 
ATOM   576  H  HD22 . ASN A 1 34  ? -14.310 17.572  11.435  1.00 34.86  ? 34  ASN A HD22 1 
ATOM   577  N  N    . GLU A 1 35  ? -14.267 15.714  14.809  1.00 22.38  ? 35  GLU A N    1 
ATOM   578  C  CA   . GLU A 1 35  ? -12.960 15.734  15.453  1.00 23.84  ? 35  GLU A CA   1 
ATOM   579  C  C    . GLU A 1 35  ? -12.754 14.503  16.325  1.00 22.69  ? 35  GLU A C    1 
ATOM   580  O  O    . GLU A 1 35  ? -11.639 13.976  16.387  1.00 22.99  ? 35  GLU A O    1 
ATOM   581  C  CB   . GLU A 1 35  ? -12.786 17.043  16.236  1.00 26.27  ? 35  GLU A CB   1 
ATOM   582  C  CG   . GLU A 1 35  ? -12.345 18.200  15.340  1.00 29.75  ? 35  GLU A CG   1 
ATOM   583  C  CD   . GLU A 1 35  ? -12.541 19.555  15.981  0.45 32.59  ? 35  GLU A CD   1 
ATOM   584  O  OE1  . GLU A 1 35  ? -12.384 19.657  17.214  0.66 33.72  ? 35  GLU A OE1  1 
ATOM   585  O  OE2  . GLU A 1 35  ? -12.835 20.518  15.244  0.61 34.25  ? 35  GLU A OE2  1 
ATOM   586  H  H    . GLU A 1 35  ? -14.832 16.294  15.100  1.00 26.87  ? 35  GLU A H    1 
ATOM   587  H  HA   . GLU A 1 35  ? -12.261 15.719  14.782  1.00 28.62  ? 35  GLU A HA   1 
ATOM   588  H  HB2  . GLU A 1 35  ? -13.633 17.283  16.645  1.00 31.54  ? 35  GLU A HB2  1 
ATOM   589  H  HB3  . GLU A 1 35  ? -12.111 16.916  16.921  1.00 31.54  ? 35  GLU A HB3  1 
ATOM   590  H  HG2  . GLU A 1 35  ? -11.401 18.099  15.138  1.00 35.71  ? 35  GLU A HG2  1 
ATOM   591  H  HG3  . GLU A 1 35  ? -12.863 18.179  14.520  1.00 35.71  ? 35  GLU A HG3  1 
ATOM   592  N  N    . ARG A 1 36  ? -13.816 14.000  16.963  1.00 21.52  ? 36  ARG A N    1 
ATOM   593  C  CA   . ARG A 1 36  ? -13.649 12.802  17.769  1.00 20.24  ? 36  ARG A CA   1 
ATOM   594  C  C    . ARG A 1 36  ? -13.375 11.591  16.885  1.00 19.90  ? 36  ARG A C    1 
ATOM   595  O  O    . ARG A 1 36  ? -12.631 10.685  17.283  1.00 20.07  ? 36  ARG A O    1 
ATOM   596  C  CB   . ARG A 1 36  ? -14.865 12.542  18.660  1.00 19.34  ? 36  ARG A CB   1 
ATOM   597  C  CG   . ARG A 1 36  ? -14.621 11.477  19.722  1.00 21.08  ? 36  ARG A CG   1 
ATOM   598  C  CD   . ARG A 1 36  ? -15.734 11.434  20.755  1.00 21.83  ? 36  ARG A CD   1 
ATOM   599  N  NE   . ARG A 1 36  ? -15.425 10.568  21.894  1.00 22.84  ? 36  ARG A NE   1 
ATOM   600  C  CZ   . ARG A 1 36  ? -16.124 9.493   22.255  1.00 23.92  ? 36  ARG A CZ   1 
ATOM   601  N  NH1  . ARG A 1 36  ? -17.208 9.114   21.602  1.00 23.06  ? 36  ARG A NH1  1 
ATOM   602  N  NH2  . ARG A 1 36  ? -15.731 8.782   23.311  1.00 23.37  ? 36  ARG A NH2  1 
ATOM   603  H  H    . ARG A 1 36  ? -14.612 14.326  16.943  1.00 25.84  ? 36  ARG A H    1 
ATOM   604  H  HA   . ARG A 1 36  ? -12.893 12.944  18.359  1.00 24.30  ? 36  ARG A HA   1 
ATOM   605  H  HB2  . ARG A 1 36  ? -15.103 13.365  19.113  1.00 23.22  ? 36  ARG A HB2  1 
ATOM   606  H  HB3  . ARG A 1 36  ? -15.602 12.244  18.104  1.00 23.22  ? 36  ARG A HB3  1 
ATOM   607  H  HG2  . ARG A 1 36  ? -14.571 10.607  19.296  1.00 25.30  ? 36  ARG A HG2  1 
ATOM   608  H  HG3  . ARG A 1 36  ? -13.789 11.669  20.182  1.00 25.30  ? 36  ARG A HG3  1 
ATOM   609  H  HD2  . ARG A 1 36  ? -15.885 12.330  21.094  1.00 26.21  ? 36  ARG A HD2  1 
ATOM   610  H  HD3  . ARG A 1 36  ? -16.541 11.098  20.335  1.00 26.21  ? 36  ARG A HD3  1 
ATOM   611  H  HE   . ARG A 1 36  ? -14.736 10.770  22.368  1.00 27.42  ? 36  ARG A HE   1 
ATOM   612  H  HH11 . ARG A 1 36  ? -17.481 9.566   20.923  1.00 27.69  ? 36  ARG A HH11 1 
ATOM   613  H  HH12 . ARG A 1 36  ? -17.641 8.416   21.856  1.00 27.69  ? 36  ARG A HH12 1 
ATOM   614  H  HH21 . ARG A 1 36  ? -15.031 9.018   23.752  1.00 28.06  ? 36  ARG A HH21 1 
ATOM   615  H  HH22 . ARG A 1 36  ? -16.176 8.086   23.551  1.00 28.06  ? 36  ARG A HH22 1 
ATOM   616  N  N    . ILE A 1 37  ? -13.994 11.540  15.697  1.00 17.85  ? 37  ILE A N    1 
ATOM   617  C  CA   . ILE A 1 37  ? -13.683 10.494  14.718  1.00 17.81  ? 37  ILE A CA   1 
ATOM   618  C  C    . ILE A 1 37  ? -12.199 10.499  14.380  1.00 18.49  ? 37  ILE A C    1 
ATOM   619  O  O    . ILE A 1 37  ? -11.544 9.450   14.347  1.00 19.60  ? 37  ILE A O    1 
ATOM   620  C  CB   . ILE A 1 37  ? -14.545 10.658  13.454  1.00 17.39  ? 37  ILE A CB   1 
ATOM   621  C  CG1  . ILE A 1 37  ? -15.992 10.259  13.762  1.00 16.62  ? 37  ILE A CG1  1 
ATOM   622  C  CG2  . ILE A 1 37  ? -13.986 9.832   12.306  1.00 17.60  ? 37  ILE A CG2  1 
ATOM   623  C  CD1  . ILE A 1 37  ? -17.020 10.714  12.748  1.00 16.79  ? 37  ILE A CD1  1 
ATOM   624  H  H    . ILE A 1 37  ? -14.594 12.097  15.436  1.00 21.43  ? 37  ILE A H    1 
ATOM   625  H  HA   . ILE A 1 37  ? -13.897 9.637   15.117  1.00 21.38  ? 37  ILE A HA   1 
ATOM   626  H  HB   . ILE A 1 37  ? -14.527 11.589  13.183  1.00 20.88  ? 37  ILE A HB   1 
ATOM   627  H  HG12 . ILE A 1 37  ? -16.039 9.291   13.808  1.00 19.95  ? 37  ILE A HG12 1 
ATOM   628  H  HG13 . ILE A 1 37  ? -16.239 10.643  14.618  1.00 19.95  ? 37  ILE A HG13 1 
ATOM   629  H  HG21 . ILE A 1 37  ? -14.675 9.724   11.631  1.00 21.14  ? 37  ILE A HG21 1 
ATOM   630  H  HG22 . ILE A 1 37  ? -13.222 10.294  11.927  1.00 21.14  ? 37  ILE A HG22 1 
ATOM   631  H  HG23 . ILE A 1 37  ? -13.715 8.964   12.644  1.00 21.14  ? 37  ILE A HG23 1 
ATOM   632  H  HD11 . ILE A 1 37  ? -17.907 10.506  13.083  1.00 20.16  ? 37  ILE A HD11 1 
ATOM   633  H  HD12 . ILE A 1 37  ? -16.932 11.671  12.616  1.00 20.16  ? 37  ILE A HD12 1 
ATOM   634  H  HD13 . ILE A 1 37  ? -16.866 10.249  11.911  1.00 20.16  ? 37  ILE A HD13 1 
ATOM   635  N  N    . LEU A 1 38  ? -11.638 11.676  14.106  1.00 19.75  ? 38  LEU A N    1 
ATOM   636  C  CA   . LEU A 1 38  ? -10.226 11.699  13.753  1.00 21.21  ? 38  LEU A CA   1 
ATOM   637  C  C    . LEU A 1 38  ? -9.366  11.278  14.931  1.00 22.22  ? 38  LEU A C    1 
ATOM   638  O  O    . LEU A 1 38  ? -8.333  10.633  14.743  1.00 23.41  ? 38  LEU A O    1 
ATOM   639  C  CB   . LEU A 1 38  ? -9.832  13.078  13.258  1.00 22.93  ? 38  LEU A CB   1 
ATOM   640  C  CG   . LEU A 1 38  ? -10.411 13.458  11.889  1.00 26.23  ? 38  LEU A CG   1 
ATOM   641  C  CD1  . LEU A 1 38  ? -10.106 14.917  11.672  1.00 27.56  ? 38  LEU A CD1  1 
ATOM   642  C  CD2  . LEU A 1 38  ? -9.797  12.606  10.782  1.00 27.15  ? 38  LEU A CD2  1 
ATOM   643  H  H    . LEU A 1 38  ? -12.036 12.438  14.118  1.00 23.71  ? 38  LEU A H    1 
ATOM   644  H  HA   . LEU A 1 38  ? -10.065 11.077  13.026  1.00 25.47  ? 38  LEU A HA   1 
ATOM   645  H  HB2  . LEU A 1 38  ? -10.142 13.736  13.900  1.00 27.53  ? 38  LEU A HB2  1 
ATOM   646  H  HB3  . LEU A 1 38  ? -8.865  13.115  13.186  1.00 27.53  ? 38  LEU A HB3  1 
ATOM   647  H  HG   . LEU A 1 38  ? -11.368 13.303  11.858  1.00 31.49  ? 38  LEU A HG   1 
ATOM   648  H  HD11 . LEU A 1 38  ? -9.146  15.048  11.708  1.00 33.09  ? 38  LEU A HD11 1 
ATOM   649  H  HD12 . LEU A 1 38  ? -10.444 15.185  10.803  1.00 33.09  ? 38  LEU A HD12 1 
ATOM   650  H  HD13 . LEU A 1 38  ? -10.537 15.437  12.369  1.00 33.09  ? 38  LEU A HD13 1 
ATOM   651  H  HD21 . LEU A 1 38  ? -10.071 12.962  9.922   1.00 32.60  ? 38  LEU A HD21 1 
ATOM   652  H  HD22 . LEU A 1 38  ? -8.831  12.636  10.860  1.00 32.60  ? 38  LEU A HD22 1 
ATOM   653  H  HD23 . LEU A 1 38  ? -10.109 11.693  10.877  1.00 32.60  ? 38  LEU A HD23 1 
ATOM   654  N  N    . GLU A 1 39  ? -9.786  11.613  16.149  1.00 22.44  ? 39  GLU A N    1 
ATOM   655  C  CA   . GLU A 1 39  ? -9.047  11.139  17.316  1.00 23.74  ? 39  GLU A CA   1 
ATOM   656  C  C    . GLU A 1 39  ? -9.115  9.624   17.439  1.00 22.56  ? 39  GLU A C    1 
ATOM   657  O  O    . GLU A 1 39  ? -8.101  8.975   17.716  1.00 23.25  ? 39  GLU A O    1 
ATOM   658  C  CB   . GLU A 1 39  ? -9.521  11.837  18.589  1.00 27.37  ? 39  GLU A CB   1 
ATOM   659  C  CG   . GLU A 1 39  ? -8.948  13.244  18.753  1.00 30.13  ? 39  GLU A CG   1 
ATOM   660  C  CD   . GLU A 1 39  ? -7.473  13.358  18.283  0.35 30.79  ? 39  GLU A CD   1 
ATOM   661  O  OE1  . GLU A 1 39  ? -6.584  12.662  18.837  0.65 32.14  ? 39  GLU A OE1  1 
ATOM   662  O  OE2  . GLU A 1 39  ? -7.205  14.116  17.332  0.51 30.20  ? 39  GLU A OE2  1 
ATOM   663  H  H    . GLU A 1 39  ? -10.474 12.098  16.322  1.00 26.94  ? 39  GLU A H    1 
ATOM   664  H  HA   . GLU A 1 39  ? -8.114  11.378  17.207  1.00 28.50  ? 39  GLU A HA   1 
ATOM   665  H  HB2  . GLU A 1 39  ? -10.488 11.910  18.566  1.00 32.86  ? 39  GLU A HB2  1 
ATOM   666  H  HB3  . GLU A 1 39  ? -9.246  11.312  19.356  1.00 32.86  ? 39  GLU A HB3  1 
ATOM   667  H  HG2  . GLU A 1 39  ? -9.478  13.864  18.227  1.00 36.17  ? 39  GLU A HG2  1 
ATOM   668  H  HG3  . GLU A 1 39  ? -8.983  13.491  19.690  1.00 36.17  ? 39  GLU A HG3  1 
ATOM   669  N  N    . PHE A 1 40  ? -10.298 9.035   17.220  1.00 21.44  ? 40  PHE A N    1 
ATOM   670  C  CA   . PHE A 1 40  ? -10.385 7.579   17.215  1.00 21.37  ? 40  PHE A CA   1 
ATOM   671  C  C    . PHE A 1 40  ? -9.474  6.976   16.149  1.00 21.34  ? 40  PHE A C    1 
ATOM   672  O  O    . PHE A 1 40  ? -8.823  5.956   16.390  1.00 21.36  ? 40  PHE A O    1 
ATOM   673  C  CB   . PHE A 1 40  ? -11.828 7.124   17.002  1.00 20.23  ? 40  PHE A CB   1 
ATOM   674  C  CG   . PHE A 1 40  ? -12.651 7.029   18.262  1.00 20.10  ? 40  PHE A CG   1 
ATOM   675  C  CD1  . PHE A 1 40  ? -12.528 7.950   19.289  1.00 20.77  ? 40  PHE A CD1  1 
ATOM   676  C  CD2  . PHE A 1 40  ? -13.606 6.037   18.378  1.00 19.91  ? 40  PHE A CD2  1 
ATOM   677  C  CE1  . PHE A 1 40  ? -13.327 7.858   20.423  1.00 20.33  ? 40  PHE A CE1  1 
ATOM   678  C  CE2  . PHE A 1 40  ? -14.408 5.944   19.501  1.00 20.01  ? 40  PHE A CE2  1 
ATOM   679  C  CZ   . PHE A 1 40  ? -14.275 6.860   20.517  1.00 21.38  ? 40  PHE A CZ   1 
ATOM   680  H  H    . PHE A 1 40  ? -11.039 9.447   17.075  1.00 25.74  ? 40  PHE A H    1 
ATOM   681  H  HA   . PHE A 1 40  ? -10.099 7.255   18.084  1.00 25.65  ? 40  PHE A HA   1 
ATOM   682  H  HB2  . PHE A 1 40  ? -12.267 7.757   16.413  1.00 24.29  ? 40  PHE A HB2  1 
ATOM   683  H  HB3  . PHE A 1 40  ? -11.816 6.244   16.593  1.00 24.29  ? 40  PHE A HB3  1 
ATOM   684  H  HD1  . PHE A 1 40  ? -11.905 8.637   19.219  1.00 24.94  ? 40  PHE A HD1  1 
ATOM   685  H  HD2  . PHE A 1 40  ? -13.712 5.422   17.689  1.00 23.91  ? 40  PHE A HD2  1 
ATOM   686  H  HE1  . PHE A 1 40  ? -13.223 8.469   21.117  1.00 24.41  ? 40  PHE A HE1  1 
ATOM   687  H  HE2  . PHE A 1 40  ? -15.037 5.263   19.569  1.00 24.03  ? 40  PHE A HE2  1 
ATOM   688  H  HZ   . PHE A 1 40  ? -14.823 6.806   21.267  1.00 25.67  ? 40  PHE A HZ   1 
ATOM   689  N  N    . ASN A 1 41  ? -9.414  7.590   14.960  1.00 21.14  ? 41  ASN A N    1 
ATOM   690  C  CA   . ASN A 1 41  ? -8.520  7.076   13.924  1.00 21.07  ? 41  ASN A CA   1 
ATOM   691  C  C    . ASN A 1 41  ? -7.064  7.079   14.398  1.00 23.49  ? 41  ASN A C    1 
ATOM   692  O  O    . ASN A 1 41  ? -6.331  6.115   14.168  1.00 26.00  ? 41  ASN A O    1 
ATOM   693  C  CB   . ASN A 1 41  ? -8.601  7.916   12.637  1.00 21.00  ? 41  ASN A CB   1 
ATOM   694  C  CG   . ASN A 1 41  ? -9.945  7.880   11.930  1.00 20.22  ? 41  ASN A CG   1 
ATOM   695  O  OD1  . ASN A 1 41  ? -10.206 8.773   11.137  1.00 21.70  ? 41  ASN A OD1  1 
ATOM   696  N  ND2  . ASN A 1 41  ? -10.783 6.875   12.178  1.00 20.57  ? 41  ASN A ND2  1 
ATOM   697  H  H    . ASN A 1 41  ? -9.869  8.285   14.736  1.00 25.38  ? 41  ASN A H    1 
ATOM   698  H  HA   . ASN A 1 41  ? -8.809  6.171   13.725  1.00 25.30  ? 41  ASN A HA   1 
ATOM   699  H  HB2  . ASN A 1 41  ? -8.416  8.841   12.861  1.00 25.21  ? 41  ASN A HB2  1 
ATOM   700  H  HB3  . ASN A 1 41  ? -7.936  7.586   12.012  1.00 25.21  ? 41  ASN A HB3  1 
ATOM   701  H  HD21 . ASN A 1 41  ? -11.547 6.844   11.783  1.00 24.69  ? 41  ASN A HD21 1 
ATOM   702  H  HD22 . ASN A 1 41  ? -10.561 6.256   12.732  1.00 24.69  ? 41  ASN A HD22 1 
ATOM   703  N  N    . LYS A 1 42  ? -6.630  8.156   15.066  1.00 25.39  ? 42  LYS A N    1 
ATOM   704  C  CA   . LYS A 1 42  ? -5.252  8.241   15.536  1.00 26.24  ? 42  LYS A CA   1 
ATOM   705  C  C    . LYS A 1 42  ? -4.977  7.241   16.655  1.00 26.46  ? 42  LYS A C    1 
ATOM   706  O  O    . LYS A 1 42  ? -3.834  6.789   16.822  1.00 30.19  ? 42  LYS A O    1 
ATOM   707  C  CB   . LYS A 1 42  ? -4.951  9.651   16.029  1.00 27.23  ? 42  LYS A CB   1 
ATOM   708  C  CG   . LYS A 1 42  ? -4.779  10.657  14.924  1.00 29.16  ? 42  LYS A CG   1 
ATOM   709  C  CD   . LYS A 1 42  ? -4.866  12.063  15.477  1.00 31.05  ? 42  LYS A CD   1 
ATOM   710  C  CE   . LYS A 1 42  ? -5.425  13.020  14.457  1.00 32.44  ? 42  LYS A CE   1 
ATOM   711  N  NZ   . LYS A 1 42  ? -5.206  14.429  14.888  0.37 31.38  ? 42  LYS A NZ   1 
ATOM   712  H  H    . LYS A 1 42  ? -7.113  8.843   15.256  1.00 30.48  ? 42  LYS A H    1 
ATOM   713  H  HA   . LYS A 1 42  ? -4.662  8.042   14.793  1.00 31.50  ? 42  LYS A HA   1 
ATOM   714  H  HB2  . LYS A 1 42  ? -5.685  9.949   16.588  1.00 32.69  ? 42  LYS A HB2  1 
ATOM   715  H  HB3  . LYS A 1 42  ? -4.128  9.632   16.542  1.00 32.69  ? 42  LYS A HB3  1 
ATOM   716  H  HG2  . LYS A 1 42  ? -3.910  10.541  14.509  1.00 35.00  ? 42  LYS A HG2  1 
ATOM   717  H  HG3  . LYS A 1 42  ? -5.481  10.540  14.264  1.00 35.00  ? 42  LYS A HG3  1 
ATOM   718  H  HD2  . LYS A 1 42  ? -5.449  12.068  16.253  1.00 37.28  ? 42  LYS A HD2  1 
ATOM   719  H  HD3  . LYS A 1 42  ? -3.979  12.366  15.727  1.00 37.28  ? 42  LYS A HD3  1 
ATOM   720  H  HE2  . LYS A 1 42  ? -4.980  12.884  13.606  1.00 38.94  ? 42  LYS A HE2  1 
ATOM   721  H  HE3  . LYS A 1 42  ? -6.379  12.871  14.360  1.00 38.94  ? 42  LYS A HE3  1 
ATOM   722  H  HZ1  . LYS A 1 42  ? -4.335  14.588  14.977  0.69 37.67  ? 42  LYS A HZ1  1 
ATOM   723  H  HZ2  . LYS A 1 42  ? -5.542  14.988  14.283  0.58 37.67  ? 42  LYS A HZ2  1 
ATOM   724  H  HZ3  . LYS A 1 42  ? -5.608  14.574  15.669  0.88 37.67  ? 42  LYS A HZ3  1 
ATOM   725  N  N    . ARG A 1 43  ? -6.011  6.869   17.406  1.00 26.22  ? 43  ARG A N    1 
ATOM   726  C  CA   . ARG A 1 43  ? -5.921  5.856   18.450  1.00 27.49  ? 43  ARG A CA   1 
ATOM   727  C  C    . ARG A 1 43  ? -6.140  4.436   17.924  1.00 28.55  ? 43  ARG A C    1 
ATOM   728  O  O    . ARG A 1 43  ? -6.054  3.488   18.703  1.00 30.30  ? 43  ARG A O    1 
ATOM   729  C  CB   . ARG A 1 43  ? -6.906  6.181   19.589  1.00 28.02  ? 43  ARG A CB   1 
ATOM   730  C  CG   . ARG A 1 43  ? -6.581  7.520   20.282  1.00 30.20  ? 43  ARG A CG   1 
ATOM   731  C  CD   . ARG A 1 43  ? -7.762  8.142   21.017  1.00 33.61  ? 43  ARG A CD   1 
ATOM   732  N  NE   . ARG A 1 43  ? -8.306  7.221   22.002  1.00 33.92  ? 43  ARG A NE   1 
ATOM   733  C  CZ   . ARG A 1 43  ? -9.451  7.404   22.638  1.00 38.90  ? 43  ARG A CZ   1 
ATOM   734  N  NH1  . ARG A 1 43  ? -10.193 8.477   22.425  1.00 39.33  ? 43  ARG A NH1  1 
ATOM   735  N  NH2  . ARG A 1 43  ? -9.861  6.488   23.509  1.00 40.96  ? 43  ARG A NH2  1 
ATOM   736  H  H    . ARG A 1 43  ? -6.800  7.201   17.326  1.00 31.48  ? 43  ARG A H    1 
ATOM   737  H  HA   . ARG A 1 43  ? -5.030  5.877   18.834  1.00 33.00  ? 43  ARG A HA   1 
ATOM   738  H  HB2  . ARG A 1 43  ? -7.804  6.240   19.225  1.00 33.63  ? 43  ARG A HB2  1 
ATOM   739  H  HB3  . ARG A 1 43  ? -6.864  5.478   20.255  1.00 33.63  ? 43  ARG A HB3  1 
ATOM   740  H  HG2  . ARG A 1 43  ? -5.876  7.372   20.932  1.00 36.25  ? 43  ARG A HG2  1 
ATOM   741  H  HG3  . ARG A 1 43  ? -6.285  8.155   19.611  1.00 36.25  ? 43  ARG A HG3  1 
ATOM   742  H  HD2  . ARG A 1 43  ? -7.471  8.946   21.476  1.00 40.34  ? 43  ARG A HD2  1 
ATOM   743  H  HD3  . ARG A 1 43  ? -8.461  8.359   20.380  1.00 40.34  ? 43  ARG A HD3  1 
ATOM   744  H  HE   . ARG A 1 43  ? -7.854  6.512   22.182  1.00 40.72  ? 43  ARG A HE   1 
ATOM   745  H  HH11 . ARG A 1 43  ? -9.933  9.074   21.864  1.00 47.21  ? 43  ARG A HH11 1 
ATOM   746  H  HH12 . ARG A 1 43  ? -10.934 8.578   22.848  1.00 47.21  ? 43  ARG A HH12 1 
ATOM   747  H  HH21 . ARG A 1 43  ? -9.382  5.788   23.654  1.00 49.17  ? 43  ARG A HH21 1 
ATOM   748  H  HH22 . ARG A 1 43  ? -10.604 6.595   23.929  1.00 49.17  ? 43  ARG A HH22 1 
ATOM   749  N  N    . ASN A 1 44  ? -6.384  4.274   16.624  1.00 27.96  ? 44  ASN A N    1 
ATOM   750  C  CA   . ASN A 1 44  ? -6.689  2.984   15.994  1.00 28.49  ? 44  ASN A CA   1 
ATOM   751  C  C    . ASN A 1 44  ? -7.872  2.274   16.660  1.00 27.09  ? 44  ASN A C    1 
ATOM   752  O  O    . ASN A 1 44  ? -7.874  1.050   16.825  1.00 29.49  ? 44  ASN A O    1 
ATOM   753  C  CB   . ASN A 1 44  ? -5.473  2.060   15.889  1.00 32.83  ? 44  ASN A CB   1 
ATOM   754  C  CG   . ASN A 1 44  ? -5.666  0.974   14.833  0.44 37.46  ? 44  ASN A CG   1 
ATOM   755  O  OD1  . ASN A 1 44  ? -6.344  1.188   13.812  1.00 40.90  ? 44  ASN A OD1  1 
ATOM   756  N  ND2  . ASN A 1 44  ? -5.101  -0.201  15.083  0.33 37.81  ? 44  ASN A ND2  1 
ATOM   757  H  H    . ASN A 1 44  ? -6.380  4.922   16.059  1.00 33.57  ? 44  ASN A H    1 
ATOM   758  H  HA   . ASN A 1 44  ? -6.958  3.187   15.085  1.00 34.20  ? 44  ASN A HA   1 
ATOM   759  H  HB2  . ASN A 1 44  ? -4.695  2.585   15.645  1.00 39.41  ? 44  ASN A HB2  1 
ATOM   760  H  HB3  . ASN A 1 44  ? -5.327  1.627   16.744  1.00 39.41  ? 44  ASN A HB3  1 
ATOM   761  H  HD21 . ASN A 1 44  ? -4.655  -0.318  15.810  0.61 45.39  ? 44  ASN A HD21 1 
ATOM   762  H  HD22 . ASN A 1 44  ? -5.180  -0.845  14.519  0.76 45.39  ? 44  ASN A HD22 1 
ATOM   763  N  N    . ILE A 1 45  ? -8.892  3.043   17.013  1.00 23.08  ? 45  ILE A N    1 
ATOM   764  C  CA   . ILE A 1 45  ? -10.158 2.530   17.519  1.00 23.14  ? 45  ILE A CA   1 
ATOM   765  C  C    . ILE A 1 45  ? -11.207 2.709   16.426  1.00 20.84  ? 45  ILE A C    1 
ATOM   766  O  O    . ILE A 1 45  ? -11.419 3.826   15.932  1.00 21.59  ? 45  ILE A O    1 
ATOM   767  C  CB   . ILE A 1 45  ? -10.613 3.286   18.774  1.00 26.31  ? 45  ILE A CB   1 
ATOM   768  C  CG1  . ILE A 1 45  ? -9.644  3.129   19.928  1.00 29.69  ? 45  ILE A CG1  1 
ATOM   769  C  CG2  . ILE A 1 45  ? -12.034 2.823   19.180  1.00 28.44  ? 45  ILE A CG2  1 
ATOM   770  C  CD1  . ILE A 1 45  ? -10.010 4.054   21.071  1.00 32.46  ? 45  ILE A CD1  1 
ATOM   771  H  H    . ILE A 1 45  ? -8.875  3.902   16.967  1.00 27.71  ? 45  ILE A H    1 
ATOM   772  H  HA   . ILE A 1 45  ? -10.052 1.588   17.723  1.00 27.78  ? 45  ILE A HA   1 
ATOM   773  H  HB   . ILE A 1 45  ? -10.631 4.231   18.555  1.00 31.58  ? 45  ILE A HB   1 
ATOM   774  H  HG12 . ILE A 1 45  ? -9.671  2.214   20.251  1.00 35.64  ? 45  ILE A HG12 1 
ATOM   775  H  HG13 . ILE A 1 45  ? -8.747  3.348   19.629  1.00 35.64  ? 45  ILE A HG13 1 
ATOM   776  H  HG21 . ILE A 1 45  ? -12.232 3.152   20.070  1.00 34.14  ? 45  ILE A HG21 1 
ATOM   777  H  HG22 . ILE A 1 45  ? -12.675 3.179   18.545  1.00 34.14  ? 45  ILE A HG22 1 
ATOM   778  H  HG23 . ILE A 1 45  ? -12.064 1.853   19.171  1.00 34.14  ? 45  ILE A HG23 1 
ATOM   779  H  HD11 . ILE A 1 45  ? -10.723 3.649   21.589  1.00 38.97  ? 45  ILE A HD11 1 
ATOM   780  H  HD12 . ILE A 1 45  ? -9.229  4.188   21.631  1.00 38.97  ? 45  ILE A HD12 1 
ATOM   781  H  HD13 . ILE A 1 45  ? -10.306 4.903   20.707  1.00 38.97  ? 45  ILE A HD13 1 
ATOM   782  N  N    . THR A 1 46  ? -11.867 1.621   16.052  1.00 20.38  ? 46  THR A N    1 
ATOM   783  C  CA   . THR A 1 46  ? -12.923 1.698   15.049  1.00 19.39  ? 46  THR A CA   1 
ATOM   784  C  C    . THR A 1 46  ? -14.011 2.645   15.541  1.00 18.91  ? 46  THR A C    1 
ATOM   785  O  O    . THR A 1 46  ? -14.484 2.522   16.675  1.00 20.38  ? 46  THR A O    1 
ATOM   786  C  CB   . THR A 1 46  ? -13.509 0.308   14.812  1.00 20.86  ? 46  THR A CB   1 
ATOM   787  O  OG1  . THR A 1 46  ? -12.489 -0.582  14.343  1.00 21.96  ? 46  THR A OG1  1 
ATOM   788  C  CG2  . THR A 1 46  ? -14.653 0.359   13.801  1.00 21.53  ? 46  THR A CG2  1 
ATOM   789  H  H    . THR A 1 46  ? -11.725 0.831   16.360  1.00 24.47  ? 46  THR A H    1 
ATOM   790  H  HA   . THR A 1 46  ? -12.567 2.027   14.209  1.00 23.28  ? 46  THR A HA   1 
ATOM   791  H  HB   . THR A 1 46  ? -13.866 -0.030  15.649  1.00 25.04  ? 46  THR A HB   1 
ATOM   792  H  HG1  . THR A 1 46  ? -11.875 -0.642  14.914  1.00 26.37  ? 46  THR A HG1  1 
ATOM   793  H  HG21 . THR A 1 46  ? -14.383 0.869   13.021  1.00 25.85  ? 46  THR A HG21 1 
ATOM   794  H  HG22 . THR A 1 46  ? -14.890 -0.539  13.523  1.00 25.85  ? 46  THR A HG22 1 
ATOM   795  H  HG23 . THR A 1 46  ? -15.430 0.781   14.200  1.00 25.85  ? 46  THR A HG23 1 
ATOM   796  N  N    . ALA A 1 47  ? -14.431 3.574   14.673  1.00 18.42  ? 47  ALA A N    1 
ATOM   797  C  CA   . ALA A 1 47  ? -15.342 4.661   15.022  1.00 17.39  ? 47  ALA A CA   1 
ATOM   798  C  C    . ALA A 1 47  ? -16.727 4.384   14.442  1.00 15.78  ? 47  ALA A C    1 
ATOM   799  O  O    . ALA A 1 47  ? -16.952 4.533   13.232  1.00 17.34  ? 47  ALA A O    1 
ATOM   800  C  CB   . ALA A 1 47  ? -14.771 5.989   14.528  1.00 17.33  ? 47  ALA A CB   1 
ATOM   801  H  H    . ALA A 1 47  ? -14.190 3.592   13.847  1.00 22.12  ? 47  ALA A H    1 
ATOM   802  H  HA   . ALA A 1 47  ? -15.448 4.688   15.986  1.00 20.88  ? 47  ALA A HA   1 
ATOM   803  H  HB1  . ALA A 1 47  ? -15.379 6.704   14.773  1.00 20.80  ? 47  ALA A HB1  1 
ATOM   804  H  HB2  . ALA A 1 47  ? -13.906 6.134   14.942  1.00 20.80  ? 47  ALA A HB2  1 
ATOM   805  H  HB3  . ALA A 1 47  ? -14.675 5.952   13.564  1.00 20.80  ? 47  ALA A HB3  1 
ATOM   806  N  N    . ILE A 1 48  ? -17.652 3.960   15.307  1.00 16.61  ? 48  ILE A N    1 
ATOM   807  C  CA   . ILE A 1 48  ? -19.021 3.634   14.924  1.00 15.88  ? 48  ILE A CA   1 
ATOM   808  C  C    . ILE A 1 48  ? -19.966 4.679   15.503  1.00 16.12  ? 48  ILE A C    1 
ATOM   809  O  O    . ILE A 1 48  ? -19.943 4.955   16.710  1.00 17.41  ? 48  ILE A O    1 
ATOM   810  C  CB   . ILE A 1 48  ? -19.444 2.216   15.345  1.00 17.84  ? 48  ILE A CB   1 
ATOM   811  C  CG1  . ILE A 1 48  ? -18.564 1.217   14.585  1.00 19.28  ? 48  ILE A CG1  1 
ATOM   812  C  CG2  . ILE A 1 48  ? -20.918 2.013   15.070  1.00 17.64  ? 48  ILE A CG2  1 
ATOM   813  C  CD1  . ILE A 1 48  ? -18.762 -0.193  14.962  1.00 22.17  ? 48  ILE A CD1  1 
ATOM   814  H  H    . ILE A 1 48  ? -17.501 3.851   16.147  1.00 19.95  ? 48  ILE A H    1 
ATOM   815  H  HA   . ILE A 1 48  ? -19.073 3.679   13.957  1.00 19.07  ? 48  ILE A HA   1 
ATOM   816  H  HB   . ILE A 1 48  ? -19.316 2.083   16.297  1.00 21.42  ? 48  ILE A HB   1 
ATOM   817  H  HG12 . ILE A 1 48  ? -18.758 1.294   13.638  1.00 23.14  ? 48  ILE A HG12 1 
ATOM   818  H  HG13 . ILE A 1 48  ? -17.634 1.436   14.753  1.00 23.14  ? 48  ILE A HG13 1 
ATOM   819  H  HG21 . ILE A 1 48  ? -21.120 2.336   14.178  1.00 21.19  ? 48  ILE A HG21 1 
ATOM   820  H  HG22 . ILE A 1 48  ? -21.124 1.067   15.134  1.00 21.19  ? 48  ILE A HG22 1 
ATOM   821  H  HG23 . ILE A 1 48  ? -21.433 2.509   15.726  1.00 21.19  ? 48  ILE A HG23 1 
ATOM   822  H  HD11 . ILE A 1 48  ? -18.048 -0.725  14.578  1.00 26.62  ? 48  ILE A HD11 1 
ATOM   823  H  HD12 . ILE A 1 48  ? -18.746 -0.266  15.929  1.00 26.62  ? 48  ILE A HD12 1 
ATOM   824  H  HD13 . ILE A 1 48  ? -19.619 -0.494  14.622  1.00 26.62  ? 48  ILE A HD13 1 
ATOM   825  N  N    . ILE A 1 49  ? -20.756 5.292   14.635  1.00 16.09  ? 49  ILE A N    1 
ATOM   826  C  CA   . ILE A 1 49  ? -21.843 6.173   15.034  1.00 16.62  ? 49  ILE A CA   1 
ATOM   827  C  C    . ILE A 1 49  ? -23.082 5.294   15.138  1.00 17.05  ? 49  ILE A C    1 
ATOM   828  O  O    . ILE A 1 49  ? -23.591 4.795   14.129  1.00 16.98  ? 49  ILE A O    1 
ATOM   829  C  CB   . ILE A 1 49  ? -22.065 7.322   14.040  1.00 16.19  ? 49  ILE A CB   1 
ATOM   830  C  CG1  . ILE A 1 49  ? -20.779 8.121   13.775  1.00 16.53  ? 49  ILE A CG1  1 
ATOM   831  C  CG2  . ILE A 1 49  ? -23.195 8.227   14.575  1.00 17.88  ? 49  ILE A CG2  1 
ATOM   832  C  CD1  . ILE A 1 49  ? -20.868 8.991   12.511  1.00 17.42  ? 49  ILE A CD1  1 
ATOM   833  H  H    . ILE A 1 49  ? -20.680 5.212   13.782  1.00 19.32  ? 49  ILE A H    1 
ATOM   834  H  HA   . ILE A 1 49  ? -21.641 6.571   15.895  1.00 19.96  ? 49  ILE A HA   1 
ATOM   835  H  HB   . ILE A 1 49  ? -22.324 6.947   13.184  1.00 19.44  ? 49  ILE A HB   1 
ATOM   836  H  HG12 . ILE A 1 49  ? -20.609 8.705   14.531  1.00 19.84  ? 49  ILE A HG12 1 
ATOM   837  H  HG13 . ILE A 1 49  ? -20.041 7.502   13.662  1.00 19.84  ? 49  ILE A HG13 1 
ATOM   838  H  HG21 . ILE A 1 49  ? -24.036 7.745   14.525  1.00 21.47  ? 49  ILE A HG21 1 
ATOM   839  H  HG22 . ILE A 1 49  ? -23.003 8.461   15.496  1.00 21.47  ? 49  ILE A HG22 1 
ATOM   840  H  HG23 . ILE A 1 49  ? -23.242 9.029   14.032  1.00 21.47  ? 49  ILE A HG23 1 
ATOM   841  H  HD11 . ILE A 1 49  ? -20.022 9.448   12.383  1.00 20.92  ? 49  ILE A HD11 1 
ATOM   842  H  HD12 . ILE A 1 49  ? -21.056 8.422   11.749  1.00 20.92  ? 49  ILE A HD12 1 
ATOM   843  H  HD13 . ILE A 1 49  ? -21.581 9.639   12.624  1.00 20.92  ? 49  ILE A HD13 1 
ATOM   844  N  N    . ALA A 1 50  ? -23.552 5.068   16.362  1.00 16.61  ? 50  ALA A N    1 
ATOM   845  C  CA   . ALA A 1 50  ? -24.709 4.216   16.595  1.00 16.72  ? 50  ALA A CA   1 
ATOM   846  C  C    . ALA A 1 50  ? -25.982 5.030   16.447  1.00 17.46  ? 50  ALA A C    1 
ATOM   847  O  O    . ALA A 1 50  ? -26.110 6.114   17.030  1.00 18.84  ? 50  ALA A O    1 
ATOM   848  C  CB   . ALA A 1 50  ? -24.653 3.609   17.995  1.00 18.14  ? 50  ALA A CB   1 
ATOM   849  H  H    . ALA A 1 50  ? -23.214 5.401   17.079  1.00 19.95  ? 50  ALA A H    1 
ATOM   850  H  HA   . ALA A 1 50  ? -24.716 3.498   15.942  1.00 20.07  ? 50  ALA A HA   1 
ATOM   851  H  HB1  . ALA A 1 50  ? -25.432 3.047   18.127  1.00 21.78  ? 50  ALA A HB1  1 
ATOM   852  H  HB2  . ALA A 1 50  ? -23.845 3.079   18.078  1.00 21.78  ? 50  ALA A HB2  1 
ATOM   853  H  HB3  . ALA A 1 50  ? -24.648 4.325   18.650  1.00 21.78  ? 50  ALA A HB3  1 
ATOM   854  N  N    . GLU A 1 51  ? -26.901 4.520   15.645  1.00 17.63  ? 51  GLU A N    1 
ATOM   855  C  CA   . GLU A 1 51  ? -28.129 5.241   15.368  1.00 18.02  ? 51  GLU A CA   1 
ATOM   856  C  C    . GLU A 1 51  ? -29.305 4.641   16.117  1.00 17.34  ? 51  GLU A C    1 
ATOM   857  O  O    . GLU A 1 51  ? -29.448 3.415   16.206  1.00 17.73  ? 51  GLU A O    1 
ATOM   858  C  CB   . GLU A 1 51  ? -28.406 5.250   13.879  1.00 18.91  ? 51  GLU A CB   1 
ATOM   859  C  CG   . GLU A 1 51  ? -29.599 6.075   13.451  1.00 21.66  ? 51  GLU A CG   1 
ATOM   860  C  CD   . GLU A 1 51  ? -29.575 6.295   11.965  1.00 27.11  ? 51  GLU A CD   1 
ATOM   861  O  OE1  . GLU A 1 51  ? -29.978 5.355   11.241  1.00 29.88  ? 51  GLU A OE1  1 
ATOM   862  O  OE2  . GLU A 1 51  ? -29.090 7.375   11.522  1.00 27.98  ? 51  GLU A OE2  1 
ATOM   863  H  H    . GLU A 1 51  ? -26.836 3.758   15.251  1.00 21.17  ? 51  GLU A H    1 
ATOM   864  H  HA   . GLU A 1 51  ? -28.039 6.155   15.678  1.00 21.63  ? 51  GLU A HA   1 
ATOM   865  H  HB2  . GLU A 1 51  ? -27.627 5.608   13.425  1.00 22.70  ? 51  GLU A HB2  1 
ATOM   866  H  HB3  . GLU A 1 51  ? -28.566 4.337   13.592  1.00 22.70  ? 51  GLU A HB3  1 
ATOM   867  H  HG2  . GLU A 1 51  ? -30.418 5.609   13.683  1.00 26.00  ? 51  GLU A HG2  1 
ATOM   868  H  HG3  . GLU A 1 51  ? -29.573 6.938   13.893  1.00 26.00  ? 51  GLU A HG3  1 
ATOM   869  N  N    . TYR A 1 52  ? -30.110 5.531   16.691  1.00 17.04  ? 52  TYR A N    1 
ATOM   870  C  CA   . TYR A 1 52  ? -31.369 5.167   17.328  1.00 15.61  ? 52  TYR A CA   1 
ATOM   871  C  C    . TYR A 1 52  ? -32.492 5.525   16.370  1.00 16.30  ? 52  TYR A C    1 
ATOM   872  O  O    . TYR A 1 52  ? -32.720 6.706   16.083  1.00 17.21  ? 52  TYR A O    1 
ATOM   873  C  CB   . TYR A 1 52  ? -31.567 5.889   18.660  1.00 16.74  ? 52  TYR A CB   1 
ATOM   874  C  CG   . TYR A 1 52  ? -32.870 5.471   19.302  1.00 17.46  ? 52  TYR A CG   1 
ATOM   875  C  CD1  . TYR A 1 52  ? -32.966 4.304   20.039  1.00 18.21  ? 52  TYR A CD1  1 
ATOM   876  C  CD2  . TYR A 1 52  ? -34.012 6.221   19.131  1.00 18.35  ? 52  TYR A CD2  1 
ATOM   877  C  CE1  . TYR A 1 52  ? -34.149 3.911   20.591  1.00 19.60  ? 52  TYR A CE1  1 
ATOM   878  C  CE2  . TYR A 1 52  ? -35.221 5.835   19.686  1.00 18.76  ? 52  TYR A CE2  1 
ATOM   879  C  CZ   . TYR A 1 52  ? -35.288 4.685   20.415  1.00 19.60  ? 52  TYR A CZ   1 
ATOM   880  O  OH   . TYR A 1 52  ? -36.495 4.326   20.960  1.00 21.47  ? 52  TYR A OH   1 
ATOM   881  H  H    . TYR A 1 52  ? -29.943 6.374   16.725  1.00 20.46  ? 52  TYR A H    1 
ATOM   882  H  HA   . TYR A 1 52  ? -31.367 4.212   17.501  1.00 18.74  ? 52  TYR A HA   1 
ATOM   883  H  HB2  . TYR A 1 52  ? -30.840 5.664   19.262  1.00 20.10  ? 52  TYR A HB2  1 
ATOM   884  H  HB3  . TYR A 1 52  ? -31.589 6.847   18.509  1.00 20.10  ? 52  TYR A HB3  1 
ATOM   885  H  HD1  . TYR A 1 52  ? -32.209 3.778   20.160  1.00 21.87  ? 52  TYR A HD1  1 
ATOM   886  H  HD2  . TYR A 1 52  ? -33.970 7.005   18.631  1.00 22.03  ? 52  TYR A HD2  1 
ATOM   887  H  HE1  . TYR A 1 52  ? -34.193 3.125   21.086  1.00 23.54  ? 52  TYR A HE1  1 
ATOM   888  H  HE2  . TYR A 1 52  ? -35.982 6.356   19.562  1.00 22.52  ? 52  TYR A HE2  1 
ATOM   889  H  HH   . TYR A 1 52  ? -36.415 3.606   21.385  1.00 25.77  ? 52  TYR A HH   1 
ATOM   890  N  N    . LYS A 1 53  ? -33.181 4.502   15.875  1.00 17.60  ? 53  LYS A N    1 
ATOM   891  C  CA   . LYS A 1 53  ? -34.382 4.685   15.074  1.00 19.54  ? 53  LYS A CA   1 
ATOM   892  C  C    . LYS A 1 53  ? -35.307 3.507   15.286  1.00 18.23  ? 53  LYS A C    1 
ATOM   893  O  O    . LYS A 1 53  ? -34.886 2.348   15.187  1.00 17.62  ? 53  LYS A O    1 
ATOM   894  C  CB   . LYS A 1 53  ? -34.118 4.888   13.583  1.00 25.05  ? 53  LYS A CB   1 
ATOM   895  C  CG   . LYS A 1 53  ? -33.417 3.795   12.917  1.00 24.23  ? 53  LYS A CG   1 
ATOM   896  C  CD   . LYS A 1 53  ? -33.331 4.046   11.390  1.00 25.13  ? 53  LYS A CD   1 
ATOM   897  C  CE   . LYS A 1 53  ? -32.505 2.984   10.750  1.00 26.23  ? 53  LYS A CE   1 
ATOM   898  N  NZ   . LYS A 1 53  ? -31.645 3.552   9.684   1.00 27.47  ? 53  LYS A NZ   1 
ATOM   899  H  H    . LYS A 1 53  ? -32.968 3.677   15.993  1.00 21.13  ? 53  LYS A H    1 
ATOM   900  H  HA   . LYS A 1 53  ? -34.815 5.494   15.387  1.00 23.46  ? 53  LYS A HA   1 
ATOM   901  H  HB2  . LYS A 1 53  ? -34.970 5.001   13.134  1.00 30.07  ? 53  LYS A HB2  1 
ATOM   902  H  HB3  . LYS A 1 53  ? -33.578 5.686   13.474  1.00 30.07  ? 53  LYS A HB3  1 
ATOM   903  H  HG2  . LYS A 1 53  ? -32.515 3.726   13.269  1.00 29.09  ? 53  LYS A HG2  1 
ATOM   904  H  HG3  . LYS A 1 53  ? -33.895 2.964   13.067  1.00 29.09  ? 53  LYS A HG3  1 
ATOM   905  H  HD2  . LYS A 1 53  ? -34.220 4.025   11.004  1.00 30.16  ? 53  LYS A HD2  1 
ATOM   906  H  HD3  . LYS A 1 53  ? -32.916 4.907   11.222  1.00 30.16  ? 53  LYS A HD3  1 
ATOM   907  H  HE2  . LYS A 1 53  ? -31.935 2.571   11.418  1.00 31.49  ? 53  LYS A HE2  1 
ATOM   908  H  HE3  . LYS A 1 53  ? -33.087 2.317   10.353  1.00 31.49  ? 53  LYS A HE3  1 
ATOM   909  H  HZ1  . LYS A 1 53  ? -31.153 2.908   9.315   1.00 32.97  ? 53  LYS A HZ1  1 
ATOM   910  H  HZ2  . LYS A 1 53  ? -32.149 3.927   9.054   1.00 32.97  ? 53  LYS A HZ2  1 
ATOM   911  H  HZ3  . LYS A 1 53  ? -31.103 4.169   10.027  1.00 32.97  ? 53  LYS A HZ3  1 
ATOM   912  N  N    . ARG A 1 54  ? -36.572 3.829   15.555  1.00 19.33  ? 54  ARG A N    1 
ATOM   913  C  CA   . ARG A 1 54  ? -37.570 2.825   15.879  1.00 19.68  ? 54  ARG A CA   1 
ATOM   914  C  C    . ARG A 1 54  ? -38.178 2.212   14.628  1.00 18.24  ? 54  ARG A C    1 
ATOM   915  O  O    . ARG A 1 54  ? -38.578 1.047   14.643  1.00 21.29  ? 54  ARG A O    1 
ATOM   916  C  CB   . ARG A 1 54  ? -38.693 3.453   16.707  1.00 20.81  ? 54  ARG A CB   1 
ATOM   917  C  CG   . ARG A 1 54  ? -38.278 4.014   18.044  1.00 21.97  ? 54  ARG A CG   1 
ATOM   918  C  CD   . ARG A 1 54  ? -39.473 4.732   18.718  1.00 23.34  ? 54  ARG A CD   1 
ATOM   919  N  NE   . ARG A 1 54  ? -39.144 5.289   20.019  0.69 25.82  ? 54  ARG A NE   1 
ATOM   920  C  CZ   . ARG A 1 54  ? -38.774 6.541   20.229  0.55 29.32  ? 54  ARG A CZ   1 
ATOM   921  N  NH1  . ARG A 1 54  ? -38.636 7.401   19.233  1.00 33.36  ? 54  ARG A NH1  1 
ATOM   922  N  NH2  . ARG A 1 54  ? -38.530 6.938   21.469  1.00 30.08  ? 54  ARG A NH2  1 
ATOM   923  H  H    . ARG A 1 54  ? -36.878 4.632   15.555  1.00 23.21  ? 54  ARG A H    1 
ATOM   924  H  HA   . ARG A 1 54  ? -37.145 2.127   16.402  1.00 23.63  ? 54  ARG A HA   1 
ATOM   925  H  HB2  . ARG A 1 54  ? -39.078 4.182   16.195  1.00 24.98  ? 54  ARG A HB2  1 
ATOM   926  H  HB3  . ARG A 1 54  ? -39.365 2.774   16.875  1.00 24.98  ? 54  ARG A HB3  1 
ATOM   927  H  HG2  . ARG A 1 54  ? -37.983 3.293   18.623  1.00 26.38  ? 54  ARG A HG2  1 
ATOM   928  H  HG3  . ARG A 1 54  ? -37.561 4.655   17.920  1.00 26.38  ? 54  ARG A HG3  1 
ATOM   929  H  HD2  . ARG A 1 54  ? -39.765 5.460   18.148  1.00 28.02  ? 54  ARG A HD2  1 
ATOM   930  H  HD3  . ARG A 1 54  ? -40.195 4.095   18.840  1.00 28.02  ? 54  ARG A HD3  1 
ATOM   931  H  HE   . ARG A 1 54  ? -39.192 4.767   20.701  0.71 30.99  ? 54  ARG A HE   1 
ATOM   932  H  HH11 . ARG A 1 54  ? -38.786 7.150   18.424  1.00 40.04  ? 54  ARG A HH11 1 
ATOM   933  H  HH12 . ARG A 1 54  ? -38.394 8.211   19.394  1.00 40.04  ? 54  ARG A HH12 1 
ATOM   934  H  HH21 . ARG A 1 54  ? -38.612 6.384   22.122  1.00 36.11  ? 54  ARG A HH21 1 
ATOM   935  H  HH22 . ARG A 1 54  ? -38.289 7.749   21.622  1.00 36.11  ? 54  ARG A HH22 1 
ATOM   936  N  N    . LYS A 1 55  ? -38.257 2.963   13.538  1.00 18.31  ? 55  LYS A N    1 
ATOM   937  C  CA   . LYS A 1 55  ? -38.952 2.530   12.335  1.00 18.75  ? 55  LYS A CA   1 
ATOM   938  C  C    . LYS A 1 55  ? -38.157 3.041   11.145  1.00 19.01  ? 55  LYS A C    1 
ATOM   939  O  O    . LYS A 1 55  ? -37.381 3.988   11.256  1.00 18.44  ? 55  LYS A O    1 
ATOM   940  C  CB   . LYS A 1 55  ? -40.385 3.078   12.385  1.00 21.01  ? 55  LYS A CB   1 
ATOM   941  C  CG   . LYS A 1 55  ? -41.268 2.696   11.231  1.00 23.81  ? 55  LYS A CG   1 
ATOM   942  C  CD   . LYS A 1 55  ? -42.711 3.161   11.445  1.00 24.30  ? 55  LYS A CD   1 
ATOM   943  C  CE   . LYS A 1 55  ? -43.676 2.392   10.559  0.38 25.62  ? 55  LYS A CE   1 
ATOM   944  N  NZ   . LYS A 1 55  ? -45.092 2.789   10.808  0.25 26.46  ? 55  LYS A NZ   1 
ATOM   945  H  H    . LYS A 1 55  ? -37.907 3.746   13.468  1.00 21.99  ? 55  LYS A H    1 
ATOM   946  H  HA   . LYS A 1 55  ? -39.004 1.566   12.236  1.00 22.51  ? 55  LYS A HA   1 
ATOM   947  H  HB2  . LYS A 1 55  ? -40.809 2.749   13.193  1.00 25.22  ? 55  LYS A HB2  1 
ATOM   948  H  HB3  . LYS A 1 55  ? -40.340 4.047   12.405  1.00 25.22  ? 55  LYS A HB3  1 
ATOM   949  H  HG2  . LYS A 1 55  ? -40.932 3.108   10.420  1.00 28.58  ? 55  LYS A HG2  1 
ATOM   950  H  HG3  . LYS A 1 55  ? -41.270 1.730   11.136  1.00 28.58  ? 55  LYS A HG3  1 
ATOM   951  H  HD2  . LYS A 1 55  ? -42.962 3.016   12.370  1.00 29.17  ? 55  LYS A HD2  1 
ATOM   952  H  HD3  . LYS A 1 55  ? -42.780 4.104   11.227  1.00 29.17  ? 55  LYS A HD3  1 
ATOM   953  H  HE2  . LYS A 1 55  ? -43.469 2.572   9.628   0.79 30.76  ? 55  LYS A HE2  1 
ATOM   954  H  HE3  . LYS A 1 55  ? -43.590 1.443   10.740  0.86 30.76  ? 55  LYS A HE3  1 
ATOM   955  H  HZ1  . LYS A 1 55  ? -45.637 2.321   10.283  0.81 31.76  ? 55  LYS A HZ1  1 
ATOM   956  H  HZ2  . LYS A 1 55  ? -45.307 2.633   11.658  0.70 31.76  ? 55  LYS A HZ2  1 
ATOM   957  H  HZ3  . LYS A 1 55  ? -45.200 3.656   10.637  0.83 31.76  ? 55  LYS A HZ3  1 
ATOM   958  N  N    . SER A 1 56  ? -38.322 2.384   10.002  1.00 18.87  ? 56  SER A N    1 
ATOM   959  C  CA   . SER A 1 56  ? -37.745 2.904   8.777   1.00 19.96  ? 56  SER A CA   1 
ATOM   960  C  C    . SER A 1 56  ? -38.595 2.488   7.593   1.00 19.52  ? 56  SER A C    1 
ATOM   961  O  O    . SER A 1 56  ? -39.321 1.485   7.654   1.00 21.39  ? 56  SER A O    1 
ATOM   962  C  CB   . SER A 1 56  ? -36.316 2.411   8.562   1.00 21.20  ? 56  SER A CB   1 
ATOM   963  O  OG   . SER A 1 56  ? -36.378 1.071   8.150   1.00 22.21  ? 56  SER A OG   1 
ATOM   964  H  H    . SER A 1 56  ? -38.757 1.647   9.916   1.00 22.66  ? 56  SER A H    1 
ATOM   965  H  HA   . SER A 1 56  ? -37.747 3.872   8.835   1.00 23.96  ? 56  SER A HA   1 
ATOM   966  H  HB2  . SER A 1 56  ? -35.886 2.945   7.875   1.00 25.45  ? 56  SER A HB2  1 
ATOM   967  H  HB3  . SER A 1 56  ? -35.820 2.476   9.392   1.00 25.45  ? 56  SER A HB3  1 
ATOM   968  H  HG   . SER A 1 56  ? -35.603 0.776   8.013   1.00 26.66  ? 56  SER A HG   1 
ATOM   969  N  N    . PRO A 1 57  ? -38.477 3.208   6.473   1.00 21.63  ? 57  PRO A N    1 
ATOM   970  C  CA   . PRO A 1 57  ? -39.186 2.793   5.261   1.00 24.14  ? 57  PRO A CA   1 
ATOM   971  C  C    . PRO A 1 57  ? -38.751 1.459   4.734   1.00 24.60  ? 57  PRO A C    1 
ATOM   972  O  O    . PRO A 1 57  ? -39.484 0.877   3.928   1.00 27.98  ? 57  PRO A O    1 
ATOM   973  C  CB   . PRO A 1 57  ? -38.867 3.908   4.257   1.00 26.37  ? 57  PRO A CB   1 
ATOM   974  C  CG   . PRO A 1 57  ? -38.470 5.034   5.060   1.00 26.53  ? 57  PRO A CG   1 
ATOM   975  C  CD   . PRO A 1 57  ? -37.801 4.504   6.289   1.00 22.88  ? 57  PRO A CD   1 
ATOM   976  H  HA   . PRO A 1 57  ? -40.140 2.777   5.434   1.00 28.98  ? 57  PRO A HA   1 
ATOM   977  H  HB2  . PRO A 1 57  ? -38.145 3.628   3.672   1.00 31.66  ? 57  PRO A HB2  1 
ATOM   978  H  HB3  . PRO A 1 57  ? -39.656 4.116   3.734   1.00 31.66  ? 57  PRO A HB3  1 
ATOM   979  H  HG2  . PRO A 1 57  ? -37.855 5.586   4.554   1.00 31.85  ? 57  PRO A HG2  1 
ATOM   980  H  HG3  . PRO A 1 57  ? -39.257 5.548   5.300   1.00 31.85  ? 57  PRO A HG3  1 
ATOM   981  H  HD2  . PRO A 1 57  ? -36.850 4.385   6.146   1.00 27.47  ? 57  PRO A HD2  1 
ATOM   982  H  HD3  . PRO A 1 57  ? -37.952 5.088   7.049   1.00 27.47  ? 57  PRO A HD3  1 
ATOM   983  N  N    . SER A 1 58  ? -37.575 0.965   5.123   1.00 23.93  ? 58  SER A N    1 
ATOM   984  C  CA   A SER A 1 58  ? -37.119 -0.355  4.705   0.55 23.88  ? 58  SER A CA   1 
ATOM   985  C  CA   B SER A 1 58  ? -37.111 -0.351  4.714   0.45 24.39  ? 58  SER A CA   1 
ATOM   986  C  C    . SER A 1 58  ? -37.563 -1.452  5.665   1.00 24.50  ? 58  SER A C    1 
ATOM   987  O  O    . SER A 1 58  ? -37.070 -2.587  5.576   1.00 25.93  ? 58  SER A O    1 
ATOM   988  C  CB   A SER A 1 58  ? -35.604 -0.387  4.440   0.55 26.48  ? 58  SER A CB   1 
ATOM   989  C  CB   B SER A 1 58  ? -35.585 -0.344  4.578   0.45 26.70  ? 58  SER A CB   1 
ATOM   990  O  OG   A SER A 1 58  ? -34.831 0.116   5.502   0.55 28.02  ? 58  SER A OG   1 
ATOM   991  O  OG   B SER A 1 58  ? -35.185 0.506   3.514   0.45 27.77  ? 58  SER A OG   1 
ATOM   992  H  H    . SER A 1 58  ? -37.023 1.382   5.633   1.00 28.72  ? 58  SER A H    1 
ATOM   993  H  HA   . SER A 1 58  ? -37.516 -0.556  3.843   1.00 29.28  ? 58  SER A HA   1 
ATOM   994  H  HB2  A SER A 1 58  ? -35.343 -1.308  4.284   0.55 31.79  ? 58  SER A HB2  1 
ATOM   995  H  HB2  B SER A 1 58  ? -35.195 -0.021  5.405   0.45 32.05  ? 58  SER A HB2  1 
ATOM   996  H  HB3  A SER A 1 58  ? -35.423 0.148   3.652   0.55 31.79  ? 58  SER A HB3  1 
ATOM   997  H  HB3  B SER A 1 58  ? -35.279 -1.246  4.396   0.45 32.05  ? 58  SER A HB3  1 
ATOM   998  H  HG   A SER A 1 58  ? -34.018 0.117   5.290   0.55 33.63  ? 58  SER A HG   1 
ATOM   999  H  HG   B SER A 1 58  ? -34.348 0.506   3.445   0.45 33.34  ? 58  SER A HG   1 
ATOM   1000 N  N    . GLY A 1 59  ? -38.479 -1.144  6.567   1.00 22.40  ? 59  GLY A N    1 
ATOM   1001 C  CA   . GLY A 1 59  ? -39.205 -2.171  7.295   1.00 21.90  ? 59  GLY A CA   1 
ATOM   1002 C  C    . GLY A 1 59  ? -38.835 -2.375  8.740   1.00 21.94  ? 59  GLY A C    1 
ATOM   1003 O  O    . GLY A 1 59  ? -39.453 -3.224  9.398   1.00 24.25  ? 59  GLY A O    1 
ATOM   1004 H  H    . GLY A 1 59  ? -38.700 -0.340  6.779   1.00 26.90  ? 59  GLY A H    1 
ATOM   1005 H  HA2  . GLY A 1 59  ? -40.149 -1.949  7.269   1.00 26.30  ? 59  GLY A HA2  1 
ATOM   1006 H  HA3  . GLY A 1 59  ? -39.067 -3.017  6.841   1.00 26.30  ? 59  GLY A HA3  1 
ATOM   1007 N  N    . LEU A 1 60  ? -37.867 -1.636  9.274   1.00 21.05  ? 60  LEU A N    1 
ATOM   1008 C  CA   . LEU A 1 60  ? -37.605 -1.730  10.700  1.00 22.44  ? 60  LEU A CA   1 
ATOM   1009 C  C    . LEU A 1 60  ? -38.842 -1.265  11.460  1.00 22.19  ? 60  LEU A C    1 
ATOM   1010 O  O    . LEU A 1 60  ? -39.480 -0.273  11.098  1.00 21.82  ? 60  LEU A O    1 
ATOM   1011 C  CB   . LEU A 1 60  ? -36.412 -0.844  11.060  1.00 21.99  ? 60  LEU A CB   1 
ATOM   1012 C  CG   . LEU A 1 60  ? -35.876 -0.943  12.488  1.00 23.01  ? 60  LEU A CG   1 
ATOM   1013 C  CD1  . LEU A 1 60  ? -35.179 -2.283  12.768  1.00 22.98  ? 60  LEU A CD1  1 
ATOM   1014 C  CD2  . LEU A 1 60  ? -34.902 0.182   12.717  1.00 22.87  ? 60  LEU A CD2  1 
ATOM   1015 H  H    . LEU A 1 60  ? -37.363 -1.089  8.842   1.00 25.27  ? 60  LEU A H    1 
ATOM   1016 H  HA   . LEU A 1 60  ? -37.395 -2.643  10.952  1.00 26.95  ? 60  LEU A HA   1 
ATOM   1017 H  HB2  . LEU A 1 60  ? -35.680 -1.074  10.467  1.00 26.40  ? 60  LEU A HB2  1 
ATOM   1018 H  HB3  . LEU A 1 60  ? -36.673 0.080   10.921  1.00 26.40  ? 60  LEU A HB3  1 
ATOM   1019 H  HG   . LEU A 1 60  ? -36.626 -0.884  13.100  1.00 27.63  ? 60  LEU A HG   1 
ATOM   1020 H  HD11 . LEU A 1 60  ? -34.441 -2.391  12.148  1.00 27.59  ? 60  LEU A HD11 1 
ATOM   1021 H  HD12 . LEU A 1 60  ? -34.848 -2.283  13.680  1.00 27.59  ? 60  LEU A HD12 1 
ATOM   1022 H  HD13 . LEU A 1 60  ? -35.819 -3.003  12.649  1.00 27.59  ? 60  LEU A HD13 1 
ATOM   1023 H  HD21 . LEU A 1 60  ? -34.181 0.112   12.071  1.00 27.46  ? 60  LEU A HD21 1 
ATOM   1024 H  HD22 . LEU A 1 60  ? -35.364 1.027   12.606  1.00 27.46  ? 60  LEU A HD22 1 
ATOM   1025 H  HD23 . LEU A 1 60  ? -34.547 0.114   13.617  1.00 27.46  ? 60  LEU A HD23 1 
ATOM   1026 N  N    . ASP A 1 61  ? -39.197 -1.978  12.525  1.00 24.86  ? 61  ASP A N    1 
ATOM   1027 C  CA   . ASP A 1 61  ? -40.318 -1.539  13.366  1.00 27.55  ? 61  ASP A CA   1 
ATOM   1028 C  C    . ASP A 1 61  ? -40.109 -2.163  14.746  1.00 28.58  ? 61  ASP A C    1 
ATOM   1029 O  O    . ASP A 1 61  ? -40.588 -3.264  15.013  1.00 32.59  ? 61  ASP A O    1 
ATOM   1030 C  CB   . ASP A 1 61  ? -41.663 -1.924  12.776  1.00 30.45  ? 61  ASP A CB   1 
ATOM   1031 C  CG   . ASP A 1 61  ? -42.833 -1.114  13.355  1.00 32.79  ? 61  ASP A CG   1 
ATOM   1032 O  OD1  . ASP A 1 61  ? -42.640 -0.305  14.287  0.50 34.18  ? 61  ASP A OD1  1 
ATOM   1033 O  OD2  . ASP A 1 61  ? -43.968 -1.297  12.856  0.45 32.84  ? 61  ASP A OD2  1 
ATOM   1034 H  H    . ASP A 1 61  ? -38.815 -2.705  12.780  1.00 29.84  ? 61  ASP A H    1 
ATOM   1035 H  HA   . ASP A 1 61  ? -40.296 -0.573  13.453  1.00 33.07  ? 61  ASP A HA   1 
ATOM   1036 H  HB2  . ASP A 1 61  ? -41.640 -1.772  11.818  1.00 36.55  ? 61  ASP A HB2  1 
ATOM   1037 H  HB3  . ASP A 1 61  ? -41.830 -2.861  12.959  1.00 36.55  ? 61  ASP A HB3  1 
ATOM   1038 N  N    . VAL A 1 62  ? -39.387 -1.447  15.602  1.00 26.13  ? 62  VAL A N    1 
ATOM   1039 C  CA   . VAL A 1 62  ? -39.073 -1.930  16.933  1.00 27.31  ? 62  VAL A CA   1 
ATOM   1040 C  C    . VAL A 1 62  ? -39.363 -0.853  17.962  1.00 26.93  ? 62  VAL A C    1 
ATOM   1041 O  O    . VAL A 1 62  ? -39.476 0.332   17.656  1.00 29.10  ? 62  VAL A O    1 
ATOM   1042 C  CB   . VAL A 1 62  ? -37.625 -2.432  17.040  1.00 28.14  ? 62  VAL A CB   1 
ATOM   1043 C  CG1  . VAL A 1 62  ? -37.358 -3.506  15.990  1.00 29.01  ? 62  VAL A CG1  1 
ATOM   1044 C  CG2  . VAL A 1 62  ? -36.652 -1.302  16.851  1.00 25.75  ? 62  VAL A CG2  1 
ATOM   1045 H  H    . VAL A 1 62  ? -39.066 -0.669  15.428  1.00 31.37  ? 62  VAL A H    1 
ATOM   1046 H  HA   . VAL A 1 62  ? -39.664 -2.670  17.141  1.00 32.78  ? 62  VAL A HA   1 
ATOM   1047 H  HB   . VAL A 1 62  ? -37.498 -2.809  17.924  1.00 33.78  ? 62  VAL A HB   1 
ATOM   1048 H  HG11 . VAL A 1 62  ? -38.206 -3.839  15.656  1.00 34.83  ? 62  VAL A HG11 1 
ATOM   1049 H  HG12 . VAL A 1 62  ? -36.847 -3.118  15.263  1.00 34.83  ? 62  VAL A HG12 1 
ATOM   1050 H  HG13 . VAL A 1 62  ? -36.857 -4.229  16.399  1.00 34.83  ? 62  VAL A HG13 1 
ATOM   1051 H  HG21 . VAL A 1 62  ? -36.767 -0.663  17.571  1.00 30.91  ? 62  VAL A HG21 1 
ATOM   1052 H  HG22 . VAL A 1 62  ? -35.750 -1.657  16.865  1.00 30.91  ? 62  VAL A HG22 1 
ATOM   1053 H  HG23 . VAL A 1 62  ? -36.826 -0.875  15.998  1.00 30.91  ? 62  VAL A HG23 1 
ATOM   1054 N  N    . GLU A 1 63  ? -39.553 -1.301  19.189  1.00 23.98  ? 63  GLU A N    1 
ATOM   1055 C  CA   . GLU A 1 63  ? -39.654 -0.436  20.345  1.00 24.75  ? 63  GLU A CA   1 
ATOM   1056 C  C    . GLU A 1 63  ? -38.499 -0.798  21.251  1.00 23.69  ? 63  GLU A C    1 
ATOM   1057 O  O    . GLU A 1 63  ? -38.271 -1.979  21.506  1.00 26.69  ? 63  GLU A O    1 
ATOM   1058 C  CB   . GLU A 1 63  ? -40.983 -0.651  21.067  1.00 29.96  ? 63  GLU A CB   1 
ATOM   1059 C  CG   . GLU A 1 63  ? -42.191 -0.243  20.238  1.00 36.71  ? 63  GLU A CG   1 
ATOM   1060 C  CD   . GLU A 1 63  ? -42.107 1.198   19.756  0.01 41.45  ? 63  GLU A CD   1 
ATOM   1061 O  OE1  . GLU A 1 63  ? -41.918 2.095   20.602  0.70 41.23  ? 63  GLU A OE1  1 
ATOM   1062 O  OE2  . GLU A 1 63  ? -42.233 1.438   18.538  1.00 46.27  ? 63  GLU A OE2  1 
ATOM   1063 H  H    . GLU A 1 63  ? -39.629 -2.135  19.383  1.00 28.79  ? 63  GLU A H    1 
ATOM   1064 H  HA   . GLU A 1 63  ? -39.604 0.500   20.097  1.00 29.71  ? 63  GLU A HA   1 
ATOM   1065 H  HB2  . GLU A 1 63  ? -41.074 -1.592  21.283  1.00 35.97  ? 63  GLU A HB2  1 
ATOM   1066 H  HB3  . GLU A 1 63  ? -40.987 -0.121  21.880  1.00 35.97  ? 63  GLU A HB3  1 
ATOM   1067 H  HG2  . GLU A 1 63  ? -42.250 -0.819  19.459  1.00 44.07  ? 63  GLU A HG2  1 
ATOM   1068 H  HG3  . GLU A 1 63  ? -42.991 -0.334  20.779  1.00 44.07  ? 63  GLU A HG3  1 
ATOM   1069 N  N    . ARG A 1 64  ? -37.757 0.205   21.705  1.00 21.71  ? 64  ARG A N    1 
ATOM   1070 C  CA   . ARG A 1 64  ? -36.594 0.010   22.552  1.00 23.21  ? 64  ARG A CA   1 
ATOM   1071 C  C    . ARG A 1 64  ? -36.446 1.289   23.347  1.00 21.75  ? 64  ARG A C    1 
ATOM   1072 O  O    . ARG A 1 64  ? -36.558 2.372   22.782  1.00 22.86  ? 64  ARG A O    1 
ATOM   1073 C  CB   . ARG A 1 64  ? -35.321 -0.217  21.712  1.00 26.96  ? 64  ARG A CB   1 
ATOM   1074 C  CG   . ARG A 1 64  ? -34.046 -0.209  22.528  1.00 28.06  ? 64  ARG A CG   1 
ATOM   1075 C  CD   . ARG A 1 64  ? -32.840 -0.650  21.744  1.00 26.88  ? 64  ARG A CD   1 
ATOM   1076 N  NE   . ARG A 1 64  ? -33.002 -1.915  21.053  1.00 26.64  ? 64  ARG A NE   1 
ATOM   1077 C  CZ   . ARG A 1 64  ? -32.789 -3.126  21.573  1.00 22.19  ? 64  ARG A CZ   1 
ATOM   1078 N  NH1  . ARG A 1 64  ? -32.523 -3.322  22.866  1.00 20.94  ? 64  ARG A NH1  1 
ATOM   1079 N  NH2  . ARG A 1 64  ? -32.857 -4.173  20.780  1.00 22.33  ? 64  ARG A NH2  1 
ATOM   1080 H  H    . ARG A 1 64  ? -37.914 1.032   21.529  1.00 26.07  ? 64  ARG A H    1 
ATOM   1081 H  HA   . ARG A 1 64  ? -36.707 -0.754  23.137  1.00 27.86  ? 64  ARG A HA   1 
ATOM   1082 H  HB2  . ARG A 1 64  ? -35.387 -1.079  21.272  1.00 32.37  ? 64  ARG A HB2  1 
ATOM   1083 H  HB3  . ARG A 1 64  ? -35.254 0.489   21.049  1.00 32.37  ? 64  ARG A HB3  1 
ATOM   1084 H  HG2  . ARG A 1 64  ? -33.881 0.693   22.846  1.00 33.69  ? 64  ARG A HG2  1 
ATOM   1085 H  HG3  . ARG A 1 64  ? -34.149 -0.812  23.281  1.00 33.69  ? 64  ARG A HG3  1 
ATOM   1086 H  HD2  . ARG A 1 64  ? -32.641 0.024   21.076  1.00 32.27  ? 64  ARG A HD2  1 
ATOM   1087 H  HD3  . ARG A 1 64  ? -32.091 -0.744  22.354  1.00 32.27  ? 64  ARG A HD3  1 
ATOM   1088 H  HE   . ARG A 1 64  ? -33.258 -1.881  20.233  1.00 31.98  ? 64  ARG A HE   1 
ATOM   1089 H  HH11 . ARG A 1 64  ? -32.483 -2.651  23.403  1.00 25.14  ? 64  ARG A HH11 1 
ATOM   1090 H  HH12 . ARG A 1 64  ? -32.392 -4.118  23.162  1.00 25.14  ? 64  ARG A HH12 1 
ATOM   1091 H  HH21 . ARG A 1 64  ? -33.035 -4.070  19.945  1.00 26.81  ? 64  ARG A HH21 1 
ATOM   1092 H  HH22 . ARG A 1 64  ? -32.723 -4.962  21.096  1.00 26.81  ? 64  ARG A HH22 1 
ATOM   1093 N  N    . ASP A 1 65  ? -36.156 1.187   24.624  1.00 21.67  ? 65  ASP A N    1 
ATOM   1094 C  CA   . ASP A 1 65  ? -36.040 2.408   25.402  1.00 22.98  ? 65  ASP A CA   1 
ATOM   1095 C  C    . ASP A 1 65  ? -34.852 3.227   24.898  1.00 22.07  ? 65  ASP A C    1 
ATOM   1096 O  O    . ASP A 1 65  ? -33.726 2.712   24.833  1.00 22.05  ? 65  ASP A O    1 
ATOM   1097 C  CB   . ASP A 1 65  ? -35.872 2.142   26.888  1.00 26.48  ? 65  ASP A CB   1 
ATOM   1098 C  CG   . ASP A 1 65  ? -35.830 3.433   27.677  1.00 29.71  ? 65  ASP A CG   1 
ATOM   1099 O  OD1  . ASP A 1 65  ? -36.915 3.996   27.953  1.00 33.23  ? 65  ASP A OD1  1 
ATOM   1100 O  OD2  . ASP A 1 65  ? -34.742 3.915   28.001  1.00 30.67  ? 65  ASP A OD2  1 
ATOM   1101 H  H    . ASP A 1 65  ? -36.025 0.454   25.053  1.00 26.01  ? 65  ASP A H    1 
ATOM   1102 H  HA   . ASP A 1 65  ? -36.863 2.909   25.292  1.00 27.59  ? 65  ASP A HA   1 
ATOM   1103 H  HB2  . ASP A 1 65  ? -36.620 1.613   27.207  1.00 31.78  ? 65  ASP A HB2  1 
ATOM   1104 H  HB3  . ASP A 1 65  ? -35.041 1.665   27.038  1.00 31.78  ? 65  ASP A HB3  1 
ATOM   1105 N  N    . PRO A 1 66  ? -35.048 4.506   24.575  1.00 20.81  ? 66  PRO A N    1 
ATOM   1106 C  CA   . PRO A 1 66  ? -33.941 5.272   23.985  1.00 21.51  ? 66  PRO A CA   1 
ATOM   1107 C  C    . PRO A 1 66  ? -32.805 5.544   24.953  1.00 22.90  ? 66  PRO A C    1 
ATOM   1108 O  O    . PRO A 1 66  ? -31.642 5.564   24.540  1.00 21.99  ? 66  PRO A O    1 
ATOM   1109 C  CB   . PRO A 1 66  ? -34.616 6.571   23.514  1.00 22.96  ? 66  PRO A CB   1 
ATOM   1110 C  CG   . PRO A 1 66  ? -35.869 6.663   24.335  1.00 23.88  ? 66  PRO A CG   1 
ATOM   1111 C  CD   . PRO A 1 66  ? -36.323 5.242   24.528  1.00 23.76  ? 66  PRO A CD   1 
ATOM   1112 H  HA   . PRO A 1 66  ? -33.593 4.793   23.217  1.00 25.83  ? 66  PRO A HA   1 
ATOM   1113 H  HB2  . PRO A 1 66  ? -34.033 7.328   23.682  1.00 27.56  ? 66  PRO A HB2  1 
ATOM   1114 H  HB3  . PRO A 1 66  ? -34.822 6.513   22.568  1.00 27.56  ? 66  PRO A HB3  1 
ATOM   1115 H  HG2  . PRO A 1 66  ? -35.674 7.082   25.188  1.00 28.66  ? 66  PRO A HG2  1 
ATOM   1116 H  HG3  . PRO A 1 66  ? -36.539 7.177   23.858  1.00 28.66  ? 66  PRO A HG3  1 
ATOM   1117 H  HD2  . PRO A 1 66  ? -36.814 5.142   25.359  1.00 28.52  ? 66  PRO A HD2  1 
ATOM   1118 H  HD3  . PRO A 1 66  ? -36.869 4.946   23.783  1.00 28.52  ? 66  PRO A HD3  1 
ATOM   1119 N  N    . ILE A 1 67  ? -33.102 5.810   26.227  1.00 23.70  ? 67  ILE A N    1 
ATOM   1120 C  CA   . ILE A 1 67  ? -32.032 6.147   27.167  1.00 24.16  ? 67  ILE A CA   1 
ATOM   1121 C  C    . ILE A 1 67  ? -31.183 4.919   27.476  1.00 23.83  ? 67  ILE A C    1 
ATOM   1122 O  O    . ILE A 1 67  ? -29.947 4.992   27.519  1.00 24.36  ? 67  ILE A O    1 
ATOM   1123 C  CB   . ILE A 1 67  ? -32.595 6.811   28.441  1.00 26.29  ? 67  ILE A CB   1 
ATOM   1124 C  CG1  . ILE A 1 67  ? -33.228 8.161   28.086  1.00 28.82  ? 67  ILE A CG1  1 
ATOM   1125 C  CG2  . ILE A 1 67  ? -31.513 6.961   29.469  1.00 28.08  ? 67  ILE A CG2  1 
ATOM   1126 C  CD1  . ILE A 1 67  ? -32.253 9.300   27.980  0.25 28.92  ? 67  ILE A CD1  1 
ATOM   1127 H  H    . ILE A 1 67  ? -33.894 5.802   26.564  1.00 28.45  ? 67  ILE A H    1 
ATOM   1128 H  HA   . ILE A 1 67  ? -31.456 6.802   26.744  1.00 29.00  ? 67  ILE A HA   1 
ATOM   1129 H  HB   . ILE A 1 67  ? -33.286 6.246   28.820  1.00 31.56  ? 67  ILE A HB   1 
ATOM   1130 H  HG12 . ILE A 1 67  ? -33.673 8.076   27.228  1.00 34.60  ? 67  ILE A HG12 1 
ATOM   1131 H  HG13 . ILE A 1 67  ? -33.873 8.390   28.773  1.00 34.60  ? 67  ILE A HG13 1 
ATOM   1132 H  HG21 . ILE A 1 67  ? -31.877 7.409   30.249  1.00 33.71  ? 67  ILE A HG21 1 
ATOM   1133 H  HG22 . ILE A 1 67  ? -31.187 6.081   29.716  1.00 33.71  ? 67  ILE A HG22 1 
ATOM   1134 H  HG23 . ILE A 1 67  ? -30.790 7.488   29.093  1.00 33.71  ? 67  ILE A HG23 1 
ATOM   1135 H  HD11 . ILE A 1 67  ? -32.736 10.109  27.750  0.32 34.72  ? 67  ILE A HD11 1 
ATOM   1136 H  HD12 . ILE A 1 67  ? -31.807 9.413   28.834  0.60 34.72  ? 67  ILE A HD12 1 
ATOM   1137 H  HD13 . ILE A 1 67  ? -31.602 9.096   27.291  0.75 34.72  ? 67  ILE A HD13 1 
ATOM   1138 N  N    . GLU A 1 68  ? -31.819 3.765   27.668  1.00 25.67  ? 68  GLU A N    1 
ATOM   1139 C  CA   . GLU A 1 68  ? -31.042 2.551   27.921  1.00 26.57  ? 68  GLU A CA   1 
ATOM   1140 C  C    . GLU A 1 68  ? -30.151 2.214   26.718  1.00 23.62  ? 68  GLU A C    1 
ATOM   1141 O  O    . GLU A 1 68  ? -28.993 1.790   26.879  1.00 23.21  ? 68  GLU A O    1 
ATOM   1142 C  CB   . GLU A 1 68  ? -31.996 1.396   28.256  1.00 32.40  ? 68  GLU A CB   1 
ATOM   1143 C  CG   . GLU A 1 68  ? -32.560 1.461   29.674  1.00 38.61  ? 68  GLU A CG   1 
ATOM   1144 C  CD   . GLU A 1 68  ? -33.634 0.419   29.934  0.22 45.13  ? 68  GLU A CD   1 
ATOM   1145 O  OE1  . GLU A 1 68  ? -33.715 -0.588  29.197  1.00 46.77  ? 68  GLU A OE1  1 
ATOM   1146 O  OE2  . GLU A 1 68  ? -34.422 0.623   30.877  1.00 49.64  ? 68  GLU A OE2  1 
ATOM   1147 H  H    . GLU A 1 68  ? -32.672 3.659   27.657  1.00 30.82  ? 68  GLU A H    1 
ATOM   1148 H  HA   . GLU A 1 68  ? -30.460 2.684   28.686  1.00 31.90  ? 68  GLU A HA   1 
ATOM   1149 H  HB2  . GLU A 1 68  ? -32.744 1.419   27.638  1.00 38.89  ? 68  GLU A HB2  1 
ATOM   1150 H  HB3  . GLU A 1 68  ? -31.516 0.557   28.166  1.00 38.89  ? 68  GLU A HB3  1 
ATOM   1151 H  HG2  . GLU A 1 68  ? -31.840 1.313   30.307  1.00 46.35  ? 68  GLU A HG2  1 
ATOM   1152 H  HG3  . GLU A 1 68  ? -32.952 2.337   29.817  1.00 46.35  ? 68  GLU A HG3  1 
ATOM   1153 N  N    . TYR A 1 69  ? -30.664 2.399   25.500  1.00 21.16  ? 69  TYR A N    1 
ATOM   1154 C  CA   . TYR A 1 69  ? -29.836 2.172   24.315  1.00 19.73  ? 69  TYR A CA   1 
ATOM   1155 C  C    . TYR A 1 69  ? -28.670 3.147   24.264  1.00 20.64  ? 69  TYR A C    1 
ATOM   1156 O  O    . TYR A 1 69  ? -27.523 2.753   24.038  1.00 20.06  ? 69  TYR A O    1 
ATOM   1157 C  CB   . TYR A 1 69  ? -30.694 2.342   23.086  1.00 19.41  ? 69  TYR A CB   1 
ATOM   1158 C  CG   . TYR A 1 69  ? -30.025 2.149   21.750  1.00 18.62  ? 69  TYR A CG   1 
ATOM   1159 C  CD1  . TYR A 1 69  ? -29.821 0.877   21.237  1.00 18.34  ? 69  TYR A CD1  1 
ATOM   1160 C  CD2  . TYR A 1 69  ? -29.651 3.235   20.967  1.00 18.62  ? 69  TYR A CD2  1 
ATOM   1161 C  CE1  . TYR A 1 69  ? -29.269 0.692   19.974  1.00 18.07  ? 69  TYR A CE1  1 
ATOM   1162 C  CE2  . TYR A 1 69  ? -29.120 3.053   19.687  1.00 18.73  ? 69  TYR A CE2  1 
ATOM   1163 C  CZ   . TYR A 1 69  ? -28.913 1.767   19.212  1.00 17.61  ? 69  TYR A CZ   1 
ATOM   1164 O  OH   . TYR A 1 69  ? -28.387 1.541   17.957  1.00 18.94  ? 69  TYR A OH   1 
ATOM   1165 H  H    . TYR A 1 69  ? -31.470 2.650   25.336  1.00 25.40  ? 69  TYR A H    1 
ATOM   1166 H  HA   . TYR A 1 69  ? -29.478 1.271   24.343  1.00 23.69  ? 69  TYR A HA   1 
ATOM   1167 H  HB2  . TYR A 1 69  ? -31.417 1.697   23.135  1.00 23.30  ? 69  TYR A HB2  1 
ATOM   1168 H  HB3  . TYR A 1 69  ? -31.053 3.243   23.094  1.00 23.30  ? 69  TYR A HB3  1 
ATOM   1169 H  HD1  . TYR A 1 69  ? -30.057 0.135   21.746  1.00 22.02  ? 69  TYR A HD1  1 
ATOM   1170 H  HD2  . TYR A 1 69  ? -29.756 4.096   21.300  1.00 22.36  ? 69  TYR A HD2  1 
ATOM   1171 H  HE1  . TYR A 1 69  ? -29.141 -0.169  19.647  1.00 21.70  ? 69  TYR A HE1  1 
ATOM   1172 H  HE2  . TYR A 1 69  ? -28.907 3.788   19.159  1.00 22.49  ? 69  TYR A HE2  1 
ATOM   1173 H  HH   . TYR A 1 69  ? -28.252 2.273   17.566  1.00 22.74  ? 69  TYR A HH   1 
ATOM   1174 N  N    . ALA A 1 70  ? -28.947 4.428   24.486  1.00 20.18  ? 70  ALA A N    1 
ATOM   1175 C  CA   . ALA A 1 70  ? -27.898 5.436   24.412  1.00 20.32  ? 70  ALA A CA   1 
ATOM   1176 C  C    . ALA A 1 70  ? -26.829 5.227   25.478  1.00 20.74  ? 70  ALA A C    1 
ATOM   1177 O  O    . ALA A 1 70  ? -25.635 5.370   25.191  1.00 20.48  ? 70  ALA A O    1 
ATOM   1178 C  CB   . ALA A 1 70  ? -28.519 6.821   24.547  1.00 21.63  ? 70  ALA A CB   1 
ATOM   1179 H  H    . ALA A 1 70  ? -29.726 4.737   24.680  1.00 24.23  ? 70  ALA A H    1 
ATOM   1180 H  HA   . ALA A 1 70  ? -27.463 5.369   23.548  1.00 24.40  ? 70  ALA A HA   1 
ATOM   1181 H  HB1  . ALA A 1 70  ? -27.815 7.488   24.504  1.00 25.96  ? 70  ALA A HB1  1 
ATOM   1182 H  HB2  . ALA A 1 70  ? -29.148 6.957   23.822  1.00 25.96  ? 70  ALA A HB2  1 
ATOM   1183 H  HB3  . ALA A 1 70  ? -28.978 6.880   25.399  1.00 25.96  ? 70  ALA A HB3  1 
ATOM   1184 N  N    . LYS A 1 71  ? -27.231 4.896   26.717  1.00 21.84  ? 71  LYS A N    1 
ATOM   1185 C  CA   . LYS A 1 71  ? -26.238 4.698   27.775  1.00 23.04  ? 71  LYS A CA   1 
ATOM   1186 C  C    . LYS A 1 71  ? -25.362 3.486   27.503  1.00 23.16  ? 71  LYS A C    1 
ATOM   1187 O  O    . LYS A 1 71  ? -24.172 3.499   27.850  1.00 24.94  ? 71  LYS A O    1 
ATOM   1188 C  CB   . LYS A 1 71  ? -26.910 4.544   29.143  1.00 26.15  ? 71  LYS A CB   1 
ATOM   1189 C  CG   . LYS A 1 71  ? -27.668 5.742   29.637  1.00 29.03  ? 71  LYS A CG   1 
ATOM   1190 C  CD   . LYS A 1 71  ? -26.816 7.001   29.757  1.00 31.28  ? 71  LYS A CD   1 
ATOM   1191 C  CE   . LYS A 1 71  ? -25.775 6.913   30.845  1.00 31.90  ? 71  LYS A CE   1 
ATOM   1192 N  NZ   . LYS A 1 71  ? -24.898 8.142   30.848  1.00 33.49  ? 71  LYS A NZ   1 
ATOM   1193 H  H    . LYS A 1 71  ? -28.048 4.784   26.959  1.00 26.22  ? 71  LYS A H    1 
ATOM   1194 H  HA   . LYS A 1 71  ? -25.679 5.490   27.806  1.00 27.66  ? 71  LYS A HA   1 
ATOM   1195 H  HB2  . LYS A 1 71  ? -27.539 3.807   29.092  1.00 31.39  ? 71  LYS A HB2  1 
ATOM   1196 H  HB3  . LYS A 1 71  ? -26.223 4.348   29.799  1.00 31.39  ? 71  LYS A HB3  1 
ATOM   1197 H  HG2  . LYS A 1 71  ? -28.390 5.931   29.019  1.00 34.84  ? 71  LYS A HG2  1 
ATOM   1198 H  HG3  . LYS A 1 71  ? -28.027 5.544   30.516  1.00 34.84  ? 71  LYS A HG3  1 
ATOM   1199 H  HD2  . LYS A 1 71  ? -26.356 7.150   28.916  1.00 37.54  ? 71  LYS A HD2  1 
ATOM   1200 H  HD3  . LYS A 1 71  ? -27.394 7.754   29.957  1.00 37.54  ? 71  LYS A HD3  1 
ATOM   1201 H  HE2  . LYS A 1 71  ? -26.213 6.846   31.707  1.00 38.29  ? 71  LYS A HE2  1 
ATOM   1202 H  HE3  . LYS A 1 71  ? -25.215 6.136   30.695  1.00 38.29  ? 71  LYS A HE3  1 
ATOM   1203 H  HZ1  . LYS A 1 71  ? -25.392 8.868   30.993  1.00 40.20  ? 71  LYS A HZ1  1 
ATOM   1204 H  HZ2  . LYS A 1 71  ? -24.285 8.077   31.490  1.00 40.20  ? 71  LYS A HZ2  1 
ATOM   1205 H  HZ3  . LYS A 1 71  ? -24.487 8.224   30.063  1.00 40.20  ? 71  LYS A HZ3  1 
ATOM   1206 N  N    . PHE A 1 72  ? -25.926 2.435   26.897  1.00 22.09  ? 72  PHE A N    1 
ATOM   1207 C  CA   . PHE A 1 72  ? -25.125 1.287   26.489  1.00 20.96  ? 72  PHE A CA   1 
ATOM   1208 C  C    . PHE A 1 72  ? -24.105 1.670   25.408  1.00 20.43  ? 72  PHE A C    1 
ATOM   1209 O  O    . PHE A 1 72  ? -22.909 1.381   25.545  1.00 22.42  ? 72  PHE A O    1 
ATOM   1210 C  CB   . PHE A 1 72  ? -26.042 0.146   26.012  1.00 22.00  ? 72  PHE A CB   1 
ATOM   1211 C  CG   . PHE A 1 72  ? -25.294 -0.988  25.372  1.00 21.55  ? 72  PHE A CG   1 
ATOM   1212 C  CD1  . PHE A 1 72  ? -24.698 -1.940  26.163  1.00 22.74  ? 72  PHE A CD1  1 
ATOM   1213 C  CD2  . PHE A 1 72  ? -25.112 -1.052  24.007  1.00 21.72  ? 72  PHE A CD2  1 
ATOM   1214 C  CE1  . PHE A 1 72  ? -23.957 -2.961  25.610  1.00 23.69  ? 72  PHE A CE1  1 
ATOM   1215 C  CE2  . PHE A 1 72  ? -24.381 -2.078  23.452  1.00 21.77  ? 72  PHE A CE2  1 
ATOM   1216 C  CZ   . PHE A 1 72  ? -23.801 -3.017  24.245  1.00 23.96  ? 72  PHE A CZ   1 
ATOM   1217 H  H    . PHE A 1 72  ? -26.763 2.366   26.713  1.00 26.52  ? 72  PHE A H    1 
ATOM   1218 H  HA   . PHE A 1 72  ? -24.628 0.965   27.257  1.00 25.16  ? 72  PHE A HA   1 
ATOM   1219 H  HB2  . PHE A 1 72  ? -26.525 -0.208  26.775  1.00 26.41  ? 72  PHE A HB2  1 
ATOM   1220 H  HB3  . PHE A 1 72  ? -26.666 0.498   25.358  1.00 26.41  ? 72  PHE A HB3  1 
ATOM   1221 H  HD1  . PHE A 1 72  ? -24.795 -1.895  27.087  1.00 27.30  ? 72  PHE A HD1  1 
ATOM   1222 H  HD2  . PHE A 1 72  ? -25.485 -0.400  23.459  1.00 26.07  ? 72  PHE A HD2  1 
ATOM   1223 H  HE1  . PHE A 1 72  ? -23.567 -3.607  26.153  1.00 28.44  ? 72  PHE A HE1  1 
ATOM   1224 H  HE2  . PHE A 1 72  ? -24.284 -2.129  22.528  1.00 26.13  ? 72  PHE A HE2  1 
ATOM   1225 H  HZ   . PHE A 1 72  ? -23.296 -3.698  23.864  1.00 28.77  ? 72  PHE A HZ   1 
ATOM   1226 N  N    . MET A 1 73  ? -24.563 2.290   24.309  1.00 20.85  ? 73  MET A N    1 
ATOM   1227 C  CA   . MET A 1 73  ? -23.680 2.816   23.244  1.00 19.82  ? 73  MET A CA   1 
ATOM   1228 C  C    . MET A 1 73  ? -22.647 3.785   23.688  1.00 20.26  ? 73  MET A C    1 
ATOM   1229 O  O    . MET A 1 73  ? -21.577 3.829   23.089  1.00 20.97  ? 73  MET A O    1 
ATOM   1230 C  CB   . MET A 1 73  ? -24.622 3.400   22.180  1.00 18.90  ? 73  MET A CB   1 
ATOM   1231 C  CG   . MET A 1 73  ? -25.466 2.430   21.360  1.00 19.08  ? 73  MET A CG   1 
ATOM   1232 S  SD   . MET A 1 73  ? -24.472 0.994   20.762  1.00 19.52  ? 73  MET A SD   1 
ATOM   1233 C  CE   . MET A 1 73  ? -25.741 -0.052  20.081  1.00 19.81  ? 73  MET A CE   1 
ATOM   1234 H  H    . MET A 1 73  ? -25.397 2.423   24.147  1.00 25.03  ? 73  MET A H    1 
ATOM   1235 H  HA   . MET A 1 73  ? -23.148 2.096   22.872  1.00 23.79  ? 73  MET A HA   1 
ATOM   1236 H  HB2  . MET A 1 73  ? -25.243 3.995   22.630  1.00 22.70  ? 73  MET A HB2  1 
ATOM   1237 H  HB3  . MET A 1 73  ? -24.081 3.899   21.549  1.00 22.70  ? 73  MET A HB3  1 
ATOM   1238 H  HG2  . MET A 1 73  ? -26.189 2.090   21.910  1.00 22.91  ? 73  MET A HG2  1 
ATOM   1239 H  HG3  . MET A 1 73  ? -25.826 2.893   20.587  1.00 22.91  ? 73  MET A HG3  1 
ATOM   1240 H  HE1  . MET A 1 73  ? -25.336 -0.874  19.764  1.00 23.78  ? 73  MET A HE1  1 
ATOM   1241 H  HE2  . MET A 1 73  ? -26.392 -0.249  20.773  1.00 23.78  ? 73  MET A HE2  1 
ATOM   1242 H  HE3  . MET A 1 73  ? -26.170 0.411   19.345  1.00 23.78  ? 73  MET A HE3  1 
ATOM   1243 N  N    . GLU A 1 74  ? -22.912 4.544   24.758  1.00 21.18  ? 74  GLU A N    1 
ATOM   1244 C  CA   . GLU A 1 74  ? -21.966 5.570   25.176  1.00 21.53  ? 74  GLU A CA   1 
ATOM   1245 C  C    . GLU A 1 74  ? -20.589 4.988   25.451  1.00 22.03  ? 74  GLU A C    1 
ATOM   1246 O  O    . GLU A 1 74  ? -19.585 5.675   25.259  1.00 22.62  ? 74  GLU A O    1 
ATOM   1247 C  CB   . GLU A 1 74  ? -22.515 6.277   26.424  1.00 24.61  ? 74  GLU A CB   1 
ATOM   1248 C  CG   . GLU A 1 74  ? -21.717 7.461   26.893  1.00 29.14  ? 74  GLU A CG   1 
ATOM   1249 C  CD   . GLU A 1 74  ? -22.342 8.152   28.079  1.00 31.61  ? 74  GLU A CD   1 
ATOM   1250 O  OE1  . GLU A 1 74  ? -22.989 7.484   28.913  1.00 32.41  ? 74  GLU A OE1  1 
ATOM   1251 O  OE2  . GLU A 1 74  ? -22.185 9.380   28.175  1.00 32.88  ? 74  GLU A OE2  1 
ATOM   1252 H  H    . GLU A 1 74  ? -23.618 4.483   25.245  1.00 25.43  ? 74  GLU A H    1 
ATOM   1253 H  HA   . GLU A 1 74  ? -21.866 6.225   24.469  1.00 25.85  ? 74  GLU A HA   1 
ATOM   1254 H  HB2  . GLU A 1 74  ? -23.412 6.591   26.228  1.00 29.54  ? 74  GLU A HB2  1 
ATOM   1255 H  HB3  . GLU A 1 74  ? -22.540 5.637   27.153  1.00 29.54  ? 74  GLU A HB3  1 
ATOM   1256 H  HG2  . GLU A 1 74  ? -20.831 7.162   27.152  1.00 34.99  ? 74  GLU A HG2  1 
ATOM   1257 H  HG3  . GLU A 1 74  ? -21.652 8.104   26.170  1.00 34.99  ? 74  GLU A HG3  1 
ATOM   1258 N  N    . ARG A 1 75  ? -20.518 3.745   25.910  1.00 23.25  ? 75  ARG A N    1 
ATOM   1259 C  CA   . ARG A 1 75  ? -19.241 3.126   26.226  1.00 26.72  ? 75  ARG A CA   1 
ATOM   1260 C  C    . ARG A 1 75  ? -18.423 2.762   24.996  1.00 25.66  ? 75  ARG A C    1 
ATOM   1261 O  O    . ARG A 1 75  ? -17.204 2.595   25.111  1.00 26.84  ? 75  ARG A O    1 
ATOM   1262 C  CB   . ARG A 1 75  ? -19.515 1.820   26.979  1.00 32.38  ? 75  ARG A CB   1 
ATOM   1263 C  CG   . ARG A 1 75  ? -18.859 1.641   28.312  1.00 42.28  ? 75  ARG A CG   1 
ATOM   1264 C  CD   . ARG A 1 75  ? -19.338 0.311   28.897  1.00 48.94  ? 75  ARG A CD   1 
ATOM   1265 N  NE   . ARG A 1 75  ? -20.569 0.487   29.663  1.00 54.34  ? 75  ARG A NE   1 
ATOM   1266 C  CZ   . ARG A 1 75  ? -21.790 0.205   29.219  1.00 57.87  ? 75  ARG A CZ   1 
ATOM   1267 N  NH1  . ARG A 1 75  ? -22.000 -0.224  27.985  1.00 57.82  ? 75  ARG A NH1  1 
ATOM   1268 N  NH2  . ARG A 1 75  ? -22.830 0.357   30.037  1.00 59.31  ? 75  ARG A NH2  1 
ATOM   1269 H  H    . ARG A 1 75  ? -21.198 3.237   26.048  1.00 27.91  ? 75  ARG A H    1 
ATOM   1270 H  HA   . ARG A 1 75  ? -18.728 3.751   26.762  1.00 32.08  ? 75  ARG A HA   1 
ATOM   1271 H  HB2  . ARG A 1 75  ? -20.471 1.757   27.127  1.00 38.87  ? 75  ARG A HB2  1 
ATOM   1272 H  HB3  . ARG A 1 75  ? -19.216 1.086   26.420  1.00 38.87  ? 75  ARG A HB3  1 
ATOM   1273 H  HG2  . ARG A 1 75  ? -17.895 1.618   28.211  1.00 50.75  ? 75  ARG A HG2  1 
ATOM   1274 H  HG3  . ARG A 1 75  ? -19.113 2.363   28.909  1.00 50.75  ? 75  ARG A HG3  1 
ATOM   1275 H  HD2  . ARG A 1 75  ? -19.511 -0.314  28.177  1.00 58.75  ? 75  ARG A HD2  1 
ATOM   1276 H  HD3  . ARG A 1 75  ? -18.657 -0.045  29.489  1.00 58.75  ? 75  ARG A HD3  1 
ATOM   1277 H  HE   . ARG A 1 75  ? -20.498 0.797   30.462  1.00 65.22  ? 75  ARG A HE   1 
ATOM   1278 H  HH11 . ARG A 1 75  ? -21.337 -0.327  27.447  1.00 69.39  ? 75  ARG A HH11 1 
ATOM   1279 H  HH12 . ARG A 1 75  ? -22.799 -0.400  27.721  1.00 69.39  ? 75  ARG A HH12 1 
ATOM   1280 H  HH21 . ARG A 1 75  ? -22.708 0.635   30.842  1.00 71.19  ? 75  ARG A HH21 1 
ATOM   1281 H  HH22 . ARG A 1 75  ? -23.625 0.177   29.760  1.00 71.19  ? 75  ARG A HH22 1 
ATOM   1282 N  N    . TYR A 1 76  ? -19.059 2.622   23.838  1.00 22.43  ? 76  TYR A N    1 
ATOM   1283 C  CA   . TYR A 1 76  ? -18.458 1.996   22.673  1.00 20.62  ? 76  TYR A CA   1 
ATOM   1284 C  C    . TYR A 1 76  ? -18.451 2.874   21.433  1.00 19.72  ? 76  TYR A C    1 
ATOM   1285 O  O    . TYR A 1 76  ? -17.508 2.793   20.658  1.00 22.35  ? 76  TYR A O    1 
ATOM   1286 C  CB   . TYR A 1 76  ? -19.234 0.711   22.346  1.00 21.98  ? 76  TYR A CB   1 
ATOM   1287 C  CG   . TYR A 1 76  ? -19.172 -0.297  23.471  1.00 24.01  ? 76  TYR A CG   1 
ATOM   1288 C  CD1  . TYR A 1 76  ? -17.975 -0.906  23.825  1.00 27.56  ? 76  TYR A CD1  1 
ATOM   1289 C  CD2  . TYR A 1 76  ? -20.298 -0.596  24.213  1.00 25.27  ? 76  TYR A CD2  1 
ATOM   1290 C  CE1  . TYR A 1 76  ? -17.909 -1.794  24.866  1.00 29.47  ? 76  TYR A CE1  1 
ATOM   1291 C  CE2  . TYR A 1 76  ? -20.240 -1.490  25.269  1.00 27.59  ? 76  TYR A CE2  1 
ATOM   1292 C  CZ   . TYR A 1 76  ? -19.034 -2.086  25.590  1.00 30.13  ? 76  TYR A CZ   1 
ATOM   1293 O  OH   . TYR A 1 76  ? -18.963 -2.972  26.625  1.00 33.70  ? 76  TYR A OH   1 
ATOM   1294 H  H    . TYR A 1 76  ? -19.865 2.890   23.701  1.00 26.92  ? 76  TYR A H    1 
ATOM   1295 H  HA   . TYR A 1 76  ? -17.535 1.773   22.871  1.00 24.76  ? 76  TYR A HA   1 
ATOM   1296 H  HB2  . TYR A 1 76  ? -20.166 0.934   22.191  1.00 26.39  ? 76  TYR A HB2  1 
ATOM   1297 H  HB3  . TYR A 1 76  ? -18.854 0.304   21.553  1.00 26.39  ? 76  TYR A HB3  1 
ATOM   1298 H  HD1  . TYR A 1 76  ? -17.203 -0.707  23.346  1.00 33.08  ? 76  TYR A HD1  1 
ATOM   1299 H  HD2  . TYR A 1 76  ? -21.107 -0.190  24.001  1.00 30.34  ? 76  TYR A HD2  1 
ATOM   1300 H  HE1  . TYR A 1 76  ? -17.100 -2.198  25.082  1.00 35.38  ? 76  TYR A HE1  1 
ATOM   1301 H  HE2  . TYR A 1 76  ? -21.006 -1.688  25.758  1.00 33.12  ? 76  TYR A HE2  1 
ATOM   1302 H  HH   . TYR A 1 76  ? -19.722 -3.073  26.970  1.00 40.45  ? 76  TYR A HH   1 
ATOM   1303 N  N    . ALA A 1 77  ? -19.471 3.699   21.233  1.00 18.87  ? 77  ALA A N    1 
ATOM   1304 C  CA   . ALA A 1 77  ? -19.651 4.431   19.984  1.00 18.77  ? 77  ALA A CA   1 
ATOM   1305 C  C    . ALA A 1 77  ? -18.852 5.726   19.981  1.00 18.49  ? 77  ALA A C    1 
ATOM   1306 O  O    . ALA A 1 77  ? -18.597 6.330   21.025  1.00 20.87  ? 77  ALA A O    1 
ATOM   1307 C  CB   . ALA A 1 77  ? -21.132 4.755   19.795  1.00 18.60  ? 77  ALA A CB   1 
ATOM   1308 H  H    . ALA A 1 77  ? -20.085 3.856   21.814  1.00 22.65  ? 77  ALA A H    1 
ATOM   1309 H  HA   . ALA A 1 77  ? -19.338 3.887   19.244  1.00 22.54  ? 77  ALA A HA   1 
ATOM   1310 H  HB1  . ALA A 1 77  ? -21.245 5.243   18.965  1.00 22.33  ? 77  ALA A HB1  1 
ATOM   1311 H  HB2  . ALA A 1 77  ? -21.635 3.926   19.762  1.00 22.33  ? 77  ALA A HB2  1 
ATOM   1312 H  HB3  . ALA A 1 77  ? -21.435 5.295   20.541  1.00 22.33  ? 77  ALA A HB3  1 
ATOM   1313 N  N    . VAL A 1 78  ? -18.466 6.156   18.781  1.00 17.41  ? 78  VAL A N    1 
ATOM   1314 C  CA   . VAL A 1 78  ? -17.814 7.454   18.635  1.00 17.43  ? 78  VAL A CA   1 
ATOM   1315 C  C    . VAL A 1 78  ? -18.822 8.578   18.760  1.00 18.01  ? 78  VAL A C    1 
ATOM   1316 O  O    . VAL A 1 78  ? -18.451 9.702   19.127  1.00 18.90  ? 78  VAL A O    1 
ATOM   1317 C  CB   . VAL A 1 78  ? -17.018 7.549   17.317  1.00 16.73  ? 78  VAL A CB   1 
ATOM   1318 C  CG1  . VAL A 1 78  ? -17.938 7.702   16.101  1.00 18.00  ? 78  VAL A CG1  1 
ATOM   1319 C  CG2  . VAL A 1 78  ? -16.048 8.709   17.367  1.00 17.93  ? 78  VAL A CG2  1 
ATOM   1320 H  H    . VAL A 1 78  ? -18.567 5.721   18.046  1.00 20.90  ? 78  VAL A H    1 
ATOM   1321 H  HA   . VAL A 1 78  ? -17.162 7.558   19.346  1.00 20.93  ? 78  VAL A HA   1 
ATOM   1322 H  HB   . VAL A 1 78  ? -16.525 6.720   17.215  1.00 20.09  ? 78  VAL A HB   1 
ATOM   1323 H  HG11 . VAL A 1 78  ? -17.415 7.583   15.293  1.00 21.61  ? 78  VAL A HG11 1 
ATOM   1324 H  HG12 . VAL A 1 78  ? -18.635 7.028   16.146  1.00 21.61  ? 78  VAL A HG12 1 
ATOM   1325 H  HG13 . VAL A 1 78  ? -18.333 8.588   16.113  1.00 21.61  ? 78  VAL A HG13 1 
ATOM   1326 H  HG21 . VAL A 1 78  ? -16.169 9.186   18.203  1.00 21.53  ? 78  VAL A HG21 1 
ATOM   1327 H  HG22 . VAL A 1 78  ? -15.142 8.367   17.309  1.00 21.53  ? 78  VAL A HG22 1 
ATOM   1328 H  HG23 . VAL A 1 78  ? -16.226 9.302   16.620  1.00 21.53  ? 78  VAL A HG23 1 
ATOM   1329 N  N    . GLY A 1 79  ? -20.083 8.293   18.514  1.00 17.40  ? 79  GLY A N    1 
ATOM   1330 C  CA   . GLY A 1 79  ? -21.150 9.267   18.595  1.00 17.75  ? 79  GLY A CA   1 
ATOM   1331 C  C    . GLY A 1 79  ? -22.453 8.535   18.380  1.00 18.63  ? 79  GLY A C    1 
ATOM   1332 O  O    . GLY A 1 79  ? -22.475 7.345   18.073  1.00 17.64  ? 79  GLY A O    1 
ATOM   1333 H  H    . GLY A 1 79  ? -20.361 7.510   18.290  1.00 20.89  ? 79  GLY A H    1 
ATOM   1334 H  HA2  . GLY A 1 79  ? -21.157 9.694   19.466  1.00 21.31  ? 79  GLY A HA2  1 
ATOM   1335 H  HA3  . GLY A 1 79  ? -21.042 9.947   17.911  1.00 21.31  ? 79  GLY A HA3  1 
ATOM   1336 N  N    . LEU A 1 80  ? -23.543 9.270   18.559  1.00 17.39  ? 80  LEU A N    1 
ATOM   1337 C  CA   . LEU A 1 80  ? -24.870 8.747   18.291  1.00 17.63  ? 80  LEU A CA   1 
ATOM   1338 C  C    . LEU A 1 80  ? -25.547 9.552   17.202  1.00 18.10  ? 80  LEU A C    1 
ATOM   1339 O  O    . LEU A 1 80  ? -25.313 10.754  17.068  1.00 20.13  ? 80  LEU A O    1 
ATOM   1340 C  CB   . LEU A 1 80  ? -25.759 8.793   19.524  1.00 19.91  ? 80  LEU A CB   1 
ATOM   1341 C  CG   . LEU A 1 80  ? -25.233 8.121   20.782  1.00 20.62  ? 80  LEU A CG   1 
ATOM   1342 C  CD1  . LEU A 1 80  ? -26.244 8.296   21.899  1.00 23.56  ? 80  LEU A CD1  1 
ATOM   1343 C  CD2  . LEU A 1 80  ? -24.910 6.654   20.561  1.00 22.89  ? 80  LEU A CD2  1 
ATOM   1344 H  H    . LEU A 1 80  ? -23.536 10.083  18.839  1.00 20.88  ? 80  LEU A H    1 
ATOM   1345 H  HA   . LEU A 1 80  ? -24.775 7.827   18.000  1.00 21.16  ? 80  LEU A HA   1 
ATOM   1346 H  HB2  . LEU A 1 80  ? -25.915 9.724   19.745  1.00 23.90  ? 80  LEU A HB2  1 
ATOM   1347 H  HB3  . LEU A 1 80  ? -26.598 8.359   19.303  1.00 23.90  ? 80  LEU A HB3  1 
ATOM   1348 H  HG   . LEU A 1 80  ? -24.397 8.542   21.037  1.00 24.76  ? 80  LEU A HG   1 
ATOM   1349 H  HD11 . LEU A 1 80  ? -26.367 9.243   22.068  1.00 28.29  ? 80  LEU A HD11 1 
ATOM   1350 H  HD12 . LEU A 1 80  ? -27.085 7.896   21.628  1.00 28.29  ? 80  LEU A HD12 1 
ATOM   1351 H  HD13 . LEU A 1 80  ? -25.911 7.858   22.697  1.00 28.29  ? 80  LEU A HD13 1 
ATOM   1352 H  HD21 . LEU A 1 80  ? -25.705 6.200   20.242  1.00 27.49  ? 80  LEU A HD21 1 
ATOM   1353 H  HD22 . LEU A 1 80  ? -24.201 6.582   19.903  1.00 27.49  ? 80  LEU A HD22 1 
ATOM   1354 H  HD23 . LEU A 1 80  ? -24.622 6.264   21.401  1.00 27.49  ? 80  LEU A HD23 1 
ATOM   1355 N  N    . SER A 1 81  ? -26.408 8.881   16.437  1.00 17.68  ? 81  SER A N    1 
ATOM   1356 C  CA   . SER A 1 81  ? -27.297 9.534   15.485  1.00 17.48  ? 81  SER A CA   1 
ATOM   1357 C  C    . SER A 1 81  ? -28.720 9.245   15.928  1.00 16.74  ? 81  SER A C    1 
ATOM   1358 O  O    . SER A 1 81  ? -29.091 8.086   16.123  1.00 18.84  ? 81  SER A O    1 
ATOM   1359 C  CB   . SER A 1 81  ? -27.068 8.972   14.076  1.00 18.06  ? 81  SER A CB   1 
ATOM   1360 O  OG   . SER A 1 81  ? -28.038 9.456   13.169  1.00 19.27  ? 81  SER A OG   1 
ATOM   1361 H  H    . SER A 1 81  ? -26.495 8.025   16.454  1.00 21.22  ? 81  SER A H    1 
ATOM   1362 H  HA   . SER A 1 81  ? -27.148 10.492  15.464  1.00 20.99  ? 81  SER A HA   1 
ATOM   1363 H  HB2  . SER A 1 81  ? -26.188 9.241   13.769  1.00 21.68  ? 81  SER A HB2  1 
ATOM   1364 H  HB3  . SER A 1 81  ? -27.125 8.004   14.110  1.00 21.68  ? 81  SER A HB3  1 
ATOM   1365 H  HG   . SER A 1 81  ? -27.899 9.139   12.403  1.00 23.14  ? 81  SER A HG   1 
ATOM   1366 N  N    . ILE A 1 82  ? -29.522 10.286  16.084  1.00 16.12  ? 82  ILE A N    1 
ATOM   1367 C  CA   A ILE A 1 82  ? -30.894 10.151  16.564  0.19 16.36  ? 82  ILE A CA   1 
ATOM   1368 C  CA   B ILE A 1 82  ? -30.890 10.152  16.568  0.81 15.50  ? 82  ILE A CA   1 
ATOM   1369 C  C    . ILE A 1 82  ? -31.838 10.588  15.452  1.00 16.96  ? 82  ILE A C    1 
ATOM   1370 O  O    . ILE A 1 82  ? -31.817 11.754  15.024  1.00 16.32  ? 82  ILE A O    1 
ATOM   1371 C  CB   A ILE A 1 82  ? -31.141 10.962  17.847  0.19 16.76  ? 82  ILE A CB   1 
ATOM   1372 C  CB   B ILE A 1 82  ? -31.132 10.969  17.848  0.81 18.09  ? 82  ILE A CB   1 
ATOM   1373 C  CG1  A ILE A 1 82  ? -30.367 10.347  19.011  0.19 17.28  ? 82  ILE A CG1  1 
ATOM   1374 C  CG1  B ILE A 1 82  ? -30.028 10.734  18.882  0.81 20.49  ? 82  ILE A CG1  1 
ATOM   1375 C  CG2  A ILE A 1 82  ? -32.631 11.024  18.155  0.19 16.53  ? 82  ILE A CG2  1 
ATOM   1376 C  CG2  B ILE A 1 82  ? -32.480 10.623  18.408  0.81 18.78  ? 82  ILE A CG2  1 
ATOM   1377 C  CD1  A ILE A 1 82  ? -29.057 11.041  19.289  0.19 17.97  ? 82  ILE A CD1  1 
ATOM   1378 C  CD1  B ILE A 1 82  ? -29.736 9.282   19.178  0.81 21.48  ? 82  ILE A CD1  1 
ATOM   1379 H  H    . ILE A 1 82  ? -29.289 11.096  15.912  1.00 19.36  ? 82  ILE A H    1 
ATOM   1380 H  HA   . ILE A 1 82  ? -31.069 9.216   16.757  1.00 18.62  ? 82  ILE A HA   1 
ATOM   1381 H  HB   A ILE A 1 82  ? -30.821 11.868  17.712  0.19 20.13  ? 82  ILE A HB   1 
ATOM   1382 H  HB   B ILE A 1 82  ? -31.109 11.912  17.623  0.81 21.72  ? 82  ILE A HB   1 
ATOM   1383 H  HG12 A ILE A 1 82  ? -30.909 10.402  19.813  0.19 20.75  ? 82  ILE A HG12 1 
ATOM   1384 H  HG12 B ILE A 1 82  ? -29.208 11.135  18.554  0.81 24.60  ? 82  ILE A HG12 1 
ATOM   1385 H  HG13 A ILE A 1 82  ? -30.174 9.418   18.805  0.19 20.75  ? 82  ILE A HG13 1 
ATOM   1386 H  HG13 B ILE A 1 82  ? -30.292 11.154  19.716  0.81 24.60  ? 82  ILE A HG13 1 
ATOM   1387 H  HG21 A ILE A 1 82  ? -32.752 11.320  19.071  0.19 19.85  ? 82  ILE A HG21 1 
ATOM   1388 H  HG21 B ILE A 1 82  ? -32.573 11.031  19.283  0.81 22.55  ? 82  ILE A HG21 1 
ATOM   1389 H  HG22 A ILE A 1 82  ? -33.053 11.651  17.547  0.19 19.85  ? 82  ILE A HG22 1 
ATOM   1390 H  HG22 B ILE A 1 82  ? -33.166 10.961  17.811  0.81 22.55  ? 82  ILE A HG22 1 
ATOM   1391 H  HG23 A ILE A 1 82  ? -33.014 10.141  18.040  0.19 19.85  ? 82  ILE A HG23 1 
ATOM   1392 H  HG23 B ILE A 1 82  ? -32.553 9.659   18.483  0.81 22.55  ? 82  ILE A HG23 1 
ATOM   1393 H  HD11 A ILE A 1 82  ? -28.582 10.554  19.980  0.19 21.58  ? 82  ILE A HD11 1 
ATOM   1394 H  HD11 B ILE A 1 82  ? -29.245 9.222   20.013  0.81 25.79  ? 82  ILE A HD11 1 
ATOM   1395 H  HD12 A ILE A 1 82  ? -28.530 11.058  18.474  0.19 21.58  ? 82  ILE A HD12 1 
ATOM   1396 H  HD12 B ILE A 1 82  ? -30.575 8.801   19.252  0.81 25.79  ? 82  ILE A HD12 1 
ATOM   1397 H  HD13 A ILE A 1 82  ? -29.237 11.946  19.585  0.19 21.58  ? 82  ILE A HD13 1 
ATOM   1398 H  HD13 B ILE A 1 82  ? -29.206 8.913   18.455  0.81 25.79  ? 82  ILE A HD13 1 
ATOM   1399 N  N    . LEU A 1 83  ? -32.687 9.671   15.008  1.00 16.99  ? 83  LEU A N    1 
ATOM   1400 C  CA   . LEU A 1 83  ? -33.736 10.031  14.060  1.00 18.07  ? 83  LEU A CA   1 
ATOM   1401 C  C    . LEU A 1 83  ? -34.791 10.907  14.738  1.00 18.30  ? 83  LEU A C    1 
ATOM   1402 O  O    . LEU A 1 83  ? -35.365 10.538  15.771  1.00 21.11  ? 83  LEU A O    1 
ATOM   1403 C  CB   . LEU A 1 83  ? -34.413 8.778   13.524  1.00 20.54  ? 83  LEU A CB   1 
ATOM   1404 C  CG   . LEU A 1 83  ? -34.086 8.354   12.101  1.00 19.98  ? 83  LEU A CG   1 
ATOM   1405 C  CD1  . LEU A 1 83  ? -34.566 9.403   11.104  1.00 22.01  ? 83  LEU A CD1  1 
ATOM   1406 C  CD2  . LEU A 1 83  ? -32.597 8.070   11.973  1.00 20.75  ? 83  LEU A CD2  1 
ATOM   1407 H  H    . LEU A 1 83  ? -32.679 8.842   15.237  1.00 20.40  ? 83  LEU A H    1 
ATOM   1408 H  HA   . LEU A 1 83  ? -33.336 10.522  13.325  1.00 21.70  ? 83  LEU A HA   1 
ATOM   1409 H  HB2  . LEU A 1 83  ? -34.166 8.039   14.101  1.00 24.66  ? 83  LEU A HB2  1 
ATOM   1410 H  HB3  . LEU A 1 83  ? -35.372 8.921   13.560  1.00 24.66  ? 83  LEU A HB3  1 
ATOM   1411 H  HG   . LEU A 1 83  ? -34.554 7.533   11.883  1.00 23.99  ? 83  LEU A HG   1 
ATOM   1412 H  HD11 . LEU A 1 83  ? -34.058 10.219  11.235  1.00 26.42  ? 83  LEU A HD11 1 
ATOM   1413 H  HD12 . LEU A 1 83  ? -34.428 9.070   10.203  1.00 26.42  ? 83  LEU A HD12 1 
ATOM   1414 H  HD13 . LEU A 1 83  ? -35.509 9.573   11.253  1.00 26.42  ? 83  LEU A HD13 1 
ATOM   1415 H  HD21 . LEU A 1 83  ? -32.342 7.416   12.642  1.00 24.91  ? 83  LEU A HD21 1 
ATOM   1416 H  HD22 . LEU A 1 83  ? -32.416 7.724   11.086  1.00 24.91  ? 83  LEU A HD22 1 
ATOM   1417 H  HD23 . LEU A 1 83  ? -32.105 8.895   12.113  1.00 24.91  ? 83  LEU A HD23 1 
ATOM   1418 N  N    . THR A 1 84  ? -35.062 12.068  14.159  1.00 17.22  ? 84  THR A N    1 
ATOM   1419 C  CA   . THR A 1 84  ? -36.139 12.909  14.655  1.00 18.08  ? 84  THR A CA   1 
ATOM   1420 C  C    . THR A 1 84  ? -37.318 13.004  13.684  1.00 18.98  ? 84  THR A C    1 
ATOM   1421 O  O    . THR A 1 84  ? -38.317 13.653  13.998  1.00 20.62  ? 84  THR A O    1 
ATOM   1422 C  CB   . THR A 1 84  ? -35.617 14.287  15.071  1.00 17.98  ? 84  THR A CB   1 
ATOM   1423 O  OG1  . THR A 1 84  ? -34.905 14.894  13.985  1.00 18.39  ? 84  THR A OG1  1 
ATOM   1424 C  CG2  . THR A 1 84  ? -34.669 14.167  16.238  1.00 18.84  ? 84  THR A CG2  1 
ATOM   1425 H  H    . THR A 1 84  ? -34.639 12.387  13.482  1.00 20.68  ? 84  THR A H    1 
ATOM   1426 H  HA   . THR A 1 84  ? -36.492 12.517  15.470  1.00 21.71  ? 84  THR A HA   1 
ATOM   1427 H  HB   . THR A 1 84  ? -36.373 14.840  15.323  1.00 21.59  ? 84  THR A HB   1 
ATOM   1428 H  HG1  . THR A 1 84  ? -35.418 15.004  13.330  1.00 22.09  ? 84  THR A HG1  1 
ATOM   1429 H  HG21 . THR A 1 84  ? -34.353 15.046  16.501  1.00 22.62  ? 84  THR A HG21 1 
ATOM   1430 H  HG22 . THR A 1 84  ? -35.121 13.756  16.992  1.00 22.62  ? 84  THR A HG22 1 
ATOM   1431 H  HG23 . THR A 1 84  ? -33.907 13.619  15.991  1.00 22.62  ? 84  THR A HG23 1 
ATOM   1432 N  N    . GLU A 1 85  ? -37.232 12.377  12.513  1.00 18.10  ? 85  GLU A N    1 
ATOM   1433 C  CA   . GLU A 1 85  ? -38.352 12.365  11.575  1.00 18.13  ? 85  GLU A CA   1 
ATOM   1434 C  C    . GLU A 1 85  ? -39.465 11.486  12.120  1.00 18.08  ? 85  GLU A C    1 
ATOM   1435 O  O    . GLU A 1 85  ? -39.216 10.360  12.561  1.00 18.93  ? 85  GLU A O    1 
ATOM   1436 C  CB   . GLU A 1 85  ? -37.886 11.846  10.217  1.00 18.97  ? 85  GLU A CB   1 
ATOM   1437 C  CG   . GLU A 1 85  ? -38.807 12.148  9.048   1.00 20.33  ? 85  GLU A CG   1 
ATOM   1438 C  CD   . GLU A 1 85  ? -40.131 11.424  9.122   1.00 23.37  ? 85  GLU A CD   1 
ATOM   1439 O  OE1  . GLU A 1 85  ? -40.100 10.189  9.299   1.00 22.24  ? 85  GLU A OE1  1 
ATOM   1440 O  OE2  . GLU A 1 85  ? -41.199 12.083  9.032   1.00 24.28  ? 85  GLU A OE2  1 
ATOM   1441 H  H    . GLU A 1 85  ? -36.537 11.952  12.238  1.00 21.73  ? 85  GLU A H    1 
ATOM   1442 H  HA   . GLU A 1 85  ? -38.696 13.264  11.456  1.00 21.77  ? 85  GLU A HA   1 
ATOM   1443 H  HB2  . GLU A 1 85  ? -37.025 12.247  10.017  1.00 22.77  ? 85  GLU A HB2  1 
ATOM   1444 H  HB3  . GLU A 1 85  ? -37.797 10.882  10.273  1.00 22.77  ? 85  GLU A HB3  1 
ATOM   1445 H  HG2  . GLU A 1 85  ? -38.990 13.100  9.030   1.00 24.41  ? 85  GLU A HG2  1 
ATOM   1446 H  HG3  . GLU A 1 85  ? -38.368 11.879  8.225   1.00 24.41  ? 85  GLU A HG3  1 
ATOM   1447 N  N    . GLU A 1 86  ? -40.700 11.996  12.098  1.00 20.04  ? 86  GLU A N    1 
ATOM   1448 C  CA   . GLU A 1 86  ? -41.780 11.337  12.830  1.00 21.29  ? 86  GLU A CA   1 
ATOM   1449 C  C    . GLU A 1 86  ? -42.552 10.280  12.044  1.00 23.71  ? 86  GLU A C    1 
ATOM   1450 O  O    . GLU A 1 86  ? -42.909 9.238   12.617  1.00 24.23  ? 86  GLU A O    1 
ATOM   1451 C  CB   . GLU A 1 86  ? -42.817 12.358  13.310  1.00 24.27  ? 86  GLU A CB   1 
ATOM   1452 C  CG   . GLU A 1 86  ? -42.280 13.578  13.949  1.00 25.41  ? 86  GLU A CG   1 
ATOM   1453 C  CD   . GLU A 1 86  ? -43.421 14.498  14.340  0.70 25.65  ? 86  GLU A CD   1 
ATOM   1454 O  OE1  . GLU A 1 86  ? -44.185 14.136  15.274  0.50 26.38  ? 86  GLU A OE1  1 
ATOM   1455 O  OE2  . GLU A 1 86  ? -43.621 15.522  13.652  0.52 26.74  ? 86  GLU A OE2  1 
ATOM   1456 H  H    . GLU A 1 86  ? -40.931 12.708  11.675  1.00 24.05  ? 86  GLU A H    1 
ATOM   1457 H  HA   . GLU A 1 86  ? -41.344 10.905  13.581  1.00 25.57  ? 86  GLU A HA   1 
ATOM   1458 H  HB2  . GLU A 1 86  ? -43.339 12.643  12.543  1.00 29.14  ? 86  GLU A HB2  1 
ATOM   1459 H  HB3  . GLU A 1 86  ? -43.392 11.924  13.959  1.00 29.14  ? 86  GLU A HB3  1 
ATOM   1460 H  HG2  . GLU A 1 86  ? -41.784 13.338  14.747  1.00 30.51  ? 86  GLU A HG2  1 
ATOM   1461 H  HG3  . GLU A 1 86  ? -41.701 14.046  13.326  1.00 30.51  ? 86  GLU A HG3  1 
ATOM   1462 N  N    . LYS A 1 87  ? -42.898 10.560  10.787  1.00 23.05  ? 87  LYS A N    1 
ATOM   1463 C  CA   . LYS A 1 87  ? -43.893 9.748   10.090  1.00 23.62  ? 87  LYS A CA   1 
ATOM   1464 C  C    . LYS A 1 87  ? -43.331 8.416   9.626   1.00 24.29  ? 87  LYS A C    1 
ATOM   1465 O  O    . LYS A 1 87  ? -44.010 7.385   9.715   1.00 25.50  ? 87  LYS A O    1 
ATOM   1466 C  CB   . LYS A 1 87  ? -44.444 10.521  8.889   1.00 25.23  ? 87  LYS A CB   1 
ATOM   1467 C  CG   . LYS A 1 87  ? -45.475 9.754   8.090   1.00 28.25  ? 87  LYS A CG   1 
ATOM   1468 C  CD   . LYS A 1 87  ? -46.240 10.713  7.183   1.00 31.79  ? 87  LYS A CD   1 
ATOM   1469 C  CE   . LYS A 1 87  ? -47.259 10.012  6.325   1.00 35.04  ? 87  LYS A CE   1 
ATOM   1470 N  NZ   . LYS A 1 87  ? -47.897 11.000  5.396   1.00 35.27  ? 87  LYS A NZ   1 
ATOM   1471 H  H    . LYS A 1 87  ? -42.576 11.208  10.322  1.00 27.67  ? 87  LYS A H    1 
ATOM   1472 H  HA   . LYS A 1 87  ? -44.619 9.566   10.708  1.00 28.36  ? 87  LYS A HA   1 
ATOM   1473 H  HB2  . LYS A 1 87  ? -44.863 11.335  9.208   1.00 30.29  ? 87  LYS A HB2  1 
ATOM   1474 H  HB3  . LYS A 1 87  ? -43.709 10.736  8.294   1.00 30.29  ? 87  LYS A HB3  1 
ATOM   1475 H  HG2  . LYS A 1 87  ? -45.035 9.088   7.539   1.00 33.91  ? 87  LYS A HG2  1 
ATOM   1476 H  HG3  . LYS A 1 87  ? -46.104 9.324   8.691   1.00 33.91  ? 87  LYS A HG3  1 
ATOM   1477 H  HD2  . LYS A 1 87  ? -46.707 11.363  7.732   1.00 38.16  ? 87  LYS A HD2  1 
ATOM   1478 H  HD3  . LYS A 1 87  ? -45.613 11.164  6.597   1.00 38.16  ? 87  LYS A HD3  1 
ATOM   1479 H  HE2  . LYS A 1 87  ? -46.826 9.322   5.799   1.00 42.07  ? 87  LYS A HE2  1 
ATOM   1480 H  HE3  . LYS A 1 87  ? -47.947 9.620   6.886   1.00 42.07  ? 87  LYS A HE3  1 
ATOM   1481 H  HZ1  . LYS A 1 87  ? -48.495 10.591  4.880   1.00 42.34  ? 87  LYS A HZ1  1 
ATOM   1482 H  HZ2  . LYS A 1 87  ? -48.307 11.637  5.864   1.00 42.34  ? 87  LYS A HZ2  1 
ATOM   1483 H  HZ3  . LYS A 1 87  ? -47.277 11.375  4.879   1.00 42.34  ? 87  LYS A HZ3  1 
ATOM   1484 N  N    . TYR A 1 88  ? -42.119 8.423   9.089   1.00 21.45  ? 88  TYR A N    1 
ATOM   1485 C  CA   . TYR A 1 88  ? -41.521 7.232   8.506   1.00 21.71  ? 88  TYR A CA   1 
ATOM   1486 C  C    . TYR A 1 88  ? -40.530 6.561   9.430   1.00 20.37  ? 88  TYR A C    1 
ATOM   1487 O  O    . TYR A 1 88  ? -40.266 5.362   9.264   1.00 21.88  ? 88  TYR A O    1 
ATOM   1488 C  CB   . TYR A 1 88  ? -40.844 7.615   7.193   1.00 22.35  ? 88  TYR A CB   1 
ATOM   1489 C  CG   . TYR A 1 88  ? -41.861 8.079   6.176   1.00 23.44  ? 88  TYR A CG   1 
ATOM   1490 C  CD1  . TYR A 1 88  ? -42.541 7.166   5.379   1.00 24.14  ? 88  TYR A CD1  1 
ATOM   1491 C  CD2  . TYR A 1 88  ? -42.181 9.429   6.035   1.00 22.91  ? 88  TYR A CD2  1 
ATOM   1492 C  CE1  . TYR A 1 88  ? -43.474 7.576   4.440   1.00 25.41  ? 88  TYR A CE1  1 
ATOM   1493 C  CE2  . TYR A 1 88  ? -43.130 9.854   5.078   1.00 24.13  ? 88  TYR A CE2  1 
ATOM   1494 C  CZ   . TYR A 1 88  ? -43.789 8.908   4.307   1.00 25.35  ? 88  TYR A CZ   1 
ATOM   1495 O  OH   . TYR A 1 88  ? -44.735 9.287   3.375   1.00 26.89  ? 88  TYR A OH   1 
ATOM   1496 H  H    . TYR A 1 88  ? -41.613 9.118   9.049   1.00 25.75  ? 88  TYR A H    1 
ATOM   1497 H  HA   . TYR A 1 88  ? -42.205 6.574   8.306   1.00 26.07  ? 88  TYR A HA   1 
ATOM   1498 H  HB2  . TYR A 1 88  ? -40.216 8.338   7.353   1.00 26.84  ? 88  TYR A HB2  1 
ATOM   1499 H  HB3  . TYR A 1 88  ? -40.378 6.844   6.833   1.00 26.84  ? 88  TYR A HB3  1 
ATOM   1500 H  HD1  . TYR A 1 88  ? -42.366 6.258   5.478   1.00 28.98  ? 88  TYR A HD1  1 
ATOM   1501 H  HD2  . TYR A 1 88  ? -41.764 10.058  6.578   1.00 27.50  ? 88  TYR A HD2  1 
ATOM   1502 H  HE1  . TYR A 1 88  ? -43.890 6.947   3.897   1.00 30.51  ? 88  TYR A HE1  1 
ATOM   1503 H  HE2  . TYR A 1 88  ? -43.312 10.759  4.967   1.00 28.97  ? 88  TYR A HE2  1 
ATOM   1504 H  HH   . TYR A 1 88  ? -44.809 10.124  3.366   1.00 32.28  ? 88  TYR A HH   1 
ATOM   1505 N  N    . PHE A 1 89  ? -40.026 7.278   10.430  1.00 19.39  ? 89  PHE A N    1 
ATOM   1506 C  CA   . PHE A 1 89  ? -39.028 6.726   11.331  1.00 18.96  ? 89  PHE A CA   1 
ATOM   1507 C  C    . PHE A 1 89  ? -39.459 6.695   12.786  1.00 19.37  ? 89  PHE A C    1 
ATOM   1508 O  O    . PHE A 1 89  ? -38.709 6.172   13.623  1.00 19.53  ? 89  PHE A O    1 
ATOM   1509 C  CB   . PHE A 1 89  ? -37.711 7.501   11.200  1.00 18.30  ? 89  PHE A CB   1 
ATOM   1510 C  CG   . PHE A 1 89  ? -37.081 7.380   9.836   1.00 18.34  ? 89  PHE A CG   1 
ATOM   1511 C  CD1  . PHE A 1 89  ? -37.446 8.234   8.808   1.00 19.50  ? 89  PHE A CD1  1 
ATOM   1512 C  CD2  . PHE A 1 89  ? -36.141 6.401   9.587   1.00 18.32  ? 89  PHE A CD2  1 
ATOM   1513 C  CE1  . PHE A 1 89  ? -36.846 8.112   7.542   1.00 19.50  ? 89  PHE A CE1  1 
ATOM   1514 C  CE2  . PHE A 1 89  ? -35.552 6.273   8.339   1.00 18.67  ? 89  PHE A CE2  1 
ATOM   1515 C  CZ   . PHE A 1 89  ? -35.905 7.139   7.319   1.00 19.98  ? 89  PHE A CZ   1 
ATOM   1516 H  H    . PHE A 1 89  ? -40.248 8.090   10.605  1.00 23.29  ? 89  PHE A H    1 
ATOM   1517 H  HA   . PHE A 1 89  ? -38.861 5.807   11.067  1.00 22.76  ? 89  PHE A HA   1 
ATOM   1518 H  HB2  . PHE A 1 89  ? -37.883 8.441   11.366  1.00 21.98  ? 89  PHE A HB2  1 
ATOM   1519 H  HB3  . PHE A 1 89  ? -37.080 7.159   11.852  1.00 21.98  ? 89  PHE A HB3  1 
ATOM   1520 H  HD1  . PHE A 1 89  ? -38.089 8.889   8.955   1.00 23.41  ? 89  PHE A HD1  1 
ATOM   1521 H  HD2  . PHE A 1 89  ? -35.898 5.817   10.269  1.00 22.00  ? 89  PHE A HD2  1 
ATOM   1522 H  HE1  . PHE A 1 89  ? -37.087 8.691   6.856   1.00 23.41  ? 89  PHE A HE1  1 
ATOM   1523 H  HE2  . PHE A 1 89  ? -34.921 5.607   8.187   1.00 22.41  ? 89  PHE A HE2  1 
ATOM   1524 H  HZ   . PHE A 1 89  ? -35.505 7.061   6.483   1.00 23.99  ? 89  PHE A HZ   1 
ATOM   1525 N  N    . ASN A 1 90  ? -40.632 7.229   13.107  1.00 20.05  ? 90  ASN A N    1 
ATOM   1526 C  CA   . ASN A 1 90  ? -41.169 7.266   14.471  1.00 20.43  ? 90  ASN A CA   1 
ATOM   1527 C  C    . ASN A 1 90  ? -40.222 7.966   15.429  1.00 20.75  ? 90  ASN A C    1 
ATOM   1528 O  O    . ASN A 1 90  ? -40.194 7.648   16.617  1.00 21.31  ? 90  ASN A O    1 
ATOM   1529 C  CB   . ASN A 1 90  ? -41.562 5.887   15.022  1.00 22.00  ? 90  ASN A CB   1 
ATOM   1530 C  CG   . ASN A 1 90  ? -42.841 5.374   14.437  0.87 23.86  ? 90  ASN A CG   1 
ATOM   1531 O  OD1  . ASN A 1 90  ? -43.502 6.055   13.641  0.58 23.72  ? 90  ASN A OD1  1 
ATOM   1532 N  ND2  . ASN A 1 90  ? -43.210 4.165   14.826  0.65 23.79  ? 90  ASN A ND2  1 
ATOM   1533 H  H    . ASN A 1 90  ? -41.160 7.591   12.533  1.00 24.08  ? 90  ASN A H    1 
ATOM   1534 H  HA   . ASN A 1 90  ? -41.990 7.780   14.423  1.00 24.53  ? 90  ASN A HA   1 
ATOM   1535 H  HB2  . ASN A 1 90  ? -40.860 5.251   14.813  1.00 26.41  ? 90  ASN A HB2  1 
ATOM   1536 H  HB3  . ASN A 1 90  ? -41.677 5.951   15.983  1.00 26.41  ? 90  ASN A HB3  1 
ATOM   1537 H  HD21 . ASN A 1 90  ? -42.724 3.725   15.382  0.79 28.56  ? 90  ASN A HD21 1 
ATOM   1538 H  HD22 . ASN A 1 90  ? -43.937 3.819   14.522  0.46 28.56  ? 90  ASN A HD22 1 
ATOM   1539 N  N    . GLY A 1 91  ? -39.429 8.906   14.922  1.00 19.77  ? 91  GLY A N    1 
ATOM   1540 C  CA   . GLY A 1 91  ? -38.599 9.709   15.776  1.00 20.82  ? 91  GLY A CA   1 
ATOM   1541 C  C    . GLY A 1 91  ? -39.374 10.845  16.401  1.00 18.50  ? 91  GLY A C    1 
ATOM   1542 O  O    . GLY A 1 91  ? -40.548 11.105  16.114  1.00 21.00  ? 91  GLY A O    1 
ATOM   1543 H  H    . GLY A 1 91  ? -39.363 9.090   14.085  1.00 23.74  ? 91  GLY A H    1 
ATOM   1544 H  HA2  . GLY A 1 91  ? -38.234 9.157   16.486  1.00 25.00  ? 91  GLY A HA2  1 
ATOM   1545 H  HA3  . GLY A 1 91  ? -37.868 10.082  15.259  1.00 25.00  ? 91  GLY A HA3  1 
ATOM   1546 N  N    . SER A 1 92  ? -38.679 11.573  17.257  1.00 18.89  ? 92  SER A N    1 
ATOM   1547 C  CA   . SER A 1 92  ? -39.292 12.758  17.838  1.00 19.41  ? 92  SER A CA   1 
ATOM   1548 C  C    . SER A 1 92  ? -38.227 13.662  18.436  1.00 19.15  ? 92  SER A C    1 
ATOM   1549 O  O    . SER A 1 92  ? -37.113 13.241  18.737  1.00 18.96  ? 92  SER A O    1 
ATOM   1550 C  CB   . SER A 1 92  ? -40.320 12.398  18.922  1.00 22.09  ? 92  SER A CB   1 
ATOM   1551 O  OG   . SER A 1 92  ? -39.679 12.019  20.128  1.00 22.72  ? 92  SER A OG   1 
ATOM   1552 H  H    . SER A 1 92  ? -37.874 11.408  17.511  1.00 22.68  ? 92  SER A H    1 
ATOM   1553 H  HA   . SER A 1 92  ? -39.733 13.241  17.121  1.00 23.30  ? 92  SER A HA   1 
ATOM   1554 H  HB2  . SER A 1 92  ? -40.881 13.170  19.093  1.00 26.52  ? 92  SER A HB2  1 
ATOM   1555 H  HB3  . SER A 1 92  ? -40.863 11.657  18.607  1.00 26.52  ? 92  SER A HB3  1 
ATOM   1556 H  HG   . SER A 1 92  ? -39.171 11.365  19.990  1.00 27.27  ? 92  SER A HG   1 
ATOM   1557 N  N    . TYR A 1 93  ? -38.586 14.929  18.582  1.00 19.79  ? 93  TYR A N    1 
ATOM   1558 C  CA   . TYR A 1 93  ? -37.686 15.882  19.204  1.00 19.23  ? 93  TYR A CA   1 
ATOM   1559 C  C    . TYR A 1 93  ? -37.442 15.545  20.681  1.00 18.67  ? 93  TYR A C    1 
ATOM   1560 O  O    . TYR A 1 93  ? -36.324 15.713  21.175  1.00 19.27  ? 93  TYR A O    1 
ATOM   1561 C  CB   . TYR A 1 93  ? -38.276 17.280  19.019  1.00 18.37  ? 93  TYR A CB   1 
ATOM   1562 C  CG   . TYR A 1 93  ? -38.010 17.935  17.663  1.00 18.18  ? 93  TYR A CG   1 
ATOM   1563 C  CD1  . TYR A 1 93  ? -36.941 17.540  16.862  1.00 20.13  ? 93  TYR A CD1  1 
ATOM   1564 C  CD2  . TYR A 1 93  ? -38.816 18.970  17.210  1.00 18.27  ? 93  TYR A CD2  1 
ATOM   1565 C  CE1  . TYR A 1 93  ? -36.690 18.159  15.657  1.00 19.41  ? 93  TYR A CE1  1 
ATOM   1566 C  CE2  . TYR A 1 93  ? -38.573 19.600  16.010  1.00 17.86  ? 93  TYR A CE2  1 
ATOM   1567 C  CZ   . TYR A 1 93  ? -37.503 19.206  15.245  1.00 18.25  ? 93  TYR A CZ   1 
ATOM   1568 O  OH   . TYR A 1 93  ? -37.250 19.864  14.063  1.00 20.07  ? 93  TYR A OH   1 
ATOM   1569 H  H    . TYR A 1 93  ? -39.339 15.259  18.331  1.00 23.76  ? 93  TYR A H    1 
ATOM   1570 H  HA   . TYR A 1 93  ? -36.815 15.857  18.777  1.00 23.09  ? 93  TYR A HA   1 
ATOM   1571 H  HB2  . TYR A 1 93  ? -39.239 17.222  19.126  1.00 22.06  ? 93  TYR A HB2  1 
ATOM   1572 H  HB3  . TYR A 1 93  ? -37.901 17.862  19.698  1.00 22.06  ? 93  TYR A HB3  1 
ATOM   1573 H  HD1  . TYR A 1 93  ? -36.388 16.847  17.145  1.00 24.17  ? 93  TYR A HD1  1 
ATOM   1574 H  HD2  . TYR A 1 93  ? -39.537 19.245  17.729  1.00 21.93  ? 93  TYR A HD2  1 
ATOM   1575 H  HE1  . TYR A 1 93  ? -35.981 17.878  15.124  1.00 23.30  ? 93  TYR A HE1  1 
ATOM   1576 H  HE2  . TYR A 1 93  ? -39.129 20.286  15.719  1.00 21.45  ? 93  TYR A HE2  1 
ATOM   1577 H  HH   . TYR A 1 93  ? -37.787 20.503  13.969  1.00 24.09  ? 93  TYR A HH   1 
ATOM   1578 N  N    . GLU A 1 94  ? -38.473 15.078  21.404  1.00 19.42  ? 94  GLU A N    1 
ATOM   1579 C  CA   . GLU A 1 94  ? -38.278 14.653  22.786  1.00 21.21  ? 94  GLU A CA   1 
ATOM   1580 C  C    . GLU A 1 94  ? -37.267 13.510  22.887  1.00 22.52  ? 94  GLU A C    1 
ATOM   1581 O  O    . GLU A 1 94  ? -36.501 13.438  23.857  1.00 24.51  ? 94  GLU A O    1 
ATOM   1582 C  CB   . GLU A 1 94  ? -39.626 14.228  23.370  1.00 24.90  ? 94  GLU A CB   1 
ATOM   1583 C  CG   . GLU A 1 94  ? -40.503 15.371  23.869  1.00 30.67  ? 94  GLU A CG   1 
ATOM   1584 C  CD   . GLU A 1 94  ? -39.778 16.288  24.811  0.57 35.33  ? 94  GLU A CD   1 
ATOM   1585 O  OE1  . GLU A 1 94  ? -39.060 15.776  25.689  0.70 38.06  ? 94  GLU A OE1  1 
ATOM   1586 O  OE2  . GLU A 1 94  ? -39.904 17.521  24.646  1.00 38.26  ? 94  GLU A OE2  1 
ATOM   1587 H  H    . GLU A 1 94  ? -39.280 15.001  21.118  1.00 23.32  ? 94  GLU A H    1 
ATOM   1588 H  HA   . GLU A 1 94  ? -37.930 15.395  23.303  1.00 25.46  ? 94  GLU A HA   1 
ATOM   1589 H  HB2  . GLU A 1 94  ? -40.124 13.759  22.682  1.00 29.89  ? 94  GLU A HB2  1 
ATOM   1590 H  HB3  . GLU A 1 94  ? -39.463 13.637  24.122  1.00 29.89  ? 94  GLU A HB3  1 
ATOM   1591 H  HG2  . GLU A 1 94  ? -40.801 15.896  23.109  1.00 36.82  ? 94  GLU A HG2  1 
ATOM   1592 H  HG3  . GLU A 1 94  ? -41.268 15.002  24.338  1.00 36.82  ? 94  GLU A HG3  1 
ATOM   1593 N  N    . THR A 1 95  ? -37.269 12.589  21.914  1.00 21.96  ? 95  THR A N    1 
ATOM   1594 C  CA   . THR A 1 95  ? -36.297 11.497  21.918  1.00 22.72  ? 95  THR A CA   1 
ATOM   1595 C  C    . THR A 1 95  ? -34.881 12.061  21.906  1.00 21.32  ? 95  THR A C    1 
ATOM   1596 O  O    . THR A 1 95  ? -34.016 11.646  22.681  1.00 22.23  ? 95  THR A O    1 
ATOM   1597 C  CB   . THR A 1 95  ? -36.495 10.601  20.679  1.00 24.36  ? 95  THR A CB   1 
ATOM   1598 O  OG1  . THR A 1 95  ? -37.834 10.081  20.632  1.00 28.01  ? 95  THR A OG1  1 
ATOM   1599 C  CG2  . THR A 1 95  ? -35.500 9.411   20.659  1.00 23.97  ? 95  THR A CG2  1 
ATOM   1600 H  H    . THR A 1 95  ? -37.816 12.577  21.251  1.00 26.37  ? 95  THR A H    1 
ATOM   1601 H  HA   . THR A 1 95  ? -36.432 10.959  22.713  1.00 27.28  ? 95  THR A HA   1 
ATOM   1602 H  HB   . THR A 1 95  ? -36.332 11.149  19.896  1.00 29.25  ? 95  THR A HB   1 
ATOM   1603 H  HG1  . THR A 1 95  ? -38.011 9.677   21.346  1.00 33.63  ? 95  THR A HG1  1 
ATOM   1604 H  HG21 . THR A 1 95  ? -34.598 9.735   20.508  1.00 28.78  ? 95  THR A HG21 1 
ATOM   1605 H  HG22 . THR A 1 95  ? -35.527 8.941   21.507  1.00 28.78  ? 95  THR A HG22 1 
ATOM   1606 H  HG23 . THR A 1 95  ? -35.735 8.793   19.949  1.00 28.78  ? 95  THR A HG23 1 
ATOM   1607 N  N    . LEU A 1 96  ? -34.629 13.012  21.009  1.00 19.79  ? 96  LEU A N    1 
ATOM   1608 C  CA   . LEU A 1 96  ? -33.328 13.654  20.938  1.00 20.26  ? 96  LEU A CA   1 
ATOM   1609 C  C    . LEU A 1 96  ? -32.996 14.379  22.234  1.00 21.02  ? 96  LEU A C    1 
ATOM   1610 O  O    . LEU A 1 96  ? -31.889 14.232  22.760  1.00 21.84  ? 96  LEU A O    1 
ATOM   1611 C  CB   . LEU A 1 96  ? -33.296 14.593  19.736  1.00 19.55  ? 96  LEU A CB   1 
ATOM   1612 C  CG   . LEU A 1 96  ? -32.106 15.547  19.679  1.00 19.20  ? 96  LEU A CG   1 
ATOM   1613 C  CD1  . LEU A 1 96  ? -30.816 14.752  19.599  1.00 20.96  ? 96  LEU A CD1  1 
ATOM   1614 C  CD2  . LEU A 1 96  ? -32.237 16.462  18.488  1.00 19.20  ? 96  LEU A CD2  1 
ATOM   1615 H  H    . LEU A 1 96  ? -35.197 13.302  20.432  1.00 23.76  ? 96  LEU A H    1 
ATOM   1616 H  HA   . LEU A 1 96  ? -32.641 12.981  20.810  1.00 24.32  ? 96  LEU A HA   1 
ATOM   1617 H  HB2  . LEU A 1 96  ? -33.274 14.055  18.929  1.00 23.47  ? 96  LEU A HB2  1 
ATOM   1618 H  HB3  . LEU A 1 96  ? -34.100 15.135  19.751  1.00 23.47  ? 96  LEU A HB3  1 
ATOM   1619 H  HG   . LEU A 1 96  ? -32.081 16.093  20.481  1.00 23.05  ? 96  LEU A HG   1 
ATOM   1620 H  HD11 . LEU A 1 96  ? -30.872 14.134  18.853  1.00 25.16  ? 96  LEU A HD11 1 
ATOM   1621 H  HD12 . LEU A 1 96  ? -30.075 15.364  19.467  1.00 25.16  ? 96  LEU A HD12 1 
ATOM   1622 H  HD13 . LEU A 1 96  ? -30.696 14.260  20.426  1.00 25.16  ? 96  LEU A HD13 1 
ATOM   1623 H  HD21 . LEU A 1 96  ? -31.464 17.047  18.453  1.00 23.05  ? 96  LEU A HD21 1 
ATOM   1624 H  HD22 . LEU A 1 96  ? -32.283 15.925  17.682  1.00 23.05  ? 96  LEU A HD22 1 
ATOM   1625 H  HD23 . LEU A 1 96  ? -33.046 16.988  18.582  1.00 23.05  ? 96  LEU A HD23 1 
ATOM   1626 N  N    . ARG A 1 97  ? -33.944 15.162  22.765  1.00 21.30  ? 97  ARG A N    1 
ATOM   1627 C  CA   . ARG A 1 97  ? -33.697 15.930  23.985  1.00 22.49  ? 97  ARG A CA   1 
ATOM   1628 C  C    . ARG A 1 97  ? -33.301 15.022  25.133  1.00 24.26  ? 97  ARG A C    1 
ATOM   1629 O  O    . ARG A 1 97  ? -32.327 15.293  25.839  1.00 24.67  ? 97  ARG A O    1 
ATOM   1630 C  CB   . ARG A 1 97  ? -34.948 16.734  24.361  1.00 25.30  ? 97  ARG A CB   1 
ATOM   1631 C  CG   . ARG A 1 97  ? -34.718 17.788  25.452  1.00 28.04  ? 97  ARG A CG   1 
ATOM   1632 C  CD   . ARG A 1 97  ? -35.999 18.468  25.953  1.00 30.14  ? 97  ARG A CD   1 
ATOM   1633 N  NE   . ARG A 1 97  ? -36.952 17.532  26.531  1.00 31.95  ? 97  ARG A NE   1 
ATOM   1634 C  CZ   . ARG A 1 97  ? -36.801 16.926  27.697  0.51 34.09  ? 97  ARG A CZ   1 
ATOM   1635 N  NH1  . ARG A 1 97  ? -35.762 17.178  28.472  1.00 36.22  ? 97  ARG A NH1  1 
ATOM   1636 N  NH2  . ARG A 1 97  ? -37.718 16.047  28.095  0.65 34.67  ? 97  ARG A NH2  1 
ATOM   1637 H  H    . ARG A 1 97  ? -34.733 15.263  22.439  1.00 25.57  ? 97  ARG A H    1 
ATOM   1638 H  HA   . ARG A 1 97  ? -32.969 16.549  23.818  1.00 27.00  ? 97  ARG A HA   1 
ATOM   1639 H  HB2  . ARG A 1 97  ? -35.268 17.195  23.570  1.00 30.37  ? 97  ARG A HB2  1 
ATOM   1640 H  HB3  . ARG A 1 97  ? -35.625 16.120  24.685  1.00 30.37  ? 97  ARG A HB3  1 
ATOM   1641 H  HG2  . ARG A 1 97  ? -34.297 17.360  26.214  1.00 33.66  ? 97  ARG A HG2  1 
ATOM   1642 H  HG3  . ARG A 1 97  ? -34.138 18.480  25.098  1.00 33.66  ? 97  ARG A HG3  1 
ATOM   1643 H  HD2  . ARG A 1 97  ? -35.765 19.116  26.636  1.00 36.18  ? 97  ARG A HD2  1 
ATOM   1644 H  HD3  . ARG A 1 97  ? -36.432 18.913  25.207  1.00 36.18  ? 97  ARG A HD3  1 
ATOM   1645 H  HE   . ARG A 1 97  ? -37.665 17.360  26.081  1.00 38.35  ? 97  ARG A HE   1 
ATOM   1646 H  HH11 . ARG A 1 97  ? -35.166 17.746  28.222  1.00 43.47  ? 97  ARG A HH11 1 
ATOM   1647 H  HH12 . ARG A 1 97  ? -35.680 16.775  29.227  1.00 43.47  ? 97  ARG A HH12 1 
ATOM   1648 H  HH21 . ARG A 1 97  ? -38.398 15.879  27.596  0.72 41.61  ? 97  ARG A HH21 1 
ATOM   1649 H  HH22 . ARG A 1 97  ? -37.630 15.647  28.851  0.76 41.61  ? 97  ARG A HH22 1 
ATOM   1650 N  N    . LYS A 1 98  ? -34.046 13.933  25.330  1.00 25.13  ? 98  LYS A N    1 
ATOM   1651 C  CA   . LYS A 1 98  ? -33.772 13.045  26.455  1.00 27.75  ? 98  LYS A CA   1 
ATOM   1652 C  C    . LYS A 1 98  ? -32.420 12.350  26.289  1.00 26.15  ? 98  LYS A C    1 
ATOM   1653 O  O    . LYS A 1 98  ? -31.650 12.229  27.257  1.00 26.60  ? 98  LYS A O    1 
ATOM   1654 C  CB   . LYS A 1 98  ? -34.903 12.015  26.583  1.00 30.95  ? 98  LYS A CB   1 
ATOM   1655 C  CG   . LYS A 1 98  ? -36.242 12.609  27.034  1.00 35.77  ? 98  LYS A CG   1 
ATOM   1656 C  CD   . LYS A 1 98  ? -37.221 11.564  27.556  1.00 40.21  ? 98  LYS A CD   1 
ATOM   1657 C  CE   . LYS A 1 98  ? -37.938 10.828  26.432  0.61 41.51  ? 98  LYS A CE   1 
ATOM   1658 N  NZ   . LYS A 1 98  ? -37.959 9.346   26.642  0.30 42.14  ? 98  LYS A NZ   1 
ATOM   1659 H  H    . LYS A 1 98  ? -34.705 13.691  24.834  1.00 30.16  ? 98  LYS A H    1 
ATOM   1660 H  HA   . LYS A 1 98  ? -33.740 13.562  27.275  1.00 33.31  ? 98  LYS A HA   1 
ATOM   1661 H  HB2  . LYS A 1 98  ? -35.042 11.598  25.718  1.00 37.15  ? 98  LYS A HB2  1 
ATOM   1662 H  HB3  . LYS A 1 98  ? -34.643 11.347  27.236  1.00 37.15  ? 98  LYS A HB3  1 
ATOM   1663 H  HG2  . LYS A 1 98  ? -36.079 13.246  27.747  1.00 42.93  ? 98  LYS A HG2  1 
ATOM   1664 H  HG3  . LYS A 1 98  ? -36.658 13.055  26.280  1.00 42.93  ? 98  LYS A HG3  1 
ATOM   1665 H  HD2  . LYS A 1 98  ? -36.736 10.910  28.083  1.00 48.27  ? 98  LYS A HD2  1 
ATOM   1666 H  HD3  . LYS A 1 98  ? -37.891 12.002  28.104  1.00 48.27  ? 98  LYS A HD3  1 
ATOM   1667 H  HE2  . LYS A 1 98  ? -38.856 11.138  26.385  0.83 49.83  ? 98  LYS A HE2  1 
ATOM   1668 H  HE3  . LYS A 1 98  ? -37.484 11.007  25.594  0.89 49.83  ? 98  LYS A HE3  1 
ATOM   1669 H  HZ1  . LYS A 1 98  ? -38.385 8.949   25.968  1.00 50.58  ? 98  LYS A HZ1  1 
ATOM   1670 H  HZ2  . LYS A 1 98  ? -37.127 9.032   26.681  0.82 50.58  ? 98  LYS A HZ2  1 
ATOM   1671 H  HZ3  . LYS A 1 98  ? -38.377 9.152   27.403  0.84 50.58  ? 98  LYS A HZ3  1 
ATOM   1672 N  N    . ILE A 1 99  ? -32.096 11.903  25.069  1.00 25.05  ? 99  ILE A N    1 
ATOM   1673 C  CA   . ILE A 1 99  ? -30.807 11.241  24.846  1.00 24.33  ? 99  ILE A CA   1 
ATOM   1674 C  C    . ILE A 1 99  ? -29.659 12.223  25.036  1.00 25.51  ? 99  ILE A C    1 
ATOM   1675 O  O    . ILE A 1 99  ? -28.664 11.920  25.712  1.00 27.14  ? 99  ILE A O    1 
ATOM   1676 C  CB   . ILE A 1 99  ? -30.762 10.567  23.460  1.00 24.29  ? 99  ILE A CB   1 
ATOM   1677 C  CG1  . ILE A 1 99  ? -31.639 9.307   23.487  1.00 26.11  ? 99  ILE A CG1  1 
ATOM   1678 C  CG2  . ILE A 1 99  ? -29.331 10.220  23.053  1.00 25.35  ? 99  ILE A CG2  1 
ATOM   1679 C  CD1  . ILE A 1 99  ? -31.810 8.667   22.102  1.00 25.92  ? 99  ILE A CD1  1 
ATOM   1680 H  H    . ILE A 1 99  ? -32.594 11.969  24.371  1.00 30.08  ? 99  ILE A H    1 
ATOM   1681 H  HA   . ILE A 1 99  ? -30.711 10.541  25.510  1.00 29.21  ? 99  ILE A HA   1 
ATOM   1682 H  HB   . ILE A 1 99  ? -31.106 11.190  22.801  1.00 29.17  ? 99  ILE A HB   1 
ATOM   1683 H  HG12 . ILE A 1 99  ? -31.229 8.650   24.071  1.00 31.34  ? 99  ILE A HG12 1 
ATOM   1684 H  HG13 . ILE A 1 99  ? -32.519 9.543   23.818  1.00 31.34  ? 99  ILE A HG13 1 
ATOM   1685 H  HG21 . ILE A 1 99  ? -29.356 9.619   22.292  1.00 30.43  ? 99  ILE A HG21 1 
ATOM   1686 H  HG22 . ILE A 1 99  ? -28.864 11.036  22.814  1.00 30.43  ? 99  ILE A HG22 1 
ATOM   1687 H  HG23 . ILE A 1 99  ? -28.886 9.790   23.800  1.00 30.43  ? 99  ILE A HG23 1 
ATOM   1688 H  HD11 . ILE A 1 99  ? -30.977 8.241   21.846  1.00 31.11  ? 99  ILE A HD11 1 
ATOM   1689 H  HD12 . ILE A 1 99  ? -32.519 8.007   22.144  1.00 31.11  ? 99  ILE A HD12 1 
ATOM   1690 H  HD13 . ILE A 1 99  ? -32.039 9.358   21.461  1.00 31.11  ? 99  ILE A HD13 1 
ATOM   1691 N  N    . ALA A 1 100 ? -29.777 13.419  24.450  1.00 25.92  ? 100 ALA A N    1 
ATOM   1692 C  CA   . ALA A 1 100 ? -28.722 14.416  24.603  1.00 27.62  ? 100 ALA A CA   1 
ATOM   1693 C  C    . ALA A 1 100 ? -28.489 14.763  26.067  1.00 31.16  ? 100 ALA A C    1 
ATOM   1694 O  O    . ALA A 1 100 ? -27.349 15.035  26.468  1.00 33.31  ? 100 ALA A O    1 
ATOM   1695 C  CB   . ALA A 1 100 ? -29.081 15.676  23.811  1.00 27.56  ? 100 ALA A CB   1 
ATOM   1696 H  H    . ALA A 1 100 ? -30.445 13.671  23.970  1.00 31.11  ? 100 ALA A H    1 
ATOM   1697 H  HA   . ALA A 1 100 ? -27.895 14.057  24.244  1.00 33.16  ? 100 ALA A HA   1 
ATOM   1698 H  HB1  . ALA A 1 100 ? -28.370 16.328  23.915  1.00 33.09  ? 100 ALA A HB1  1 
ATOM   1699 H  HB2  . ALA A 1 100 ? -29.181 15.443  22.875  1.00 33.09  ? 100 ALA A HB2  1 
ATOM   1700 H  HB3  . ALA A 1 100 ? -29.914 16.038  24.153  1.00 33.09  ? 100 ALA A HB3  1 
ATOM   1701 N  N    . SER A 1 101 ? -29.550 14.760  26.878  1.00 31.10  ? 101 SER A N    1 
ATOM   1702 C  CA   . SER A 1 101 ? -29.444 15.101  28.289  1.00 32.82  ? 101 SER A CA   1 
ATOM   1703 C  C    . SER A 1 101 ? -28.830 13.983  29.119  1.00 32.52  ? 101 SER A C    1 
ATOM   1704 O  O    . SER A 1 101 ? -28.575 14.191  30.316  1.00 34.41  ? 101 SER A O    1 
ATOM   1705 C  CB   . SER A 1 101 ? -30.844 15.398  28.827  1.00 34.41  ? 101 SER A CB   1 
ATOM   1706 O  OG   . SER A 1 101 ? -31.140 16.781  28.666  0.36 33.77  ? 101 SER A OG   1 
ATOM   1707 H  H    . SER A 1 101 ? -30.348 14.561  26.628  1.00 37.33  ? 101 SER A H    1 
ATOM   1708 H  HA   . SER A 1 101 ? -28.886 15.888  28.389  1.00 39.40  ? 101 SER A HA   1 
ATOM   1709 H  HB2  . SER A 1 101 ? -31.494 14.873  28.333  1.00 41.30  ? 101 SER A HB2  1 
ATOM   1710 H  HB3  . SER A 1 101 ? -30.880 15.171  29.769  1.00 41.30  ? 101 SER A HB3  1 
ATOM   1711 H  HG   . SER A 1 101 ? -31.917 16.942  28.940  0.62 40.53  ? 101 SER A HG   1 
ATOM   1712 N  N    . SER A 1 102 ? -28.569 12.819  28.515  1.00 31.64  ? 102 SER A N    1 
ATOM   1713 C  CA   A SER A 1 102 ? -28.163 11.639  29.259  0.60 29.50  ? 102 SER A CA   1 
ATOM   1714 C  CA   B SER A 1 102 ? -28.166 11.633  29.259  0.40 29.93  ? 102 SER A CA   1 
ATOM   1715 C  C    . SER A 1 102 ? -26.793 11.092  28.901  1.00 28.69  ? 102 SER A C    1 
ATOM   1716 O  O    . SER A 1 102 ? -26.293 10.222  29.620  1.00 28.29  ? 102 SER A O    1 
ATOM   1717 C  CB   A SER A 1 102 ? -29.224 10.542  29.098  0.60 27.93  ? 102 SER A CB   1 
ATOM   1718 C  CB   B SER A 1 102 ? -29.176 10.491  29.051  0.40 29.87  ? 102 SER A CB   1 
ATOM   1719 O  OG   A SER A 1 102 ? -30.482 11.055  29.544  0.60 27.19  ? 102 SER A OG   1 
ATOM   1720 O  OG   B SER A 1 102 ? -29.094 9.949   27.742  0.40 30.27  ? 102 SER A OG   1 
ATOM   1721 H  H    . SER A 1 102 ? -28.623 12.694  27.666  1.00 37.98  ? 102 SER A H    1 
ATOM   1722 H  HA   . SER A 1 102 ? -28.111 11.871  30.200  1.00 35.93  ? 102 SER A HA   1 
ATOM   1723 H  HB2  A SER A 1 102 ? -29.289 10.288  28.164  0.60 33.53  ? 102 SER A HB2  1 
ATOM   1724 H  HB2  B SER A 1 102 ? -28.990 9.788   29.693  0.40 35.85  ? 102 SER A HB2  1 
ATOM   1725 H  HB3  A SER A 1 102 ? -28.978 9.772   29.634  0.60 33.53  ? 102 SER A HB3  1 
ATOM   1726 H  HB3  B SER A 1 102 ? -30.072 10.837  29.190  0.40 35.85  ? 102 SER A HB3  1 
ATOM   1727 H  HG   A SER A 1 102 ? -30.712 11.706  29.066  0.60 32.64  ? 102 SER A HG   1 
ATOM   1728 H  HG   B SER A 1 102 ? -29.261 10.544  27.174  0.40 36.34  ? 102 SER A HG   1 
ATOM   1729 N  N    . VAL A 1 103 ? -26.169 11.566  27.831  1.00 27.59  ? 103 VAL A N    1 
ATOM   1730 C  CA   . VAL A 1 103 ? -24.859 11.057  27.439  1.00 27.37  ? 103 VAL A CA   1 
ATOM   1731 C  C    . VAL A 1 103 ? -23.912 12.216  27.173  1.00 28.82  ? 103 VAL A C    1 
ATOM   1732 O  O    . VAL A 1 103 ? -24.328 13.357  26.954  1.00 31.02  ? 103 VAL A O    1 
ATOM   1733 C  CB   . VAL A 1 103 ? -24.896 10.111  26.208  1.00 27.10  ? 103 VAL A CB   1 
ATOM   1734 C  CG1  . VAL A 1 103 ? -25.809 8.913   26.487  1.00 28.19  ? 103 VAL A CG1  1 
ATOM   1735 C  CG2  . VAL A 1 103 ? -25.330 10.845  24.911  1.00 28.16  ? 103 VAL A CG2  1 
ATOM   1736 H  H    . VAL A 1 103 ? -26.482 12.180  27.317  1.00 33.12  ? 103 VAL A H    1 
ATOM   1737 H  HA   . VAL A 1 103 ? -24.516 10.551  28.192  1.00 32.86  ? 103 VAL A HA   1 
ATOM   1738 H  HB   . VAL A 1 103 ? -23.994 9.789   26.054  1.00 32.53  ? 103 VAL A HB   1 
ATOM   1739 H  HG11 . VAL A 1 103 ? -26.619 9.227   26.919  1.00 33.84  ? 103 VAL A HG11 1 
ATOM   1740 H  HG12 . VAL A 1 103 ? -26.029 8.481   25.646  1.00 33.84  ? 103 VAL A HG12 1 
ATOM   1741 H  HG13 . VAL A 1 103 ? -25.345 8.290   27.067  1.00 33.84  ? 103 VAL A HG13 1 
ATOM   1742 H  HG21 . VAL A 1 103 ? -25.656 11.729  25.143  1.00 33.80  ? 103 VAL A HG21 1 
ATOM   1743 H  HG22 . VAL A 1 103 ? -24.565 10.919  24.319  1.00 33.80  ? 103 VAL A HG22 1 
ATOM   1744 H  HG23 . VAL A 1 103 ? -26.034 10.335  24.481  1.00 33.80  ? 103 VAL A HG23 1 
ATOM   1745 N  N    . SER A 1 104 ? -22.620 11.900  27.160  1.00 28.17  ? 104 SER A N    1 
ATOM   1746 C  CA   . SER A 1 104 ? -21.581 12.911  27.000  1.00 28.51  ? 104 SER A CA   1 
ATOM   1747 C  C    . SER A 1 104 ? -20.787 12.759  25.703  1.00 27.18  ? 104 SER A C    1 
ATOM   1748 O  O    . SER A 1 104 ? -19.770 13.436  25.531  1.00 31.24  ? 104 SER A O    1 
ATOM   1749 C  CB   . SER A 1 104 ? -20.628 12.917  28.208  1.00 32.14  ? 104 SER A CB   1 
ATOM   1750 O  OG   . SER A 1 104 ? -20.077 11.635  28.463  0.57 33.21  ? 104 SER A OG   1 
ATOM   1751 H  H    . SER A 1 104 ? -22.319 11.099  27.243  1.00 33.81  ? 104 SER A H    1 
ATOM   1752 H  HA   . SER A 1 104 ? -22.020 13.775  26.970  1.00 34.23  ? 104 SER A HA   1 
ATOM   1753 H  HB2  . SER A 1 104 ? -19.903 13.536  28.028  1.00 38.58  ? 104 SER A HB2  1 
ATOM   1754 H  HB3  . SER A 1 104 ? -21.122 13.203  28.992  1.00 38.58  ? 104 SER A HB3  1 
ATOM   1755 H  HG   . SER A 1 104 ? -20.693 11.074  28.574  0.69 39.86  ? 104 SER A HG   1 
ATOM   1756 N  N    . ILE A 1 105 ? -21.199 11.887  24.798  1.00 22.65  ? 105 ILE A N    1 
ATOM   1757 C  CA   . ILE A 1 105 ? -20.500 11.763  23.516  1.00 22.43  ? 105 ILE A CA   1 
ATOM   1758 C  C    . ILE A 1 105 ? -21.237 12.575  22.459  1.00 20.94  ? 105 ILE A C    1 
ATOM   1759 O  O    . ILE A 1 105 ? -22.396 12.960  22.673  1.00 21.92  ? 105 ILE A O    1 
ATOM   1760 C  CB   . ILE A 1 105 ? -20.338 10.297  23.091  1.00 24.04  ? 105 ILE A CB   1 
ATOM   1761 C  CG1  . ILE A 1 105 ? -21.701 9.613   22.928  1.00 22.88  ? 105 ILE A CG1  1 
ATOM   1762 C  CG2  . ILE A 1 105 ? -19.489 9.557   24.119  1.00 25.43  ? 105 ILE A CG2  1 
ATOM   1763 C  CD1  . ILE A 1 105 ? -21.602 8.215   22.246  1.00 23.77  ? 105 ILE A CD1  1 
ATOM   1764 H  H    . ILE A 1 105 ? -21.871 11.360  24.896  1.00 27.19  ? 105 ILE A H    1 
ATOM   1765 H  HA   . ILE A 1 105 ? -19.612 12.140  23.615  1.00 26.93  ? 105 ILE A HA   1 
ATOM   1766 H  HB   . ILE A 1 105 ? -19.893 10.277  22.229  1.00 28.86  ? 105 ILE A HB   1 
ATOM   1767 H  HG12 . ILE A 1 105 ? -22.099 9.492   23.804  1.00 27.47  ? 105 ILE A HG12 1 
ATOM   1768 H  HG13 . ILE A 1 105 ? -22.271 10.174  22.379  1.00 27.47  ? 105 ILE A HG13 1 
ATOM   1769 H  HG21 . ILE A 1 105 ? -19.389 8.633   23.839  1.00 30.52  ? 105 ILE A HG21 1 
ATOM   1770 H  HG22 . ILE A 1 105 ? -18.619 9.981   24.174  1.00 30.52  ? 105 ILE A HG22 1 
ATOM   1771 H  HG23 . ILE A 1 105 ? -19.932 9.595   24.981  1.00 30.52  ? 105 ILE A HG23 1 
ATOM   1772 H  HD11 . ILE A 1 105 ? -22.491 7.836   22.172  1.00 28.54  ? 105 ILE A HD11 1 
ATOM   1773 H  HD12 . ILE A 1 105 ? -21.213 8.321   21.364  1.00 28.54  ? 105 ILE A HD12 1 
ATOM   1774 H  HD13 . ILE A 1 105 ? -21.040 7.639   22.788  1.00 28.54  ? 105 ILE A HD13 1 
ATOM   1775 N  N    . PRO A 1 106 ? -20.627 12.851  21.304  1.00 19.91  ? 106 PRO A N    1 
ATOM   1776 C  CA   . PRO A 1 106 ? -21.279 13.729  20.314  1.00 19.49  ? 106 PRO A CA   1 
ATOM   1777 C  C    . PRO A 1 106 ? -22.543 13.136  19.702  1.00 18.18  ? 106 PRO A C    1 
ATOM   1778 O  O    . PRO A 1 106 ? -22.646 11.921  19.488  1.00 19.42  ? 106 PRO A O    1 
ATOM   1779 C  CB   . PRO A 1 106 ? -20.194 13.939  19.254  1.00 19.67  ? 106 PRO A CB   1 
ATOM   1780 C  CG   . PRO A 1 106 ? -18.914 13.648  19.944  1.00 20.95  ? 106 PRO A CG   1 
ATOM   1781 C  CD   . PRO A 1 106 ? -19.229 12.561  20.944  1.00 20.93  ? 106 PRO A CD   1 
ATOM   1782 H  HA   . PRO A 1 106 ? -21.511 14.570  20.739  1.00 23.40  ? 106 PRO A HA   1 
ATOM   1783 H  HB2  . PRO A 1 106 ? -20.335 13.328  18.514  1.00 23.61  ? 106 PRO A HB2  1 
ATOM   1784 H  HB3  . PRO A 1 106 ? -20.216 14.855  18.937  1.00 23.61  ? 106 PRO A HB3  1 
ATOM   1785 H  HG2  . PRO A 1 106 ? -18.257 13.344  19.299  1.00 25.15  ? 106 PRO A HG2  1 
ATOM   1786 H  HG3  . PRO A 1 106 ? -18.595 14.447  20.392  1.00 25.15  ? 106 PRO A HG3  1 
ATOM   1787 H  HD2  . PRO A 1 106 ? -19.149 11.683  20.540  1.00 25.12  ? 106 PRO A HD2  1 
ATOM   1788 H  HD3  . PRO A 1 106 ? -18.650 12.624  21.720  1.00 25.12  ? 106 PRO A HD3  1 
ATOM   1789 N  N    . ILE A 1 107 ? -23.521 13.999  19.442  1.00 19.83  ? 107 ILE A N    1 
ATOM   1790 C  CA   A ILE A 1 107 ? -24.827 13.584  18.947  0.53 18.77  ? 107 ILE A CA   1 
ATOM   1791 C  CA   B ILE A 1 107 ? -24.831 13.588  18.951  0.47 18.80  ? 107 ILE A CA   1 
ATOM   1792 C  C    . ILE A 1 107 ? -25.129 14.267  17.620  1.00 17.92  ? 107 ILE A C    1 
ATOM   1793 O  O    . ILE A 1 107 ? -25.070 15.500  17.515  1.00 18.54  ? 107 ILE A O    1 
ATOM   1794 C  CB   A ILE A 1 107 ? -25.933 13.899  19.969  0.53 20.16  ? 107 ILE A CB   1 
ATOM   1795 C  CB   B ILE A 1 107 ? -25.930 13.971  19.957  0.47 19.52  ? 107 ILE A CB   1 
ATOM   1796 C  CG1  A ILE A 1 107 ? -25.843 12.919  21.139  0.53 22.09  ? 107 ILE A CG1  1 
ATOM   1797 C  CG1  B ILE A 1 107 ? -25.613 13.449  21.358  0.47 19.39  ? 107 ILE A CG1  1 
ATOM   1798 C  CG2  A ILE A 1 107 ? -27.295 13.858  19.307  0.53 20.79  ? 107 ILE A CG2  1 
ATOM   1799 C  CG2  B ILE A 1 107 ? -27.279 13.452  19.493  0.47 20.71  ? 107 ILE A CG2  1 
ATOM   1800 C  CD1  A ILE A 1 107 ? -26.620 13.342  22.333  0.53 22.96  ? 107 ILE A CD1  1 
ATOM   1801 C  CD1  B ILE A 1 107 ? -25.614 11.945  21.462  0.47 20.14  ? 107 ILE A CD1  1 
ATOM   1802 H  H    . ILE A 1 107 ? -23.445 14.849  19.549  1.00 23.81  ? 107 ILE A H    1 
ATOM   1803 H  HA   . ILE A 1 107 ? -24.796 12.629  18.779  1.00 22.57  ? 107 ILE A HA   1 
ATOM   1804 H  HB   A ILE A 1 107 ? -25.805 14.797  20.313  0.53 24.20  ? 107 ILE A HB   1 
ATOM   1805 H  HB   B ILE A 1 107 ? -25.961 14.940  20.000  0.47 23.44  ? 107 ILE A HB   1 
ATOM   1806 H  HG12 A ILE A 1 107 ? -26.186 12.058  20.852  0.53 26.52  ? 107 ILE A HG12 1 
ATOM   1807 H  HG12 B ILE A 1 107 ? -24.732 13.762  21.615  0.47 23.28  ? 107 ILE A HG12 1 
ATOM   1808 H  HG13 A ILE A 1 107 ? -24.914 12.835  21.405  0.53 26.52  ? 107 ILE A HG13 1 
ATOM   1809 H  HG13 B ILE A 1 107 ? -26.279 13.788  21.975  0.47 23.28  ? 107 ILE A HG13 1 
ATOM   1810 H  HG21 A ILE A 1 107 ? -27.976 13.777  19.992  0.53 24.96  ? 107 ILE A HG21 1 
ATOM   1811 H  HG21 B ILE A 1 107 ? -27.912 13.518  20.225  0.47 24.86  ? 107 ILE A HG21 1 
ATOM   1812 H  HG22 A ILE A 1 107 ? -27.426 14.678  18.805  0.53 24.96  ? 107 ILE A HG22 1 
ATOM   1813 H  HG22 B ILE A 1 107 ? -27.583 13.988  18.744  0.47 24.86  ? 107 ILE A HG22 1 
ATOM   1814 H  HG23 A ILE A 1 107 ? -27.333 13.095  18.710  0.53 24.96  ? 107 ILE A HG23 1 
ATOM   1815 H  HG23 B ILE A 1 107 ? -27.184 12.526  19.220  0.47 24.86  ? 107 ILE A HG23 1 
ATOM   1816 H  HD11 A ILE A 1 107 ? -26.400 12.758  23.075  0.53 27.57  ? 107 ILE A HD11 1 
ATOM   1817 H  HD11 B ILE A 1 107 ? -25.340 11.690  22.357  0.47 24.18  ? 107 ILE A HD11 1 
ATOM   1818 H  HD12 A ILE A 1 107 ? -26.388 14.258  22.553  0.53 27.57  ? 107 ILE A HD12 1 
ATOM   1819 H  HD12 B ILE A 1 107 ? -26.510 11.617  21.284  0.47 24.18  ? 107 ILE A HD12 1 
ATOM   1820 H  HD13 A ILE A 1 107 ? -27.567 13.280  22.132  0.53 27.57  ? 107 ILE A HD13 1 
ATOM   1821 H  HD13 B ILE A 1 107 ? -24.994 11.583  20.810  0.47 24.18  ? 107 ILE A HD13 1 
ATOM   1822 N  N    . LEU A 1 108 ? -25.540 13.470  16.639  1.00 16.26  ? 108 LEU A N    1 
ATOM   1823 C  CA   . LEU A 1 108 ? -25.986 13.941  15.335  1.00 16.03  ? 108 LEU A CA   1 
ATOM   1824 C  C    . LEU A 1 108 ? -27.499 13.795  15.294  1.00 15.97  ? 108 LEU A C    1 
ATOM   1825 O  O    . LEU A 1 108 ? -28.027 12.719  15.579  1.00 17.59  ? 108 LEU A O    1 
ATOM   1826 C  CB   . LEU A 1 108 ? -25.320 13.109  14.225  1.00 18.78  ? 108 LEU A CB   1 
ATOM   1827 C  CG   . LEU A 1 108 ? -25.693 13.544  12.796  1.00 21.80  ? 108 LEU A CG   1 
ATOM   1828 C  CD1  . LEU A 1 108 ? -24.531 13.403  11.852  1.00 25.36  ? 108 LEU A CD1  1 
ATOM   1829 C  CD2  . LEU A 1 108 ? -26.875 12.733  12.360  1.00 21.70  ? 108 LEU A CD2  1 
ATOM   1830 H  H    . LEU A 1 108 ? -25.569 12.613  16.709  1.00 19.53  ? 108 LEU A H    1 
ATOM   1831 H  HA   . LEU A 1 108 ? -25.756 14.872  15.189  1.00 19.25  ? 108 LEU A HA   1 
ATOM   1832 H  HB2  . LEU A 1 108 ? -24.358 13.188  14.315  1.00 22.55  ? 108 LEU A HB2  1 
ATOM   1833 H  HB3  . LEU A 1 108 ? -25.588 12.183  14.331  1.00 22.55  ? 108 LEU A HB3  1 
ATOM   1834 H  HG   . LEU A 1 108 ? -25.927 14.485  12.776  1.00 26.18  ? 108 LEU A HG   1 
ATOM   1835 H  HD11 . LEU A 1 108 ? -24.805 13.695  10.968  1.00 30.44  ? 108 LEU A HD11 1 
ATOM   1836 H  HD12 . LEU A 1 108 ? -23.798 13.951  12.169  1.00 30.44  ? 108 LEU A HD12 1 
ATOM   1837 H  HD13 . LEU A 1 108 ? -24.260 12.472  11.822  1.00 30.44  ? 108 LEU A HD13 1 
ATOM   1838 H  HD21 . LEU A 1 108 ? -27.062 12.922  11.427  1.00 26.06  ? 108 LEU A HD21 1 
ATOM   1839 H  HD22 . LEU A 1 108 ? -26.670 11.791  12.471  1.00 26.06  ? 108 LEU A HD22 1 
ATOM   1840 H  HD23 . LEU A 1 108 ? -27.641 12.972  12.905  1.00 26.06  ? 108 LEU A HD23 1 
ATOM   1841 N  N    . MET A 1 109 ? -28.190 14.877  14.954  1.00 16.03  ? 109 MET A N    1 
ATOM   1842 C  CA   A MET A 1 109 ? -29.613 14.826  14.676  0.82 15.93  ? 109 MET A CA   1 
ATOM   1843 C  CA   B MET A 1 109 ? -29.617 14.817  14.687  0.18 16.21  ? 109 MET A CA   1 
ATOM   1844 C  C    . MET A 1 109 ? -29.798 14.477  13.209  1.00 16.46  ? 109 MET A C    1 
ATOM   1845 O  O    . MET A 1 109 ? -29.277 15.181  12.334  1.00 18.07  ? 109 MET A O    1 
ATOM   1846 C  CB   A MET A 1 109 ? -30.272 16.177  14.940  0.82 16.33  ? 109 MET A CB   1 
ATOM   1847 C  CB   B MET A 1 109 ? -30.256 16.151  15.036  0.18 16.52  ? 109 MET A CB   1 
ATOM   1848 C  CG   A MET A 1 109 ? -31.782 16.093  14.766  0.82 18.40  ? 109 MET A CG   1 
ATOM   1849 C  CG   B MET A 1 109 ? -31.679 16.272  14.577  0.18 16.83  ? 109 MET A CG   1 
ATOM   1850 S  SD   A MET A 1 109 ? -32.727 17.559  15.143  0.82 18.91  ? 109 MET A SD   1 
ATOM   1851 S  SD   B MET A 1 109 ? -31.756 17.217  13.048  0.18 17.52  ? 109 MET A SD   1 
ATOM   1852 C  CE   A MET A 1 109 ? -33.059 18.138  13.502  0.82 19.68  ? 109 MET A CE   1 
ATOM   1853 C  CE   B MET A 1 109 ? -33.318 18.060  13.310  0.18 17.83  ? 109 MET A CE   1 
ATOM   1854 H  H    A MET A 1 109 ? -27.850 15.663  14.877  0.82 19.24  ? 109 MET A H    1 
ATOM   1855 H  H    B MET A 1 109 ? -27.851 15.663  14.871  0.18 19.24  ? 109 MET A H    1 
ATOM   1856 H  HA   A MET A 1 109 ? -30.035 14.175  15.258  0.82 19.13  ? 109 MET A HA   1 
ATOM   1857 H  HA   B MET A 1 109 ? -30.063 14.150  15.233  0.18 19.46  ? 109 MET A HA   1 
ATOM   1858 H  HB2  A MET A 1 109 ? -30.082 16.456  15.849  0.82 19.61  ? 109 MET A HB2  1 
ATOM   1859 H  HB2  B MET A 1 109 ? -30.244 16.261  15.999  0.18 19.84  ? 109 MET A HB2  1 
ATOM   1860 H  HB3  A MET A 1 109 ? -29.926 16.832  14.313  0.82 19.61  ? 109 MET A HB3  1 
ATOM   1861 H  HB3  B MET A 1 109 ? -29.747 16.860  14.614  0.18 19.84  ? 109 MET A HB3  1 
ATOM   1862 H  HG2  A MET A 1 109 ? -31.965 15.871  13.840  0.82 22.09  ? 109 MET A HG2  1 
ATOM   1863 H  HG2  B MET A 1 109 ? -32.047 15.389  14.417  0.18 20.21  ? 109 MET A HG2  1 
ATOM   1864 H  HG3  A MET A 1 109 ? -32.111 15.389  15.347  0.82 22.09  ? 109 MET A HG3  1 
ATOM   1865 H  HG3  B MET A 1 109 ? -32.202 16.731  15.253  0.18 20.21  ? 109 MET A HG3  1 
ATOM   1866 H  HE1  A MET A 1 109 ? -33.578 18.955  13.555  0.82 23.63  ? 109 MET A HE1  1 
ATOM   1867 H  HE1  B MET A 1 109 ? -33.255 18.598  14.115  0.18 21.40  ? 109 MET A HE1  1 
ATOM   1868 H  HE2  A MET A 1 109 ? -32.217 18.308  13.051  0.82 23.63  ? 109 MET A HE2  1 
ATOM   1869 H  HE2  B MET A 1 109 ? -33.503 18.628  12.546  0.18 21.40  ? 109 MET A HE2  1 
ATOM   1870 H  HE3  A MET A 1 109 ? -33.559 17.459  13.023  0.82 23.63  ? 109 MET A HE3  1 
ATOM   1871 H  HE3  B MET A 1 109 ? -34.021 17.399  13.409  0.18 21.40  ? 109 MET A HE3  1 
HETATM 1872 C  C    . HQA A 1 110 ? -32.226 13.073  11.258  1.00 15.94  ? 110 HQA A C    1 
HETATM 1873 O  O    . HQA A 1 110 ? -33.108 12.491  11.897  1.00 16.63  ? 110 HQA A O    1 
HETATM 1874 C  CA   . HQA A 1 110 ? -30.767 12.936  11.557  1.00 15.67  ? 110 HQA A CA   1 
HETATM 1875 N  N    . HQA A 1 110 ? -30.506 13.375  12.929  1.00 15.88  ? 110 HQA A N    1 
HETATM 1876 C  C03  . HQA A 1 110 ? -30.309 11.475  11.387  1.00 16.55  ? 110 HQA A C03  1 
HETATM 1877 C  C04  . HQA A 1 110 ? -30.431 10.902  10.015  1.00 20.11  ? 110 HQA A C04  1 
HETATM 1878 C  C05  . HQA A 1 110 ? -29.240 10.587  9.287   1.00 21.82  ? 110 HQA A C05  1 
HETATM 1879 N  N06  . HQA A 1 110 ? -29.208 10.050  8.044   1.00 22.48  ? 110 HQA A N06  1 
HETATM 1880 C  C07  . HQA A 1 110 ? -30.419 9.775   7.435   1.00 25.27  ? 110 HQA A C07  1 
HETATM 1881 C  C08  . HQA A 1 110 ? -30.463 9.191   6.122   1.00 28.54  ? 110 HQA A C08  1 
HETATM 1882 O  O09  . HQA A 1 110 ? -29.343 8.848   5.437   1.00 29.27  ? 110 HQA A O09  1 
HETATM 1883 C  C10  . HQA A 1 110 ? -31.670 8.929   5.495   1.00 31.03  ? 110 HQA A C10  1 
HETATM 1884 C  C11  . HQA A 1 110 ? -32.871 9.250   6.145   1.00 32.19  ? 110 HQA A C11  1 
HETATM 1885 C  C12  . HQA A 1 110 ? -32.879 9.807   7.400   1.00 30.15  ? 110 HQA A C12  1 
HETATM 1886 C  C13  . HQA A 1 110 ? -31.658 10.081  8.069   1.00 24.49  ? 110 HQA A C13  1 
HETATM 1887 C  C14  . HQA A 1 110 ? -31.631 10.664  9.379   1.00 22.65  ? 110 HQA A C14  1 
HETATM 1888 H  HA   . HQA A 1 110 ? -30.273 13.586  10.771  1.00 18.81  ? 110 HQA A HA   1 
HETATM 1889 H  H03  . HQA A 1 110 ? -30.911 10.842  12.093  1.00 19.87  ? 110 HQA A H03  1 
HETATM 1890 H  H03A . HQA A 1 110 ? -29.235 11.412  11.706  1.00 19.87  ? 110 HQA A H03A 1 
HETATM 1891 H  H05  . HQA A 1 110 ? -28.257 10.789  9.751   1.00 26.20  ? 110 HQA A H05  1 
HETATM 1892 H  H10  . HQA A 1 110 ? -31.678 8.472   4.494   1.00 37.25  ? 110 HQA A H10  1 
HETATM 1893 H  H11  . HQA A 1 110 ? -33.819 9.045   5.624   1.00 38.64  ? 110 HQA A H11  1 
HETATM 1894 H  H12  . HQA A 1 110 ? -33.827 10.047  7.904   1.00 36.20  ? 110 HQA A H12  1 
HETATM 1895 H  H14  . HQA A 1 110 ? -32.588 10.916  9.862   1.00 27.20  ? 110 HQA A H14  1 
ATOM   1896 N  N    . ASP A 1 111 ? -32.477 13.898  10.233  1.00 16.36  ? 111 ASP A N    1 
ATOM   1897 C  CA   . ASP A 1 111 ? -33.823 14.248  9.788   1.00 16.85  ? 111 ASP A CA   1 
ATOM   1898 C  C    . ASP A 1 111 ? -33.690 14.734  8.346   1.00 16.95  ? 111 ASP A C    1 
ATOM   1899 O  O    . ASP A 1 111 ? -32.633 14.567  7.732   1.00 18.19  ? 111 ASP A O    1 
ATOM   1900 C  CB   . ASP A 1 111 ? -34.388 15.317  10.724  1.00 16.47  ? 111 ASP A CB   1 
ATOM   1901 C  CG   . ASP A 1 111 ? -35.922 15.299  10.825  1.00 17.81  ? 111 ASP A CG   1 
ATOM   1902 O  OD1  . ASP A 1 111 ? -36.601 15.056  9.802   1.00 19.29  ? 111 ASP A OD1  1 
ATOM   1903 O  OD2  . ASP A 1 111 ? -36.430 15.587  11.940  1.00 18.93  ? 111 ASP A OD2  1 
ATOM   1904 H  H    . ASP A 1 111 ? -31.863 14.279  9.767   1.00 19.65  ? 111 ASP A H    1 
ATOM   1905 H  HA   . ASP A 1 111 ? -34.452 13.510  9.812   1.00 20.23  ? 111 ASP A HA   1 
ATOM   1906 H  HB2  . ASP A 1 111 ? -34.031 15.173  11.615  1.00 19.77  ? 111 ASP A HB2  1 
ATOM   1907 H  HB3  . ASP A 1 111 ? -34.123 16.191  10.397  1.00 19.77  ? 111 ASP A HB3  1 
ATOM   1908 N  N    . PHE A 1 112 ? -34.757 15.330  7.823   1.00 17.41  ? 112 PHE A N    1 
ATOM   1909 C  CA   . PHE A 1 112 ? -34.805 15.862  6.462   1.00 16.42  ? 112 PHE A CA   1 
ATOM   1910 C  C    . PHE A 1 112 ? -34.854 17.380  6.616   1.00 16.41  ? 112 PHE A C    1 
ATOM   1911 O  O    . PHE A 1 112 ? -35.914 17.997  6.648   1.00 17.75  ? 112 PHE A O    1 
ATOM   1912 C  CB   . PHE A 1 112 ? -35.962 15.259  5.732   1.00 18.96  ? 112 PHE A CB   1 
ATOM   1913 C  CG   . PHE A 1 112 ? -35.853 13.768  5.608   1.00 20.59  ? 112 PHE A CG   1 
ATOM   1914 C  CD1  . PHE A 1 112 ? -36.201 12.943  6.656   1.00 21.36  ? 112 PHE A CD1  1 
ATOM   1915 C  CD2  . PHE A 1 112 ? -35.300 13.205  4.481   1.00 21.73  ? 112 PHE A CD2  1 
ATOM   1916 C  CE1  . PHE A 1 112 ? -36.049 11.579  6.569   1.00 23.66  ? 112 PHE A CE1  1 
ATOM   1917 C  CE2  . PHE A 1 112 ? -35.200 11.838  4.363   1.00 23.38  ? 112 PHE A CE2  1 
ATOM   1918 C  CZ   . PHE A 1 112 ? -35.542 11.018  5.429   1.00 24.18  ? 112 PHE A CZ   1 
ATOM   1919 H  H    . PHE A 1 112 ? -35.494 15.442  8.252   1.00 20.90  ? 112 PHE A H    1 
ATOM   1920 H  HA   . PHE A 1 112 ? -34.012 15.653  5.942   1.00 19.71  ? 112 PHE A HA   1 
ATOM   1921 H  HB2  . PHE A 1 112 ? -36.780 15.461  6.213   1.00 22.76  ? 112 PHE A HB2  1 
ATOM   1922 H  HB3  . PHE A 1 112 ? -36.002 15.633  4.838   1.00 22.76  ? 112 PHE A HB3  1 
ATOM   1923 H  HD1  . PHE A 1 112 ? -36.546 13.315  7.436   1.00 25.65  ? 112 PHE A HD1  1 
ATOM   1924 H  HD2  . PHE A 1 112 ? -34.993 13.752  3.795   1.00 26.09  ? 112 PHE A HD2  1 
ATOM   1925 H  HE1  . PHE A 1 112 ? -36.290 11.038  7.286   1.00 28.40  ? 112 PHE A HE1  1 
ATOM   1926 H  HE2  . PHE A 1 112 ? -34.902 11.462  3.566   1.00 28.07  ? 112 PHE A HE2  1 
ATOM   1927 H  HZ   . PHE A 1 112 ? -35.428 10.097  5.369   1.00 29.03  ? 112 PHE A HZ   1 
ATOM   1928 N  N    . ILE A 1 113 ? -33.679 17.977  6.737   1.00 17.11  ? 113 ILE A N    1 
ATOM   1929 C  CA   . ILE A 1 113 ? -33.562 19.400  7.050   1.00 17.66  ? 113 ILE A CA   1 
ATOM   1930 C  C    . ILE A 1 113 ? -33.742 20.219  5.783   1.00 18.88  ? 113 ILE A C    1 
ATOM   1931 O  O    . ILE A 1 113 ? -32.960 20.101  4.823   1.00 19.33  ? 113 ILE A O    1 
ATOM   1932 C  CB   . ILE A 1 113 ? -32.229 19.714  7.749   1.00 18.54  ? 113 ILE A CB   1 
ATOM   1933 C  CG1  . ILE A 1 113 ? -32.224 19.023  9.110   1.00 21.04  ? 113 ILE A CG1  1 
ATOM   1934 C  CG2  . ILE A 1 113 ? -32.032 21.210  7.898   1.00 18.90  ? 113 ILE A CG2  1 
ATOM   1935 C  CD1  . ILE A 1 113 ? -31.102 19.371  10.027  1.00 23.28  ? 113 ILE A CD1  1 
ATOM   1936 H  H    . ILE A 1 113 ? -32.923 17.579  6.642   1.00 20.54  ? 113 ILE A H    1 
ATOM   1937 H  HA   . ILE A 1 113 ? -34.281 19.642  7.654   1.00 21.21  ? 113 ILE A HA   1 
ATOM   1938 H  HB   . ILE A 1 113 ? -31.494 19.381  7.211   1.00 22.26  ? 113 ILE A HB   1 
ATOM   1939 H  HG12 . ILE A 1 113 ? -33.047 19.255  9.569   1.00 25.26  ? 113 ILE A HG12 1 
ATOM   1940 H  HG13 . ILE A 1 113 ? -32.185 18.066  8.962   1.00 25.26  ? 113 ILE A HG13 1 
ATOM   1941 H  HG21 . ILE A 1 113 ? -31.225 21.373  8.411   1.00 22.70  ? 113 ILE A HG21 1 
ATOM   1942 H  HG22 . ILE A 1 113 ? -31.949 21.607  7.016   1.00 22.70  ? 113 ILE A HG22 1 
ATOM   1943 H  HG23 . ILE A 1 113 ? -32.798 21.586  8.358   1.00 22.70  ? 113 ILE A HG23 1 
ATOM   1944 H  HD11 . ILE A 1 113 ? -31.251 20.260  10.385  1.00 27.94  ? 113 ILE A HD11 1 
ATOM   1945 H  HD12 . ILE A 1 113 ? -31.072 18.724  10.749  1.00 27.94  ? 113 ILE A HD12 1 
ATOM   1946 H  HD13 . ILE A 1 113 ? -30.270 19.349  9.529   1.00 27.94  ? 113 ILE A HD13 1 
ATOM   1947 N  N    . VAL A 1 114 ? -34.778 21.053  5.781   1.00 18.98  ? 114 VAL A N    1 
ATOM   1948 C  CA   . VAL A 1 114 ? -35.088 21.886  4.627   1.00 20.56  ? 114 VAL A CA   1 
ATOM   1949 C  C    . VAL A 1 114 ? -35.231 23.355  5.002   1.00 19.92  ? 114 VAL A C    1 
ATOM   1950 O  O    . VAL A 1 114 ? -35.401 24.200  4.118   1.00 23.36  ? 114 VAL A O    1 
ATOM   1951 C  CB   . VAL A 1 114 ? -36.354 21.380  3.911   1.00 22.54  ? 114 VAL A CB   1 
ATOM   1952 C  CG1  . VAL A 1 114 ? -36.130 20.030  3.282   1.00 23.10  ? 114 VAL A CG1  1 
ATOM   1953 C  CG2  . VAL A 1 114 ? -37.547 21.325  4.888   1.00 24.34  ? 114 VAL A CG2  1 
ATOM   1954 H  H    . VAL A 1 114 ? -35.319 21.155  6.442   1.00 22.79  ? 114 VAL A H    1 
ATOM   1955 H  HA   . VAL A 1 114 ? -34.330 21.832  4.024   1.00 24.69  ? 114 VAL A HA   1 
ATOM   1956 H  HB   . VAL A 1 114 ? -36.566 22.005  3.200   1.00 27.06  ? 114 VAL A HB   1 
ATOM   1957 H  HG11 . VAL A 1 114 ? -35.277 19.679  3.582   1.00 27.73  ? 114 VAL A HG11 1 
ATOM   1958 H  HG12 . VAL A 1 114 ? -36.846 19.433  3.550   1.00 27.73  ? 114 VAL A HG12 1 
ATOM   1959 H  HG13 . VAL A 1 114 ? -36.126 20.128  2.317   1.00 27.73  ? 114 VAL A HG13 1 
ATOM   1960 H  HG21 . VAL A 1 114 ? -37.431 22.008  5.567   1.00 29.22  ? 114 VAL A HG21 1 
ATOM   1961 H  HG22 . VAL A 1 114 ? -38.367 21.484  4.395   1.00 29.22  ? 114 VAL A HG22 1 
ATOM   1962 H  HG23 . VAL A 1 114 ? -37.576 20.449  5.303   1.00 29.22  ? 114 VAL A HG23 1 
ATOM   1963 N  N    . LYS A 1 115 ? -35.175 23.673  6.297   1.00 20.00  ? 115 LYS A N    1 
ATOM   1964 C  CA   . LYS A 1 115 ? -35.335 25.051  6.743   1.00 20.35  ? 115 LYS A CA   1 
ATOM   1965 C  C    . LYS A 1 115 ? -34.470 25.304  7.969   1.00 19.02  ? 115 LYS A C    1 
ATOM   1966 O  O    . LYS A 1 115 ? -34.153 24.393  8.734   1.00 19.25  ? 115 LYS A O    1 
ATOM   1967 C  CB   . LYS A 1 115 ? -36.806 25.396  7.029   1.00 21.25  ? 115 LYS A CB   1 
ATOM   1968 C  CG   . LYS A 1 115 ? -37.454 24.554  8.133   1.00 21.31  ? 115 LYS A CG   1 
ATOM   1969 C  CD   . LYS A 1 115 ? -38.933 24.935  8.352   1.00 20.99  ? 115 LYS A CD   1 
ATOM   1970 C  CE   . LYS A 1 115 ? -39.597 24.045  9.385   1.00 21.06  ? 115 LYS A CE   1 
ATOM   1971 N  NZ   . LYS A 1 115 ? -40.913 24.587  9.841   1.00 23.05  ? 115 LYS A NZ   1 
ATOM   1972 H  H    . LYS A 1 115 ? -35.046 23.108  6.933   1.00 24.01  ? 115 LYS A H    1 
ATOM   1973 H  HA   . LYS A 1 115 ? -35.019 25.641  6.041   1.00 24.43  ? 115 LYS A HA   1 
ATOM   1974 H  HB2  . LYS A 1 115 ? -36.858 26.326  7.301   1.00 25.51  ? 115 LYS A HB2  1 
ATOM   1975 H  HB3  . LYS A 1 115 ? -37.318 25.259  6.217   1.00 25.51  ? 115 LYS A HB3  1 
ATOM   1976 H  HG2  . LYS A 1 115 ? -37.415 23.617  7.886   1.00 25.58  ? 115 LYS A HG2  1 
ATOM   1977 H  HG3  . LYS A 1 115 ? -36.977 24.697  8.966   1.00 25.58  ? 115 LYS A HG3  1 
ATOM   1978 H  HD2  . LYS A 1 115 ? -38.984 25.852  8.663   1.00 25.20  ? 115 LYS A HD2  1 
ATOM   1979 H  HD3  . LYS A 1 115 ? -39.415 24.841  7.516   1.00 25.20  ? 115 LYS A HD3  1 
ATOM   1980 H  HE2  . LYS A 1 115 ? -39.749 23.169  8.999   1.00 25.28  ? 115 LYS A HE2  1 
ATOM   1981 H  HE3  . LYS A 1 115 ? -39.017 23.971  10.160  1.00 25.28  ? 115 LYS A HE3  1 
ATOM   1982 H  HZ1  . LYS A 1 115 ? -41.465 24.668  9.148   1.00 27.68  ? 115 LYS A HZ1  1 
ATOM   1983 H  HZ2  . LYS A 1 115 ? -41.278 24.037  10.438  1.00 27.68  ? 115 LYS A HZ2  1 
ATOM   1984 H  HZ3  . LYS A 1 115 ? -40.800 25.386  10.215  1.00 27.68  ? 115 LYS A HZ3  1 
ATOM   1985 N  N    . GLU A 1 116 ? -34.127 26.577  8.165   1.00 19.08  ? 116 GLU A N    1 
ATOM   1986 C  CA   . GLU A 1 116 ? -33.213 26.954  9.239   1.00 20.04  ? 116 GLU A CA   1 
ATOM   1987 C  C    . GLU A 1 116 ? -33.745 26.587  10.612  1.00 19.41  ? 116 GLU A C    1 
ATOM   1988 O  O    . GLU A 1 116 ? -32.959 26.245  11.494  1.00 19.12  ? 116 GLU A O    1 
ATOM   1989 C  CB   . GLU A 1 116 ? -32.924 28.455  9.169   1.00 22.76  ? 116 GLU A CB   1 
ATOM   1990 C  CG   . GLU A 1 116 ? -32.000 28.786  7.997   1.00 25.05  ? 116 GLU A CG   1 
ATOM   1991 C  CD   . GLU A 1 116 ? -31.733 30.260  7.790   1.00 29.46  ? 116 GLU A CD   1 
ATOM   1992 O  OE1  . GLU A 1 116 ? -32.343 31.111  8.480   1.00 32.23  ? 116 GLU A OE1  1 
ATOM   1993 O  OE2  . GLU A 1 116 ? -30.924 30.574  6.885   1.00 32.12  ? 116 GLU A OE2  1 
ATOM   1994 H  H    . GLU A 1 116 ? -34.408 27.239  7.692   1.00 22.91  ? 116 GLU A H    1 
ATOM   1995 H  HA   . GLU A 1 116 ? -32.385 26.466  9.111   1.00 24.06  ? 116 GLU A HA   1 
ATOM   1996 H  HB2  . GLU A 1 116 ? -33.756 28.938  9.049   1.00 27.33  ? 116 GLU A HB2  1 
ATOM   1997 H  HB3  . GLU A 1 116 ? -32.491 28.738  9.990   1.00 27.33  ? 116 GLU A HB3  1 
ATOM   1998 H  HG2  . GLU A 1 116 ? -31.145 28.354  8.148   1.00 30.07  ? 116 GLU A HG2  1 
ATOM   1999 H  HG3  . GLU A 1 116 ? -32.404 28.447  7.182   1.00 30.07  ? 116 GLU A HG3  1 
ATOM   2000 N  N    . SER A 1 117 ? -35.065 26.666  10.830  1.00 19.36  ? 117 SER A N    1 
ATOM   2001 C  CA   . SER A 1 117 ? -35.560 26.391  12.174  1.00 18.60  ? 117 SER A CA   1 
ATOM   2002 C  C    . SER A 1 117 ? -35.298 24.958  12.613  1.00 17.20  ? 117 SER A C    1 
ATOM   2003 O  O    . SER A 1 117 ? -35.232 24.701  13.813  1.00 17.54  ? 117 SER A O    1 
ATOM   2004 C  CB   . SER A 1 117 ? -37.036 26.707  12.313  1.00 19.56  ? 117 SER A CB   1 
ATOM   2005 O  OG   . SER A 1 117 ? -37.836 25.838  11.565  1.00 21.95  ? 117 SER A OG   1 
ATOM   2006 H  H    . SER A 1 117 ? -35.661 26.866  10.243  1.00 23.25  ? 117 SER A H    1 
ATOM   2007 H  HA   . SER A 1 117 ? -35.088 26.987  12.775  1.00 22.33  ? 117 SER A HA   1 
ATOM   2008 H  HB2  . SER A 1 117 ? -37.283 26.629  13.248  1.00 23.48  ? 117 SER A HB2  1 
ATOM   2009 H  HB3  . SER A 1 117 ? -37.190 27.613  12.004  1.00 23.48  ? 117 SER A HB3  1 
ATOM   2010 H  HG   . SER A 1 117 ? -38.647 26.031  11.672  1.00 26.35  ? 117 SER A HG   1 
ATOM   2011 N  N    . GLN A 1 118 ? -35.108 24.020  11.682  1.00 17.09  ? 118 GLN A N    1 
ATOM   2012 C  CA   . GLN A 1 118 ? -34.770 22.661  12.100  1.00 16.88  ? 118 GLN A CA   1 
ATOM   2013 C  C    . GLN A 1 118 ? -33.341 22.568  12.622  1.00 16.23  ? 118 GLN A C    1 
ATOM   2014 O  O    . GLN A 1 118 ? -33.044 21.716  13.464  1.00 17.40  ? 118 GLN A O    1 
ATOM   2015 C  CB   . GLN A 1 118 ? -34.950 21.701  10.923  1.00 17.23  ? 118 GLN A CB   1 
ATOM   2016 C  CG   . GLN A 1 118 ? -36.383 21.501  10.468  1.00 17.50  ? 118 GLN A CG   1 
ATOM   2017 C  CD   . GLN A 1 118 ? -36.423 20.739  9.139   1.00 17.02  ? 118 GLN A CD   1 
ATOM   2018 O  OE1  . GLN A 1 118 ? -36.275 21.320  8.069   1.00 18.82  ? 118 GLN A OE1  1 
ATOM   2019 N  NE2  . GLN A 1 118 ? -36.577 19.427  9.214   1.00 17.72  ? 118 GLN A NE2  1 
ATOM   2020 H  H    . GLN A 1 118 ? -35.168 24.140  10.833  1.00 20.52  ? 118 GLN A H    1 
ATOM   2021 H  HA   . GLN A 1 118 ? -35.370 22.396  12.815  1.00 20.26  ? 118 GLN A HA   1 
ATOM   2022 H  HB2  . GLN A 1 118 ? -34.451 22.046  10.166  1.00 20.68  ? 118 GLN A HB2  1 
ATOM   2023 H  HB3  . GLN A 1 118 ? -34.604 20.832  11.180  1.00 20.68  ? 118 GLN A HB3  1 
ATOM   2024 H  HG2  . GLN A 1 118 ? -36.867 20.988  11.134  1.00 21.01  ? 118 GLN A HG2  1 
ATOM   2025 H  HG3  . GLN A 1 118 ? -36.807 22.365  10.342  1.00 21.01  ? 118 GLN A HG3  1 
ATOM   2026 H  HE21 . GLN A 1 118 ? -36.648 19.045  9.981   1.00 21.27  ? 118 GLN A HE21 1 
ATOM   2027 H  HE22 . GLN A 1 118 ? -36.606 18.956  8.495   1.00 21.27  ? 118 GLN A HE22 1 
ATOM   2028 N  N    . ILE A 1 119 ? -32.445 23.428  12.126  1.00 16.62  ? 119 ILE A N    1 
ATOM   2029 C  CA   . ILE A 1 119 ? -31.117 23.522  12.721  1.00 17.54  ? 119 ILE A CA   1 
ATOM   2030 C  C    . ILE A 1 119 ? -31.207 24.181  14.095  1.00 18.43  ? 119 ILE A C    1 
ATOM   2031 O  O    . ILE A 1 119 ? -30.545 23.752  15.051  1.00 18.22  ? 119 ILE A O    1 
ATOM   2032 C  CB   . ILE A 1 119 ? -30.142 24.258  11.784  1.00 17.74  ? 119 ILE A CB   1 
ATOM   2033 C  CG1  . ILE A 1 119 ? -29.957 23.417  10.511  1.00 18.97  ? 119 ILE A CG1  1 
ATOM   2034 C  CG2  . ILE A 1 119 ? -28.809 24.467  12.482  1.00 19.05  ? 119 ILE A CG2  1 
ATOM   2035 C  CD1  . ILE A 1 119 ? -29.167 24.081  9.356   1.00 19.80  ? 119 ILE A CD1  1 
ATOM   2036 H  H    . ILE A 1 119 ? -32.582 23.955  11.459  1.00 19.96  ? 119 ILE A H    1 
ATOM   2037 H  HA   . ILE A 1 119 ? -30.769 22.625  12.840  1.00 21.06  ? 119 ILE A HA   1 
ATOM   2038 H  HB   . ILE A 1 119 ? -30.502 25.127  11.549  1.00 21.30  ? 119 ILE A HB   1 
ATOM   2039 H  HG12 . ILE A 1 119 ? -29.483 22.606  10.752  1.00 22.78  ? 119 ILE A HG12 1 
ATOM   2040 H  HG13 . ILE A 1 119 ? -30.836 23.197  10.165  1.00 22.78  ? 119 ILE A HG13 1 
ATOM   2041 H  HG21 . ILE A 1 119 ? -28.153 24.758  11.829  1.00 22.87  ? 119 ILE A HG21 1 
ATOM   2042 H  HG22 . ILE A 1 119 ? -28.915 25.144  13.168  1.00 22.87  ? 119 ILE A HG22 1 
ATOM   2043 H  HG23 . ILE A 1 119 ? -28.528 23.630  12.883  1.00 22.87  ? 119 ILE A HG23 1 
ATOM   2044 H  HD11 . ILE A 1 119 ? -29.214 23.511  8.573   1.00 23.77  ? 119 ILE A HD11 1 
ATOM   2045 H  HD12 . ILE A 1 119 ? -29.560 24.946  9.160   1.00 23.77  ? 119 ILE A HD12 1 
ATOM   2046 H  HD13 . ILE A 1 119 ? -28.243 24.192  9.629   1.00 23.77  ? 119 ILE A HD13 1 
ATOM   2047 N  N    . ASP A 1 120 ? -32.028 25.233  14.222  1.00 17.00  ? 120 ASP A N    1 
ATOM   2048 C  CA   . ASP A 1 120 ? -32.290 25.806  15.542  1.00 18.36  ? 120 ASP A CA   1 
ATOM   2049 C  C    . ASP A 1 120 ? -32.767 24.722  16.500  1.00 18.45  ? 120 ASP A C    1 
ATOM   2050 O  O    . ASP A 1 120 ? -32.338 24.670  17.669  1.00 18.67  ? 120 ASP A O    1 
ATOM   2051 C  CB   . ASP A 1 120 ? -33.366 26.897  15.496  1.00 18.80  ? 120 ASP A CB   1 
ATOM   2052 C  CG   . ASP A 1 120 ? -33.007 28.084  14.640  1.00 20.00  ? 120 ASP A CG   1 
ATOM   2053 O  OD1  . ASP A 1 120 ? -31.819 28.337  14.387  1.00 21.77  ? 120 ASP A OD1  1 
ATOM   2054 O  OD2  . ASP A 1 120 ? -33.963 28.787  14.251  1.00 22.81  ? 120 ASP A OD2  1 
ATOM   2055 H  H    . ASP A 1 120 ? -32.435 25.622  13.572  1.00 20.41  ? 120 ASP A H    1 
ATOM   2056 H  HA   . ASP A 1 120 ? -31.465 26.212  15.850  1.00 22.05  ? 120 ASP A HA   1 
ATOM   2057 H  HB2  . ASP A 1 120 ? -34.182 26.513  15.138  1.00 22.57  ? 120 ASP A HB2  1 
ATOM   2058 H  HB3  . ASP A 1 120 ? -33.520 27.221  16.397  1.00 22.57  ? 120 ASP A HB3  1 
ATOM   2059 N  N    . ASP A 1 121 ? -33.675 23.856  16.023  1.00 18.47  ? 121 ASP A N    1 
ATOM   2060 C  CA   . ASP A 1 121 ? -34.227 22.797  16.858  1.00 17.79  ? 121 ASP A CA   1 
ATOM   2061 C  C    . ASP A 1 121 ? -33.120 21.857  17.326  1.00 18.39  ? 121 ASP A C    1 
ATOM   2062 O  O    . ASP A 1 121 ? -33.028 21.533  18.509  1.00 18.73  ? 121 ASP A O    1 
ATOM   2063 C  CB   . ASP A 1 121 ? -35.295 22.021  16.082  1.00 18.20  ? 121 ASP A CB   1 
ATOM   2064 C  CG   . ASP A 1 121 ? -36.536 22.845  15.758  1.00 19.84  ? 121 ASP A CG   1 
ATOM   2065 O  OD1  . ASP A 1 121 ? -36.810 23.844  16.461  1.00 19.56  ? 121 ASP A OD1  1 
ATOM   2066 O  OD2  . ASP A 1 121 ? -37.276 22.432  14.815  1.00 19.36  ? 121 ASP A OD2  1 
ATOM   2067 H  H    . ASP A 1 121 ? -33.983 23.866  15.221  1.00 22.18  ? 121 ASP A H    1 
ATOM   2068 H  HA   . ASP A 1 121 ? -34.648 23.193  17.637  1.00 21.36  ? 121 ASP A HA   1 
ATOM   2069 H  HB2  . ASP A 1 121 ? -34.914 21.718  15.243  1.00 21.85  ? 121 ASP A HB2  1 
ATOM   2070 H  HB3  . ASP A 1 121 ? -35.576 21.259  16.613  1.00 21.85  ? 121 ASP A HB3  1 
ATOM   2071 N  N    . ALA A 1 122 ? -32.262 21.413  16.409  1.00 17.93  ? 122 ALA A N    1 
ATOM   2072 C  CA   . ALA A 1 122 ? -31.148 20.550  16.787  1.00 17.06  ? 122 ALA A CA   1 
ATOM   2073 C  C    . ALA A 1 122 ? -30.298 21.192  17.871  1.00 17.24  ? 122 ALA A C    1 
ATOM   2074 O  O    . ALA A 1 122 ? -29.942 20.549  18.869  1.00 18.97  ? 122 ALA A O    1 
ATOM   2075 C  CB   . ALA A 1 122 ? -30.297 20.265  15.540  1.00 17.85  ? 122 ALA A CB   1 
ATOM   2076 H  H    . ALA A 1 122 ? -32.303 21.595  15.569  1.00 21.53  ? 122 ALA A H    1 
ATOM   2077 H  HA   . ALA A 1 122 ? -31.492 19.713  17.135  1.00 20.48  ? 122 ALA A HA   1 
ATOM   2078 H  HB1  . ALA A 1 122 ? -29.570 19.669  15.783  1.00 21.44  ? 122 ALA A HB1  1 
ATOM   2079 H  HB2  . ALA A 1 122 ? -30.855 19.848  14.865  1.00 21.44  ? 122 ALA A HB2  1 
ATOM   2080 H  HB3  . ALA A 1 122 ? -29.940 21.101  15.203  1.00 21.44  ? 122 ALA A HB3  1 
ATOM   2081 N  N    . TYR A 1 123 ? -29.944 22.460  17.689  1.00 18.12  ? 123 TYR A N    1 
ATOM   2082 C  CA   . TYR A 1 123 ? -29.102 23.134  18.675  1.00 19.18  ? 123 TYR A CA   1 
ATOM   2083 C  C    . TYR A 1 123 ? -29.812 23.239  20.023  1.00 20.09  ? 123 TYR A C    1 
ATOM   2084 O  O    . TYR A 1 123 ? -29.230 22.940  21.077  1.00 21.65  ? 123 TYR A O    1 
ATOM   2085 C  CB   . TYR A 1 123 ? -28.733 24.521  18.161  1.00 21.56  ? 123 TYR A CB   1 
ATOM   2086 C  CG   . TYR A 1 123 ? -27.780 25.255  19.062  1.00 23.44  ? 123 TYR A CG   1 
ATOM   2087 C  CD1  . TYR A 1 123 ? -26.421 24.981  19.039  1.00 24.18  ? 123 TYR A CD1  1 
ATOM   2088 C  CD2  . TYR A 1 123 ? -28.237 26.221  19.951  1.00 23.80  ? 123 TYR A CD2  1 
ATOM   2089 C  CE1  . TYR A 1 123 ? -25.538 25.654  19.874  1.00 26.14  ? 123 TYR A CE1  1 
ATOM   2090 C  CE2  . TYR A 1 123 ? -27.355 26.913  20.789  1.00 25.03  ? 123 TYR A CE2  1 
ATOM   2091 C  CZ   . TYR A 1 123 ? -26.011 26.614  20.744  1.00 26.59  ? 123 TYR A CZ   1 
ATOM   2092 O  OH   . TYR A 1 123 ? -25.127 27.296  21.560  1.00 30.87  ? 123 TYR A OH   1 
ATOM   2093 H  H    . TYR A 1 123 ? -30.173 22.945  17.017  1.00 21.76  ? 123 TYR A H    1 
ATOM   2094 H  HA   . TYR A 1 123 ? -28.289 22.622  18.802  1.00 23.03  ? 123 TYR A HA   1 
ATOM   2095 H  HB2  . TYR A 1 123 ? -28.312 24.431  17.292  1.00 25.88  ? 123 TYR A HB2  1 
ATOM   2096 H  HB3  . TYR A 1 123 ? -29.541 25.052  18.086  1.00 25.88  ? 123 TYR A HB3  1 
ATOM   2097 H  HD1  . TYR A 1 123 ? -26.094 24.334  18.455  1.00 29.03  ? 123 TYR A HD1  1 
ATOM   2098 H  HD2  . TYR A 1 123 ? -29.147 26.410  19.990  1.00 28.57  ? 123 TYR A HD2  1 
ATOM   2099 H  HE1  . TYR A 1 123 ? -24.630 25.457  19.846  1.00 31.38  ? 123 TYR A HE1  1 
ATOM   2100 H  HE2  . TYR A 1 123 ? -27.673 27.566  21.370  1.00 30.05  ? 123 TYR A HE2  1 
ATOM   2101 H  HH   . TYR A 1 123 ? -25.540 27.863  22.022  1.00 37.06  ? 123 TYR A HH   1 
ATOM   2102 N  N    . ASN A 1 124 ? -31.079 23.659  20.013  1.00 20.90  ? 124 ASN A N    1 
ATOM   2103 C  CA   . ASN A 1 124 ? -31.787 23.880  21.261  1.00 21.76  ? 124 ASN A CA   1 
ATOM   2104 C  C    . ASN A 1 124 ? -32.076 22.583  21.995  1.00 22.47  ? 124 ASN A C    1 
ATOM   2105 O  O    . ASN A 1 124 ? -32.226 22.621  23.218  1.00 24.93  ? 124 ASN A O    1 
ATOM   2106 C  CB   . ASN A 1 124 ? -33.096 24.618  20.979  1.00 23.75  ? 124 ASN A CB   1 
ATOM   2107 C  CG   . ASN A 1 124 ? -32.876 26.059  20.543  1.00 27.12  ? 124 ASN A CG   1 
ATOM   2108 O  OD1  . ASN A 1 124 ? -31.872 26.679  20.880  1.00 26.84  ? 124 ASN A OD1  1 
ATOM   2109 N  ND2  . ASN A 1 124 ? -33.840 26.607  19.807  1.00 31.04  ? 124 ASN A ND2  1 
ATOM   2110 H  H    . ASN A 1 124 ? -31.540 23.818  19.305  1.00 25.10  ? 124 ASN A H    1 
ATOM   2111 H  HA   . ASN A 1 124 ? -31.241 24.433  21.841  1.00 26.12  ? 124 ASN A HA   1 
ATOM   2112 H  HB2  . ASN A 1 124 ? -33.572 24.159  20.269  1.00 28.51  ? 124 ASN A HB2  1 
ATOM   2113 H  HB3  . ASN A 1 124 ? -33.634 24.628  21.786  1.00 28.51  ? 124 ASN A HB3  1 
ATOM   2114 H  HD21 . ASN A 1 124 ? -33.764 27.419  19.535  1.00 37.26  ? 124 ASN A HD21 1 
ATOM   2115 H  HD22 . ASN A 1 124 ? -34.539 26.149  19.603  1.00 37.26  ? 124 ASN A HD22 1 
ATOM   2116 N  N    . LEU A 1 125 ? -32.137 21.450  21.295  1.00 22.02  ? 125 LEU A N    1 
ATOM   2117 C  CA   . LEU A 1 125 ? -32.384 20.149  21.900  1.00 22.89  ? 125 LEU A CA   1 
ATOM   2118 C  C    . LEU A 1 125 ? -31.107 19.465  22.365  1.00 22.82  ? 125 LEU A C    1 
ATOM   2119 O  O    . LEU A 1 125 ? -31.186 18.420  23.019  1.00 24.44  ? 125 LEU A O    1 
ATOM   2120 C  CB   . LEU A 1 125 ? -33.129 19.244  20.910  1.00 22.84  ? 125 LEU A CB   1 
ATOM   2121 C  CG   . LEU A 1 125 ? -34.523 19.744  20.550  1.00 24.73  ? 125 LEU A CG   1 
ATOM   2122 C  CD1  . LEU A 1 125 ? -35.037 19.053  19.303  1.00 24.20  ? 125 LEU A CD1  1 
ATOM   2123 C  CD2  . LEU A 1 125 ? -35.494 19.543  21.700  1.00 28.59  ? 125 LEU A CD2  1 
ATOM   2124 H  H    . LEU A 1 125 ? -32.034 21.411  20.442  1.00 26.43  ? 125 LEU A H    1 
ATOM   2125 H  HA   . LEU A 1 125 ? -32.954 20.263  22.676  1.00 27.48  ? 125 LEU A HA   1 
ATOM   2126 H  HB2  . LEU A 1 125 ? -32.612 19.188  20.091  1.00 27.41  ? 125 LEU A HB2  1 
ATOM   2127 H  HB3  . LEU A 1 125 ? -33.222 18.363  21.305  1.00 27.41  ? 125 LEU A HB3  1 
ATOM   2128 H  HG   . LEU A 1 125 ? -34.468 20.695  20.370  1.00 29.69  ? 125 LEU A HG   1 
ATOM   2129 H  HD11 . LEU A 1 125 ? -34.432 19.239  18.567  1.00 29.05  ? 125 LEU A HD11 1 
ATOM   2130 H  HD12 . LEU A 1 125 ? -35.077 18.098  19.465  1.00 29.05  ? 125 LEU A HD12 1 
ATOM   2131 H  HD13 . LEU A 1 125 ? -35.922 19.392  19.096  1.00 29.05  ? 125 LEU A HD13 1 
ATOM   2132 H  HD21 . LEU A 1 125 ? -36.360 19.899  21.449  1.00 34.32  ? 125 LEU A HD21 1 
ATOM   2133 H  HD22 . LEU A 1 125 ? -35.568 18.594  21.889  1.00 34.32  ? 125 LEU A HD22 1 
ATOM   2134 H  HD23 . LEU A 1 125 ? -35.158 20.010  22.481  1.00 34.32  ? 125 LEU A HD23 1 
ATOM   2135 N  N    . GLY A 1 126 ? -29.945 20.042  22.090  1.00 22.21  ? 126 GLY A N    1 
ATOM   2136 C  CA   . GLY A 1 126 ? -28.691 19.507  22.571  1.00 21.80  ? 126 GLY A CA   1 
ATOM   2137 C  C    . GLY A 1 126 ? -27.835 18.754  21.566  1.00 20.29  ? 126 GLY A C    1 
ATOM   2138 O  O    . GLY A 1 126 ? -26.778 18.231  21.961  1.00 21.56  ? 126 GLY A O    1 
ATOM   2139 H  H    . GLY A 1 126 ? -29.861 20.757  21.619  1.00 26.66  ? 126 GLY A H    1 
ATOM   2140 H  HA2  . GLY A 1 126 ? -28.157 20.243  22.908  1.00 26.18  ? 126 GLY A HA2  1 
ATOM   2141 H  HA3  . GLY A 1 126 ? -28.883 18.896  23.299  1.00 26.18  ? 126 GLY A HA3  1 
ATOM   2142 N  N    . ALA A 1 127 ? -28.228 18.677  20.292  1.00 20.04  ? 127 ALA A N    1 
ATOM   2143 C  CA   . ALA A 1 127 ? -27.398 17.970  19.326  1.00 19.29  ? 127 ALA A CA   1 
ATOM   2144 C  C    . ALA A 1 127 ? -26.125 18.755  19.049  1.00 19.06  ? 127 ALA A C    1 
ATOM   2145 O  O    . ALA A 1 127 ? -26.079 19.975  19.171  1.00 20.19  ? 127 ALA A O    1 
ATOM   2146 C  CB   . ALA A 1 127 ? -28.143 17.769  18.015  1.00 19.36  ? 127 ALA A CB   1 
ATOM   2147 H  H    . ALA A 1 127 ? -28.952 19.018  19.974  1.00 24.07  ? 127 ALA A H    1 
ATOM   2148 H  HA   . ALA A 1 127 ? -27.168 17.100  19.687  1.00 23.16  ? 127 ALA A HA   1 
ATOM   2149 H  HB1  . ALA A 1 127 ? -27.561 17.311  17.388  1.00 23.24  ? 127 ALA A HB1  1 
ATOM   2150 H  HB2  . ALA A 1 127 ? -28.935 17.234  18.181  1.00 23.24  ? 127 ALA A HB2  1 
ATOM   2151 H  HB3  . ALA A 1 127 ? -28.397 18.635  17.659  1.00 23.24  ? 127 ALA A HB3  1 
ATOM   2152 N  N    . ASP A 1 128 ? -25.074 18.027  18.691  1.00 18.20  ? 128 ASP A N    1 
ATOM   2153 C  CA   . ASP A 1 128 ? -23.802 18.621  18.327  1.00 17.72  ? 128 ASP A CA   1 
ATOM   2154 C  C    . ASP A 1 128 ? -23.636 18.851  16.849  1.00 16.81  ? 128 ASP A C    1 
ATOM   2155 O  O    . ASP A 1 128 ? -22.815 19.690  16.472  1.00 18.87  ? 128 ASP A O    1 
ATOM   2156 C  CB   . ASP A 1 128 ? -22.684 17.726  18.852  1.00 20.40  ? 128 ASP A CB   1 
ATOM   2157 C  CG   . ASP A 1 128 ? -22.764 17.571  20.353  1.00 21.83  ? 128 ASP A CG   1 
ATOM   2158 O  OD1  . ASP A 1 128 ? -22.533 18.598  21.037  1.00 22.10  ? 128 ASP A OD1  1 
ATOM   2159 O  OD2  . ASP A 1 128 ? -23.092 16.448  20.818  1.00 23.65  ? 128 ASP A OD2  1 
ATOM   2160 H  H    . ASP A 1 128 ? -25.076 17.168  18.650  1.00 21.85  ? 128 ASP A H    1 
ATOM   2161 H  HA   . ASP A 1 128 ? -23.716 19.494  18.741  1.00 21.28  ? 128 ASP A HA   1 
ATOM   2162 H  HB2  . ASP A 1 128 ? -22.759 16.847  18.449  1.00 24.49  ? 128 ASP A HB2  1 
ATOM   2163 H  HB3  . ASP A 1 128 ? -21.826 18.120  18.631  1.00 24.49  ? 128 ASP A HB3  1 
ATOM   2164 N  N    . THR A 1 129 ? -24.412 18.166  16.013  1.00 16.91  ? 129 THR A N    1 
ATOM   2165 C  CA   . THR A 1 129 ? -24.384 18.409  14.585  1.00 17.63  ? 129 THR A CA   1 
ATOM   2166 C  C    . THR A 1 129 ? -25.655 17.840  13.968  1.00 17.46  ? 129 THR A C    1 
ATOM   2167 O  O    . THR A 1 129 ? -26.506 17.279  14.659  1.00 17.85  ? 129 THR A O    1 
ATOM   2168 C  CB   . THR A 1 129 ? -23.109 17.829  13.984  1.00 18.85  ? 129 THR A CB   1 
ATOM   2169 O  OG1  . THR A 1 129 ? -23.025 18.296  12.634  1.00 22.03  ? 129 THR A OG1  1 
ATOM   2170 C  CG2  . THR A 1 129 ? -23.084 16.303  14.001  1.00 19.23  ? 129 THR A CG2  1 
ATOM   2171 H  H    . THR A 1 129 ? -24.964 17.553  16.256  1.00 20.31  ? 129 THR A H    1 
ATOM   2172 H  HA   . THR A 1 129 ? -24.396 19.362  14.407  1.00 21.16  ? 129 THR A HA   1 
ATOM   2173 H  HB   . THR A 1 129 ? -22.344 18.111  14.510  1.00 22.63  ? 129 THR A HB   1 
ATOM   2174 H  HG1  . THR A 1 129 ? -22.324 18.007  12.273  1.00 26.45  ? 129 THR A HG1  1 
ATOM   2175 H  HG21 . THR A 1 129 ? -22.209 15.982  13.732  1.00 23.08  ? 129 THR A HG21 1 
ATOM   2176 H  HG22 . THR A 1 129 ? -23.278 15.977  14.893  1.00 23.08  ? 129 THR A HG22 1 
ATOM   2177 H  HG23 . THR A 1 129 ? -23.749 15.953  13.387  1.00 23.08  ? 129 THR A HG23 1 
ATOM   2178 N  N    . VAL A 1 130 ? -25.774 18.013  12.650  1.00 16.58  ? 130 VAL A N    1 
ATOM   2179 C  CA   . VAL A 1 130 ? -26.933 17.599  11.869  1.00 16.08  ? 130 VAL A CA   1 
ATOM   2180 C  C    . VAL A 1 130 ? -26.446 16.981  10.567  1.00 16.55  ? 130 VAL A C    1 
ATOM   2181 O  O    . VAL A 1 130 ? -25.344 17.270  10.091  1.00 17.59  ? 130 VAL A O    1 
ATOM   2182 C  CB   . VAL A 1 130 ? -27.881 18.773  11.539  1.00 16.13  ? 130 VAL A CB   1 
ATOM   2183 C  CG1  . VAL A 1 130 ? -28.419 19.380  12.813  1.00 17.28  ? 130 VAL A CG1  1 
ATOM   2184 C  CG2  . VAL A 1 130 ? -27.140 19.834  10.704  1.00 19.38  ? 130 VAL A CG2  1 
ATOM   2185 H  H    . VAL A 1 130 ? -25.167 18.386  12.168  1.00 19.91  ? 130 VAL A H    1 
ATOM   2186 H  HA   . VAL A 1 130 ? -27.422 16.938  12.385  1.00 19.31  ? 130 VAL A HA   1 
ATOM   2187 H  HB   . VAL A 1 130 ? -28.631 18.445  11.019  1.00 19.37  ? 130 VAL A HB   1 
ATOM   2188 H  HG11 . VAL A 1 130 ? -29.058 20.074  12.587  1.00 20.75  ? 130 VAL A HG11 1 
ATOM   2189 H  HG12 . VAL A 1 130 ? -28.853 18.687  13.335  1.00 20.75  ? 130 VAL A HG12 1 
ATOM   2190 H  HG13 . VAL A 1 130 ? -27.682 19.761  13.317  1.00 20.75  ? 130 VAL A HG13 1 
ATOM   2191 H  HG21 . VAL A 1 130 ? -26.187 19.655  10.739  1.00 23.27  ? 130 VAL A HG21 1 
ATOM   2192 H  HG22 . VAL A 1 130 ? -27.452 19.788  9.787   1.00 23.27  ? 130 VAL A HG22 1 
ATOM   2193 H  HG23 . VAL A 1 130 ? -27.325 20.712  11.073  1.00 23.27  ? 130 VAL A HG23 1 
ATOM   2194 N  N    . ALA A 1 131 ? -27.263 16.106  9.999   1.00 16.02  ? 131 ALA A N    1 
ATOM   2195 C  CA   . ALA A 1 131 ? -27.094 15.683  8.619   1.00 16.78  ? 131 ALA A CA   1 
ATOM   2196 C  C    . ALA A 1 131 ? -27.814 16.648  7.679   1.00 16.53  ? 131 ALA A C    1 
ATOM   2197 O  O    . ALA A 1 131 ? -28.930 17.089  7.957   1.00 18.01  ? 131 ALA A O    1 
ATOM   2198 C  CB   . ALA A 1 131 ? -27.670 14.275  8.469   1.00 19.14  ? 131 ALA A CB   1 
ATOM   2199 H  H    . ALA A 1 131 ? -27.930 15.739  10.398  1.00 19.24  ? 131 ALA A H    1 
ATOM   2200 H  HA   . ALA A 1 131 ? -26.156 15.678  8.371   1.00 20.15  ? 131 ALA A HA   1 
ATOM   2201 H  HB1  . ALA A 1 131 ? -27.576 13.991  7.546   1.00 22.98  ? 131 ALA A HB1  1 
ATOM   2202 H  HB2  . ALA A 1 131 ? -27.184 13.671  9.052   1.00 22.98  ? 131 ALA A HB2  1 
ATOM   2203 H  HB3  . ALA A 1 131 ? -28.608 14.290  8.716   1.00 22.98  ? 131 ALA A HB3  1 
ATOM   2204 N  N    . LEU A 1 132 ? -27.161 16.985  6.568   1.00 16.48  ? 132 LEU A N    1 
ATOM   2205 C  CA   . LEU A 1 132 ? -27.791 17.690  5.450   1.00 16.87  ? 132 LEU A CA   1 
ATOM   2206 C  C    . LEU A 1 132 ? -27.722 16.766  4.235   1.00 17.86  ? 132 LEU A C    1 
ATOM   2207 O  O    . LEU A 1 132 ? -26.651 16.243  3.915   1.00 18.55  ? 132 LEU A O    1 
ATOM   2208 C  CB   . LEU A 1 132 ? -27.079 19.024  5.165   1.00 17.18  ? 132 LEU A CB   1 
ATOM   2209 C  CG   . LEU A 1 132 ? -27.115 20.023  6.319   1.00 17.41  ? 132 LEU A CG   1 
ATOM   2210 C  CD1  . LEU A 1 132 ? -26.291 21.223  5.977   1.00 18.41  ? 132 LEU A CD1  1 
ATOM   2211 C  CD2  . LEU A 1 132 ? -28.537 20.434  6.631   1.00 18.98  ? 132 LEU A CD2  1 
ATOM   2212 H  H    . LEU A 1 132 ? -26.329 16.811  6.433   1.00 19.79  ? 132 LEU A H    1 
ATOM   2213 H  HA   . LEU A 1 132 ? -28.718 17.895  5.646   1.00 20.26  ? 132 LEU A HA   1 
ATOM   2214 H  HB2  . LEU A 1 132 ? -26.148 18.840  4.965   1.00 20.63  ? 132 LEU A HB2  1 
ATOM   2215 H  HB3  . LEU A 1 132 ? -27.506 19.443  4.401   1.00 20.63  ? 132 LEU A HB3  1 
ATOM   2216 H  HG   . LEU A 1 132 ? -26.745 19.606  7.113   1.00 20.91  ? 132 LEU A HG   1 
ATOM   2217 H  HD11 . LEU A 1 132 ? -25.381 20.941  5.797   1.00 22.10  ? 132 LEU A HD11 1 
ATOM   2218 H  HD12 . LEU A 1 132 ? -26.666 21.651  5.191   1.00 22.10  ? 132 LEU A HD12 1 
ATOM   2219 H  HD13 . LEU A 1 132 ? -26.304 21.839  6.727   1.00 22.10  ? 132 LEU A HD13 1 
ATOM   2220 H  HD21 . LEU A 1 132 ? -28.522 21.153  7.282   1.00 22.78  ? 132 LEU A HD21 1 
ATOM   2221 H  HD22 . LEU A 1 132 ? -28.966 20.734  5.815   1.00 22.78  ? 132 LEU A HD22 1 
ATOM   2222 H  HD23 . LEU A 1 132 ? -29.013 19.670  6.993   1.00 22.78  ? 132 LEU A HD23 1 
ATOM   2223 N  N    . ILE A 1 133 ? -28.856 16.559  3.574   1.00 17.73  ? 133 ILE A N    1 
ATOM   2224 C  CA   . ILE A 1 133 ? -28.993 15.540  2.530   1.00 16.33  ? 133 ILE A CA   1 
ATOM   2225 C  C    . ILE A 1 133 ? -29.016 16.228  1.165   1.00 17.08  ? 133 ILE A C    1 
ATOM   2226 O  O    . ILE A 1 133 ? -29.956 16.955  0.822   1.00 18.09  ? 133 ILE A O    1 
ATOM   2227 C  CB   . ILE A 1 133 ? -30.236 14.677  2.765   1.00 17.69  ? 133 ILE A CB   1 
ATOM   2228 C  CG1  . ILE A 1 133 ? -30.117 13.969  4.102   1.00 18.13  ? 133 ILE A CG1  1 
ATOM   2229 C  CG2  . ILE A 1 133 ? -30.438 13.711  1.613   1.00 17.66  ? 133 ILE A CG2  1 
ATOM   2230 C  CD1  . ILE A 1 133 ? -31.372 13.298  4.512   1.00 20.85  ? 133 ILE A CD1  1 
ATOM   2231 H  H    . ILE A 1 133 ? -29.578 17.004  3.714   1.00 21.29  ? 133 ILE A H    1 
ATOM   2232 H  HA   . ILE A 1 133 ? -28.209 14.969  2.535   1.00 19.60  ? 133 ILE A HA   1 
ATOM   2233 H  HB   . ILE A 1 133 ? -31.023 15.242  2.798   1.00 21.24  ? 133 ILE A HB   1 
ATOM   2234 H  HG12 . ILE A 1 133 ? -29.422 13.294  4.042   1.00 21.77  ? 133 ILE A HG12 1 
ATOM   2235 H  HG13 . ILE A 1 133 ? -29.889 14.619  4.784   1.00 21.77  ? 133 ILE A HG13 1 
ATOM   2236 H  HG21 . ILE A 1 133 ? -30.698 14.211  0.824   1.00 21.20  ? 133 ILE A HG21 1 
ATOM   2237 H  HG22 . ILE A 1 133 ? -29.606 13.240  1.446   1.00 21.20  ? 133 ILE A HG22 1 
ATOM   2238 H  HG23 . ILE A 1 133 ? -31.135 13.079  1.849   1.00 21.20  ? 133 ILE A HG23 1 
ATOM   2239 H  HD11 . ILE A 1 133 ? -32.115 13.904  4.370   1.00 25.03  ? 133 ILE A HD11 1 
ATOM   2240 H  HD12 . ILE A 1 133 ? -31.491 12.498  3.977   1.00 25.03  ? 133 ILE A HD12 1 
ATOM   2241 H  HD13 . ILE A 1 133 ? -31.312 13.061  5.451   1.00 25.03  ? 133 ILE A HD13 1 
ATOM   2242 N  N    . VAL A 1 134 ? -27.965 16.002  0.375   1.00 17.65  ? 134 VAL A N    1 
ATOM   2243 C  CA   . VAL A 1 134 ? -27.821 16.751  -0.872  1.00 17.13  ? 134 VAL A CA   1 
ATOM   2244 C  C    . VAL A 1 134 ? -29.014 16.539  -1.803  1.00 19.00  ? 134 VAL A C    1 
ATOM   2245 O  O    . VAL A 1 134 ? -29.485 17.478  -2.456  1.00 21.53  ? 134 VAL A O    1 
ATOM   2246 C  CB   . VAL A 1 134 ? -26.493 16.400  -1.561  1.00 18.33  ? 134 VAL A CB   1 
ATOM   2247 C  CG1  . VAL A 1 134 ? -26.373 17.140  -2.914  1.00 18.77  ? 134 VAL A CG1  1 
ATOM   2248 C  CG2  . VAL A 1 134 ? -25.321 16.734  -0.669  1.00 19.64  ? 134 VAL A CG2  1 
ATOM   2249 H  H    . VAL A 1 134 ? -27.338 15.435  0.535   1.00 21.19  ? 134 VAL A H    1 
ATOM   2250 H  HA   . VAL A 1 134 ? -27.804 17.694  -0.644  1.00 20.57  ? 134 VAL A HA   1 
ATOM   2251 H  HB   . VAL A 1 134 ? -26.476 15.445  -1.734  1.00 22.00  ? 134 VAL A HB   1 
ATOM   2252 H  HG11 . VAL A 1 134 ? -26.819 17.999  -2.845  1.00 22.54  ? 134 VAL A HG11 1 
ATOM   2253 H  HG12 . VAL A 1 134 ? -25.434 17.271  -3.121  1.00 22.54  ? 134 VAL A HG12 1 
ATOM   2254 H  HG13 . VAL A 1 134 ? -26.792 16.605  -3.606  1.00 22.54  ? 134 VAL A HG13 1 
ATOM   2255 H  HG21 . VAL A 1 134 ? -25.654 17.076  0.175   1.00 23.58  ? 134 VAL A HG21 1 
ATOM   2256 H  HG22 . VAL A 1 134 ? -24.800 15.929  -0.518  1.00 23.58  ? 134 VAL A HG22 1 
ATOM   2257 H  HG23 . VAL A 1 134 ? -24.773 17.405  -1.106  1.00 23.58  ? 134 VAL A HG23 1 
ATOM   2258 N  N    . LYS A 1 135 ? -29.532 15.315  -1.880  1.00 20.38  ? 135 LYS A N    1 
ATOM   2259 C  CA   . LYS A 1 135 ? -30.531 15.048  -2.903  1.00 23.08  ? 135 LYS A CA   1 
ATOM   2260 C  C    . LYS A 1 135 ? -31.889 15.671  -2.618  1.00 21.36  ? 135 LYS A C    1 
ATOM   2261 O  O    . LYS A 1 135 ? -32.753 15.599  -3.482  1.00 22.85  ? 135 LYS A O    1 
ATOM   2262 C  CB   . LYS A 1 135 ? -30.604 13.560  -3.185  1.00 28.74  ? 135 LYS A CB   1 
ATOM   2263 C  CG   . LYS A 1 135 ? -31.378 12.771  -2.197  1.00 31.12  ? 135 LYS A CG   1 
ATOM   2264 C  CD   . LYS A 1 135 ? -31.958 11.532  -2.916  1.00 36.44  ? 135 LYS A CD   1 
ATOM   2265 C  CE   . LYS A 1 135 ? -30.865 10.492  -3.143  1.00 39.86  ? 135 LYS A CE   1 
ATOM   2266 N  NZ   . LYS A 1 135 ? -31.116 9.628   -4.310  1.00 40.98  ? 135 LYS A NZ   1 
ATOM   2267 H  H    . LYS A 1 135 ? -29.328 14.651  -1.372  1.00 24.47  ? 135 LYS A H    1 
ATOM   2268 H  HA   . LYS A 1 135 ? -30.248 15.459  -3.735  1.00 27.71  ? 135 LYS A HA   1 
ATOM   2269 H  HB2  . LYS A 1 135 ? -31.023 13.432  -4.051  1.00 34.50  ? 135 LYS A HB2  1 
ATOM   2270 H  HB3  . LYS A 1 135 ? -29.702 13.205  -3.197  1.00 34.50  ? 135 LYS A HB3  1 
ATOM   2271 H  HG2  . LYS A 1 135 ? -30.799 12.480  -1.476  1.00 37.36  ? 135 LYS A HG2  1 
ATOM   2272 H  HG3  . LYS A 1 135 ? -32.107 13.304  -1.842  1.00 37.36  ? 135 LYS A HG3  1 
ATOM   2273 H  HD2  . LYS A 1 135 ? -32.655 11.135  -2.370  1.00 43.73  ? 135 LYS A HD2  1 
ATOM   2274 H  HD3  . LYS A 1 135 ? -32.320 11.794  -3.777  1.00 43.73  ? 135 LYS A HD3  1 
ATOM   2275 H  HE2  . LYS A 1 135 ? -30.021 10.949  -3.288  1.00 47.85  ? 135 LYS A HE2  1 
ATOM   2276 H  HE3  . LYS A 1 135 ? -30.803 9.924   -2.360  1.00 47.85  ? 135 LYS A HE3  1 
ATOM   2277 H  HZ1  . LYS A 1 135 ? -30.458 9.036   -4.397  1.00 49.19  ? 135 LYS A HZ1  1 
ATOM   2278 H  HZ2  . LYS A 1 135 ? -31.885 9.192   -4.205  1.00 49.19  ? 135 LYS A HZ2  1 
ATOM   2279 H  HZ3  . LYS A 1 135 ? -31.162 10.121  -5.049  1.00 49.19  ? 135 LYS A HZ3  1 
ATOM   2280 N  N    . ILE A 1 136 ? -32.113 16.263  -1.446  1.00 19.43  ? 136 ILE A N    1 
ATOM   2281 C  CA   . ILE A 1 136 ? -33.382 16.924  -1.181  1.00 19.57  ? 136 ILE A CA   1 
ATOM   2282 C  C    . ILE A 1 136 ? -33.287 18.429  -1.269  1.00 20.12  ? 136 ILE A C    1 
ATOM   2283 O  O    . ILE A 1 136 ? -34.329 19.094  -1.186  1.00 20.41  ? 136 ILE A O    1 
ATOM   2284 C  CB   . ILE A 1 136 ? -34.047 16.480  0.146   1.00 20.11  ? 136 ILE A CB   1 
ATOM   2285 C  CG1  . ILE A 1 136 ? -33.299 17.011  1.380   1.00 21.55  ? 136 ILE A CG1  1 
ATOM   2286 C  CG2  . ILE A 1 136 ? -34.224 14.948  0.178   1.00 21.66  ? 136 ILE A CG2  1 
ATOM   2287 C  CD1  . ILE A 1 136 ? -33.992 16.732  2.713   1.00 21.34  ? 136 ILE A CD1  1 
ATOM   2288 H  H    . ILE A 1 136 ? -31.549 16.293  -0.797  1.00 23.33  ? 136 ILE A H    1 
ATOM   2289 H  HA   . ILE A 1 136 ? -33.995 16.635  -1.874  1.00 23.50  ? 136 ILE A HA   1 
ATOM   2290 H  HB   . ILE A 1 136 ? -34.929 16.882  0.181   1.00 24.14  ? 136 ILE A HB   1 
ATOM   2291 H  HG12 . ILE A 1 136 ? -32.423 16.595  1.413   1.00 25.87  ? 136 ILE A HG12 1 
ATOM   2292 H  HG13 . ILE A 1 136 ? -33.206 17.973  1.295   1.00 25.87  ? 136 ILE A HG13 1 
ATOM   2293 H  HG21 . ILE A 1 136 ? -34.733 14.705  0.968   1.00 26.00  ? 136 ILE A HG21 1 
ATOM   2294 H  HG22 . ILE A 1 136 ? -34.699 14.668  -0.620  1.00 26.00  ? 136 ILE A HG22 1 
ATOM   2295 H  HG23 . ILE A 1 136 ? -33.350 14.529  0.206   1.00 26.00  ? 136 ILE A HG23 1 
ATOM   2296 H  HD11 . ILE A 1 136 ? -33.492 17.161  3.425   1.00 25.62  ? 136 ILE A HD11 1 
ATOM   2297 H  HD12 . ILE A 1 136 ? -34.894 17.088  2.681   1.00 25.62  ? 136 ILE A HD12 1 
ATOM   2298 H  HD13 . ILE A 1 136 ? -34.020 15.773  2.860   1.00 25.62  ? 136 ILE A HD13 1 
ATOM   2299 N  N    . LEU A 1 137 ? -32.086 18.984  -1.458  1.00 21.46  ? 137 LEU A N    1 
ATOM   2300 C  CA   . LEU A 1 137 ? -31.823 20.414  -1.409  1.00 22.10  ? 137 LEU A CA   1 
ATOM   2301 C  C    . LEU A 1 137 ? -31.269 20.912  -2.743  1.00 22.31  ? 137 LEU A C    1 
ATOM   2302 O  O    . LEU A 1 137 ? -30.548 20.189  -3.449  1.00 23.51  ? 137 LEU A O    1 
ATOM   2303 C  CB   . LEU A 1 137 ? -30.798 20.740  -0.299  1.00 23.27  ? 137 LEU A CB   1 
ATOM   2304 C  CG   . LEU A 1 137 ? -31.216 20.393  1.126   1.00 24.20  ? 137 LEU A CG   1 
ATOM   2305 C  CD1  . LEU A 1 137 ? -30.116 20.576  2.136   1.00 24.99  ? 137 LEU A CD1  1 
ATOM   2306 C  CD2  . LEU A 1 137 ? -32.397 21.222  1.515   1.00 24.07  ? 137 LEU A CD2  1 
ATOM   2307 H  H    . LEU A 1 137 ? -31.378 18.526  -1.625  1.00 25.76  ? 137 LEU A H    1 
ATOM   2308 H  HA   . LEU A 1 137 ? -32.655 20.880  -1.235  1.00 26.53  ? 137 LEU A HA   1 
ATOM   2309 H  HB2  . LEU A 1 137 ? -29.984 20.248  -0.486  1.00 27.94  ? 137 LEU A HB2  1 
ATOM   2310 H  HB3  . LEU A 1 137 ? -30.623 21.694  -0.321  1.00 27.94  ? 137 LEU A HB3  1 
ATOM   2311 H  HG   . LEU A 1 137 ? -31.441 19.450  1.138   1.00 29.05  ? 137 LEU A HG   1 
ATOM   2312 H  HD11 . LEU A 1 137 ? -29.820 21.499  2.116   1.00 30.01  ? 137 LEU A HD11 1 
ATOM   2313 H  HD12 . LEU A 1 137 ? -30.458 20.356  3.017   1.00 30.01  ? 137 LEU A HD12 1 
ATOM   2314 H  HD13 . LEU A 1 137 ? -29.380 19.986  1.910   1.00 30.01  ? 137 LEU A HD13 1 
ATOM   2315 H  HD21 . LEU A 1 137 ? -32.578 21.090  2.459   1.00 28.90  ? 137 LEU A HD21 1 
ATOM   2316 H  HD22 . LEU A 1 137 ? -32.199 22.155  1.343   1.00 28.90  ? 137 LEU A HD22 1 
ATOM   2317 H  HD23 . LEU A 1 137 ? -33.164 20.945  0.989   1.00 28.90  ? 137 LEU A HD23 1 
ATOM   2318 N  N    . THR A 1 138 ? -31.609 22.157  -3.088  1.00 23.18  ? 138 THR A N    1 
ATOM   2319 C  CA   . THR A 1 138 ? -30.868 22.815  -4.158  1.00 24.53  ? 138 THR A CA   1 
ATOM   2320 C  C    . THR A 1 138 ? -29.476 23.163  -3.660  1.00 23.46  ? 138 THR A C    1 
ATOM   2321 O  O    . THR A 1 138 ? -29.215 23.177  -2.457  1.00 23.75  ? 138 THR A O    1 
ATOM   2322 C  CB   . THR A 1 138 ? -31.566 24.079  -4.632  1.00 25.97  ? 138 THR A CB   1 
ATOM   2323 O  OG1  . THR A 1 138 ? -31.511 25.068  -3.603  1.00 27.24  ? 138 THR A OG1  1 
ATOM   2324 C  CG2  . THR A 1 138 ? -33.028 23.782  -4.951  1.00 29.20  ? 138 THR A CG2  1 
ATOM   2325 H  H    . THR A 1 138 ? -32.239 22.620  -2.731  1.00 27.82  ? 138 THR A H    1 
ATOM   2326 H  HA   . THR A 1 138 ? -30.809 22.218  -4.920  1.00 29.44  ? 138 THR A HA   1 
ATOM   2327 H  HB   . THR A 1 138 ? -31.129 24.414  -5.431  1.00 31.17  ? 138 THR A HB   1 
ATOM   2328 H  HG1  . THR A 1 138 ? -31.891 25.772  -3.859  1.00 32.70  ? 138 THR A HG1  1 
ATOM   2329 H  HG21 . THR A 1 138 ? -33.435 24.547  -5.387  1.00 35.05  ? 138 THR A HG21 1 
ATOM   2330 H  HG22 . THR A 1 138 ? -33.089 23.014  -5.540  1.00 35.05  ? 138 THR A HG22 1 
ATOM   2331 H  HG23 . THR A 1 138 ? -33.514 23.591  -4.133  1.00 35.05  ? 138 THR A HG23 1 
ATOM   2332 N  N    . GLU A 1 139 ? -28.566 23.412  -4.604  1.00 23.99  ? 139 GLU A N    1 
ATOM   2333 C  CA   . GLU A 1 139 ? -27.206 23.769  -4.223  1.00 23.35  ? 139 GLU A CA   1 
ATOM   2334 C  C    . GLU A 1 139 ? -27.192 25.036  -3.369  1.00 24.47  ? 139 GLU A C    1 
ATOM   2335 O  O    . GLU A 1 139 ? -26.476 25.109  -2.363  1.00 24.83  ? 139 GLU A O    1 
ATOM   2336 C  CB   . GLU A 1 139 ? -26.349 23.931  -5.475  1.00 25.16  ? 139 GLU A CB   1 
ATOM   2337 C  CG   . GLU A 1 139 ? -24.884 24.151  -5.155  1.00 27.05  ? 139 GLU A CG   1 
ATOM   2338 C  CD   . GLU A 1 139 ? -23.981 23.945  -6.341  1.00 30.33  ? 139 GLU A CD   1 
ATOM   2339 O  OE1  . GLU A 1 139 ? -24.447 23.432  -7.385  1.00 32.07  ? 139 GLU A OE1  1 
ATOM   2340 O  OE2  . GLU A 1 139 ? -22.786 24.294  -6.229  1.00 32.60  ? 139 GLU A OE2  1 
ATOM   2341 H  H    . GLU A 1 139 ? -28.709 23.379  -5.451  1.00 28.80  ? 139 GLU A H    1 
ATOM   2342 H  HA   . GLU A 1 139 ? -26.820 23.056  -3.692  1.00 28.03  ? 139 GLU A HA   1 
ATOM   2343 H  HB2  . GLU A 1 139 ? -26.422 23.128  -6.014  1.00 30.20  ? 139 GLU A HB2  1 
ATOM   2344 H  HB3  . GLU A 1 139 ? -26.666 24.698  -5.978  1.00 30.20  ? 139 GLU A HB3  1 
ATOM   2345 H  HG2  . GLU A 1 139 ? -24.764 25.062  -4.843  1.00 32.47  ? 139 GLU A HG2  1 
ATOM   2346 H  HG3  . GLU A 1 139 ? -24.616 23.525  -4.464  1.00 32.47  ? 139 GLU A HG3  1 
ATOM   2347 N  N    . ARG A 1 140 ? -28.016 26.026  -3.723  1.00 24.53  ? 140 ARG A N    1 
ATOM   2348 C  CA   . ARG A 1 140 ? -28.046 27.269  -2.966  1.00 26.47  ? 140 ARG A CA   1 
ATOM   2349 C  C    . ARG A 1 140 ? -28.523 27.030  -1.546  1.00 24.88  ? 140 ARG A C    1 
ATOM   2350 O  O    . ARG A 1 140 ? -27.956 27.595  -0.600  1.00 26.29  ? 140 ARG A O    1 
ATOM   2351 C  CB   . ARG A 1 140 ? -28.966 28.278  -3.649  1.00 31.31  ? 140 ARG A CB   1 
ATOM   2352 C  CG   . ARG A 1 140 ? -28.950 29.658  -3.025  0.35 36.40  ? 140 ARG A CG   1 
ATOM   2353 C  CD   . ARG A 1 140 ? -30.289 30.355  -3.218  0.48 41.87  ? 140 ARG A CD   1 
ATOM   2354 N  NE   . ARG A 1 140 ? -31.231 29.922  -2.195  0.36 46.04  ? 140 ARG A NE   1 
ATOM   2355 C  CZ   . ARG A 1 140 ? -32.512 29.660  -2.407  0.40 49.10  ? 140 ARG A CZ   1 
ATOM   2356 N  NH1  . ARG A 1 140 ? -33.056 29.794  -3.604  0.36 50.31  ? 140 ARG A NH1  1 
ATOM   2357 N  NH2  . ARG A 1 140 ? -33.265 29.253  -1.389  0.49 50.29  ? 140 ARG A NH2  1 
ATOM   2358 H  H    . ARG A 1 140 ? -28.559 25.999  -4.389  1.00 29.45  ? 140 ARG A H    1 
ATOM   2359 H  HA   . ARG A 1 140 ? -27.149 27.636  -2.940  1.00 31.77  ? 140 ARG A HA   1 
ATOM   2360 H  HB2  . ARG A 1 140 ? -28.691 28.371  -4.574  1.00 37.59  ? 140 ARG A HB2  1 
ATOM   2361 H  HB3  . ARG A 1 140 ? -29.876 27.946  -3.605  1.00 37.59  ? 140 ARG A HB3  1 
ATOM   2362 H  HG2  . ARG A 1 140 ? -28.778 29.581  -2.073  0.49 43.69  ? 140 ARG A HG2  1 
ATOM   2363 H  HG3  . ARG A 1 140 ? -28.260 30.195  -3.444  0.45 43.69  ? 140 ARG A HG3  1 
ATOM   2364 H  HD2  . ARG A 1 140 ? -30.170 31.315  -3.145  0.51 50.26  ? 140 ARG A HD2  1 
ATOM   2365 H  HD3  . ARG A 1 140 ? -30.651 30.131  -4.089  0.53 50.26  ? 140 ARG A HD3  1 
ATOM   2366 H  HE   . ARG A 1 140 ? -30.934 29.830  -1.393  0.50 55.26  ? 140 ARG A HE   1 
ATOM   2367 H  HH11 . ARG A 1 140 ? -32.576 30.057  -4.268  0.51 60.38  ? 140 ARG A HH11 1 
ATOM   2368 H  HH12 . ARG A 1 140 ? -33.890 29.618  -3.720  0.47 60.38  ? 140 ARG A HH12 1 
ATOM   2369 H  HH21 . ARG A 1 140 ? -32.919 29.164  -0.606  0.52 60.36  ? 140 ARG A HH21 1 
ATOM   2370 H  HH22 . ARG A 1 140 ? -34.098 29.080  -1.513  0.49 60.36  ? 140 ARG A HH22 1 
ATOM   2371 N  N    . GLU A 1 141 ? -29.587 26.229  -1.384  1.00 23.93  ? 141 GLU A N    1 
ATOM   2372 C  CA   . GLU A 1 141 ? -30.077 25.901  -0.048  1.00 23.75  ? 141 GLU A CA   1 
ATOM   2373 C  C    . GLU A 1 141 ? -29.018 25.178  0.763   1.00 22.24  ? 141 GLU A C    1 
ATOM   2374 O  O    . GLU A 1 141 ? -28.843 25.453  1.953   1.00 23.40  ? 141 GLU A O    1 
ATOM   2375 C  CB   . GLU A 1 141 ? -31.339 25.033  -0.118  1.00 26.06  ? 141 GLU A CB   1 
ATOM   2376 C  CG   . GLU A 1 141 ? -32.542 25.728  -0.709  1.00 28.57  ? 141 GLU A CG   1 
ATOM   2377 C  CD   . GLU A 1 141 ? -33.700 24.782  -0.929  1.00 29.11  ? 141 GLU A CD   1 
ATOM   2378 O  OE1  . GLU A 1 141 ? -33.446 23.644  -1.370  0.88 27.85  ? 141 GLU A OE1  1 
ATOM   2379 O  OE2  . GLU A 1 141 ? -34.855 25.171  -0.642  1.00 30.87  ? 141 GLU A OE2  1 
ATOM   2380 H  H    . GLU A 1 141 ? -30.033 25.869  -2.025  1.00 28.73  ? 141 GLU A H    1 
ATOM   2381 H  HA   . GLU A 1 141 ? -30.307 26.734  0.392   1.00 28.51  ? 141 GLU A HA   1 
ATOM   2382 H  HB2  . GLU A 1 141 ? -31.149 24.256  -0.667  1.00 31.28  ? 141 GLU A HB2  1 
ATOM   2383 H  HB3  . GLU A 1 141 ? -31.573 24.754  0.781   1.00 31.28  ? 141 GLU A HB3  1 
ATOM   2384 H  HG2  . GLU A 1 141 ? -32.835 26.427  -0.104  1.00 34.29  ? 141 GLU A HG2  1 
ATOM   2385 H  HG3  . GLU A 1 141 ? -32.299 26.111  -1.566  1.00 34.29  ? 141 GLU A HG3  1 
ATOM   2386 N  N    . LEU A 1 142 ? -28.330 24.224  0.148   1.00 21.48  ? 142 LEU A N    1 
ATOM   2387 C  CA   . LEU A 1 142 ? -27.327 23.462  0.873   1.00 21.14  ? 142 LEU A CA   1 
ATOM   2388 C  C    . LEU A 1 142 ? -26.207 24.360  1.368   1.00 22.21  ? 142 LEU A C    1 
ATOM   2389 O  O    . LEU A 1 142 ? -25.797 24.280  2.531   1.00 22.46  ? 142 LEU A O    1 
ATOM   2390 C  CB   . LEU A 1 142 ? -26.803 22.337  -0.013  1.00 23.51  ? 142 LEU A CB   1 
ATOM   2391 C  CG   . LEU A 1 142 ? -25.755 21.426  0.607   1.00 26.04  ? 142 LEU A CG   1 
ATOM   2392 C  CD1  . LEU A 1 142 ? -26.320 20.687  1.800   1.00 27.50  ? 142 LEU A CD1  1 
ATOM   2393 C  CD2  . LEU A 1 142 ? -25.255 20.417  -0.428  1.00 28.16  ? 142 LEU A CD2  1 
ATOM   2394 H  H    . LEU A 1 142 ? -28.423 24.002  -0.677  1.00 25.79  ? 142 LEU A H    1 
ATOM   2395 H  HA   . LEU A 1 142 ? -27.731 23.056  1.656   1.00 25.38  ? 142 LEU A HA   1 
ATOM   2396 H  HB2  . LEU A 1 142 ? -27.554 21.779  -0.267  1.00 28.23  ? 142 LEU A HB2  1 
ATOM   2397 H  HB3  . LEU A 1 142 ? -26.405 22.736  -0.803  1.00 28.23  ? 142 LEU A HB3  1 
ATOM   2398 H  HG   . LEU A 1 142 ? -25.011 21.970  0.907   1.00 31.26  ? 142 LEU A HG   1 
ATOM   2399 H  HD11 . LEU A 1 142 ? -27.123 20.216  1.528   1.00 33.02  ? 142 LEU A HD11 1 
ATOM   2400 H  HD12 . LEU A 1 142 ? -25.659 20.055  2.121   1.00 33.02  ? 142 LEU A HD12 1 
ATOM   2401 H  HD13 . LEU A 1 142 ? -26.531 21.328  2.496   1.00 33.02  ? 142 LEU A HD13 1 
ATOM   2402 H  HD21 . LEU A 1 142 ? -24.566 19.866  -0.024  1.00 33.80  ? 142 LEU A HD21 1 
ATOM   2403 H  HD22 . LEU A 1 142 ? -25.997 19.862  -0.713  1.00 33.80  ? 142 LEU A HD22 1 
ATOM   2404 H  HD23 . LEU A 1 142 ? -24.890 20.898  -1.187  1.00 33.80  ? 142 LEU A HD23 1 
ATOM   2405 N  N    . GLU A 1 143 ? -25.704 25.236  0.508   1.00 24.37  ? 143 GLU A N    1 
ATOM   2406 C  CA   . GLU A 1 143 ? -24.646 26.130  0.945   1.00 25.80  ? 143 GLU A CA   1 
ATOM   2407 C  C    . GLU A 1 143 ? -25.110 26.985  2.105   1.00 24.68  ? 143 GLU A C    1 
ATOM   2408 O  O    . GLU A 1 143 ? -24.343 27.237  3.048   1.00 24.87  ? 143 GLU A O    1 
ATOM   2409 C  CB   . GLU A 1 143 ? -24.155 27.015  -0.198  1.00 28.46  ? 143 GLU A CB   1 
ATOM   2410 C  CG   . GLU A 1 143 ? -22.765 27.604  0.111   1.00 31.87  ? 143 GLU A CG   1 
ATOM   2411 C  CD   . GLU A 1 143 ? -22.855 28.878  0.923   0.19 32.90  ? 143 GLU A CD   1 
ATOM   2412 O  OE1  . GLU A 1 143 ? -22.000 29.088  1.803   0.55 31.99  ? 143 GLU A OE1  1 
ATOM   2413 O  OE2  . GLU A 1 143 ? -23.781 29.675  0.668   0.49 34.99  ? 143 GLU A OE2  1 
ATOM   2414 H  H    . GLU A 1 143 ? -25.951 25.329  -0.311  1.00 29.25  ? 143 GLU A H    1 
ATOM   2415 H  HA   . GLU A 1 143 ? -23.895 25.588  1.231   1.00 30.97  ? 143 GLU A HA   1 
ATOM   2416 H  HB2  . GLU A 1 143 ? -24.091 26.486  -1.009  1.00 34.17  ? 143 GLU A HB2  1 
ATOM   2417 H  HB3  . GLU A 1 143 ? -24.778 27.748  -0.328  1.00 34.17  ? 143 GLU A HB3  1 
ATOM   2418 H  HG2  . GLU A 1 143 ? -22.251 26.957  0.618   1.00 38.26  ? 143 GLU A HG2  1 
ATOM   2419 H  HG3  . GLU A 1 143 ? -22.313 27.808  -0.723  1.00 38.26  ? 143 GLU A HG3  1 
ATOM   2420 N  N    . SER A 1 144 ? -26.347 27.479  2.025   1.00 23.44  ? 144 SER A N    1 
ATOM   2421 C  CA   . SER A 1 144 ? -26.857 28.381  3.052   1.00 22.83  ? 144 SER A CA   1 
ATOM   2422 C  C    . SER A 1 144 ? -27.053 27.660  4.381   1.00 21.41  ? 144 SER A C    1 
ATOM   2423 O  O    . SER A 1 144 ? -26.692 28.186  5.438   1.00 20.96  ? 144 SER A O    1 
ATOM   2424 C  CB   . SER A 1 144 ? -28.181 28.993  2.612   1.00 25.95  ? 144 SER A CB   1 
ATOM   2425 O  OG   . SER A 1 144 ? -28.600 29.955  3.561   0.70 25.12  ? 144 SER A OG   1 
ATOM   2426 H  H    . SER A 1 144 ? -26.905 27.307  1.393   1.00 28.14  ? 144 SER A H    1 
ATOM   2427 H  HA   . SER A 1 144 ? -26.210 29.093  3.173   1.00 27.41  ? 144 SER A HA   1 
ATOM   2428 H  HB2  . SER A 1 144 ? -28.065 29.423  1.750   1.00 31.15  ? 144 SER A HB2  1 
ATOM   2429 H  HB3  . SER A 1 144 ? -28.851 28.295  2.547   1.00 31.15  ? 144 SER A HB3  1 
ATOM   2430 H  HG   . SER A 1 144 ? -28.018 30.556  3.637   0.63 30.15  ? 144 SER A HG   1 
ATOM   2431 N  N    . LEU A 1 145 ? -27.611 26.449  4.345   1.00 19.50  ? 145 LEU A N    1 
ATOM   2432 C  CA   . LEU A 1 145 ? -27.838 25.707  5.578   1.00 18.38  ? 145 LEU A CA   1 
ATOM   2433 C  C    . LEU A 1 145 ? -26.519 25.236  6.193   1.00 19.69  ? 145 LEU A C    1 
ATOM   2434 O  O    . LEU A 1 145 ? -26.390 25.160  7.420   1.00 19.26  ? 145 LEU A O    1 
ATOM   2435 C  CB   . LEU A 1 145 ? -28.780 24.534  5.293   1.00 18.62  ? 145 LEU A CB   1 
ATOM   2436 C  CG   . LEU A 1 145 ? -30.244 24.887  4.987   1.00 19.39  ? 145 LEU A CG   1 
ATOM   2437 C  CD1  . LEU A 1 145 ? -30.958 23.686  4.392   1.00 19.24  ? 145 LEU A CD1  1 
ATOM   2438 C  CD2  . LEU A 1 145 ? -30.965 25.369  6.243   1.00 20.78  ? 145 LEU A CD2  1 
ATOM   2439 H  H    . LEU A 1 145 ? -27.864 26.044  3.629   1.00 23.42  ? 145 LEU A H    1 
ATOM   2440 H  HA   . LEU A 1 145 ? -28.268 26.276  6.235   1.00 22.07  ? 145 LEU A HA   1 
ATOM   2441 H  HB2  . LEU A 1 145 ? -28.437 24.054  4.523   1.00 22.35  ? 145 LEU A HB2  1 
ATOM   2442 H  HB3  . LEU A 1 145 ? -28.783 23.955  6.071   1.00 22.35  ? 145 LEU A HB3  1 
ATOM   2443 H  HG   . LEU A 1 145 ? -30.266 25.610  4.341   1.00 23.28  ? 145 LEU A HG   1 
ATOM   2444 H  HD11 . LEU A 1 145 ? -31.881 23.924  4.213   1.00 23.10  ? 145 LEU A HD11 1 
ATOM   2445 H  HD12 . LEU A 1 145 ? -30.516 23.433  3.567   1.00 23.10  ? 145 LEU A HD12 1 
ATOM   2446 H  HD13 . LEU A 1 145 ? -30.923 22.952  5.026   1.00 23.10  ? 145 LEU A HD13 1 
ATOM   2447 H  HD21 . LEU A 1 145 ? -30.921 24.675  6.919   1.00 24.95  ? 145 LEU A HD21 1 
ATOM   2448 H  HD22 . LEU A 1 145 ? -30.530 26.174  6.568   1.00 24.95  ? 145 LEU A HD22 1 
ATOM   2449 H  HD23 . LEU A 1 145 ? -31.890 25.559  6.024   1.00 24.95  ? 145 LEU A HD23 1 
ATOM   2450 N  N    . LEU A 1 146 ? -25.526 24.943  5.365   1.00 20.16  ? 146 LEU A N    1 
ATOM   2451 C  CA   . LEU A 1 146 ? -24.213 24.573  5.878   1.00 20.04  ? 146 LEU A CA   1 
ATOM   2452 C  C    . LEU A 1 146 ? -23.583 25.729  6.641   1.00 19.83  ? 146 LEU A C    1 
ATOM   2453 O  O    . LEU A 1 146 ? -23.067 25.558  7.753   1.00 20.79  ? 146 LEU A O    1 
ATOM   2454 C  CB   . LEU A 1 146 ? -23.323 24.143  4.707   1.00 21.08  ? 146 LEU A CB   1 
ATOM   2455 C  CG   . LEU A 1 146 ? -21.834 23.904  5.007   1.00 21.96  ? 146 LEU A CG   1 
ATOM   2456 C  CD1  . LEU A 1 146 ? -21.671 22.861  6.147   1.00 22.73  ? 146 LEU A CD1  1 
ATOM   2457 C  CD2  . LEU A 1 146 ? -21.097 23.473  3.733   1.00 24.47  ? 146 LEU A CD2  1 
ATOM   2458 H  H    . LEU A 1 146 ? -25.584 24.950  4.507   1.00 24.21  ? 146 LEU A H    1 
ATOM   2459 H  HA   . LEU A 1 146 ? -24.301 23.827  6.491   1.00 24.06  ? 146 LEU A HA   1 
ATOM   2460 H  HB2  . LEU A 1 146 ? -23.676 23.312  4.354   1.00 25.31  ? 146 LEU A HB2  1 
ATOM   2461 H  HB3  . LEU A 1 146 ? -23.366 24.836  4.030   1.00 25.31  ? 146 LEU A HB3  1 
ATOM   2462 H  HG   . LEU A 1 146 ? -21.426 24.729  5.312   1.00 26.37  ? 146 LEU A HG   1 
ATOM   2463 H  HD11 . LEU A 1 146 ? -21.982 23.251  6.979   1.00 27.29  ? 146 LEU A HD11 1 
ATOM   2464 H  HD12 . LEU A 1 146 ? -22.197 22.074  5.934   1.00 27.29  ? 146 LEU A HD12 1 
ATOM   2465 H  HD13 . LEU A 1 146 ? -20.734 22.620  6.225   1.00 27.29  ? 146 LEU A HD13 1 
ATOM   2466 H  HD21 . LEU A 1 146 ? -21.498 22.656  3.397   1.00 29.38  ? 146 LEU A HD21 1 
ATOM   2467 H  HD22 . LEU A 1 146 ? -21.175 24.177  3.070   1.00 29.38  ? 146 LEU A HD22 1 
ATOM   2468 H  HD23 . LEU A 1 146 ? -20.163 23.320  3.945   1.00 29.38  ? 146 LEU A HD23 1 
ATOM   2469 N  N    . GLU A 1 147 ? -23.600 26.916  6.040   1.00 21.38  ? 147 GLU A N    1 
ATOM   2470 C  CA   . GLU A 1 147 ? -23.123 28.123  6.710   1.00 21.73  ? 147 GLU A CA   1 
ATOM   2471 C  C    . GLU A 1 147 ? -23.898 28.381  8.002   1.00 21.00  ? 147 GLU A C    1 
ATOM   2472 O  O    . GLU A 1 147 ? -23.316 28.785  9.019   1.00 22.32  ? 147 GLU A O    1 
ATOM   2473 C  CB   . GLU A 1 147 ? -23.267 29.311  5.751   1.00 23.54  ? 147 GLU A CB   1 
ATOM   2474 C  CG   . GLU A 1 147 ? -22.786 30.617  6.289   1.00 26.39  ? 147 GLU A CG   1 
ATOM   2475 C  CD   . GLU A 1 147 ? -22.524 31.696  5.243   1.00 26.18  ? 147 GLU A CD   1 
ATOM   2476 O  OE1  . GLU A 1 147 ? -22.345 31.408  4.020   1.00 26.69  ? 147 GLU A OE1  1 
ATOM   2477 O  OE2  . GLU A 1 147 ? -22.561 32.855  5.688   0.79 26.12  ? 147 GLU A OE2  1 
ATOM   2478 H  H    . GLU A 1 147 ? -23.884 27.052  5.239   1.00 25.67  ? 147 GLU A H    1 
ATOM   2479 H  HA   . GLU A 1 147 ? -22.188 28.018  6.944   1.00 26.09  ? 147 GLU A HA   1 
ATOM   2480 H  HB2  . GLU A 1 147 ? -22.757 29.121  4.948   1.00 28.26  ? 147 GLU A HB2  1 
ATOM   2481 H  HB3  . GLU A 1 147 ? -24.206 29.415  5.530   1.00 28.26  ? 147 GLU A HB3  1 
ATOM   2482 H  HG2  . GLU A 1 147 ? -23.456 30.962  6.899   1.00 31.68  ? 147 GLU A HG2  1 
ATOM   2483 H  HG3  . GLU A 1 147 ? -21.953 30.465  6.762   1.00 31.68  ? 147 GLU A HG3  1 
ATOM   2484 N  N    . TYR A 1 148 ? -25.213 28.156  7.979   1.00 19.97  ? 148 TYR A N    1 
ATOM   2485 C  CA   . TYR A 1 148 ? -26.038 28.422  9.149   1.00 19.80  ? 148 TYR A CA   1 
ATOM   2486 C  C    . TYR A 1 148 ? -25.664 27.488  10.295  1.00 18.99  ? 148 TYR A C    1 
ATOM   2487 O  O    . TYR A 1 148 ? -25.522 27.911  11.448  1.00 20.31  ? 148 TYR A O    1 
ATOM   2488 C  CB   . TYR A 1 148 ? -27.514 28.274  8.759   1.00 21.46  ? 148 TYR A CB   1 
ATOM   2489 C  CG   . TYR A 1 148 ? -28.477 28.782  9.805   1.00 21.21  ? 148 TYR A CG   1 
ATOM   2490 C  CD1  . TYR A 1 148 ? -28.684 30.118  9.980   1.00 22.19  ? 148 TYR A CD1  1 
ATOM   2491 C  CD2  . TYR A 1 148 ? -29.171 27.907  10.619  1.00 20.85  ? 148 TYR A CD2  1 
ATOM   2492 C  CE1  . TYR A 1 148 ? -29.538 30.587  10.926  1.00 23.45  ? 148 TYR A CE1  1 
ATOM   2493 C  CE2  . TYR A 1 148 ? -30.034 28.361  11.590  1.00 21.73  ? 148 TYR A CE2  1 
ATOM   2494 C  CZ   . TYR A 1 148 ? -30.231 29.708  11.730  1.00 22.81  ? 148 TYR A CZ   1 
ATOM   2495 O  OH   . TYR A 1 148 ? -31.092 30.184  12.691  1.00 24.90  ? 148 TYR A OH   1 
ATOM   2496 H  H    . TYR A 1 148 ? -25.646 27.851  7.302   1.00 23.97  ? 148 TYR A H    1 
ATOM   2497 H  HA   . TYR A 1 148 ? -25.898 29.331  9.458   1.00 23.78  ? 148 TYR A HA   1 
ATOM   2498 H  HB2  . TYR A 1 148 ? -27.672 28.775  7.943   1.00 25.77  ? 148 TYR A HB2  1 
ATOM   2499 H  HB3  . TYR A 1 148 ? -27.704 27.334  8.613   1.00 25.77  ? 148 TYR A HB3  1 
ATOM   2500 H  HD1  . TYR A 1 148 ? -28.231 30.723  9.438   1.00 26.64  ? 148 TYR A HD1  1 
ATOM   2501 H  HD2  . TYR A 1 148 ? -29.053 26.992  10.508  1.00 25.03  ? 148 TYR A HD2  1 
ATOM   2502 H  HE1  . TYR A 1 148 ? -29.654 31.504  11.032  1.00 28.16  ? 148 TYR A HE1  1 
ATOM   2503 H  HE2  . TYR A 1 148 ? -30.477 27.760  12.145  1.00 26.09  ? 148 TYR A HE2  1 
ATOM   2504 H  HH   . TYR A 1 148 ? -31.410 29.545  13.133  1.00 29.89  ? 148 TYR A HH   1 
ATOM   2505 N  N    . ALA A 1 149 ? -25.508 26.206  9.999   1.00 19.44  ? 149 ALA A N    1 
ATOM   2506 C  CA   . ALA A 1 149 ? -25.087 25.268  11.031  1.00 19.82  ? 149 ALA A CA   1 
ATOM   2507 C  C    . ALA A 1 149 ? -23.707 25.611  11.570  1.00 19.87  ? 149 ALA A C    1 
ATOM   2508 O  O    . ALA A 1 149 ? -23.486 25.554  12.784  1.00 20.26  ? 149 ALA A O    1 
ATOM   2509 C  CB   . ALA A 1 149 ? -25.096 23.850  10.457  1.00 21.56  ? 149 ALA A CB   1 
ATOM   2510 H  H    . ALA A 1 149 ? -25.637 25.858  9.223   1.00 23.34  ? 149 ALA A H    1 
ATOM   2511 H  HA   . ALA A 1 149 ? -25.713 25.311  11.771  1.00 23.80  ? 149 ALA A HA   1 
ATOM   2512 H  HB1  . ALA A 1 149 ? -24.505 23.817  9.689   1.00 25.88  ? 149 ALA A HB1  1 
ATOM   2513 H  HB2  . ALA A 1 149 ? -24.788 23.232  11.139  1.00 25.88  ? 149 ALA A HB2  1 
ATOM   2514 H  HB3  . ALA A 1 149 ? -26.000 23.624  10.189  1.00 25.88  ? 149 ALA A HB3  1 
ATOM   2515 N  N    . ARG A 1 150 ? -22.776 26.002  10.697  1.00 21.29  ? 150 ARG A N    1 
ATOM   2516 C  CA   . ARG A 1 150 ? -21.446 26.392  11.163  1.00 21.51  ? 150 ARG A CA   1 
ATOM   2517 C  C    . ARG A 1 150 ? -21.506 27.614  12.065  1.00 21.83  ? 150 ARG A C    1 
ATOM   2518 O  O    . ARG A 1 150 ? -20.668 27.758  12.964  1.00 23.26  ? 150 ARG A O    1 
ATOM   2519 C  CB   . ARG A 1 150 ? -20.497 26.641  9.984   1.00 21.42  ? 150 ARG A CB   1 
ATOM   2520 C  CG   . ARG A 1 150 ? -20.079 25.350  9.293   1.00 21.88  ? 150 ARG A CG   1 
ATOM   2521 C  CD   . ARG A 1 150 ? -19.040 25.604  8.235   1.00 24.51  ? 150 ARG A CD   1 
ATOM   2522 N  NE   . ARG A 1 150 ? -18.520 24.379  7.632   1.00 22.92  ? 150 ARG A NE   1 
ATOM   2523 C  CZ   . ARG A 1 150 ? -18.230 24.246  6.347   1.00 23.04  ? 150 ARG A CZ   1 
ATOM   2524 N  NH1  . ARG A 1 150 ? -18.364 25.253  5.500   1.00 23.84  ? 150 ARG A NH1  1 
ATOM   2525 N  NH2  . ARG A 1 150 ? -17.760 23.086  5.907   1.00 22.45  ? 150 ARG A NH2  1 
ATOM   2526 H  H    . ARG A 1 150 ? -22.887 26.050  9.845   1.00 25.56  ? 150 ARG A H    1 
ATOM   2527 H  HA   . ARG A 1 150 ? -21.078 25.655  11.674  1.00 25.82  ? 150 ARG A HA   1 
ATOM   2528 H  HB2  . ARG A 1 150 ? -20.943 27.202  9.330   1.00 25.72  ? 150 ARG A HB2  1 
ATOM   2529 H  HB3  . ARG A 1 150 ? -19.696 27.082  10.309  1.00 25.72  ? 150 ARG A HB3  1 
ATOM   2530 H  HG2  . ARG A 1 150 ? -19.704 24.742  9.949   1.00 26.27  ? 150 ARG A HG2  1 
ATOM   2531 H  HG3  . ARG A 1 150 ? -20.853 24.947  8.871   1.00 26.27  ? 150 ARG A HG3  1 
ATOM   2532 H  HD2  . ARG A 1 150 ? -19.435 26.139  7.529   1.00 29.42  ? 150 ARG A HD2  1 
ATOM   2533 H  HD3  . ARG A 1 150 ? -18.295 26.079  8.634   1.00 29.42  ? 150 ARG A HD3  1 
ATOM   2534 H  HE   . ARG A 1 150 ? -18.394 23.700  8.145   1.00 27.52  ? 150 ARG A HE   1 
ATOM   2535 H  HH11 . ARG A 1 150 ? -18.644 26.016  5.781   1.00 28.62  ? 150 ARG A HH11 1 
ATOM   2536 H  HH12 . ARG A 1 150 ? -18.170 25.145  4.670   1.00 28.62  ? 150 ARG A HH12 1 
ATOM   2537 H  HH21 . ARG A 1 150 ? -17.646 22.433  6.455   1.00 26.95  ? 150 ARG A HH21 1 
ATOM   2538 H  HH22 . ARG A 1 150 ? -17.568 22.988  5.075   1.00 26.95  ? 150 ARG A HH22 1 
ATOM   2539 N  N    . SER A 1 151 ? -22.491 28.497  11.863  1.00 21.12  ? 151 SER A N    1 
ATOM   2540 C  CA   . SER A 1 151 ? -22.585 29.691  12.690  1.00 22.25  ? 151 SER A CA   1 
ATOM   2541 C  C    . SER A 1 151 ? -22.945 29.358  14.128  1.00 22.12  ? 151 SER A C    1 
ATOM   2542 O  O    . SER A 1 151 ? -22.662 30.164  15.022  1.00 23.48  ? 151 SER A O    1 
ATOM   2543 C  CB   . SER A 1 151 ? -23.580 30.688  12.091  1.00 22.83  ? 151 SER A CB   1 
ATOM   2544 O  OG   . SER A 1 151 ? -24.911 30.366  12.417  1.00 23.93  ? 151 SER A OG   1 
ATOM   2545 H  H    . SER A 1 151 ? -23.103 28.424  11.264  1.00 25.36  ? 151 SER A H    1 
ATOM   2546 H  HA   . SER A 1 151 ? -21.723 30.136  12.700  1.00 26.72  ? 151 SER A HA   1 
ATOM   2547 H  HB2  . SER A 1 151 ? -23.380 31.572  12.436  1.00 27.41  ? 151 SER A HB2  1 
ATOM   2548 H  HB3  . SER A 1 151 ? -23.485 30.679  11.125  1.00 27.41  ? 151 SER A HB3  1 
ATOM   2549 H  HG   . SER A 1 151 ? -25.435 30.922  12.068  1.00 28.73  ? 151 SER A HG   1 
ATOM   2550 N  N    . TYR A 1 152 ? -23.556 28.195  14.363  1.00 21.74  ? 152 TYR A N    1 
ATOM   2551 C  CA   . TYR A 1 152 ? -23.745 27.689  15.713  1.00 21.59  ? 152 TYR A CA   1 
ATOM   2552 C  C    . TYR A 1 152 ? -22.507 26.983  16.264  1.00 23.12  ? 152 TYR A C    1 
ATOM   2553 O  O    . TYR A 1 152 ? -22.474 26.661  17.456  1.00 26.58  ? 152 TYR A O    1 
ATOM   2554 C  CB   . TYR A 1 152 ? -24.899 26.692  15.720  1.00 21.39  ? 152 TYR A CB   1 
ATOM   2555 C  CG   . TYR A 1 152 ? -26.282 27.257  15.857  1.00 21.61  ? 152 TYR A CG   1 
ATOM   2556 C  CD1  . TYR A 1 152 ? -26.720 27.790  17.062  1.00 23.50  ? 152 TYR A CD1  1 
ATOM   2557 C  CD2  . TYR A 1 152 ? -27.182 27.204  14.812  1.00 22.96  ? 152 TYR A CD2  1 
ATOM   2558 C  CE1  . TYR A 1 152 ? -27.991 28.277  17.207  1.00 23.34  ? 152 TYR A CE1  1 
ATOM   2559 C  CE2  . TYR A 1 152 ? -28.474 27.694  14.957  1.00 24.00  ? 152 TYR A CE2  1 
ATOM   2560 C  CZ   . TYR A 1 152 ? -28.874 28.222  16.162  1.00 23.02  ? 152 TYR A CZ   1 
ATOM   2561 O  OH   . TYR A 1 152 ? -30.153 28.696  16.333  1.00 24.54  ? 152 TYR A OH   1 
ATOM   2562 H  H    . TYR A 1 152 ? -23.871 27.680  13.750  1.00 26.10  ? 152 TYR A H    1 
ATOM   2563 H  HA   . TYR A 1 152 ? -23.957 28.436  16.295  1.00 25.92  ? 152 TYR A HA   1 
ATOM   2564 H  HB2  . TYR A 1 152 ? -24.876 26.201  14.884  1.00 25.68  ? 152 TYR A HB2  1 
ATOM   2565 H  HB3  . TYR A 1 152 ? -24.766 26.085  16.465  1.00 25.68  ? 152 TYR A HB3  1 
ATOM   2566 H  HD1  . TYR A 1 152 ? -26.137 27.817  17.786  1.00 28.22  ? 152 TYR A HD1  1 
ATOM   2567 H  HD2  . TYR A 1 152 ? -26.920 26.835  13.999  1.00 27.57  ? 152 TYR A HD2  1 
ATOM   2568 H  HE1  . TYR A 1 152 ? -28.255 28.646  18.019  1.00 28.02  ? 152 TYR A HE1  1 
ATOM   2569 H  HE2  . TYR A 1 152 ? -29.067 27.664  14.242  1.00 28.81  ? 152 TYR A HE2  1 
ATOM   2570 H  HH   . TYR A 1 152 ? -30.595 28.592  15.626  1.00 29.46  ? 152 TYR A HH   1 
ATOM   2571 N  N    . GLY A 1 153 ? -21.525 26.683  15.425  1.00 22.25  ? 153 GLY A N    1 
ATOM   2572 C  CA   . GLY A 1 153 ? -20.394 25.878  15.816  1.00 22.49  ? 153 GLY A CA   1 
ATOM   2573 C  C    . GLY A 1 153 ? -20.479 24.416  15.432  1.00 22.25  ? 153 GLY A C    1 
ATOM   2574 O  O    . GLY A 1 153 ? -19.661 23.625  15.916  1.00 24.23  ? 153 GLY A O    1 
ATOM   2575 H  H    . GLY A 1 153 ? -21.497 26.943  14.606  1.00 26.71  ? 153 GLY A H    1 
ATOM   2576 H  HA2  . GLY A 1 153 ? -19.596 26.246  15.403  1.00 27.00  ? 153 GLY A HA2  1 
ATOM   2577 H  HA3  . GLY A 1 153 ? -20.300 25.924  16.780  1.00 27.00  ? 153 GLY A HA3  1 
ATOM   2578 N  N    . MET A 1 154 ? -21.434 24.038  14.594  1.00 21.36  ? 154 MET A N    1 
ATOM   2579 C  CA   . MET A 1 154 ? -21.561 22.667  14.127  1.00 20.26  ? 154 MET A CA   1 
ATOM   2580 C  C    . MET A 1 154 ? -20.761 22.464  12.847  1.00 22.83  ? 154 MET A C    1 
ATOM   2581 O  O    . MET A 1 154 ? -20.534 23.402  12.083  1.00 25.12  ? 154 MET A O    1 
ATOM   2582 C  CB   . MET A 1 154 ? -23.026 22.346  13.802  1.00 21.76  ? 154 MET A CB   1 
ATOM   2583 C  CG   . MET A 1 154 ? -24.006 22.591  14.917  1.00 20.82  ? 154 MET A CG   1 
ATOM   2584 S  SD   . MET A 1 154 ? -25.651 22.118  14.338  1.00 22.78  ? 154 MET A SD   1 
ATOM   2585 C  CE   . MET A 1 154 ? -26.516 22.290  15.883  1.00 24.99  ? 154 MET A CE   1 
ATOM   2586 H  H    . MET A 1 154 ? -22.033 24.568  14.276  1.00 25.64  ? 154 MET A H    1 
ATOM   2587 H  HA   . MET A 1 154 ? -21.242 22.076  14.826  1.00 24.33  ? 154 MET A HA   1 
ATOM   2588 H  HB2  . MET A 1 154 ? -23.300 22.897  13.051  1.00 26.12  ? 154 MET A HB2  1 
ATOM   2589 H  HB3  . MET A 1 154 ? -23.088 21.408  13.565  1.00 26.12  ? 154 MET A HB3  1 
ATOM   2590 H  HG2  . MET A 1 154 ? -23.772 22.054  15.690  1.00 24.99  ? 154 MET A HG2  1 
ATOM   2591 H  HG3  . MET A 1 154 ? -24.010 23.532  15.156  1.00 24.99  ? 154 MET A HG3  1 
ATOM   2592 H  HE1  . MET A 1 154 ? -27.445 22.042  15.754  1.00 29.99  ? 154 MET A HE1  1 
ATOM   2593 H  HE2  . MET A 1 154 ? -26.106 21.706  16.540  1.00 29.99  ? 154 MET A HE2  1 
ATOM   2594 H  HE3  . MET A 1 154 ? -26.457 23.212  16.177  1.00 29.99  ? 154 MET A HE3  1 
ATOM   2595 N  N    . GLU A 1 155 ? -20.340 21.228  12.619  1.00 20.52  ? 155 GLU A N    1 
ATOM   2596 C  CA   . GLU A 1 155 ? -19.835 20.802  11.311  1.00 18.88  ? 155 GLU A CA   1 
ATOM   2597 C  C    . GLU A 1 155 ? -20.777 19.721  10.821  1.00 17.53  ? 155 GLU A C    1 
ATOM   2598 O  O    . GLU A 1 155 ? -20.695 18.563  11.280  1.00 18.52  ? 155 GLU A O    1 
ATOM   2599 C  CB   . GLU A 1 155 ? -18.406 20.278  11.370  1.00 20.65  ? 155 GLU A CB   1 
ATOM   2600 C  CG   . GLU A 1 155 ? -17.855 19.946  9.948   1.00 22.67  ? 155 GLU A CG   1 
ATOM   2601 C  CD   . GLU A 1 155 ? -17.823 21.154  8.994   1.00 25.21  ? 155 GLU A CD   1 
ATOM   2602 O  OE1  . GLU A 1 155 ? -17.697 22.283  9.486   1.00 25.61  ? 155 GLU A OE1  1 
ATOM   2603 O  OE2  . GLU A 1 155 ? -17.938 20.964  7.755   1.00 26.12  ? 155 GLU A OE2  1 
ATOM   2604 H  H    . GLU A 1 155 ? -20.335 20.605  13.212  1.00 24.64  ? 155 GLU A H    1 
ATOM   2605 H  HA   . GLU A 1 155 ? -19.821 21.557  10.703  1.00 22.67  ? 155 GLU A HA   1 
ATOM   2606 H  HB2  . GLU A 1 155 ? -17.834 20.952  11.769  1.00 24.79  ? 155 GLU A HB2  1 
ATOM   2607 H  HB3  . GLU A 1 155 ? -18.384 19.467  11.902  1.00 24.79  ? 155 GLU A HB3  1 
ATOM   2608 H  HG2  . GLU A 1 155 ? -16.947 19.615  10.035  1.00 27.21  ? 155 GLU A HG2  1 
ATOM   2609 H  HG3  . GLU A 1 155 ? -18.419 19.267  9.546   1.00 27.21  ? 155 GLU A HG3  1 
ATOM   2610 N  N    . PRO A 1 156 ? -21.687 20.045  9.911   1.00 18.30  ? 156 PRO A N    1 
ATOM   2611 C  CA   . PRO A 1 156 ? -22.693 19.075  9.481   1.00 17.34  ? 156 PRO A CA   1 
ATOM   2612 C  C    . PRO A 1 156 ? -22.090 17.942  8.681   1.00 17.17  ? 156 PRO A C    1 
ATOM   2613 O  O    . PRO A 1 156 ? -21.086 18.107  7.976   1.00 18.69  ? 156 PRO A O    1 
ATOM   2614 C  CB   . PRO A 1 156 ? -23.632 19.892  8.584   1.00 20.11  ? 156 PRO A CB   1 
ATOM   2615 C  CG   . PRO A 1 156 ? -23.343 21.306  8.834   1.00 22.91  ? 156 PRO A CG   1 
ATOM   2616 C  CD   . PRO A 1 156 ? -21.973 21.413  9.454   1.00 20.67  ? 156 PRO A CD   1 
ATOM   2617 H  HA   . PRO A 1 156 ? -23.167 18.730  10.254  1.00 20.83  ? 156 PRO A HA   1 
ATOM   2618 H  HB2  . PRO A 1 156 ? -23.464 19.671  7.655   1.00 24.14  ? 156 PRO A HB2  1 
ATOM   2619 H  HB3  . PRO A 1 156 ? -24.553 19.689  8.812   1.00 24.14  ? 156 PRO A HB3  1 
ATOM   2620 H  HG2  . PRO A 1 156 ? -23.367 21.787  7.992   1.00 27.50  ? 156 PRO A HG2  1 
ATOM   2621 H  HG3  . PRO A 1 156 ? -24.012 21.663  9.439   1.00 27.50  ? 156 PRO A HG3  1 
ATOM   2622 H  HD2  . PRO A 1 156 ? -21.320 21.699  8.796   1.00 24.82  ? 156 PRO A HD2  1 
ATOM   2623 H  HD3  . PRO A 1 156 ? -21.982 22.030  10.202  1.00 24.82  ? 156 PRO A HD3  1 
ATOM   2624 N  N    . LEU A 1 157 ? -22.794 16.810  8.715   1.00 16.56  ? 157 LEU A N    1 
ATOM   2625 C  CA   . LEU A 1 157 ? -22.511 15.659  7.868   1.00 16.08  ? 157 LEU A CA   1 
ATOM   2626 C  C    . LEU A 1 157 ? -23.310 15.819  6.585   1.00 16.25  ? 157 LEU A C    1 
ATOM   2627 O  O    . LEU A 1 157 ? -24.538 15.837  6.624   1.00 17.84  ? 157 LEU A O    1 
ATOM   2628 C  CB   . LEU A 1 157 ? -22.866 14.379  8.610   1.00 16.78  ? 157 LEU A CB   1 
ATOM   2629 C  CG   . LEU A 1 157 ? -22.551 13.065  7.885   1.00 17.51  ? 157 LEU A CG   1 
ATOM   2630 C  CD1  . LEU A 1 157 ? -21.044 12.923  7.743   1.00 17.11  ? 157 LEU A CD1  1 
ATOM   2631 C  CD2  . LEU A 1 157 ? -23.147 11.861  8.602   1.00 20.53  ? 157 LEU A CD2  1 
ATOM   2632 H  H    . LEU A 1 157 ? -23.463 16.683  9.240   1.00 19.88  ? 157 LEU A H    1 
ATOM   2633 H  HA   . LEU A 1 157 ? -21.571 15.621  7.635   1.00 19.30  ? 157 LEU A HA   1 
ATOM   2634 H  HB2  . LEU A 1 157 ? -22.375 14.370  9.447   1.00 20.15  ? 157 LEU A HB2  1 
ATOM   2635 H  HB3  . LEU A 1 157 ? -23.820 14.388  8.786   1.00 20.15  ? 157 LEU A HB3  1 
ATOM   2636 H  HG   . LEU A 1 157 ? -22.955 13.083  7.003   1.00 21.02  ? 157 LEU A HG   1 
ATOM   2637 H  HD11 . LEU A 1 157 ? -20.635 13.008  8.618   1.00 20.54  ? 157 LEU A HD11 1 
ATOM   2638 H  HD12 . LEU A 1 157 ? -20.843 12.051  7.367   1.00 20.54  ? 157 LEU A HD12 1 
ATOM   2639 H  HD13 . LEU A 1 157 ? -20.715 13.620  7.154   1.00 20.54  ? 157 LEU A HD13 1 
ATOM   2640 H  HD21 . LEU A 1 157 ? -22.926 11.056  8.108   1.00 24.65  ? 157 LEU A HD21 1 
ATOM   2641 H  HD22 . LEU A 1 157 ? -22.776 11.811  9.497   1.00 24.65  ? 157 LEU A HD22 1 
ATOM   2642 H  HD23 . LEU A 1 157 ? -24.110 11.966  8.649   1.00 24.65  ? 157 LEU A HD23 1 
ATOM   2643 N  N    . ILE A 1 158 ? -22.605 16.023  5.461   1.00 16.63  ? 158 ILE A N    1 
ATOM   2644 C  CA   . ILE A 1 158 ? -23.227 16.251  4.162   1.00 16.78  ? 158 ILE A CA   1 
ATOM   2645 C  C    . ILE A 1 158 ? -23.329 14.892  3.474   1.00 16.48  ? 158 ILE A C    1 
ATOM   2646 O  O    . ILE A 1 158 ? -22.314 14.256  3.182   1.00 16.86  ? 158 ILE A O    1 
ATOM   2647 C  CB   . ILE A 1 158 ? -22.368 17.202  3.318   1.00 18.17  ? 158 ILE A CB   1 
ATOM   2648 C  CG1  . ILE A 1 158 ? -22.108 18.532  4.019   1.00 21.66  ? 158 ILE A CG1  1 
ATOM   2649 C  CG2  . ILE A 1 158 ? -23.008 17.427  1.945   1.00 19.15  ? 158 ILE A CG2  1 
ATOM   2650 C  CD1  . ILE A 1 158 ? -23.312 19.279  4.438   1.00 24.66  ? 158 ILE A CD1  1 
ATOM   2651 H  H    . ILE A 1 158 ? -21.745 16.033  5.432   1.00 19.97  ? 158 ILE A H    1 
ATOM   2652 H  HA   . ILE A 1 158 ? -24.112 16.632  4.273   1.00 20.15  ? 158 ILE A HA   1 
ATOM   2653 H  HB   . ILE A 1 158 ? -21.505 16.774  3.201   1.00 21.81  ? 158 ILE A HB   1 
ATOM   2654 H  HG12 . ILE A 1 158 ? -21.585 18.358  4.817   1.00 26.01  ? 158 ILE A HG12 1 
ATOM   2655 H  HG13 . ILE A 1 158 ? -21.611 19.103  3.413   1.00 26.01  ? 158 ILE A HG13 1 
ATOM   2656 H  HG21 . ILE A 1 158 ? -22.538 18.144  1.492   1.00 22.99  ? 158 ILE A HG21 1 
ATOM   2657 H  HG22 . ILE A 1 158 ? -22.942 16.609  1.428   1.00 22.99  ? 158 ILE A HG22 1 
ATOM   2658 H  HG23 . ILE A 1 158 ? -23.939 17.667  2.067   1.00 22.99  ? 158 ILE A HG23 1 
ATOM   2659 H  HD11 . ILE A 1 158 ? -23.786 18.765  5.110   1.00 29.61  ? 158 ILE A HD11 1 
ATOM   2660 H  HD12 . ILE A 1 158 ? -23.041 20.134  4.807   1.00 29.61  ? 158 ILE A HD12 1 
ATOM   2661 H  HD13 . ILE A 1 158 ? -23.882 19.418  3.665   1.00 29.61  ? 158 ILE A HD13 1 
ATOM   2662 N  N    . GLU A 1 159 ? -24.548 14.444  3.213   1.00 16.60  ? 159 GLU A N    1 
ATOM   2663 C  CA   . GLU A 1 159 ? -24.810 13.078  2.789   1.00 15.79  ? 159 GLU A CA   1 
ATOM   2664 C  C    . GLU A 1 159 ? -25.020 13.003  1.280   1.00 15.71  ? 159 GLU A C    1 
ATOM   2665 O  O    . GLU A 1 159 ? -25.860 13.722  0.711   1.00 16.31  ? 159 GLU A O    1 
ATOM   2666 C  CB   . GLU A 1 159 ? -26.025 12.550  3.548   1.00 18.34  ? 159 GLU A CB   1 
ATOM   2667 C  CG   . GLU A 1 159 ? -25.722 12.391  5.039   1.00 22.39  ? 159 GLU A CG   1 
ATOM   2668 C  CD   . GLU A 1 159 ? -26.632 11.411  5.753   1.00 25.83  ? 159 GLU A CD   1 
ATOM   2669 O  OE1  . GLU A 1 159 ? -26.413 11.212  6.954   1.00 26.58  ? 159 GLU A OE1  1 
ATOM   2670 O  OE2  . GLU A 1 159 ? -27.546 10.872  5.113   1.00 26.74  ? 159 GLU A OE2  1 
ATOM   2671 H  H    . GLU A 1 159 ? -25.259 14.924  3.276   1.00 19.93  ? 159 GLU A H    1 
ATOM   2672 H  HA   . GLU A 1 159 ? -24.042 12.516  2.977   1.00 18.97  ? 159 GLU A HA   1 
ATOM   2673 H  HB2  . GLU A 1 159 ? -26.761 13.173  3.449   1.00 22.02  ? 159 GLU A HB2  1 
ATOM   2674 H  HB3  . GLU A 1 159 ? -26.274 11.683  3.192   1.00 22.02  ? 159 GLU A HB3  1 
ATOM   2675 H  HG2  . GLU A 1 159 ? -24.811 12.073  5.140   1.00 26.88  ? 159 GLU A HG2  1 
ATOM   2676 H  HG3  . GLU A 1 159 ? -25.822 13.254  5.471   1.00 26.88  ? 159 GLU A HG3  1 
ATOM   2677 N  N    . ILE A 1 160 ? -24.297 12.076  0.660   1.00 16.27  ? 160 ILE A N    1 
ATOM   2678 C  CA   . ILE A 1 160 ? -24.271 11.914  -0.788  1.00 15.62  ? 160 ILE A CA   1 
ATOM   2679 C  C    . ILE A 1 160 ? -24.598 10.466  -1.140  1.00 16.22  ? 160 ILE A C    1 
ATOM   2680 O  O    . ILE A 1 160 ? -24.271 9.528   -0.402  1.00 16.86  ? 160 ILE A O    1 
ATOM   2681 C  CB   . ILE A 1 160 ? -22.906 12.332  -1.400  1.00 16.44  ? 160 ILE A CB   1 
ATOM   2682 C  CG1  . ILE A 1 160 ? -21.813 11.341  -0.998  1.00 17.84  ? 160 ILE A CG1  1 
ATOM   2683 C  CG2  . ILE A 1 160 ? -22.623 13.777  -1.035  1.00 17.20  ? 160 ILE A CG2  1 
ATOM   2684 C  CD1  . ILE A 1 160 ? -20.501 11.474  -1.718  1.00 21.67  ? 160 ILE A CD1  1 
ATOM   2685 H  H    . ILE A 1 160 ? -23.797 11.510  1.071   1.00 19.54  ? 160 ILE A H    1 
ATOM   2686 H  HA   . ILE A 1 160 ? -24.960 12.477  -1.174  1.00 18.76  ? 160 ILE A HA   1 
ATOM   2687 H  HB   . ILE A 1 160 ? -22.933 12.293  -2.369  1.00 19.74  ? 160 ILE A HB   1 
ATOM   2688 H  HG12 . ILE A 1 160 ? -21.632 11.458  -0.052  1.00 21.42  ? 160 ILE A HG12 1 
ATOM   2689 H  HG13 . ILE A 1 160 ? -22.141 10.444  -1.165  1.00 21.42  ? 160 ILE A HG13 1 
ATOM   2690 H  HG21 . ILE A 1 160 ? -23.363 14.329  -1.332  1.00 20.66  ? 160 ILE A HG21 1 
ATOM   2691 H  HG22 . ILE A 1 160 ? -22.523 13.846  -0.073  1.00 20.66  ? 160 ILE A HG22 1 
ATOM   2692 H  HG23 . ILE A 1 160 ? -21.804 14.059  -1.473  1.00 20.66  ? 160 ILE A HG23 1 
ATOM   2693 H  HD11 . ILE A 1 160 ? -20.649 11.350  -2.669  1.00 26.01  ? 160 ILE A HD11 1 
ATOM   2694 H  HD12 . ILE A 1 160 ? -20.138 12.357  -1.552  1.00 26.01  ? 160 ILE A HD12 1 
ATOM   2695 H  HD13 . ILE A 1 160 ? -19.890 10.797  -1.388  1.00 26.01  ? 160 ILE A HD13 1 
ATOM   2696 N  N    . ASN A 1 161 ? -25.169 10.279  -2.330  1.00 17.48  ? 161 ASN A N    1 
ATOM   2697 C  CA   . ASN A 1 161 ? -25.494 8.953   -2.841  1.00 18.03  ? 161 ASN A CA   1 
ATOM   2698 C  C    . ASN A 1 161 ? -25.056 8.748   -4.278  1.00 18.75  ? 161 ASN A C    1 
ATOM   2699 O  O    . ASN A 1 161 ? -24.993 7.595   -4.722  1.00 22.35  ? 161 ASN A O    1 
ATOM   2700 C  CB   . ASN A 1 161 ? -27.009 8.716   -2.718  1.00 18.99  ? 161 ASN A CB   1 
ATOM   2701 C  CG   . ASN A 1 161 ? -27.480 7.404   -3.282  1.00 19.23  ? 161 ASN A CG   1 
ATOM   2702 O  OD1  . ASN A 1 161 ? -28.228 7.396   -4.277  1.00 22.29  ? 161 ASN A OD1  1 
ATOM   2703 N  ND2  . ASN A 1 161 ? -27.102 6.296   -2.653  1.00 19.34  ? 161 ASN A ND2  1 
ATOM   2704 H  H    . ASN A 1 161 ? -25.380 10.916  -2.867  1.00 20.99  ? 161 ASN A H    1 
ATOM   2705 H  HA   . ASN A 1 161 ? -25.053 8.271   -2.309  1.00 21.65  ? 161 ASN A HA   1 
ATOM   2706 H  HB2  . ASN A 1 161 ? -27.250 8.735   -1.779  1.00 22.80  ? 161 ASN A HB2  1 
ATOM   2707 H  HB3  . ASN A 1 161 ? -27.472 9.422   -3.194  1.00 22.80  ? 161 ASN A HB3  1 
ATOM   2708 H  HD21 . ASN A 1 161 ? -27.353 5.528   -2.947  1.00 23.22  ? 161 ASN A HD21 1 
ATOM   2709 H  HD22 . ASN A 1 161 ? -26.607 6.347   -1.952  1.00 23.22  ? 161 ASN A HD22 1 
ATOM   2710 N  N    . ASP A 1 162 ? -24.743 9.807   -5.017  1.00 19.67  ? 162 ASP A N    1 
ATOM   2711 C  CA   . ASP A 1 162 ? -24.367 9.680   -6.425  1.00 21.20  ? 162 ASP A CA   1 
ATOM   2712 C  C    . ASP A 1 162 ? -23.333 10.749  -6.781  1.00 20.60  ? 162 ASP A C    1 
ATOM   2713 O  O    . ASP A 1 162 ? -22.931 11.565  -5.946  1.00 19.49  ? 162 ASP A O    1 
ATOM   2714 C  CB   . ASP A 1 162 ? -25.601 9.688   -7.332  1.00 22.99  ? 162 ASP A CB   1 
ATOM   2715 C  CG   . ASP A 1 162 ? -26.297 11.023  -7.398  1.00 25.57  ? 162 ASP A CG   1 
ATOM   2716 O  OD1  . ASP A 1 162 ? -25.758 12.024  -6.937  1.00 25.23  ? 162 ASP A OD1  1 
ATOM   2717 O  OD2  . ASP A 1 162 ? -27.402 11.081  -7.983  1.00 30.23  ? 162 ASP A OD2  1 
ATOM   2718 H  H    . ASP A 1 162 ? -24.741 10.617  -4.726  1.00 23.61  ? 162 ASP A H    1 
ATOM   2719 H  HA   . ASP A 1 162 ? -23.924 8.827   -6.556  1.00 25.46  ? 162 ASP A HA   1 
ATOM   2720 H  HB2  . ASP A 1 162 ? -25.328 9.452   -8.233  1.00 27.60  ? 162 ASP A HB2  1 
ATOM   2721 H  HB3  . ASP A 1 162 ? -26.239 9.038   -6.998  1.00 27.60  ? 162 ASP A HB3  1 
ATOM   2722 N  N    . GLU A 1 163 ? -22.867 10.715  -8.032  1.00 21.89  ? 163 GLU A N    1 
ATOM   2723 C  CA   . GLU A 1 163 ? -21.744 11.568  -8.401  1.00 24.20  ? 163 GLU A CA   1 
ATOM   2724 C  C    . GLU A 1 163 ? -22.191 13.020  -8.510  1.00 22.90  ? 163 GLU A C    1 
ATOM   2725 O  O    . GLU A 1 163 ? -21.423 13.916  -8.177  1.00 23.96  ? 163 GLU A O    1 
ATOM   2726 C  CB   . GLU A 1 163 ? -21.019 10.985  -9.626  1.00 30.06  ? 163 GLU A CB   1 
ATOM   2727 C  CG   . GLU A 1 163 ? -20.154 11.947  -10.381 0.64 36.58  ? 163 GLU A CG   1 
ATOM   2728 C  CD   . GLU A 1 163 ? -19.273 11.236  -11.405 1.00 43.47  ? 163 GLU A CD   1 
ATOM   2729 O  OE1  . GLU A 1 163 ? -18.230 11.820  -11.783 1.00 46.50  ? 163 GLU A OE1  1 
ATOM   2730 O  OE2  . GLU A 1 163 ? -19.584 10.087  -11.787 1.00 45.76  ? 163 GLU A OE2  1 
ATOM   2731 H  H    . GLU A 1 163 ? -23.176 10.221  -8.665  1.00 26.29  ? 163 GLU A H    1 
ATOM   2732 H  HA   . GLU A 1 163 ? -21.055 11.575  -7.719  1.00 29.06  ? 163 GLU A HA   1 
ATOM   2733 H  HB2  . GLU A 1 163 ? -20.450 10.259  -9.326  1.00 36.09  ? 163 GLU A HB2  1 
ATOM   2734 H  HB3  . GLU A 1 163 ? -21.686 10.650  -10.245 1.00 36.09  ? 163 GLU A HB3  1 
ATOM   2735 H  HG2  . GLU A 1 163 ? -20.718 12.580  -10.853 0.53 43.91  ? 163 GLU A HG2  1 
ATOM   2736 H  HG3  . GLU A 1 163 ? -19.578 12.416  -9.757  0.75 43.91  ? 163 GLU A HG3  1 
ATOM   2737 N  N    . ASN A 1 164 ? -23.457 13.262  -8.889  1.00 23.31  ? 164 ASN A N    1 
ATOM   2738 C  CA   . ASN A 1 164 ? -24.009 14.622  -8.864  1.00 22.46  ? 164 ASN A CA   1 
ATOM   2739 C  C    . ASN A 1 164 ? -23.978 15.185  -7.440  1.00 21.72  ? 164 ASN A C    1 
ATOM   2740 O  O    . ASN A 1 164 ? -23.530 16.321  -7.219  1.00 21.94  ? 164 ASN A O    1 
ATOM   2741 C  CB   . ASN A 1 164 ? -25.437 14.576  -9.452  1.00 24.61  ? 164 ASN A CB   1 
ATOM   2742 C  CG   . ASN A 1 164 ? -26.039 15.942  -9.747  1.00 26.59  ? 164 ASN A CG   1 
ATOM   2743 O  OD1  . ASN A 1 164 ? -26.508 16.648  -8.858  1.00 27.98  ? 164 ASN A OD1  1 
ATOM   2744 N  ND2  . ASN A 1 164 ? -26.138 16.259  -11.040 0.62 25.67  ? 164 ASN A ND2  1 
ATOM   2745 H  H    . ASN A 1 164 ? -24.010 12.662  -9.160  1.00 27.98  ? 164 ASN A H    1 
ATOM   2746 H  HA   . ASN A 1 164 ? -23.481 15.223  -9.412  1.00 26.97  ? 164 ASN A HA   1 
ATOM   2747 H  HB2  . ASN A 1 164 ? -25.413 14.080  -10.285 1.00 29.54  ? 164 ASN A HB2  1 
ATOM   2748 H  HB3  . ASN A 1 164 ? -26.019 14.130  -8.816  1.00 29.54  ? 164 ASN A HB3  1 
ATOM   2749 H  HD21 . ASN A 1 164 ? -25.870 15.705  -11.640 0.76 30.81  ? 164 ASN A HD21 1 
ATOM   2750 H  HD22 . ASN A 1 164 ? -26.471 17.017  -11.272 0.92 30.81  ? 164 ASN A HD22 1 
ATOM   2751 N  N    . ASP A 1 165 ? -24.413 14.380  -6.457  1.00 21.36  ? 165 ASP A N    1 
ATOM   2752 C  CA   . ASP A 1 165 ? -24.360 14.796  -5.057  1.00 20.54  ? 165 ASP A CA   1 
ATOM   2753 C  C    . ASP A 1 165 ? -22.925 15.117  -4.645  1.00 18.42  ? 165 ASP A C    1 
ATOM   2754 O  O    . ASP A 1 165 ? -22.671 16.100  -3.933  1.00 18.56  ? 165 ASP A O    1 
ATOM   2755 C  CB   . ASP A 1 165 ? -24.867 13.680  -4.129  1.00 20.13  ? 165 ASP A CB   1 
ATOM   2756 C  CG   . ASP A 1 165 ? -26.363 13.419  -4.177  1.00 21.23  ? 165 ASP A CG   1 
ATOM   2757 O  OD1  . ASP A 1 165 ? -27.163 14.191  -4.765  1.00 22.95  ? 165 ASP A OD1  1 
ATOM   2758 O  OD2  . ASP A 1 165 ? -26.735 12.391  -3.537  1.00 20.16  ? 165 ASP A OD2  1 
ATOM   2759 H  H    . ASP A 1 165 ? -24.740 13.594  -6.578  1.00 25.65  ? 165 ASP A H    1 
ATOM   2760 H  HA   . ASP A 1 165 ? -24.930 15.576  -4.966  1.00 24.67  ? 165 ASP A HA   1 
ATOM   2761 H  HB2  . ASP A 1 165 ? -24.422 12.854  -4.373  1.00 24.17  ? 165 ASP A HB2  1 
ATOM   2762 H  HB3  . ASP A 1 165 ? -24.646 13.919  -3.215  1.00 24.17  ? 165 ASP A HB3  1 
ATOM   2763 N  N    . LEU A 1 166 ? -21.983 14.235  -5.011  1.00 18.96  ? 166 LEU A N    1 
ATOM   2764 C  CA   . LEU A 1 166 ? -20.584 14.435  -4.642  1.00 19.06  ? 166 LEU A CA   1 
ATOM   2765 C  C    . LEU A 1 166 ? -20.041 15.730  -5.235  1.00 19.43  ? 166 LEU A C    1 
ATOM   2766 O  O    . LEU A 1 166 ? -19.362 16.501  -4.547  1.00 20.21  ? 166 LEU A O    1 
ATOM   2767 C  CB   . LEU A 1 166 ? -19.744 13.251  -5.118  1.00 21.10  ? 166 LEU A CB   1 
ATOM   2768 C  CG   . LEU A 1 166 ? -18.240 13.359  -4.851  1.00 22.53  ? 166 LEU A CG   1 
ATOM   2769 C  CD1  . LEU A 1 166 ? -17.934 13.480  -3.381  1.00 24.19  ? 166 LEU A CD1  1 
ATOM   2770 C  CD2  . LEU A 1 166 ? -17.484 12.164  -5.471  0.43 20.88  ? 166 LEU A CD2  1 
ATOM   2771 H  H    . LEU A 1 166 ? -22.131 13.522  -5.469  1.00 22.76  ? 166 LEU A H    1 
ATOM   2772 H  HA   . LEU A 1 166 ? -20.521 14.488  -3.676  1.00 22.89  ? 166 LEU A HA   1 
ATOM   2773 H  HB2  . LEU A 1 166 ? -20.061 12.453  -4.668  1.00 25.33  ? 166 LEU A HB2  1 
ATOM   2774 H  HB3  . LEU A 1 166 ? -19.861 13.161  -6.077  1.00 25.33  ? 166 LEU A HB3  1 
ATOM   2775 H  HG   . LEU A 1 166 ? -17.921 14.172  -5.274  1.00 27.05  ? 166 LEU A HG   1 
ATOM   2776 H  HD11 . LEU A 1 166 ? -16.972 13.499  -3.258  1.00 29.04  ? 166 LEU A HD11 1 
ATOM   2777 H  HD12 . LEU A 1 166 ? -18.326 14.301  -3.043  1.00 29.04  ? 166 LEU A HD12 1 
ATOM   2778 H  HD13 . LEU A 1 166 ? -18.312 12.717  -2.916  1.00 29.04  ? 166 LEU A HD13 1 
ATOM   2779 H  HD21 . LEU A 1 166 ? -16.537 12.256  -5.280  1.00 25.07  ? 166 LEU A HD21 1 
ATOM   2780 H  HD22 . LEU A 1 166 ? -17.821 11.342  -5.084  0.67 25.07  ? 166 LEU A HD22 1 
ATOM   2781 H  HD23 . LEU A 1 166 ? -17.628 12.163  -6.431  1.00 25.07  ? 166 LEU A HD23 1 
ATOM   2782 N  N    . ASP A 1 167 ? -20.356 15.995  -6.505  1.00 20.09  ? 167 ASP A N    1 
ATOM   2783 C  CA   . ASP A 1 167 ? -19.881 17.224  -7.134  1.00 21.55  ? 167 ASP A CA   1 
ATOM   2784 C  C    . ASP A 1 167 ? -20.339 18.439  -6.337  1.00 19.74  ? 167 ASP A C    1 
ATOM   2785 O  O    . ASP A 1 167 ? -19.572 19.381  -6.103  1.00 20.12  ? 167 ASP A O    1 
ATOM   2786 C  CB   . ASP A 1 167 ? -20.422 17.336  -8.563  1.00 24.85  ? 167 ASP A CB   1 
ATOM   2787 C  CG   . ASP A 1 167 ? -19.771 16.361  -9.528  1.00 31.77  ? 167 ASP A CG   1 
ATOM   2788 O  OD1  . ASP A 1 167 ? -18.623 15.950  -9.282  1.00 32.24  ? 167 ASP A OD1  1 
ATOM   2789 O  OD2  . ASP A 1 167 ? -20.410 16.034  -10.553 1.00 36.49  ? 167 ASP A OD2  1 
ATOM   2790 H  H    . ASP A 1 167 ? -20.833 15.490  -7.012  1.00 24.12  ? 167 ASP A H    1 
ATOM   2791 H  HA   . ASP A 1 167 ? -18.912 17.197  -7.168  1.00 25.87  ? 167 ASP A HA   1 
ATOM   2792 H  HB2  . ASP A 1 167 ? -21.375 17.154  -8.553  1.00 29.83  ? 167 ASP A HB2  1 
ATOM   2793 H  HB3  . ASP A 1 167 ? -20.259 18.234  -8.891  1.00 29.83  ? 167 ASP A HB3  1 
ATOM   2794 N  N    . ILE A 1 168 ? -21.616 18.453  -5.944  1.00 20.44  ? 168 ILE A N    1 
ATOM   2795 C  CA   . ILE A 1 168 ? -22.162 19.557  -5.155  1.00 19.88  ? 168 ILE A CA   1 
ATOM   2796 C  C    . ILE A 1 168 ? -21.474 19.650  -3.801  1.00 18.83  ? 168 ILE A C    1 
ATOM   2797 O  O    . ILE A 1 168 ? -21.074 20.738  -3.361  1.00 19.73  ? 168 ILE A O    1 
ATOM   2798 C  CB   . ILE A 1 168 ? -23.686 19.387  -4.999  1.00 19.71  ? 168 ILE A CB   1 
ATOM   2799 C  CG1  . ILE A 1 168 ? -24.378 19.624  -6.356  1.00 22.00  ? 168 ILE A CG1  1 
ATOM   2800 C  CG2  . ILE A 1 168 ? -24.222 20.340  -3.959  1.00 20.38  ? 168 ILE A CG2  1 
ATOM   2801 C  CD1  . ILE A 1 168 ? -25.828 19.174  -6.380  1.00 24.43  ? 168 ILE A CD1  1 
ATOM   2802 H  H    . ILE A 1 168 ? -22.186 17.834  -6.122  1.00 24.54  ? 168 ILE A H    1 
ATOM   2803 H  HA   . ILE A 1 168 ? -21.989 20.386  -5.628  1.00 23.86  ? 168 ILE A HA   1 
ATOM   2804 H  HB   . ILE A 1 168 ? -23.870 18.481  -4.705  1.00 23.67  ? 168 ILE A HB   1 
ATOM   2805 H  HG12 . ILE A 1 168 ? -24.358 20.573  -6.557  1.00 26.41  ? 168 ILE A HG12 1 
ATOM   2806 H  HG13 . ILE A 1 168 ? -23.902 19.130  -7.042  1.00 26.41  ? 168 ILE A HG13 1 
ATOM   2807 H  HG21 . ILE A 1 168 ? -24.001 20.001  -3.077  1.00 24.47  ? 168 ILE A HG21 1 
ATOM   2808 H  HG22 . ILE A 1 168 ? -23.817 21.211  -4.090  1.00 24.47  ? 168 ILE A HG22 1 
ATOM   2809 H  HG23 . ILE A 1 168 ? -25.185 20.405  -4.056  1.00 24.47  ? 168 ILE A HG23 1 
ATOM   2810 H  HD11 . ILE A 1 168 ? -26.147 19.185  -7.296  1.00 29.33  ? 168 ILE A HD11 1 
ATOM   2811 H  HD12 . ILE A 1 168 ? -25.885 18.274  -6.022  1.00 29.33  ? 168 ILE A HD12 1 
ATOM   2812 H  HD13 . ILE A 1 168 ? -26.356 19.780  -5.838  1.00 29.33  ? 168 ILE A HD13 1 
ATOM   2813 N  N    . ALA A 1 169 ? -21.365 18.518  -3.099  1.00 18.63  ? 169 ALA A N    1 
ATOM   2814 C  CA   . ALA A 1 169 ? -20.807 18.537  -1.753  1.00 18.19  ? 169 ALA A CA   1 
ATOM   2815 C  C    . ALA A 1 169 ? -19.395 19.096  -1.742  1.00 18.79  ? 169 ALA A C    1 
ATOM   2816 O  O    . ALA A 1 169 ? -19.048 19.909  -0.881  1.00 20.65  ? 169 ALA A O    1 
ATOM   2817 C  CB   . ALA A 1 169 ? -20.812 17.118  -1.194  1.00 18.53  ? 169 ALA A CB   1 
ATOM   2818 H  H    . ALA A 1 169 ? -21.605 17.740  -3.378  1.00 22.37  ? 169 ALA A H    1 
ATOM   2819 H  HA   . ALA A 1 169 ? -21.355 19.105  -1.189  1.00 21.84  ? 169 ALA A HA   1 
ATOM   2820 H  HB1  . ALA A 1 169 ? -20.285 16.547  -1.776  1.00 22.25  ? 169 ALA A HB1  1 
ATOM   2821 H  HB2  . ALA A 1 169 ? -20.426 17.127  -0.304  1.00 22.25  ? 169 ALA A HB2  1 
ATOM   2822 H  HB3  . ALA A 1 169 ? -21.726 16.797  -1.155  1.00 22.25  ? 169 ALA A HB3  1 
ATOM   2823 N  N    . LEU A 1 170 ? -18.559 18.696  -2.707  1.00 20.47  ? 170 LEU A N    1 
ATOM   2824 C  CA   . LEU A 1 170 ? -17.198 19.226  -2.726  1.00 21.35  ? 170 LEU A CA   1 
ATOM   2825 C  C    . LEU A 1 170 ? -17.188 20.689  -3.146  1.00 22.18  ? 170 LEU A C    1 
ATOM   2826 O  O    . LEU A 1 170 ? -16.434 21.497  -2.596  1.00 22.79  ? 170 LEU A O    1 
ATOM   2827 C  CB   . LEU A 1 170 ? -16.326 18.368  -3.651  1.00 22.51  ? 170 LEU A CB   1 
ATOM   2828 C  CG   . LEU A 1 170 ? -16.117 16.910  -3.188  1.00 24.90  ? 170 LEU A CG   1 
ATOM   2829 C  CD1  . LEU A 1 170 ? -15.302 16.179  -4.296  1.00 26.14  ? 170 LEU A CD1  1 
ATOM   2830 C  CD2  . LEU A 1 170 ? -15.421 16.838  -1.854  1.00 26.20  ? 170 LEU A CD2  1 
ATOM   2831 H  H    . LEU A 1 170 ? -18.750 18.142  -3.336  1.00 24.58  ? 170 LEU A H    1 
ATOM   2832 H  HA   . LEU A 1 170 ? -16.818 19.177  -1.835  1.00 25.63  ? 170 LEU A HA   1 
ATOM   2833 H  HB2  . LEU A 1 170 ? -16.745 18.338  -4.526  1.00 27.03  ? 170 LEU A HB2  1 
ATOM   2834 H  HB3  . LEU A 1 170 ? -15.451 18.781  -3.716  1.00 27.03  ? 170 LEU A HB3  1 
ATOM   2835 H  HG   . LEU A 1 170 ? -16.972 16.470  -3.059  1.00 29.89  ? 170 LEU A HG   1 
ATOM   2836 H  HD11 . LEU A 1 170 ? -14.454 16.635  -4.416  1.00 31.38  ? 170 LEU A HD11 1 
ATOM   2837 H  HD12 . LEU A 1 170 ? -15.148 15.262  -4.021  1.00 31.38  ? 170 LEU A HD12 1 
ATOM   2838 H  HD13 . LEU A 1 170 ? -15.808 16.196  -5.123  1.00 31.38  ? 170 LEU A HD13 1 
ATOM   2839 H  HD21 . LEU A 1 170 ? -16.015 17.183  -1.169  1.00 31.45  ? 170 LEU A HD21 1 
ATOM   2840 H  HD22 . LEU A 1 170 ? -15.197 15.914  -1.663  1.00 31.45  ? 170 LEU A HD22 1 
ATOM   2841 H  HD23 . LEU A 1 170 ? -14.613 17.374  -1.890  1.00 31.45  ? 170 LEU A HD23 1 
ATOM   2842 N  N    . ARG A 1 171 ? -18.031 21.051  -4.114  1.00 23.36  ? 171 ARG A N    1 
ATOM   2843 C  CA   . ARG A 1 171 ? -18.090 22.434  -4.585  1.00 23.88  ? 171 ARG A CA   1 
ATOM   2844 C  C    . ARG A 1 171 ? -18.448 23.400  -3.453  1.00 23.38  ? 171 ARG A C    1 
ATOM   2845 O  O    . ARG A 1 171 ? -17.894 24.508  -3.361  1.00 26.15  ? 171 ARG A O    1 
ATOM   2846 C  CB   . ARG A 1 171 ? -19.109 22.509  -5.728  1.00 26.54  ? 171 ARG A CB   1 
ATOM   2847 C  CG   . ARG A 1 171 ? -19.126 23.760  -6.500  1.00 29.32  ? 171 ARG A CG   1 
ATOM   2848 C  CD   . ARG A 1 171 ? -19.602 23.478  -7.934  1.00 28.87  ? 171 ARG A CD   1 
ATOM   2849 N  NE   . ARG A 1 171 ? -20.959 22.957  -8.030  1.00 28.24  ? 171 ARG A NE   1 
ATOM   2850 C  CZ   . ARG A 1 171 ? -21.330 21.907  -8.759  1.00 25.13  ? 171 ARG A CZ   1 
ATOM   2851 N  NH1  . ARG A 1 171 ? -20.463 21.191  -9.460  1.00 23.44  ? 171 ARG A NH1  1 
ATOM   2852 N  NH2  . ARG A 1 171 ? -22.609 21.566  -8.796  1.00 25.45  ? 171 ARG A NH2  1 
ATOM   2853 H  H    . ARG A 1 171 ? -18.576 20.519  -4.512  1.00 28.04  ? 171 ARG A H    1 
ATOM   2854 H  HA   . ARG A 1 171 ? -17.223 22.708  -4.921  1.00 28.66  ? 171 ARG A HA   1 
ATOM   2855 H  HB2  . ARG A 1 171 ? -18.917 21.791  -6.351  1.00 31.86  ? 171 ARG A HB2  1 
ATOM   2856 H  HB3  . ARG A 1 171 ? -19.995 22.394  -5.351  1.00 31.86  ? 171 ARG A HB3  1 
ATOM   2857 H  HG2  . ARG A 1 171 ? -19.735 24.392  -6.088  1.00 35.20  ? 171 ARG A HG2  1 
ATOM   2858 H  HG3  . ARG A 1 171 ? -18.232 24.136  -6.536  1.00 35.20  ? 171 ARG A HG3  1 
ATOM   2859 H  HD2  . ARG A 1 171 ? -19.570 24.305  -8.439  1.00 34.66  ? 171 ARG A HD2  1 
ATOM   2860 H  HD3  . ARG A 1 171 ? -19.009 22.822  -8.334  1.00 34.66  ? 171 ARG A HD3  1 
ATOM   2861 H  HE   . ARG A 1 171 ? -21.569 23.361  -7.578  1.00 33.90  ? 171 ARG A HE   1 
ATOM   2862 H  HH11 . ARG A 1 171 ? -19.629 21.400  -9.454  1.00 28.14  ? 171 ARG A HH11 1 
ATOM   2863 H  HH12 . ARG A 1 171 ? -20.735 20.518  -9.922  1.00 28.14  ? 171 ARG A HH12 1 
ATOM   2864 H  HH21 . ARG A 1 171 ? -23.188 22.021  -8.352  1.00 30.55  ? 171 ARG A HH21 1 
ATOM   2865 H  HH22 . ARG A 1 171 ? -22.860 20.890  -9.264  1.00 30.55  ? 171 ARG A HH22 1 
ATOM   2866 N  N    . ILE A 1 172 ? -19.391 23.015  -2.592  1.00 23.57  ? 172 ILE A N    1 
ATOM   2867 C  CA   . ILE A 1 172 ? -19.840 23.884  -1.506  1.00 24.28  ? 172 ILE A CA   1 
ATOM   2868 C  C    . ILE A 1 172 ? -18.902 23.880  -0.307  1.00 22.82  ? 172 ILE A C    1 
ATOM   2869 O  O    . ILE A 1 172 ? -19.160 24.599  0.663   1.00 25.85  ? 172 ILE A O    1 
ATOM   2870 C  CB   . ILE A 1 172 ? -21.283 23.563  -1.056  1.00 27.32  ? 172 ILE A CB   1 
ATOM   2871 C  CG1  . ILE A 1 172 ? -21.301 22.193  -0.346  1.00 26.40  ? 172 ILE A CG1  1 
ATOM   2872 C  CG2  . ILE A 1 172 ? -22.235 23.689  -2.255  1.00 31.12  ? 172 ILE A CG2  1 
ATOM   2873 C  CD1  . ILE A 1 172 ? -22.571 21.877  0.361   1.00 30.21  ? 172 ILE A CD1  1 
ATOM   2874 H  H    . ILE A 1 172 ? -19.789 22.252  -2.617  1.00 28.30  ? 172 ILE A H    1 
ATOM   2875 H  HA   . ILE A 1 172 ? -19.849 24.788  -1.857  1.00 29.15  ? 172 ILE A HA   1 
ATOM   2876 H  HB   . ILE A 1 172 ? -21.603 24.204  -0.402  1.00 32.80  ? 172 ILE A HB   1 
ATOM   2877 H  HG12 . ILE A 1 172 ? -21.155 21.501  -1.008  1.00 31.69  ? 172 ILE A HG12 1 
ATOM   2878 H  HG13 . ILE A 1 172 ? -20.589 22.178  0.313   1.00 31.69  ? 172 ILE A HG13 1 
ATOM   2879 H  HG21 . ILE A 1 172 ? -23.150 23.608  -1.942  1.00 37.35  ? 172 ILE A HG21 1 
ATOM   2880 H  HG22 . ILE A 1 172 ? -22.104 24.554  -2.674  1.00 37.35  ? 172 ILE A HG22 1 
ATOM   2881 H  HG23 . ILE A 1 172 ? -22.039 22.981  -2.890  1.00 37.35  ? 172 ILE A HG23 1 
ATOM   2882 H  HD11 . ILE A 1 172 ? -22.623 20.918  0.502   1.00 36.27  ? 172 ILE A HD11 1 
ATOM   2883 H  HD12 . ILE A 1 172 ? -22.581 22.338  1.214   1.00 36.27  ? 172 ILE A HD12 1 
ATOM   2884 H  HD13 . ILE A 1 172 ? -23.317 22.171  -0.184  1.00 36.27  ? 172 ILE A HD13 1 
ATOM   2885 N  N    . GLY A 1 173 ? -17.861 23.052  -0.302  1.00 22.41  ? 173 GLY A N    1 
ATOM   2886 C  CA   . GLY A 1 173 ? -16.896 23.079  0.781   1.00 21.70  ? 173 GLY A CA   1 
ATOM   2887 C  C    . GLY A 1 173 ? -17.195 22.159  1.939   1.00 19.91  ? 173 GLY A C    1 
ATOM   2888 O  O    . GLY A 1 173 ? -16.805 22.461  3.071   1.00 21.64  ? 173 GLY A O    1 
ATOM   2889 H  H    . GLY A 1 173 ? -17.695 22.471  -0.914  1.00 26.91  ? 173 GLY A H    1 
ATOM   2890 H  HA2  . GLY A 1 173 ? -16.028 22.831  0.426   1.00 26.05  ? 173 GLY A HA2  1 
ATOM   2891 H  HA3  . GLY A 1 173 ? -16.849 23.983  1.129   1.00 26.05  ? 173 GLY A HA3  1 
ATOM   2892 N  N    . ALA A 1 174 ? -17.850 21.032  1.695   1.00 19.28  ? 174 ALA A N    1 
ATOM   2893 C  CA   . ALA A 1 174 ? -18.080 20.058  2.755   1.00 19.17  ? 174 ALA A CA   1 
ATOM   2894 C  C    . ALA A 1 174 ? -16.756 19.498  3.253   1.00 20.53  ? 174 ALA A C    1 
ATOM   2895 O  O    . ALA A 1 174 ? -15.873 19.162  2.463   1.00 24.18  ? 174 ALA A O    1 
ATOM   2896 C  CB   . ALA A 1 174 ? -18.926 18.892  2.236   1.00 19.82  ? 174 ALA A CB   1 
ATOM   2897 H  H    . ALA A 1 174 ? -18.170 20.806  0.929   1.00 23.14  ? 174 ALA A H    1 
ATOM   2898 H  HA   . ALA A 1 174 ? -18.549 20.495  3.483   1.00 23.02  ? 174 ALA A HA   1 
ATOM   2899 H  HB1  . ALA A 1 174 ? -19.075 18.263  2.959   1.00 23.79  ? 174 ALA A HB1  1 
ATOM   2900 H  HB2  . ALA A 1 174 ? -19.775 19.236  1.916   1.00 23.79  ? 174 ALA A HB2  1 
ATOM   2901 H  HB3  . ALA A 1 174 ? -18.452 18.456  1.511   1.00 23.79  ? 174 ALA A HB3  1 
ATOM   2902 N  N    . ARG A 1 175 ? -16.636 19.368  4.576   1.00 19.39  ? 175 ARG A N    1 
ATOM   2903 C  CA   A ARG A 1 175 ? -15.467 18.750  5.186   0.49 20.62  ? 175 ARG A CA   1 
ATOM   2904 C  CA   B ARG A 1 175 ? -15.471 18.751  5.189   0.51 20.10  ? 175 ARG A CA   1 
ATOM   2905 C  C    . ARG A 1 175 ? -15.783 17.436  5.884   1.00 18.43  ? 175 ARG A C    1 
ATOM   2906 O  O    . ARG A 1 175 ? -14.854 16.778  6.383   1.00 19.83  ? 175 ARG A O    1 
ATOM   2907 C  CB   A ARG A 1 175 ? -14.806 19.688  6.217   0.49 24.67  ? 175 ARG A CB   1 
ATOM   2908 C  CB   B ARG A 1 175 ? -14.857 19.691  6.236   0.51 22.83  ? 175 ARG A CB   1 
ATOM   2909 C  CG   A ARG A 1 175 ? -14.535 21.101  5.734   0.49 29.08  ? 175 ARG A CG   1 
ATOM   2910 C  CG   B ARG A 1 175 ? -14.525 21.077  5.736   0.51 25.91  ? 175 ARG A CG   1 
ATOM   2911 C  CD   A ARG A 1 175 ? -13.045 21.455  5.622   0.49 31.22  ? 175 ARG A CD   1 
ATOM   2912 C  CD   B ARG A 1 175 ? -13.361 21.655  6.528   0.51 26.37  ? 175 ARG A CD   1 
ATOM   2913 N  NE   A ARG A 1 175 ? -12.185 20.942  6.687   0.49 32.61  ? 175 ARG A NE   1 
ATOM   2914 N  NE   B ARG A 1 175 ? -13.776 22.079  7.861   0.51 28.70  ? 175 ARG A NE   1 
ATOM   2915 C  CZ   A ARG A 1 175 ? -11.682 21.661  7.685   0.49 34.40  ? 175 ARG A CZ   1 
ATOM   2916 C  CZ   B ARG A 1 175 ? -14.495 23.159  8.131   0.51 30.72  ? 175 ARG A CZ   1 
ATOM   2917 N  NH1  A ARG A 1 175 ? -11.996 22.936  7.851   0.49 34.90  ? 175 ARG A NH1  1 
ATOM   2918 N  NH1  B ARG A 1 175 ? -14.875 23.996  7.178   0.51 31.26  ? 175 ARG A NH1  1 
ATOM   2919 N  NH2  A ARG A 1 175 ? -10.838 21.083  8.536   0.49 35.28  ? 175 ARG A NH2  1 
ATOM   2920 N  NH2  B ARG A 1 175 ? -14.844 23.405  9.391   0.51 31.44  ? 175 ARG A NH2  1 
ATOM   2921 H  H    . ARG A 1 175 ? -17.227 19.635  5.141   1.00 23.28  ? 175 ARG A H    1 
ATOM   2922 H  HA   . ARG A 1 175 ? -14.822 18.587  4.481   1.00 24.13  ? 175 ARG A HA   1 
ATOM   2923 H  HB2  A ARG A 1 175 ? -15.391 19.754  6.989   0.49 29.61  ? 175 ARG A HB2  1 
ATOM   2924 H  HB2  B ARG A 1 175 ? -15.487 19.790  6.967   0.51 27.41  ? 175 ARG A HB2  1 
ATOM   2925 H  HB3  A ARG A 1 175 ? -13.955 19.304  6.478   0.49 29.61  ? 175 ARG A HB3  1 
ATOM   2926 H  HB3  B ARG A 1 175 ? -14.033 19.294  6.560   0.51 27.41  ? 175 ARG A HB3  1 
ATOM   2927 H  HG2  A ARG A 1 175 ? -14.929 21.209  4.855   0.49 34.90  ? 175 ARG A HG2  1 
ATOM   2928 H  HG2  B ARG A 1 175 ? -14.273 21.035  4.800   0.51 31.10  ? 175 ARG A HG2  1 
ATOM   2929 H  HG3  A ARG A 1 175 ? -14.938 21.725  6.358   0.49 34.90  ? 175 ARG A HG3  1 
ATOM   2930 H  HG3  B ARG A 1 175 ? -15.294 21.657  5.846   0.51 31.10  ? 175 ARG A HG3  1 
ATOM   2931 H  HD2  A ARG A 1 175 ? -12.709 21.097  4.785   0.49 37.48  ? 175 ARG A HD2  1 
ATOM   2932 H  HD2  B ARG A 1 175 ? -12.672 20.980  6.624   0.51 31.66  ? 175 ARG A HD2  1 
ATOM   2933 H  HD3  A ARG A 1 175 ? -12.961 22.421  5.626   0.49 37.48  ? 175 ARG A HD3  1 
ATOM   2934 H  HD3  B ARG A 1 175 ? -13.006 22.427  6.060   0.51 31.66  ? 175 ARG A HD3  1 
ATOM   2935 H  HE   A ARG A 1 175 ? -11.988 20.105  6.665   0.49 39.14  ? 175 ARG A HE   1 
ATOM   2936 H  HE   B ARG A 1 175 ? -13.535 21.588  8.525   0.51 34.45  ? 175 ARG A HE   1 
ATOM   2937 H  HH11 A ARG A 1 175 ? -12.538 23.320  7.304   0.49 41.89  ? 175 ARG A HH11 1 
ATOM   2938 H  HH11 B ARG A 1 175 ? -14.657 23.844  6.360   0.51 37.52  ? 175 ARG A HH11 1 
ATOM   2939 H  HH12 A ARG A 1 175 ? -11.658 23.380  8.504   0.49 41.89  ? 175 ARG A HH12 1 
ATOM   2940 H  HH12 B ARG A 1 175 ? -15.341 24.691  7.377   0.51 37.52  ? 175 ARG A HH12 1 
ATOM   2941 H  HH21 A ARG A 1 175 ? -10.625 20.256  8.436   0.49 42.35  ? 175 ARG A HH21 1 
ATOM   2942 H  HH21 B ARG A 1 175 ? -14.603 22.866  10.017  0.51 37.74  ? 175 ARG A HH21 1 
ATOM   2943 H  HH22 A ARG A 1 175 ? -10.506 21.537  9.186   0.49 42.35  ? 175 ARG A HH22 1 
ATOM   2944 H  HH22 B ARG A 1 175 ? -15.310 24.102  9.580   0.51 37.74  ? 175 ARG A HH22 1 
ATOM   2945 N  N    . PHE A 1 176 ? -17.050 17.054  5.948   1.00 16.33  ? 176 PHE A N    1 
ATOM   2946 C  CA   . PHE A 1 176 ? -17.525 15.893  6.692   1.00 15.75  ? 176 PHE A CA   1 
ATOM   2947 C  C    . PHE A 1 176 ? -18.627 15.341  5.809   1.00 15.75  ? 176 PHE A C    1 
ATOM   2948 O  O    . PHE A 1 176 ? -19.674 15.974  5.676   1.00 17.24  ? 176 PHE A O    1 
ATOM   2949 C  CB   . PHE A 1 176 ? -18.060 16.401  8.038   1.00 16.63  ? 176 PHE A CB   1 
ATOM   2950 C  CG   . PHE A 1 176 ? -18.417 15.337  9.066   1.00 16.17  ? 176 PHE A CG   1 
ATOM   2951 C  CD1  . PHE A 1 176 ? -17.832 14.097  9.108   1.00 16.14  ? 176 PHE A CD1  1 
ATOM   2952 C  CD2  . PHE A 1 176 ? -19.330 15.655  10.049  1.00 16.99  ? 176 PHE A CD2  1 
ATOM   2953 C  CE1  . PHE A 1 176 ? -18.192 13.176  10.094  1.00 15.67  ? 176 PHE A CE1  1 
ATOM   2954 C  CE2  . PHE A 1 176 ? -19.658 14.771  11.029  1.00 17.58  ? 176 PHE A CE2  1 
ATOM   2955 C  CZ   . PHE A 1 176 ? -19.101 13.517  11.047  1.00 17.00  ? 176 PHE A CZ   1 
ATOM   2956 H  H    . PHE A 1 176 ? -17.688 17.471  5.549   1.00 19.61  ? 176 PHE A H    1 
ATOM   2957 H  HA   . PHE A 1 176 ? -16.863 15.204  6.859   1.00 18.91  ? 176 PHE A HA   1 
ATOM   2958 H  HB2  . PHE A 1 176 ? -17.382 16.968  8.438   1.00 19.97  ? 176 PHE A HB2  1 
ATOM   2959 H  HB3  . PHE A 1 176 ? -18.864 16.916  7.869   1.00 19.97  ? 176 PHE A HB3  1 
ATOM   2960 H  HD1  . PHE A 1 176 ? -17.191 13.868  8.474   1.00 19.38  ? 176 PHE A HD1  1 
ATOM   2961 H  HD2  . PHE A 1 176 ? -19.731 16.495  10.041  1.00 20.40  ? 176 PHE A HD2  1 
ATOM   2962 H  HE1  . PHE A 1 176 ? -17.809 12.329  10.100  1.00 18.81  ? 176 PHE A HE1  1 
ATOM   2963 H  HE2  . PHE A 1 176 ? -20.262 15.018  11.691  1.00 21.11  ? 176 PHE A HE2  1 
ATOM   2964 H  HZ   . PHE A 1 176 ? -19.344 12.906  11.704  1.00 20.42  ? 176 PHE A HZ   1 
ATOM   2965 N  N    . ILE A 1 177 ? -18.363 14.221  5.145   1.00 15.41  ? 177 ILE A N    1 
ATOM   2966 C  CA   . ILE A 1 177 ? -19.271 13.667  4.138   1.00 14.66  ? 177 ILE A CA   1 
ATOM   2967 C  C    . ILE A 1 177 ? -19.698 12.257  4.523   1.00 16.15  ? 177 ILE A C    1 
ATOM   2968 O  O    . ILE A 1 177 ? -18.875 11.419  4.901   1.00 16.46  ? 177 ILE A O    1 
ATOM   2969 C  CB   . ILE A 1 177 ? -18.622 13.660  2.736   1.00 16.37  ? 177 ILE A CB   1 
ATOM   2970 C  CG1  . ILE A 1 177 ? -18.460 15.074  2.214   1.00 17.50  ? 177 ILE A CG1  1 
ATOM   2971 C  CG2  . ILE A 1 177 ? -19.461 12.844  1.729   1.00 17.25  ? 177 ILE A CG2  1 
ATOM   2972 C  CD1  . ILE A 1 177 ? -17.732 15.208  0.897   1.00 18.43  ? 177 ILE A CD1  1 
ATOM   2973 H  H    . ILE A 1 177 ? -17.651 13.752  5.260   1.00 18.50  ? 177 ILE A H    1 
ATOM   2974 H  HA   . ILE A 1 177 ? -20.069 14.218  4.127   1.00 17.60  ? 177 ILE A HA   1 
ATOM   2975 H  HB   . ILE A 1 177 ? -17.751 13.245  2.829   1.00 19.66  ? 177 ILE A HB   1 
ATOM   2976 H  HG12 . ILE A 1 177 ? -19.344 15.456  2.094   1.00 21.01  ? 177 ILE A HG12 1 
ATOM   2977 H  HG13 . ILE A 1 177 ? -17.963 15.585  2.871   1.00 21.01  ? 177 ILE A HG13 1 
ATOM   2978 H  HG21 . ILE A 1 177 ? -19.387 11.902  1.947   1.00 20.71  ? 177 ILE A HG21 1 
ATOM   2979 H  HG22 . ILE A 1 177 ? -20.387 13.126  1.788   1.00 20.71  ? 177 ILE A HG22 1 
ATOM   2980 H  HG23 . ILE A 1 177 ? -19.123 13.004  0.834   1.00 20.71  ? 177 ILE A HG23 1 
ATOM   2981 H  HD11 . ILE A 1 177 ? -16.972 14.605  0.893   1.00 22.13  ? 177 ILE A HD11 1 
ATOM   2982 H  HD12 . ILE A 1 177 ? -18.339 14.981  0.175   1.00 22.13  ? 177 ILE A HD12 1 
ATOM   2983 H  HD13 . ILE A 1 177 ? -17.427 16.124  0.797   1.00 22.13  ? 177 ILE A HD13 1 
ATOM   2984 N  N    . GLY A 1 178 ? -21.003 12.003  4.461   1.00 15.44  ? 178 GLY A N    1 
ATOM   2985 C  CA   . GLY A 1 178 ? -21.512 10.660  4.584   1.00 15.63  ? 178 GLY A CA   1 
ATOM   2986 C  C    . GLY A 1 178 ? -21.841 10.127  3.205   1.00 15.87  ? 178 GLY A C    1 
ATOM   2987 O  O    . GLY A 1 178 ? -22.512 10.795  2.420   1.00 18.49  ? 178 GLY A O    1 
ATOM   2988 H  H    . GLY A 1 178 ? -21.610 12.602  4.347   1.00 18.54  ? 178 GLY A H    1 
ATOM   2989 H  HA2  . GLY A 1 178 ? -20.847 10.087  4.998   1.00 18.77  ? 178 GLY A HA2  1 
ATOM   2990 H  HA3  . GLY A 1 178 ? -22.315 10.655  5.128   1.00 18.77  ? 178 GLY A HA3  1 
ATOM   2991 N  N    . ILE A 1 179 ? -21.345 8.923   2.926   1.00 15.88  ? 179 ILE A N    1 
ATOM   2992 C  CA   . ILE A 1 179 ? -21.600 8.257   1.662   1.00 15.39  ? 179 ILE A CA   1 
ATOM   2993 C  C    . ILE A 1 179 ? -22.575 7.138   1.962   1.00 15.71  ? 179 ILE A C    1 
ATOM   2994 O  O    . ILE A 1 179 ? -22.193 6.125   2.560   1.00 16.58  ? 179 ILE A O    1 
ATOM   2995 C  CB   . ILE A 1 179 ? -20.318 7.719   1.034   1.00 17.34  ? 179 ILE A CB   1 
ATOM   2996 C  CG1  . ILE A 1 179 ? -19.220 8.782   0.971   1.00 18.35  ? 179 ILE A CG1  1 
ATOM   2997 C  CG2  . ILE A 1 179 ? -20.659 7.260   -0.388  1.00 17.89  ? 179 ILE A CG2  1 
ATOM   2998 C  CD1  . ILE A 1 179 ? -18.334 8.834   2.211   1.00 18.39  ? 179 ILE A CD1  1 
ATOM   2999 H  H    . ILE A 1 179 ? -20.851 8.470   3.464   1.00 19.07  ? 179 ILE A H    1 
ATOM   3000 H  HA   . ILE A 1 179 ? -22.005 8.876   1.035   1.00 18.48  ? 179 ILE A HA   1 
ATOM   3001 H  HB   . ILE A 1 179 ? -19.982 6.990   1.580   1.00 20.83  ? 179 ILE A HB   1 
ATOM   3002 H  HG12 . ILE A 1 179 ? -18.649 8.596   0.209   1.00 22.03  ? 179 ILE A HG12 1 
ATOM   3003 H  HG13 . ILE A 1 179 ? -19.635 9.653   0.869   1.00 22.03  ? 179 ILE A HG13 1 
ATOM   3004 H  HG21 . ILE A 1 179 ? -19.872 6.859   -0.788  1.00 21.49  ? 179 ILE A HG21 1 
ATOM   3005 H  HG22 . ILE A 1 179 ? -21.377 6.610   -0.346  1.00 21.49  ? 179 ILE A HG22 1 
ATOM   3006 H  HG23 . ILE A 1 179 ? -20.940 8.029   -0.909  1.00 21.49  ? 179 ILE A HG23 1 
ATOM   3007 H  HD11 . ILE A 1 179 ? -18.846 9.198   2.950   1.00 22.08  ? 179 ILE A HD11 1 
ATOM   3008 H  HD12 . ILE A 1 179 ? -18.037 7.936   2.425   1.00 22.08  ? 179 ILE A HD12 1 
ATOM   3009 H  HD13 . ILE A 1 179 ? -17.568 9.401   2.029   1.00 22.08  ? 179 ILE A HD13 1 
ATOM   3010 N  N    . THR A 1 180 ? -23.834 7.324   1.579   1.00 16.04  ? 180 THR A N    1 
ATOM   3011 C  CA   . THR A 1 180 ? -24.832 6.319   1.880   1.00 17.47  ? 180 THR A CA   1 
ATOM   3012 C  C    . THR A 1 180 ? -24.978 5.358   0.704   1.00 17.21  ? 180 THR A C    1 
ATOM   3013 O  O    . THR A 1 180 ? -25.090 5.783   -0.450  1.00 18.86  ? 180 THR A O    1 
ATOM   3014 C  CB   . THR A 1 180 ? -26.190 6.940   2.239   1.00 17.23  ? 180 THR A CB   1 
ATOM   3015 O  OG1  . THR A 1 180 ? -27.088 5.862   2.544   1.00 19.32  ? 180 THR A OG1  1 
ATOM   3016 C  CG2  . THR A 1 180 ? -26.782 7.812   1.139   1.00 19.62  ? 180 THR A CG2  1 
ATOM   3017 H  H    . THR A 1 180 ? -24.124 8.012   1.153   1.00 19.26  ? 180 THR A H    1 
ATOM   3018 H  HA   . THR A 1 180 ? -24.535 5.817   2.655   1.00 20.97  ? 180 THR A HA   1 
ATOM   3019 H  HB   . THR A 1 180 ? -26.073 7.538   2.994   1.00 20.69  ? 180 THR A HB   1 
ATOM   3020 H  HG1  . THR A 1 180 ? -27.841 6.167   2.757   1.00 23.19  ? 180 THR A HG1  1 
ATOM   3021 H  HG21 . THR A 1 180 ? -26.922 7.285   0.337   1.00 23.55  ? 180 THR A HG21 1 
ATOM   3022 H  HG22 . THR A 1 180 ? -27.632 8.178   1.428   1.00 23.55  ? 180 THR A HG22 1 
ATOM   3023 H  HG23 . THR A 1 180 ? -26.178 8.543   0.934   1.00 23.55  ? 180 THR A HG23 1 
ATOM   3024 N  N    . SER A 1 181 ? -24.978 4.067   1.002   1.00 17.09  ? 181 SER A N    1 
ATOM   3025 C  CA   . SER A 1 181 ? -25.182 3.058   -0.030  1.00 17.58  ? 181 SER A CA   1 
ATOM   3026 C  C    . SER A 1 181 ? -26.645 2.888   -0.402  1.00 19.19  ? 181 SER A C    1 
ATOM   3027 O  O    . SER A 1 181 ? -26.930 2.184   -1.373  1.00 20.40  ? 181 SER A O    1 
ATOM   3028 C  CB   . SER A 1 181 ? -24.612 1.726   0.440   1.00 19.84  ? 181 SER A CB   1 
ATOM   3029 O  OG   . SER A 1 181 ? -25.304 1.250   1.580   1.00 21.35  ? 181 SER A OG   1 
ATOM   3030 H  H    . SER A 1 181 ? -24.862 3.749   1.792   1.00 20.52  ? 181 SER A H    1 
ATOM   3031 H  HA   . SER A 1 181 ? -24.706 3.323   -0.832  1.00 21.11  ? 181 SER A HA   1 
ATOM   3032 H  HB2  . SER A 1 181 ? -24.698 1.077   -0.275  1.00 23.82  ? 181 SER A HB2  1 
ATOM   3033 H  HB3  . SER A 1 181 ? -23.677 1.847   0.668   1.00 23.82  ? 181 SER A HB3  1 
ATOM   3034 H  HG   . SER A 1 181 ? -24.965 0.527   1.840   1.00 25.63  ? 181 SER A HG   1 
ATOM   3035 N  N    . ARG A 1 182 ? -27.562 3.512   0.338   1.00 18.41  ? 182 ARG A N    1 
ATOM   3036 C  CA   . ARG A 1 182 ? -28.990 3.416   0.079   1.00 18.78  ? 182 ARG A CA   1 
ATOM   3037 C  C    . ARG A 1 182 ? -29.474 4.660   -0.651  1.00 18.80  ? 182 ARG A C    1 
ATOM   3038 O  O    . ARG A 1 182 ? -29.307 5.776   -0.156  1.00 19.29  ? 182 ARG A O    1 
ATOM   3039 C  CB   . ARG A 1 182 ? -29.773 3.252   1.384   1.00 19.71  ? 182 ARG A CB   1 
ATOM   3040 C  CG   . ARG A 1 182 ? -31.281 2.999   1.127   1.00 21.97  ? 182 ARG A CG   1 
ATOM   3041 C  CD   . ARG A 1 182 ? -32.116 2.755   2.402   1.00 25.32  ? 182 ARG A CD   1 
ATOM   3042 N  NE   . ARG A 1 182 ? -31.848 1.472   3.051   1.00 30.44  ? 182 ARG A NE   1 
ATOM   3043 C  CZ   . ARG A 1 182 ? -31.085 1.279   4.125   1.00 37.03  ? 182 ARG A CZ   1 
ATOM   3044 N  NH1  . ARG A 1 182 ? -30.671 2.284   4.883   1.00 38.26  ? 182 ARG A NH1  1 
ATOM   3045 N  NH2  . ARG A 1 182 ? -30.761 0.038   4.469   0.51 38.99  ? 182 ARG A NH2  1 
ATOM   3046 H  H    . ARG A 1 182 ? -27.371 4.010   1.012   1.00 22.10  ? 182 ARG A H    1 
ATOM   3047 H  HA   . ARG A 1 182 ? -29.144 2.645   -0.489  1.00 22.55  ? 182 ARG A HA   1 
ATOM   3048 H  HB2  . ARG A 1 182 ? -29.418 2.496   1.876   1.00 23.66  ? 182 ARG A HB2  1 
ATOM   3049 H  HB3  . ARG A 1 182 ? -29.687 4.062   1.911   1.00 23.66  ? 182 ARG A HB3  1 
ATOM   3050 H  HG2  . ARG A 1 182 ? -31.653 3.773   0.678   1.00 26.37  ? 182 ARG A HG2  1 
ATOM   3051 H  HG3  . ARG A 1 182 ? -31.371 2.214   0.565   1.00 26.37  ? 182 ARG A HG3  1 
ATOM   3052 H  HD2  . ARG A 1 182 ? -31.919 3.457   3.043   1.00 30.40  ? 182 ARG A HD2  1 
ATOM   3053 H  HD3  . ARG A 1 182 ? -33.057 2.776   2.167   1.00 30.40  ? 182 ARG A HD3  1 
ATOM   3054 H  HE   . ARG A 1 182 ? -32.217 0.776   2.706   1.00 36.55  ? 182 ARG A HE   1 
ATOM   3055 H  HH11 . ARG A 1 182 ? -30.894 3.091   4.687   1.00 45.93  ? 182 ARG A HH11 1 
ATOM   3056 H  HH12 . ARG A 1 182 ? -30.179 2.130   5.572   1.00 45.93  ? 182 ARG A HH12 1 
ATOM   3057 H  HH21 . ARG A 1 182 ? -31.043 -0.626  4.000   0.89 46.80  ? 182 ARG A HH21 1 
ATOM   3058 H  HH22 . ARG A 1 182 ? -30.269 -0.102  5.160   0.69 46.80  ? 182 ARG A HH22 1 
ATOM   3059 N  N    . ASP A 1 183 ? -30.071 4.461   -1.827  1.00 18.85  ? 183 ASP A N    1 
ATOM   3060 C  CA   . ASP A 1 183 ? -30.801 5.528   -2.511  1.00 18.72  ? 183 ASP A CA   1 
ATOM   3061 C  C    . ASP A 1 183 ? -32.121 5.702   -1.786  1.00 20.93  ? 183 ASP A C    1 
ATOM   3062 O  O    . ASP A 1 183 ? -32.956 4.807   -1.813  1.00 21.90  ? 183 ASP A O    1 
ATOM   3063 C  CB   . ASP A 1 183 ? -31.021 5.115   -3.964  1.00 20.86  ? 183 ASP A CB   1 
ATOM   3064 C  CG   . ASP A 1 183 ? -31.739 6.175   -4.780  1.00 23.47  ? 183 ASP A CG   1 
ATOM   3065 O  OD1  . ASP A 1 183 ? -32.388 7.061   -4.207  1.00 25.22  ? 183 ASP A OD1  1 
ATOM   3066 O  OD2  . ASP A 1 183 ? -31.650 6.112   -6.028  1.00 25.26  ? 183 ASP A OD2  1 
ATOM   3067 H  H    . ASP A 1 183 ? -30.067 3.713   -2.251  1.00 22.64  ? 183 ASP A H    1 
ATOM   3068 H  HA   . ASP A 1 183 ? -30.312 6.365   -2.501  1.00 22.48  ? 183 ASP A HA   1 
ATOM   3069 H  HB2  . ASP A 1 183 ? -30.159 4.952   -4.379  1.00 25.04  ? 183 ASP A HB2  1 
ATOM   3070 H  HB3  . ASP A 1 183 ? -31.557 4.307   -3.984  1.00 25.04  ? 183 ASP A HB3  1 
ATOM   3071 N  N    . GLU A 1 184 ? -32.304 6.828   -1.096  1.00 19.88  ? 184 GLU A N    1 
ATOM   3072 C  CA   . GLU A 1 184 ? -33.494 6.955   -0.261  1.00 21.60  ? 184 GLU A CA   1 
ATOM   3073 C  C    . GLU A 1 184 ? -34.772 7.005   -1.085  1.00 21.82  ? 184 GLU A C    1 
ATOM   3074 O  O    . GLU A 1 184 ? -35.843 6.674   -0.574  1.00 24.48  ? 184 GLU A O    1 
ATOM   3075 C  CB   . GLU A 1 184 ? -33.378 8.166   0.653   1.00 24.09  ? 184 GLU A CB   1 
ATOM   3076 C  CG   . GLU A 1 184 ? -32.398 7.976   1.796   1.00 27.02  ? 184 GLU A CG   1 
ATOM   3077 C  CD   . GLU A 1 184 ? -32.716 6.776   2.684   1.00 29.98  ? 184 GLU A CD   1 
ATOM   3078 O  OE1  . GLU A 1 184 ? -33.907 6.444   2.853   1.00 33.82  ? 184 GLU A OE1  1 
ATOM   3079 O  OE2  . GLU A 1 184 ? -31.770 6.172   3.226   1.00 29.37  ? 184 GLU A OE2  1 
ATOM   3080 H  H    . GLU A 1 184 ? -31.774 7.506   -1.095  1.00 23.86  ? 184 GLU A H    1 
ATOM   3081 H  HA   . GLU A 1 184 ? -33.557 6.178   0.316   1.00 25.93  ? 184 GLU A HA   1 
ATOM   3082 H  HB2  . GLU A 1 184 ? -33.079 8.925   0.129   1.00 28.93  ? 184 GLU A HB2  1 
ATOM   3083 H  HB3  . GLU A 1 184 ? -34.249 8.350   1.038   1.00 28.93  ? 184 GLU A HB3  1 
ATOM   3084 H  HG2  . GLU A 1 184 ? -31.510 7.845   1.428   1.00 32.44  ? 184 GLU A HG2  1 
ATOM   3085 H  HG3  . GLU A 1 184 ? -32.411 8.769   2.355   1.00 32.44  ? 184 GLU A HG3  1 
ATOM   3086 N  N    . GLU A 1 185 ? -34.681 7.385   -2.360  1.00 21.20  ? 185 GLU A N    1 
ATOM   3087 C  CA   . GLU A 1 185 ? -35.879 7.449   -3.184  1.00 24.06  ? 185 GLU A CA   1 
ATOM   3088 C  C    . GLU A 1 185 ? -36.418 6.060   -3.472  1.00 24.32  ? 185 GLU A C    1 
ATOM   3089 O  O    . GLU A 1 185 ? -37.625 5.825   -3.353  1.00 27.29  ? 185 GLU A O    1 
ATOM   3090 C  CB   . GLU A 1 185 ? -35.569 8.190   -4.473  1.00 29.73  ? 185 GLU A CB   1 
ATOM   3091 C  CG   . GLU A 1 185 ? -36.759 8.413   -5.363  1.00 38.79  ? 185 GLU A CG   1 
ATOM   3092 C  CD   . GLU A 1 185 ? -36.407 9.309   -6.531  1.00 47.13  ? 185 GLU A CD   1 
ATOM   3093 O  OE1  . GLU A 1 185 ? -36.516 10.554  -6.403  1.00 50.95  ? 185 GLU A OE1  1 
ATOM   3094 O  OE2  . GLU A 1 185 ? -35.984 8.766   -7.560  1.00 50.34  ? 185 GLU A OE2  1 
ATOM   3095 H  H    . GLU A 1 185 ? -33.952 7.604   -2.760  1.00 25.45  ? 185 GLU A H    1 
ATOM   3096 H  HA   . GLU A 1 185 ? -36.568 7.940   -2.709  1.00 28.89  ? 185 GLU A HA   1 
ATOM   3097 H  HB2  . GLU A 1 185 ? -35.204 9.060   -4.249  1.00 35.69  ? 185 GLU A HB2  1 
ATOM   3098 H  HB3  . GLU A 1 185 ? -34.918 7.676   -4.977  1.00 35.69  ? 185 GLU A HB3  1 
ATOM   3099 H  HG2  . GLU A 1 185 ? -37.064 7.560   -5.712  1.00 46.56  ? 185 GLU A HG2  1 
ATOM   3100 H  HG3  . GLU A 1 185 ? -37.467 8.836   -4.854  1.00 46.56  ? 185 GLU A HG3  1 
ATOM   3101 N  N    . THR A 1 186 ? -35.538 5.130   -3.847  1.00 22.76  ? 186 THR A N    1 
ATOM   3102 C  CA   . THR A 1 186 ? -35.922 3.799   -4.294  1.00 21.92  ? 186 THR A CA   1 
ATOM   3103 C  C    . THR A 1 186 ? -35.650 2.714   -3.268  1.00 21.62  ? 186 THR A C    1 
ATOM   3104 O  O    . THR A 1 186 ? -36.145 1.589   -3.443  1.00 23.81  ? 186 THR A O    1 
ATOM   3105 C  CB   . THR A 1 186 ? -35.131 3.418   -5.550  1.00 23.38  ? 186 THR A CB   1 
ATOM   3106 O  OG1  . THR A 1 186 ? -33.743 3.221   -5.205  1.00 22.04  ? 186 THR A OG1  1 
ATOM   3107 C  CG2  . THR A 1 186 ? -35.240 4.477   -6.617  1.00 27.07  ? 186 THR A CG2  1 
ATOM   3108 H  H    . THR A 1 186 ? -34.687 5.254   -3.849  1.00 27.32  ? 186 THR A H    1 
ATOM   3109 H  HA   . THR A 1 186 ? -36.871 3.821   -4.494  1.00 26.32  ? 186 THR A HA   1 
ATOM   3110 H  HB   . THR A 1 186 ? -35.497 2.597   -5.915  1.00 28.06  ? 186 THR A HB   1 
ATOM   3111 H  HG1  . THR A 1 186 ? -33.422 3.930   -4.889  1.00 26.46  ? 186 THR A HG1  1 
ATOM   3112 H  HG21 . THR A 1 186 ? -36.173 4.674   -6.795  1.00 32.50  ? 186 THR A HG21 1 
ATOM   3113 H  HG22 . THR A 1 186 ? -34.797 5.289   -6.325  1.00 32.50  ? 186 THR A HG22 1 
ATOM   3114 H  HG23 . THR A 1 186 ? -34.821 4.168   -7.436  1.00 32.50  ? 186 THR A HG23 1 
ATOM   3115 N  N    . LEU A 1 187 ? -34.875 3.027   -2.220  1.00 22.36  ? 187 LEU A N    1 
ATOM   3116 C  CA   . LEU A 1 187 ? -34.409 2.124   -1.166  1.00 24.12  ? 187 LEU A CA   1 
ATOM   3117 C  C    . LEU A 1 187 ? -33.410 1.088   -1.670  1.00 23.48  ? 187 LEU A C    1 
ATOM   3118 O  O    . LEU A 1 187 ? -33.089 0.144   -0.941  1.00 25.48  ? 187 LEU A O    1 
ATOM   3119 C  CB   . LEU A 1 187 ? -35.571 1.488   -0.394  1.00 25.83  ? 187 LEU A CB   1 
ATOM   3120 C  CG   . LEU A 1 187 ? -36.608 2.456   0.177   1.00 27.15  ? 187 LEU A CG   1 
ATOM   3121 C  CD1  . LEU A 1 187 ? -37.703 1.722   0.938   1.00 29.16  ? 187 LEU A CD1  1 
ATOM   3122 C  CD2  . LEU A 1 187 ? -35.989 3.520   1.099   1.00 28.91  ? 187 LEU A CD2  1 
ATOM   3123 H  H    . LEU A 1 187 ? -34.585 3.826   -2.092  1.00 26.84  ? 187 LEU A H    1 
ATOM   3124 H  HA   . LEU A 1 187 ? -33.921 2.646   -0.510  1.00 28.96  ? 187 LEU A HA   1 
ATOM   3125 H  HB2  . LEU A 1 187 ? -36.039 0.886   -0.994  1.00 31.01  ? 187 LEU A HB2  1 
ATOM   3126 H  HB3  . LEU A 1 187 ? -35.201 0.990   0.352   1.00 31.01  ? 187 LEU A HB3  1 
ATOM   3127 H  HG   . LEU A 1 187 ? -36.998 2.911   -0.586  1.00 32.59  ? 187 LEU A HG   1 
ATOM   3128 H  HD11 . LEU A 1 187 ? -38.338 2.370   1.282   1.00 35.00  ? 187 LEU A HD11 1 
ATOM   3129 H  HD12 . LEU A 1 187 ? -38.151 1.109   0.334   1.00 35.00  ? 187 LEU A HD12 1 
ATOM   3130 H  HD13 . LEU A 1 187 ? -37.303 1.230   1.672   1.00 35.00  ? 187 LEU A HD13 1 
ATOM   3131 H  HD21 . LEU A 1 187 ? -36.698 4.063   1.476   1.00 34.70  ? 187 LEU A HD21 1 
ATOM   3132 H  HD22 . LEU A 1 187 ? -35.499 3.076   1.809   1.00 34.70  ? 187 LEU A HD22 1 
ATOM   3133 H  HD23 . LEU A 1 187 ? -35.387 4.076   0.580   1.00 34.70  ? 187 LEU A HD23 1 
ATOM   3134 N  N    . GLU A 1 188 ? -32.890 1.258   -2.887  1.00 22.62  ? 188 GLU A N    1 
ATOM   3135 C  CA   A GLU A 1 188 ? -31.920 0.322   -3.429  0.47 24.43  ? 188 GLU A CA   1 
ATOM   3136 C  CA   B GLU A 1 188 ? -31.909 0.343   -3.463  0.53 25.40  ? 188 GLU A CA   1 
ATOM   3137 C  C    . GLU A 1 188 ? -30.542 0.543   -2.819  1.00 24.55  ? 188 GLU A C    1 
ATOM   3138 O  O    . GLU A 1 188 ? -30.104 1.681   -2.604  1.00 26.22  ? 188 GLU A O    1 
ATOM   3139 C  CB   A GLU A 1 188 ? -31.888 0.461   -4.946  0.47 23.89  ? 188 GLU A CB   1 
ATOM   3140 C  CB   B GLU A 1 188 ? -31.762 0.615   -4.967  0.53 26.63  ? 188 GLU A CB   1 
ATOM   3141 C  CG   A GLU A 1 188 ? -33.209 0.012   -5.569  0.47 22.42  ? 188 GLU A CG   1 
ATOM   3142 C  CG   B GLU A 1 188 ? -30.478 0.004   -5.587  0.53 27.84  ? 188 GLU A CG   1 
ATOM   3143 C  CD   A GLU A 1 188 ? -33.197 0.011   -7.078  0.47 24.82  ? 188 GLU A CD   1 
ATOM   3144 C  CD   B GLU A 1 188 ? -30.483 -0.045  -7.112  0.53 28.80  ? 188 GLU A CD   1 
ATOM   3145 O  OE1  A GLU A 1 188 ? -32.100 -0.050  -7.672  0.47 26.25  ? 188 GLU A OE1  1 
ATOM   3146 O  OE1  B GLU A 1 188 ? -31.575 0.042   -7.719  0.53 30.83  ? 188 GLU A OE1  1 
ATOM   3147 O  OE2  A GLU A 1 188 ? -34.298 0.070   -7.664  0.47 26.23  ? 188 GLU A OE2  1 
ATOM   3148 O  OE2  B GLU A 1 188 ? -29.397 -0.214  -7.705  0.53 27.46  ? 188 GLU A OE2  1 
ATOM   3149 H  H    A GLU A 1 188 ? -33.086 1.909   -3.414  0.47 27.16  ? 188 GLU A H    1 
ATOM   3150 H  H    B GLU A 1 188 ? -33.094 1.910   -3.409  0.53 27.16  ? 188 GLU A H    1 
ATOM   3151 H  HA   A GLU A 1 188 ? -32.171 -0.589  -3.211  0.47 29.33  ? 188 GLU A HA   1 
ATOM   3152 H  HA   B GLU A 1 188 ? -32.209 -0.567  -3.316  0.53 30.49  ? 188 GLU A HA   1 
ATOM   3153 H  HB2  A GLU A 1 188 ? -31.738 1.390   -5.180  0.47 28.69  ? 188 GLU A HB2  1 
ATOM   3154 H  HB2  B GLU A 1 188 ? -32.525 0.234   -5.429  0.53 31.96  ? 188 GLU A HB2  1 
ATOM   3155 H  HB3  A GLU A 1 188 ? -31.176 -0.091  -5.304  0.47 28.69  ? 188 GLU A HB3  1 
ATOM   3156 H  HB3  B GLU A 1 188 ? -31.732 1.574   -5.109  0.53 31.96  ? 188 GLU A HB3  1 
ATOM   3157 H  HG2  A GLU A 1 188 ? -33.403 -0.892  -5.273  0.47 26.91  ? 188 GLU A HG2  1 
ATOM   3158 H  HG2  B GLU A 1 188 ? -29.716 0.538   -5.312  0.53 33.42  ? 188 GLU A HG2  1 
ATOM   3159 H  HG3  A GLU A 1 188 ? -33.912 0.614   -5.279  0.47 26.91  ? 188 GLU A HG3  1 
ATOM   3160 H  HG3  B GLU A 1 188 ? -30.380 -0.906  -5.264  0.53 33.42  ? 188 GLU A HG3  1 
ATOM   3161 N  N    . ILE A 1 189 ? -29.850 -0.570  -2.556  1.00 24.31  ? 189 ILE A N    1 
ATOM   3162 C  CA   . ILE A 1 189 ? -28.505 -0.568  -1.990  1.00 23.98  ? 189 ILE A CA   1 
ATOM   3163 C  C    . ILE A 1 189 ? -27.518 -0.892  -3.098  1.00 24.40  ? 189 ILE A C    1 
ATOM   3164 O  O    . ILE A 1 189 ? -27.686 -1.899  -3.799  1.00 25.23  ? 189 ILE A O    1 
ATOM   3165 C  CB   . ILE A 1 189 ? -28.370 -1.609  -0.865  1.00 25.26  ? 189 ILE A CB   1 
ATOM   3166 C  CG1  . ILE A 1 189 ? -29.325 -1.309  0.273   1.00 28.77  ? 189 ILE A CG1  1 
ATOM   3167 C  CG2  . ILE A 1 189 ? -26.943 -1.662  -0.385  1.00 25.43  ? 189 ILE A CG2  1 
ATOM   3168 C  CD1  . ILE A 1 189 ? -28.825 -0.287  1.219   1.00 32.63  ? 189 ILE A CD1  1 
ATOM   3169 H  H    . ILE A 1 189 ? -30.152 -1.361  -2.703  1.00 29.18  ? 189 ILE A H    1 
ATOM   3170 H  HA   . ILE A 1 189 ? -28.316 0.315   -1.633  1.00 28.79  ? 189 ILE A HA   1 
ATOM   3171 H  HB   . ILE A 1 189 ? -28.611 -2.480  -1.219  1.00 30.33  ? 189 ILE A HB   1 
ATOM   3172 H  HG12 . ILE A 1 189 ? -30.160 -0.985  -0.099  1.00 34.54  ? 189 ILE A HG12 1 
ATOM   3173 H  HG13 . ILE A 1 189 ? -29.479 -2.126  0.774   1.00 34.54  ? 189 ILE A HG13 1 
ATOM   3174 H  HG21 . ILE A 1 189 ? -26.916 -2.102  0.479   1.00 30.53  ? 189 ILE A HG21 1 
ATOM   3175 H  HG22 . ILE A 1 189 ? -26.412 -2.160  -1.027  1.00 30.53  ? 189 ILE A HG22 1 
ATOM   3176 H  HG23 . ILE A 1 189 ? -26.602 -0.757  -0.306  1.00 30.53  ? 189 ILE A HG23 1 
ATOM   3177 H  HD11 . ILE A 1 189 ? -29.570 0.050   1.742   1.00 39.17  ? 189 ILE A HD11 1 
ATOM   3178 H  HD12 . ILE A 1 189 ? -28.167 -0.694  1.804   1.00 39.17  ? 189 ILE A HD12 1 
ATOM   3179 H  HD13 . ILE A 1 189 ? -28.419 0.436   0.717   1.00 39.17  ? 189 ILE A HD13 1 
ATOM   3180 N  N    . ASN A 1 190 ? -26.488 -0.046  -3.256  1.00 22.80  ? 190 ASN A N    1 
ATOM   3181 C  CA   . ASN A 1 190 ? -25.407 -0.298  -4.216  1.00 22.72  ? 190 ASN A CA   1 
ATOM   3182 C  C    . ASN A 1 190 ? -24.057 -0.000  -3.568  1.00 21.36  ? 190 ASN A C    1 
ATOM   3183 O  O    . ASN A 1 190 ? -23.650 1.159   -3.456  1.00 22.31  ? 190 ASN A O    1 
ATOM   3184 C  CB   . ASN A 1 190 ? -25.622 0.516   -5.490  1.00 25.08  ? 190 ASN A CB   1 
ATOM   3185 C  CG   . ASN A 1 190 ? -24.703 0.090   -6.615  1.00 27.19  ? 190 ASN A CG   1 
ATOM   3186 O  OD1  . ASN A 1 190 ? -23.521 -0.134  -6.406  1.00 28.00  ? 190 ASN A OD1  1 
ATOM   3187 N  ND2  . ASN A 1 190 ? -25.251 -0.055  -7.807  1.00 33.40  ? 190 ASN A ND2  1 
ATOM   3188 H  H    . ASN A 1 190 ? -26.395 0.686   -2.814  1.00 27.38  ? 190 ASN A H    1 
ATOM   3189 H  HA   . ASN A 1 190 ? -25.400 -1.243  -4.435  1.00 27.28  ? 190 ASN A HA   1 
ATOM   3190 H  HB2  . ASN A 1 190 ? -26.538 0.399   -5.789  1.00 30.11  ? 190 ASN A HB2  1 
ATOM   3191 H  HB3  . ASN A 1 190 ? -25.452 1.452   -5.300  1.00 30.11  ? 190 ASN A HB3  1 
ATOM   3192 H  HD21 . ASN A 1 190 ? -24.767 -0.295  -8.476  1.00 40.09  ? 190 ASN A HD21 1 
ATOM   3193 H  HD22 . ASN A 1 190 ? -26.091 0.091   -7.914  1.00 40.09  ? 190 ASN A HD22 1 
ATOM   3194 N  N    . LYS A 1 191 ? -23.388 -1.055  -3.109  1.00 22.65  ? 191 LYS A N    1 
ATOM   3195 C  CA   . LYS A 1 191 ? -22.105 -0.875  -2.443  1.00 23.15  ? 191 LYS A CA   1 
ATOM   3196 C  C    . LYS A 1 191 ? -20.973 -0.560  -3.412  1.00 23.71  ? 191 LYS A C    1 
ATOM   3197 O  O    . LYS A 1 191 ? -20.016 0.119   -3.025  1.00 22.85  ? 191 LYS A O    1 
ATOM   3198 C  CB   . LYS A 1 191 ? -21.746 -2.118  -1.634  1.00 26.62  ? 191 LYS A CB   1 
ATOM   3199 C  CG   . LYS A 1 191 ? -22.754 -2.491  -0.567  1.00 30.11  ? 191 LYS A CG   1 
ATOM   3200 C  CD   . LYS A 1 191 ? -22.812 -1.520  0.596   0.48 32.14  ? 191 LYS A CD   1 
ATOM   3201 C  CE   . LYS A 1 191 ? -23.822 -1.978  1.645   0.42 34.56  ? 191 LYS A CE   1 
ATOM   3202 N  NZ   . LYS A 1 191 ? -23.465 -3.282  2.259   1.00 36.52  ? 191 LYS A NZ   1 
ATOM   3203 H  H    . LYS A 1 191 ? -23.651 -1.871  -3.171  1.00 27.19  ? 191 LYS A H    1 
ATOM   3204 H  HA   . LYS A 1 191 ? -22.194 -0.126  -1.833  1.00 27.79  ? 191 LYS A HA   1 
ATOM   3205 H  HB2  . LYS A 1 191 ? -21.671 -2.870  -2.241  1.00 31.96  ? 191 LYS A HB2  1 
ATOM   3206 H  HB3  . LYS A 1 191 ? -20.896 -1.962  -1.192  1.00 31.96  ? 191 LYS A HB3  1 
ATOM   3207 H  HG2  . LYS A 1 191 ? -23.636 -2.522  -0.969  1.00 36.15  ? 191 LYS A HG2  1 
ATOM   3208 H  HG3  . LYS A 1 191 ? -22.521 -3.363  -0.210  1.00 36.15  ? 191 LYS A HG3  1 
ATOM   3209 H  HD2  . LYS A 1 191 ? -21.939 -1.465  1.015   0.60 38.58  ? 191 LYS A HD2  1 
ATOM   3210 H  HD3  . LYS A 1 191 ? -23.081 -0.645  0.273   0.44 38.58  ? 191 LYS A HD3  1 
ATOM   3211 H  HE2  . LYS A 1 191 ? -23.866 -1.316  2.352   1.00 41.49  ? 191 LYS A HE2  1 
ATOM   3212 H  HE3  . LYS A 1 191 ? -24.692 -2.072  1.226   0.78 41.49  ? 191 LYS A HE3  1 
ATOM   3213 H  HZ1  . LYS A 1 191 ? -23.457 -3.919  1.637   1.00 43.83  ? 191 LYS A HZ1  1 
ATOM   3214 H  HZ2  . LYS A 1 191 ? -22.659 -3.232  2.632   1.00 43.83  ? 191 LYS A HZ2  1 
ATOM   3215 H  HZ3  . LYS A 1 191 ? -24.060 -3.497  2.885   1.00 43.83  ? 191 LYS A HZ3  1 
ATOM   3216 N  N    . GLU A 1 192 ? -21.057 -1.025  -4.658  1.00 24.24  ? 192 GLU A N    1 
ATOM   3217 C  CA   . GLU A 1 192 ? -20.032 -0.696  -5.643  1.00 27.04  ? 192 GLU A CA   1 
ATOM   3218 C  C    . GLU A 1 192 ? -19.984 0.799   -5.882  1.00 25.84  ? 192 GLU A C    1 
ATOM   3219 O  O    . GLU A 1 192 ? -18.910 1.402   -5.913  1.00 26.46  ? 192 GLU A O    1 
ATOM   3220 C  CB   . GLU A 1 192 ? -20.290 -1.419  -6.973  1.00 30.98  ? 192 GLU A CB   1 
ATOM   3221 C  CG   . GLU A 1 192 ? -19.171 -1.166  -7.995  1.00 35.19  ? 192 GLU A CG   1 
ATOM   3222 C  CD   . GLU A 1 192 ? -19.369 -1.824  -9.366  1.00 39.80  ? 192 GLU A CD   1 
ATOM   3223 O  OE1  . GLU A 1 192 ? -20.432 -2.436  -9.623  1.00 41.45  ? 192 GLU A OE1  1 
ATOM   3224 O  OE2  . GLU A 1 192 ? -18.446 -1.699  -10.201 0.50 40.68  ? 192 GLU A OE2  1 
ATOM   3225 H  H    . GLU A 1 192 ? -21.690 -1.527  -4.954  1.00 29.10  ? 192 GLU A H    1 
ATOM   3226 H  HA   . GLU A 1 192 ? -19.178 -1.000  -5.298  1.00 32.45  ? 192 GLU A HA   1 
ATOM   3227 H  HB2  . GLU A 1 192 ? -20.343 -2.374  -6.812  1.00 37.19  ? 192 GLU A HB2  1 
ATOM   3228 H  HB3  . GLU A 1 192 ? -21.124 -1.100  -7.352  1.00 37.19  ? 192 GLU A HB3  1 
ATOM   3229 H  HG2  . GLU A 1 192 ? -19.101 -0.209  -8.141  1.00 42.24  ? 192 GLU A HG2  1 
ATOM   3230 H  HG3  . GLU A 1 192 ? -18.340 -1.507  -7.629  1.00 42.24  ? 192 GLU A HG3  1 
ATOM   3231 N  N    . ASN A 1 193 ? -21.152 1.410   -6.064  1.00 24.61  ? 193 ASN A N    1 
ATOM   3232 C  CA   . ASN A 1 193 ? -21.223 2.850   -6.270  1.00 24.51  ? 193 ASN A CA   1 
ATOM   3233 C  C    . ASN A 1 193 ? -20.742 3.601   -5.026  1.00 22.51  ? 193 ASN A C    1 
ATOM   3234 O  O    . ASN A 1 193 ? -20.032 4.614   -5.130  1.00 23.31  ? 193 ASN A O    1 
ATOM   3235 C  CB   . ASN A 1 193 ? -22.680 3.196   -6.566  1.00 27.25  ? 193 ASN A CB   1 
ATOM   3236 C  CG   . ASN A 1 193 ? -22.933 4.681   -6.735  1.00 34.78  ? 193 ASN A CG   1 
ATOM   3237 O  OD1  . ASN A 1 193 ? -22.249 5.350   -7.509  1.00 37.38  ? 193 ASN A OD1  1 
ATOM   3238 N  ND2  . ASN A 1 193 ? -23.861 5.222   -5.942  1.00 39.04  ? 193 ASN A ND2  1 
ATOM   3239 H  H    . ASN A 1 193 ? -21.916 1.014   -6.072  1.00 29.54  ? 193 ASN A H    1 
ATOM   3240 H  HA   . ASN A 1 193 ? -20.661 3.120   -7.013  1.00 29.42  ? 193 ASN A HA   1 
ATOM   3241 H  HB2  . ASN A 1 193 ? -22.944 2.756   -7.389  1.00 32.71  ? 193 ASN A HB2  1 
ATOM   3242 H  HB3  . ASN A 1 193 ? -23.231 2.884   -5.832  1.00 32.71  ? 193 ASN A HB3  1 
ATOM   3243 H  HD21 . ASN A 1 193 ? -24.279 4.731   -5.373  1.00 46.86  ? 193 ASN A HD21 1 
ATOM   3244 H  HD22 . ASN A 1 193 ? -24.040 6.061   -5.999  1.00 46.86  ? 193 ASN A HD22 1 
ATOM   3245 N  N    . GLN A 1 194 ? -21.093 3.112   -3.837  1.00 20.84  ? 194 GLN A N    1 
ATOM   3246 C  CA   . GLN A 1 194 ? -20.592 3.740   -2.620  1.00 20.49  ? 194 GLN A CA   1 
ATOM   3247 C  C    . GLN A 1 194 ? -19.069 3.736   -2.588  1.00 21.00  ? 194 GLN A C    1 
ATOM   3248 O  O    . GLN A 1 194 ? -18.451 4.755   -2.270  1.00 21.21  ? 194 GLN A O    1 
ATOM   3249 C  CB   . GLN A 1 194 ? -21.160 3.003   -1.416  1.00 20.16  ? 194 GLN A CB   1 
ATOM   3250 C  CG   . GLN A 1 194 ? -20.684 3.535   -0.066  1.00 19.91  ? 194 GLN A CG   1 
ATOM   3251 C  CD   . GLN A 1 194 ? -21.082 2.627   1.085   1.00 20.17  ? 194 GLN A CD   1 
ATOM   3252 O  OE1  . GLN A 1 194 ? -20.888 1.418   1.027   1.00 22.02  ? 194 GLN A OE1  1 
ATOM   3253 N  NE2  . GLN A 1 194 ? -21.699 3.208   2.112   1.00 19.08  ? 194 GLN A NE2  1 
ATOM   3254 H  H    . GLN A 1 194 ? -21.607 2.434   -3.711  1.00 25.02  ? 194 GLN A H    1 
ATOM   3255 H  HA   . GLN A 1 194 ? -20.883 4.665   -2.584  1.00 24.60  ? 194 GLN A HA   1 
ATOM   3256 H  HB2  . GLN A 1 194 ? -22.127 3.077   -1.436  1.00 24.21  ? 194 GLN A HB2  1 
ATOM   3257 H  HB3  . GLN A 1 194 ? -20.897 2.071   -1.472  1.00 24.21  ? 194 GLN A HB3  1 
ATOM   3258 H  HG2  . GLN A 1 194 ? -19.717 3.605   -0.075  1.00 23.91  ? 194 GLN A HG2  1 
ATOM   3259 H  HG3  . GLN A 1 194 ? -21.078 4.408   0.088   1.00 23.91  ? 194 GLN A HG3  1 
ATOM   3260 H  HE21 . GLN A 1 194 ? -21.852 4.054   2.099   1.00 22.91  ? 194 GLN A HE21 1 
ATOM   3261 H  HE22 . GLN A 1 194 ? -21.945 2.737   2.788   1.00 22.91  ? 194 GLN A HE22 1 
ATOM   3262 N  N    . ARG A 1 195 ? -18.447 2.610   -2.946  1.00 22.38  ? 195 ARG A N    1 
ATOM   3263 C  CA   . ARG A 1 195 ? -16.990 2.534   -2.952  1.00 23.37  ? 195 ARG A CA   1 
ATOM   3264 C  C    . ARG A 1 195 ? -16.383 3.455   -4.009  1.00 22.56  ? 195 ARG A C    1 
ATOM   3265 O  O    . ARG A 1 195 ? -15.359 4.105   -3.758  1.00 23.33  ? 195 ARG A O    1 
ATOM   3266 C  CB   . ARG A 1 195 ? -16.552 1.083   -3.160  1.00 27.36  ? 195 ARG A CB   1 
ATOM   3267 C  CG   . ARG A 1 195 ? -16.476 0.295   -1.854  1.00 32.35  ? 195 ARG A CG   1 
ATOM   3268 C  CD   . ARG A 1 195 ? -16.707 -1.205  -2.058  1.00 37.98  ? 195 ARG A CD   1 
ATOM   3269 N  NE   . ARG A 1 195 ? -16.088 -2.023  -1.020  1.00 41.47  ? 195 ARG A NE   1 
ATOM   3270 C  CZ   . ARG A 1 195 ? -16.722 -2.558  0.016   0.20 43.59  ? 195 ARG A CZ   1 
ATOM   3271 N  NH1  . ARG A 1 195 ? -18.016 -2.348  0.228   1.00 45.42  ? 195 ARG A NH1  1 
ATOM   3272 N  NH2  . ARG A 1 195 ? -16.040 -3.327  0.861   1.00 43.49  ? 195 ARG A NH2  1 
ATOM   3273 H  H    . ARG A 1 195 ? -18.842 1.885   -3.187  1.00 26.87  ? 195 ARG A H    1 
ATOM   3274 H  HA   . ARG A 1 195 ? -16.652 2.828   -2.091  1.00 28.06  ? 195 ARG A HA   1 
ATOM   3275 H  HB2  . ARG A 1 195 ? -17.191 0.641   -3.741  1.00 32.85  ? 195 ARG A HB2  1 
ATOM   3276 H  HB3  . ARG A 1 195 ? -15.672 1.074   -3.568  1.00 32.85  ? 195 ARG A HB3  1 
ATOM   3277 H  HG2  . ARG A 1 195 ? -15.595 0.412   -1.463  1.00 38.83  ? 195 ARG A HG2  1 
ATOM   3278 H  HG3  . ARG A 1 195 ? -17.155 0.623   -1.245  1.00 38.83  ? 195 ARG A HG3  1 
ATOM   3279 H  HD2  . ARG A 1 195 ? -17.661 -1.381  -2.048  1.00 45.59  ? 195 ARG A HD2  1 
ATOM   3280 H  HD3  . ARG A 1 195 ? -16.330 -1.469  -2.911  1.00 45.59  ? 195 ARG A HD3  1 
ATOM   3281 H  HE   . ARG A 1 195 ? -15.244 -2.171  -1.085  1.00 49.77  ? 195 ARG A HE   1 
ATOM   3282 H  HH11 . ARG A 1 195 ? -18.465 -1.853  -0.313  1.00 54.52  ? 195 ARG A HH11 1 
ATOM   3283 H  HH12 . ARG A 1 195 ? -18.404 -2.705  0.907   1.00 54.52  ? 195 ARG A HH12 1 
ATOM   3284 H  HH21 . ARG A 1 195 ? -15.202 -3.470  0.732   1.00 52.20  ? 195 ARG A HH21 1 
ATOM   3285 H  HH22 . ARG A 1 195 ? -16.438 -3.681  1.537   1.00 52.20  ? 195 ARG A HH22 1 
ATOM   3286 N  N    . LYS A 1 196 ? -17.010 3.553   -5.181  1.00 23.26  ? 196 LYS A N    1 
ATOM   3287 C  CA   . LYS A 1 196 ? -16.546 4.491   -6.193  1.00 24.83  ? 196 LYS A CA   1 
ATOM   3288 C  C    . LYS A 1 196 ? -16.536 5.914   -5.654  1.00 24.65  ? 196 LYS A C    1 
ATOM   3289 O  O    . LYS A 1 196 ? -15.543 6.641   -5.798  1.00 24.52  ? 196 LYS A O    1 
ATOM   3290 C  CB   . LYS A 1 196 ? -17.454 4.393   -7.416  1.00 28.58  ? 196 LYS A CB   1 
ATOM   3291 C  CG   . LYS A 1 196 ? -17.041 5.266   -8.589  1.00 34.62  ? 196 LYS A CG   1 
ATOM   3292 C  CD   . LYS A 1 196 ? -18.208 5.470   -9.573  1.00 39.00  ? 196 LYS A CD   1 
ATOM   3293 C  CE   . LYS A 1 196 ? -18.176 6.865   -10.194 0.78 42.10  ? 196 LYS A CE   1 
ATOM   3294 N  NZ   . LYS A 1 196 ? -16.934 7.062   -11.006 0.41 42.73  ? 196 LYS A NZ   1 
ATOM   3295 H  H    . LYS A 1 196 ? -17.699 3.092   -5.410  1.00 27.92  ? 196 LYS A H    1 
ATOM   3296 H  HA   . LYS A 1 196 ? -15.640 4.263   -6.454  1.00 29.80  ? 196 LYS A HA   1 
ATOM   3297 H  HB2  . LYS A 1 196 ? -17.458 3.473   -7.724  1.00 34.31  ? 196 LYS A HB2  1 
ATOM   3298 H  HB3  . LYS A 1 196 ? -18.350 4.658   -7.156  1.00 34.31  ? 196 LYS A HB3  1 
ATOM   3299 H  HG2  . LYS A 1 196 ? -16.762 6.135   -8.261  1.00 41.56  ? 196 LYS A HG2  1 
ATOM   3300 H  HG3  . LYS A 1 196 ? -16.310 4.842   -9.065  1.00 41.56  ? 196 LYS A HG3  1 
ATOM   3301 H  HD2  . LYS A 1 196 ? -18.144 4.816   -10.287 1.00 46.82  ? 196 LYS A HD2  1 
ATOM   3302 H  HD3  . LYS A 1 196 ? -19.048 5.365   -9.101  1.00 46.82  ? 196 LYS A HD3  1 
ATOM   3303 H  HE2  . LYS A 1 196 ? -18.945 6.977   -10.776 1.00 50.53  ? 196 LYS A HE2  1 
ATOM   3304 H  HE3  . LYS A 1 196 ? -18.193 7.533   -9.491  1.00 50.53  ? 196 LYS A HE3  1 
ATOM   3305 H  HZ1  . LYS A 1 196 ? -16.929 7.878   -11.362 0.90 51.29  ? 196 LYS A HZ1  1 
ATOM   3306 H  HZ2  . LYS A 1 196 ? -16.215 6.967   -10.490 0.84 51.29  ? 196 LYS A HZ2  1 
ATOM   3307 H  HZ3  . LYS A 1 196 ? -16.901 6.461   -11.662 0.85 51.29  ? 196 LYS A HZ3  1 
ATOM   3308 N  N    . LEU A 1 197 ? -17.634 6.338   -5.018  1.00 22.81  ? 197 LEU A N    1 
ATOM   3309 C  CA   . LEU A 1 197 ? -17.673 7.709   -4.513  1.00 21.46  ? 197 LEU A CA   1 
ATOM   3310 C  C    . LEU A 1 197 ? -16.622 7.923   -3.427  1.00 21.69  ? 197 LEU A C    1 
ATOM   3311 O  O    . LEU A 1 197 ? -15.951 8.962   -3.390  1.00 22.00  ? 197 LEU A O    1 
ATOM   3312 C  CB   . LEU A 1 197 ? -19.077 8.046   -4.004  1.00 20.90  ? 197 LEU A CB   1 
ATOM   3313 C  CG   . LEU A 1 197 ? -20.173 7.959   -5.063  1.00 23.26  ? 197 LEU A CG   1 
ATOM   3314 C  CD1  . LEU A 1 197 ? -21.549 8.078   -4.425  1.00 25.71  ? 197 LEU A CD1  1 
ATOM   3315 C  CD2  . LEU A 1 197 ? -20.024 9.012   -6.155  1.00 23.80  ? 197 LEU A CD2  1 
ATOM   3316 H  H    . LEU A 1 197 ? -18.340 5.870   -4.873  1.00 27.38  ? 197 LEU A H    1 
ATOM   3317 H  HA   . LEU A 1 197 ? -17.476 8.321   -5.239  1.00 25.76  ? 197 LEU A HA   1 
ATOM   3318 H  HB2  . LEU A 1 197 ? -19.304 7.426   -3.294  1.00 25.10  ? 197 LEU A HB2  1 
ATOM   3319 H  HB3  . LEU A 1 197 ? -19.070 8.954   -3.662  1.00 25.10  ? 197 LEU A HB3  1 
ATOM   3320 H  HG   . LEU A 1 197 ? -20.088 7.090   -5.486  1.00 27.92  ? 197 LEU A HG   1 
ATOM   3321 H  HD11 . LEU A 1 197 ? -22.225 8.001   -5.117  1.00 30.86  ? 197 LEU A HD11 1 
ATOM   3322 H  HD12 . LEU A 1 197 ? -21.658 7.367   -3.775  1.00 30.86  ? 197 LEU A HD12 1 
ATOM   3323 H  HD13 . LEU A 1 197 ? -21.620 8.941   -3.988  1.00 30.86  ? 197 LEU A HD13 1 
ATOM   3324 H  HD21 . LEU A 1 197 ? -19.987 9.890   -5.745  1.00 28.57  ? 197 LEU A HD21 1 
ATOM   3325 H  HD22 . LEU A 1 197 ? -19.205 8.842   -6.647  1.00 28.57  ? 197 LEU A HD22 1 
ATOM   3326 H  HD23 . LEU A 1 197 ? -20.786 8.957   -6.753  1.00 28.57  ? 197 LEU A HD23 1 
ATOM   3327 N  N    . ILE A 1 198 ? -16.460 6.952   -2.535  1.00 21.01  ? 198 ILE A N    1 
ATOM   3328 C  CA   . ILE A 1 198 ? -15.442 7.070   -1.491  1.00 21.24  ? 198 ILE A CA   1 
ATOM   3329 C  C    . ILE A 1 198 ? -14.073 7.324   -2.115  1.00 22.41  ? 198 ILE A C    1 
ATOM   3330 O  O    . ILE A 1 198 ? -13.296 8.143   -1.619  1.00 22.93  ? 198 ILE A O    1 
ATOM   3331 C  CB   . ILE A 1 198 ? -15.452 5.816   -0.604  1.00 21.55  ? 198 ILE A CB   1 
ATOM   3332 C  CG1  . ILE A 1 198 ? -16.651 5.810   0.340   1.00 20.70  ? 198 ILE A CG1  1 
ATOM   3333 C  CG2  . ILE A 1 198 ? -14.184 5.736   0.210   1.00 22.72  ? 198 ILE A CG2  1 
ATOM   3334 C  CD1  . ILE A 1 198 ? -17.015 4.442   0.873   1.00 21.58  ? 198 ILE A CD1  1 
ATOM   3335 H  H    . ILE A 1 198 ? -16.918 6.224   -2.509  1.00 25.23  ? 198 ILE A H    1 
ATOM   3336 H  HA   . ILE A 1 198 ? -15.652 7.831   -0.928  1.00 25.50  ? 198 ILE A HA   1 
ATOM   3337 H  HB   . ILE A 1 198 ? -15.516 5.049   -1.195  1.00 25.87  ? 198 ILE A HB   1 
ATOM   3338 H  HG12 . ILE A 1 198 ? -16.450 6.378   1.100   1.00 24.86  ? 198 ILE A HG12 1 
ATOM   3339 H  HG13 . ILE A 1 198 ? -17.423 6.155   -0.136  1.00 24.86  ? 198 ILE A HG13 1 
ATOM   3340 H  HG21 . ILE A 1 198 ? -13.965 6.621   0.541   1.00 27.27  ? 198 ILE A HG21 1 
ATOM   3341 H  HG22 . ILE A 1 198 ? -14.325 5.130   0.954   1.00 27.27  ? 198 ILE A HG22 1 
ATOM   3342 H  HG23 . ILE A 1 198 ? -13.467 5.407   -0.354  1.00 27.27  ? 198 ILE A HG23 1 
ATOM   3343 H  HD11 . ILE A 1 198 ? -17.794 4.522   1.444   1.00 25.91  ? 198 ILE A HD11 1 
ATOM   3344 H  HD12 . ILE A 1 198 ? -17.210 3.854   0.126   1.00 25.91  ? 198 ILE A HD12 1 
ATOM   3345 H  HD13 . ILE A 1 198 ? -16.266 4.092   1.382   1.00 25.91  ? 198 ILE A HD13 1 
ATOM   3346 N  N    . SER A 1 199 ? -13.750 6.615   -3.201  1.00 24.06  ? 199 SER A N    1 
ATOM   3347 C  CA   . SER A 1 199 ? -12.447 6.763   -3.831  1.00 25.27  ? 199 SER A CA   1 
ATOM   3348 C  C    . SER A 1 199 ? -12.256 8.122   -4.495  1.00 25.75  ? 199 SER A C    1 
ATOM   3349 O  O    . SER A 1 199 ? -11.118 8.473   -4.824  1.00 27.54  ? 199 SER A O    1 
ATOM   3350 C  CB   . SER A 1 199 ? -12.237 5.638   -4.844  1.00 27.42  ? 199 SER A CB   1 
ATOM   3351 O  OG   . SER A 1 199 ? -12.917 5.924   -6.050  1.00 29.01  ? 199 SER A OG   1 
ATOM   3352 H  H    . SER A 1 199 ? -14.268 6.047   -3.585  1.00 28.89  ? 199 SER A H    1 
ATOM   3353 H  HA   . SER A 1 199 ? -11.758 6.683   -3.153  1.00 30.33  ? 199 SER A HA   1 
ATOM   3354 H  HB2  . SER A 1 199 ? -11.288 5.549   -5.028  1.00 32.91  ? 199 SER A HB2  1 
ATOM   3355 H  HB3  . SER A 1 199 ? -12.581 4.810   -4.474  1.00 32.91  ? 199 SER A HB3  1 
ATOM   3356 H  HG   . SER A 1 199 ? -12.541 6.562   -6.447  1.00 34.82  ? 199 SER A HG   1 
ATOM   3357 N  N    . MET A 1 200 ? -13.325 8.897   -4.676  1.00 23.72  ? 200 MET A N    1 
ATOM   3358 C  CA   . MET A 1 200 ? -13.257 10.191  -5.342  1.00 25.62  ? 200 MET A CA   1 
ATOM   3359 C  C    . MET A 1 200 ? -13.193 11.347  -4.349  1.00 25.90  ? 200 MET A C    1 
ATOM   3360 O  O    . MET A 1 200 ? -13.116 12.501  -4.759  1.00 28.73  ? 200 MET A O    1 
ATOM   3361 C  CB   . MET A 1 200 ? -14.473 10.361  -6.248  1.00 27.82  ? 200 MET A CB   1 
ATOM   3362 C  CG   . MET A 1 200 ? -14.532 9.324   -7.395  1.00 30.35  ? 200 MET A CG   1 
ATOM   3363 S  SD   . MET A 1 200 ? -16.100 9.263   -8.325  1.00 36.05  ? 200 MET A SD   1 
ATOM   3364 C  CE   . MET A 1 200 ? -16.112 10.871  -9.099  1.00 39.62  ? 200 MET A CE   1 
ATOM   3365 H  H    . MET A 1 200 ? -14.117 8.687   -4.415  1.00 28.48  ? 200 MET A H    1 
ATOM   3366 H  HA   . MET A 1 200 ? -12.464 10.219  -5.900  1.00 30.75  ? 200 MET A HA   1 
ATOM   3367 H  HB2  . MET A 1 200 ? -15.277 10.262  -5.716  1.00 33.39  ? 200 MET A HB2  1 
ATOM   3368 H  HB3  . MET A 1 200 ? -14.446 11.245  -6.647  1.00 33.39  ? 200 MET A HB3  1 
ATOM   3369 H  HG2  . MET A 1 200 ? -13.829 9.531   -8.030  1.00 36.44  ? 200 MET A HG2  1 
ATOM   3370 H  HG3  . MET A 1 200 ? -14.388 8.442   -7.017  1.00 36.44  ? 200 MET A HG3  1 
ATOM   3371 H  HE1  . MET A 1 200 ? -16.100 11.554  -8.410  1.00 47.55  ? 200 MET A HE1  1 
ATOM   3372 H  HE2  . MET A 1 200 ? -15.326 10.956  -9.662  1.00 47.55  ? 200 MET A HE2  1 
ATOM   3373 H  HE3  . MET A 1 200 ? -16.915 10.957  -9.637  1.00 47.55  ? 200 MET A HE3  1 
ATOM   3374 N  N    . ILE A 1 201 ? -13.212 11.069  -3.053  1.00 23.87  ? 201 ILE A N    1 
ATOM   3375 C  CA   . ILE A 1 201 ? -13.217 12.129  -2.049  1.00 22.42  ? 201 ILE A CA   1 
ATOM   3376 C  C    . ILE A 1 201 ? -11.787 12.384  -1.593  1.00 23.53  ? 201 ILE A C    1 
ATOM   3377 O  O    . ILE A 1 201 ? -11.031 11.429  -1.365  1.00 24.92  ? 201 ILE A O    1 
ATOM   3378 C  CB   . ILE A 1 201 ? -14.101 11.736  -0.854  1.00 20.92  ? 201 ILE A CB   1 
ATOM   3379 C  CG1  . ILE A 1 201 ? -15.557 11.599  -1.281  1.00 21.56  ? 201 ILE A CG1  1 
ATOM   3380 C  CG2  . ILE A 1 201 ? -13.989 12.762  0.262   1.00 21.32  ? 201 ILE A CG2  1 
ATOM   3381 C  CD1  . ILE A 1 201 ? -16.471 11.014  -0.229  1.00 21.55  ? 201 ILE A CD1  1 
ATOM   3382 H  H    . ILE A 1 201 ? -13.223 10.273  -2.727  1.00 28.66  ? 201 ILE A H    1 
ATOM   3383 H  HA   . ILE A 1 201 ? -13.562 12.943  -2.447  1.00 26.92  ? 201 ILE A HA   1 
ATOM   3384 H  HB   . ILE A 1 201 ? -13.787 10.879  -0.526  1.00 25.12  ? 201 ILE A HB   1 
ATOM   3385 H  HG12 . ILE A 1 201 ? -15.897 12.479  -1.505  1.00 25.88  ? 201 ILE A HG12 1 
ATOM   3386 H  HG13 . ILE A 1 201 ? -15.598 11.020  -2.057  1.00 25.88  ? 201 ILE A HG13 1 
ATOM   3387 H  HG21 . ILE A 1 201 ? -14.683 12.593  0.917   1.00 25.60  ? 201 ILE A HG21 1 
ATOM   3388 H  HG22 . ILE A 1 201 ? -13.116 12.683  0.677   1.00 25.60  ? 201 ILE A HG22 1 
ATOM   3389 H  HG23 . ILE A 1 201 ? -14.097 13.650  -0.114  1.00 25.60  ? 201 ILE A HG23 1 
ATOM   3390 H  HD11 . ILE A 1 201 ? -16.046 10.233  0.159   1.00 25.87  ? 201 ILE A HD11 1 
ATOM   3391 H  HD12 . ILE A 1 201 ? -16.630 11.680  0.458   1.00 25.87  ? 201 ILE A HD12 1 
ATOM   3392 H  HD13 . ILE A 1 201 ? -17.310 10.762  -0.645  1.00 25.87  ? 201 ILE A HD13 1 
ATOM   3393 N  N    . PRO A 1 202 ? -11.378 13.647  -1.450  1.00 23.84  ? 202 PRO A N    1 
ATOM   3394 C  CA   . PRO A 1 202 ? -10.031 13.926  -0.951  1.00 25.00  ? 202 PRO A CA   1 
ATOM   3395 C  C    . PRO A 1 202 ? -9.782  13.341  0.434   1.00 26.14  ? 202 PRO A C    1 
ATOM   3396 O  O    . PRO A 1 202 ? -10.681 13.218  1.265   1.00 25.65  ? 202 PRO A O    1 
ATOM   3397 C  CB   . PRO A 1 202 ? -9.977  15.459  -0.930  1.00 26.01  ? 202 PRO A CB   1 
ATOM   3398 C  CG   . PRO A 1 202 ? -10.947 15.850  -1.990  1.00 25.61  ? 202 PRO A CG   1 
ATOM   3399 C  CD   . PRO A 1 202 ? -12.049 14.878  -1.913  1.00 24.06  ? 202 PRO A CD   1 
ATOM   3400 H  HA   . PRO A 1 202 ? -9.368  13.572  -1.564  1.00 30.02  ? 202 PRO A HA   1 
ATOM   3401 H  HB2  . PRO A 1 202 ? -10.248 15.794  -0.061  1.00 31.22  ? 202 PRO A HB2  1 
ATOM   3402 H  HB3  . PRO A 1 202 ? -9.081  15.768  -1.139  1.00 31.22  ? 202 PRO A HB3  1 
ATOM   3403 H  HG2  . PRO A 1 202 ? -11.270 16.748  -1.821  1.00 30.75  ? 202 PRO A HG2  1 
ATOM   3404 H  HG3  . PRO A 1 202 ? -10.516 15.810  -2.858  1.00 30.75  ? 202 PRO A HG3  1 
ATOM   3405 H  HD2  . PRO A 1 202 ? -12.721 15.166  -1.275  1.00 28.88  ? 202 PRO A HD2  1 
ATOM   3406 H  HD3  . PRO A 1 202 ? -12.455 14.744  -2.783  1.00 28.88  ? 202 PRO A HD3  1 
ATOM   3407 N  N    . SER A 1 203 ? -8.516  13.009  0.687   1.00 30.11  ? 203 SER A N    1 
ATOM   3408 C  CA   . SER A 1 203 ? -8.175  12.323  1.930   1.00 32.67  ? 203 SER A CA   1 
ATOM   3409 C  C    . SER A 1 203 ? -8.453  13.179  3.159   1.00 32.34  ? 203 SER A C    1 
ATOM   3410 O  O    . SER A 1 203 ? -8.752  12.635  4.230   1.00 33.58  ? 203 SER A O    1 
ATOM   3411 C  CB   . SER A 1 203 ? -6.709  11.888  1.896   1.00 38.56  ? 203 SER A CB   1 
ATOM   3412 O  OG   . SER A 1 203 ? -5.892  12.908  1.357   1.00 43.97  ? 203 SER A OG   1 
ATOM   3413 H  H    . SER A 1 203 ? -7.850  13.167  0.167   1.00 36.14  ? 203 SER A H    1 
ATOM   3414 H  HA   . SER A 1 203 ? -8.725  11.528  2.005   1.00 39.22  ? 203 SER A HA   1 
ATOM   3415 H  HB2  . SER A 1 203 ? -6.416  11.695  2.800   1.00 46.29  ? 203 SER A HB2  1 
ATOM   3416 H  HB3  . SER A 1 203 ? -6.628  11.094  1.344   1.00 46.29  ? 203 SER A HB3  1 
ATOM   3417 H  HG   . SER A 1 203 ? -5.090  12.658  1.345   1.00 52.78  ? 203 SER A HG   1 
ATOM   3418 N  N    . ASN A 1 204 ? -8.383  14.506  3.035   1.00 29.40  ? 204 ASN A N    1 
ATOM   3419 C  CA   . ASN A 1 204 ? -8.590  15.366  4.200   1.00 29.72  ? 204 ASN A CA   1 
ATOM   3420 C  C    . ASN A 1 204 ? -10.061 15.592  4.559   1.00 27.75  ? 204 ASN A C    1 
ATOM   3421 O  O    . ASN A 1 204 ? -10.333 16.254  5.567   1.00 30.43  ? 204 ASN A O    1 
ATOM   3422 C  CB   . ASN A 1 204 ? -7.828  16.695  4.029   1.00 30.78  ? 204 ASN A CB   1 
ATOM   3423 C  CG   . ASN A 1 204 ? -8.444  17.622  2.989   0.74 31.97  ? 204 ASN A CG   1 
ATOM   3424 O  OD1  . ASN A 1 204 ? -9.247  17.209  2.150   0.43 31.09  ? 204 ASN A OD1  1 
ATOM   3425 N  ND2  . ASN A 1 204 ? -8.041  18.886  3.030   0.42 32.05  ? 204 ASN A ND2  1 
ATOM   3426 H  H    . ASN A 1 204 ? -8.219  14.923  2.301   1.00 35.29  ? 204 ASN A H    1 
ATOM   3427 H  HA   . ASN A 1 204 ? -8.204  14.928  4.974   1.00 35.67  ? 204 ASN A HA   1 
ATOM   3428 H  HB2  . ASN A 1 204 ? -7.822  17.164  4.878   1.00 36.95  ? 204 ASN A HB2  1 
ATOM   3429 H  HB3  . ASN A 1 204 ? -6.919  16.500  3.751   1.00 36.95  ? 204 ASN A HB3  1 
ATOM   3430 H  HD21 . ASN A 1 204 ? -7.466  19.135  3.618   0.91 38.47  ? 204 ASN A HD21 1 
ATOM   3431 H  HD22 . ASN A 1 204 ? -8.354  19.455  2.467   0.91 38.47  ? 204 ASN A HD22 1 
ATOM   3432 N  N    . VAL A 1 205 ? -11.004 15.051  3.801   1.00 23.15  ? 205 VAL A N    1 
ATOM   3433 C  CA   . VAL A 1 205 ? -12.418 15.086  4.163   1.00 21.25  ? 205 VAL A CA   1 
ATOM   3434 C  C    . VAL A 1 205 ? -12.688 13.898  5.078   1.00 20.97  ? 205 VAL A C    1 
ATOM   3435 O  O    . VAL A 1 205 ? -12.263 12.781  4.791   1.00 22.18  ? 205 VAL A O    1 
ATOM   3436 C  CB   . VAL A 1 205 ? -13.292 15.000  2.901   1.00 21.28  ? 205 VAL A CB   1 
ATOM   3437 C  CG1  . VAL A 1 205 ? -14.762 14.897  3.257   1.00 21.34  ? 205 VAL A CG1  1 
ATOM   3438 C  CG2  . VAL A 1 205 ? -13.066 16.220  2.060   1.00 22.76  ? 205 VAL A CG2  1 
ATOM   3439 H  H    . VAL A 1 205 ? -10.850 14.648  3.057   1.00 27.79  ? 205 VAL A H    1 
ATOM   3440 H  HA   . VAL A 1 205 ? -12.626 15.909  4.633   1.00 25.52  ? 205 VAL A HA   1 
ATOM   3441 H  HB   . VAL A 1 205 ? -13.046 14.203  2.406   1.00 25.55  ? 205 VAL A HB   1 
ATOM   3442 H  HG11 . VAL A 1 205 ? -15.291 15.046  2.458   1.00 25.62  ? 205 VAL A HG11 1 
ATOM   3443 H  HG12 . VAL A 1 205 ? -14.940 14.013  3.612   1.00 25.62  ? 205 VAL A HG12 1 
ATOM   3444 H  HG13 . VAL A 1 205 ? -14.974 15.570  3.923   1.00 25.62  ? 205 VAL A HG13 1 
ATOM   3445 H  HG21 . VAL A 1 205 ? -13.638 16.175  1.277   1.00 27.32  ? 205 VAL A HG21 1 
ATOM   3446 H  HG22 . VAL A 1 205 ? -13.282 17.009  2.582   1.00 27.32  ? 205 VAL A HG22 1 
ATOM   3447 H  HG23 . VAL A 1 205 ? -12.135 16.249  1.788   1.00 27.32  ? 205 VAL A HG23 1 
ATOM   3448 N  N    . VAL A 1 206 ? -13.404 14.127  6.171   1.00 17.99  ? 206 VAL A N    1 
ATOM   3449 C  CA   . VAL A 1 206 ? -13.763 13.036  7.072   1.00 17.70  ? 206 VAL A CA   1 
ATOM   3450 C  C    . VAL A 1 206 ? -14.946 12.300  6.454   1.00 17.88  ? 206 VAL A C    1 
ATOM   3451 O  O    . VAL A 1 206 ? -15.982 12.908  6.152   1.00 18.34  ? 206 VAL A O    1 
ATOM   3452 C  CB   . VAL A 1 206 ? -14.077 13.561  8.480   1.00 19.08  ? 206 VAL A CB   1 
ATOM   3453 C  CG1  . VAL A 1 206 ? -14.504 12.407  9.403   1.00 20.29  ? 206 VAL A CG1  1 
ATOM   3454 C  CG2  . VAL A 1 206 ? -12.863 14.249  9.063   1.00 21.78  ? 206 VAL A CG2  1 
ATOM   3455 H  H    . VAL A 1 206 ? -13.693 14.900  6.413   1.00 21.61  ? 206 VAL A H    1 
ATOM   3456 H  HA   . VAL A 1 206 ? -13.025 12.412  7.157   1.00 21.26  ? 206 VAL A HA   1 
ATOM   3457 H  HB   . VAL A 1 206 ? -14.806 14.199  8.418   1.00 22.91  ? 206 VAL A HB   1 
ATOM   3458 H  HG11 . VAL A 1 206 ? -14.557 12.734  10.314  1.00 24.35  ? 206 VAL A HG11 1 
ATOM   3459 H  HG12 . VAL A 1 206 ? -15.372 12.080  9.119   1.00 24.35  ? 206 VAL A HG12 1 
ATOM   3460 H  HG13 . VAL A 1 206 ? -13.847 11.696  9.344   1.00 24.35  ? 206 VAL A HG13 1 
ATOM   3461 H  HG21 . VAL A 1 206 ? -13.067 14.537  9.966   1.00 26.14  ? 206 VAL A HG21 1 
ATOM   3462 H  HG22 . VAL A 1 206 ? -12.121 13.624  9.074   1.00 26.14  ? 206 VAL A HG22 1 
ATOM   3463 H  HG23 . VAL A 1 206 ? -12.641 15.017  8.513   1.00 26.14  ? 206 VAL A HG23 1 
ATOM   3464 N  N    . LYS A 1 207 ? -14.779 10.997  6.230   1.00 17.58  ? 207 LYS A N    1 
ATOM   3465 C  CA   . LYS A 1 207 ? -15.719 10.191  5.458   1.00 17.84  ? 207 LYS A CA   1 
ATOM   3466 C  C    . LYS A 1 207 ? -16.429 9.186   6.348   1.00 16.89  ? 207 LYS A C    1 
ATOM   3467 O  O    . LYS A 1 207 ? -15.778 8.444   7.092   1.00 17.57  ? 207 LYS A O    1 
ATOM   3468 C  CB   . LYS A 1 207 ? -14.968 9.426   4.362   1.00 18.29  ? 207 LYS A CB   1 
ATOM   3469 C  CG   . LYS A 1 207 ? -14.346 10.345  3.323   1.00 20.42  ? 207 LYS A CG   1 
ATOM   3470 C  CD   . LYS A 1 207 ? -13.329 9.584   2.486   1.00 24.08  ? 207 LYS A CD   1 
ATOM   3471 C  CE   . LYS A 1 207 ? -12.051 9.377   3.246   1.00 26.77  ? 207 LYS A CE   1 
ATOM   3472 N  NZ   . LYS A 1 207 ? -11.253 10.622  3.334   1.00 27.83  ? 207 LYS A NZ   1 
ATOM   3473 H  H    . LYS A 1 207 ? -14.109 10.547  6.525   1.00 21.10  ? 207 LYS A H    1 
ATOM   3474 H  HA   . LYS A 1 207 ? -16.388 10.777  5.071   1.00 21.42  ? 207 LYS A HA   1 
ATOM   3475 H  HB2  . LYS A 1 207 ? -14.256 8.909   4.770   1.00 21.96  ? 207 LYS A HB2  1 
ATOM   3476 H  HB3  . LYS A 1 207 ? -15.589 8.836   3.907   1.00 21.96  ? 207 LYS A HB3  1 
ATOM   3477 H  HG2  . LYS A 1 207 ? -15.037 10.687  2.735   1.00 24.51  ? 207 LYS A HG2  1 
ATOM   3478 H  HG3  . LYS A 1 207 ? -13.894 11.080  3.767   1.00 24.51  ? 207 LYS A HG3  1 
ATOM   3479 H  HD2  . LYS A 1 207 ? -13.690 8.715   2.250   1.00 28.91  ? 207 LYS A HD2  1 
ATOM   3480 H  HD3  . LYS A 1 207 ? -13.129 10.090  1.683   1.00 28.91  ? 207 LYS A HD3  1 
ATOM   3481 H  HE2  . LYS A 1 207 ? -12.259 9.086   4.148   1.00 32.13  ? 207 LYS A HE2  1 
ATOM   3482 H  HE3  . LYS A 1 207 ? -11.517 8.704   2.796   1.00 32.13  ? 207 LYS A HE3  1 
ATOM   3483 H  HZ1  . LYS A 1 207 ? -11.054 10.913  2.517   1.00 33.41  ? 207 LYS A HZ1  1 
ATOM   3484 H  HZ2  . LYS A 1 207 ? -11.716 11.251  3.760   1.00 33.41  ? 207 LYS A HZ2  1 
ATOM   3485 H  HZ3  . LYS A 1 207 ? -10.497 10.468  3.778   1.00 33.41  ? 207 LYS A HZ3  1 
ATOM   3486 N  N    . VAL A 1 208 ? -17.755 9.136   6.236   1.00 15.68  ? 208 VAL A N    1 
ATOM   3487 C  CA   . VAL A 1 208 ? -18.600 8.220   6.995   1.00 15.40  ? 208 VAL A CA   1 
ATOM   3488 C  C    . VAL A 1 208 ? -19.340 7.343   5.994   1.00 15.59  ? 208 VAL A C    1 
ATOM   3489 O  O    . VAL A 1 208 ? -20.063 7.857   5.143   1.00 17.19  ? 208 VAL A O    1 
ATOM   3490 C  CB   . VAL A 1 208 ? -19.616 8.970   7.880   1.00 16.06  ? 208 VAL A CB   1 
ATOM   3491 C  CG1  . VAL A 1 208 ? -20.494 8.005   8.642   1.00 17.36  ? 208 VAL A CG1  1 
ATOM   3492 C  CG2  . VAL A 1 208 ? -18.895 9.923   8.854   1.00 17.73  ? 208 VAL A CG2  1 
ATOM   3493 H  H    . VAL A 1 208 ? -18.204 9.644   5.706   1.00 18.83  ? 208 VAL A H    1 
ATOM   3494 H  HA   . VAL A 1 208 ? -18.040 7.666   7.560   1.00 18.50  ? 208 VAL A HA   1 
ATOM   3495 H  HB   . VAL A 1 208 ? -20.186 9.499   7.301   1.00 19.28  ? 208 VAL A HB   1 
ATOM   3496 H  HG11 . VAL A 1 208 ? -21.021 8.501   9.288   1.00 20.84  ? 208 VAL A HG11 1 
ATOM   3497 H  HG12 . VAL A 1 208 ? -21.080 7.550   8.016   1.00 20.84  ? 208 VAL A HG12 1 
ATOM   3498 H  HG13 . VAL A 1 208 ? -19.933 7.360   9.098   1.00 20.84  ? 208 VAL A HG13 1 
ATOM   3499 H  HG21 . VAL A 1 208 ? -19.555 10.356  9.418   1.00 21.29  ? 208 VAL A HG21 1 
ATOM   3500 H  HG22 . VAL A 1 208 ? -18.278 9.410   9.399   1.00 21.29  ? 208 VAL A HG22 1 
ATOM   3501 H  HG23 . VAL A 1 208 ? -18.410 10.589  8.342   1.00 21.29  ? 208 VAL A HG23 1 
ATOM   3502 N  N    . ALA A 1 209 ? -19.185 6.027   6.111   1.00 15.44  ? 209 ALA A N    1 
ATOM   3503 C  CA   . ALA A 1 209 ? -19.982 5.088   5.329   1.00 15.35  ? 209 ALA A CA   1 
ATOM   3504 C  C    . ALA A 1 209 ? -21.288 4.841   6.070   1.00 15.53  ? 209 ALA A C    1 
ATOM   3505 O  O    . ALA A 1 209 ? -21.279 4.599   7.284   1.00 17.08  ? 209 ALA A O    1 
ATOM   3506 C  CB   . ALA A 1 209 ? -19.203 3.792   5.138   1.00 17.05  ? 209 ALA A CB   1 
ATOM   3507 H  H    . ALA A 1 209 ? -18.621 5.651   6.640   1.00 18.54  ? 209 ALA A H    1 
ATOM   3508 H  HA   . ALA A 1 209 ? -20.189 5.442   4.450   1.00 18.43  ? 209 ALA A HA   1 
ATOM   3509 H  HB1  . ALA A 1 209 ? -19.752 3.163   4.646   1.00 20.47  ? 209 ALA A HB1  1 
ATOM   3510 H  HB2  . ALA A 1 209 ? -18.391 3.982   4.642   1.00 20.47  ? 209 ALA A HB2  1 
ATOM   3511 H  HB3  . ALA A 1 209 ? -18.981 3.427   6.009   1.00 20.47  ? 209 ALA A HB3  1 
ATOM   3512 N  N    . GLU A 1 210 ? -22.397 4.944   5.358   1.00 16.71  ? 210 GLU A N    1 
ATOM   3513 C  CA   . GLU A 1 210 ? -23.715 4.769   5.937   1.00 18.55  ? 210 GLU A CA   1 
ATOM   3514 C  C    . GLU A 1 210 ? -24.526 3.743   5.164   1.00 18.84  ? 210 GLU A C    1 
ATOM   3515 O  O    . GLU A 1 210 ? -24.451 3.680   3.930   1.00 18.25  ? 210 GLU A O    1 
ATOM   3516 C  CB   . GLU A 1 210 ? -24.485 6.085   5.948   1.00 21.33  ? 210 GLU A CB   1 
ATOM   3517 C  CG   . GLU A 1 210 ? -25.780 6.003   6.759   0.80 29.11  ? 210 GLU A CG   1 
ATOM   3518 C  CD   . GLU A 1 210 ? -26.615 7.277   6.755   0.80 37.25  ? 210 GLU A CD   1 
ATOM   3519 O  OE1  . GLU A 1 210 ? -27.650 7.299   7.487   0.80 42.17  ? 210 GLU A OE1  1 
ATOM   3520 O  OE2  . GLU A 1 210 ? -26.258 8.247   6.054   1.00 38.83  ? 210 GLU A OE2  1 
ATOM   3521 H  H    . GLU A 1 210 ? -22.411 5.119   4.516   1.00 20.06  ? 210 GLU A H    1 
ATOM   3522 H  HA   . GLU A 1 210 ? -23.605 4.440   6.843   1.00 22.28  ? 210 GLU A HA   1 
ATOM   3523 H  HB2  . GLU A 1 210 ? -23.927 6.774   6.342   1.00 25.61  ? 210 GLU A HB2  1 
ATOM   3524 H  HB3  . GLU A 1 210 ? -24.715 6.324   5.037   1.00 25.61  ? 210 GLU A HB3  1 
ATOM   3525 H  HG2  . GLU A 1 210 ? -26.330 5.293   6.391   0.80 34.95  ? 210 GLU A HG2  1 
ATOM   3526 H  HG3  . GLU A 1 210 ? -25.555 5.805   7.681   0.80 34.95  ? 210 GLU A HG3  1 
ATOM   3527 N  N    . SER A 1 211 ? -25.311 2.966   5.916   1.00 19.71  ? 211 SER A N    1 
ATOM   3528 C  CA   . SER A 1 211 ? -26.408 2.104   5.461   1.00 19.62  ? 211 SER A CA   1 
ATOM   3529 C  C    . SER A 1 211 ? -25.987 0.669   5.190   1.00 21.56  ? 211 SER A C    1 
ATOM   3530 O  O    . SER A 1 211 ? -25.001 0.415   4.496   1.00 24.42  ? 211 SER A O    1 
ATOM   3531 C  CB   . SER A 1 211 ? -27.122 2.658   4.219   1.00 19.25  ? 211 SER A CB   1 
ATOM   3532 O  OG   . SER A 1 211 ? -27.519 4.002   4.412   1.00 21.50  ? 211 SER A OG   1 
ATOM   3533 H  H    . SER A 1 211 ? -25.221 2.915   6.769   1.00 23.66  ? 211 SER A H    1 
ATOM   3534 H  HA   . SER A 1 211 ? -27.037 2.093   6.200   1.00 23.56  ? 211 SER A HA   1 
ATOM   3535 H  HB2  . SER A 1 211 ? -26.515 2.616   3.463   1.00 23.11  ? 211 SER A HB2  1 
ATOM   3536 H  HB3  . SER A 1 211 ? -27.909 2.120   4.042   1.00 23.11  ? 211 SER A HB3  1 
ATOM   3537 H  HG   . SER A 1 211 ? -27.930 4.281   3.735   1.00 25.82  ? 211 SER A HG   1 
ATOM   3538 N  N    . GLY A 1 212 ? -26.755 -0.279  5.709   1.00 21.34  ? 212 GLY A N    1 
ATOM   3539 C  CA   . GLY A 1 212 ? -26.549 -1.662  5.351   1.00 23.59  ? 212 GLY A CA   1 
ATOM   3540 C  C    . GLY A 1 212 ? -25.355 -2.345  5.963   1.00 23.84  ? 212 GLY A C    1 
ATOM   3541 O  O    . GLY A 1 212 ? -25.001 -3.431  5.508   1.00 27.38  ? 212 GLY A O    1 
ATOM   3542 H  H    . GLY A 1 212 ? -27.396 -0.142  6.266   1.00 25.62  ? 212 GLY A H    1 
ATOM   3543 H  HA2  . GLY A 1 212 ? -27.336 -2.165  5.614   1.00 28.32  ? 212 GLY A HA2  1 
ATOM   3544 H  HA3  . GLY A 1 212 ? -26.448 -1.715  4.387   1.00 28.32  ? 212 GLY A HA3  1 
ATOM   3545 N  N    . ILE A 1 213 ? -24.727 -1.766  6.982   1.00 22.35  ? 213 ILE A N    1 
ATOM   3546 C  CA   . ILE A 1 213 ? -23.543 -2.364  7.586   1.00 22.82  ? 213 ILE A CA   1 
ATOM   3547 C  C    . ILE A 1 213 ? -23.975 -3.267  8.729   1.00 23.49  ? 213 ILE A C    1 
ATOM   3548 O  O    . ILE A 1 213 ? -24.748 -2.851  9.608   1.00 24.42  ? 213 ILE A O    1 
ATOM   3549 C  CB   . ILE A 1 213 ? -22.559 -1.287  8.074   1.00 23.42  ? 213 ILE A CB   1 
ATOM   3550 C  CG1  . ILE A 1 213 ? -22.117 -0.400  6.917   1.00 25.04  ? 213 ILE A CG1  1 
ATOM   3551 C  CG2  . ILE A 1 213 ? -21.367 -1.943  8.779   1.00 25.13  ? 213 ILE A CG2  1 
ATOM   3552 C  CD1  . ILE A 1 213 ? -21.404 0.868   7.371   1.00 27.80  ? 213 ILE A CD1  1 
ATOM   3553 H  H    . ILE A 1 213 ? -24.968 -1.023  7.341   1.00 26.83  ? 213 ILE A H    1 
ATOM   3554 H  HA   . ILE A 1 213 ? -23.091 -2.907  6.922   1.00 27.40  ? 213 ILE A HA   1 
ATOM   3555 H  HB   . ILE A 1 213 ? -23.010 -0.717  8.717   1.00 28.11  ? 213 ILE A HB   1 
ATOM   3556 H  HG12 . ILE A 1 213 ? -21.506 -0.901  6.354   1.00 30.06  ? 213 ILE A HG12 1 
ATOM   3557 H  HG13 . ILE A 1 213 ? -22.898 -0.137  6.406   1.00 30.06  ? 213 ILE A HG13 1 
ATOM   3558 H  HG21 . ILE A 1 213 ? -21.657 -2.284  9.639   1.00 30.17  ? 213 ILE A HG21 1 
ATOM   3559 H  HG22 . ILE A 1 213 ? -21.037 -2.672  8.229   1.00 30.17  ? 213 ILE A HG22 1 
ATOM   3560 H  HG23 . ILE A 1 213 ? -20.669 -1.281  8.903   1.00 30.17  ? 213 ILE A HG23 1 
ATOM   3561 H  HD11 . ILE A 1 213 ? -21.272 1.448   6.604   1.00 33.38  ? 213 ILE A HD11 1 
ATOM   3562 H  HD12 . ILE A 1 213 ? -21.951 1.317   8.035   1.00 33.38  ? 213 ILE A HD12 1 
ATOM   3563 H  HD13 . ILE A 1 213 ? -20.547 0.628   7.756   1.00 33.38  ? 213 ILE A HD13 1 
ATOM   3564 N  N    . SER A 1 214 ? -23.471 -4.504  8.724   1.00 23.22  ? 214 SER A N    1 
ATOM   3565 C  CA   . SER A 1 214 ? -23.785 -5.452  9.780   1.00 24.96  ? 214 SER A CA   1 
ATOM   3566 C  C    . SER A 1 214 ? -22.584 -6.277  10.213  1.00 26.91  ? 214 SER A C    1 
ATOM   3567 O  O    . SER A 1 214 ? -22.672 -6.964  11.244  1.00 28.78  ? 214 SER A O    1 
ATOM   3568 C  CB   . SER A 1 214 ? -24.884 -6.443  9.350   1.00 25.83  ? 214 SER A CB   1 
ATOM   3569 O  OG   . SER A 1 214 ? -24.626 -7.023  8.067   0.50 24.07  ? 214 SER A OG   1 
ATOM   3570 H  H    . SER A 1 214 ? -22.945 -4.813  8.117   1.00 27.88  ? 214 SER A H    1 
ATOM   3571 H  HA   . SER A 1 214 ? -24.127 -4.949  10.535  1.00 29.96  ? 214 SER A HA   1 
ATOM   3572 H  HB2  . SER A 1 214 ? -24.934 -7.155  10.007  1.00 31.01  ? 214 SER A HB2  1 
ATOM   3573 H  HB3  . SER A 1 214 ? -25.730 -5.969  9.310   1.00 31.01  ? 214 SER A HB3  1 
ATOM   3574 H  HG   . SER A 1 214 ? -23.875 -7.399  8.068   0.89 28.89  ? 214 SER A HG   1 
ATOM   3575 N  N    . GLU A 1 215 ? -21.470 -6.252  9.475   1.00 26.41  ? 215 GLU A N    1 
ATOM   3576 C  CA   . GLU A 1 215 ? -20.391 -7.207  9.703   1.00 28.19  ? 215 GLU A CA   1 
ATOM   3577 C  C    . GLU A 1 215 ? -19.031 -6.523  9.774   1.00 28.10  ? 215 GLU A C    1 
ATOM   3578 O  O    . GLU A 1 215 ? -18.762 -5.550  9.061   1.00 26.83  ? 215 GLU A O    1 
ATOM   3579 C  CB   . GLU A 1 215 ? -20.360 -8.270  8.578   1.00 31.31  ? 215 GLU A CB   1 
ATOM   3580 C  CG   . GLU A 1 215 ? -21.552 -9.238  8.511   1.00 34.49  ? 215 GLU A CG   1 
ATOM   3581 C  CD   . GLU A 1 215 ? -21.866 -9.959  9.821   1.00 36.85  ? 215 GLU A CD   1 
ATOM   3582 O  OE1  . GLU A 1 215 ? -23.066 -10.209 10.071  0.40 37.70  ? 215 GLU A OE1  1 
ATOM   3583 O  OE2  . GLU A 1 215 ? -20.935 -10.274 10.593  0.46 36.71  ? 215 GLU A OE2  1 
ATOM   3584 H  H    . GLU A 1 215 ? -21.321 -5.692  8.840   1.00 31.71  ? 215 GLU A H    1 
ATOM   3585 H  HA   . GLU A 1 215 ? -20.541 -7.630  10.563  1.00 33.84  ? 215 GLU A HA   1 
ATOM   3586 H  HB2  . GLU A 1 215 ? -20.324 -7.805  7.727   1.00 37.59  ? 215 GLU A HB2  1 
ATOM   3587 H  HB3  . GLU A 1 215 ? -19.563 -8.809  8.696   1.00 37.59  ? 215 GLU A HB3  1 
ATOM   3588 H  HG2  . GLU A 1 215 ? -22.343 -8.736  8.258   1.00 41.40  ? 215 GLU A HG2  1 
ATOM   3589 H  HG3  . GLU A 1 215 ? -21.362 -9.915  7.844   1.00 41.40  ? 215 GLU A HG3  1 
ATOM   3590 N  N    . ARG A 1 216 ? -18.188 -7.038  10.661  1.00 25.69  ? 216 ARG A N    1 
ATOM   3591 C  CA   . ARG A 1 216 ? -16.836 -6.480  10.867  1.00 26.24  ? 216 ARG A CA   1 
ATOM   3592 C  C    . ARG A 1 216 ? -16.038 -6.562  9.571   1.00 27.14  ? 216 ARG A C    1 
ATOM   3593 O  O    . ARG A 1 216 ? -15.239 -5.708  9.391   1.00 25.44  ? 216 ARG A O    1 
ATOM   3594 C  CB   . ARG A 1 216 ? -16.115 -7.247  11.969  1.00 27.34  ? 216 ARG A CB   1 
ATOM   3595 C  CG   . ARG A 1 216 ? -14.860 -6.557  12.479  1.00 28.68  ? 216 ARG A CG   1 
ATOM   3596 C  CD   . ARG A 1 216 ? -14.344 -7.248  13.719  1.00 28.19  ? 216 ARG A CD   1 
ATOM   3597 N  NE   . ARG A 1 216 ? -13.433 -8.320  13.366  1.00 28.83  ? 216 ARG A NE   1 
ATOM   3598 C  CZ   . ARG A 1 216 ? -12.424 -8.726  14.123  1.00 27.07  ? 216 ARG A CZ   1 
ATOM   3599 N  NH1  . ARG A 1 216 ? -11.473 -7.881  14.473  1.00 22.45  ? 216 ARG A NH1  1 
ATOM   3600 N  NH2  . ARG A 1 216 ? -12.375 -9.979  14.536  1.00 29.99  ? 216 ARG A NH2  1 
ATOM   3601 H  H    . ARG A 1 216 ? -18.374 -7.756  11.188  1.00 30.84  ? 216 ARG A H    1 
ATOM   3602 H  HA   . ARG A 1 216 ? -16.921 -5.536  11.134  1.00 32.39  ? 216 ARG A HA   1 
ATOM   3603 H  HB2  . ARG A 1 216 ? -16.734 -7.371  12.719  1.00 32.82  ? 216 ARG A HB2  1 
ATOM   3604 H  HB3  . ARG A 1 216 ? -15.873 -8.132  11.628  1.00 32.82  ? 216 ARG A HB3  1 
ATOM   3605 H  HG2  . ARG A 1 216 ? -14.167 -6.577  11.787  1.00 34.42  ? 216 ARG A HG2  1 
ATOM   3606 H  HG3  . ARG A 1 216 ? -15.062 -5.620  12.689  1.00 34.42  ? 216 ARG A HG3  1 
ATOM   3607 H  HD2  . ARG A 1 216 ? -13.885 -6.599  14.292  1.00 33.84  ? 216 ARG A HD2  1 
ATOM   3608 H  HD3  . ARG A 1 216 ? -15.098 -7.619  14.219  1.00 33.84  ? 216 ARG A HD3  1 
ATOM   3609 H  HE   . ARG A 1 216 ? -13.554 -8.723  12.604  1.00 34.61  ? 216 ARG A HE   1 
ATOM   3610 H  HH11 . ARG A 1 216 ? -11.028 -8.010  15.222  1.00 26.96  ? 216 ARG A HH11 1 
ATOM   3611 H  HH12 . ARG A 1 216 ? -11.294 -7.187  13.962  1.00 26.96  ? 216 ARG A HH12 1 
ATOM   3612 H  HH21 . ARG A 1 216 ? -12.387 -10.633 13.950  1.00 36.00  ? 216 ARG A HH21 1 
ATOM   3613 H  HH22 . ARG A 1 216 ? -12.334 -10.153 15.397  1.00 36.00  ? 216 ARG A HH22 1 
ATOM   3614 N  N    . ASN A 1 217 ? -16.227 -7.587  8.745   1.00 29.26  ? 217 ASN A N    1 
ATOM   3615 C  CA   . ASN A 1 217 ? -15.442 -7.717  7.524   1.00 31.72  ? 217 ASN A CA   1 
ATOM   3616 C  C    . ASN A 1 217 ? -15.634 -6.511  6.617   1.00 29.74  ? 217 ASN A C    1 
ATOM   3617 O  O    . ASN A 1 217 ? -14.666 -5.995  6.049   1.00 29.33  ? 217 ASN A O    1 
ATOM   3618 C  CB   . ASN A 1 217 ? -15.826 -9.009  6.803   1.00 35.90  ? 217 ASN A CB   1 
ATOM   3619 C  CG   . ASN A 1 217 ? -15.402 -9.017  5.356   1.00 40.28  ? 217 ASN A CG   1 
ATOM   3620 O  OD1  . ASN A 1 217 ? -14.208 -9.040  5.049   0.40 40.91  ? 217 ASN A OD1  1 
ATOM   3621 N  ND2  . ASN A 1 217 ? -16.375 -8.965  4.450   0.25 41.22  ? 217 ASN A ND2  1 
ATOM   3622 H  H    . ASN A 1 217 ? -16.786 -8.225  8.886   1.00 35.12  ? 217 ASN A H    1 
ATOM   3623 H  HA   . ASN A 1 217 ? -14.500 -7.767  7.751   1.00 38.07  ? 217 ASN A HA   1 
ATOM   3624 H  HB2  . ASN A 1 217 ? -15.397 -9.758  7.245   1.00 43.10  ? 217 ASN A HB2  1 
ATOM   3625 H  HB3  . ASN A 1 217 ? -16.790 -9.113  6.834   1.00 43.10  ? 217 ASN A HB3  1 
ATOM   3626 H  HD21 . ASN A 1 217 ? -17.196 -8.930  4.703   0.97 49.47  ? 217 ASN A HD21 1 
ATOM   3627 H  HD22 . ASN A 1 217 ? -16.183 -8.968  3.612   0.86 49.47  ? 217 ASN A HD22 1 
ATOM   3628 N  N    . GLU A 1 218 ? -16.877 -6.034  6.480   1.00 28.69  ? 218 GLU A N    1 
ATOM   3629 C  CA   . GLU A 1 218 ? -17.124 -4.894  5.609   1.00 28.48  ? 218 GLU A CA   1 
ATOM   3630 C  C    . GLU A 1 218 ? -16.510 -3.627  6.182   1.00 25.12  ? 218 GLU A C    1 
ATOM   3631 O  O    . GLU A 1 218 ? -15.990 -2.787  5.435   1.00 25.65  ? 218 GLU A O    1 
ATOM   3632 C  CB   . GLU A 1 218 ? -18.618 -4.651  5.419   1.00 31.29  ? 218 GLU A CB   1 
ATOM   3633 C  CG   . GLU A 1 218 ? -18.880 -3.617  4.309   1.00 36.10  ? 218 GLU A CG   1 
ATOM   3634 C  CD   . GLU A 1 218 ? -20.349 -3.295  4.107   1.00 41.64  ? 218 GLU A CD   1 
ATOM   3635 O  OE1  . GLU A 1 218 ? -20.662 -2.166  3.663   1.00 46.00  ? 218 GLU A OE1  1 
ATOM   3636 O  OE2  . GLU A 1 218 ? -21.195 -4.146  4.445   1.00 43.76  ? 218 GLU A OE2  1 
ATOM   3637 H  H    . GLU A 1 218 ? -17.574 -6.348  6.873   1.00 34.44  ? 218 GLU A H    1 
ATOM   3638 H  HA   . GLU A 1 218 ? -16.729 -5.101  4.747   1.00 34.19  ? 218 GLU A HA   1 
ATOM   3639 H  HB2  . GLU A 1 218 ? -19.050 -5.483  5.170   1.00 37.56  ? 218 GLU A HB2  1 
ATOM   3640 H  HB3  . GLU A 1 218 ? -18.997 -4.314  6.246   1.00 37.56  ? 218 GLU A HB3  1 
ATOM   3641 H  HG2  . GLU A 1 218 ? -18.425 -2.791  4.538   1.00 43.34  ? 218 GLU A HG2  1 
ATOM   3642 H  HG3  . GLU A 1 218 ? -18.536 -3.964  3.471   1.00 43.34  ? 218 GLU A HG3  1 
ATOM   3643 N  N    . ILE A 1 219 ? -16.589 -3.456  7.505   1.00 22.91  ? 219 ILE A N    1 
ATOM   3644 C  CA   . ILE A 1 219 ? -15.954 -2.307  8.143   1.00 21.70  ? 219 ILE A CA   1 
ATOM   3645 C  C    . ILE A 1 219 ? -14.467 -2.313  7.842   1.00 22.52  ? 219 ILE A C    1 
ATOM   3646 O  O    . ILE A 1 219 ? -13.882 -1.284  7.506   1.00 22.72  ? 219 ILE A O    1 
ATOM   3647 C  CB   . ILE A 1 219 ? -16.234 -2.315  9.660   1.00 21.69  ? 219 ILE A CB   1 
ATOM   3648 C  CG1  . ILE A 1 219 ? -17.722 -2.034  9.910   1.00 23.01  ? 219 ILE A CG1  1 
ATOM   3649 C  CG2  . ILE A 1 219 ? -15.387 -1.305  10.373  1.00 23.65  ? 219 ILE A CG2  1 
ATOM   3650 C  CD1  . ILE A 1 219 ? -18.154 -2.180  11.359  1.00 25.50  ? 219 ILE A CD1  1 
ATOM   3651 H  H    . ILE A 1 219 ? -16.998 -3.984  8.046   1.00 27.51  ? 219 ILE A H    1 
ATOM   3652 H  HA   . ILE A 1 219 ? -16.333 -1.491  7.781   1.00 26.05  ? 219 ILE A HA   1 
ATOM   3653 H  HB   . ILE A 1 219 ? -16.009 -3.193  10.006  1.00 26.04  ? 219 ILE A HB   1 
ATOM   3654 H  HG12 . ILE A 1 219 ? -17.915 -1.123  9.637   1.00 27.62  ? 219 ILE A HG12 1 
ATOM   3655 H  HG13 . ILE A 1 219 ? -18.248 -2.656  9.383   1.00 27.62  ? 219 ILE A HG13 1 
ATOM   3656 H  HG21 . ILE A 1 219 ? -15.438 -0.459  9.900   1.00 28.39  ? 219 ILE A HG21 1 
ATOM   3657 H  HG22 . ILE A 1 219 ? -15.717 -1.198  11.278  1.00 28.39  ? 219 ILE A HG22 1 
ATOM   3658 H  HG23 . ILE A 1 219 ? -14.469 -1.619  10.390  1.00 28.39  ? 219 ILE A HG23 1 
ATOM   3659 H  HD11 . ILE A 1 219 ? -17.844 -1.409  11.860  1.00 30.61  ? 219 ILE A HD11 1 
ATOM   3660 H  HD12 . ILE A 1 219 ? -19.122 -2.231  11.396  1.00 30.61  ? 219 ILE A HD12 1 
ATOM   3661 H  HD13 . ILE A 1 219 ? -17.766 -2.990  11.724  1.00 30.61  ? 219 ILE A HD13 1 
ATOM   3662 N  N    . GLU A 1 220 ? -13.834 -3.481  7.943   1.00 23.48  ? 220 GLU A N    1 
ATOM   3663 C  CA   . GLU A 1 220 ? -12.394 -3.545  7.733   1.00 26.75  ? 220 GLU A CA   1 
ATOM   3664 C  C    . GLU A 1 220 ? -12.031 -3.162  6.308   1.00 26.97  ? 220 GLU A C    1 
ATOM   3665 O  O    . GLU A 1 220 ? -11.060 -2.426  6.071   1.00 27.17  ? 220 GLU A O    1 
ATOM   3666 C  CB   . GLU A 1 220 ? -11.923 -4.962  8.024   1.00 33.13  ? 220 GLU A CB   1 
ATOM   3667 C  CG   . GLU A 1 220 ? -11.295 -5.133  9.373   1.00 41.09  ? 220 GLU A CG   1 
ATOM   3668 C  CD   . GLU A 1 220 ? -11.204 -6.593  9.786   1.00 46.56  ? 220 GLU A CD   1 
ATOM   3669 O  OE1  . GLU A 1 220 ? -10.992 -7.455  8.893   0.60 48.51  ? 220 GLU A OE1  1 
ATOM   3670 O  OE2  . GLU A 1 220 ? -11.331 -6.867  11.003  1.00 49.45  ? 220 GLU A OE2  1 
ATOM   3671 H  H    . GLU A 1 220 ? -14.208 -4.233  8.129   1.00 28.18  ? 220 GLU A H    1 
ATOM   3672 H  HA   . GLU A 1 220 ? -11.949 -2.926  8.333   1.00 32.11  ? 220 GLU A HA   1 
ATOM   3673 H  HB2  . GLU A 1 220 ? -12.686 -5.559  7.976   1.00 39.76  ? 220 GLU A HB2  1 
ATOM   3674 H  HB3  . GLU A 1 220 ? -11.263 -5.213  7.358   1.00 39.76  ? 220 GLU A HB3  1 
ATOM   3675 H  HG2  . GLU A 1 220 ? -10.397 -4.767  9.355   1.00 49.33  ? 220 GLU A HG2  1 
ATOM   3676 H  HG3  . GLU A 1 220 ? -11.830 -4.665  10.034  1.00 49.33  ? 220 GLU A HG3  1 
ATOM   3677 N  N    . GLU A 1 221 ? -12.800 -3.658  5.345   1.00 25.21  ? 221 GLU A N    1 
ATOM   3678 C  CA   . GLU A 1 221 ? -12.526 -3.372  3.943   1.00 27.70  ? 221 GLU A CA   1 
ATOM   3679 C  C    . GLU A 1 221 ? -12.713 -1.892  3.649   1.00 26.13  ? 221 GLU A C    1 
ATOM   3680 O  O    . GLU A 1 221 ? -11.913 -1.288  2.924   1.00 27.37  ? 221 GLU A O    1 
ATOM   3681 C  CB   . GLU A 1 221 ? -13.481 -4.190  3.090   1.00 32.58  ? 221 GLU A CB   1 
ATOM   3682 C  CG   . GLU A 1 221 ? -13.081 -5.649  3.001   1.00 38.60  ? 221 GLU A CG   1 
ATOM   3683 C  CD   . GLU A 1 221 ? -14.004 -6.453  2.129   1.00 45.76  ? 221 GLU A CD   1 
ATOM   3684 O  OE1  . GLU A 1 221 ? -13.789 -7.682  2.005   1.00 49.16  ? 221 GLU A OE1  1 
ATOM   3685 O  OE2  . GLU A 1 221 ? -14.953 -5.863  1.567   1.00 49.76  ? 221 GLU A OE2  1 
ATOM   3686 H  H    . GLU A 1 221 ? -13.485 -4.161  5.476   1.00 30.26  ? 221 GLU A H    1 
ATOM   3687 H  HA   . GLU A 1 221 ? -11.611 -3.613  3.730   1.00 33.26  ? 221 GLU A HA   1 
ATOM   3688 H  HB2  . GLU A 1 221 ? -14.369 -4.145  3.477   1.00 39.11  ? 221 GLU A HB2  1 
ATOM   3689 H  HB3  . GLU A 1 221 ? -13.492 -3.826  2.191   1.00 39.11  ? 221 GLU A HB3  1 
ATOM   3690 H  HG2  . GLU A 1 221 ? -12.188 -5.710  2.627   1.00 46.33  ? 221 GLU A HG2  1 
ATOM   3691 H  HG3  . GLU A 1 221 ? -13.096 -6.036  3.890   1.00 46.33  ? 221 GLU A HG3  1 
ATOM   3692 N  N    . LEU A 1 222 ? -13.766 -1.287  4.215   1.00 23.66  ? 222 LEU A N    1 
ATOM   3693 C  CA   . LEU A 1 222 ? -14.019 0.131   3.980   1.00 21.36  ? 222 LEU A CA   1 
ATOM   3694 C  C    . LEU A 1 222 ? -12.967 1.004   4.652   1.00 21.13  ? 222 LEU A C    1 
ATOM   3695 O  O    . LEU A 1 222 ? -12.554 2.028   4.097   1.00 20.00  ? 222 LEU A O    1 
ATOM   3696 C  CB   . LEU A 1 222 ? -15.418 0.492   4.476   1.00 21.54  ? 222 LEU A CB   1 
ATOM   3697 C  CG   . LEU A 1 222 ? -16.549 0.009   3.586   1.00 23.69  ? 222 LEU A CG   1 
ATOM   3698 C  CD1  . LEU A 1 222 ? -17.862 0.198   4.346   1.00 24.83  ? 222 LEU A CD1  1 
ATOM   3699 C  CD2  . LEU A 1 222 ? -16.578 0.747   2.241   1.00 26.86  ? 222 LEU A CD2  1 
ATOM   3700 H  H    . LEU A 1 222 ? -14.338 -1.672  4.730   1.00 28.41  ? 222 LEU A H    1 
ATOM   3701 H  HA   . LEU A 1 222 ? -13.979 0.303   3.026   1.00 25.65  ? 222 LEU A HA   1 
ATOM   3702 H  HB2  . LEU A 1 222 ? -15.545 0.097   5.352   1.00 25.85  ? 222 LEU A HB2  1 
ATOM   3703 H  HB3  . LEU A 1 222 ? -15.483 1.458   4.535   1.00 25.85  ? 222 LEU A HB3  1 
ATOM   3704 H  HG   . LEU A 1 222 ? -16.423 -0.928  3.370   1.00 28.44  ? 222 LEU A HG   1 
ATOM   3705 H  HD11 . LEU A 1 222 ? -18.597 -0.098  3.786   1.00 29.80  ? 222 LEU A HD11 1 
ATOM   3706 H  HD12 . LEU A 1 222 ? -17.834 -0.329  5.160   1.00 29.80  ? 222 LEU A HD12 1 
ATOM   3707 H  HD13 . LEU A 1 222 ? -17.969 1.137   4.563   1.00 29.80  ? 222 LEU A HD13 1 
ATOM   3708 H  HD21 . LEU A 1 222 ? -17.387 0.503   1.764   1.00 32.24  ? 222 LEU A HD21 1 
ATOM   3709 H  HD22 . LEU A 1 222 ? -16.567 1.703   2.405   1.00 32.24  ? 222 LEU A HD22 1 
ATOM   3710 H  HD23 . LEU A 1 222 ? -15.799 0.490   1.723   1.00 32.24  ? 222 LEU A HD23 1 
ATOM   3711 N  N    . ARG A 1 223 ? -12.523 0.620   5.854   1.00 21.23  ? 223 ARG A N    1 
ATOM   3712 C  CA   . ARG A 1 223 ? -11.439 1.349   6.506   1.00 22.12  ? 223 ARG A CA   1 
ATOM   3713 C  C    . ARG A 1 223 ? -10.185 1.363   5.641   1.00 24.08  ? 223 ARG A C    1 
ATOM   3714 O  O    . ARG A 1 223 ? -9.500  2.391   5.536   1.00 24.18  ? 223 ARG A O    1 
ATOM   3715 C  CB   . ARG A 1 223 ? -11.160 0.723   7.866   1.00 23.21  ? 223 ARG A CB   1 
ATOM   3716 C  CG   . ARG A 1 223 ? -10.182 1.476   8.741   1.00 23.98  ? 223 ARG A CG   1 
ATOM   3717 C  CD   . ARG A 1 223 ? -10.784 2.759   9.344   1.00 23.88  ? 223 ARG A CD   1 
ATOM   3718 N  NE   . ARG A 1 223 ? -9.759  3.500   10.067  1.00 26.21  ? 223 ARG A NE   1 
ATOM   3719 C  CZ   . ARG A 1 223 ? -9.137  4.574   9.614   1.00 27.19  ? 223 ARG A CZ   1 
ATOM   3720 N  NH1  . ARG A 1 223 ? -9.494  5.150   8.479   1.00 27.57  ? 223 ARG A NH1  1 
ATOM   3721 N  NH2  . ARG A 1 223 ? -8.123  5.081   10.318  1.00 28.34  ? 223 ARG A NH2  1 
ATOM   3722 H  H    . ARG A 1 223 ? -12.829 -0.047  6.303   1.00 25.49  ? 223 ARG A H    1 
ATOM   3723 H  HA   . ARG A 1 223 ? -11.705 2.271   6.645   1.00 26.55  ? 223 ARG A HA   1 
ATOM   3724 H  HB2  . ARG A 1 223 ? -11.997 0.665   8.353   1.00 27.86  ? 223 ARG A HB2  1 
ATOM   3725 H  HB3  . ARG A 1 223 ? -10.796 -0.165  7.725   1.00 27.86  ? 223 ARG A HB3  1 
ATOM   3726 H  HG2  . ARG A 1 223 ? -9.907  0.902   9.473   1.00 28.79  ? 223 ARG A HG2  1 
ATOM   3727 H  HG3  . ARG A 1 223 ? -9.412  1.728   8.209   1.00 28.79  ? 223 ARG A HG3  1 
ATOM   3728 H  HD2  . ARG A 1 223 ? -11.132 3.322   8.634   1.00 28.67  ? 223 ARG A HD2  1 
ATOM   3729 H  HD3  . ARG A 1 223 ? -11.495 2.528   9.962   1.00 28.67  ? 223 ARG A HD3  1 
ATOM   3730 H  HE   . ARG A 1 223 ? -9.542  3.216   10.849  1.00 31.46  ? 223 ARG A HE   1 
ATOM   3731 H  HH11 . ARG A 1 223 ? -10.144 4.826   8.019   1.00 33.10  ? 223 ARG A HH11 1 
ATOM   3732 H  HH12 . ARG A 1 223 ? -9.076  5.848   8.201   1.00 33.10  ? 223 ARG A HH12 1 
ATOM   3733 H  HH21 . ARG A 1 223 ? -7.884  4.709   11.056  1.00 34.02  ? 223 ARG A HH21 1 
ATOM   3734 H  HH22 . ARG A 1 223 ? -7.710  5.780   10.035  1.00 34.02  ? 223 ARG A HH22 1 
ATOM   3735 N  N    . LYS A 1 224 ? -9.907  0.251   4.966   1.00 25.39  ? 224 LYS A N    1 
ATOM   3736 C  CA   . LYS A 1 224 ? -8.724  0.165   4.125   1.00 28.22  ? 224 LYS A CA   1 
ATOM   3737 C  C    . LYS A 1 224 ? -8.801  1.133   2.958   1.00 28.09  ? 224 LYS A C    1 
ATOM   3738 O  O    . LYS A 1 224 ? -7.762  1.575   2.450   1.00 29.62  ? 224 LYS A O    1 
ATOM   3739 C  CB   . LYS A 1 224 ? -8.615  -1.258  3.595   1.00 33.28  ? 224 LYS A CB   1 
ATOM   3740 C  CG   . LYS A 1 224 ? -7.781  -2.152  4.461   1.00 39.62  ? 224 LYS A CG   1 
ATOM   3741 C  CD   . LYS A 1 224 ? -7.989  -3.613  4.074   1.00 44.84  ? 224 LYS A CD   1 
ATOM   3742 C  CE   . LYS A 1 224 ? -7.014  -4.523  4.803   1.00 48.19  ? 224 LYS A CE   1 
ATOM   3743 N  NZ   . LYS A 1 224 ? -7.196  -4.501  6.280   0.31 48.88  ? 224 LYS A NZ   1 
ATOM   3744 H  H    . LYS A 1 224 ? -10.385 -0.464  4.979   1.00 30.48  ? 224 LYS A H    1 
ATOM   3745 H  HA   . LYS A 1 224 ? -7.936  0.383   4.647   1.00 33.88  ? 224 LYS A HA   1 
ATOM   3746 H  HB2  . LYS A 1 224 ? -9.505  -1.641  3.542   1.00 39.95  ? 224 LYS A HB2  1 
ATOM   3747 H  HB3  . LYS A 1 224 ? -8.211  -1.234  2.714   1.00 39.95  ? 224 LYS A HB3  1 
ATOM   3748 H  HG2  . LYS A 1 224 ? -6.843  -1.932  4.346   1.00 47.55  ? 224 LYS A HG2  1 
ATOM   3749 H  HG3  . LYS A 1 224 ? -8.038  -2.038  5.389   1.00 47.55  ? 224 LYS A HG3  1 
ATOM   3750 H  HD2  . LYS A 1 224 ? -8.891  -3.882  4.308   1.00 53.82  ? 224 LYS A HD2  1 
ATOM   3751 H  HD3  . LYS A 1 224 ? -7.849  -3.716  3.120   1.00 53.82  ? 224 LYS A HD3  1 
ATOM   3752 H  HE2  . LYS A 1 224 ? -7.146  -5.434  4.499   1.00 57.84  ? 224 LYS A HE2  1 
ATOM   3753 H  HE3  . LYS A 1 224 ? -6.108  -4.236  4.609   1.00 57.84  ? 224 LYS A HE3  1 
ATOM   3754 H  HZ1  . LYS A 1 224 ? -6.599  -5.036  6.668   0.73 58.66  ? 224 LYS A HZ1  1 
ATOM   3755 H  HZ2  . LYS A 1 224 ? -7.086  -3.674  6.588   0.83 58.66  ? 224 LYS A HZ2  1 
ATOM   3756 H  HZ3  . LYS A 1 224 ? -8.014  -4.782  6.490   0.85 58.66  ? 224 LYS A HZ3  1 
ATOM   3757 N  N    . LEU A 1 225 ? -10.018 1.459   2.519   1.00 26.47  ? 225 LEU A N    1 
ATOM   3758 C  CA   . LEU A 1 225 ? -10.284 2.372   1.415   1.00 25.87  ? 225 LEU A CA   1 
ATOM   3759 C  C    . LEU A 1 225 ? -10.328 3.821   1.868   1.00 24.91  ? 225 LEU A C    1 
ATOM   3760 O  O    . LEU A 1 225 ? -10.560 4.714   1.046   1.00 25.52  ? 225 LEU A O    1 
ATOM   3761 C  CB   . LEU A 1 225 ? -11.616 1.994   0.738   1.00 27.12  ? 225 LEU A CB   1 
ATOM   3762 C  CG   . LEU A 1 225 ? -11.539 0.625   0.045   1.00 29.63  ? 225 LEU A CG   1 
ATOM   3763 C  CD1  . LEU A 1 225 ? -12.923 0.107   -0.318  1.00 31.02  ? 225 LEU A CD1  1 
ATOM   3764 C  CD2  . LEU A 1 225 ? -10.650 0.717   -1.182  1.00 31.16  ? 225 LEU A CD2  1 
ATOM   3765 H  H    . LEU A 1 225 ? -10.741 1.146   2.864   1.00 31.77  ? 225 LEU A H    1 
ATOM   3766 H  HA   . LEU A 1 225 ? -9.582  2.288   0.750   1.00 31.06  ? 225 LEU A HA   1 
ATOM   3767 H  HB2  . LEU A 1 225 ? -12.315 1.956   1.410   1.00 32.56  ? 225 LEU A HB2  1 
ATOM   3768 H  HB3  . LEU A 1 225 ? -11.835 2.662   0.070   1.00 32.56  ? 225 LEU A HB3  1 
ATOM   3769 H  HG   . LEU A 1 225 ? -11.151 -0.018  0.658   1.00 35.57  ? 225 LEU A HG   1 
ATOM   3770 H  HD11 . LEU A 1 225 ? -12.834 -0.761  -0.742  1.00 37.23  ? 225 LEU A HD11 1 
ATOM   3771 H  HD12 . LEU A 1 225 ? -13.453 0.028   0.490   1.00 37.23  ? 225 LEU A HD12 1 
ATOM   3772 H  HD13 . LEU A 1 225 ? -13.344 0.731   -0.930  1.00 37.23  ? 225 LEU A HD13 1 
ATOM   3773 H  HD21 . LEU A 1 225 ? -9.727  0.807   -0.896  1.00 37.40  ? 225 LEU A HD21 1 
ATOM   3774 H  HD22 . LEU A 1 225 ? -10.756 -0.089  -1.710  1.00 37.40  ? 225 LEU A HD22 1 
ATOM   3775 H  HD23 . LEU A 1 225 ? -10.911 1.492   -1.704  1.00 37.40  ? 225 LEU A HD23 1 
ATOM   3776 N  N    . GLY A 1 226 ? -10.123 4.078   3.154   1.00 23.02  ? 226 GLY A N    1 
ATOM   3777 C  CA   . GLY A 1 226 ? -10.042 5.432   3.656   1.00 21.45  ? 226 GLY A CA   1 
ATOM   3778 C  C    . GLY A 1 226 ? -11.235 5.901   4.457   1.00 20.48  ? 226 GLY A C    1 
ATOM   3779 O  O    . GLY A 1 226 ? -11.215 7.043   4.935   1.00 22.65  ? 226 GLY A O    1 
ATOM   3780 H  H    . GLY A 1 226 ? -10.027 3.474   3.758   1.00 27.64  ? 226 GLY A H    1 
ATOM   3781 H  HA2  . GLY A 1 226 ? -9.260  5.503   4.226   1.00 25.76  ? 226 GLY A HA2  1 
ATOM   3782 H  HA3  . GLY A 1 226 ? -9.940  6.035   2.903   1.00 25.76  ? 226 GLY A HA3  1 
ATOM   3783 N  N    . VAL A 1 227 ? -12.275 5.078   4.625   1.00 18.82  ? 227 VAL A N    1 
ATOM   3784 C  CA   . VAL A 1 227 ? -13.420 5.511   5.423   1.00 18.13  ? 227 VAL A CA   1 
ATOM   3785 C  C    . VAL A 1 227 ? -12.986 5.722   6.869   1.00 17.82  ? 227 VAL A C    1 
ATOM   3786 O  O    . VAL A 1 227 ? -12.313 4.878   7.470   1.00 18.33  ? 227 VAL A O    1 
ATOM   3787 C  CB   . VAL A 1 227 ? -14.559 4.483   5.322   1.00 18.04  ? 227 VAL A CB   1 
ATOM   3788 C  CG1  . VAL A 1 227 ? -15.709 4.858   6.230   1.00 18.26  ? 227 VAL A CG1  1 
ATOM   3789 C  CG2  . VAL A 1 227 ? -15.015 4.342   3.880   1.00 19.27  ? 227 VAL A CG2  1 
ATOM   3790 H  H    . VAL A 1 227 ? -12.339 4.286   4.296   1.00 22.60  ? 227 VAL A H    1 
ATOM   3791 H  HA   . VAL A 1 227 ? -13.747 6.356   5.079   1.00 21.77  ? 227 VAL A HA   1 
ATOM   3792 H  HB   . VAL A 1 227 ? -14.231 3.618   5.617   1.00 21.67  ? 227 VAL A HB   1 
ATOM   3793 H  HG11 . VAL A 1 227 ? -16.484 4.324   5.996   1.00 21.93  ? 227 VAL A HG11 1 
ATOM   3794 H  HG12 . VAL A 1 227 ? -15.454 4.686   7.150   1.00 21.93  ? 227 VAL A HG12 1 
ATOM   3795 H  HG13 . VAL A 1 227 ? -15.909 5.800   6.113   1.00 21.93  ? 227 VAL A HG13 1 
ATOM   3796 H  HG21 . VAL A 1 227 ? -15.768 3.731   3.844   1.00 23.14  ? 227 VAL A HG21 1 
ATOM   3797 H  HG22 . VAL A 1 227 ? -15.280 5.213   3.546   1.00 23.14  ? 227 VAL A HG22 1 
ATOM   3798 H  HG23 . VAL A 1 227 ? -14.281 3.993   3.349   1.00 23.14  ? 227 VAL A HG23 1 
ATOM   3799 N  N    . ASN A 1 228 ? -13.436 6.830   7.462   1.00 16.49  ? 228 ASN A N    1 
ATOM   3800 C  CA   . ASN A 1 228 ? -13.045 7.180   8.823   1.00 16.84  ? 228 ASN A CA   1 
ATOM   3801 C  C    . ASN A 1 228 ? -13.996 6.666   9.888   1.00 16.96  ? 228 ASN A C    1 
ATOM   3802 O  O    . ASN A 1 228 ? -13.567 6.414   11.024  1.00 18.04  ? 228 ASN A O    1 
ATOM   3803 C  CB   . ASN A 1 228 ? -12.928 8.698   8.911   1.00 17.39  ? 228 ASN A CB   1 
ATOM   3804 C  CG   . ASN A 1 228 ? -11.943 9.245   7.894   1.00 18.49  ? 228 ASN A CG   1 
ATOM   3805 O  OD1  . ASN A 1 228 ? -12.320 9.806   6.871   1.00 17.74  ? 228 ASN A OD1  1 
ATOM   3806 N  ND2  . ASN A 1 228 ? -10.668 9.063   8.165   1.00 22.23  ? 228 ASN A ND2  1 
ATOM   3807 H  H    . ASN A 1 228 ? -13.969 7.395   7.094   1.00 19.80  ? 228 ASN A H    1 
ATOM   3808 H  HA   . ASN A 1 228 ? -12.183 6.783   9.023   1.00 20.22  ? 228 ASN A HA   1 
ATOM   3809 H  HB2  . ASN A 1 228 ? -13.795 9.096   8.740   1.00 20.88  ? 228 ASN A HB2  1 
ATOM   3810 H  HB3  . ASN A 1 228 ? -12.619 8.944   9.797   1.00 20.88  ? 228 ASN A HB3  1 
ATOM   3811 H  HD21 . ASN A 1 228 ? -10.067 9.354   7.623   1.00 26.69  ? 228 ASN A HD21 1 
ATOM   3812 H  HD22 . ASN A 1 228 ? -10.436 8.654   8.885   1.00 26.69  ? 228 ASN A HD22 1 
ATOM   3813 N  N    . ALA A 1 229 ? -15.283 6.555   9.568   1.00 16.71  ? 229 ALA A N    1 
ATOM   3814 C  CA   . ALA A 1 229 ? -16.291 6.156   10.541  1.00 16.17  ? 229 ALA A CA   1 
ATOM   3815 C  C    . ALA A 1 229 ? -17.462 5.489   9.829   1.00 15.04  ? 229 ALA A C    1 
ATOM   3816 O  O    . ALA A 1 229 ? -17.615 5.585   8.601   1.00 15.83  ? 229 ALA A O    1 
ATOM   3817 C  CB   . ALA A 1 229 ? -16.775 7.338   11.399  1.00 16.27  ? 229 ALA A CB   1 
ATOM   3818 H  H    . ALA A 1 229 ? -15.600 6.708   8.784   1.00 20.07  ? 229 ALA A H    1 
ATOM   3819 H  HA   . ALA A 1 229 ? -15.888 5.501   11.131  1.00 19.41  ? 229 ALA A HA   1 
ATOM   3820 H  HB1  . ALA A 1 229 ? -17.443 7.020   12.026  1.00 19.53  ? 229 ALA A HB1  1 
ATOM   3821 H  HB2  . ALA A 1 229 ? -16.019 7.709   11.881  1.00 19.53  ? 229 ALA A HB2  1 
ATOM   3822 H  HB3  . ALA A 1 229 ? -17.160 8.012   10.818  1.00 19.53  ? 229 ALA A HB3  1 
ATOM   3823 N  N    . PHE A 1 230 ? -18.319 4.843   10.632  1.00 16.31  ? 230 PHE A N    1 
ATOM   3824 C  CA   . PHE A 1 230 ? -19.393 3.978   10.142  1.00 16.43  ? 230 PHE A CA   1 
ATOM   3825 C  C    . PHE A 1 230 ? -20.676 4.279   10.886  1.00 17.00  ? 230 PHE A C    1 
ATOM   3826 O  O    . PHE A 1 230 ? -20.719 4.176   12.114  1.00 18.51  ? 230 PHE A O    1 
ATOM   3827 C  CB   . PHE A 1 230 ? -18.982 2.506   10.314  1.00 16.72  ? 230 PHE A CB   1 
ATOM   3828 C  CG   . PHE A 1 230 ? -17.636 2.244   9.736   1.00 18.37  ? 230 PHE A CG   1 
ATOM   3829 C  CD1  . PHE A 1 230 ? -16.486 2.440   10.501  1.00 19.03  ? 230 PHE A CD1  1 
ATOM   3830 C  CD2  . PHE A 1 230 ? -17.495 1.935   8.389   1.00 19.65  ? 230 PHE A CD2  1 
ATOM   3831 C  CE1  . PHE A 1 230 ? -15.244 2.273   9.929   1.00 20.83  ? 230 PHE A CE1  1 
ATOM   3832 C  CE2  . PHE A 1 230 ? -16.248 1.756   7.834   1.00 22.44  ? 230 PHE A CE2  1 
ATOM   3833 C  CZ   . PHE A 1 230 ? -15.129 1.945   8.597   1.00 21.48  ? 230 PHE A CZ   1 
ATOM   3834 H  H    . PHE A 1 230 ? -18.295 4.894   11.490  1.00 19.58  ? 230 PHE A H    1 
ATOM   3835 H  HA   . PHE A 1 230 ? -19.567 4.159   9.205   1.00 19.73  ? 230 PHE A HA   1 
ATOM   3836 H  HB2  . PHE A 1 230 ? -18.956 2.289   11.259  1.00 20.08  ? 230 PHE A HB2  1 
ATOM   3837 H  HB3  . PHE A 1 230 ? -19.625 1.939   9.861   1.00 20.08  ? 230 PHE A HB3  1 
ATOM   3838 H  HD1  . PHE A 1 230 ? -16.558 2.684   11.396  1.00 22.85  ? 230 PHE A HD1  1 
ATOM   3839 H  HD2  . PHE A 1 230 ? -18.253 1.847   7.856   1.00 23.59  ? 230 PHE A HD2  1 
ATOM   3840 H  HE1  . PHE A 1 230 ? -14.479 2.382   10.446  1.00 25.00  ? 230 PHE A HE1  1 
ATOM   3841 H  HE2  . PHE A 1 230 ? -16.167 1.508   6.941   1.00 26.94  ? 230 PHE A HE2  1 
ATOM   3842 H  HZ   . PHE A 1 230 ? -14.286 1.852   8.214   1.00 25.79  ? 230 PHE A HZ   1 
ATOM   3843 N  N    . LEU A 1 231 ? -21.720 4.629   10.144  1.00 16.32  ? 231 LEU A N    1 
ATOM   3844 C  CA   . LEU A 1 231 ? -23.026 4.939   10.710  1.00 16.65  ? 231 LEU A CA   1 
ATOM   3845 C  C    . LEU A 1 231 ? -23.883 3.697   10.569  1.00 16.32  ? 231 LEU A C    1 
ATOM   3846 O  O    . LEU A 1 231 ? -24.119 3.224   9.452   1.00 19.66  ? 231 LEU A O    1 
ATOM   3847 C  CB   . LEU A 1 231 ? -23.643 6.157   10.015  1.00 20.77  ? 231 LEU A CB   1 
ATOM   3848 C  CG   . LEU A 1 231 ? -24.713 6.924   10.788  1.00 27.34  ? 231 LEU A CG   1 
ATOM   3849 C  CD1  . LEU A 1 231 ? -24.930 8.237   10.109  1.00 28.68  ? 231 LEU A CD1  1 
ATOM   3850 C  CD2  . LEU A 1 231 ? -25.964 6.139   10.781  1.00 33.61  ? 231 LEU A CD2  1 
ATOM   3851 H  H    . LEU A 1 231 ? -21.696 4.695   9.287   1.00 19.60  ? 231 LEU A H    1 
ATOM   3852 H  HA   . LEU A 1 231 ? -22.960 5.160   11.652  1.00 20.00  ? 231 LEU A HA   1 
ATOM   3853 H  HB2  . LEU A 1 231 ? -22.928 6.784   9.822   1.00 24.94  ? 231 LEU A HB2  1 
ATOM   3854 H  HB3  . LEU A 1 231 ? -24.052 5.854   9.189   1.00 24.94  ? 231 LEU A HB3  1 
ATOM   3855 H  HG   . LEU A 1 231 ? -24.444 7.077   11.708  1.00 32.83  ? 231 LEU A HG   1 
ATOM   3856 H  HD11 . LEU A 1 231 ? -25.598 8.741   10.601  1.00 34.43  ? 231 LEU A HD11 1 
ATOM   3857 H  HD12 . LEU A 1 231 ? -24.093 8.726   10.092  1.00 34.43  ? 231 LEU A HD12 1 
ATOM   3858 H  HD13 . LEU A 1 231 ? -25.238 8.077   9.203   1.00 34.43  ? 231 LEU A HD13 1 
ATOM   3859 H  HD21 . LEU A 1 231 ? -26.652 6.635   11.251  1.00 40.34  ? 231 LEU A HD21 1 
ATOM   3860 H  HD22 . LEU A 1 231 ? -26.235 5.986   9.862   1.00 40.34  ? 231 LEU A HD22 1 
ATOM   3861 H  HD23 . LEU A 1 231 ? -25.807 5.291   11.225  1.00 40.34  ? 231 LEU A HD23 1 
ATOM   3862 N  N    . ILE A 1 232 ? -24.310 3.155   11.703  1.00 16.38  ? 232 ILE A N    1 
ATOM   3863 C  CA   . ILE A 1 232 ? -24.954 1.856   11.761  1.00 16.81  ? 232 ILE A CA   1 
ATOM   3864 C  C    . ILE A 1 232 ? -26.215 1.972   12.607  1.00 16.99  ? 232 ILE A C    1 
ATOM   3865 O  O    . ILE A 1 232 ? -26.142 2.324   13.786  1.00 16.90  ? 232 ILE A O    1 
ATOM   3866 C  CB   . ILE A 1 232 ? -24.006 0.802   12.347  1.00 17.46  ? 232 ILE A CB   1 
ATOM   3867 C  CG1  . ILE A 1 232 ? -22.664 0.821   11.613  1.00 18.63  ? 232 ILE A CG1  1 
ATOM   3868 C  CG2  . ILE A 1 232 ? -24.669 -0.562  12.264  1.00 20.13  ? 232 ILE A CG2  1 
ATOM   3869 C  CD1  . ILE A 1 232 ? -21.727 -0.258  12.065  1.00 19.89  ? 232 ILE A CD1  1 
ATOM   3870 H  H    . ILE A 1 232 ? -24.234 3.533   12.472  1.00 19.67  ? 232 ILE A H    1 
ATOM   3871 H  HA   . ILE A 1 232 ? -25.226 1.587   10.870  1.00 20.19  ? 232 ILE A HA   1 
ATOM   3872 H  HB   . ILE A 1 232 ? -23.827 1.007   13.278  1.00 20.96  ? 232 ILE A HB   1 
ATOM   3873 H  HG12 . ILE A 1 232 ? -22.824 0.699   10.664  1.00 22.37  ? 232 ILE A HG12 1 
ATOM   3874 H  HG13 . ILE A 1 232 ? -22.232 1.675   11.770  1.00 22.37  ? 232 ILE A HG13 1 
ATOM   3875 H  HG21 . ILE A 1 232 ? -24.074 -1.226  12.646  1.00 24.17  ? 232 ILE A HG21 1 
ATOM   3876 H  HG22 . ILE A 1 232 ? -25.502 -0.539  12.761  1.00 24.17  ? 232 ILE A HG22 1 
ATOM   3877 H  HG23 . ILE A 1 232 ? -24.845 -0.771  11.334  1.00 24.17  ? 232 ILE A HG23 1 
ATOM   3878 H  HD11 . ILE A 1 232 ? -22.046 -1.112  11.733  1.00 23.88  ? 232 ILE A HD11 1 
ATOM   3879 H  HD12 . ILE A 1 232 ? -20.842 -0.075  11.713  1.00 23.88  ? 232 ILE A HD12 1 
ATOM   3880 H  HD13 . ILE A 1 232 ? -21.702 -0.269  13.034  1.00 23.88  ? 232 ILE A HD13 1 
ATOM   3881 N  N    . GLY A 1 233 ? -27.356 1.636   12.022  1.00 17.67  ? 233 GLY A N    1 
ATOM   3882 C  CA   . GLY A 1 233 ? -28.642 1.708   12.697  1.00 17.22  ? 233 GLY A CA   1 
ATOM   3883 C  C    . GLY A 1 233 ? -29.310 0.371   12.923  1.00 17.20  ? 233 GLY A C    1 
ATOM   3884 O  O    . GLY A 1 233 ? -29.285 -0.166  14.027  1.00 17.01  ? 233 GLY A O    1 
ATOM   3885 H  H    . GLY A 1 233 ? -27.414 1.356   11.211  1.00 21.22  ? 233 GLY A H    1 
ATOM   3886 H  HA2  . GLY A 1 233 ? -28.518 2.128   13.562  1.00 20.68  ? 233 GLY A HA2  1 
ATOM   3887 H  HA3  . GLY A 1 233 ? -29.244 2.253   12.165  1.00 20.68  ? 233 GLY A HA3  1 
ATOM   3888 N  N    . SER A 1 234 ? -29.913 -0.165  11.863  1.00 17.45  ? 234 SER A N    1 
ATOM   3889 C  CA   . SER A 1 234 ? -30.737 -1.362  11.968  1.00 16.83  ? 234 SER A CA   1 
ATOM   3890 C  C    . SER A 1 234 ? -30.074 -2.510  12.723  1.00 16.41  ? 234 SER A C    1 
ATOM   3891 O  O    . SER A 1 234 ? -30.686 -3.089  13.629  1.00 16.19  ? 234 SER A O    1 
ATOM   3892 C  CB   . SER A 1 234 ? -31.144 -1.793  10.568  1.00 17.26  ? 234 SER A CB   1 
ATOM   3893 O  OG   . SER A 1 234 ? -31.870 -2.991  10.614  1.00 19.24  ? 234 SER A OG   1 
ATOM   3894 H  H    . SER A 1 234 ? -29.859 0.149   11.064  1.00 20.95  ? 234 SER A H    1 
ATOM   3895 H  HA   . SER A 1 234 ? -31.525 -1.138  12.488  1.00 20.21  ? 234 SER A HA   1 
ATOM   3896 H  HB2  . SER A 1 234 ? -31.698 -1.102  10.172  1.00 20.73  ? 234 SER A HB2  1 
ATOM   3897 H  HB3  . SER A 1 234 ? -30.346 -1.926  10.032  1.00 20.73  ? 234 SER A HB3  1 
ATOM   3898 H  HG   . SER A 1 234 ? -32.147 -3.189  9.847   1.00 23.11  ? 234 SER A HG   1 
ATOM   3899 N  N    . SER A 1 235 ? -28.837 -2.866  12.376  1.00 16.73  ? 235 SER A N    1 
ATOM   3900 C  CA   A SER A 1 235 ? -28.230 -4.029  13.020  0.51 16.33  ? 235 SER A CA   1 
ATOM   3901 C  CA   B SER A 1 235 ? -28.194 -4.014  13.014  0.28 17.33  ? 235 SER A CA   1 
ATOM   3902 C  CA   C SER A 1 235 ? -28.197 -4.015  13.015  0.21 16.28  ? 235 SER A CA   1 
ATOM   3903 C  C    . SER A 1 235 ? -28.067 -3.819  14.521  1.00 16.81  ? 235 SER A C    1 
ATOM   3904 O  O    . SER A 1 235 ? -28.200 -4.780  15.297  1.00 17.64  ? 235 SER A O    1 
ATOM   3905 C  CB   A SER A 1 235 ? -26.900 -4.415  12.378  0.51 18.57  ? 235 SER A CB   1 
ATOM   3906 C  CB   B SER A 1 235 ? -26.820 -4.248  12.392  0.28 19.36  ? 235 SER A CB   1 
ATOM   3907 C  CB   C SER A 1 235 ? -26.821 -4.265  12.399  0.21 16.82  ? 235 SER A CB   1 
ATOM   3908 O  OG   A SER A 1 235 ? -25.963 -3.378  12.442  0.51 18.90  ? 235 SER A OG   1 
ATOM   3909 O  OG   B SER A 1 235 ? -26.105 -5.241  13.096  0.28 20.79  ? 235 SER A OG   1 
ATOM   3910 O  OG   C SER A 1 235 ? -26.929 -4.717  11.058  0.21 17.06  ? 235 SER A OG   1 
ATOM   3911 H  H    A SER A 1 235 ? -28.347 -2.467  11.793  0.51 20.09  ? 235 SER A H    1 
ATOM   3912 H  H    B SER A 1 235 ? -28.357 -2.468  11.785  0.28 20.09  ? 235 SER A H    1 
ATOM   3913 H  H    C SER A 1 235 ? -28.356 -2.468  11.785  0.21 20.09  ? 235 SER A H    1 
ATOM   3914 H  HA   A SER A 1 235 ? -28.825 -4.782  12.880  0.51 19.61  ? 235 SER A HA   1 
ATOM   3915 H  HA   B SER A 1 235 ? -28.740 -4.800  12.860  0.28 20.81  ? 235 SER A HA   1 
ATOM   3916 H  HA   C SER A 1 235 ? -28.750 -4.796  12.858  0.21 19.55  ? 235 SER A HA   1 
ATOM   3917 H  HB2  A SER A 1 235 ? -26.542 -5.187  12.845  0.51 22.30  ? 235 SER A HB2  1 
ATOM   3918 H  HB2  B SER A 1 235 ? -26.935 -4.535  11.473  0.28 23.24  ? 235 SER A HB2  1 
ATOM   3919 H  HB2  C SER A 1 235 ? -26.316 -3.437  12.411  0.21 20.20  ? 235 SER A HB2  1 
ATOM   3920 H  HB3  A SER A 1 235 ? -27.058 -4.635  11.446  0.51 22.30  ? 235 SER A HB3  1 
ATOM   3921 H  HB3  B SER A 1 235 ? -26.316 -3.419  12.420  0.28 23.24  ? 235 SER A HB3  1 
ATOM   3922 H  HB3  C SER A 1 235 ? -26.362 -4.941  12.921  0.21 20.20  ? 235 SER A HB3  1 
ATOM   3923 H  HG   A SER A 1 235 ? -26.259 -2.699  12.045  0.51 22.69  ? 235 SER A HG   1 
ATOM   3924 H  HG   B SER A 1 235 ? -26.565 -5.942  13.149  0.28 24.97  ? 235 SER A HG   1 
ATOM   3925 H  HG   C SER A 1 235 ? -26.218 -4.554  10.642  0.21 20.48  ? 235 SER A HG   1 
ATOM   3926 N  N    . LEU A 1 236 ? -27.804 -2.592  14.954  1.00 15.83  ? 236 LEU A N    1 
ATOM   3927 C  CA   . LEU A 1 236 ? -27.628 -2.321  16.371  1.00 15.61  ? 236 LEU A CA   1 
ATOM   3928 C  C    . LEU A 1 236 ? -28.964 -2.139  17.078  1.00 15.91  ? 236 LEU A C    1 
ATOM   3929 O  O    . LEU A 1 236 ? -29.076 -2.469  18.259  1.00 16.61  ? 236 LEU A O    1 
ATOM   3930 C  CB   . LEU A 1 236 ? -26.765 -1.076  16.568  1.00 16.24  ? 236 LEU A CB   1 
ATOM   3931 C  CG   . LEU A 1 236 ? -25.349 -1.236  15.991  1.00 16.52  ? 236 LEU A CG   1 
ATOM   3932 C  CD1  . LEU A 1 236 ? -24.571 0.041   16.226  1.00 20.14  ? 236 LEU A CD1  1 
ATOM   3933 C  CD2  . LEU A 1 236 ? -24.621 -2.385  16.638  1.00 18.31  ? 236 LEU A CD2  1 
ATOM   3934 H  H    . LEU A 1 236 ? -27.723 -1.902  14.448  1.00 19.01  ? 236 LEU A H    1 
ATOM   3935 H  HA   . LEU A 1 236 ? -27.166 -3.072  16.777  1.00 18.75  ? 236 LEU A HA   1 
ATOM   3936 H  HB2  . LEU A 1 236 ? -27.189 -0.326  16.122  1.00 19.50  ? 236 LEU A HB2  1 
ATOM   3937 H  HB3  . LEU A 1 236 ? -26.685 -0.895  17.517  1.00 19.50  ? 236 LEU A HB3  1 
ATOM   3938 H  HG   . LEU A 1 236 ? -25.415 -1.419  15.041  1.00 19.84  ? 236 LEU A HG   1 
ATOM   3939 H  HD11 . LEU A 1 236 ? -23.689 -0.050  15.834  1.00 24.18  ? 236 LEU A HD11 1 
ATOM   3940 H  HD12 . LEU A 1 236 ? -25.043 0.780   15.811  1.00 24.18  ? 236 LEU A HD12 1 
ATOM   3941 H  HD13 . LEU A 1 236 ? -24.494 0.193   17.181  1.00 24.18  ? 236 LEU A HD13 1 
ATOM   3942 H  HD21 . LEU A 1 236 ? -24.723 -2.322  17.600  1.00 21.99  ? 236 LEU A HD21 1 
ATOM   3943 H  HD22 . LEU A 1 236 ? -25.000 -3.219  16.319  1.00 21.99  ? 236 LEU A HD22 1 
ATOM   3944 H  HD23 . LEU A 1 236 ? -23.682 -2.337  16.400  1.00 21.99  ? 236 LEU A HD23 1 
ATOM   3945 N  N    . MET A 1 237 ? -29.974 -1.587  16.394  1.00 16.33  ? 237 MET A N    1 
ATOM   3946 C  CA   . MET A 1 237 ? -31.302 -1.519  16.978  1.00 16.27  ? 237 MET A CA   1 
ATOM   3947 C  C    . MET A 1 237 ? -31.869 -2.899  17.244  1.00 17.12  ? 237 MET A C    1 
ATOM   3948 O  O    . MET A 1 237 ? -32.637 -3.078  18.184  1.00 17.01  ? 237 MET A O    1 
ATOM   3949 C  CB   . MET A 1 237 ? -32.239 -0.759  16.048  1.00 17.63  ? 237 MET A CB   1 
ATOM   3950 C  CG   . MET A 1 237 ? -32.125 0.756   16.033  1.00 16.87  ? 237 MET A CG   1 
ATOM   3951 S  SD   . MET A 1 237 ? -32.311 1.544   17.638  1.00 18.00  ? 237 MET A SD   1 
ATOM   3952 C  CE   . MET A 1 237 ? -34.029 1.148   18.023  1.00 19.52  ? 237 MET A CE   1 
ATOM   3953 H  H    . MET A 1 237 ? -29.911 -1.253  15.604  1.00 19.61  ? 237 MET A H    1 
ATOM   3954 H  HA   . MET A 1 237 ? -31.238 -1.034  17.815  1.00 19.53  ? 237 MET A HA   1 
ATOM   3955 H  HB2  . MET A 1 237 ? -32.071 -1.063  15.142  1.00 21.17  ? 237 MET A HB2  1 
ATOM   3956 H  HB3  . MET A 1 237 ? -33.150 -0.971  16.306  1.00 21.17  ? 237 MET A HB3  1 
ATOM   3957 H  HG2  . MET A 1 237 ? -31.250 0.996   15.691  1.00 20.26  ? 237 MET A HG2  1 
ATOM   3958 H  HG3  . MET A 1 237 ? -32.817 1.111   15.453  1.00 20.26  ? 237 MET A HG3  1 
ATOM   3959 H  HE1  . MET A 1 237 ? -34.244 1.499   18.902  1.00 23.44  ? 237 MET A HE1  1 
ATOM   3960 H  HE2  . MET A 1 237 ? -34.604 1.553   17.355  1.00 23.44  ? 237 MET A HE2  1 
ATOM   3961 H  HE3  . MET A 1 237 ? -34.140 0.185   18.015  1.00 23.44  ? 237 MET A HE3  1 
ATOM   3962 N  N    . ARG A 1 238 ? -31.504 -3.896  16.428  1.00 16.82  ? 238 ARG A N    1 
ATOM   3963 C  CA   . ARG A 1 238 ? -32.002 -5.250  16.614  1.00 15.95  ? 238 ARG A CA   1 
ATOM   3964 C  C    . ARG A 1 238 ? -31.118 -6.082  17.546  1.00 16.96  ? 238 ARG A C    1 
ATOM   3965 O  O    . ARG A 1 238 ? -31.621 -7.010  18.176  1.00 18.18  ? 238 ARG A O    1 
ATOM   3966 C  CB   . ARG A 1 238 ? -32.160 -5.931  15.249  1.00 16.73  ? 238 ARG A CB   1 
ATOM   3967 C  CG   . ARG A 1 238 ? -33.297 -5.288  14.432  1.00 17.67  ? 238 ARG A CG   1 
ATOM   3968 C  CD   . ARG A 1 238 ? -33.434 -5.849  13.032  1.00 19.57  ? 238 ARG A CD   1 
ATOM   3969 N  NE   . ARG A 1 238 ? -32.327 -5.457  12.168  1.00 20.19  ? 238 ARG A NE   1 
ATOM   3970 C  CZ   . ARG A 1 238 ? -31.399 -6.277  11.694  1.00 20.43  ? 238 ARG A CZ   1 
ATOM   3971 N  NH1  . ARG A 1 238 ? -31.405 -7.573  11.969  1.00 20.63  ? 238 ARG A NH1  1 
ATOM   3972 N  NH2  . ARG A 1 238 ? -30.460 -5.791  10.885  1.00 20.95  ? 238 ARG A NH2  1 
ATOM   3973 H  H    . ARG A 1 238 ? -30.968 -3.807  15.761  1.00 20.20  ? 238 ARG A H    1 
ATOM   3974 H  HA   . ARG A 1 238 ? -32.881 -5.223  17.022  1.00 19.15  ? 238 ARG A HA   1 
ATOM   3975 H  HB2  . ARG A 1 238 ? -31.334 -5.842  14.748  1.00 20.09  ? 238 ARG A HB2  1 
ATOM   3976 H  HB3  . ARG A 1 238 ? -32.370 -6.869  15.380  1.00 20.09  ? 238 ARG A HB3  1 
ATOM   3977 H  HG2  . ARG A 1 238 ? -34.137 -5.436  14.894  1.00 21.22  ? 238 ARG A HG2  1 
ATOM   3978 H  HG3  . ARG A 1 238 ? -33.125 -4.336  14.353  1.00 21.22  ? 238 ARG A HG3  1 
ATOM   3979 H  HD2  . ARG A 1 238 ? -33.452 -6.818  13.078  1.00 23.50  ? 238 ARG A HD2  1 
ATOM   3980 H  HD3  . ARG A 1 238 ? -34.256 -5.520  12.636  1.00 23.50  ? 238 ARG A HD3  1 
ATOM   3981 H  HE   . ARG A 1 238 ? -32.271 -4.628  11.949  1.00 24.24  ? 238 ARG A HE   1 
ATOM   3982 H  HH11 . ARG A 1 238 ? -32.022 -7.905  12.467  1.00 24.77  ? 238 ARG A HH11 1 
ATOM   3983 H  HH12 . ARG A 1 238 ? -30.791 -8.084  11.648  1.00 24.77  ? 238 ARG A HH12 1 
ATOM   3984 H  HH21 . ARG A 1 238 ? -30.461 -4.957  10.677  1.00 25.15  ? 238 ARG A HH21 1 
ATOM   3985 H  HH22 . ARG A 1 238 ? -29.852 -6.312  10.570  1.00 25.15  ? 238 ARG A HH22 1 
ATOM   3986 N  N    . ASN A 1 239 ? -29.827 -5.775  17.657  1.00 17.01  ? 239 ASN A N    1 
ATOM   3987 C  CA   . ASN A 1 239 ? -28.943 -6.464  18.600  1.00 17.20  ? 239 ASN A CA   1 
ATOM   3988 C  C    . ASN A 1 239 ? -27.852 -5.515  19.051  1.00 16.99  ? 239 ASN A C    1 
ATOM   3989 O  O    . ASN A 1 239 ? -26.750 -5.504  18.494  1.00 17.95  ? 239 ASN A O    1 
ATOM   3990 C  CB   . ASN A 1 239 ? -28.329 -7.728  18.006  1.00 17.99  ? 239 ASN A CB   1 
ATOM   3991 C  CG   . ASN A 1 239 ? -27.478 -8.480  19.012  1.00 19.44  ? 239 ASN A CG   1 
ATOM   3992 O  OD1  . ASN A 1 239 ? -27.492 -8.189  20.213  1.00 20.21  ? 239 ASN A OD1  1 
ATOM   3993 N  ND2  . ASN A 1 239 ? -26.719 -9.440  18.527  1.00 22.26  ? 239 ASN A ND2  1 
ATOM   3994 H  H    . ASN A 1 239 ? -29.435 -5.166  17.193  1.00 20.42  ? 239 ASN A H    1 
ATOM   3995 H  HA   . ASN A 1 239 ? -29.470 -6.713  19.375  1.00 20.65  ? 239 ASN A HA   1 
ATOM   3996 H  HB2  . ASN A 1 239 ? -29.040 -8.318  17.710  1.00 21.60  ? 239 ASN A HB2  1 
ATOM   3997 H  HB3  . ASN A 1 239 ? -27.766 -7.485  17.255  1.00 21.60  ? 239 ASN A HB3  1 
ATOM   3998 H  HD21 . ASN A 1 239 ? -26.216 -9.899  19.053  1.00 26.73  ? 239 ASN A HD21 1 
ATOM   3999 H  HD22 . ASN A 1 239 ? -26.727 -9.609  17.683  1.00 26.73  ? 239 ASN A HD22 1 
ATOM   4000 N  N    . PRO A 1 240 ? -28.121 -4.692  20.068  1.00 16.67  ? 240 PRO A N    1 
ATOM   4001 C  CA   . PRO A 1 240 ? -27.142 -3.658  20.435  1.00 16.77  ? 240 PRO A CA   1 
ATOM   4002 C  C    . PRO A 1 240 ? -25.755 -4.185  20.760  1.00 17.73  ? 240 PRO A C    1 
ATOM   4003 O  O    . PRO A 1 240 ? -24.773 -3.516  20.452  1.00 17.95  ? 240 PRO A O    1 
ATOM   4004 C  CB   . PRO A 1 240 ? -27.782 -2.988  21.664  1.00 18.03  ? 240 PRO A CB   1 
ATOM   4005 C  CG   . PRO A 1 240 ? -29.281 -3.132  21.447  1.00 17.78  ? 240 PRO A CG   1 
ATOM   4006 C  CD   . PRO A 1 240 ? -29.420 -4.493  20.735  1.00 17.87  ? 240 PRO A CD   1 
ATOM   4007 H  HA   . PRO A 1 240 ? -27.074 -3.025  19.703  1.00 20.14  ? 240 PRO A HA   1 
ATOM   4008 H  HB2  . PRO A 1 240 ? -27.502 -3.444  22.473  1.00 21.65  ? 240 PRO A HB2  1 
ATOM   4009 H  HB3  . PRO A 1 240 ? -27.525 -2.054  21.703  1.00 21.65  ? 240 PRO A HB3  1 
ATOM   4010 H  HG2  . PRO A 1 240 ? -29.745 -3.133  22.300  1.00 21.34  ? 240 PRO A HG2  1 
ATOM   4011 H  HG3  . PRO A 1 240 ? -29.611 -2.409  20.891  1.00 21.34  ? 240 PRO A HG3  1 
ATOM   4012 H  HD2  . PRO A 1 240 ? -29.585 -5.200  21.378  1.00 21.46  ? 240 PRO A HD2  1 
ATOM   4013 H  HD3  . PRO A 1 240 ? -30.138 -4.464  20.082  1.00 21.46  ? 240 PRO A HD3  1 
ATOM   4014 N  N    . GLU A 1 241 ? -25.645 -5.341  21.413  1.00 18.91  ? 241 GLU A N    1 
ATOM   4015 C  CA   . GLU A 1 241 ? -24.340 -5.836  21.813  1.00 19.91  ? 241 GLU A CA   1 
ATOM   4016 C  C    . GLU A 1 241 ? -23.434 -6.123  20.620  1.00 19.86  ? 241 GLU A C    1 
ATOM   4017 O  O    . GLU A 1 241 ? -22.212 -6.244  20.803  1.00 20.38  ? 241 GLU A O    1 
ATOM   4018 C  CB   . GLU A 1 241 ? -24.501 -7.024  22.759  1.00 23.14  ? 241 GLU A CB   1 
ATOM   4019 C  CG   . GLU A 1 241 ? -24.592 -8.339  22.067  1.00 25.41  ? 241 GLU A CG   1 
ATOM   4020 C  CD   . GLU A 1 241 ? -24.691 -9.518  23.015  1.00 26.63  ? 241 GLU A CD   1 
ATOM   4021 O  OE1  . GLU A 1 241 ? -25.136 -9.355  24.176  1.00 28.45  ? 241 GLU A OE1  1 
ATOM   4022 O  OE2  . GLU A 1 241 ? -24.331 -10.607 22.555  1.00 24.86  ? 241 GLU A OE2  1 
ATOM   4023 H  H    . GLU A 1 241 ? -26.305 -5.847  21.632  1.00 22.71  ? 241 GLU A H    1 
ATOM   4024 H  HA   . GLU A 1 241 ? -23.871 -5.163  22.331  1.00 23.90  ? 241 GLU A HA   1 
ATOM   4025 H  HB2  . GLU A 1 241 ? -23.734 -7.055  23.353  1.00 27.78  ? 241 GLU A HB2  1 
ATOM   4026 H  HB3  . GLU A 1 241 ? -25.314 -6.904  23.274  1.00 27.78  ? 241 GLU A HB3  1 
ATOM   4027 H  HG2  . GLU A 1 241 ? -25.383 -8.343  21.505  1.00 30.51  ? 241 GLU A HG2  1 
ATOM   4028 H  HG3  . GLU A 1 241 ? -23.799 -8.462  21.522  1.00 30.51  ? 241 GLU A HG3  1 
ATOM   4029 N  N    . LYS A 1 242 ? -23.976 -6.190  19.405  1.00 19.97  ? 242 LYS A N    1 
ATOM   4030 C  CA   . LYS A 1 242 ? -23.136 -6.390  18.227  1.00 20.36  ? 242 LYS A CA   1 
ATOM   4031 C  C    . LYS A 1 242 ? -22.045 -5.325  18.085  1.00 19.69  ? 242 LYS A C    1 
ATOM   4032 O  O    . LYS A 1 242 ? -20.991 -5.593  17.498  1.00 20.53  ? 242 LYS A O    1 
ATOM   4033 C  CB   . LYS A 1 242 ? -23.992 -6.365  16.964  1.00 24.80  ? 242 LYS A CB   1 
ATOM   4034 C  CG   . LYS A 1 242 ? -24.596 -7.688  16.626  0.45 27.47  ? 242 LYS A CG   1 
ATOM   4035 C  CD   . LYS A 1 242 ? -25.235 -7.720  15.240  0.55 30.81  ? 242 LYS A CD   1 
ATOM   4036 C  CE   . LYS A 1 242 ? -24.267 -7.313  14.153  1.00 34.38  ? 242 LYS A CE   1 
ATOM   4037 N  NZ   . LYS A 1 242 ? -23.604 -8.549  13.604  1.00 38.11  ? 242 LYS A NZ   1 
ATOM   4038 H  H    . LYS A 1 242 ? -24.817 -6.125  19.237  1.00 23.98  ? 242 LYS A H    1 
ATOM   4039 H  HA   . LYS A 1 242 ? -22.710 -7.256  18.323  1.00 24.45  ? 242 LYS A HA   1 
ATOM   4040 H  HB2  . LYS A 1 242 ? -24.716 -5.731  17.090  1.00 29.78  ? 242 LYS A HB2  1 
ATOM   4041 H  HB3  . LYS A 1 242 ? -23.438 -6.092  16.216  1.00 29.78  ? 242 LYS A HB3  1 
ATOM   4042 H  HG2  . LYS A 1 242 ? -23.903 -8.366  16.650  0.62 32.98  ? 242 LYS A HG2  1 
ATOM   4043 H  HG3  . LYS A 1 242 ? -25.285 -7.895  17.276  0.78 32.98  ? 242 LYS A HG3  1 
ATOM   4044 H  HD2  . LYS A 1 242 ? -25.540 -8.621  15.051  0.73 36.99  ? 242 LYS A HD2  1 
ATOM   4045 H  HD3  . LYS A 1 242 ? -25.985 -7.105  15.221  0.66 36.99  ? 242 LYS A HD3  1 
ATOM   4046 H  HE2  . LYS A 1 242 ? -24.744 -6.866  13.436  1.00 41.26  ? 242 LYS A HE2  1 
ATOM   4047 H  HE3  . LYS A 1 242 ? -23.588 -6.725  14.517  1.00 41.26  ? 242 LYS A HE3  1 
ATOM   4048 H  HZ1  . LYS A 1 242 ? -23.020 -8.325  12.970  1.00 45.74  ? 242 LYS A HZ1  1 
ATOM   4049 H  HZ2  . LYS A 1 242 ? -23.173 -8.978  14.254  1.00 45.74  ? 242 LYS A HZ2  1 
ATOM   4050 H  HZ3  . LYS A 1 242 ? -24.215 -9.093  13.254  1.00 45.74  ? 242 LYS A HZ3  1 
ATOM   4051 N  N    . ILE A 1 243 ? -22.261 -4.116  18.595  1.00 19.90  ? 243 ILE A N    1 
ATOM   4052 C  CA   . ILE A 1 243 ? -21.229 -3.086  18.445  1.00 19.28  ? 243 ILE A CA   1 
ATOM   4053 C  C    . ILE A 1 243 ? -19.910 -3.532  19.054  1.00 20.17  ? 243 ILE A C    1 
ATOM   4054 O  O    . ILE A 1 243 ? -18.843 -3.111  18.615  1.00 20.82  ? 243 ILE A O    1 
ATOM   4055 C  CB   . ILE A 1 243 ? -21.707 -1.738  19.028  1.00 19.92  ? 243 ILE A CB   1 
ATOM   4056 C  CG1  . ILE A 1 243 ? -20.813 -0.608  18.518  1.00 20.32  ? 243 ILE A CG1  1 
ATOM   4057 C  CG2  . ILE A 1 243 ? -21.755 -1.793  20.546  1.00 20.36  ? 243 ILE A CG2  1 
ATOM   4058 C  CD1  . ILE A 1 243 ? -21.258 0.757   18.966  1.00 21.67  ? 243 ILE A CD1  1 
ATOM   4059 H  H    . ILE A 1 243 ? -22.968 -3.872  19.018  1.00 23.89  ? 243 ILE A H    1 
ATOM   4060 H  HA   . ILE A 1 243 ? -21.080 -2.953  17.496  1.00 23.15  ? 243 ILE A HA   1 
ATOM   4061 H  HB   . ILE A 1 243 ? -22.611 -1.562  18.725  1.00 23.92  ? 243 ILE A HB   1 
ATOM   4062 H  HG12 . ILE A 1 243 ? -19.911 -0.750  18.846  1.00 24.39  ? 243 ILE A HG12 1 
ATOM   4063 H  HG13 . ILE A 1 243 ? -20.818 -0.619  17.548  1.00 24.39  ? 243 ILE A HG13 1 
ATOM   4064 H  HG21 . ILE A 1 243 ? -22.252 -1.028  20.874  1.00 24.44  ? 243 ILE A HG21 1 
ATOM   4065 H  HG22 . ILE A 1 243 ? -22.194 -2.614  20.818  1.00 24.44  ? 243 ILE A HG22 1 
ATOM   4066 H  HG23 . ILE A 1 243 ? -20.849 -1.772  20.892  1.00 24.44  ? 243 ILE A HG23 1 
ATOM   4067 H  HD11 . ILE A 1 243 ? -20.702 1.426   18.537  1.00 26.02  ? 243 ILE A HD11 1 
ATOM   4068 H  HD12 . ILE A 1 243 ? -22.185 0.885   18.714  1.00 26.02  ? 243 ILE A HD12 1 
ATOM   4069 H  HD13 . ILE A 1 243 ? -21.165 0.818   19.930  1.00 26.02  ? 243 ILE A HD13 1 
ATOM   4070 N  N    . LYS A 1 244 ? -19.952 -4.368  20.090  1.00 21.40  ? 244 LYS A N    1 
ATOM   4071 C  CA   . LYS A 1 244 ? -18.701 -4.783  20.717  1.00 23.38  ? 244 LYS A CA   1 
ATOM   4072 C  C    . LYS A 1 244 ? -17.856 -5.593  19.750  1.00 25.12  ? 244 LYS A C    1 
ATOM   4073 O  O    . LYS A 1 244 ? -16.633 -5.430  19.693  1.00 27.41  ? 244 LYS A O    1 
ATOM   4074 C  CB   . LYS A 1 244 ? -18.978 -5.594  21.981  1.00 26.17  ? 244 LYS A CB   1 
ATOM   4075 C  CG   . LYS A 1 244 ? -19.783 -4.869  23.015  1.00 29.90  ? 244 LYS A CG   1 
ATOM   4076 C  CD   . LYS A 1 244 ? -19.777 -5.652  24.314  1.00 32.79  ? 244 LYS A CD   1 
ATOM   4077 C  CE   . LYS A 1 244 ? -21.018 -5.388  25.108  1.00 35.05  ? 244 LYS A CE   1 
ATOM   4078 N  NZ   . LYS A 1 244 ? -21.056 -6.299  26.306  1.00 36.83  ? 244 LYS A NZ   1 
ATOM   4079 H  H    . LYS A 1 244 ? -20.667 -4.698  20.437  1.00 25.69  ? 244 LYS A H    1 
ATOM   4080 H  HA   . LYS A 1 244 ? -18.207 -3.989  20.976  1.00 28.06  ? 244 LYS A HA   1 
ATOM   4081 H  HB2  . LYS A 1 244 ? -19.468 -6.394  21.735  1.00 31.41  ? 244 LYS A HB2  1 
ATOM   4082 H  HB3  . LYS A 1 244 ? -18.130 -5.835  22.386  1.00 31.41  ? 244 LYS A HB3  1 
ATOM   4083 H  HG2  . LYS A 1 244 ? -19.398 -3.994  23.177  1.00 35.89  ? 244 LYS A HG2  1 
ATOM   4084 H  HG3  . LYS A 1 244 ? -20.700 -4.777  22.711  1.00 35.89  ? 244 LYS A HG3  1 
ATOM   4085 H  HD2  . LYS A 1 244 ? -19.734 -6.601  24.118  1.00 39.37  ? 244 LYS A HD2  1 
ATOM   4086 H  HD3  . LYS A 1 244 ? -19.011 -5.388  24.846  1.00 39.37  ? 244 LYS A HD3  1 
ATOM   4087 H  HE2  . LYS A 1 244 ? -21.022 -4.468  25.414  1.00 42.07  ? 244 LYS A HE2  1 
ATOM   4088 H  HE3  . LYS A 1 244 ? -21.800 -5.559  24.560  1.00 42.07  ? 244 LYS A HE3  1 
ATOM   4089 H  HZ1  . LYS A 1 244 ? -20.469 -6.025  26.916  1.00 44.20  ? 244 LYS A HZ1  1 
ATOM   4090 H  HZ2  . LYS A 1 244 ? -21.870 -6.294  26.666  1.00 44.20  ? 244 LYS A HZ2  1 
ATOM   4091 H  HZ3  . LYS A 1 244 ? -20.854 -7.131  26.063  1.00 44.20  ? 244 LYS A HZ3  1 
ATOM   4092 N  N    . GLU A 1 245 ? -18.488 -6.489  18.997  1.00 25.12  ? 245 GLU A N    1 
ATOM   4093 C  CA   . GLU A 1 245 ? -17.777 -7.282  18.007  1.00 29.75  ? 245 GLU A CA   1 
ATOM   4094 C  C    . GLU A 1 245 ? -17.361 -6.440  16.820  1.00 26.82  ? 245 GLU A C    1 
ATOM   4095 O  O    . GLU A 1 245 ? -16.301 -6.673  16.244  1.00 29.34  ? 245 GLU A O    1 
ATOM   4096 C  CB   . GLU A 1 245 ? -18.697 -8.405  17.518  1.00 38.77  ? 245 GLU A CB   1 
ATOM   4097 C  CG   . GLU A 1 245 ? -17.979 -9.559  16.854  1.00 48.24  ? 245 GLU A CG   1 
ATOM   4098 C  CD   . GLU A 1 245 ? -17.719 -9.328  15.381  1.00 55.33  ? 245 GLU A CD   1 
ATOM   4099 O  OE1  . GLU A 1 245 ? -18.594 -8.733  14.718  1.00 58.20  ? 245 GLU A OE1  1 
ATOM   4100 O  OE2  . GLU A 1 245 ? -16.642 -9.762  14.892  1.00 58.68  ? 245 GLU A OE2  1 
ATOM   4101 H  H    . GLU A 1 245 ? -19.331 -6.657  19.041  1.00 30.15  ? 245 GLU A H    1 
ATOM   4102 H  HA   . GLU A 1 245 ? -16.983 -7.662  18.414  1.00 35.71  ? 245 GLU A HA   1 
ATOM   4103 H  HB2  . GLU A 1 245 ? -19.183 -8.760  18.279  1.00 46.54  ? 245 GLU A HB2  1 
ATOM   4104 H  HB3  . GLU A 1 245 ? -19.319 -8.035  16.871  1.00 46.54  ? 245 GLU A HB3  1 
ATOM   4105 H  HG2  . GLU A 1 245 ? -17.124 -9.691  17.291  1.00 57.90  ? 245 GLU A HG2  1 
ATOM   4106 H  HG3  . GLU A 1 245 ? -18.522 -10.358 16.939  1.00 57.90  ? 245 GLU A HG3  1 
ATOM   4107 N  N    . LEU A 1 246 ? -18.167 -5.451  16.454  1.00 22.98  ? 246 LEU A N    1 
ATOM   4108 C  CA   . LEU A 1 246 ? -17.841 -4.637  15.292  1.00 23.13  ? 246 LEU A CA   1 
ATOM   4109 C  C    . LEU A 1 246 ? -16.639 -3.738  15.540  1.00 25.36  ? 246 LEU A C    1 
ATOM   4110 O  O    . LEU A 1 246 ? -15.949 -3.371  14.585  1.00 26.75  ? 246 LEU A O    1 
ATOM   4111 C  CB   . LEU A 1 246 ? -19.045 -3.805  14.871  1.00 23.79  ? 246 LEU A CB   1 
ATOM   4112 C  CG   . LEU A 1 246 ? -20.291 -4.560  14.390  1.00 23.91  ? 246 LEU A CG   1 
ATOM   4113 C  CD1  . LEU A 1 246 ? -21.395 -3.559  14.095  1.00 24.87  ? 246 LEU A CD1  1 
ATOM   4114 C  CD2  . LEU A 1 246 ? -19.983 -5.400  13.173  1.00 25.25  ? 246 LEU A CD2  1 
ATOM   4115 H  H    . LEU A 1 246 ? -18.897 -5.233  16.854  1.00 27.59  ? 246 LEU A H    1 
ATOM   4116 H  HA   . LEU A 1 246 ? -17.618 -5.233  14.560  1.00 27.76  ? 246 LEU A HA   1 
ATOM   4117 H  HB2  . LEU A 1 246 ? -19.317 -3.269  15.632  1.00 28.56  ? 246 LEU A HB2  1 
ATOM   4118 H  HB3  . LEU A 1 246 ? -18.767 -3.229  14.142  1.00 28.56  ? 246 LEU A HB3  1 
ATOM   4119 H  HG   . LEU A 1 246 ? -20.593 -5.168  15.083  1.00 28.70  ? 246 LEU A HG   1 
ATOM   4120 H  HD11 . LEU A 1 246 ? -22.185 -4.038  13.800  1.00 29.86  ? 246 LEU A HD11 1 
ATOM   4121 H  HD12 . LEU A 1 246 ? -21.594 -3.060  14.903  1.00 29.86  ? 246 LEU A HD12 1 
ATOM   4122 H  HD13 . LEU A 1 246 ? -21.095 -2.954  13.399  1.00 29.86  ? 246 LEU A HD13 1 
ATOM   4123 H  HD21 . LEU A 1 246 ? -19.568 -4.838  12.499  1.00 30.31  ? 246 LEU A HD21 1 
ATOM   4124 H  HD22 . LEU A 1 246 ? -19.377 -6.113  13.426  1.00 30.31  ? 246 LEU A HD22 1 
ATOM   4125 H  HD23 . LEU A 1 246 ? -20.809 -5.774  12.829  1.00 30.31  ? 246 LEU A HD23 1 
ATOM   4126 N  N    . ILE A 1 247 ? -16.385 -3.345  16.794  1.00 26.38  ? 247 ILE A N    1 
ATOM   4127 C  CA   . ILE A 1 247 ? -15.223 -2.520  17.096  1.00 29.04  ? 247 ILE A CA   1 
ATOM   4128 C  C    . ILE A 1 247 ? -13.959 -3.325  17.336  1.00 33.67  ? 247 ILE A C    1 
ATOM   4129 O  O    . ILE A 1 247 ? -12.865 -2.747  17.324  1.00 33.85  ? 247 ILE A O    1 
ATOM   4130 C  CB   . ILE A 1 247 ? -15.487 -1.534  18.254  1.00 29.35  ? 247 ILE A CB   1 
ATOM   4131 C  CG1  . ILE A 1 247 ? -15.744 -2.261  19.570  1.00 29.60  ? 247 ILE A CG1  1 
ATOM   4132 C  CG2  . ILE A 1 247 ? -16.638 -0.620  17.924  1.00 29.45  ? 247 ILE A CG2  1 
ATOM   4133 C  CD1  . ILE A 1 247 ? -15.940 -1.308  20.742  0.47 29.46  ? 247 ILE A CD1  1 
ATOM   4134 H  H    . ILE A 1 247 ? -16.868 -3.544  17.476  1.00 31.66  ? 247 ILE A H    1 
ATOM   4135 H  HA   . ILE A 1 247 ? -15.054 -1.973  16.313  1.00 34.85  ? 247 ILE A HA   1 
ATOM   4136 H  HB   . ILE A 1 247 ? -14.684 -1.001  18.364  1.00 35.23  ? 247 ILE A HB   1 
ATOM   4137 H  HG12 . ILE A 1 247 ? -16.547 -2.799  19.482  1.00 35.53  ? 247 ILE A HG12 1 
ATOM   4138 H  HG13 . ILE A 1 247 ? -14.984 -2.830  19.769  1.00 35.53  ? 247 ILE A HG13 1 
ATOM   4139 H  HG21 . ILE A 1 247 ? -16.761 0.008   18.653  1.00 35.35  ? 247 ILE A HG21 1 
ATOM   4140 H  HG22 . ILE A 1 247 ? -16.436 -0.141  17.105  1.00 35.35  ? 247 ILE A HG22 1 
ATOM   4141 H  HG23 . ILE A 1 247 ? -17.440 -1.152  17.807  1.00 35.35  ? 247 ILE A HG23 1 
ATOM   4142 H  HD11 . ILE A 1 247 ? -16.075 -1.826  21.551  0.18 35.36  ? 247 ILE A HD11 1 
ATOM   4143 H  HD12 . ILE A 1 247 ? -15.150 -0.752  20.833  0.67 35.36  ? 247 ILE A HD12 1 
ATOM   4144 H  HD13 . ILE A 1 247 ? -16.717 -0.754  20.571  0.83 35.36  ? 247 ILE A HD13 1 
ATOM   4145 N  N    . GLU A 1 248 ? -14.064 -4.624  17.521  1.00 38.49  ? 248 GLU A N    1 
ATOM   4146 C  CA   . GLU A 1 248 ? -12.876 -5.466  17.806  1.00 50.23  ? 248 GLU A CA   1 
ATOM   4147 C  C    . GLU A 1 248 ? -12.020 -5.526  16.531  1.00 54.83  ? 248 GLU A C    1 
ATOM   4148 O  O    . GLU A 1 248 ? -10.902 -4.997  16.574  1.00 57.61  ? 248 GLU A O    1 
ATOM   4149 C  CB   . GLU A 1 248 ? -13.329 -6.823  18.338  1.00 56.49  ? 248 GLU A CB   1 
ATOM   4150 C  CG   . GLU A 1 248 ? -13.419 -7.909  17.286  1.00 64.88  ? 248 GLU A CG   1 
ATOM   4151 C  CD   . GLU A 1 248 ? -14.107 -9.180  17.751  1.00 71.93  ? 248 GLU A CD   1 
ATOM   4152 O  OE1  . GLU A 1 248 ? -14.416 -9.282  18.953  1.00 74.27  ? 248 GLU A OE1  1 
ATOM   4153 O  OE2  . GLU A 1 248 ? -14.321 -10.069 16.909  1.00 75.05  ? 248 GLU A OE2  1 
ATOM   4154 H  H    . GLU A 1 248 ? -14.854 -5.083  17.492  1.00 46.19  ? 248 GLU A H    1 
ATOM   4155 H  HA   . GLU A 1 248 ? -12.350 -5.021  18.509  1.00 60.29  ? 248 GLU A HA   1 
ATOM   4156 H  HB2  . GLU A 1 248 ? -12.703 -7.108  19.035  1.00 67.80  ? 248 GLU A HB2  1 
ATOM   4157 H  HB3  . GLU A 1 248 ? -14.210 -6.709  18.752  1.00 67.80  ? 248 GLU A HB3  1 
ATOM   4158 H  HG2  . GLU A 1 248 ? -13.902 -7.563  16.508  1.00 77.87  ? 248 GLU A HG2  1 
ATOM   4159 H  HG3  . GLU A 1 248 ? -12.514 -8.144  16.992  1.00 77.87  ? 248 GLU A HG3  1 
HETATM 4160 S  S    . SO4 B 2 .   ? -28.883 1.215   8.575   1.00 21.20  ? 301 SO4 A S    1 
HETATM 4161 O  O1   . SO4 B 2 .   ? -28.736 2.601   8.107   1.00 28.53  ? 301 SO4 A O1   1 
HETATM 4162 O  O2   . SO4 B 2 .   ? -29.008 0.360   7.398   1.00 24.47  ? 301 SO4 A O2   1 
HETATM 4163 O  O3   . SO4 B 2 .   ? -30.088 1.129   9.382   1.00 21.30  ? 301 SO4 A O3   1 
HETATM 4164 O  O4   . SO4 B 2 .   ? -27.680 0.825   9.318   1.00 23.44  ? 301 SO4 A O4   1 
HETATM 4165 S  S    . SO4 C 2 .   ? -36.289 -2.303  25.974  1.00 40.87  ? 302 SO4 A S    1 
HETATM 4166 O  O1   . SO4 C 2 .   ? -35.466 -3.278  25.275  1.00 42.47  ? 302 SO4 A O1   1 
HETATM 4167 O  O2   . SO4 C 2 .   ? -37.444 -1.930  25.129  1.00 40.99  ? 302 SO4 A O2   1 
HETATM 4168 O  O3   . SO4 C 2 .   ? -36.718 -2.828  27.277  1.00 40.80  ? 302 SO4 A O3   1 
HETATM 4169 O  O4   . SO4 C 2 .   ? -35.551 -1.051  26.199  1.00 43.31  ? 302 SO4 A O4   1 
HETATM 4170 S  S    . SO4 D 2 .   ? -2.537  16.042  16.062  1.00 73.12  ? 303 SO4 A S    1 
HETATM 4171 O  O1   . SO4 D 2 .   ? -1.758  17.078  15.400  1.00 73.36  ? 303 SO4 A O1   1 
HETATM 4172 O  O2   . SO4 D 2 .   ? -2.077  14.730  15.618  1.00 73.94  ? 303 SO4 A O2   1 
HETATM 4173 O  O3   . SO4 D 2 .   ? -3.941  16.201  15.693  1.00 73.26  ? 303 SO4 A O3   1 
HETATM 4174 O  O4   . SO4 D 2 .   ? -2.418  16.138  17.507  1.00 73.54  ? 303 SO4 A O4   1 
HETATM 4175 S  S    . SO4 E 2 .   ? -7.070  7.515   7.717   1.00 113.06 ? 304 SO4 A S    1 
HETATM 4176 O  O1   . SO4 E 2 .   ? -5.740  7.908   7.255   1.00 113.32 ? 304 SO4 A O1   1 
HETATM 4177 O  O2   . SO4 E 2 .   ? -7.412  6.212   7.157   1.00 113.11 ? 304 SO4 A O2   1 
HETATM 4178 O  O3   . SO4 E 2 .   ? -7.063  7.436   9.175   1.00 113.02 ? 304 SO4 A O3   1 
HETATM 4179 O  O4   . SO4 E 2 .   ? -8.043  8.507   7.272   1.00 112.93 ? 304 SO4 A O4   1 
HETATM 4180 ZN ZN   . ZN  F 3 .   ? -27.898 9.528   6.575   0.70 21.66  ? 305 ZN  A ZN   1 
HETATM 4181 O  O    . HOH G 4 .   ? -12.154 18.784  19.245  1.00 55.92  ? 401 HOH A O    1 
HETATM 4182 O  O    . HOH G 4 .   ? -24.310 9.329   6.086   1.00 51.03  ? 402 HOH A O    1 
HETATM 4183 O  O    . HOH G 4 .   ? -25.185 31.122  1.639   1.00 51.44  ? 403 HOH A O    1 
HETATM 4184 O  O    . HOH G 4 .   ? -6.273  10.933  20.236  0.50 30.00  ? 404 HOH A O    1 
HETATM 4185 O  O    . HOH G 4 .   ? -26.785 18.177  30.036  1.00 67.02  ? 405 HOH A O    1 
HETATM 4186 O  O    . HOH G 4 .   ? -27.886 4.444   9.200   1.00 63.75  ? 406 HOH A O    1 
HETATM 4187 O  O    . HOH G 4 .   ? -37.916 11.519  -4.843  1.00 48.23  ? 407 HOH A O    1 
HETATM 4188 O  O    . HOH G 4 .   ? -21.566 -2.446  28.469  1.00 70.78  ? 408 HOH A O    1 
HETATM 4189 O  O    . HOH G 4 .   ? -43.383 3.451   18.646  1.00 51.71  ? 409 HOH A O    1 
HETATM 4190 O  O    . HOH G 4 .   ? -20.498 -3.843  -11.492 1.00 59.53  ? 410 HOH A O    1 
HETATM 4191 O  O    . HOH G 4 .   ? -9.625  10.686  21.877  1.00 60.88  ? 411 HOH A O    1 
HETATM 4192 O  O    . HOH G 4 .   ? -28.003 27.802  26.430  1.00 62.70  ? 412 HOH A O    1 
HETATM 4193 O  O    . HOH G 4 .   ? -19.329 -0.379  0.053   1.00 44.65  ? 413 HOH A O    1 
HETATM 4194 O  O    . HOH G 4 .   ? -43.498 15.612  11.264  1.00 31.87  ? 414 HOH A O    1 
HETATM 4195 O  O    . HOH G 4 .   ? -39.816 6.731   -3.746  1.00 68.00  ? 415 HOH A O    1 
HETATM 4196 O  O    . HOH G 4 .   ? -38.981 7.243   26.055  1.00 58.60  ? 416 HOH A O    1 
HETATM 4197 O  O    . HOH G 4 .   ? -47.446 20.649  10.973  1.00 57.90  ? 417 HOH A O    1 
HETATM 4198 O  O    . HOH G 4 .   ? -10.794 19.365  5.426   1.00 75.70  ? 418 HOH A O    1 
HETATM 4199 O  O    . HOH G 4 .   ? -29.576 7.179   9.120   1.00 50.31  ? 419 HOH A O    1 
HETATM 4200 O  O    . HOH G 4 .   ? -34.902 29.945  27.698  1.00 64.75  ? 420 HOH A O    1 
HETATM 4201 O  O    . HOH G 4 .   ? -13.799 20.565  9.802   1.00 59.05  ? 421 HOH A O    1 
HETATM 4202 O  O    . HOH G 4 .   ? -26.301 22.505  -8.732  1.00 61.36  ? 422 HOH A O    1 
HETATM 4203 O  O    . HOH G 4 .   ? -29.102 9.388   -8.673  1.00 51.66  ? 423 HOH A O    1 
HETATM 4204 O  O    . HOH G 4 .   ? -34.724 4.917   4.666   1.00 55.26  ? 424 HOH A O    1 
HETATM 4205 O  O    . HOH G 4 .   ? -29.481 9.158   -6.154  1.00 54.95  ? 425 HOH A O    1 
HETATM 4206 O  O    . HOH G 4 .   ? -31.642 4.983   5.433   1.00 64.62  ? 426 HOH A O    1 
HETATM 4207 O  O    . HOH G 4 .   ? -33.346 -1.139  7.102   1.00 43.93  ? 427 HOH A O    1 
HETATM 4208 O  O    . HOH G 4 .   ? -19.153 -9.230  12.307  1.00 35.60  ? 428 HOH A O    1 
HETATM 4209 O  O    . HOH G 4 .   ? -16.861 -3.418  28.005  1.00 58.06  ? 429 HOH A O    1 
HETATM 4210 O  O    . HOH G 4 .   ? -28.843 10.356  2.974   1.00 25.54  ? 430 HOH A O    1 
HETATM 4211 O  O    . HOH G 4 .   ? -29.073 32.347  6.647   1.00 53.67  ? 431 HOH A O    1 
HETATM 4212 O  O    . HOH G 4 .   ? -32.627 27.653  -4.985  1.00 66.68  ? 432 HOH A O    1 
HETATM 4213 O  O    . HOH G 4 .   ? -27.732 15.996  -6.532  1.00 37.91  ? 433 HOH A O    1 
HETATM 4214 O  O    . HOH G 4 .   ? -35.367 8.181   16.857  1.00 24.73  ? 434 HOH A O    1 
HETATM 4215 O  O    . HOH G 4 .   ? -14.120 21.100  -1.490  1.00 51.97  ? 435 HOH A O    1 
HETATM 4216 O  O    . HOH G 4 .   ? -6.673  4.131   12.519  1.00 47.15  ? 436 HOH A O    1 
HETATM 4217 O  O    . HOH G 4 .   ? -41.197 14.377  10.279  1.00 27.87  ? 437 HOH A O    1 
HETATM 4218 O  O    . HOH G 4 .   ? -29.296 6.973   3.613   1.00 32.25  ? 438 HOH A O    1 
HETATM 4219 O  O    . HOH G 4 .   ? -11.065 -0.847  17.294  1.00 38.20  ? 439 HOH A O    1 
HETATM 4220 O  O    . HOH G 4 .   ? -39.720 -5.809  9.040   1.00 62.75  ? 440 HOH A O    1 
HETATM 4221 O  O    . HOH G 4 .   ? -35.610 -0.971  -3.232  1.00 55.00  ? 441 HOH A O    1 
HETATM 4222 O  O    . HOH G 4 .   ? -22.714 18.936  23.714  1.00 27.48  ? 442 HOH A O    1 
HETATM 4223 O  O    . HOH G 4 .   ? -10.521 4.312   13.504  1.00 22.65  ? 443 HOH A O    1 
HETATM 4224 O  O    . HOH G 4 .   ? -31.593 21.457  25.502  1.00 36.53  ? 444 HOH A O    1 
HETATM 4225 O  O    . HOH G 4 .   ? -33.318 31.660  10.872  1.00 50.63  ? 445 HOH A O    1 
HETATM 4226 O  O    . HOH G 4 .   ? -23.018 4.940   29.741  1.00 51.55  ? 446 HOH A O    1 
HETATM 4227 O  O    . HOH G 4 .   ? -31.458 3.716   -7.128  1.00 48.07  ? 447 HOH A O    1 
HETATM 4228 O  O    . HOH G 4 .   ? -33.740 25.636  2.637   1.00 46.80  ? 448 HOH A O    1 
HETATM 4229 O  O    . HOH G 4 .   ? -10.654 18.688  0.462   1.00 54.51  ? 449 HOH A O    1 
HETATM 4230 O  O    . HOH G 4 .   ? -22.822 32.927  8.324   1.00 39.88  ? 450 HOH A O    1 
HETATM 4231 O  O    . HOH G 4 .   ? -32.930 -0.544  1.711   1.00 47.58  ? 451 HOH A O    1 
HETATM 4232 O  O    . HOH G 4 .   ? -30.247 28.575  5.117   1.00 42.30  ? 452 HOH A O    1 
HETATM 4233 O  O    . HOH G 4 .   ? -7.807  9.837   10.028  1.00 32.07  ? 453 HOH A O    1 
HETATM 4234 O  O    . HOH G 4 .   ? -31.170 16.429  6.520   1.00 18.70  ? 454 HOH A O    1 
HETATM 4235 O  O    . HOH G 4 .   ? -20.730 -8.439  20.544  1.00 33.49  ? 455 HOH A O    1 
HETATM 4236 O  O    . HOH G 4 .   ? -20.059 20.211  26.168  1.00 49.79  ? 456 HOH A O    1 
HETATM 4237 O  O    . HOH G 4 .   ? -19.192 19.246  6.145   1.00 21.28  ? 457 HOH A O    1 
HETATM 4238 O  O    . HOH G 4 .   ? -38.712 23.647  12.815  1.00 21.88  ? 458 HOH A O    1 
HETATM 4239 O  O    . HOH G 4 .   ? -9.381  8.990   4.797   1.00 46.61  ? 459 HOH A O    1 
HETATM 4240 O  O    . HOH G 4 .   ? -22.046 26.452  -4.823  1.00 63.83  ? 460 HOH A O    1 
HETATM 4241 O  O    . HOH G 4 .   ? -34.859 2.800   5.436   1.00 33.89  ? 461 HOH A O    1 
HETATM 4242 O  O    . HOH G 4 .   ? -35.895 26.216  17.555  1.00 27.53  ? 462 HOH A O    1 
HETATM 4243 O  O    . HOH G 4 .   ? -36.513 18.407  11.924  1.00 26.54  ? 463 HOH A O    1 
HETATM 4244 O  O    . HOH G 4 .   ? -28.789 13.230  -7.138  1.00 53.07  ? 464 HOH A O    1 
HETATM 4245 O  O    . HOH G 4 .   ? -24.221 -10.729 19.865  1.00 22.85  ? 465 HOH A O    1 
HETATM 4246 O  O    . HOH G 4 .   ? -31.616 28.805  18.594  1.00 60.14  ? 466 HOH A O    1 
HETATM 4247 O  O    . HOH G 4 .   ? -33.995 -2.583  9.001   1.00 36.74  ? 467 HOH A O    1 
HETATM 4248 O  O    . HOH G 4 .   ? -10.053 9.711   0.477   1.00 49.22  ? 468 HOH A O    1 
HETATM 4249 O  O    . HOH G 4 .   ? -24.857 3.560   -3.830  1.00 25.03  ? 469 HOH A O    1 
HETATM 4250 O  O    . HOH G 4 .   ? -41.578 1.616   15.890  1.00 39.35  ? 470 HOH A O    1 
HETATM 4251 O  O    . HOH G 4 .   ? -25.177 0.914   8.258   1.00 19.09  ? 471 HOH A O    1 
HETATM 4252 O  O    . HOH G 4 .   ? -40.338 17.714  -2.988  1.00 64.44  ? 472 HOH A O    1 
HETATM 4253 O  O    . HOH G 4 .   ? -21.924 -5.537  6.673   1.00 27.37  ? 473 HOH A O    1 
HETATM 4254 O  O    . HOH G 4 .   ? -33.152 14.157  -5.761  1.00 35.94  ? 474 HOH A O    1 
HETATM 4255 O  O    . HOH G 4 .   ? -15.073 15.847  20.211  1.00 36.24  ? 475 HOH A O    1 
HETATM 4256 O  O    . HOH G 4 .   ? -45.496 21.917  3.806   1.00 53.27  ? 476 HOH A O    1 
HETATM 4257 O  O    . HOH G 4 .   ? -17.313 23.734  11.769  1.00 42.53  ? 477 HOH A O    1 
HETATM 4258 O  O    . HOH G 4 .   ? -10.483 0.115   12.622  1.00 45.76  ? 478 HOH A O    1 
HETATM 4259 O  O    . HOH G 4 .   ? -37.018 26.127  3.046   1.00 45.60  ? 479 HOH A O    1 
HETATM 4260 O  O    . HOH G 4 .   ? -26.637 20.590  25.760  1.00 50.84  ? 480 HOH A O    1 
HETATM 4261 O  O    . HOH G 4 .   ? -9.413  20.931  4.227   1.00 72.79  ? 481 HOH A O    1 
HETATM 4262 O  O    . HOH G 4 .   ? -9.246  15.395  16.029  1.00 47.29  ? 482 HOH A O    1 
HETATM 4263 O  O    . HOH G 4 .   ? -12.371 17.835  10.960  1.00 73.94  ? 483 HOH A O    1 
HETATM 4264 O  O    . HOH G 4 .   ? -13.834 20.210  0.960   1.00 30.65  ? 484 HOH A O    1 
HETATM 4265 O  O    . HOH G 4 .   ? -31.064 18.012  4.315   1.00 21.83  ? 485 HOH A O    1 
HETATM 4266 O  O    . HOH G 4 .   ? -38.018 24.100  26.868  1.00 25.20  ? 486 HOH A O    1 
HETATM 4267 O  O    . HOH G 4 .   ? -27.452 1.640   -8.269  1.00 70.38  ? 487 HOH A O    1 
HETATM 4268 O  O    . HOH G 4 .   ? -17.439 6.217   23.519  1.00 26.07  ? 488 HOH A O    1 
HETATM 4269 O  O    . HOH G 4 .   ? -16.587 21.825  23.464  1.00 51.68  ? 489 HOH A O    1 
HETATM 4270 O  O    . HOH G 4 .   ? -23.421 15.377  23.504  1.00 52.12  ? 490 HOH A O    1 
HETATM 4271 O  O    . HOH G 4 .   ? -39.134 16.134  9.652   1.00 22.47  ? 491 HOH A O    1 
HETATM 4272 O  O    . HOH G 4 .   ? -39.338 3.949   26.637  1.00 66.89  ? 492 HOH A O    1 
HETATM 4273 O  O    . HOH G 4 .   ? -44.395 18.091  10.250  1.00 40.87  ? 493 HOH A O    1 
HETATM 4274 O  O    . HOH G 4 .   ? -20.348 19.707  15.227  1.00 26.31  ? 494 HOH A O    1 
HETATM 4275 O  O    . HOH G 4 .   ? -42.283 18.067  -1.164  1.00 42.07  ? 495 HOH A O    1 
HETATM 4276 O  O    . HOH G 4 .   ? -10.106 11.949  6.541   1.00 50.33  ? 496 HOH A O    1 
HETATM 4277 O  O    . HOH G 4 .   ? -13.208 3.062   -2.364  1.00 30.31  ? 497 HOH A O    1 
HETATM 4278 O  O    . HOH G 4 .   ? -36.533 23.450  -6.310  1.00 52.70  ? 498 HOH A O    1 
HETATM 4279 O  O    . HOH G 4 .   ? -33.056 3.527   7.300   1.00 53.23  ? 499 HOH A O    1 
HETATM 4280 O  O    . HOH G 4 .   ? -30.252 -2.091  7.051   1.00 29.31  ? 500 HOH A O    1 
HETATM 4281 O  O    . HOH G 4 .   ? -15.923 20.482  14.331  1.00 56.12  ? 501 HOH A O    1 
HETATM 4282 O  O    . HOH G 4 .   ? -23.372 5.609   -2.624  1.00 28.07  ? 502 HOH A O    1 
HETATM 4283 O  O    . HOH G 4 .   ? -30.374 27.130  23.174  1.00 44.80  ? 503 HOH A O    1 
HETATM 4284 O  O    . HOH G 4 .   ? -9.272  15.002  7.810   1.00 52.07  ? 504 HOH A O    1 
HETATM 4285 O  O    . HOH G 4 .   ? -25.494 18.643  24.394  1.00 29.28  ? 505 HOH A O    1 
HETATM 4286 O  O    . HOH G 4 .   ? -44.784 8.801   14.626  1.00 66.50  ? 506 HOH A O    1 
HETATM 4287 O  O    . HOH G 4 .   ? -27.885 12.903  -1.013  1.00 18.45  ? 507 HOH A O    1 
HETATM 4288 O  O    . HOH G 4 .   ? -16.750 3.419   18.021  1.00 18.47  ? 508 HOH A O    1 
HETATM 4289 O  O    . HOH G 4 .   ? -21.519 -4.700  28.538  1.00 71.03  ? 509 HOH A O    1 
HETATM 4290 O  O    . HOH G 4 .   ? -18.199 26.474  13.075  1.00 47.36  ? 510 HOH A O    1 
HETATM 4291 O  O    . HOH G 4 .   ? -22.738 27.530  20.143  1.00 52.90  ? 511 HOH A O    1 
HETATM 4292 O  O    . HOH G 4 .   ? -31.631 29.337  0.868   1.00 58.23  ? 512 HOH A O    1 
HETATM 4293 O  O    . HOH G 4 .   ? -27.381 -1.889  9.883   1.00 19.67  ? 513 HOH A O    1 
HETATM 4294 O  O    . HOH G 4 .   ? -19.481 17.299  13.934  1.00 29.57  ? 514 HOH A O    1 
HETATM 4295 O  O    . HOH G 4 .   ? -33.178 7.973   -7.447  1.00 37.38  ? 515 HOH A O    1 
HETATM 4296 O  O    . HOH G 4 .   ? -22.363 1.401   4.139   1.00 35.27  ? 516 HOH A O    1 
HETATM 4297 O  O    . HOH G 4 .   ? -21.025 30.365  9.320   1.00 31.57  ? 517 HOH A O    1 
HETATM 4298 O  O    . HOH G 4 .   ? -13.680 17.661  8.766   1.00 42.51  ? 518 HOH A O    1 
HETATM 4299 O  O    . HOH G 4 .   ? -39.435 2.785   21.697  1.00 27.92  ? 519 HOH A O    1 
HETATM 4300 O  O    . HOH G 4 .   ? -28.944 11.782  -5.148  1.00 44.91  ? 520 HOH A O    1 
HETATM 4301 O  O    . HOH G 4 .   ? -17.009 19.552  -7.223  1.00 22.41  ? 521 HOH A O    1 
HETATM 4302 O  O    . HOH G 4 .   ? -29.339 6.920   -7.396  1.00 57.45  ? 522 HOH A O    1 
HETATM 4303 O  O    . HOH G 4 .   ? -28.245 18.791  -9.365  1.00 38.56  ? 523 HOH A O    1 
HETATM 4304 O  O    . HOH G 4 .   ? -11.030 4.625   -1.719  1.00 30.22  ? 524 HOH A O    1 
HETATM 4305 O  O    . HOH G 4 .   ? -29.948 8.377   -0.992  1.00 22.60  ? 525 HOH A O    1 
HETATM 4306 O  O    . HOH G 4 .   ? -30.586 15.997  9.943   1.00 22.09  ? 526 HOH A O    1 
HETATM 4307 O  O    . HOH G 4 .   ? -20.968 25.403  21.848  1.00 41.34  ? 527 HOH A O    1 
HETATM 4308 O  O    . HOH G 4 .   ? -14.980 -5.170  21.954  1.00 63.40  ? 528 HOH A O    1 
HETATM 4309 O  O    . HOH G 4 .   ? -17.438 24.290  17.512  1.00 65.61  ? 529 HOH A O    1 
HETATM 4310 O  O    . HOH G 4 .   ? -39.327 8.822   -2.631  1.00 43.05  ? 530 HOH A O    1 
HETATM 4311 O  O    . HOH G 4 .   ? -28.646 -7.382  14.310  1.00 25.35  ? 531 HOH A O    1 
HETATM 4312 O  O    . HOH G 4 .   ? -9.000  -2.197  7.981   1.00 45.02  ? 532 HOH A O    1 
HETATM 4313 O  O    . HOH G 4 .   ? -33.028 0.031   25.362  1.00 45.06  ? 533 HOH A O    1 
HETATM 4314 O  O    . HOH G 4 .   ? -44.553 5.084   8.176   1.00 51.64  ? 534 HOH A O    1 
HETATM 4315 O  O    . HOH G 4 .   ? -26.531 30.030  -0.700  1.00 39.22  ? 535 HOH A O    1 
HETATM 4316 O  O    . HOH G 4 .   ? -22.799 17.018  -11.711 1.00 38.51  ? 536 HOH A O    1 
HETATM 4317 O  O    . HOH G 4 .   ? -28.196 0.623   29.333  1.00 47.36  ? 537 HOH A O    1 
HETATM 4318 O  O    . HOH G 4 .   ? -41.593 -0.384  9.212   1.00 32.86  ? 538 HOH A O    1 
HETATM 4319 O  O    . HOH G 4 .   ? -6.869  16.169  0.990   1.00 50.89  ? 539 HOH A O    1 
HETATM 4320 O  O    . HOH G 4 .   ? -40.418 27.023  11.221  1.00 39.08  ? 540 HOH A O    1 
HETATM 4321 O  O    . HOH G 4 .   ? -45.753 24.541  11.930  1.00 46.62  ? 541 HOH A O    1 
HETATM 4322 O  O    . HOH G 4 .   ? -12.957 3.890   12.193  1.00 18.68  ? 542 HOH A O    1 
HETATM 4323 O  O    . HOH G 4 .   ? -37.120 6.594   15.970  1.00 30.97  ? 543 HOH A O    1 
HETATM 4324 O  O    . HOH G 4 .   ? -33.319 10.585  -5.843  1.00 70.67  ? 544 HOH A O    1 
HETATM 4325 O  O    . HOH G 4 .   ? -18.212 21.171  15.913  1.00 35.92  ? 545 HOH A O    1 
HETATM 4326 O  O    . HOH G 4 .   ? -24.934 -9.814  7.538   1.00 59.31  ? 546 HOH A O    1 
HETATM 4327 O  O    . HOH G 4 .   ? -36.571 6.823   27.669  1.00 49.11  ? 547 HOH A O    1 
HETATM 4328 O  O    . HOH G 4 .   ? -34.962 4.803   30.713  1.00 49.10  ? 548 HOH A O    1 
HETATM 4329 O  O    . HOH G 4 .   ? -42.958 9.663   16.674  1.00 54.06  ? 549 HOH A O    1 
HETATM 4330 O  O    . HOH G 4 .   ? -12.922 3.635   -7.780  1.00 40.90  ? 550 HOH A O    1 
HETATM 4331 O  O    . HOH G 4 .   ? -16.352 0.650   -6.974  1.00 33.18  ? 551 HOH A O    1 
HETATM 4332 O  O    . HOH G 4 .   ? -30.926 -3.204  -2.947  1.00 25.22  ? 552 HOH A O    1 
HETATM 4333 O  O    . HOH G 4 .   ? -15.662 25.860  10.656  1.00 59.48  ? 553 HOH A O    1 
HETATM 4334 O  O    . HOH G 4 .   ? -10.529 -2.999  1.065   1.00 40.41  ? 554 HOH A O    1 
HETATM 4335 O  O    . HOH G 4 .   ? -41.841 3.859   7.375   1.00 30.53  ? 555 HOH A O    1 
HETATM 4336 O  O    . HOH G 4 .   ? -26.697 30.983  6.139   1.00 27.99  ? 556 HOH A O    1 
HETATM 4337 O  O    . HOH G 4 .   ? -31.095 18.079  25.882  1.00 36.34  ? 557 HOH A O    1 
HETATM 4338 O  O    . HOH G 4 .   ? -6.659  5.101   23.060  1.00 39.82  ? 558 HOH A O    1 
HETATM 4339 O  O    . HOH G 4 .   ? -26.199 32.603  11.115  1.00 33.30  ? 559 HOH A O    1 
HETATM 4340 O  O    . HOH G 4 .   ? -36.366 28.428  15.819  1.00 31.60  ? 560 HOH A O    1 
HETATM 4341 O  O    . HOH G 4 .   ? -27.599 3.489   -3.873  1.00 22.14  ? 561 HOH A O    1 
HETATM 4342 O  O    . HOH G 4 .   ? -20.964 27.071  3.611   1.00 42.07  ? 562 HOH A O    1 
HETATM 4343 O  O    . HOH G 4 .   ? -25.037 15.968  24.980  1.00 50.19  ? 563 HOH A O    1 
HETATM 4344 O  O    . HOH G 4 .   ? -24.269 21.711  31.862  1.00 71.03  ? 564 HOH A O    1 
HETATM 4345 O  O    . HOH G 4 .   ? -29.229 26.322  -6.348  1.00 33.96  ? 565 HOH A O    1 
HETATM 4346 O  O    . HOH G 4 .   ? -5.782  3.191   21.585  1.00 46.54  ? 566 HOH A O    1 
HETATM 4347 O  O    . HOH G 4 .   ? -45.919 11.844  -2.390  1.00 61.14  ? 567 HOH A O    1 
HETATM 4348 O  O    . HOH G 4 .   ? -6.695  13.688  -1.481  1.00 49.21  ? 568 HOH A O    1 
HETATM 4349 O  O    . HOH G 4 .   ? -42.362 19.236  15.405  1.00 46.32  ? 569 HOH A O    1 
HETATM 4350 O  O    . HOH G 4 .   ? -26.537 29.081  23.394  1.00 56.38  ? 570 HOH A O    1 
HETATM 4351 O  O    . HOH G 4 .   ? -42.208 6.254   -2.494  1.00 32.55  ? 571 HOH A O    1 
HETATM 4352 O  O    . HOH G 4 .   ? -29.364 5.104   6.411   1.00 57.00  ? 572 HOH A O    1 
HETATM 4353 O  O    . HOH G 4 .   ? -42.346 -3.530  8.998   1.00 60.85  ? 573 HOH A O    1 
HETATM 4354 O  O    . HOH G 4 .   ? -17.536 20.914  -9.567  1.00 33.32  ? 574 HOH A O    1 
HETATM 4355 O  O    . HOH G 4 .   ? -40.006 -4.198  19.451  1.00 27.72  ? 575 HOH A O    1 
HETATM 4356 O  O    . HOH G 4 .   ? -43.442 26.068  9.530   1.00 57.11  ? 576 HOH A O    1 
HETATM 4357 O  O    . HOH G 4 .   ? -25.086 11.406  -10.511 1.00 28.29  ? 577 HOH A O    1 
HETATM 4358 O  O    . HOH G 4 .   ? -14.719 20.835  12.336  1.00 44.77  ? 578 HOH A O    1 
HETATM 4359 O  O    . HOH G 4 .   ? -25.632 -0.578  29.889  1.00 68.08  ? 579 HOH A O    1 
HETATM 4360 O  O    . HOH G 4 .   ? -11.171 7.733   0.403   1.00 49.70  ? 580 HOH A O    1 
HETATM 4361 O  O    . HOH G 4 .   ? -38.786 9.577   23.803  1.00 56.38  ? 581 HOH A O    1 
HETATM 4362 O  O    . HOH G 4 .   ? -21.203 32.674  14.378  1.00 46.75  ? 582 HOH A O    1 
HETATM 4363 O  O    . HOH G 4 .   ? -28.445 -7.635  9.709   1.00 44.99  ? 583 HOH A O    1 
HETATM 4364 O  O    . HOH G 4 .   ? -34.935 28.508  6.046   1.00 31.41  ? 584 HOH A O    1 
HETATM 4365 O  O    . HOH G 4 .   ? -36.907 28.390  9.240   1.00 24.31  ? 585 HOH A O    1 
HETATM 4366 O  O    . HOH G 4 .   ? -15.002 19.430  20.358  1.00 47.74  ? 586 HOH A O    1 
HETATM 4367 O  O    . HOH G 4 .   ? -39.815 5.871   23.957  1.00 46.01  ? 587 HOH A O    1 
HETATM 4368 O  O    . HOH G 4 .   ? -29.407 20.335  -7.245  1.00 53.09  ? 588 HOH A O    1 
HETATM 4369 O  O    . HOH G 4 .   ? -22.951 7.997   -9.312  1.00 48.75  ? 589 HOH A O    1 
HETATM 4370 O  O    . HOH G 4 .   ? -29.262 -1.099  26.094  1.00 38.77  ? 590 HOH A O    1 
HETATM 4371 O  O    . HOH G 4 .   ? -44.706 15.278  -7.519  1.00 60.68  ? 591 HOH A O    1 
HETATM 4372 O  O    . HOH G 4 .   ? -48.724 12.962  7.531   1.00 60.77  ? 592 HOH A O    1 
HETATM 4373 O  O    . HOH G 4 .   ? -42.766 26.589  14.020  1.00 37.75  ? 593 HOH A O    1 
HETATM 4374 O  O    . HOH G 4 .   ? -21.377 -10.098 22.929  1.00 41.14  ? 594 HOH A O    1 
HETATM 4375 O  O    . HOH G 4 .   ? -42.612 20.707  17.921  1.00 24.15  ? 595 HOH A O    1 
HETATM 4376 O  O    . HOH G 4 .   ? -9.001  2.204   12.770  1.00 30.75  ? 596 HOH A O    1 
HETATM 4377 O  O    . HOH G 4 .   ? -17.212 12.734  24.049  1.00 29.91  ? 597 HOH A O    1 
HETATM 4378 O  O    . HOH G 4 .   ? -31.309 -1.142  24.601  1.00 49.81  ? 598 HOH A O    1 
HETATM 4379 O  O    . HOH G 4 .   ? -39.493 23.959  -3.947  1.00 63.20  ? 599 HOH A O    1 
HETATM 4380 O  O    . HOH G 4 .   ? -29.628 -10.053 11.770  1.00 53.39  ? 600 HOH A O    1 
HETATM 4381 O  O    . HOH G 4 .   ? -17.529 -10.273 9.428   1.00 42.87  ? 601 HOH A O    1 
HETATM 4382 O  O    . HOH G 4 .   ? -35.319 28.772  22.322  1.00 30.72  ? 602 HOH A O    1 
HETATM 4383 O  O    . HOH G 4 .   ? -31.642 6.292   8.290   1.00 47.24  ? 603 HOH A O    1 
HETATM 4384 O  O    . HOH G 4 .   ? -42.384 1.197   7.404   1.00 45.85  ? 604 HOH A O    1 
HETATM 4385 O  O    . HOH G 4 .   ? -27.012 6.115   -6.809  1.00 51.43  ? 605 HOH A O    1 
HETATM 4386 O  O    . HOH G 4 .   ? -33.318 0.764   8.445   1.00 46.82  ? 606 HOH A O    1 
HETATM 4387 O  O    . HOH G 4 .   ? -25.140 34.246  4.662   1.00 44.09  ? 607 HOH A O    1 
HETATM 4388 O  O    . HOH G 4 .   ? -41.570 1.795   1.814   1.00 76.34  ? 608 HOH A O    1 
HETATM 4389 O  O    . HOH G 4 .   ? -21.179 19.347  -11.859 1.00 32.28  ? 609 HOH A O    1 
HETATM 4390 O  O    . HOH G 4 .   ? -28.915 -3.959  8.788   1.00 25.59  ? 610 HOH A O    1 
HETATM 4391 O  O    . HOH G 4 .   ? -27.422 -7.807  11.902  1.00 40.04  ? 611 HOH A O    1 
HETATM 4392 O  O    . HOH G 4 .   ? -29.052 20.703  26.181  1.00 65.36  ? 612 HOH A O    1 
HETATM 4393 O  O    . HOH G 4 .   ? -23.864 18.076  -9.845  1.00 44.70  ? 613 HOH A O    1 
HETATM 4394 O  O    . HOH G 4 .   ? -7.992  11.622  7.837   1.00 48.09  ? 614 HOH A O    1 
HETATM 4395 O  O    . HOH G 4 .   ? -26.297 3.543   -7.090  1.00 52.41  ? 615 HOH A O    1 
HETATM 4396 O  O    . HOH G 4 .   ? -24.187 -6.918  26.219  1.00 34.27  ? 616 HOH A O    1 
HETATM 4397 O  O    . HOH G 4 .   ? -41.031 26.584  5.642   1.00 56.17  ? 617 HOH A O    1 
HETATM 4398 O  O    . HOH G 4 .   ? -33.471 31.538  15.835  1.00 56.30  ? 618 HOH A O    1 
HETATM 4399 O  O    . HOH G 4 .   ? -35.641 20.028  -8.248  1.00 52.84  ? 619 HOH A O    1 
HETATM 4400 O  O    . HOH G 4 .   ? -40.316 28.419  12.972  1.00 65.37  ? 620 HOH A O    1 
HETATM 4401 O  O    . HOH G 4 .   ? -32.598 29.547  22.542  1.00 60.49  ? 621 HOH A O    1 
HETATM 4402 O  O    . HOH G 4 .   ? -38.153 21.907  23.910  1.00 53.44  ? 622 HOH A O    1 
HETATM 4403 O  O    . HOH G 4 .   ? -22.604 1.005   -9.384  1.00 78.67  ? 623 HOH A O    1 
HETATM 4404 O  O    . HOH G 4 .   ? -34.054 29.634  18.596  1.00 65.77  ? 624 HOH A O    1 
HETATM 4405 O  O    . HOH G 4 .   ? -19.526 27.041  -4.705  1.00 53.94  ? 625 HOH A O    1 
HETATM 4406 O  O    . HOH G 4 .   ? -38.880 32.282  16.904  1.00 62.87  ? 626 HOH A O    1 
HETATM 4407 O  O    . HOH G 4 .   ? -18.124 -3.273  -3.308  1.00 50.82  ? 627 HOH A O    1 
HETATM 4408 O  O    . HOH G 4 .   ? -25.341 20.100  -9.980  1.00 48.29  ? 628 HOH A O    1 
HETATM 4409 O  O    . HOH G 4 .   ? -27.119 18.817  -12.920 1.00 37.93  ? 629 HOH A O    1 
HETATM 4410 O  O    . HOH G 4 .   ? -26.171 32.266  3.594   1.00 53.56  ? 630 HOH A O    1 
HETATM 4411 O  O    . HOH G 4 .   ? -8.974  -1.461  14.880  1.00 59.40  ? 631 HOH A O    1 
HETATM 4412 O  O    . HOH G 4 .   ? -38.411 29.428  14.382  1.00 51.92  ? 632 HOH A O    1 
HETATM 4413 O  O    . HOH G 4 .   ? -6.459  11.088  11.936  1.00 43.51  ? 633 HOH A O    1 
HETATM 4414 O  O    . HOH G 4 .   ? -39.687 3.167   23.900  1.00 66.75  ? 634 HOH A O    1 
HETATM 4415 O  O    . HOH G 4 .   ? -48.310 14.233  9.709   1.00 58.48  ? 635 HOH A O    1 
HETATM 4416 O  O    . HOH G 4 .   ? -37.564 -4.973  12.076  1.00 50.08  ? 636 HOH A O    1 
HETATM 4417 O  O    . HOH G 4 .   ? -28.882 2.837   -6.193  1.00 41.06  ? 637 HOH A O    1 
HETATM 4418 O  O    . HOH G 4 .   ? -14.468 2.795   22.317  1.00 60.08  ? 638 HOH A O    1 
HETATM 4419 O  O    . HOH G 4 .   ? -11.072 17.506  8.724   1.00 68.83  ? 639 HOH A O    1 
HETATM 4420 O  O    . HOH G 4 .   ? -13.388 -9.962  8.340   1.00 78.61  ? 640 HOH A O    1 
HETATM 4421 O  O    . HOH G 4 .   ? -39.386 14.465  -9.711  1.00 61.27  ? 641 HOH A O    1 
HETATM 4422 O  O    . HOH G 4 .   ? -27.966 -5.864  7.770   1.00 89.57  ? 642 HOH A O    1 
HETATM 4423 O  O    . HOH G 4 .   ? -35.973 30.166  11.638  1.00 61.59  ? 643 HOH A O    1 
HETATM 4424 O  O    . HOH G 4 .   ? -16.528 23.311  14.221  1.00 68.79  ? 644 HOH A O    1 
HETATM 4425 O  O    . HOH G 4 .   ? -4.775  8.384   11.778  1.00 52.71  ? 645 HOH A O    1 
HETATM 4426 O  O    . HOH G 4 .   ? -43.342 6.701   18.120  1.00 70.58  ? 646 HOH A O    1 
HETATM 4427 O  O    . HOH G 4 .   ? -42.183 14.387  -9.665  1.00 58.84  ? 647 HOH A O    1 
HETATM 4428 O  O    . HOH G 4 .   ? -14.088 1.715   -6.298  1.00 39.17  ? 648 HOH A O    1 
HETATM 4429 O  O    . HOH G 4 .   ? -14.513 4.607   23.734  1.00 59.02  ? 649 HOH A O    1 
HETATM 4430 O  O    . HOH G 4 .   ? -24.299 27.777  -3.595  1.00 44.23  ? 650 HOH A O    1 
HETATM 4431 O  O    . HOH G 4 .   ? -25.531 31.780  8.453   1.00 30.37  ? 651 HOH A O    1 
HETATM 4432 O  O    . HOH G 4 .   ? -45.806 14.018  11.075  1.00 41.73  ? 652 HOH A O    1 
HETATM 4433 O  O    . HOH G 4 .   ? -26.016 31.732  15.673  1.00 56.44  ? 653 HOH A O    1 
HETATM 4434 O  O    . HOH G 4 .   ? -19.085 28.704  6.630   1.00 52.77  ? 654 HOH A O    1 
HETATM 4435 O  O    . HOH G 4 .   ? -45.906 7.979   -0.635  1.00 57.08  ? 655 HOH A O    1 
HETATM 4436 O  O    . HOH G 4 .   ? -18.666 30.226  14.889  1.00 55.98  ? 656 HOH A O    1 
HETATM 4437 O  O    . HOH G 4 .   ? -36.276 30.078  18.300  1.00 59.11  ? 657 HOH A O    1 
HETATM 4438 O  O    . HOH G 4 .   ? -36.586 29.742  24.879  1.00 55.41  ? 658 HOH A O    1 
HETATM 4439 O  O    . HOH G 4 .   ? -26.873 -1.347  -10.952 1.00 52.60  ? 659 HOH A O    1 
HETATM 4440 O  O    . HOH G 4 .   ? -7.475  -2.980  14.119  1.00 61.53  ? 660 HOH A O    1 
HETATM 4441 O  O    . HOH G 4 .   ? -19.090 29.172  16.918  1.00 54.44  ? 661 HOH A O    1 
HETATM 4442 O  O    . HOH G 4 .   ? -5.984  13.927  11.214  1.00 57.84  ? 662 HOH A O    1 
HETATM 4443 O  O    . HOH G 4 .   ? -29.871 23.938  -8.127  1.00 44.08  ? 663 HOH A O    1 
HETATM 4444 O  O    . HOH G 4 .   ? -21.415 16.873  25.843  1.00 61.70  ? 664 HOH A O    1 
HETATM 4445 O  O    . HOH G 4 .   ? -16.322 21.790  18.260  1.00 61.45  ? 665 HOH A O    1 
HETATM 4446 O  O    . HOH G 4 .   ? -20.560 2.567   -9.682  1.00 61.88  ? 666 HOH A O    1 
HETATM 4447 O  O    . HOH G 4 .   ? -3.478  4.341   21.477  1.00 60.47  ? 667 HOH A O    1 
HETATM 4448 O  O    . HOH G 4 .   ? -39.840 0.657   -2.645  1.00 58.90  ? 668 HOH A O    1 
HETATM 4449 O  O    . HOH G 4 .   ? -40.784 10.920  24.442  1.00 56.75  ? 669 HOH A O    1 
HETATM 4450 O  O    . HOH G 4 .   ? -28.254 31.901  15.121  1.00 51.29  ? 670 HOH A O    1 
HETATM 4451 O  O    . HOH G 4 .   ? -7.950  6.754   -1.046  1.00 61.91  ? 671 HOH A O    1 
HETATM 4452 O  O    . HOH G 4 .   ? -31.312 12.731  -6.948  1.00 58.52  ? 672 HOH A O    1 
HETATM 4453 O  O    . HOH G 4 .   ? -30.918 28.260  -6.549  1.00 77.00  ? 673 HOH A O    1 
HETATM 4454 O  O    . HOH G 4 .   ? -28.760 28.991  23.732  1.00 56.22  ? 674 HOH A O    1 
HETATM 4455 O  O    . HOH G 4 .   ? -40.420 28.351  8.387   1.00 64.08  ? 675 HOH A O    1 
HETATM 4456 O  O    . HOH G 4 .   ? -25.203 30.778  19.436  1.00 63.03  ? 676 HOH A O    1 
HETATM 4457 O  O    . HOH G 4 .   ? -40.877 22.242  -2.885  1.00 48.54  ? 677 HOH A O    1 
HETATM 4458 O  O    . HOH G 4 .   ? -15.277 14.601  22.705  1.00 39.39  ? 678 HOH A O    1 
HETATM 4459 O  O    . HOH G 4 .   ? -24.298 -4.925  28.443  1.00 47.01  ? 679 HOH A O    1 
HETATM 4460 O  O    . HOH G 4 .   ? -12.575 1.093   -4.236  1.00 35.15  ? 680 HOH A O    1 
HETATM 4461 O  O    . HOH G 4 .   ? -11.556 13.715  20.535  1.00 48.83  ? 681 HOH A O    1 
HETATM 4462 O  O    . HOH G 4 .   ? -6.218  5.469   2.814   1.00 61.33  ? 682 HOH A O    1 
HETATM 4463 O  O    . HOH G 4 .   ? -29.539 -9.734  15.080  1.00 48.81  ? 683 HOH A O    1 
HETATM 4464 O  O    . HOH G 4 .   ? -17.011 26.917  16.082  1.00 70.35  ? 684 HOH A O    1 
HETATM 4465 O  O    . HOH G 4 .   ? -41.113 6.970   28.241  1.00 73.48  ? 685 HOH A O    1 
HETATM 4466 O  O    . HOH G 4 .   ? -44.547 6.266   -3.867  1.00 69.04  ? 686 HOH A O    1 
HETATM 4467 O  O    . HOH G 4 .   ? -10.176 18.423  11.846  1.00 56.90  ? 687 HOH A O    1 
HETATM 4468 O  O    . HOH G 4 .   ? -32.139 21.414  -8.113  1.00 65.61  ? 688 HOH A O    1 
HETATM 4469 O  O    . HOH G 4 .   ? -21.802 -9.991  18.537  1.00 27.80  ? 689 HOH A O    1 
HETATM 4470 O  O    . HOH G 4 .   ? -28.988 10.588  0.184   1.00 25.96  ? 690 HOH A O    1 
HETATM 4471 O  O    . HOH G 4 .   ? -9.874  -1.613  10.867  1.00 30.00  ? 691 HOH A O    1 
HETATM 4472 O  O    . HOH G 4 .   ? -44.303 26.672  11.902  1.00 59.98  ? 692 HOH A O    1 
HETATM 4473 O  O    . HOH G 4 .   ? -9.315  4.114   -3.244  1.00 64.14  ? 693 HOH A O    1 
HETATM 4474 O  O    . HOH G 4 .   ? -23.465 28.795  -6.053  1.00 57.37  ? 694 HOH A O    1 
HETATM 4475 O  O    . HOH G 4 .   ? -25.381 20.436  -12.707 1.00 39.54  ? 695 HOH A O    1 
HETATM 4476 O  O    . HOH G 4 .   ? -7.672  14.758  -3.896  1.00 63.04  ? 696 HOH A O    1 
HETATM 4477 O  O    . HOH G 4 .   ? -26.570 30.039  -5.467  1.00 69.35  ? 697 HOH A O    1 
HETATM 4478 O  O    . HOH G 4 .   ? -43.496 8.979   19.625  1.00 63.29  ? 698 HOH A O    1 
HETATM 4479 O  O    . HOH G 4 .   ? -18.989 19.126  -13.774 1.00 48.05  ? 699 HOH A O    1 
HETATM 4480 O  O    . HOH G 4 .   ? -29.492 19.403  -12.141 1.00 49.39  ? 700 HOH A O    1 
HETATM 4481 O  O    . HOH G 4 .   ? -7.118  14.574  8.603   1.00 61.59  ? 701 HOH A O    1 
HETATM 4482 O  O    . HOH G 4 .   ? -45.440 7.616   17.664  1.00 29.69  ? 702 HOH A O    1 
HETATM 4483 O  O    . HOH G 4 .   ? -34.598 21.966  -8.360  1.00 71.80  ? 703 HOH A O    1 
HETATM 4484 O  O    . HOH G 4 .   ? -12.448 18.688  -3.006  1.00 49.53  ? 704 HOH A O    1 
HETATM 4485 O  O    . HOH G 4 .   ? -41.601 23.959  -1.529  1.00 82.05  ? 705 HOH A O    1 
HETATM 4486 O  O    . HOH G 4 .   ? -11.325 17.328  -5.458  1.00 55.72  ? 706 HOH A O    1 
HETATM 4487 O  O    . HOH G 4 .   ? -17.808 28.348  19.003  1.00 64.43  ? 707 HOH A O    1 
HETATM 4488 O  O    . HOH G 4 .   ? -8.504  17.563  -4.078  1.00 64.81  ? 708 HOH A O    1 
HETATM 4489 O  O    . HOH G 4 .   ? -20.227 -12.511 18.771  1.00 41.36  ? 709 HOH A O    1 
HETATM 4490 O  O    . HOH G 4 .   ? -41.137 8.134   31.331  1.00 71.39  ? 710 HOH A O    1 
HETATM 4491 O  O    . HOH G 4 .   ? -45.210 7.215   20.109  1.00 72.41  ? 711 HOH A O    1 
HETATM 4492 O  O    . HOH G 4 .   ? -12.270 -0.926  -7.948  1.00 55.31  ? 712 HOH A O    1 
HETATM 4493 O  O    . HOH G 4 .   ? -42.207 11.563  33.454  1.00 75.34  ? 713 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   . PRO A 2   ? 0.3928 0.3502 0.2832 0.0741  0.0635  0.0084  2   PRO A N   
2    C  CA  . PRO A 2   ? 0.3723 0.3256 0.2596 0.0494  0.0453  0.0177  2   PRO A CA  
3    C  C   . PRO A 2   ? 0.3923 0.3420 0.2545 0.0306  0.0133  0.0212  2   PRO A C   
4    O  O   . PRO A 2   ? 0.4391 0.3872 0.2709 0.0504  0.0007  0.0431  2   PRO A O   
5    C  CB  . PRO A 2   ? 0.3848 0.3758 0.2672 0.0794  0.0526  0.0059  2   PRO A CB  
6    C  CG  . PRO A 2   ? 0.4458 0.4212 0.2907 0.1281  0.0500  0.0134  2   PRO A CG  
7    C  CD  . PRO A 2   ? 0.4123 0.4026 0.2969 0.0941  0.0585  0.0041  2   PRO A CD  
15   N  N   . ARG A 3   ? 0.3867 0.3625 0.2208 0.0483  0.0029  0.0029  3   ARG A N   
16   C  CA  . ARG A 3   ? 0.3993 0.4058 0.1978 -0.0107 0.0107  -0.0224 3   ARG A CA  
17   C  C   . ARG A 3   ? 0.4177 0.5256 0.1953 -0.0077 0.0102  -0.0048 3   ARG A C   
18   O  O   . ARG A 3   ? 0.3828 0.5459 0.2040 -0.0411 0.0164  -0.0382 3   ARG A O   
19   C  CB  . ARG A 3   ? 0.4402 0.4097 0.2037 0.0246  0.0144  -0.0274 3   ARG A CB  
20   C  CG  . ARG A 3   ? 0.5163 0.4102 0.2242 0.0199  0.0060  -0.0363 3   ARG A CG  
21   C  CD  . ARG A 3   ? 0.5907 0.4599 0.2545 0.0441  0.0234  -0.0192 3   ARG A CD  
22   N  NE  . ARG A 3   ? 0.6585 0.5084 0.2873 0.0575  0.0384  -0.0055 3   ARG A NE  
23   C  CZ  . ARG A 3   ? 0.6822 0.5368 0.2918 0.0254  0.0830  0.0058  3   ARG A CZ  
24   N  NH1 . ARG A 3   ? 0.7143 0.5494 0.3316 0.0196  0.1075  0.0065  3   ARG A NH1 
25   N  NH2 . ARG A 3   ? 0.6740 0.5301 0.2625 0.0192  0.0906  0.0303  3   ARG A NH2 
39   N  N   . TYR A 4   ? 0.5054 0.6440 0.2053 0.0354  -0.0282 -0.0144 4   TYR A N   
40   C  CA  . TYR A 4   ? 0.5770 0.7509 0.2247 0.0626  -0.0344 -0.0242 4   TYR A CA  
41   C  C   . TYR A 4   ? 0.5306 0.7043 0.2287 -0.0361 0.0124  -0.0309 4   TYR A C   
42   O  O   . TYR A 4   ? 0.5629 0.7214 0.2673 -0.0282 0.0732  -0.0176 4   TYR A O   
43   C  CB  . TYR A 4   ? 0.6908 0.8692 0.2661 0.2116  -0.0708 -0.0459 4   TYR A CB  
44   C  CG  . TYR A 4   ? 0.7892 0.9861 0.3269 0.3276  -0.0896 -0.0488 4   TYR A CG  
45   C  CD1 . TYR A 4   ? 0.8305 1.0332 0.3529 0.3682  -0.1008 -0.0488 4   TYR A CD1 
46   C  CD2 . TYR A 4   ? 0.8422 1.0415 0.3531 0.3935  -0.0813 -0.0401 4   TYR A CD2 
47   C  CE1 . TYR A 4   ? 0.8796 1.0782 0.3729 0.4064  -0.0973 -0.0349 4   TYR A CE1 
48   C  CE2 . TYR A 4   ? 0.8880 1.0889 0.3820 0.4298  -0.0756 -0.0272 4   TYR A CE2 
49   C  CZ  . TYR A 4   ? 0.9114 1.1000 0.3947 0.4463  -0.0771 -0.0278 4   TYR A CZ  
50   O  OH  . TYR A 4   ? 0.9614 1.1274 0.4208 0.4687  -0.0636 -0.0277 4   TYR A OH  
60   N  N   . LEU A 5   ? 0.4668 0.7047 0.2235 -0.1202 -0.0059 -0.0309 5   LEU A N   
61   C  CA  . LEU A 5   ? 0.4355 0.7034 0.2204 -0.1765 -0.0005 -0.0341 5   LEU A CA  
62   C  C   . LEU A 5   ? 0.4506 0.7119 0.2412 -0.1625 -0.0012 -0.0332 5   LEU A C   
63   O  O   . LEU A 5   ? 0.4457 0.7598 0.2485 -0.1319 -0.0050 -0.0336 5   LEU A O   
64   C  CB  . LEU A 5   ? 0.4249 0.7157 0.2026 -0.1824 0.0186  -0.0152 5   LEU A CB  
65   C  CG  . LEU A 5   ? 0.4295 0.6767 0.2205 -0.2194 0.0495  -0.0009 5   LEU A CG  
66   C  CD1 . LEU A 5   ? 0.4739 0.7335 0.2146 -0.1742 0.0382  0.0159  5   LEU A CD1 
67   C  CD2 . LEU A 5   ? 0.4522 0.7241 0.2151 -0.1794 0.0467  -0.0001 5   LEU A CD2 
79   N  N   . LYS A 6   ? 0.5028 0.6521 0.2649 -0.1929 -0.0111 -0.0375 6   LYS A N   
80   C  CA  . LYS A 6   ? 0.5513 0.6691 0.2895 -0.1527 -0.0106 -0.0512 6   LYS A CA  
81   C  C   . LYS A 6   ? 0.4895 0.6423 0.2991 -0.1381 -0.0332 -0.0766 6   LYS A C   
82   O  O   . LYS A 6   ? 0.4814 0.6977 0.3097 -0.1565 -0.0430 -0.0771 6   LYS A O   
83   C  CB  . LYS A 6   ? 0.6704 0.7269 0.3075 -0.0616 0.0180  -0.0251 6   LYS A CB  
84   C  CG  . LYS A 6   ? 0.7839 0.7943 0.3281 0.0407  0.0422  0.0036  6   LYS A CG  
85   C  CD  . LYS A 6   ? 0.8913 0.8864 0.3434 0.1505  0.0692  0.0261  6   LYS A CD  
86   C  CE  . LYS A 6   ? 0.9604 0.9575 0.3565 0.2493  0.0834  0.0324  6   LYS A CE  
87   N  NZ  . LYS A 6   ? 1.0362 1.0112 0.3649 0.2944  0.0868  0.0305  6   LYS A NZ  
101  N  N   . GLY A 7   ? 0.4583 0.5905 0.2962 -0.1039 -0.0230 -0.0885 7   GLY A N   
102  C  CA  . GLY A 7   ? 0.4026 0.5245 0.3034 -0.0910 -0.0191 -0.0804 7   GLY A CA  
103  C  C   . GLY A 7   ? 0.3409 0.5126 0.3092 -0.0392 -0.0101 -0.0990 7   GLY A C   
104  O  O   . GLY A 7   ? 0.3556 0.5048 0.3148 -0.0199 -0.0077 -0.0942 7   GLY A O   
108  N  N   . TRP A 8   ? 0.2815 0.4911 0.2986 -0.0322 0.0036  -0.0945 8   TRP A N   
109  C  CA  . TRP A 8   ? 0.2906 0.4837 0.2947 -0.0084 0.0005  -0.1092 8   TRP A CA  
110  C  C   . TRP A 8   ? 0.2883 0.4586 0.2878 -0.0141 0.0025  -0.1184 8   TRP A C   
111  O  O   . TRP A 8   ? 0.3090 0.4435 0.2698 0.0080  0.0054  -0.1043 8   TRP A O   
112  C  CB  . TRP A 8   ? 0.2794 0.4683 0.2989 -0.0085 0.0116  -0.1054 8   TRP A CB  
113  C  CG  . TRP A 8   ? 0.2423 0.4015 0.2879 -0.0084 0.0229  -0.0991 8   TRP A CG  
114  C  CD1 . TRP A 8   ? 0.2693 0.3932 0.2881 0.0013  0.0243  -0.0974 8   TRP A CD1 
115  C  CD2 . TRP A 8   ? 0.2720 0.3251 0.2688 -0.0065 0.0167  -0.0731 8   TRP A CD2 
116  N  NE1 . TRP A 8   ? 0.2863 0.3679 0.2826 -0.0083 0.0071  -0.0940 8   TRP A NE1 
117  C  CE2 . TRP A 8   ? 0.2693 0.2923 0.2662 -0.0178 0.0159  -0.0758 8   TRP A CE2 
118  C  CE3 . TRP A 8   ? 0.2922 0.3246 0.2500 0.0060  0.0060  -0.0445 8   TRP A CE3 
119  C  CZ2 . TRP A 8   ? 0.3079 0.2580 0.2496 0.0155  0.0168  -0.0256 8   TRP A CZ2 
120  C  CZ3 . TRP A 8   ? 0.3026 0.3195 0.2486 0.0186  -0.0060 -0.0070 8   TRP A CZ3 
121  C  CH2 . TRP A 8   ? 0.3185 0.3051 0.2504 0.0257  0.0057  -0.0079 8   TRP A CH2 
132  N  N   . LEU A 9   ? 0.2860 0.4867 0.2867 -0.0199 0.0140  -0.1315 9   LEU A N   
133  C  CA  . LEU A 9   ? 0.2934 0.4894 0.2732 -0.0087 0.0255  -0.1223 9   LEU A CA  
134  C  C   . LEU A 9   ? 0.3299 0.4785 0.2611 -0.0092 0.0225  -0.1014 9   LEU A C   
135  O  O   . LEU A 9   ? 0.3370 0.4433 0.2654 0.0036  0.0233  -0.0836 9   LEU A O   
136  C  CB  . LEU A 9   ? 0.3180 0.4940 0.2739 0.0153  0.0313  -0.0678 9   LEU A CB  
137  C  CG  . LEU A 9   ? 0.3540 0.4480 0.2811 0.0978  0.0463  -0.0485 9   LEU A CG  
138  C  CD1 . LEU A 9   ? 0.3426 0.4073 0.3040 0.1079  0.0660  -0.0378 9   LEU A CD1 
139  C  CD2 . LEU A 9   ? 0.3516 0.4170 0.2749 0.0864  0.0328  -0.0573 9   LEU A CD2 
151  N  N   . GLU A 10  ? 0.3274 0.4566 0.2421 -0.0357 0.0221  -0.0832 10  GLU A N   
152  C  CA  . GLU A 10  ? 0.3808 0.4960 0.2355 -0.0065 0.0158  -0.0392 10  GLU A CA  
153  C  C   . GLU A 10  ? 0.3569 0.4299 0.2229 -0.0648 0.0194  -0.0249 10  GLU A C   
154  O  O   . GLU A 10  ? 0.3640 0.4982 0.2072 -0.0574 -0.0043 -0.0311 10  GLU A O   
155  C  CB  . GLU A 10  ? 0.4395 0.5533 0.2436 0.0172  -0.0113 -0.0243 10  GLU A CB  
156  C  CG  . GLU A 10  ? 0.5068 0.6286 0.2576 0.0755  -0.0451 -0.0149 10  GLU A CG  
157  C  CD  . GLU A 10  ? 0.5270 0.6499 0.2778 0.1028  -0.0600 -0.0050 10  GLU A CD  
158  O  OE1 . GLU A 10  ? 0.5819 0.6524 0.2830 0.1230  -0.0708 0.0148  10  GLU A OE1 
159  O  OE2 . GLU A 10  ? 0.5032 0.6789 0.2796 0.0992  -0.0527 0.0004  10  GLU A OE2 
166  N  N   . ASP A 11  ? 0.3628 0.3778 0.2263 -0.0238 0.0048  -0.0197 11  ASP A N   
167  C  CA  . ASP A 11  ? 0.3178 0.3771 0.2466 -0.0277 0.0048  -0.0158 11  ASP A CA  
168  C  C   . ASP A 11  ? 0.3113 0.3539 0.2390 -0.0195 0.0002  -0.0374 11  ASP A C   
169  O  O   . ASP A 11  ? 0.2791 0.3574 0.2149 0.0028  0.0083  -0.0248 11  ASP A O   
170  C  CB  . ASP A 11  ? 0.3032 0.4245 0.2727 -0.0226 0.0157  -0.0051 11  ASP A CB  
171  C  CG  . ASP A 11  ? 0.3024 0.5061 0.3023 -0.0070 0.0058  0.0141  11  ASP A CG  
172  O  OD1 . ASP A 11  ? 0.3366 0.5166 0.3307 0.0002  -0.0072 0.0091  11  ASP A OD1 
173  O  OD2 . ASP A 11  ? 0.2892 0.5450 0.2961 0.0065  0.0043  0.0393  11  ASP A OD2 
178  N  N   . VAL A 12  ? 0.2926 0.3463 0.2449 0.0117  0.0038  -0.0536 12  VAL A N   
179  C  CA  . VAL A 12  ? 0.2626 0.3625 0.2528 0.0181  -0.0025 -0.0648 12  VAL A CA  
180  C  C   . VAL A 12  ? 0.2584 0.3182 0.2537 -0.0133 -0.0003 -0.0533 12  VAL A C   
181  O  O   . VAL A 12  ? 0.2719 0.2952 0.2619 0.0137  -0.0031 -0.0684 12  VAL A O   
182  C  CB  . VAL A 12  ? 0.2990 0.4245 0.2610 0.0550  -0.0196 -0.0948 12  VAL A CB  
183  C  CG1 . VAL A 12  ? 0.3252 0.4485 0.2700 0.0491  -0.0183 -0.0819 12  VAL A CG1 
184  C  CG2 . VAL A 12  ? 0.3250 0.4714 0.2770 0.0769  -0.0427 -0.1015 12  VAL A CG2 
194  N  N   . VAL A 13  ? 0.2952 0.3369 0.2549 0.0008  0.0115  -0.0460 13  VAL A N   
195  C  CA  . VAL A 13  ? 0.3342 0.3666 0.2517 -0.0188 0.0075  -0.0437 13  VAL A CA  
196  C  C   . VAL A 13  ? 0.3140 0.3420 0.2476 -0.0249 -0.0130 -0.0185 13  VAL A C   
197  O  O   . VAL A 13  ? 0.3120 0.3535 0.2404 0.0340  0.0027  -0.0197 13  VAL A O   
198  C  CB  . VAL A 13  ? 0.3697 0.4112 0.2712 -0.0160 0.0295  -0.0402 13  VAL A CB  
199  C  CG1 . VAL A 13  ? 0.4035 0.4472 0.2843 -0.0068 0.0299  -0.0098 13  VAL A CG1 
200  C  CG2 . VAL A 13  ? 0.3630 0.4488 0.2730 -0.0110 0.0400  -0.0629 13  VAL A CG2 
210  N  N   . GLN A 14  ? 0.3067 0.3111 0.2434 -0.0042 -0.0280 0.0113  14  GLN A N   
211  C  CA  . GLN A 14  ? 0.3236 0.3372 0.2689 0.0577  -0.0306 0.0130  14  GLN A CA  
212  C  C   . GLN A 14  ? 0.2889 0.2946 0.2775 0.0426  -0.0143 -0.0118 14  GLN A C   
213  O  O   . GLN A 14  ? 0.3128 0.2875 0.2971 0.0643  -0.0184 -0.0219 14  GLN A O   
214  C  CB  . GLN A 14  ? 0.3568 0.3770 0.2879 0.1025  -0.0187 -0.0019 14  GLN A CB  
215  C  CG  . GLN A 14  ? 0.3353 0.3782 0.2764 0.0975  -0.0459 -0.0144 14  GLN A CG  
216  C  CD  . GLN A 14  ? 0.3200 0.3741 0.2693 0.0966  -0.0612 -0.0349 14  GLN A CD  
217  O  OE1 . GLN A 14  ? 0.3000 0.3597 0.2647 0.0652  -0.0892 -0.0448 14  GLN A OE1 
218  N  NE2 . GLN A 14  ? 0.3193 0.3490 0.2716 0.1060  -0.0413 -0.0410 14  GLN A NE2 
227  N  N   . LEU A 15  ? 0.3041 0.2974 0.2768 0.0090  -0.0006 -0.0012 15  LEU A N   
228  C  CA  . LEU A 15  ? 0.3399 0.3241 0.2729 0.0505  0.0169  -0.0076 15  LEU A CA  
229  C  C   . LEU A 15  ? 0.2938 0.2844 0.2484 0.0320  0.0222  -0.0181 15  LEU A C   
230  O  O   . LEU A 15  ? 0.2990 0.2973 0.2477 0.0405  0.0335  -0.0241 15  LEU A O   
231  C  CB  . LEU A 15  ? 0.3936 0.3470 0.3104 0.0107  0.0270  0.0116  15  LEU A CB  
232  C  CG  . LEU A 15  ? 0.4756 0.4162 0.3548 0.0920  0.0273  0.0467  15  LEU A CG  
233  C  CD1 . LEU A 15  ? 0.4918 0.3952 0.3774 0.0850  0.0176  0.0579  15  LEU A CD1 
234  C  CD2 . LEU A 15  ? 0.4550 0.4230 0.3601 0.0774  0.0487  0.0712  15  LEU A CD2 
246  N  N   . SER A 16  ? 0.3070 0.2779 0.2288 0.0539  0.0368  0.0090  16  SER A N   
247  C  CA  . SER A 16  ? 0.2752 0.2717 0.2171 0.0354  0.0145  0.0026  16  SER A CA  
248  C  C   . SER A 16  ? 0.2843 0.2690 0.2127 0.0386  -0.0074 -0.0156 16  SER A C   
249  O  O   . SER A 16  ? 0.3252 0.2774 0.2202 0.0296  -0.0100 -0.0257 16  SER A O   
250  C  CB  . SER A 16  ? 0.2847 0.2932 0.2201 0.0394  0.0166  0.0120  16  SER A CB  
251  O  OG  . SER A 16  ? 0.3524 0.3534 0.2293 0.0959  -0.0061 0.0110  16  SER A OG  
257  N  N   . LEU A 17  ? 0.3262 0.2771 0.2118 0.0603  -0.0072 -0.0210 17  LEU A N   
258  C  CA  . LEU A 17  ? 0.3484 0.2784 0.2271 0.0765  -0.0099 -0.0034 17  LEU A CA  
259  C  C   . LEU A 17  ? 0.3751 0.2913 0.2374 0.0832  -0.0012 -0.0067 17  LEU A C   
260  O  O   . LEU A 17  ? 0.4144 0.2830 0.2420 0.0862  -0.0056 -0.0116 17  LEU A O   
261  C  CB  . LEU A 17  ? 0.3603 0.3173 0.2326 0.0758  -0.0225 0.0016  17  LEU A CB  
262  C  CG  . LEU A 17  ? 0.3789 0.3636 0.2531 0.0620  -0.0068 0.0045  17  LEU A CG  
263  C  CD1 . LEU A 17  ? 0.4001 0.3775 0.2524 0.0650  -0.0091 0.0101  17  LEU A CD1 
264  C  CD2 . LEU A 17  ? 0.4114 0.3494 0.2730 0.0386  0.0198  0.0133  17  LEU A CD2 
276  N  N   . ARG A 18  ? 0.3637 0.3257 0.2605 0.0751  0.0210  0.0133  18  ARG A N   
277  C  CA  . ARG A 18  ? 0.3439 0.3391 0.2871 0.0414  0.0327  -0.0115 18  ARG A CA  
278  C  C   . ARG A 18  ? 0.3345 0.3249 0.2835 0.0475  0.0354  0.0032  18  ARG A C   
279  O  O   . ARG A 18  ? 0.3666 0.3386 0.2971 0.0760  0.0457  0.0157  18  ARG A O   
280  C  CB  . ARG A 18  ? 0.3506 0.4273 0.3336 -0.0023 0.0307  -0.0223 18  ARG A CB  
281  C  CG  . ARG A 18  ? 0.3963 0.5066 0.3755 0.0227  0.0325  -0.0301 18  ARG A CG  
282  C  CD  . ARG A 18  ? 0.4837 0.5980 0.4253 0.0693  0.0340  -0.0391 18  ARG A CD  
283  N  NE  . ARG A 18  ? 0.5466 0.6727 0.4615 0.0758  0.0267  -0.0409 18  ARG A NE  
284  C  CZ  . ARG A 18  ? 0.6034 0.7544 0.4839 0.1207  0.0393  -0.0424 18  ARG A CZ  
285  N  NH1 . ARG A 18  ? 0.6341 0.8001 0.4962 0.1310  0.0444  -0.0401 18  ARG A NH1 
286  N  NH2 . ARG A 18  ? 0.6225 0.7884 0.4907 0.1504  0.0426  -0.0449 18  ARG A NH2 
300  N  N   . ARG A 19  ? 0.3461 0.2817 0.2757 0.0166  0.0407  -0.0006 19  ARG A N   
301  C  CA  . ARG A 19  ? 0.3298 0.2864 0.2682 0.0337  0.0355  -0.0138 19  ARG A CA  
302  C  C   . ARG A 19  ? 0.3022 0.2511 0.2549 0.0363  0.0320  -0.0245 19  ARG A C   
303  O  O   . ARG A 19  ? 0.3356 0.2474 0.2386 0.0632  0.0508  -0.0049 19  ARG A O   
304  C  CB  . ARG A 19  ? 0.3475 0.3260 0.2687 0.0381  0.0326  -0.0332 19  ARG A CB  
305  C  CG  . ARG A 19  ? 0.3850 0.3051 0.2908 0.0448  0.0228  -0.0348 19  ARG A CG  
306  C  CD  . ARG A 19  ? 0.3635 0.3297 0.2995 0.0702  0.0304  -0.0154 19  ARG A CD  
307  N  NE  . ARG A 19  ? 0.3430 0.2941 0.3039 0.0600  0.0436  -0.0169 19  ARG A NE  
308  C  CZ  . ARG A 19  ? 0.3354 0.2684 0.2838 0.0646  0.0704  -0.0136 19  ARG A CZ  
309  N  NH1 . ARG A 19  ? 0.3706 0.2703 0.2709 0.0509  0.0909  -0.0041 19  ARG A NH1 
310  N  NH2 . ARG A 19  ? 0.3510 0.2469 0.2625 0.0184  0.0695  0.0216  19  ARG A NH2 
324  N  N   . PRO A 20  ? 0.3188 0.2490 0.2654 0.0163  0.0233  -0.0223 20  PRO A N   
325  C  CA  . PRO A 20  ? 0.2892 0.2559 0.2607 0.0262  0.0389  -0.0171 20  PRO A CA  
326  C  C   . PRO A 20  ? 0.2725 0.2213 0.2516 0.0471  0.0521  -0.0070 20  PRO A C   
327  O  O   . PRO A 20  ? 0.3205 0.2401 0.2917 0.0277  0.0393  0.0009  20  PRO A O   
328  C  CB  . PRO A 20  ? 0.2902 0.2984 0.2708 0.0085  0.0404  -0.0217 20  PRO A CB  
329  C  CG  . PRO A 20  ? 0.3209 0.3081 0.2907 0.0396  0.0385  -0.0127 20  PRO A CG  
330  C  CD  . PRO A 20  ? 0.3382 0.3081 0.2722 0.0139  0.0272  -0.0190 20  PRO A CD  
338  N  N   . SER A 21  ? 0.2596 0.2299 0.2309 0.0085  0.0640  -0.0131 21  SER A N   
339  C  CA  . SER A 21  ? 0.2585 0.2371 0.2308 0.0057  0.0737  -0.0105 21  SER A CA  
340  C  C   . SER A 21  ? 0.2381 0.2303 0.2162 -0.0023 0.0828  -0.0049 21  SER A C   
341  O  O   . SER A 21  ? 0.2507 0.2477 0.1986 0.0171  0.0648  -0.0180 21  SER A O   
342  C  CB  . SER A 21  ? 0.3080 0.2768 0.2514 0.0267  0.0824  -0.0155 21  SER A CB  
343  O  OG  . SER A 21  ? 0.3215 0.2700 0.2829 0.0274  0.0386  0.0036  21  SER A OG  
349  N  N   . VAL A 22  ? 0.2554 0.2328 0.2167 0.0119  0.0716  0.0083  22  VAL A N   
350  C  CA  . VAL A 22  ? 0.2423 0.2167 0.2148 -0.0217 0.0606  -0.0033 22  VAL A CA  
351  C  C   . VAL A 22  ? 0.2550 0.2367 0.2261 -0.0098 0.0564  -0.0137 22  VAL A C   
352  O  O   . VAL A 22  ? 0.2767 0.2397 0.2461 0.0271  0.0757  0.0028  22  VAL A O   
353  C  CB  . VAL A 22  ? 0.2684 0.2444 0.2220 -0.0036 0.0519  -0.0161 22  VAL A CB  
354  C  CG1 . VAL A 22  ? 0.3133 0.2616 0.2270 -0.0150 0.0235  -0.0481 22  VAL A CG1 
355  C  CG2 . VAL A 22  ? 0.2550 0.2458 0.2379 0.0152  0.0594  0.0122  22  VAL A CG2 
365  N  N   . ARG A 23  ? 0.2425 0.2249 0.2324 -0.0260 0.0547  -0.0204 23  ARG A N   
366  C  CA  . ARG A 23  ? 0.2705 0.2379 0.2406 -0.0349 0.0520  -0.0412 23  ARG A CA  
367  C  C   . ARG A 23  ? 0.2851 0.2329 0.2373 -0.0542 0.0585  -0.0283 23  ARG A C   
368  O  O   . ARG A 23  ? 0.2868 0.2788 0.2467 -0.0679 0.0290  0.0008  23  ARG A O   
369  C  CB  . ARG A 23  ? 0.2966 0.2538 0.2457 -0.0110 0.0655  -0.0289 23  ARG A CB  
370  C  CG  . ARG A 23  ? 0.2874 0.2556 0.2482 -0.0176 0.0675  -0.0103 23  ARG A CG  
371  C  CD  . ARG A 23  ? 0.3052 0.2642 0.2665 -0.0274 0.0652  -0.0099 23  ARG A CD  
372  N  NE  . ARG A 23  ? 0.3507 0.2535 0.2653 0.0214  0.0717  -0.0034 23  ARG A NE  
373  C  CZ  . ARG A 23  ? 0.3528 0.2319 0.2634 0.0341  0.0723  0.0227  23  ARG A CZ  
374  N  NH1 . ARG A 23  ? 0.3078 0.2057 0.2666 0.0231  0.0738  0.0046  23  ARG A NH1 
375  N  NH2 . ARG A 23  ? 0.4170 0.2945 0.2723 0.1105  0.0624  0.0327  23  ARG A NH2 
389  N  N   . ALA A 24  ? 0.2658 0.2912 0.2238 -0.0558 0.0501  -0.0183 24  ALA A N   
390  C  CA  . ALA A 24  ? 0.2940 0.3258 0.2507 -0.0483 0.0639  0.0179  24  ALA A CA  
391  C  C   . ALA A 24  ? 0.3058 0.4086 0.2536 -0.0697 0.0568  0.0195  24  ALA A C   
392  O  O   . ALA A 24  ? 0.3261 0.4197 0.2591 -0.0709 0.0564  0.0322  24  ALA A O   
393  C  CB  . ALA A 24  ? 0.3190 0.4000 0.2716 0.0144  0.0589  0.0189  24  ALA A CB  
399  N  N   . SER A 25  ? 0.2923 0.4965 0.2502 -0.0636 0.0424  0.0167  25  SER A N   
400  C  CA  A SER A 25  ? 0.3044 0.5352 0.2544 -0.0487 0.0289  -0.0027 25  SER A CA  
401  C  CA  B SER A 25  ? 0.2977 0.5451 0.2513 -0.0426 0.0485  0.0109  25  SER A CA  
402  C  C   . SER A 25  ? 0.2984 0.5585 0.2472 -0.0626 0.0420  0.0059  25  SER A C   
403  O  O   . SER A 25  ? 0.3366 0.5855 0.2727 -0.0133 0.0374  0.0100  25  SER A O   
404  C  CB  A SER A 25  ? 0.3224 0.5430 0.2785 -0.0132 -0.0089 -0.0552 25  SER A CB  
405  C  CB  B SER A 25  ? 0.3023 0.5824 0.2701 -0.0058 0.0464  -0.0230 25  SER A CB  
406  O  OG  A SER A 25  ? 0.3542 0.5763 0.2951 0.0315  -0.0359 -0.0825 25  SER A OG  
407  O  OG  B SER A 25  ? 0.3156 0.6426 0.2781 0.0347  0.0567  -0.0302 25  SER A OG  
416  N  N   . ARG A 26  ? 0.3539 0.6019 0.2445 -0.0074 0.0342  -0.0165 26  ARG A N   
417  C  CA  . ARG A 26  ? 0.4179 0.6296 0.2469 0.0395  0.0437  -0.0418 26  ARG A CA  
418  C  C   . ARG A 26  ? 0.4166 0.6310 0.2652 -0.0140 0.0345  -0.0604 26  ARG A C   
419  O  O   . ARG A 26  ? 0.4041 0.6193 0.2623 -0.0338 0.0247  -0.0454 26  ARG A O   
420  C  CB  . ARG A 26  ? 0.4848 0.6267 0.2552 0.1001  0.0389  -0.0503 26  ARG A CB  
421  C  CG  . ARG A 26  ? 0.4783 0.5955 0.2699 0.0935  0.0179  -0.0509 26  ARG A CG  
422  C  CD  . ARG A 26  ? 0.4475 0.4549 0.2549 0.0345  0.0251  -0.0690 26  ARG A CD  
423  N  NE  . ARG A 26  ? 0.4123 0.3394 0.2605 0.0200  -0.0102 -0.0635 26  ARG A NE  
424  C  CZ  . ARG A 26  ? 0.3748 0.2989 0.2538 -0.0088 0.0221  -0.0538 26  ARG A CZ  
425  N  NH1 . ARG A 26  ? 0.3866 0.2908 0.2593 -0.0213 0.0093  -0.0620 26  ARG A NH1 
426  N  NH2 . ARG A 26  ? 0.3048 0.3207 0.2665 -0.0448 0.0361  -0.0184 26  ARG A NH2 
440  N  N   . GLN A 27  ? 0.4425 0.6625 0.2711 -0.0324 0.0345  -0.0781 27  GLN A N   
441  C  CA  . GLN A 27  ? 0.5145 0.6895 0.2997 0.0033  0.0403  -0.0856 27  GLN A CA  
442  C  C   . GLN A 27  ? 0.5086 0.6809 0.3121 0.0187  0.0221  -0.1137 27  GLN A C   
443  O  O   . GLN A 27  ? 0.5103 0.6934 0.3501 0.0373  0.0244  -0.1270 27  GLN A O   
444  C  CB  . GLN A 27  ? 0.6283 0.7629 0.3236 0.0632  0.0418  -0.0815 27  GLN A CB  
445  C  CG  . GLN A 27  ? 0.7288 0.8287 0.3427 0.1377  0.0492  -0.0678 27  GLN A CG  
446  C  CD  . GLN A 27  ? 0.8359 0.8765 0.3610 0.1991  0.0366  -0.0569 27  GLN A CD  
447  O  OE1 . GLN A 27  ? 0.8776 0.8902 0.3671 0.2077  0.0289  -0.0429 27  GLN A OE1 
448  N  NE2 . GLN A 27  ? 0.8812 0.8977 0.3659 0.2087  0.0411  -0.0595 27  GLN A NE2 
457  N  N   . ARG A 28  ? 0.5145 0.6639 0.2797 0.0341  0.0499  -0.0820 28  ARG A N   
458  C  CA  . ARG A 28  ? 0.5195 0.6214 0.2892 0.0297  0.0461  -0.0714 28  ARG A CA  
459  C  C   . ARG A 28  ? 0.4508 0.5103 0.2734 -0.0125 0.0353  -0.0965 28  ARG A C   
460  O  O   . ARG A 28  ? 0.4056 0.5217 0.2843 -0.0266 0.0249  -0.1497 28  ARG A O   
461  C  CB  . ARG A 28  ? 0.6025 0.6739 0.3098 0.0474  0.0543  -0.0377 28  ARG A CB  
462  C  CG  . ARG A 28  ? 0.6657 0.7626 0.3350 0.0648  0.0486  -0.0253 28  ARG A CG  
463  C  CD  . ARG A 28  ? 0.7405 0.8487 0.3554 0.1180  0.0356  -0.0156 28  ARG A CD  
464  N  NE  . ARG A 28  ? 0.7983 0.8909 0.3745 0.1709  0.0243  -0.0155 28  ARG A NE  
465  C  CZ  . ARG A 28  ? 0.8373 0.9316 0.3855 0.2086  0.0071  -0.0130 28  ARG A CZ  
466  N  NH1 . ARG A 28  ? 0.8516 0.9450 0.3841 0.2160  0.0099  -0.0056 28  ARG A NH1 
467  N  NH2 . ARG A 28  ? 0.8453 0.9455 0.3960 0.2245  -0.0103 -0.0200 28  ARG A NH2 
481  N  N   . PRO A 29  ? 0.4368 0.4424 0.2608 -0.0273 0.0232  -0.0959 29  PRO A N   
482  C  CA  . PRO A 29  ? 0.4248 0.3854 0.2761 -0.0592 0.0202  -0.0701 29  PRO A CA  
483  C  C   . PRO A 29  ? 0.4130 0.3593 0.2641 -0.0743 0.0377  -0.0760 29  PRO A C   
484  O  O   . PRO A 29  ? 0.4461 0.3955 0.2664 -0.0528 0.0617  -0.0681 29  PRO A O   
485  C  CB  . PRO A 29  ? 0.4408 0.4059 0.2794 -0.0813 -0.0060 -0.0932 29  PRO A CB  
486  C  CG  . PRO A 29  ? 0.4475 0.4500 0.2779 -0.0439 -0.0007 -0.1005 29  PRO A CG  
487  C  CD  . PRO A 29  ? 0.4425 0.4473 0.2683 -0.0384 0.0261  -0.0835 29  PRO A CD  
495  N  N   . ILE A 30  ? 0.3924 0.3400 0.2513 -0.0710 0.0186  -0.0921 30  ILE A N   
496  C  CA  . ILE A 30  ? 0.3698 0.3212 0.2627 -0.0871 0.0365  -0.0802 30  ILE A CA  
497  C  C   . ILE A 30  ? 0.4048 0.3469 0.2761 -0.0663 0.0210  -0.0853 30  ILE A C   
498  O  O   . ILE A 30  ? 0.4202 0.3926 0.2996 -0.0464 0.0263  -0.0759 30  ILE A O   
499  C  CB  . ILE A 30  ? 0.3973 0.2999 0.2574 -0.0738 0.0483  -0.0649 30  ILE A CB  
500  C  CG1 . ILE A 30  ? 0.4503 0.3590 0.2584 0.0132  0.0642  -0.0055 30  ILE A CG1 
501  C  CG2 . ILE A 30  ? 0.4145 0.3356 0.2541 -0.0696 0.0523  -0.0734 30  ILE A CG2 
502  C  CD1 . ILE A 30  ? 0.4532 0.3892 0.2708 0.0394  0.0411  -0.0022 30  ILE A CD1 
514  N  N   . ILE A 31  ? 0.3901 0.3597 0.2582 0.0052  0.0138  -0.0919 31  ILE A N   
515  C  CA  . ILE A 31  ? 0.3790 0.4306 0.2520 0.0096  0.0062  -0.1028 31  ILE A CA  
516  C  C   . ILE A 31  ? 0.3574 0.4357 0.2459 0.0114  0.0006  -0.1138 31  ILE A C   
517  O  O   . ILE A 31  ? 0.3348 0.4972 0.2529 0.0163  0.0113  -0.1244 31  ILE A O   
518  C  CB  . ILE A 31  ? 0.4399 0.4987 0.2562 0.0618  0.0059  -0.1067 31  ILE A CB  
519  C  CG1 . ILE A 31  ? 0.4675 0.4957 0.2637 0.0735  -0.0198 -0.1222 31  ILE A CG1 
520  C  CG2 . ILE A 31  ? 0.4693 0.5176 0.2651 0.0767  -0.0045 -0.1094 31  ILE A CG2 
521  C  CD1 . ILE A 31  ? 0.4953 0.5377 0.2763 0.1034  -0.0418 -0.1209 31  ILE A CD1 
533  N  N   . SER A 32  ? 0.3393 0.3676 0.2280 -0.0295 -0.0106 -0.0993 32  SER A N   
534  C  CA  . SER A 32  ? 0.3412 0.3001 0.2171 -0.0312 -0.0041 -0.0806 32  SER A CA  
535  C  C   . SER A 32  ? 0.3356 0.2938 0.2085 -0.0252 0.0003  -0.0331 32  SER A C   
536  O  O   . SER A 32  ? 0.3860 0.3187 0.2223 -0.0209 -0.0053 -0.0259 32  SER A O   
537  C  CB  . SER A 32  ? 0.3918 0.2786 0.2259 -0.0114 0.0001  -0.0556 32  SER A CB  
538  O  OG  . SER A 32  ? 0.4168 0.2915 0.2378 -0.0206 -0.0028 -0.0409 32  SER A OG  
544  N  N   . LEU A 33  ? 0.2837 0.2642 0.2058 -0.0178 0.0047  -0.0196 33  LEU A N   
545  C  CA  . LEU A 33  ? 0.2611 0.2602 0.1998 -0.0243 0.0098  -0.0258 33  LEU A CA  
546  C  C   . LEU A 33  ? 0.2465 0.2534 0.2075 -0.0295 0.0028  -0.0196 33  LEU A C   
547  O  O   . LEU A 33  ? 0.2400 0.2414 0.2245 -0.0242 -0.0006 -0.0264 33  LEU A O   
548  C  CB  . LEU A 33  ? 0.2867 0.2108 0.2096 -0.0469 0.0454  -0.0235 33  LEU A CB  
549  C  CG  . LEU A 33  ? 0.2573 0.2326 0.2119 -0.0405 0.0615  -0.0288 33  LEU A CG  
550  C  CD1 . LEU A 33  ? 0.2745 0.2550 0.2090 -0.0171 0.0666  -0.0038 33  LEU A CD1 
551  C  CD2 . LEU A 33  ? 0.2450 0.2587 0.2278 -0.0193 0.0732  -0.0221 33  LEU A CD2 
563  N  N   . ASN A 34  ? 0.2609 0.2718 0.2098 -0.0330 0.0018  -0.0083 34  ASN A N   
564  C  CA  . ASN A 34  ? 0.2581 0.2867 0.2253 -0.0648 0.0032  -0.0067 34  ASN A CA  
565  C  C   . ASN A 34  ? 0.2737 0.2834 0.2410 -0.0756 -0.0140 -0.0256 34  ASN A C   
566  O  O   . ASN A 34  ? 0.2654 0.3006 0.2516 -0.0801 -0.0037 -0.0147 34  ASN A O   
567  C  CB  . ASN A 34  ? 0.2856 0.3091 0.2579 -0.0865 0.0067  -0.0099 34  ASN A CB  
568  C  CG  . ASN A 34  ? 0.3663 0.3134 0.2915 -0.0780 0.0374  -0.0016 34  ASN A CG  
569  O  OD1 . ASN A 34  ? 0.4363 0.3365 0.3087 0.0027  0.0417  0.0078  34  ASN A OD1 
570  N  ND2 . ASN A 34  ? 0.4269 0.3588 0.3175 -0.0267 0.0441  0.0286  34  ASN A ND2 
577  N  N   . GLU A 35  ? 0.2848 0.3029 0.2625 -0.0454 -0.0364 -0.0108 35  GLU A N   
578  C  CA  . GLU A 35  ? 0.3248 0.2992 0.2819 -0.0388 -0.0468 -0.0128 35  GLU A CA  
579  C  C   . GLU A 35  ? 0.2988 0.3094 0.2539 -0.0723 -0.0385 0.0039  35  GLU A C   
580  O  O   . GLU A 35  ? 0.3002 0.3298 0.2433 -0.0743 -0.0446 -0.0187 35  GLU A O   
581  C  CB  . GLU A 35  ? 0.3674 0.3120 0.3187 -0.0778 -0.0722 -0.0120 35  GLU A CB  
582  C  CG  . GLU A 35  ? 0.4254 0.3467 0.3583 -0.0533 -0.0670 -0.0060 35  GLU A CG  
583  C  CD  . GLU A 35  ? 0.4663 0.3902 0.3818 -0.0278 -0.0736 -0.0030 35  GLU A CD  
584  O  OE1 . GLU A 35  ? 0.4825 0.4069 0.3918 -0.0262 -0.0741 -0.0032 35  GLU A OE1 
585  O  OE2 . GLU A 35  ? 0.5013 0.4024 0.3977 -0.0053 -0.0743 0.0082  35  GLU A OE2 
592  N  N   . ARG A 36  ? 0.3033 0.2805 0.2339 -0.0500 -0.0346 -0.0236 36  ARG A N   
593  C  CA  . ARG A 36  ? 0.2776 0.2679 0.2235 -0.0415 -0.0271 -0.0052 36  ARG A CA  
594  C  C   . ARG A 36  ? 0.2628 0.2773 0.2160 -0.0166 -0.0212 -0.0167 36  ARG A C   
595  O  O   . ARG A 36  ? 0.2622 0.2804 0.2201 -0.0030 -0.0241 -0.0246 36  ARG A O   
596  C  CB  . ARG A 36  ? 0.2666 0.2576 0.2107 -0.0452 -0.0307 -0.0279 36  ARG A CB  
597  C  CG  . ARG A 36  ? 0.2916 0.3070 0.2023 -0.0200 -0.0208 0.0025  36  ARG A CG  
598  C  CD  . ARG A 36  ? 0.3025 0.3224 0.2045 0.0104  -0.0168 -0.0094 36  ARG A CD  
599  N  NE  . ARG A 36  ? 0.3157 0.3568 0.1951 -0.0051 -0.0123 -0.0028 36  ARG A NE  
600  C  CZ  . ARG A 36  ? 0.3396 0.3739 0.1952 0.0424  -0.0184 -0.0074 36  ARG A CZ  
601  N  NH1 . ARG A 36  ? 0.3336 0.3343 0.2084 -0.0049 -0.0074 0.0052  36  ARG A NH1 
602  N  NH2 . ARG A 36  ? 0.3502 0.3582 0.1796 0.0293  -0.0014 -0.0116 36  ARG A NH2 
616  N  N   . ILE A 37  ? 0.2318 0.2323 0.2141 -0.0263 -0.0042 -0.0099 37  ILE A N   
617  C  CA  . ILE A 37  ? 0.2180 0.2582 0.2004 -0.0554 -0.0118 -0.0210 37  ILE A CA  
618  C  C   . ILE A 37  ? 0.2329 0.2574 0.2122 -0.0568 -0.0114 -0.0247 37  ILE A C   
619  O  O   . ILE A 37  ? 0.2348 0.2756 0.2342 -0.0318 -0.0093 -0.0125 37  ILE A O   
620  C  CB  . ILE A 37  ? 0.2099 0.2788 0.1719 -0.0414 0.0154  -0.0040 37  ILE A CB  
621  C  CG1 . ILE A 37  ? 0.2006 0.2556 0.1751 -0.0349 -0.0045 -0.0147 37  ILE A CG1 
622  C  CG2 . ILE A 37  ? 0.1896 0.3192 0.1601 -0.0520 0.0076  -0.0125 37  ILE A CG2 
623  C  CD1 . ILE A 37  ? 0.2064 0.2621 0.1693 -0.0158 -0.0148 -0.0255 37  ILE A CD1 
635  N  N   . LEU A 38  ? 0.2402 0.2854 0.2246 -0.0588 -0.0126 -0.0067 38  LEU A N   
636  C  CA  . LEU A 38  ? 0.2440 0.3194 0.2427 -0.0718 -0.0099 0.0191  38  LEU A CA  
637  C  C   . LEU A 38  ? 0.2390 0.3408 0.2644 -0.0841 -0.0204 0.0352  38  LEU A C   
638  O  O   . LEU A 38  ? 0.2304 0.3778 0.2812 -0.0674 -0.0228 0.0231  38  LEU A O   
639  C  CB  . LEU A 38  ? 0.2548 0.3642 0.2523 -0.0802 -0.0204 0.0510  38  LEU A CB  
640  C  CG  . LEU A 38  ? 0.2979 0.4302 0.2685 -0.0193 -0.0198 0.0730  38  LEU A CG  
641  C  CD1 . LEU A 38  ? 0.3278 0.4384 0.2811 -0.0128 -0.0309 0.0901  38  LEU A CD1 
642  C  CD2 . LEU A 38  ? 0.2963 0.4632 0.2721 -0.0023 0.0128  0.0788  38  LEU A CD2 
654  N  N   . GLU A 39  ? 0.2402 0.3477 0.2646 -0.1040 -0.0354 0.0365  39  GLU A N   
655  C  CA  . GLU A 39  ? 0.2682 0.3637 0.2700 -0.1076 -0.0609 0.0046  39  GLU A CA  
656  C  C   . GLU A 39  ? 0.2310 0.3638 0.2622 -0.0598 -0.0400 0.0144  39  GLU A C   
657  O  O   . GLU A 39  ? 0.2259 0.3981 0.2595 -0.0342 -0.0334 0.0490  39  GLU A O   
658  C  CB  . GLU A 39  ? 0.3577 0.3984 0.2838 -0.0784 -0.0790 -0.0409 39  GLU A CB  
659  C  CG  . GLU A 39  ? 0.4209 0.4306 0.2933 -0.0295 -0.0679 -0.0640 39  GLU A CG  
660  C  CD  . GLU A 39  ? 0.4122 0.4542 0.3034 -0.0487 -0.0485 -0.0848 39  GLU A CD  
661  O  OE1 . GLU A 39  ? 0.4359 0.4750 0.3101 -0.0229 -0.0282 -0.1128 39  GLU A OE1 
662  O  OE2 . GLU A 39  ? 0.3977 0.4378 0.3119 -0.0861 -0.0443 -0.0900 39  GLU A OE2 
669  N  N   . PHE A 40  ? 0.2079 0.3561 0.2505 -0.0614 -0.0233 0.0167  40  PHE A N   
670  C  CA  . PHE A 40  ? 0.2139 0.3443 0.2537 -0.0440 -0.0017 0.0204  40  PHE A CA  
671  C  C   . PHE A 40  ? 0.2134 0.3314 0.2660 -0.0173 -0.0015 0.0076  40  PHE A C   
672  O  O   . PHE A 40  ? 0.2314 0.3124 0.2678 -0.0258 -0.0240 0.0098  40  PHE A O   
673  C  CB  . PHE A 40  ? 0.2065 0.3116 0.2504 -0.0250 -0.0026 0.0103  40  PHE A CB  
674  C  CG  . PHE A 40  ? 0.2283 0.2952 0.2403 0.0027  -0.0190 0.0224  40  PHE A CG  
675  C  CD1 . PHE A 40  ? 0.2213 0.3263 0.2417 -0.0119 -0.0101 0.0283  40  PHE A CD1 
676  C  CD2 . PHE A 40  ? 0.2064 0.3100 0.2401 -0.0098 -0.0043 0.0271  40  PHE A CD2 
677  C  CE1 . PHE A 40  ? 0.2361 0.2992 0.2370 -0.0398 -0.0328 -0.0016 40  PHE A CE1 
678  C  CE2 . PHE A 40  ? 0.1992 0.3248 0.2365 -0.0133 -0.0146 0.0185  40  PHE A CE2 
679  C  CZ  . PHE A 40  ? 0.2370 0.3397 0.2357 0.0062  -0.0263 -0.0006 40  PHE A CZ  
689  N  N   . ASN A 41  ? 0.1896 0.3498 0.2639 -0.0451 -0.0002 -0.0041 41  ASN A N   
690  C  CA  . ASN A 41  ? 0.1846 0.3475 0.2686 -0.0598 -0.0174 -0.0170 41  ASN A CA  
691  C  C   . ASN A 41  ? 0.2111 0.3836 0.2980 -0.0721 -0.0084 -0.0208 41  ASN A C   
692  O  O   . ASN A 41  ? 0.2234 0.4534 0.3112 -0.0304 -0.0182 -0.0332 41  ASN A O   
693  C  CB  . ASN A 41  ? 0.2070 0.3400 0.2509 -0.0384 -0.0053 0.0152  41  ASN A CB  
694  C  CG  . ASN A 41  ? 0.2037 0.3273 0.2372 -0.0495 0.0033  0.0393  41  ASN A CG  
695  O  OD1 . ASN A 41  ? 0.2428 0.3636 0.2181 -0.0680 -0.0301 0.0443  41  ASN A OD1 
696  N  ND2 . ASN A 41  ? 0.1967 0.3340 0.2507 -0.0465 0.0103  0.0000  41  ASN A ND2 
703  N  N   . LYS A 42  ? 0.1990 0.4479 0.3178 -0.0684 -0.0198 -0.0405 42  LYS A N   
704  C  CA  . LYS A 42  ? 0.2042 0.4359 0.3567 -0.0835 -0.0202 -0.0183 42  LYS A CA  
705  C  C   . LYS A 42  ? 0.1924 0.4445 0.3683 -0.0692 -0.0473 -0.0118 42  LYS A C   
706  O  O   . LYS A 42  ? 0.2204 0.5409 0.3857 -0.0272 -0.0390 0.0224  42  LYS A O   
707  C  CB  . LYS A 42  ? 0.2093 0.4458 0.3796 -0.0888 -0.0104 -0.0107 42  LYS A CB  
708  C  CG  . LYS A 42  ? 0.2626 0.4462 0.3991 -0.0316 0.0024  -0.0170 42  LYS A CG  
709  C  CD  . LYS A 42  ? 0.3161 0.4458 0.4180 -0.0131 -0.0035 -0.0208 42  LYS A CD  
710  C  CE  . LYS A 42  ? 0.3375 0.4594 0.4357 -0.0224 -0.0008 -0.0277 42  LYS A CE  
711  N  NZ  . LYS A 42  ? 0.3143 0.4388 0.4391 -0.0698 -0.0029 -0.0389 42  LYS A NZ  
725  N  N   . ARG A 43  ? 0.2229 0.3988 0.3746 -0.0663 -0.0458 -0.0243 43  ARG A N   
726  C  CA  . ARG A 43  ? 0.2404 0.4213 0.3827 -0.0357 -0.0568 -0.0182 43  ARG A CA  
727  C  C   . ARG A 43  ? 0.2670 0.4145 0.4032 -0.0136 -0.0725 -0.0248 43  ARG A C   
728  O  O   . ARG A 43  ? 0.3054 0.4304 0.4155 -0.0022 -0.0776 -0.0184 43  ARG A O   
729  C  CB  . ARG A 43  ? 0.2368 0.4480 0.3797 -0.0414 -0.0427 -0.0125 43  ARG A CB  
730  C  CG  . ARG A 43  ? 0.2656 0.4972 0.3845 -0.0589 -0.0222 -0.0148 43  ARG A CG  
731  C  CD  . ARG A 43  ? 0.3144 0.5729 0.3897 -0.0607 -0.0382 -0.0305 43  ARG A CD  
732  N  NE  . ARG A 43  ? 0.3201 0.5730 0.3958 -0.1124 -0.0246 -0.0574 43  ARG A NE  
733  C  CZ  . ARG A 43  ? 0.4065 0.6678 0.4039 -0.0287 -0.0327 -0.0843 43  ARG A CZ  
734  N  NH1 . ARG A 43  ? 0.3788 0.7149 0.4008 0.0026  -0.0522 -0.1135 43  ARG A NH1 
735  N  NH2 . ARG A 43  ? 0.4506 0.6895 0.4165 -0.0233 -0.0194 -0.0825 43  ARG A NH2 
749  N  N   . ASN A 44  ? 0.2652 0.3891 0.4082 0.0016  -0.0596 -0.0267 44  ASN A N   
750  C  CA  . ASN A 44  ? 0.2871 0.3895 0.4059 0.0194  -0.0671 -0.0449 44  ASN A CA  
751  C  C   . ASN A 44  ? 0.3022 0.3396 0.3877 0.0269  -0.0675 -0.0295 44  ASN A C   
752  O  O   . ASN A 44  ? 0.3285 0.3753 0.4166 0.0618  -0.0602 -0.0150 44  ASN A O   
753  C  CB  . ASN A 44  ? 0.3342 0.4873 0.4260 0.0803  -0.0525 -0.0638 44  ASN A CB  
754  C  CG  . ASN A 44  ? 0.3919 0.5835 0.4479 0.1746  -0.0351 -0.0633 44  ASN A CG  
755  O  OD1 . ASN A 44  ? 0.4521 0.6307 0.4712 0.2270  0.0039  -0.0499 44  ASN A OD1 
756  N  ND2 . ASN A 44  ? 0.4180 0.5673 0.4516 0.1907  -0.0399 -0.0668 44  ASN A ND2 
763  N  N   . ILE A 45  ? 0.2481 0.2792 0.3497 0.0031  -0.0554 -0.0153 45  ILE A N   
764  C  CA  . ILE A 45  ? 0.2541 0.2890 0.3362 -0.0291 -0.0371 -0.0045 45  ILE A CA  
765  C  C   . ILE A 45  ? 0.2247 0.2570 0.3101 -0.0173 -0.0207 0.0074  45  ILE A C   
766  O  O   . ILE A 45  ? 0.2673 0.2445 0.3085 0.0087  -0.0359 -0.0042 45  ILE A O   
767  C  CB  . ILE A 45  ? 0.2783 0.3784 0.3429 -0.0682 -0.0162 -0.0004 45  ILE A CB  
768  C  CG1 . ILE A 45  ? 0.3568 0.4215 0.3499 -0.0664 -0.0001 -0.0083 45  ILE A CG1 
769  C  CG2 . ILE A 45  ? 0.3542 0.3740 0.3523 -0.0030 -0.0085 -0.0064 45  ILE A CG2 
770  C  CD1 . ILE A 45  ? 0.4086 0.4699 0.3550 -0.0506 0.0171  -0.0168 45  ILE A CD1 
782  N  N   . THR A 46  ? 0.2022 0.2745 0.2976 -0.0069 -0.0029 -0.0012 46  THR A N   
783  C  CA  . THR A 46  ? 0.1918 0.2571 0.2879 -0.0033 -0.0161 -0.0071 46  THR A CA  
784  C  C   . THR A 46  ? 0.1877 0.2730 0.2579 -0.0031 -0.0020 -0.0049 46  THR A C   
785  O  O   . THR A 46  ? 0.1980 0.3064 0.2699 0.0130  0.0107  0.0213  46  THR A O   
786  C  CB  . THR A 46  ? 0.2079 0.2748 0.3099 0.0126  -0.0156 -0.0125 46  THR A CB  
787  O  OG1 . THR A 46  ? 0.2315 0.2721 0.3308 0.0383  -0.0146 -0.0185 46  THR A OG1 
788  C  CG2 . THR A 46  ? 0.2047 0.3001 0.3134 0.0150  -0.0127 -0.0264 46  THR A CG2 
796  N  N   . ALA A 47  ? 0.2054 0.2594 0.2351 0.0156  0.0127  -0.0001 47  ALA A N   
797  C  CA  . ALA A 47  ? 0.2036 0.2368 0.2204 -0.0042 0.0104  0.0271  47  ALA A CA  
798  C  C   . ALA A 47  ? 0.1854 0.2208 0.1935 -0.0101 0.0082  0.0010  47  ALA A C   
799  O  O   . ALA A 47  ? 0.1938 0.2547 0.2103 -0.0249 0.0056  0.0018  47  ALA A O   
800  C  CB  . ALA A 47  ? 0.2055 0.2280 0.2248 -0.0094 -0.0118 -0.0189 47  ALA A CB  
806  N  N   . ILE A 48  ? 0.1903 0.2319 0.2090 -0.0139 0.0141  0.0116  48  ILE A N   
807  C  CA  . ILE A 48  ? 0.1816 0.2113 0.2105 -0.0246 0.0257  0.0084  48  ILE A CA  
808  C  C   . ILE A 48  ? 0.1721 0.2493 0.1909 -0.0008 0.0154  0.0148  48  ILE A C   
809  O  O   . ILE A 48  ? 0.1896 0.2822 0.1897 -0.0083 0.0138  0.0193  48  ILE A O   
810  C  CB  . ILE A 48  ? 0.1967 0.2313 0.2500 -0.0168 0.0231  0.0220  48  ILE A CB  
811  C  CG1 . ILE A 48  ? 0.2220 0.2053 0.3052 0.0110  0.0136  0.0207  48  ILE A CG1 
812  C  CG2 . ILE A 48  ? 0.2208 0.2087 0.2408 -0.0269 0.0182  0.0196  48  ILE A CG2 
813  C  CD1 . ILE A 48  ? 0.2485 0.2667 0.3273 0.0473  0.0013  0.0126  48  ILE A CD1 
825  N  N   . ILE A 49  ? 0.1993 0.2211 0.1911 0.0200  0.0213  0.0276  49  ILE A N   
826  C  CA  . ILE A 49  ? 0.2150 0.2242 0.1922 0.0035  0.0163  0.0082  49  ILE A CA  
827  C  C   . ILE A 49  ? 0.2105 0.2404 0.1969 -0.0013 0.0230  0.0145  49  ILE A C   
828  O  O   . ILE A 49  ? 0.2086 0.2287 0.2080 -0.0056 0.0097  0.0223  49  ILE A O   
829  C  CB  . ILE A 49  ? 0.2115 0.2065 0.1970 -0.0089 0.0237  0.0070  49  ILE A CB  
830  C  CG1 . ILE A 49  ? 0.2239 0.2076 0.1965 -0.0368 0.0239  0.0111  49  ILE A CG1 
831  C  CG2 . ILE A 49  ? 0.1980 0.2663 0.2152 0.0074  0.0071  0.0021  49  ILE A CG2 
832  C  CD1 . ILE A 49  ? 0.2408 0.2146 0.2065 -0.0485 0.0393  0.0267  49  ILE A CD1 
844  N  N   . ALA A 50  ? 0.1961 0.2360 0.1991 -0.0027 0.0320  0.0230  50  ALA A N   
845  C  CA  . ALA A 50  ? 0.2115 0.2079 0.2158 0.0307  0.0387  0.0352  50  ALA A CA  
846  C  C   . ALA A 50  ? 0.2161 0.2032 0.2442 -0.0036 0.0290  0.0176  50  ALA A C   
847  O  O   . ALA A 50  ? 0.2472 0.2058 0.2630 0.0369  0.0276  0.0109  50  ALA A O   
848  C  CB  . ALA A 50  ? 0.2682 0.2053 0.2156 0.0215  0.0467  0.0485  50  ALA A CB  
854  N  N   . GLU A 51  ? 0.2129 0.1916 0.2654 0.0082  0.0183  0.0418  51  GLU A N   
855  C  CA  . GLU A 51  ? 0.2102 0.1969 0.2774 0.0141  0.0188  0.0139  51  GLU A CA  
856  C  C   . GLU A 51  ? 0.2117 0.1874 0.2599 0.0077  0.0198  -0.0049 51  GLU A C   
857  O  O   . GLU A 51  ? 0.2074 0.2086 0.2575 0.0028  0.0204  0.0250  51  GLU A O   
858  C  CB  . GLU A 51  ? 0.2008 0.2357 0.2820 0.0208  0.0029  0.0227  51  GLU A CB  
859  C  CG  . GLU A 51  ? 0.2262 0.2978 0.2989 0.0013  0.0351  0.0307  51  GLU A CG  
860  C  CD  . GLU A 51  ? 0.3076 0.3985 0.3238 0.0252  0.0122  -0.0076 51  GLU A CD  
861  O  OE1 . GLU A 51  ? 0.3452 0.4610 0.3292 -0.0256 -0.0093 -0.0422 51  GLU A OE1 
862  O  OE2 . GLU A 51  ? 0.3227 0.3972 0.3431 0.0325  0.0045  -0.0080 51  GLU A OE2 
869  N  N   . TYR A 52  ? 0.2115 0.1813 0.2546 0.0042  0.0296  0.0107  52  TYR A N   
870  C  CA  . TYR A 52  ? 0.1718 0.1837 0.2375 0.0216  0.0422  0.0343  52  TYR A CA  
871  C  C   . TYR A 52  ? 0.2056 0.1820 0.2316 0.0183  0.0416  0.0402  52  TYR A C   
872  O  O   . TYR A 52  ? 0.2466 0.1943 0.2131 0.0228  0.0306  0.0266  52  TYR A O   
873  C  CB  . TYR A 52  ? 0.1964 0.2065 0.2330 0.0157  0.0494  0.0439  52  TYR A CB  
874  C  CG  . TYR A 52  ? 0.2144 0.2264 0.2227 0.0330  0.0508  0.0429  52  TYR A CG  
875  C  CD1 . TYR A 52  ? 0.2347 0.2348 0.2224 0.0116  0.0429  0.0474  52  TYR A CD1 
876  C  CD2 . TYR A 52  ? 0.2350 0.2369 0.2252 0.0400  0.0618  0.0287  52  TYR A CD2 
877  C  CE1 . TYR A 52  ? 0.2459 0.2830 0.2159 0.0340  0.0556  0.0577  52  TYR A CE1 
878  C  CE2 . TYR A 52  ? 0.2332 0.2471 0.2324 0.0443  0.0544  0.0214  52  TYR A CE2 
879  C  CZ  . TYR A 52  ? 0.2508 0.2681 0.2260 0.0266  0.0591  0.0389  52  TYR A CZ  
880  O  OH  . TYR A 52  ? 0.2671 0.3022 0.2463 0.0384  0.0629  0.0252  52  TYR A OH  
890  N  N   . LYS A 53  ? 0.2348 0.1885 0.2454 0.0071  0.0114  0.0359  53  LYS A N   
891  C  CA  . LYS A 53  ? 0.2481 0.2399 0.2546 -0.0386 0.0282  0.0390  53  LYS A CA  
892  C  C   . LYS A 53  ? 0.2356 0.2163 0.2406 0.0283  0.0146  0.0464  53  LYS A C   
893  O  O   . LYS A 53  ? 0.2236 0.1984 0.2474 -0.0008 0.0019  0.0389  53  LYS A O   
894  C  CB  . LYS A 53  ? 0.3521 0.3068 0.2929 -0.0101 0.0673  0.0499  53  LYS A CB  
895  C  CG  . LYS A 53  ? 0.3493 0.2744 0.2970 -0.0285 0.1027  0.0378  53  LYS A CG  
896  C  CD  . LYS A 53  ? 0.3299 0.3185 0.3063 -0.0117 0.0787  0.0208  53  LYS A CD  
897  C  CE  . LYS A 53  ? 0.3360 0.3598 0.3008 0.0402  0.0795  0.0330  53  LYS A CE  
898  N  NZ  . LYS A 53  ? 0.3199 0.4197 0.3039 0.1096  0.0856  0.0311  53  LYS A NZ  
912  N  N   . ARG A 54  ? 0.2319 0.2642 0.2383 0.0271  0.0341  0.0374  54  ARG A N   
913  C  CA  . ARG A 54  ? 0.2352 0.2705 0.2420 -0.0010 0.0431  0.0373  54  ARG A CA  
914  C  C   . ARG A 54  ? 0.2328 0.2293 0.2312 -0.0435 0.0370  0.0336  54  ARG A C   
915  O  O   . ARG A 54  ? 0.3212 0.2531 0.2344 -0.0436 0.0061  0.0536  54  ARG A O   
916  C  CB  . ARG A 54  ? 0.2364 0.2980 0.2563 0.0119  0.0391  0.0191  54  ARG A CB  
917  C  CG  . ARG A 54  ? 0.2412 0.3296 0.2641 0.0117  0.0484  0.0007  54  ARG A CG  
918  C  CD  . ARG A 54  ? 0.2703 0.3598 0.2568 0.0061  0.0578  0.0206  54  ARG A CD  
919  N  NE  . ARG A 54  ? 0.2873 0.4272 0.2665 0.0557  0.0458  0.0112  54  ARG A NE  
920  C  CZ  . ARG A 54  ? 0.3222 0.5078 0.2838 0.1016  0.0216  -0.0162 54  ARG A CZ  
921  N  NH1 . ARG A 54  ? 0.3914 0.5731 0.3029 0.1962  0.0007  -0.0381 54  ARG A NH1 
922  N  NH2 . ARG A 54  ? 0.3305 0.5154 0.2971 0.0590  0.0108  -0.0303 54  ARG A NH2 
936  N  N   . LYS A 55  ? 0.2548 0.2083 0.2326 -0.0119 0.0412  0.0051  55  LYS A N   
937  C  CA  . LYS A 55  ? 0.2597 0.2217 0.2309 -0.0137 0.0425  0.0115  55  LYS A CA  
938  C  C   . LYS A 55  ? 0.2678 0.2124 0.2420 0.0038  0.0270  -0.0191 55  LYS A C   
939  O  O   . LYS A 55  ? 0.2485 0.2255 0.2267 -0.0038 0.0144  -0.0079 55  LYS A O   
940  C  CB  . LYS A 55  ? 0.2979 0.2677 0.2326 0.0264  0.0538  0.0094  55  LYS A CB  
941  C  CG  . LYS A 55  ? 0.3050 0.3322 0.2674 0.0389  0.0538  0.0083  55  LYS A CG  
942  C  CD  . LYS A 55  ? 0.2796 0.3574 0.2862 0.0379  0.0367  0.0232  55  LYS A CD  
943  C  CE  . LYS A 55  ? 0.2898 0.3902 0.2934 0.0821  0.0334  0.0256  55  LYS A CE  
944  N  NZ  . LYS A 55  ? 0.2985 0.4089 0.2978 0.0923  0.0309  0.0354  55  LYS A NZ  
958  N  N   . SER A 56  ? 0.2707 0.1971 0.2491 -0.0205 0.0321  -0.0179 56  SER A N   
959  C  CA  . SER A 56  ? 0.2632 0.2256 0.2696 -0.0336 0.0306  -0.0092 56  SER A CA  
960  C  C   . SER A 56  ? 0.2680 0.1978 0.2758 -0.0387 0.0115  0.0009  56  SER A C   
961  O  O   . SER A 56  ? 0.2589 0.2754 0.2784 -0.0415 -0.0009 0.0096  56  SER A O   
962  C  CB  . SER A 56  ? 0.2973 0.2361 0.2721 -0.0098 0.0409  -0.0067 56  SER A CB  
963  O  OG  . SER A 56  ? 0.3387 0.2380 0.2670 -0.0001 0.0286  -0.0195 56  SER A OG  
969  N  N   . PRO A 57  ? 0.3087 0.2374 0.2757 -0.0195 0.0024  0.0156  57  PRO A N   
970  C  CA  . PRO A 57  ? 0.3561 0.2964 0.2646 -0.0127 -0.0087 0.0368  57  PRO A CA  
971  C  C   . PRO A 57  ? 0.3663 0.3080 0.2604 -0.0853 -0.0167 0.0110  57  PRO A C   
972  O  O   . PRO A 57  ? 0.3948 0.3981 0.2702 -0.0708 -0.0470 -0.0114 57  PRO A O   
973  C  CB  . PRO A 57  ? 0.4009 0.3177 0.2834 0.0287  -0.0077 0.0424  57  PRO A CB  
974  C  CG  . PRO A 57  ? 0.4179 0.3087 0.2815 0.0340  -0.0150 0.0134  57  PRO A CG  
975  C  CD  . PRO A 57  ? 0.3476 0.2448 0.2770 0.0056  -0.0144 0.0164  57  PRO A CD  
983  N  N   . SER A 58  ? 0.3658 0.2907 0.2526 -0.0700 0.0084  -0.0214 58  SER A N   
984  C  CA  A SER A 58  ? 0.3910 0.2497 0.2665 -0.0373 0.0133  -0.0430 58  SER A CA  
985  C  CA  B SER A 58  ? 0.3779 0.2861 0.2627 -0.0432 0.0240  -0.0294 58  SER A CA  
986  C  C   . SER A 58  ? 0.3708 0.2975 0.2624 0.0042  0.0140  -0.0405 58  SER A C   
987  O  O   . SER A 58  ? 0.4266 0.2911 0.2674 0.0164  0.0288  -0.0580 58  SER A O   
988  C  CB  A SER A 58  ? 0.4364 0.2878 0.2821 0.0050  0.0118  -0.0519 58  SER A CB  
989  C  CB  B SER A 58  ? 0.3976 0.3450 0.2719 -0.0192 0.0450  -0.0239 58  SER A CB  
990  O  OG  A SER A 58  ? 0.4593 0.3201 0.2851 0.0082  0.0127  -0.0696 58  SER A OG  
991  O  OG  B SER A 58  ? 0.3986 0.3824 0.2741 -0.0233 0.0729  -0.0172 58  SER A OG  
1000 N  N   . GLY A 59  ? 0.3017 0.2724 0.2772 -0.0400 0.0040  -0.0185 59  GLY A N   
1001 C  CA  . GLY A 59  ? 0.2983 0.2583 0.2757 -0.0239 0.0164  0.0000  59  GLY A CA  
1002 C  C   . GLY A 59  ? 0.3090 0.2520 0.2728 -0.0266 0.0179  0.0026  59  GLY A C   
1003 O  O   . GLY A 59  ? 0.3384 0.3014 0.2815 -0.0443 -0.0043 0.0111  59  GLY A O   
1007 N  N   . LEU A 60  ? 0.3060 0.2316 0.2621 0.0127  0.0127  0.0040  60  LEU A N   
1008 C  CA  . LEU A 60  ? 0.3338 0.2599 0.2592 0.0320  -0.0117 0.0105  60  LEU A CA  
1009 C  C   . LEU A 60  ? 0.3253 0.2472 0.2707 -0.0200 0.0001  0.0311  60  LEU A C   
1010 O  O   . LEU A 60  ? 0.3019 0.2518 0.2754 -0.0330 -0.0255 0.0332  60  LEU A O   
1011 C  CB  . LEU A 60  ? 0.3249 0.2573 0.2534 0.0250  -0.0060 -0.0002 60  LEU A CB  
1012 C  CG  . LEU A 60  ? 0.3413 0.2812 0.2518 0.0436  -0.0185 -0.0064 60  LEU A CG  
1013 C  CD1 . LEU A 60  ? 0.3386 0.2719 0.2628 0.0666  -0.0337 -0.0050 60  LEU A CD1 
1014 C  CD2 . LEU A 60  ? 0.3308 0.2910 0.2471 -0.0001 -0.0423 -0.0275 60  LEU A CD2 
1026 N  N   . ASP A 61  ? 0.3612 0.2947 0.2886 -0.0444 -0.0209 0.0113  61  ASP A N   
1027 C  CA  . ASP A 61  ? 0.3790 0.3607 0.3070 -0.1016 -0.0089 0.0313  61  ASP A CA  
1028 C  C   . ASP A 61  ? 0.4507 0.3246 0.3108 -0.0791 0.0127  0.0639  61  ASP A C   
1029 O  O   . ASP A 61  ? 0.5205 0.3843 0.3336 -0.0789 0.0328  0.0534  61  ASP A O   
1030 C  CB  . ASP A 61  ? 0.3527 0.4660 0.3381 -0.1087 -0.0151 0.0117  61  ASP A CB  
1031 C  CG  . ASP A 61  ? 0.3321 0.5507 0.3630 -0.1295 -0.0333 -0.0274 61  ASP A CG  
1032 O  OD1 . ASP A 61  ? 0.3289 0.5920 0.3778 -0.1114 -0.0276 -0.0297 61  ASP A OD1 
1033 O  OD2 . ASP A 61  ? 0.3015 0.5821 0.3640 -0.1357 -0.0410 -0.0393 61  ASP A OD2 
1038 N  N   . VAL A 62  ? 0.4392 0.2653 0.2883 -0.0436 0.0144  0.0774  62  VAL A N   
1039 C  CA  . VAL A 62  ? 0.4581 0.2794 0.3002 0.0353  0.0155  0.0726  62  VAL A CA  
1040 C  C   . VAL A 62  ? 0.4357 0.2724 0.3152 0.0215  0.0111  0.0749  62  VAL A C   
1041 O  O   . VAL A 62  ? 0.4956 0.2866 0.3233 0.0438  0.0090  0.0836  62  VAL A O   
1042 C  CB  . VAL A 62  ? 0.4449 0.3284 0.2958 0.0605  0.0033  0.0445  62  VAL A CB  
1043 C  CG1 . VAL A 62  ? 0.4720 0.3330 0.2973 0.1034  0.0089  0.0302  62  VAL A CG1 
1044 C  CG2 . VAL A 62  ? 0.3904 0.2986 0.2892 0.0197  -0.0161 0.0129  62  VAL A CG2 
1054 N  N   . GLU A 63  ? 0.3313 0.2624 0.3174 -0.0009 0.0152  0.0712  63  GLU A N   
1055 C  CA  . GLU A 63  ? 0.3104 0.2939 0.3361 0.0082  0.0266  0.0678  63  GLU A CA  
1056 C  C   . GLU A 63  ? 0.3068 0.2732 0.3202 0.0357  0.0253  0.0662  63  GLU A C   
1057 O  O   . GLU A 63  ? 0.3864 0.2791 0.3484 0.0634  -0.0441 0.0373  63  GLU A O   
1058 C  CB  . GLU A 63  ? 0.3601 0.4128 0.3656 0.0404  0.0372  0.0757  63  GLU A CB  
1059 C  CG  . GLU A 63  ? 0.4408 0.5494 0.4046 0.0902  0.0256  0.0364  63  GLU A CG  
1060 C  CD  . GLU A 63  ? 0.5104 0.6320 0.4327 0.1728  0.0257  0.0182  63  GLU A CD  
1061 O  OE1 . GLU A 63  ? 0.4811 0.6530 0.4322 0.1700  0.0419  0.0134  63  GLU A OE1 
1062 O  OE2 . GLU A 63  ? 0.6144 0.6816 0.4620 0.2230  0.0074  0.0110  63  GLU A OE2 
1069 N  N   . ARG A 64  ? 0.2535 0.2799 0.2916 0.0193  0.0622  0.0793  64  ARG A N   
1070 C  CA  . ARG A 64  ? 0.2644 0.3210 0.2963 0.0578  0.0457  0.0438  64  ARG A CA  
1071 C  C   . ARG A 64  ? 0.2399 0.3079 0.2787 0.0262  0.0434  0.0437  64  ARG A C   
1072 O  O   . ARG A 64  ? 0.2966 0.3010 0.2712 0.0501  0.0421  0.0641  64  ARG A O   
1073 C  CB  . ARG A 64  ? 0.2898 0.4053 0.3294 0.0989  0.0362  -0.0109 64  ARG A CB  
1074 C  CG  . ARG A 64  ? 0.3014 0.4166 0.3482 0.0776  0.0628  -0.0071 64  ARG A CG  
1075 C  CD  . ARG A 64  ? 0.2963 0.3717 0.3534 0.0274  0.0764  -0.0013 64  ARG A CD  
1076 N  NE  . ARG A 64  ? 0.2897 0.3775 0.3449 -0.0209 0.0471  0.0398  64  ARG A NE  
1077 C  CZ  . ARG A 64  ? 0.2536 0.2818 0.3076 0.0182  0.0388  0.0865  64  ARG A CZ  
1078 N  NH1 . ARG A 64  ? 0.2473 0.2456 0.3026 0.0343  0.0586  0.0253  64  ARG A NH1 
1079 N  NH2 . ARG A 64  ? 0.2278 0.3319 0.2888 0.0206  0.0463  0.1073  64  ARG A NH2 
1093 N  N   . ASP A 65  ? 0.2455 0.3020 0.2757 0.0220  0.0591  0.0356  65  ASP A N   
1094 C  CA  . ASP A 65  ? 0.2422 0.3644 0.2666 0.0132  0.0565  0.0414  65  ASP A CA  
1095 C  C   . ASP A 65  ? 0.2468 0.3420 0.2499 0.0395  0.0469  0.0549  65  ASP A C   
1096 O  O   . ASP A 65  ? 0.2545 0.3512 0.2320 0.0370  0.0391  0.0560  65  ASP A O   
1097 C  CB  . ASP A 65  ? 0.2726 0.4598 0.2736 0.0042  0.0741  0.0420  65  ASP A CB  
1098 C  CG  . ASP A 65  ? 0.3141 0.5227 0.2921 0.0498  0.0748  0.0128  65  ASP A CG  
1099 O  OD1 . ASP A 65  ? 0.3588 0.5898 0.3140 0.0696  0.0653  0.0122  65  ASP A OD1 
1100 O  OD2 . ASP A 65  ? 0.3224 0.5470 0.2959 0.0732  0.0828  0.0245  65  ASP A OD2 
1105 N  N   . PRO A 66  ? 0.2450 0.2919 0.2537 0.0320  0.0555  0.0447  66  PRO A N   
1106 C  CA  . PRO A 66  ? 0.2688 0.2957 0.2528 0.0485  0.0545  0.0595  66  PRO A CA  
1107 C  C   . PRO A 66  ? 0.2975 0.3255 0.2473 0.0416  0.0419  0.0366  66  PRO A C   
1108 O  O   . PRO A 66  ? 0.2882 0.3020 0.2454 0.0358  0.0424  0.0359  66  PRO A O   
1109 C  CB  . PRO A 66  ? 0.3043 0.3003 0.2678 0.0716  0.0560  0.0625  66  PRO A CB  
1110 C  CG  . PRO A 66  ? 0.3174 0.3190 0.2708 0.0857  0.0508  0.0459  66  PRO A CG  
1111 C  CD  . PRO A 66  ? 0.3093 0.3286 0.2647 0.0766  0.0612  0.0397  66  PRO A CD  
1119 N  N   . ILE A 67  ? 0.2916 0.3764 0.2324 0.0418  0.0449  0.0206  67  ILE A N   
1120 C  CA  . ILE A 67  ? 0.2991 0.3933 0.2255 0.0034  0.0497  0.0139  67  ILE A CA  
1121 C  C   . ILE A 67  ? 0.3055 0.3854 0.2145 0.0169  0.0326  0.0214  67  ILE A C   
1122 O  O   . ILE A 67  ? 0.2937 0.4264 0.2053 0.0393  0.0190  0.0135  67  ILE A O   
1123 C  CB  . ILE A 67  ? 0.3501 0.4092 0.2395 0.0647  0.0195  -0.0195 67  ILE A CB  
1124 C  CG1 . ILE A 67  ? 0.3972 0.4414 0.2564 0.1391  0.0014  -0.0443 67  ILE A CG1 
1125 C  CG2 . ILE A 67  ? 0.4015 0.4157 0.2498 0.0646  0.0126  -0.0249 67  ILE A CG2 
1126 C  CD1 . ILE A 67  ? 0.3933 0.4456 0.2599 0.1494  0.0166  -0.0301 67  ILE A CD1 
1138 N  N   . GLU A 68  ? 0.3115 0.4302 0.2337 0.0387  0.0391  0.0709  68  GLU A N   
1139 C  CA  . GLU A 68  ? 0.3231 0.4285 0.2581 0.0448  0.0568  0.0937  68  GLU A CA  
1140 C  C   . GLU A 68  ? 0.2834 0.3706 0.2434 0.0581  0.0433  0.0849  68  GLU A C   
1141 O  O   . GLU A 68  ? 0.2946 0.3409 0.2462 0.0612  0.0369  0.0657  68  GLU A O   
1142 C  CB  . GLU A 68  ? 0.4239 0.5253 0.2817 0.1093  0.0931  0.1277  68  GLU A CB  
1143 C  CG  . GLU A 68  ? 0.5224 0.6240 0.3207 0.1486  0.1168  0.1194  68  GLU A CG  
1144 C  CD  . GLU A 68  ? 0.6340 0.7284 0.3524 0.2022  0.1248  0.1324  68  GLU A CD  
1145 O  OE1 . GLU A 68  ? 0.6797 0.7354 0.3617 0.1917  0.1178  0.1551  68  GLU A OE1 
1146 O  OE2 . GLU A 68  ? 0.6981 0.8086 0.3796 0.2352  0.1274  0.1124  68  GLU A OE2 
1153 N  N   . TYR A 69  ? 0.2763 0.2806 0.2471 0.0294  0.0411  0.0624  69  TYR A N   
1154 C  CA  . TYR A 69  ? 0.2696 0.2468 0.2332 0.0093  0.0314  0.0556  69  TYR A CA  
1155 C  C   . TYR A 69  ? 0.2695 0.2963 0.2186 0.0158  0.0118  0.0417  69  TYR A C   
1156 O  O   . TYR A 69  ? 0.2510 0.2923 0.2188 0.0153  0.0024  0.0317  69  TYR A O   
1157 C  CB  . TYR A 69  ? 0.2704 0.2316 0.2355 0.0348  0.0338  0.0330  69  TYR A CB  
1158 C  CG  . TYR A 69  ? 0.2642 0.2124 0.2308 0.0267  0.0035  0.0049  69  TYR A CG  
1159 C  CD1 . TYR A 69  ? 0.2384 0.2191 0.2394 0.0104  0.0016  0.0028  69  TYR A CD1 
1160 C  CD2 . TYR A 69  ? 0.2517 0.2222 0.2337 0.0520  0.0014  0.0102  69  TYR A CD2 
1161 C  CE1 . TYR A 69  ? 0.2296 0.2135 0.2435 -0.0127 0.0040  0.0205  69  TYR A CE1 
1162 C  CE2 . TYR A 69  ? 0.2627 0.2221 0.2270 0.0387  0.0097  0.0348  69  TYR A CE2 
1163 C  CZ  . TYR A 69  ? 0.2144 0.2264 0.2283 0.0040  0.0227  0.0351  69  TYR A CZ  
1164 O  OH  . TYR A 69  ? 0.2569 0.2356 0.2271 0.0301  0.0220  0.0358  69  TYR A OH  
1174 N  N   . ALA A 70  ? 0.2742 0.2927 0.2000 0.0305  0.0099  0.0242  70  ALA A N   
1175 C  CA  . ALA A 70  ? 0.2718 0.2991 0.2013 0.0194  0.0204  0.0229  70  ALA A CA  
1176 C  C   . ALA A 70  ? 0.2599 0.3085 0.2198 0.0181  0.0118  0.0123  70  ALA A C   
1177 O  O   . ALA A 70  ? 0.2541 0.2990 0.2251 0.0026  0.0186  0.0050  70  ALA A O   
1178 C  CB  . ALA A 70  ? 0.3051 0.3008 0.2159 0.0125  0.0168  0.0038  70  ALA A CB  
1184 N  N   . LYS A 71  ? 0.2699 0.3344 0.2256 0.0394  0.0012  -0.0069 71  LYS A N   
1185 C  CA  . LYS A 71  ? 0.2769 0.3768 0.2217 0.0436  0.0018  0.0300  71  LYS A CA  
1186 C  C   . LYS A 71  ? 0.2852 0.3748 0.2198 0.0414  -0.0090 0.0372  71  LYS A C   
1187 O  O   . LYS A 71  ? 0.2850 0.4320 0.2306 0.0847  -0.0078 0.0252  71  LYS A O   
1188 C  CB  . LYS A 71  ? 0.3269 0.4209 0.2456 0.0508  -0.0051 0.0076  71  LYS A CB  
1189 C  CG  . LYS A 71  ? 0.3883 0.4365 0.2781 0.0334  -0.0247 -0.0139 71  LYS A CG  
1190 C  CD  . LYS A 71  ? 0.4247 0.4695 0.2941 -0.0233 -0.0543 -0.0401 71  LYS A CD  
1191 C  CE  . LYS A 71  ? 0.4457 0.4656 0.3007 -0.0462 -0.0637 -0.0721 71  LYS A CE  
1192 N  NZ  . LYS A 71  ? 0.4725 0.4977 0.3023 -0.0078 -0.0369 -0.0685 71  LYS A NZ  
1206 N  N   . PHE A 72  ? 0.2714 0.3512 0.2168 0.0395  0.0072  0.0503  72  PHE A N   
1207 C  CA  . PHE A 72  ? 0.2403 0.3310 0.2251 0.0146  0.0037  0.0509  72  PHE A CA  
1208 C  C   . PHE A 72  ? 0.2302 0.3164 0.2295 -0.0022 0.0016  0.0182  72  PHE A C   
1209 O  O   . PHE A 72  ? 0.2313 0.3667 0.2539 0.0104  -0.0173 -0.0004 72  PHE A O   
1210 C  CB  . PHE A 72  ? 0.2431 0.3517 0.2411 0.0058  0.0253  0.0724  72  PHE A CB  
1211 C  CG  . PHE A 72  ? 0.2290 0.3351 0.2547 0.0301  0.0191  0.0747  72  PHE A CG  
1212 C  CD1 . PHE A 72  ? 0.2745 0.3308 0.2586 0.0359  -0.0067 0.0642  72  PHE A CD1 
1213 C  CD2 . PHE A 72  ? 0.2503 0.3073 0.2675 0.0271  0.0068  0.0544  72  PHE A CD2 
1214 C  CE1 . PHE A 72  ? 0.2894 0.3381 0.2727 0.0445  -0.0207 0.0357  72  PHE A CE1 
1215 C  CE2 . PHE A 72  ? 0.2474 0.3078 0.2718 0.0099  -0.0027 0.0434  72  PHE A CE2 
1216 C  CZ  . PHE A 72  ? 0.3002 0.3347 0.2756 0.0387  -0.0099 0.0337  72  PHE A CZ  
1226 N  N   . MET A 73  ? 0.2609 0.2962 0.2349 0.0350  -0.0168 0.0063  73  MET A N   
1227 C  CA  . MET A 73  ? 0.2217 0.3152 0.2161 -0.0053 0.0229  0.0210  73  MET A CA  
1228 C  C   . MET A 73  ? 0.2372 0.3155 0.2173 -0.0195 0.0116  0.0045  73  MET A C   
1229 O  O   . MET A 73  ? 0.2319 0.3565 0.2085 0.0014  0.0161  -0.0027 73  MET A O   
1230 C  CB  . MET A 73  ? 0.2237 0.2777 0.2168 0.0101  -0.0053 0.0107  73  MET A CB  
1231 C  CG  . MET A 73  ? 0.2294 0.2747 0.2208 0.0325  -0.0007 -0.0014 73  MET A CG  
1232 S  SD  . MET A 73  ? 0.2449 0.2629 0.2337 0.0082  0.0073  0.0267  73  MET A SD  
1233 C  CE  . MET A 73  ? 0.2615 0.2388 0.2523 -0.0147 0.0012  0.0111  73  MET A CE  
1243 N  N   . GLU A 74  ? 0.2698 0.3156 0.2193 0.0061  0.0102  0.0227  74  GLU A N   
1244 C  CA  . GLU A 74  ? 0.2793 0.3137 0.2251 0.0008  -0.0007 0.0059  74  GLU A CA  
1245 C  C   . GLU A 74  ? 0.2977 0.3122 0.2272 -0.0276 0.0025  0.0051  74  GLU A C   
1246 O  O   . GLU A 74  ? 0.2957 0.3191 0.2445 -0.0124 -0.0145 0.0036  74  GLU A O   
1247 C  CB  . GLU A 74  ? 0.3384 0.3426 0.2541 0.0070  0.0060  -0.0328 74  GLU A CB  
1248 C  CG  . GLU A 74  ? 0.4345 0.3915 0.2813 0.0673  0.0159  -0.0421 74  GLU A CG  
1249 C  CD  . GLU A 74  ? 0.4967 0.3918 0.3126 0.0829  -0.0077 -0.0647 74  GLU A CD  
1250 O  OE1 . GLU A 74  ? 0.5219 0.3913 0.3183 0.0458  -0.0089 -0.0590 74  GLU A OE1 
1251 O  OE2 . GLU A 74  ? 0.5122 0.4078 0.3292 0.1166  -0.0397 -0.0775 74  GLU A OE2 
1258 N  N   . ARG A 75  ? 0.3259 0.3308 0.2265 -0.0176 -0.0012 0.0156  75  ARG A N   
1259 C  CA  . ARG A 75  ? 0.3714 0.3889 0.2551 -0.0192 -0.0044 0.0373  75  ARG A CA  
1260 C  C   . ARG A 75  ? 0.3499 0.3646 0.2603 0.0139  -0.0217 0.0329  75  ARG A C   
1261 O  O   . ARG A 75  ? 0.3501 0.4010 0.2686 0.0146  -0.0542 0.0090  75  ARG A O   
1262 C  CB  . ARG A 75  ? 0.4569 0.4782 0.2951 -0.0296 0.0187  0.0628  75  ARG A CB  
1263 C  CG  . ARG A 75  ? 0.5708 0.6796 0.3561 0.0157  0.0282  0.0315  75  ARG A CG  
1264 C  CD  . ARG A 75  ? 0.6451 0.8304 0.3841 0.0418  0.0398  0.0278  75  ARG A CD  
1265 N  NE  . ARG A 75  ? 0.6867 0.9723 0.4056 0.0644  0.0500  0.0012  75  ARG A NE  
1266 C  CZ  . ARG A 75  ? 0.7007 1.0845 0.4136 0.0707  0.0647  -0.0165 75  ARG A CZ  
1267 N  NH1 . ARG A 75  ? 0.6810 1.1074 0.4084 0.0466  0.0612  -0.0248 75  ARG A NH1 
1268 N  NH2 . ARG A 75  ? 0.7064 1.1352 0.4120 0.0824  0.0832  -0.0168 75  ARG A NH2 
1282 N  N   . TYR A 76  ? 0.2967 0.3042 0.2512 0.0061  -0.0183 0.0500  76  TYR A N   
1283 C  CA  . TYR A 76  ? 0.2615 0.2735 0.2485 -0.0019 0.0008  0.0380  76  TYR A CA  
1284 C  C   . TYR A 76  ? 0.2240 0.2943 0.2308 0.0047  0.0258  0.0457  76  TYR A C   
1285 O  O   . TYR A 76  ? 0.2422 0.3591 0.2479 0.0428  0.0345  0.0715  76  TYR A O   
1286 C  CB  . TYR A 76  ? 0.2783 0.2999 0.2571 -0.0221 -0.0337 0.0292  76  TYR A CB  
1287 C  CG  . TYR A 76  ? 0.3023 0.3261 0.2837 -0.0715 -0.0802 0.0626  76  TYR A CG  
1288 C  CD1 . TYR A 76  ? 0.3661 0.3688 0.3122 -0.0094 -0.0832 0.0926  76  TYR A CD1 
1289 C  CD2 . TYR A 76  ? 0.3386 0.3280 0.2937 -0.0658 -0.0750 0.0987  76  TYR A CD2 
1290 C  CE1 . TYR A 76  ? 0.4065 0.3828 0.3306 -0.0155 -0.0744 0.1189  76  TYR A CE1 
1291 C  CE2 . TYR A 76  ? 0.3927 0.3433 0.3123 -0.0482 -0.0710 0.1199  76  TYR A CE2 
1292 C  CZ  . TYR A 76  ? 0.4385 0.3726 0.3338 -0.0381 -0.0799 0.1288  76  TYR A CZ  
1293 O  OH  . TYR A 76  ? 0.5160 0.3996 0.3649 -0.0365 -0.0727 0.1409  76  TYR A OH  
1303 N  N   . ALA A 77  ? 0.2221 0.2881 0.2066 0.0273  0.0173  0.0462  77  ALA A N   
1304 C  CA  . ALA A 77  ? 0.2542 0.2683 0.1907 0.0309  0.0258  0.0488  77  ALA A CA  
1305 C  C   . ALA A 77  ? 0.2365 0.2738 0.1922 0.0136  0.0162  0.0253  77  ALA A C   
1306 O  O   . ALA A 77  ? 0.2595 0.3155 0.2181 0.0065  -0.0097 0.0274  77  ALA A O   
1307 C  CB  . ALA A 77  ? 0.2543 0.2598 0.1926 0.0172  0.0374  0.0227  77  ALA A CB  
1313 N  N   . VAL A 78  ? 0.1946 0.2729 0.1938 -0.0199 0.0052  0.0144  78  VAL A N   
1314 C  CA  . VAL A 78  ? 0.2266 0.2448 0.1910 -0.0101 -0.0093 0.0038  78  VAL A CA  
1315 C  C   . VAL A 78  ? 0.2407 0.2330 0.2105 -0.0133 0.0000  0.0045  78  VAL A C   
1316 O  O   . VAL A 78  ? 0.2468 0.2504 0.2211 -0.0151 -0.0003 0.0080  78  VAL A O   
1317 C  CB  . VAL A 78  ? 0.2220 0.2257 0.1880 -0.0087 0.0024  0.0103  78  VAL A CB  
1318 C  CG1 . VAL A 78  ? 0.2632 0.2230 0.1977 0.0060  0.0079  0.0131  78  VAL A CG1 
1319 C  CG2 . VAL A 78  ? 0.2254 0.2679 0.1882 -0.0330 -0.0006 -0.0020 78  VAL A CG2 
1329 N  N   . GLY A 79  ? 0.2422 0.2105 0.2084 0.0008  0.0128  0.0087  79  GLY A N   
1330 C  CA  . GLY A 79  ? 0.2360 0.2284 0.2099 0.0020  0.0251  -0.0027 79  GLY A CA  
1331 C  C   . GLY A 79  ? 0.2639 0.2374 0.2066 0.0273  0.0335  0.0173  79  GLY A C   
1332 O  O   . GLY A 79  ? 0.2459 0.2315 0.1928 0.0191  0.0412  0.0207  79  GLY A O   
1336 N  N   . LEU A 80  ? 0.2317 0.2008 0.2284 0.0105  0.0182  0.0056  80  LEU A N   
1337 C  CA  . LEU A 80  ? 0.2354 0.1960 0.2383 -0.0302 0.0180  0.0036  80  LEU A CA  
1338 C  C   . LEU A 80  ? 0.2358 0.1922 0.2598 0.0012  0.0135  0.0065  80  LEU A C   
1339 O  O   . LEU A 80  ? 0.2675 0.2078 0.2896 0.0003  -0.0169 0.0061  80  LEU A O   
1340 C  CB  . LEU A 80  ? 0.2740 0.2403 0.2422 -0.0034 0.0412  0.0208  80  LEU A CB  
1341 C  CG  . LEU A 80  ? 0.2791 0.2694 0.2350 -0.0184 0.0535  0.0272  80  LEU A CG  
1342 C  CD1 . LEU A 80  ? 0.3089 0.3469 0.2395 0.0230  0.0647  0.0012  80  LEU A CD1 
1343 C  CD2 . LEU A 80  ? 0.3321 0.2913 0.2465 0.0168  0.0605  0.0411  80  LEU A CD2 
1355 N  N   . SER A 81  ? 0.2095 0.2081 0.2540 0.0043  0.0106  0.0226  81  SER A N   
1356 C  CA  . SER A 81  ? 0.1910 0.2202 0.2530 0.0029  0.0161  0.0200  81  SER A CA  
1357 C  C   . SER A 81  ? 0.1909 0.1898 0.2553 -0.0154 0.0311  0.0202  81  SER A C   
1358 O  O   . SER A 81  ? 0.1992 0.2131 0.3036 -0.0003 0.0578  0.0261  81  SER A O   
1359 C  CB  . SER A 81  ? 0.2231 0.2177 0.2452 0.0109  0.0108  0.0457  81  SER A CB  
1360 O  OG  . SER A 81  ? 0.2414 0.2427 0.2481 0.0214  0.0239  0.0448  81  SER A OG  
1366 N  N   . ILE A 82  ? 0.2110 0.1940 0.2075 0.0068  0.0175  0.0144  82  ILE A N   
1367 C  CA  A ILE A 82  ? 0.2229 0.1923 0.2064 0.0142  0.0300  0.0232  82  ILE A CA  
1368 C  CA  B ILE A 82  ? 0.2137 0.1835 0.1919 -0.0046 0.0376  0.0437  82  ILE A CA  
1369 C  C   . ILE A 82  ? 0.2280 0.2099 0.2063 0.0251  0.0452  0.0397  82  ILE A C   
1370 O  O   . ILE A 82  ? 0.2318 0.1979 0.1904 0.0161  0.0491  0.0440  82  ILE A O   
1371 C  CB  A ILE A 82  ? 0.2365 0.1905 0.2099 0.0442  0.0243  0.0169  82  ILE A CB  
1372 C  CB  B ILE A 82  ? 0.2595 0.2276 0.2003 0.0160  0.0314  0.0182  82  ILE A CB  
1373 C  CG1 A ILE A 82  ? 0.2569 0.1877 0.2121 0.0651  0.0225  0.0155  82  ILE A CG1 
1374 C  CG1 B ILE A 82  ? 0.3068 0.2654 0.2063 0.0427  0.0308  0.0390  82  ILE A CG1 
1375 C  CG2 A ILE A 82  ? 0.2349 0.1852 0.2078 0.0566  0.0273  0.0221  82  ILE A CG2 
1376 C  CG2 B ILE A 82  ? 0.2699 0.2431 0.2006 0.0412  0.0514  0.0199  82  ILE A CG2 
1377 C  CD1 A ILE A 82  ? 0.2733 0.1948 0.2147 0.0716  0.0125  0.0056  82  ILE A CD1 
1378 C  CD1 B ILE A 82  ? 0.3284 0.2800 0.2078 0.0282  0.0385  0.0666  82  ILE A CD1 
1399 N  N   . LEU A 83  ? 0.2551 0.1769 0.2137 0.0122  0.0368  0.0319  83  LEU A N   
1400 C  CA  . LEU A 83  ? 0.2629 0.1980 0.2256 -0.0163 0.0200  0.0395  83  LEU A CA  
1401 C  C   . LEU A 83  ? 0.2656 0.2090 0.2208 0.0118  0.0390  0.0561  83  LEU A C   
1402 O  O   . LEU A 83  ? 0.2654 0.2970 0.2399 0.0351  0.0493  0.0743  83  LEU A O   
1403 C  CB  . LEU A 83  ? 0.3014 0.2331 0.2460 0.0217  0.0067  0.0406  83  LEU A CB  
1404 C  CG  . LEU A 83  ? 0.2799 0.2241 0.2551 0.0067  0.0052  0.0338  83  LEU A CG  
1405 C  CD1 . LEU A 83  ? 0.3327 0.2385 0.2651 -0.0177 -0.0028 0.0384  83  LEU A CD1 
1406 C  CD2 . LEU A 83  ? 0.2422 0.2661 0.2801 -0.0237 0.0283  0.0023  83  LEU A CD2 
1418 N  N   . THR A 84  ? 0.2502 0.1909 0.2133 0.0131  0.0429  0.0418  84  THR A N   
1419 C  CA  . THR A 84  ? 0.2442 0.2205 0.2222 0.0287  0.0452  0.0155  84  THR A CA  
1420 C  C   . THR A 84  ? 0.2113 0.2526 0.2572 0.0280  0.0501  0.0079  84  THR A C   
1421 O  O   . THR A 84  ? 0.2343 0.2483 0.3009 0.0167  0.0530  -0.0077 84  THR A O   
1422 C  CB  . THR A 84  ? 0.2699 0.2075 0.2057 -0.0109 0.0358  0.0273  84  THR A CB  
1423 O  OG1 . THR A 84  ? 0.2744 0.2254 0.1991 -0.0117 0.0447  -0.0061 84  THR A OG1 
1424 C  CG2 . THR A 84  ? 0.2777 0.2335 0.2044 -0.0286 0.0719  0.0254  84  THR A CG2 
1432 N  N   . GLU A 85  ? 0.2204 0.2134 0.2539 0.0573  0.0489  0.0438  85  GLU A N   
1433 C  CA  . GLU A 85  ? 0.1947 0.2156 0.2787 0.0239  0.0374  0.0241  85  GLU A CA  
1434 C  C   . GLU A 85  ? 0.2028 0.1925 0.2917 0.0278  0.0482  0.0449  85  GLU A C   
1435 O  O   . GLU A 85  ? 0.2449 0.1895 0.2850 0.0290  0.0357  0.0493  85  GLU A O   
1436 C  CB  . GLU A 85  ? 0.2165 0.2373 0.2669 0.0379  0.0166  0.0372  85  GLU A CB  
1437 C  CG  . GLU A 85  ? 0.2263 0.2795 0.2668 0.0321  0.0123  0.0552  85  GLU A CG  
1438 C  CD  . GLU A 85  ? 0.2529 0.3558 0.2792 0.0505  0.0061  0.0544  85  GLU A CD  
1439 O  OE1 . GLU A 85  ? 0.2392 0.3288 0.2769 0.0049  0.0194  0.0265  85  GLU A OE1 
1440 O  OE2 . GLU A 85  ? 0.2519 0.3812 0.2896 0.0130  0.0130  0.0872  85  GLU A OE2 
1447 N  N   . GLU A 86  ? 0.2186 0.2258 0.3169 0.0254  0.0383  0.0547  86  GLU A N   
1448 C  CA  . GLU A 86  ? 0.2103 0.2613 0.3375 0.0150  0.0393  0.0588  86  GLU A CA  
1449 C  C   . GLU A 86  ? 0.2278 0.3408 0.3324 0.0383  0.0365  0.0402  86  GLU A C   
1450 O  O   . GLU A 86  ? 0.2295 0.3673 0.3238 0.0253  0.0267  0.0799  86  GLU A O   
1451 C  CB  . GLU A 86  ? 0.2643 0.3065 0.3513 0.0363  0.0760  0.0445  86  GLU A CB  
1452 C  CG  . GLU A 86  ? 0.2825 0.3230 0.3599 0.0359  0.0709  0.0164  86  GLU A CG  
1453 C  CD  . GLU A 86  ? 0.2845 0.3260 0.3642 0.0687  0.0864  0.0310  86  GLU A CD  
1454 O  OE1 . GLU A 86  ? 0.3178 0.3176 0.3670 0.1197  0.0888  0.0297  86  GLU A OE1 
1455 O  OE2 . GLU A 86  ? 0.2866 0.3590 0.3705 0.0666  0.0734  0.0288  86  GLU A OE2 
1462 N  N   . LYS A 87  ? 0.2139 0.3281 0.3337 0.0113  0.0290  0.0288  87  LYS A N   
1463 C  CA  . LYS A 87  ? 0.2241 0.3445 0.3290 -0.0115 0.0242  0.0523  87  LYS A CA  
1464 C  C   . LYS A 87  ? 0.2654 0.3254 0.3322 -0.0157 0.0220  0.0387  87  LYS A C   
1465 O  O   . LYS A 87  ? 0.2841 0.3268 0.3580 -0.0213 0.0209  0.0230  87  LYS A O   
1466 C  CB  . LYS A 87  ? 0.2104 0.4197 0.3284 0.0099  0.0078  0.0554  87  LYS A CB  
1467 C  CG  . LYS A 87  ? 0.2374 0.5093 0.3266 0.0085  0.0022  0.0807  87  LYS A CG  
1468 C  CD  . LYS A 87  ? 0.2849 0.5979 0.3252 0.0133  -0.0039 0.0988  87  LYS A CD  
1469 C  CE  . LYS A 87  ? 0.3390 0.6677 0.3248 0.0250  -0.0109 0.1076  87  LYS A CE  
1470 N  NZ  . LYS A 87  ? 0.3201 0.6817 0.3384 0.0113  -0.0244 0.0946  87  LYS A NZ  
1484 N  N   . TYR A 88  ? 0.2286 0.2844 0.3019 -0.0051 0.0214  0.0360  88  TYR A N   
1485 C  CA  . TYR A 88  ? 0.2746 0.2659 0.2845 -0.0106 0.0075  0.0307  88  TYR A CA  
1486 C  C   . TYR A 88  ? 0.2637 0.2236 0.2866 -0.0100 0.0168  0.0239  88  TYR A C   
1487 O  O   . TYR A 88  ? 0.2869 0.2476 0.2966 -0.0099 0.0033  0.0155  88  TYR A O   
1488 C  CB  . TYR A 88  ? 0.2850 0.2923 0.2720 -0.0161 -0.0059 0.0169  88  TYR A CB  
1489 C  CG  . TYR A 88  ? 0.2870 0.3361 0.2677 0.0098  -0.0259 0.0140  88  TYR A CG  
1490 C  CD1 . TYR A 88  ? 0.2993 0.3536 0.2643 -0.0087 -0.0424 -0.0135 88  TYR A CD1 
1491 C  CD2 . TYR A 88  ? 0.2761 0.3414 0.2529 0.0206  -0.0249 0.0258  88  TYR A CD2 
1492 C  CE1 . TYR A 88  ? 0.3109 0.3985 0.2561 0.0093  -0.0384 0.0044  88  TYR A CE1 
1493 C  CE2 . TYR A 88  ? 0.2699 0.3917 0.2551 0.0039  -0.0309 0.0143  88  TYR A CE2 
1494 C  CZ  . TYR A 88  ? 0.2860 0.4213 0.2560 0.0225  -0.0460 0.0039  88  TYR A CZ  
1495 O  OH  . TYR A 88  ? 0.3068 0.4619 0.2531 0.0032  -0.0567 0.0011  88  TYR A OH  
1505 N  N   . PHE A 89  ? 0.2680 0.1862 0.2827 0.0069  0.0235  0.0311  89  PHE A N   
1506 C  CA  . PHE A 89  ? 0.2372 0.2107 0.2725 0.0258  0.0312  0.0300  89  PHE A CA  
1507 C  C   . PHE A 89  ? 0.2284 0.2335 0.2741 0.0101  0.0326  0.0301  89  PHE A C   
1508 O  O   . PHE A 89  ? 0.2440 0.2303 0.2680 0.0300  0.0305  0.0288  89  PHE A O   
1509 C  CB  . PHE A 89  ? 0.2311 0.2080 0.2563 -0.0044 0.0415  0.0167  89  PHE A CB  
1510 C  CG  . PHE A 89  ? 0.2698 0.1812 0.2458 -0.0030 0.0311  0.0164  89  PHE A CG  
1511 C  CD1 . PHE A 89  ? 0.2863 0.2058 0.2488 -0.0370 0.0168  0.0005  89  PHE A CD1 
1512 C  CD2 . PHE A 89  ? 0.2461 0.2030 0.2470 -0.0163 0.0299  0.0203  89  PHE A CD2 
1513 C  CE1 . PHE A 89  ? 0.2856 0.2138 0.2415 -0.0177 0.0285  0.0121  89  PHE A CE1 
1514 C  CE2 . PHE A 89  ? 0.2516 0.2099 0.2478 0.0078  0.0330  0.0173  89  PHE A CE2 
1515 C  CZ  . PHE A 89  ? 0.2791 0.2318 0.2482 -0.0233 0.0217  0.0057  89  PHE A CZ  
1525 N  N   . ASN A 90  ? 0.2215 0.2587 0.2818 -0.0106 0.0520  0.0500  90  ASN A N   
1526 C  CA  . ASN A 90  ? 0.2308 0.2627 0.2827 -0.0145 0.0503  0.0382  90  ASN A CA  
1527 C  C   . ASN A 90  ? 0.2260 0.2844 0.2780 0.0030  0.0665  0.0383  90  ASN A C   
1528 O  O   . ASN A 90  ? 0.2705 0.2743 0.2650 0.0261  0.0692  0.0375  90  ASN A O   
1529 C  CB  . ASN A 90  ? 0.2573 0.2708 0.3076 -0.0046 0.0619  0.0291  90  ASN A CB  
1530 C  CG  . ASN A 90  ? 0.2897 0.2922 0.3248 -0.0078 0.0617  0.0662  90  ASN A CG  
1531 O  OD1 . ASN A 90  ? 0.2772 0.2812 0.3427 -0.0273 0.0296  0.0619  90  ASN A OD1 
1532 N  ND2 . ASN A 90  ? 0.2965 0.2804 0.3271 -0.0210 0.0596  0.0821  90  ASN A ND2 
1539 N  N   . GLY A 91  ? 0.2232 0.2381 0.2899 -0.0065 0.0377  -0.0002 91  GLY A N   
1540 C  CA  . GLY A 91  ? 0.2295 0.2652 0.2964 0.0377  0.0426  0.0028  91  GLY A CA  
1541 C  C   . GLY A 91  ? 0.2182 0.2097 0.2747 0.0269  0.0580  0.0443  91  GLY A C   
1542 O  O   . GLY A 91  ? 0.2788 0.2294 0.2898 0.0418  0.0383  0.0360  91  GLY A O   
1546 N  N   . SER A 92  ? 0.2264 0.2206 0.2706 0.0407  0.0523  0.0252  92  SER A N   
1547 C  CA  . SER A 92  ? 0.2384 0.2286 0.2705 0.0244  0.0711  0.0188  92  SER A CA  
1548 C  C   . SER A 92  ? 0.2637 0.2126 0.2513 0.0382  0.0825  0.0173  92  SER A C   
1549 O  O   . SER A 92  ? 0.2554 0.2051 0.2601 0.0370  0.0815  0.0062  92  SER A O   
1550 C  CB  . SER A 92  ? 0.2542 0.2929 0.2923 -0.0048 0.0669  0.0304  92  SER A CB  
1551 O  OG  . SER A 92  ? 0.2808 0.2732 0.3091 0.0285  0.0633  0.0614  92  SER A OG  
1557 N  N   . TYR A 93  ? 0.2992 0.2136 0.2392 0.0252  0.0879  0.0164  93  TYR A N   
1558 C  CA  . TYR A 93  ? 0.2708 0.2270 0.2328 0.0349  0.0820  0.0251  93  TYR A CA  
1559 C  C   . TYR A 93  ? 0.2383 0.2322 0.2387 0.0023  0.0521  -0.0026 93  TYR A C   
1560 O  O   . TYR A 93  ? 0.2528 0.2489 0.2304 0.0318  0.0357  0.0043  93  TYR A O   
1561 C  CB  . TYR A 93  ? 0.2785 0.2065 0.2130 0.0548  0.0584  0.0034  93  TYR A CB  
1562 C  CG  . TYR A 93  ? 0.2618 0.2296 0.1992 0.0292  0.0505  -0.0053 93  TYR A CG  
1563 C  CD1 . TYR A 93  ? 0.2927 0.2766 0.1955 0.0647  0.0533  0.0160  93  TYR A CD1 
1564 C  CD2 . TYR A 93  ? 0.2929 0.2083 0.1929 0.0187  0.0340  -0.0043 93  TYR A CD2 
1565 C  CE1 . TYR A 93  ? 0.2995 0.2449 0.1931 0.0440  0.0557  0.0194  93  TYR A CE1 
1566 C  CE2 . TYR A 93  ? 0.2886 0.1964 0.1937 0.0448  0.0410  0.0022  93  TYR A CE2 
1567 C  CZ  . TYR A 93  ? 0.3027 0.1955 0.1951 0.0468  0.0564  0.0064  93  TYR A CZ  
1568 O  OH  . TYR A 93  ? 0.3287 0.2351 0.1986 0.0622  0.0402  0.0258  93  TYR A OH  
1578 N  N   . GLU A 94  ? 0.2525 0.2353 0.2501 0.0210  0.0476  0.0032  94  GLU A N   
1579 C  CA  . GLU A 94  ? 0.2593 0.2878 0.2587 0.0449  0.0796  0.0132  94  GLU A CA  
1580 C  C   . GLU A 94  ? 0.2675 0.3315 0.2566 0.0516  0.0560  0.0573  94  GLU A C   
1581 O  O   . GLU A 94  ? 0.3141 0.3802 0.2368 0.0453  0.0739  0.1004  94  GLU A O   
1582 C  CB  . GLU A 94  ? 0.3218 0.3491 0.2752 0.0373  0.0775  0.0084  94  GLU A CB  
1583 C  CG  . GLU A 94  ? 0.4331 0.4199 0.3125 0.0278  0.0438  -0.0175 94  GLU A CG  
1584 C  CD  . GLU A 94  ? 0.4994 0.5256 0.3173 0.0423  0.0310  -0.0225 94  GLU A CD  
1585 O  OE1 . GLU A 94  ? 0.5582 0.5812 0.3068 0.0821  0.0330  -0.0268 94  GLU A OE1 
1586 O  OE2 . GLU A 94  ? 0.5435 0.5899 0.3204 0.0223  0.0201  -0.0001 94  GLU A OE2 
1593 N  N   . THR A 95  ? 0.2645 0.2964 0.2737 0.0468  0.0633  0.0836  95  THR A N   
1594 C  CA  . THR A 95  ? 0.2457 0.3157 0.3019 0.0406  0.0519  0.0616  95  THR A CA  
1595 C  C   . THR A 95  ? 0.2736 0.2724 0.2641 0.0441  0.0620  0.0745  95  THR A C   
1596 O  O   . THR A 95  ? 0.3165 0.2633 0.2650 0.0466  0.0597  0.0802  95  THR A O   
1597 C  CB  . THR A 95  ? 0.2664 0.2942 0.3652 0.0590  0.0560  0.0478  95  THR A CB  
1598 O  OG1 . THR A 95  ? 0.3287 0.3349 0.4008 0.0518  0.0420  0.0346  95  THR A OG1 
1599 C  CG2 . THR A 95  ? 0.2705 0.2569 0.3834 0.0610  0.0548  0.0464  95  THR A CG2 
1607 N  N   . LEU A 96  ? 0.2759 0.2434 0.2325 0.0384  0.0778  0.0628  96  LEU A N   
1608 C  CA  . LEU A 96  ? 0.2894 0.2748 0.2055 0.0248  0.0722  0.0671  96  LEU A CA  
1609 C  C   . LEU A 96  ? 0.2817 0.3087 0.2082 0.0168  0.0647  0.0575  96  LEU A C   
1610 O  O   . LEU A 96  ? 0.3037 0.3174 0.2089 0.0375  0.0367  0.0415  96  LEU A O   
1611 C  CB  . LEU A 96  ? 0.2796 0.2659 0.1973 0.0178  0.0774  0.0624  96  LEU A CB  
1612 C  CG  . LEU A 96  ? 0.2654 0.2740 0.1901 0.0394  0.0574  0.0470  96  LEU A CG  
1613 C  CD1 . LEU A 96  ? 0.3087 0.2788 0.2089 0.0757  0.0467  0.0506  96  LEU A CD1 
1614 C  CD2 . LEU A 96  ? 0.2599 0.2894 0.1801 0.0384  0.0539  0.0762  96  LEU A CD2 
1626 N  N   . ARG A 97  ? 0.2824 0.3274 0.1995 0.0327  0.0729  0.0477  97  ARG A N   
1627 C  CA  . ARG A 97  ? 0.3053 0.3478 0.2014 0.0343  0.0731  0.0376  97  ARG A CA  
1628 C  C   . ARG A 97  ? 0.3441 0.3637 0.2139 0.0471  0.0702  0.0351  97  ARG A C   
1629 O  O   . ARG A 97  ? 0.3424 0.3810 0.2140 0.0609  0.0728  0.0349  97  ARG A O   
1630 C  CB  . ARG A 97  ? 0.3868 0.3683 0.2059 0.0885  0.0880  -0.0040 97  ARG A CB  
1631 C  CG  . ARG A 97  ? 0.4467 0.3963 0.2224 0.0911  0.1036  -0.0104 97  ARG A CG  
1632 C  CD  . ARG A 97  ? 0.4790 0.4168 0.2495 0.0189  0.0965  -0.0353 97  ARG A CD  
1633 N  NE  . ARG A 97  ? 0.4886 0.4764 0.2489 -0.0080 0.1087  -0.0419 97  ARG A NE  
1634 C  CZ  . ARG A 97  ? 0.5179 0.5219 0.2556 -0.0241 0.1017  -0.0490 97  ARG A CZ  
1635 N  NH1 . ARG A 97  ? 0.5581 0.5507 0.2674 0.0092  0.0933  -0.0456 97  ARG A NH1 
1636 N  NH2 . ARG A 97  ? 0.4984 0.5617 0.2571 -0.0518 0.1135  -0.0556 97  ARG A NH2 
1650 N  N   . LYS A 98  ? 0.3634 0.3589 0.2324 0.0442  0.0876  0.0824  98  LYS A N   
1651 C  CA  . LYS A 98  ? 0.3827 0.4242 0.2475 0.0605  0.0696  0.1115  98  LYS A CA  
1652 C  C   . LYS A 98  ? 0.3375 0.4136 0.2424 0.0415  0.0465  0.1151  98  LYS A C   
1653 O  O   . LYS A 98  ? 0.3601 0.4010 0.2496 0.0476  0.0204  0.0919  98  LYS A O   
1654 C  CB  . LYS A 98  ? 0.4333 0.4683 0.2744 0.0357  0.0602  0.1297  98  LYS A CB  
1655 C  CG  . LYS A 98  ? 0.5273 0.5312 0.3006 0.0802  0.0473  0.1549  98  LYS A CG  
1656 C  CD  . LYS A 98  ? 0.6057 0.5973 0.3249 0.1192  0.0336  0.1495  98  LYS A CD  
1657 C  CE  . LYS A 98  ? 0.6366 0.6158 0.3249 0.1427  0.0144  0.1533  98  LYS A CE  
1658 N  NZ  . LYS A 98  ? 0.6518 0.6248 0.3245 0.1538  0.0158  0.1553  98  LYS A NZ  
1672 N  N   . ILE A 99  ? 0.3149 0.3889 0.2481 0.0223  0.0342  0.1057  99  ILE A N   
1673 C  CA  . ILE A 99  ? 0.2956 0.3870 0.2417 0.0199  0.0469  0.1063  99  ILE A CA  
1674 C  C   . ILE A 99  ? 0.3274 0.3999 0.2420 0.0291  0.0401  0.1109  99  ILE A C   
1675 O  O   . ILE A 99  ? 0.3494 0.4194 0.2622 0.0386  0.0349  0.0984  99  ILE A O   
1676 C  CB  . ILE A 99  ? 0.2696 0.3992 0.2543 0.0087  0.0400  0.1008  99  ILE A CB  
1677 C  CG1 . ILE A 99  ? 0.3044 0.4214 0.2661 0.0496  0.0579  0.1170  99  ILE A CG1 
1678 C  CG2 . ILE A 99  ? 0.2981 0.4038 0.2612 0.0192  0.0284  0.0962  99  ILE A CG2 
1679 C  CD1 . ILE A 99  ? 0.3370 0.3807 0.2671 0.0278  0.0497  0.1023  99  ILE A CD1 
1691 N  N   . ALA A 100 ? 0.3350 0.3918 0.2580 0.0007  0.0347  0.1330  100 ALA A N   
1692 C  CA  . ALA A 100 ? 0.3611 0.4183 0.2702 -0.0115 0.0017  0.1319  100 ALA A CA  
1693 C  C   . ALA A 100 ? 0.4078 0.4945 0.2815 -0.0069 -0.0099 0.1008  100 ALA A C   
1694 O  O   . ALA A 100 ? 0.4478 0.5171 0.3007 0.0008  -0.0288 0.1051  100 ALA A O   
1695 C  CB  . ALA A 100 ? 0.3505 0.4104 0.2864 0.0003  -0.0025 0.1394  100 ALA A CB  
1701 N  N   . SER A 101 ? 0.4439 0.4791 0.2586 0.0109  0.0099  0.1070  101 SER A N   
1702 C  CA  . SER A 101 ? 0.4579 0.5252 0.2641 0.0436  0.0166  0.0872  101 SER A CA  
1703 C  C   . SER A 101 ? 0.4610 0.5209 0.2536 0.0294  0.0189  0.0879  101 SER A C   
1704 O  O   . SER A 101 ? 0.4983 0.5447 0.2645 0.0431  -0.0140 0.0699  101 SER A O   
1705 C  CB  . SER A 101 ? 0.4820 0.5504 0.2750 0.0787  0.0195  0.0891  101 SER A CB  
1706 O  OG  . SER A 101 ? 0.4770 0.5285 0.2776 0.0770  0.0200  0.0934  101 SER A OG  
1712 N  N   . SER A 102 ? 0.4196 0.5411 0.2413 0.0497  0.0390  0.0889  102 SER A N   
1713 C  CA  A SER A 102 ? 0.3724 0.5148 0.2335 0.0313  0.0386  0.0887  102 SER A CA  
1714 C  CA  B SER A 102 ? 0.3952 0.5141 0.2280 0.0338  0.0277  0.0956  102 SER A CA  
1715 C  C   . SER A 102 ? 0.3697 0.5015 0.2188 0.0206  0.0200  0.0683  102 SER A C   
1716 O  O   . SER A 102 ? 0.3364 0.5226 0.2160 -0.0002 -0.0166 0.0670  102 SER A O   
1717 C  CB  A SER A 102 ? 0.3303 0.4830 0.2481 0.0181  0.0568  0.0839  102 SER A CB  
1718 C  CB  B SER A 102 ? 0.3947 0.5090 0.2311 0.0266  0.0218  0.1193  102 SER A CB  
1719 O  OG  A SER A 102 ? 0.3026 0.4614 0.2690 -0.0018 0.0508  0.0771  102 SER A OG  
1720 O  OG  B SER A 102 ? 0.3992 0.5075 0.2435 0.0183  -0.0047 0.1390  102 SER A OG  
1729 N  N   . VAL A 103 ? 0.3748 0.4803 0.1932 -0.0108 0.0335  0.0441  103 VAL A N   
1730 C  CA  . VAL A 103 ? 0.3855 0.4569 0.1976 -0.0758 0.0228  0.0258  103 VAL A CA  
1731 C  C   . VAL A 103 ? 0.4076 0.4780 0.2094 -0.0565 0.0219  0.0172  103 VAL A C   
1732 O  O   . VAL A 103 ? 0.4351 0.5128 0.2306 -0.0436 0.0302  0.0454  103 VAL A O   
1733 C  CB  . VAL A 103 ? 0.4065 0.4408 0.1823 -0.0607 0.0184  0.0140  103 VAL A CB  
1734 C  CG1 . VAL A 103 ? 0.4258 0.4422 0.2032 -0.0443 0.0429  0.0049  103 VAL A CG1 
1735 C  CG2 . VAL A 103 ? 0.4056 0.4882 0.1760 -0.0442 -0.0018 0.0009  103 VAL A CG2 
1745 N  N   . SER A 104 ? 0.3808 0.4944 0.1950 -0.0977 0.0359  -0.0051 104 SER A N   
1746 C  CA  . SER A 104 ? 0.4065 0.4645 0.2124 -0.1090 0.0341  -0.0231 104 SER A CA  
1747 C  C   . SER A 104 ? 0.3701 0.4453 0.2174 -0.0980 0.0449  -0.0157 104 SER A C   
1748 O  O   . SER A 104 ? 0.4444 0.5085 0.2339 -0.0996 0.0447  -0.0167 104 SER A O   
1749 C  CB  . SER A 104 ? 0.4468 0.5302 0.2442 -0.0782 -0.0104 -0.0216 104 SER A CB  
1750 O  OG  . SER A 104 ? 0.4570 0.5507 0.2541 -0.0814 -0.0568 -0.0139 104 SER A OG  
1756 N  N   . ILE A 105 ? 0.2845 0.3844 0.1918 -0.0380 0.0200  -0.0226 105 ILE A N   
1757 C  CA  . ILE A 105 ? 0.2829 0.3718 0.1977 0.0023  0.0176  -0.0017 105 ILE A CA  
1758 C  C   . ILE A 105 ? 0.2691 0.3454 0.1811 0.0237  0.0079  -0.0271 105 ILE A C   
1759 O  O   . ILE A 105 ? 0.2875 0.3640 0.1813 0.0361  0.0188  0.0050  105 ILE A O   
1760 C  CB  . ILE A 105 ? 0.3054 0.3995 0.2086 0.0545  0.0023  0.0244  105 ILE A CB  
1761 C  CG1 . ILE A 105 ? 0.3384 0.3127 0.2184 0.0645  0.0076  0.0134  105 ILE A CG1 
1762 C  CG2 . ILE A 105 ? 0.2706 0.4724 0.2231 0.0396  0.0053  0.0522  105 ILE A CG2 
1763 C  CD1 . ILE A 105 ? 0.3834 0.3054 0.2146 0.0759  0.0350  -0.0014 105 ILE A CD1 
1775 N  N   . PRO A 106 ? 0.2700 0.3050 0.1816 0.0208  0.0131  -0.0223 106 PRO A N   
1776 C  CA  . PRO A 106 ? 0.2668 0.2868 0.1869 0.0179  0.0013  -0.0233 106 PRO A CA  
1777 C  C   . PRO A 106 ? 0.2699 0.2438 0.1772 0.0155  0.0044  -0.0099 106 PRO A C   
1778 O  O   . PRO A 106 ? 0.2943 0.2608 0.1827 0.0184  0.0054  -0.0099 106 PRO A O   
1779 C  CB  . PRO A 106 ? 0.2681 0.2870 0.1922 -0.0097 0.0107  -0.0188 106 PRO A CB  
1780 C  CG  . PRO A 106 ? 0.2911 0.3067 0.1980 0.0130  0.0198  -0.0143 106 PRO A CG  
1781 C  CD  . PRO A 106 ? 0.2962 0.3064 0.1925 0.0271  0.0202  0.0016  106 PRO A CD  
1789 N  N   . ILE A 107 ? 0.2773 0.2949 0.1811 0.0120  0.0322  0.0110  107 ILE A N   
1790 C  CA  A ILE A 107 ? 0.2789 0.2543 0.1799 0.0046  0.0350  0.0201  107 ILE A CA  
1791 C  CA  B ILE A 107 ? 0.2711 0.2659 0.1773 0.0076  0.0356  0.0134  107 ILE A CA  
1792 C  C   . ILE A 107 ? 0.2838 0.2230 0.1741 0.0093  0.0292  -0.0057 107 ILE A C   
1793 O  O   . ILE A 107 ? 0.3047 0.2162 0.1836 0.0195  0.0296  -0.0091 107 ILE A O   
1794 C  CB  A ILE A 107 ? 0.2917 0.2875 0.1867 0.0352  0.0394  0.0424  107 ILE A CB  
1795 C  CB  B ILE A 107 ? 0.2657 0.2974 0.1786 0.0210  0.0392  0.0220  107 ILE A CB  
1796 C  CG1 A ILE A 107 ? 0.3056 0.3481 0.1855 0.0612  0.0379  0.0462  107 ILE A CG1 
1797 C  CG1 B ILE A 107 ? 0.2602 0.3036 0.1728 0.0034  0.0301  0.0285  107 ILE A CG1 
1798 C  CG2 A ILE A 107 ? 0.3077 0.2941 0.1883 0.0440  0.0378  0.0764  107 ILE A CG2 
1799 C  CG2 B ILE A 107 ? 0.2858 0.3193 0.1818 0.0498  0.0443  0.0285  107 ILE A CG2 
1800 C  CD1 A ILE A 107 ? 0.3245 0.3634 0.1846 0.0451  0.0354  0.0493  107 ILE A CD1 
1801 C  CD1 B ILE A 107 ? 0.2859 0.3008 0.1785 0.0177  0.0132  0.0364  107 ILE A CD1 
1822 N  N   . LEU A 108 ? 0.2660 0.2015 0.1503 -0.0025 0.0126  -0.0307 108 LEU A N   
1823 C  CA  . LEU A 108 ? 0.2386 0.2166 0.1540 -0.0237 0.0379  -0.0082 108 LEU A CA  
1824 C  C   . LEU A 108 ? 0.2418 0.1806 0.1846 -0.0319 0.0187  -0.0039 108 LEU A C   
1825 O  O   . LEU A 108 ? 0.2294 0.2270 0.2121 -0.0146 0.0165  0.0040  108 LEU A O   
1826 C  CB  . LEU A 108 ? 0.2773 0.2785 0.1579 -0.0138 0.0356  -0.0001 108 LEU A CB  
1827 C  CG  . LEU A 108 ? 0.3298 0.3175 0.1812 0.0027  0.0455  -0.0600 108 LEU A CG  
1828 C  CD1 . LEU A 108 ? 0.3868 0.3742 0.2026 0.0008  0.0576  -0.0154 108 LEU A CD1 
1829 C  CD2 . LEU A 108 ? 0.3816 0.2499 0.1932 -0.0123 0.0533  -0.0196 108 LEU A CD2 
1841 N  N   . MET A 109 ? 0.2294 0.1852 0.1943 -0.0194 0.0429  0.0020  109 MET A N   
1842 C  CA  A MET A 109 ? 0.2362 0.1792 0.1897 -0.0170 0.0323  -0.0043 109 MET A CA  
1843 C  CA  B MET A 109 ? 0.2349 0.1949 0.1859 -0.0147 0.0371  0.0084  109 MET A CA  
1844 C  C   . MET A 109 ? 0.2408 0.1975 0.1871 -0.0032 0.0370  -0.0007 109 MET A C   
1845 O  O   . MET A 109 ? 0.2572 0.2213 0.2081 0.0092  0.0426  0.0074  109 MET A O   
1846 C  CB  A MET A 109 ? 0.2318 0.1847 0.2040 0.0044  0.0278  0.0161  109 MET A CB  
1847 C  CB  B MET A 109 ? 0.2306 0.2114 0.1858 -0.0163 0.0365  0.0283  109 MET A CB  
1848 C  CG  A MET A 109 ? 0.2535 0.2294 0.2162 0.0344  0.0271  -0.0111 109 MET A CG  
1849 C  CG  B MET A 109 ? 0.2327 0.2210 0.1859 -0.0091 0.0347  0.0357  109 MET A CG  
1850 S  SD  A MET A 109 ? 0.2899 0.2085 0.2199 0.0254  0.0312  -0.0015 109 MET A SD  
1851 S  SD  B MET A 109 ? 0.2355 0.2495 0.1807 -0.0135 0.0343  0.0457  109 MET A SD  
1852 C  CE  A MET A 109 ? 0.3447 0.2011 0.2019 0.0566  0.0499  0.0060  109 MET A CE  
1853 C  CE  B MET A 109 ? 0.2445 0.2482 0.1845 -0.0010 0.0380  0.0518  109 MET A CE  
1872 C  C   . HQA A 110 ? 0.2217 0.1928 0.1912 0.0037  0.0307  0.0278  110 HQA A C   
1873 O  O   . HQA A 110 ? 0.2491 0.1957 0.1870 -0.0005 0.0279  0.0213  110 HQA A O   
1874 C  CA  . HQA A 110 ? 0.2277 0.1761 0.1914 0.0024  0.0207  0.0056  110 HQA A CA  
1875 N  N   . HQA A 110 ? 0.2189 0.2043 0.1802 0.0131  0.0078  0.0014  110 HQA A N   
1876 C  C03 . HQA A 110 ? 0.2284 0.2053 0.1950 -0.0027 0.0170  0.0020  110 HQA A C03 
1877 C  C04 . HQA A 110 ? 0.2891 0.2617 0.2132 0.0421  0.0302  -0.0083 110 HQA A C04 
1878 C  C05 . HQA A 110 ? 0.2856 0.3261 0.2175 -0.0084 0.0491  0.0214  110 HQA A C05 
1879 N  N06 . HQA A 110 ? 0.2724 0.3576 0.2240 0.0080  0.0434  -0.0175 110 HQA A N06 
1880 C  C07 . HQA A 110 ? 0.3367 0.3855 0.2379 0.0295  0.0327  -0.0539 110 HQA A C07 
1881 C  C08 . HQA A 110 ? 0.3615 0.4663 0.2568 0.0393  0.0376  -0.0705 110 HQA A C08 
1882 O  O09 . HQA A 110 ? 0.3818 0.4451 0.2853 0.0039  0.0405  -0.0931 110 HQA A O09 
1883 C  C10 . HQA A 110 ? 0.3833 0.5327 0.2632 0.0687  0.0221  -0.0829 110 HQA A C10 
1884 C  C11 . HQA A 110 ? 0.3936 0.5654 0.2640 0.0683  0.0050  -0.0727 110 HQA A C11 
1885 C  C12 . HQA A 110 ? 0.3736 0.5175 0.2545 0.0616  0.0088  -0.0739 110 HQA A C12 
1886 C  C13 . HQA A 110 ? 0.3119 0.3775 0.2412 -0.0011 0.0128  -0.0462 110 HQA A C13 
1887 C  C14 . HQA A 110 ? 0.2932 0.3371 0.2304 0.0216  0.0209  -0.0190 110 HQA A C14 
1896 N  N   . ASP A 111 ? 0.2039 0.2212 0.1967 -0.0044 0.0609  0.0170  111 ASP A N   
1897 C  CA  . ASP A 111 ? 0.2281 0.2192 0.1927 0.0049  0.0506  0.0095  111 ASP A CA  
1898 C  C   . ASP A 111 ? 0.2252 0.2269 0.1921 0.0135  0.0475  0.0033  111 ASP A C   
1899 O  O   . ASP A 111 ? 0.2390 0.2504 0.2017 0.0193  0.0279  0.0150  111 ASP A O   
1900 C  CB  . ASP A 111 ? 0.2292 0.1972 0.1993 0.0143  0.0601  0.0267  111 ASP A CB  
1901 C  CG  . ASP A 111 ? 0.2531 0.2168 0.2070 0.0265  0.0567  0.0085  111 ASP A CG  
1902 O  OD1 . ASP A 111 ? 0.2495 0.2473 0.2363 0.0032  0.0373  0.0178  111 ASP A OD1 
1903 O  OD2 . ASP A 111 ? 0.2877 0.2178 0.2137 0.0214  0.0646  -0.0016 111 ASP A OD2 
1908 N  N   . PHE A 112 ? 0.2353 0.2412 0.1848 0.0029  0.0290  0.0241  112 PHE A N   
1909 C  CA  . PHE A 112 ? 0.2190 0.2049 0.1999 -0.0147 0.0310  0.0156  112 PHE A CA  
1910 C  C   . PHE A 112 ? 0.2578 0.1763 0.1893 0.0315  0.0412  0.0324  112 PHE A C   
1911 O  O   . PHE A 112 ? 0.2521 0.2290 0.1935 0.0379  0.0404  0.0190  112 PHE A O   
1912 C  CB  . PHE A 112 ? 0.2490 0.2375 0.2338 -0.0402 0.0309  -0.0095 112 PHE A CB  
1913 C  CG  . PHE A 112 ? 0.2777 0.2482 0.2565 -0.0231 0.0320  -0.0076 112 PHE A CG  
1914 C  CD1 . PHE A 112 ? 0.3095 0.2219 0.2803 -0.0092 0.0253  -0.0125 112 PHE A CD1 
1915 C  CD2 . PHE A 112 ? 0.2952 0.2559 0.2745 -0.0199 0.0393  -0.0241 112 PHE A CD2 
1916 C  CE1 . PHE A 112 ? 0.3550 0.2443 0.2996 -0.0244 0.0420  -0.0022 112 PHE A CE1 
1917 C  CE2 . PHE A 112 ? 0.3318 0.2718 0.2847 0.0034  0.0545  -0.0279 112 PHE A CE2 
1918 C  CZ  . PHE A 112 ? 0.3633 0.2582 0.2973 -0.0264 0.0352  -0.0261 112 PHE A CZ  
1928 N  N   . ILE A 113 ? 0.2605 0.1892 0.2003 0.0042  0.0550  0.0421  113 ILE A N   
1929 C  CA  . ILE A 113 ? 0.2838 0.1809 0.2064 0.0252  0.0554  0.0318  113 ILE A CA  
1930 C  C   . ILE A 113 ? 0.3028 0.2152 0.1993 0.0135  0.0651  0.0354  113 ILE A C   
1931 O  O   . ILE A 113 ? 0.3122 0.2171 0.2050 0.0318  0.0663  0.0269  113 ILE A O   
1932 C  CB  . ILE A 113 ? 0.2911 0.2068 0.2064 0.0129  0.0432  0.0080  113 ILE A CB  
1933 C  CG1 . ILE A 113 ? 0.3189 0.2532 0.2274 0.0001  0.0340  0.0130  113 ILE A CG1 
1934 C  CG2 . ILE A 113 ? 0.2828 0.2329 0.2025 0.0087  0.0446  -0.0164 113 ILE A CG2 
1935 C  CD1 . ILE A 113 ? 0.3541 0.3076 0.2227 -0.0161 0.0280  0.0153  113 ILE A CD1 
1947 N  N   . VAL A 114 ? 0.3177 0.1966 0.2071 0.0106  0.0439  0.0282  114 VAL A N   
1948 C  CA  . VAL A 114 ? 0.3311 0.2244 0.2257 0.0575  0.0276  0.0273  114 VAL A CA  
1949 C  C   . VAL A 114 ? 0.3223 0.2087 0.2260 0.0357  0.0436  0.0294  114 VAL A C   
1950 O  O   . VAL A 114 ? 0.3901 0.2476 0.2497 0.0696  0.0352  0.0338  114 VAL A O   
1951 C  CB  . VAL A 114 ? 0.3211 0.3015 0.2338 0.0337  -0.0047 -0.0032 114 VAL A CB  
1952 C  CG1 . VAL A 114 ? 0.3326 0.3150 0.2302 0.0402  -0.0255 -0.0110 114 VAL A CG1 
1953 C  CG2 . VAL A 114 ? 0.3133 0.3661 0.2454 0.0035  -0.0219 -0.0155 114 VAL A CG2 
1963 N  N   . LYS A 115 ? 0.3435 0.1789 0.2373 0.0329  0.0555  0.0314  115 LYS A N   
1964 C  CA  . LYS A 115 ? 0.3407 0.2050 0.2275 0.0434  0.0614  0.0428  115 LYS A CA  
1965 C  C   . LYS A 115 ? 0.3076 0.1822 0.2330 0.0274  0.0611  0.0226  115 LYS A C   
1966 O  O   . LYS A 115 ? 0.3091 0.1915 0.2310 0.0148  0.0443  0.0159  115 LYS A O   
1967 C  CB  . LYS A 115 ? 0.3615 0.2189 0.2270 0.0507  0.0402  0.0381  115 LYS A CB  
1968 C  CG  . LYS A 115 ? 0.3530 0.2289 0.2277 0.0422  0.0304  0.0318  115 LYS A CG  
1969 C  CD  . LYS A 115 ? 0.3349 0.2278 0.2346 0.0360  0.0333  0.0181  115 LYS A CD  
1970 C  CE  . LYS A 115 ? 0.2987 0.2498 0.2516 0.0320  0.0214  0.0084  115 LYS A CE  
1971 N  NZ  . LYS A 115 ? 0.3217 0.2864 0.2679 0.0380  0.0341  0.0030  115 LYS A NZ  
1985 N  N   . GLU A 116 ? 0.3089 0.1733 0.2429 0.0147  0.0738  0.0094  116 GLU A N   
1986 C  CA  . GLU A 116 ? 0.3084 0.2025 0.2506 -0.0067 0.0773  0.0305  116 GLU A CA  
1987 C  C   . GLU A 116 ? 0.3044 0.1896 0.2435 -0.0108 0.0655  0.0298  116 GLU A C   
1988 O  O   . GLU A 116 ? 0.2919 0.2034 0.2312 0.0074  0.0435  0.0020  116 GLU A O   
1989 C  CB  . GLU A 116 ? 0.3418 0.2471 0.2759 -0.0078 0.0962  0.0304  116 GLU A CB  
1990 C  CG  . GLU A 116 ? 0.3780 0.2595 0.3143 -0.0109 0.0957  0.0534  116 GLU A CG  
1991 C  CD  . GLU A 116 ? 0.4450 0.3120 0.3624 0.0189  0.1115  0.0536  116 GLU A CD  
1992 O  OE1 . GLU A 116 ? 0.4975 0.3329 0.3941 0.0407  0.1120  0.0341  116 GLU A OE1 
1993 O  OE2 . GLU A 116 ? 0.4741 0.3545 0.3918 -0.0167 0.1160  0.0533  116 GLU A OE2 
2000 N  N   . SER A 117 ? 0.3001 0.1992 0.2365 0.0170  0.0566  0.0167  117 SER A N   
2001 C  CA  . SER A 117 ? 0.2833 0.1883 0.2352 0.0157  0.0696  0.0056  117 SER A CA  
2002 C  C   . SER A 117 ? 0.2563 0.1850 0.2122 0.0039  0.0672  0.0060  117 SER A C   
2003 O  O   . SER A 117 ? 0.2625 0.2106 0.1935 0.0298  0.0645  0.0172  117 SER A O   
2004 C  CB  . SER A 117 ? 0.3033 0.1752 0.2644 0.0394  0.0710  -0.0033 117 SER A CB  
2005 O  OG  . SER A 117 ? 0.3148 0.2228 0.2964 0.0430  0.0556  -0.0119 117 SER A OG  
2011 N  N   . GLN A 118 ? 0.2524 0.1857 0.2110 0.0131  0.0594  0.0016  118 GLN A N   
2012 C  CA  . GLN A 118 ? 0.2353 0.1925 0.2134 0.0200  0.0553  0.0063  118 GLN A CA  
2013 C  C   . GLN A 118 ? 0.2575 0.1567 0.2025 0.0156  0.0652  0.0247  118 GLN A C   
2014 O  O   . GLN A 118 ? 0.2690 0.1886 0.2034 0.0175  0.0543  0.0123  118 GLN A O   
2015 C  CB  . GLN A 118 ? 0.2375 0.2092 0.2079 0.0011  0.0358  -0.0023 118 GLN A CB  
2016 C  CG  . GLN A 118 ? 0.2523 0.2234 0.1891 0.0066  0.0301  0.0069  118 GLN A CG  
2017 C  CD  . GLN A 118 ? 0.2730 0.1914 0.1822 -0.0003 0.0323  0.0234  118 GLN A CD  
2018 O  OE1 . GLN A 118 ? 0.3019 0.2109 0.2024 0.0223  0.0389  0.0278  118 GLN A OE1 
2019 N  NE2 . GLN A 118 ? 0.2827 0.2090 0.1814 0.0085  0.0295  0.0273  118 GLN A NE2 
2028 N  N   . ILE A 119 ? 0.2508 0.1995 0.1814 -0.0057 0.0600  0.0045  119 ILE A N   
2029 C  CA  . ILE A 119 ? 0.2663 0.2165 0.1835 0.0029  0.0772  0.0072  119 ILE A CA  
2030 C  C   . ILE A 119 ? 0.2756 0.2479 0.1769 0.0254  0.0709  0.0054  119 ILE A C   
2031 O  O   . ILE A 119 ? 0.2726 0.2301 0.1896 -0.0036 0.0542  -0.0107 119 ILE A O   
2032 C  CB  . ILE A 119 ? 0.2614 0.2297 0.1830 -0.0259 0.0813  0.0026  119 ILE A CB  
2033 C  CG1 . ILE A 119 ? 0.3160 0.2357 0.1690 -0.0214 0.0751  0.0065  119 ILE A CG1 
2034 C  CG2 . ILE A 119 ? 0.3084 0.2216 0.1937 -0.0247 0.0653  -0.0125 119 ILE A CG2 
2035 C  CD1 . ILE A 119 ? 0.3212 0.2554 0.1755 -0.0083 0.0580  -0.0027 119 ILE A CD1 
2047 N  N   . ASP A 120 ? 0.2419 0.2228 0.1810 0.0191  0.0601  0.0059  120 ASP A N   
2048 C  CA  . ASP A 120 ? 0.2526 0.2454 0.1996 0.0116  0.0681  -0.0049 120 ASP A CA  
2049 C  C   . ASP A 120 ? 0.2675 0.2258 0.2078 0.0091  0.0646  -0.0153 120 ASP A C   
2050 O  O   . ASP A 120 ? 0.2782 0.2306 0.2005 0.0178  0.0702  -0.0238 120 ASP A O   
2051 C  CB  . ASP A 120 ? 0.2818 0.2063 0.2260 0.0227  0.0592  -0.0191 120 ASP A CB  
2052 C  CG  . ASP A 120 ? 0.2837 0.2122 0.2641 -0.0032 0.0619  -0.0138 120 ASP A CG  
2053 O  OD1 . ASP A 120 ? 0.3088 0.2364 0.2820 0.0033  0.0760  -0.0164 120 ASP A OD1 
2054 O  OD2 . ASP A 120 ? 0.3312 0.2406 0.2949 0.0013  0.0542  -0.0100 120 ASP A OD2 
2059 N  N   . ASP A 121 ? 0.2797 0.2205 0.2016 0.0157  0.0631  0.0007  121 ASP A N   
2060 C  CA  . ASP A 121 ? 0.2597 0.2061 0.2102 0.0036  0.0717  0.0067  121 ASP A CA  
2061 C  C   . ASP A 121 ? 0.2753 0.2179 0.2056 0.0185  0.0541  0.0134  121 ASP A C   
2062 O  O   . ASP A 121 ? 0.2826 0.2351 0.1940 0.0097  0.0546  -0.0012 121 ASP A O   
2063 C  CB  . ASP A 121 ? 0.2709 0.2011 0.2194 0.0028  0.0778  0.0163  121 ASP A CB  
2064 C  CG  . ASP A 121 ? 0.3101 0.2227 0.2209 0.0459  0.0768  0.0163  121 ASP A CG  
2065 O  OD1 . ASP A 121 ? 0.2808 0.2411 0.2214 0.0421  0.0837  0.0199  121 ASP A OD1 
2066 O  OD2 . ASP A 121 ? 0.2907 0.2184 0.2265 0.0180  0.0658  -0.0061 121 ASP A OD2 
2071 N  N   . ALA A 122 ? 0.2640 0.2091 0.2083 0.0158  0.0443  0.0254  122 ALA A N   
2072 C  CA  . ALA A 122 ? 0.2627 0.2008 0.1846 0.0206  0.0617  0.0175  122 ALA A CA  
2073 C  C   . ALA A 122 ? 0.2610 0.2134 0.1807 -0.0069 0.0696  0.0379  122 ALA A C   
2074 O  O   . ALA A 122 ? 0.3205 0.2382 0.1620 0.0235  0.0479  0.0119  122 ALA A O   
2075 C  CB  . ALA A 122 ? 0.3078 0.2001 0.1704 0.0319  0.0427  0.0246  122 ALA A CB  
2081 N  N   . TYR A 123 ? 0.2766 0.2220 0.1899 0.0033  0.0751  0.0214  123 TYR A N   
2082 C  CA  . TYR A 123 ? 0.3044 0.2189 0.2054 -0.0060 0.0564  -0.0013 123 TYR A CA  
2083 C  C   . TYR A 123 ? 0.3438 0.2300 0.1897 0.0262  0.0473  -0.0044 123 TYR A C   
2084 O  O   . TYR A 123 ? 0.3630 0.2805 0.1793 0.0348  0.0412  -0.0078 123 TYR A O   
2085 C  CB  . TYR A 123 ? 0.3281 0.2719 0.2190 -0.0238 0.0403  -0.0377 123 TYR A CB  
2086 C  CG  . TYR A 123 ? 0.3697 0.2860 0.2349 -0.0479 0.0222  -0.0494 123 TYR A CG  
2087 C  CD1 . TYR A 123 ? 0.3978 0.2765 0.2444 -0.0654 0.0196  -0.0485 123 TYR A CD1 
2088 C  CD2 . TYR A 123 ? 0.3790 0.2956 0.2296 -0.0291 0.0139  -0.0541 123 TYR A CD2 
2089 C  CE1 . TYR A 123 ? 0.4569 0.2817 0.2547 -0.0602 0.0071  -0.0685 123 TYR A CE1 
2090 C  CE2 . TYR A 123 ? 0.4232 0.2950 0.2328 -0.0120 0.0070  -0.0550 123 TYR A CE2 
2091 C  CZ  . TYR A 123 ? 0.4546 0.2974 0.2582 -0.0739 -0.0212 -0.0854 123 TYR A CZ  
2092 O  OH  . TYR A 123 ? 0.5242 0.3557 0.2931 -0.0556 -0.0416 -0.0892 123 TYR A OH  
2102 N  N   . ASN A 124 ? 0.3560 0.2494 0.1887 0.0626  0.0692  -0.0117 124 ASN A N   
2103 C  CA  . ASN A 124 ? 0.3797 0.2618 0.1852 0.0969  0.0843  0.0119  124 ASN A CA  
2104 C  C   . ASN A 124 ? 0.4029 0.2716 0.1793 0.0873  0.0942  0.0083  124 ASN A C   
2105 O  O   . ASN A 124 ? 0.4528 0.3316 0.1628 0.0981  0.0882  -0.0103 124 ASN A O   
2106 C  CB  . ASN A 124 ? 0.3947 0.2970 0.2108 0.0947  0.0689  0.0028  124 ASN A CB  
2107 C  CG  . ASN A 124 ? 0.4555 0.3318 0.2431 0.1292  0.0253  -0.0091 124 ASN A CG  
2108 O  OD1 . ASN A 124 ? 0.4610 0.3097 0.2491 0.1106  0.0596  0.0191  124 ASN A OD1 
2109 N  ND2 . ASN A 124 ? 0.5444 0.3625 0.2724 0.2066  -0.0212 -0.0303 124 ASN A ND2 
2116 N  N   . LEU A 125 ? 0.3717 0.2657 0.1992 0.0730  0.0968  0.0272  125 LEU A N   
2117 C  CA  . LEU A 125 ? 0.3464 0.3062 0.2171 0.0893  0.0854  0.0394  125 LEU A CA  
2118 C  C   . LEU A 125 ? 0.3691 0.2852 0.2128 0.0923  0.0784  0.0381  125 LEU A C   
2119 O  O   . LEU A 125 ? 0.3902 0.2986 0.2398 0.0735  0.0464  0.0527  125 LEU A O   
2120 C  CB  . LEU A 125 ? 0.3100 0.3053 0.2524 0.0655  0.0900  0.0803  125 LEU A CB  
2121 C  CG  . LEU A 125 ? 0.2891 0.3697 0.2809 0.0686  0.1008  0.0943  125 LEU A CG  
2122 C  CD1 . LEU A 125 ? 0.2776 0.3313 0.3107 0.0234  0.0897  0.1029  125 LEU A CD1 
2123 C  CD2 . LEU A 125 ? 0.3262 0.4664 0.2938 0.0917  0.1005  0.0929  125 LEU A CD2 
2135 N  N   . GLY A 126 ? 0.3829 0.2590 0.2018 0.0972  0.0798  0.0254  126 GLY A N   
2136 C  CA  . GLY A 126 ? 0.3600 0.2674 0.2010 0.0837  0.0541  0.0118  126 GLY A CA  
2137 C  C   . GLY A 126 ? 0.3128 0.2557 0.2025 0.0167  0.0448  -0.0034 126 GLY A C   
2138 O  O   . GLY A 126 ? 0.3155 0.2816 0.2222 0.0356  0.0415  -0.0167 126 GLY A O   
2142 N  N   . ALA A 127 ? 0.2984 0.2575 0.2057 0.0304  0.0403  -0.0185 127 ALA A N   
2143 C  CA  . ALA A 127 ? 0.2864 0.2434 0.2032 0.0313  0.0375  -0.0183 127 ALA A CA  
2144 C  C   . ALA A 127 ? 0.3067 0.2132 0.2042 0.0219  0.0487  -0.0153 127 ALA A C   
2145 O  O   . ALA A 127 ? 0.3344 0.2072 0.2255 0.0047  0.0551  -0.0244 127 ALA A O   
2146 C  CB  . ALA A 127 ? 0.2884 0.2384 0.2089 0.0432  0.0229  -0.0333 127 ALA A CB  
2152 N  N   . ASP A 128 ? 0.2744 0.2126 0.2044 0.0062  0.0253  -0.0130 128 ASP A N   
2153 C  CA  . ASP A 128 ? 0.2541 0.2302 0.1891 -0.0326 0.0080  -0.0282 128 ASP A CA  
2154 C  C   . ASP A 128 ? 0.2477 0.2047 0.1864 -0.0591 0.0115  -0.0271 128 ASP A C   
2155 O  O   . ASP A 128 ? 0.2754 0.2624 0.1791 -0.0537 0.0153  -0.0118 128 ASP A O   
2156 C  CB  . ASP A 128 ? 0.3098 0.2791 0.1863 -0.0154 0.0066  -0.0094 128 ASP A CB  
2157 C  CG  . ASP A 128 ? 0.3595 0.2795 0.1903 -0.0249 0.0128  -0.0320 128 ASP A CG  
2158 O  OD1 . ASP A 128 ? 0.3699 0.2690 0.2007 -0.0159 -0.0089 -0.0476 128 ASP A OD1 
2159 O  OD2 . ASP A 128 ? 0.4016 0.2866 0.2104 0.0057  0.0225  -0.0320 128 ASP A OD2 
2164 N  N   . THR A 129 ? 0.2617 0.2042 0.1768 -0.0467 0.0278  -0.0127 129 THR A N   
2165 C  CA  . THR A 129 ? 0.2513 0.2398 0.1787 -0.0389 0.0471  -0.0065 129 THR A CA  
2166 C  C   . THR A 129 ? 0.2606 0.2160 0.1870 -0.0213 0.0460  0.0110  129 THR A C   
2167 O  O   . THR A 129 ? 0.2785 0.2100 0.1896 -0.0035 0.0402  0.0067  129 THR A O   
2168 C  CB  . THR A 129 ? 0.2565 0.2691 0.1907 -0.0189 0.0469  -0.0437 129 THR A CB  
2169 O  OG1 . THR A 129 ? 0.2737 0.3611 0.2022 -0.0313 0.0207  -0.0192 129 THR A OG1 
2170 C  CG2 . THR A 129 ? 0.2510 0.2831 0.1964 -0.0040 0.0678  -0.0355 129 THR A CG2 
2178 N  N   . VAL A 130 ? 0.2497 0.2038 0.1764 -0.0238 0.0507  -0.0165 130 VAL A N   
2179 C  CA  . VAL A 130 ? 0.2404 0.1956 0.1750 -0.0189 0.0525  -0.0131 130 VAL A CA  
2180 C  C   . VAL A 130 ? 0.2309 0.2219 0.1762 -0.0288 0.0454  -0.0089 130 VAL A C   
2181 O  O   . VAL A 130 ? 0.2366 0.2327 0.1991 -0.0264 0.0709  -0.0214 130 VAL A O   
2182 C  CB  . VAL A 130 ? 0.2399 0.2051 0.1679 -0.0027 0.0696  0.0096  130 VAL A CB  
2183 C  CG1 . VAL A 130 ? 0.2447 0.2492 0.1628 0.0003  0.0620  -0.0110 130 VAL A CG1 
2184 C  CG2 . VAL A 130 ? 0.3017 0.2469 0.1878 0.0204  0.0738  0.0295  130 VAL A CG2 
2194 N  N   . ALA A 131 ? 0.2380 0.2089 0.1619 -0.0298 0.0291  -0.0144 131 ALA A N   
2195 C  CA  . ALA A 131 ? 0.2774 0.1899 0.1703 0.0126  0.0245  -0.0271 131 ALA A CA  
2196 C  C   . ALA A 131 ? 0.2443 0.1950 0.1886 -0.0050 0.0422  0.0009  131 ALA A C   
2197 O  O   . ALA A 131 ? 0.2281 0.2509 0.2051 0.0084  0.0435  0.0000  131 ALA A O   
2198 C  CB  . ALA A 131 ? 0.3248 0.2227 0.1797 0.0028  0.0334  -0.0410 131 ALA A CB  
2204 N  N   . LEU A 132 ? 0.2594 0.1803 0.1865 -0.0080 0.0485  -0.0016 132 LEU A N   
2205 C  CA  . LEU A 132 ? 0.2447 0.2064 0.1899 0.0002  0.0449  -0.0012 132 LEU A CA  
2206 C  C   . LEU A 132 ? 0.2438 0.2439 0.1910 0.0021  0.0225  -0.0162 132 LEU A C   
2207 O  O   . LEU A 132 ? 0.2380 0.2730 0.1937 0.0143  0.0173  -0.0307 132 LEU A O   
2208 C  CB  . LEU A 132 ? 0.2655 0.2011 0.1862 0.0098  0.0386  0.0090  132 LEU A CB  
2209 C  CG  . LEU A 132 ? 0.2733 0.1782 0.2102 -0.0088 0.0410  0.0031  132 LEU A CG  
2210 C  CD1 . LEU A 132 ? 0.2925 0.1945 0.2124 0.0034  0.0467  -0.0015 132 LEU A CD1 
2211 C  CD2 . LEU A 132 ? 0.2897 0.2063 0.2250 0.0184  0.0388  -0.0086 132 LEU A CD2 
2223 N  N   . ILE A 133 ? 0.2492 0.2303 0.1943 0.0112  0.0242  -0.0188 133 ILE A N   
2224 C  CA  . ILE A 133 ? 0.2213 0.2161 0.1829 -0.0153 0.0067  -0.0154 133 ILE A CA  
2225 C  C   . ILE A 133 ? 0.2189 0.2430 0.1869 0.0029  0.0141  -0.0286 133 ILE A C   
2226 O  O   . ILE A 133 ? 0.2437 0.2518 0.1920 0.0202  0.0066  -0.0109 133 ILE A O   
2227 C  CB  . ILE A 133 ? 0.2378 0.2480 0.1862 -0.0033 -0.0035 -0.0053 133 ILE A CB  
2228 C  CG1 . ILE A 133 ? 0.2542 0.2396 0.1952 -0.0302 0.0201  -0.0075 133 ILE A CG1 
2229 C  CG2 . ILE A 133 ? 0.2450 0.2405 0.1855 -0.0172 0.0163  -0.0019 133 ILE A CG2 
2230 C  CD1 . ILE A 133 ? 0.2944 0.2891 0.2086 -0.0023 0.0215  -0.0076 133 ILE A CD1 
2242 N  N   . VAL A 134 ? 0.2608 0.2173 0.1924 0.0171  0.0350  -0.0169 134 VAL A N   
2243 C  CA  . VAL A 134 ? 0.2691 0.1905 0.1913 -0.0064 0.0230  -0.0023 134 VAL A CA  
2244 C  C   . VAL A 134 ? 0.2870 0.2382 0.1967 0.0134  0.0184  0.0103  134 VAL A C   
2245 O  O   . VAL A 134 ? 0.3315 0.2942 0.1923 0.0538  0.0351  0.0502  134 VAL A O   
2246 C  CB  . VAL A 134 ? 0.2872 0.2047 0.2045 0.0076  0.0383  0.0185  134 VAL A CB  
2247 C  CG1 . VAL A 134 ? 0.2950 0.1971 0.2210 0.0297  0.0285  0.0136  134 VAL A CG1 
2248 C  CG2 . VAL A 134 ? 0.2910 0.2293 0.2258 -0.0093 0.0385  0.0122  134 VAL A CG2 
2258 N  N   . LYS A 135 ? 0.2711 0.3097 0.1938 0.0099  0.0130  -0.0350 135 LYS A N   
2259 C  CA  . LYS A 135 ? 0.3003 0.3415 0.2350 0.0207  0.0002  -0.0702 135 LYS A CA  
2260 C  C   . LYS A 135 ? 0.2866 0.2965 0.2287 -0.0109 -0.0021 -0.0381 135 LYS A C   
2261 O  O   . LYS A 135 ? 0.2947 0.3354 0.2383 0.0321  -0.0282 -0.0595 135 LYS A O   
2262 C  CB  . LYS A 135 ? 0.4076 0.4170 0.2674 0.0406  -0.0103 -0.0863 135 LYS A CB  
2263 C  CG  . LYS A 135 ? 0.4968 0.4305 0.2551 0.0955  0.0510  -0.0623 135 LYS A CG  
2264 C  CD  . LYS A 135 ? 0.6038 0.5135 0.2671 0.1239  0.0373  -0.0843 135 LYS A CD  
2265 C  CE  . LYS A 135 ? 0.6853 0.5483 0.2811 0.1301  0.0310  -0.0627 135 LYS A CE  
2266 N  NZ  . LYS A 135 ? 0.7341 0.5249 0.2982 0.1222  0.0604  -0.0516 135 LYS A NZ  
2280 N  N   . ILE A 136 ? 0.2726 0.2594 0.2065 0.0005  0.0130  0.0135  136 ILE A N   
2281 C  CA  . ILE A 136 ? 0.2693 0.2674 0.2070 -0.0033 0.0191  0.0210  136 ILE A CA  
2282 C  C   . ILE A 136 ? 0.2844 0.2773 0.2029 -0.0075 0.0447  -0.0037 136 ILE A C   
2283 O  O   . ILE A 136 ? 0.3011 0.2739 0.2006 0.0098  0.0488  0.0057  136 ILE A O   
2284 C  CB  . ILE A 136 ? 0.2885 0.2555 0.2201 0.0002  0.0218  0.0198  136 ILE A CB  
2285 C  CG1 . ILE A 136 ? 0.3262 0.2730 0.2195 0.0193  0.0121  0.0177  136 ILE A CG1 
2286 C  CG2 . ILE A 136 ? 0.3061 0.2762 0.2406 -0.0202 0.0159  0.0141  136 ILE A CG2 
2287 C  CD1 . ILE A 136 ? 0.3125 0.2552 0.2430 -0.0168 0.0136  0.0062  136 ILE A CD1 
2299 N  N   . LEU A 137 ? 0.3413 0.2576 0.2164 -0.0242 0.0644  0.0016  137 LEU A N   
2300 C  CA  . LEU A 137 ? 0.3647 0.2510 0.2239 -0.0060 0.0707  -0.0045 137 LEU A CA  
2301 C  C   . LEU A 137 ? 0.3691 0.2430 0.2356 0.0246  0.0593  0.0041  137 LEU A C   
2302 O  O   . LEU A 137 ? 0.3670 0.2750 0.2513 0.0314  0.0782  0.0290  137 LEU A O   
2303 C  CB  . LEU A 137 ? 0.4023 0.2456 0.2362 -0.0123 0.0552  -0.0175 137 LEU A CB  
2304 C  CG  . LEU A 137 ? 0.4201 0.2549 0.2444 -0.0226 0.0565  -0.0130 137 LEU A CG  
2305 C  CD1 . LEU A 137 ? 0.4249 0.2818 0.2430 -0.0302 0.0437  0.0049  137 LEU A CD1 
2306 C  CD2 . LEU A 137 ? 0.4129 0.2593 0.2425 -0.0151 0.0672  -0.0173 137 LEU A CD2 
2318 N  N   . THR A 138 ? 0.3982 0.2408 0.2416 0.0358  0.0583  0.0352  138 THR A N   
2319 C  CA  . THR A 138 ? 0.4183 0.2584 0.2551 -0.0055 0.0414  0.0155  138 THR A CA  
2320 C  C   . THR A 138 ? 0.4216 0.2366 0.2331 -0.0351 0.0514  0.0198  138 THR A C   
2321 O  O   . THR A 138 ? 0.4260 0.2683 0.2081 -0.0029 0.0530  0.0309  138 THR A O   
2322 C  CB  . THR A 138 ? 0.4340 0.2734 0.2791 -0.0193 0.0060  0.0074  138 THR A CB  
2323 O  OG1 . THR A 138 ? 0.4470 0.3015 0.2864 0.0071  0.0262  0.0224  138 THR A OG1 
2324 C  CG2 . THR A 138 ? 0.5009 0.3107 0.2978 0.0144  -0.0017 -0.0118 138 THR A CG2 
2332 N  N   . GLU A 139 ? 0.4140 0.2550 0.2424 -0.0065 0.0721  0.0194  139 GLU A N   
2333 C  CA  . GLU A 139 ? 0.4077 0.2518 0.2276 -0.0451 0.0624  0.0214  139 GLU A CA  
2334 C  C   . GLU A 139 ? 0.4493 0.2469 0.2335 -0.0329 0.0615  0.0370  139 GLU A C   
2335 O  O   . GLU A 139 ? 0.4728 0.2624 0.2083 -0.0187 0.0589  0.0239  139 GLU A O   
2336 C  CB  . GLU A 139 ? 0.4036 0.3247 0.2275 -0.0240 0.0639  0.0471  139 GLU A CB  
2337 C  CG  . GLU A 139 ? 0.4102 0.3856 0.2319 0.0239  0.0659  0.0420  139 GLU A CG  
2338 C  CD  . GLU A 139 ? 0.4353 0.4623 0.2547 0.0365  0.0619  0.0437  139 GLU A CD  
2339 O  OE1 . GLU A 139 ? 0.4528 0.4999 0.2658 0.0465  0.0601  0.0262  139 GLU A OE1 
2340 O  OE2 . GLU A 139 ? 0.4490 0.5179 0.2717 0.0466  0.0505  0.0342  139 GLU A OE2 
2347 N  N   . ARG A 140 ? 0.4660 0.2160 0.2502 -0.0453 0.0638  0.0547  140 ARG A N   
2348 C  CA  . ARG A 140 ? 0.5039 0.2349 0.2668 -0.0269 0.0526  0.0167  140 ARG A CA  
2349 C  C   . ARG A 140 ? 0.4569 0.2392 0.2490 -0.0329 0.0655  -0.0008 140 ARG A C   
2350 O  O   . ARG A 140 ? 0.4770 0.2561 0.2656 -0.0405 0.0965  0.0222  140 ARG A O   
2351 C  CB  . ARG A 140 ? 0.5995 0.2949 0.2953 0.0616  0.0508  0.0113  140 ARG A CB  
2352 C  CG  . ARG A 140 ? 0.6609 0.3955 0.3265 0.1657  0.0541  -0.0095 140 ARG A CG  
2353 C  CD  . ARG A 140 ? 0.7236 0.5116 0.3556 0.2341  0.0580  -0.0250 140 ARG A CD  
2354 N  NE  . ARG A 140 ? 0.7586 0.6123 0.3783 0.2826  0.0652  -0.0235 140 ARG A NE  
2355 C  CZ  . ARG A 140 ? 0.7945 0.6796 0.3914 0.2955  0.0627  -0.0200 140 ARG A CZ  
2356 N  NH1 . ARG A 140 ? 0.8103 0.7061 0.3950 0.2941  0.0584  -0.0250 140 ARG A NH1 
2357 N  NH2 . ARG A 140 ? 0.8093 0.7067 0.3948 0.2887  0.0678  -0.0089 140 ARG A NH2 
2371 N  N   . GLU A 141 ? 0.4381 0.2258 0.2452 0.0124  0.0570  0.0060  141 GLU A N   
2372 C  CA  . GLU A 141 ? 0.4031 0.2508 0.2484 -0.0108 0.0573  -0.0102 141 GLU A CA  
2373 C  C   . GLU A 141 ? 0.3867 0.2302 0.2279 -0.0214 0.0546  -0.0120 141 GLU A C   
2374 O  O   . GLU A 141 ? 0.4114 0.2590 0.2187 -0.0383 0.0712  -0.0153 141 GLU A O   
2375 C  CB  . GLU A 141 ? 0.3956 0.3038 0.2906 -0.0077 0.0355  -0.0309 141 GLU A CB  
2376 C  CG  . GLU A 141 ? 0.4118 0.3383 0.3352 0.0120  0.0362  -0.0348 141 GLU A CG  
2377 C  CD  . GLU A 141 ? 0.3716 0.3651 0.3693 0.0113  0.0575  -0.0537 141 GLU A CD  
2378 O  OE1 . GLU A 141 ? 0.3339 0.3586 0.3655 0.0162  0.0640  -0.0868 141 GLU A OE1 
2379 O  OE2 . GLU A 141 ? 0.4003 0.3695 0.4030 0.0463  0.0566  -0.0614 141 GLU A OE2 
2386 N  N   . LEU A 142 ? 0.3683 0.2210 0.2269 -0.0235 0.0632  0.0223  142 LEU A N   
2387 C  CA  . LEU A 142 ? 0.3883 0.1983 0.2168 -0.0360 0.0599  0.0031  142 LEU A CA  
2388 C  C   . LEU A 142 ? 0.3922 0.2380 0.2136 -0.0667 0.0844  0.0003  142 LEU A C   
2389 O  O   . LEU A 142 ? 0.3936 0.2473 0.2124 -0.0230 0.0775  -0.0266 142 LEU A O   
2390 C  CB  . LEU A 142 ? 0.4388 0.2439 0.2106 0.0085  0.0675  0.0062  142 LEU A CB  
2391 C  CG  . LEU A 142 ? 0.4758 0.2713 0.2422 0.0110  0.0779  0.0132  142 LEU A CG  
2392 C  CD1 . LEU A 142 ? 0.5009 0.2851 0.2590 0.0283  0.0893  0.0658  142 LEU A CD1 
2393 C  CD2 . LEU A 142 ? 0.5171 0.2800 0.2728 0.0425  0.0738  -0.0078 142 LEU A CD2 
2405 N  N   . GLU A 143 ? 0.4197 0.2768 0.2292 -0.0914 0.0934  -0.0086 143 GLU A N   
2406 C  CA  . GLU A 143 ? 0.4272 0.3154 0.2375 -0.1273 0.1084  -0.0101 143 GLU A CA  
2407 C  C   . GLU A 143 ? 0.4316 0.2734 0.2326 -0.1085 0.0966  -0.0459 143 GLU A C   
2408 O  O   . GLU A 143 ? 0.4364 0.2738 0.2347 -0.1182 0.1038  -0.0290 143 GLU A O   
2409 C  CB  . GLU A 143 ? 0.4329 0.3748 0.2737 -0.1647 0.0900  -0.0023 143 GLU A CB  
2410 C  CG  . GLU A 143 ? 0.4490 0.4677 0.2942 -0.1041 0.0770  -0.0035 143 GLU A CG  
2411 C  CD  . GLU A 143 ? 0.4369 0.5023 0.3108 -0.0798 0.0667  -0.0125 143 GLU A CD  
2412 O  OE1 . GLU A 143 ? 0.3914 0.5155 0.3085 -0.1401 0.0395  -0.0391 143 GLU A OE1 
2413 O  OE2 . GLU A 143 ? 0.4621 0.5396 0.3278 -0.0018 0.0811  -0.0010 143 GLU A OE2 
2420 N  N   . SER A 144 ? 0.4281 0.2369 0.2257 -0.0968 0.0760  -0.0288 144 SER A N   
2421 C  CA  . SER A 144 ? 0.4327 0.2086 0.2260 -0.0538 0.0973  -0.0042 144 SER A CA  
2422 C  C   . SER A 144 ? 0.3958 0.2017 0.2158 -0.0159 0.0881  0.0003  144 SER A C   
2423 O  O   . SER A 144 ? 0.3706 0.2011 0.2246 -0.0232 0.0832  0.0002  144 SER A O   
2424 C  CB  . SER A 144 ? 0.4929 0.2630 0.2300 0.0183  0.0888  -0.0031 144 SER A CB  
2425 O  OG  . SER A 144 ? 0.5066 0.2084 0.2393 -0.0254 0.0825  -0.0348 144 SER A OG  
2431 N  N   . LEU A 145 ? 0.3187 0.2029 0.2194 -0.0286 0.0759  -0.0042 145 LEU A N   
2432 C  CA  . LEU A 145 ? 0.2970 0.1929 0.2083 -0.0536 0.0626  0.0075  145 LEU A CA  
2433 C  C   . LEU A 145 ? 0.2929 0.2277 0.2276 -0.0395 0.0780  0.0113  145 LEU A C   
2434 O  O   . LEU A 145 ? 0.2918 0.2228 0.2173 -0.0621 0.0511  0.0050  145 LEU A O   
2435 C  CB  . LEU A 145 ? 0.2914 0.2084 0.2075 -0.0047 0.0410  0.0381  145 LEU A CB  
2436 C  CG  . LEU A 145 ? 0.2978 0.2273 0.2116 0.0046  0.0437  0.0267  145 LEU A CG  
2437 C  CD1 . LEU A 145 ? 0.2926 0.2237 0.2149 0.0004  0.0420  0.0234  145 LEU A CD1 
2438 C  CD2 . LEU A 145 ? 0.2961 0.2764 0.2172 0.0067  0.0375  0.0368  145 LEU A CD2 
2450 N  N   . LEU A 146 ? 0.3041 0.2213 0.2405 -0.0477 0.0922  0.0096  146 LEU A N   
2451 C  CA  . LEU A 146 ? 0.2883 0.2296 0.2435 -0.0573 0.0773  0.0019  146 LEU A CA  
2452 C  C   . LEU A 146 ? 0.3100 0.2079 0.2354 -0.0722 0.0787  -0.0044 146 LEU A C   
2453 O  O   . LEU A 146 ? 0.3236 0.2327 0.2337 -0.0421 0.0661  -0.0101 146 LEU A O   
2454 C  CB  . LEU A 146 ? 0.2892 0.2511 0.2606 -0.0351 0.0801  -0.0255 146 LEU A CB  
2455 C  CG  . LEU A 146 ? 0.2913 0.2691 0.2741 -0.0762 0.0974  -0.0265 146 LEU A CG  
2456 C  CD1 . LEU A 146 ? 0.3086 0.2578 0.2974 -0.0587 0.0827  -0.0345 146 LEU A CD1 
2457 C  CD2 . LEU A 146 ? 0.3493 0.2972 0.2835 -0.0474 0.1112  -0.0311 146 LEU A CD2 
2469 N  N   . GLU A 147 ? 0.3355 0.2230 0.2539 -0.0691 0.0787  -0.0056 147 GLU A N   
2470 C  CA  . GLU A 147 ? 0.3251 0.2287 0.2720 -0.0865 0.0859  -0.0016 147 GLU A CA  
2471 C  C   . GLU A 147 ? 0.3200 0.2148 0.2632 -0.0965 0.0840  -0.0218 147 GLU A C   
2472 O  O   . GLU A 147 ? 0.3456 0.2307 0.2719 -0.0565 0.0906  -0.0125 147 GLU A O   
2473 C  CB  . GLU A 147 ? 0.3543 0.2386 0.3014 -0.0740 0.0701  -0.0060 147 GLU A CB  
2474 C  CG  . GLU A 147 ? 0.3822 0.2774 0.3430 -0.0434 0.0726  0.0226  147 GLU A CG  
2475 C  CD  . GLU A 147 ? 0.3483 0.2626 0.3840 -0.0625 0.0520  0.0511  147 GLU A CD  
2476 O  OE1 . GLU A 147 ? 0.3245 0.2764 0.4134 -0.0636 0.0124  0.0950  147 GLU A OE1 
2477 O  OE2 . GLU A 147 ? 0.3381 0.2658 0.3886 -0.0430 0.0732  0.0627  147 GLU A OE2 
2484 N  N   . TYR A 148 ? 0.2978 0.2157 0.2451 -0.0941 0.0835  -0.0197 148 TYR A N   
2485 C  CA  . TYR A 148 ? 0.3002 0.2193 0.2329 -0.0213 0.0818  -0.0075 148 TYR A CA  
2486 C  C   . TYR A 148 ? 0.3076 0.2030 0.2108 -0.0130 0.0686  -0.0044 148 TYR A C   
2487 O  O   . TYR A 148 ? 0.3221 0.2430 0.2068 -0.0357 0.0543  -0.0301 148 TYR A O   
2488 C  CB  . TYR A 148 ? 0.3101 0.2655 0.2399 -0.0098 0.0805  0.0020  148 TYR A CB  
2489 C  CG  . TYR A 148 ? 0.3165 0.2405 0.2487 0.0013  0.0917  0.0177  148 TYR A CG  
2490 C  CD1 . TYR A 148 ? 0.3495 0.2372 0.2564 0.0198  0.1043  0.0395  148 TYR A CD1 
2491 C  CD2 . TYR A 148 ? 0.3088 0.2378 0.2456 -0.0190 0.1006  0.0163  148 TYR A CD2 
2492 C  CE1 . TYR A 148 ? 0.3746 0.2357 0.2807 0.0212  0.1070  0.0171  148 TYR A CE1 
2493 C  CE2 . TYR A 148 ? 0.3381 0.2267 0.2609 -0.0119 0.0882  0.0030  148 TYR A CE2 
2494 C  CZ  . TYR A 148 ? 0.3742 0.2202 0.2722 0.0023  0.1194  0.0150  148 TYR A CZ  
2495 O  OH  . TYR A 148 ? 0.4161 0.2336 0.2963 0.0075  0.1306  0.0008  148 TYR A OH  
2505 N  N   . ALA A 149 ? 0.2942 0.2177 0.2267 -0.0384 0.0450  -0.0128 149 ALA A N   
2506 C  CA  . ALA A 149 ? 0.3162 0.2093 0.2277 -0.0615 0.0575  -0.0186 149 ALA A CA  
2507 C  C   . ALA A 149 ? 0.2951 0.2360 0.2237 -0.0620 0.0569  -0.0423 149 ALA A C   
2508 O  O   . ALA A 149 ? 0.3033 0.2436 0.2230 -0.0519 0.0411  -0.0385 149 ALA A O   
2509 C  CB  . ALA A 149 ? 0.3313 0.2456 0.2423 -0.0613 0.0660  -0.0046 149 ALA A CB  
2515 N  N   . ARG A 150 ? 0.3238 0.2285 0.2567 -0.0771 0.0516  -0.0375 150 ARG A N   
2516 C  CA  . ARG A 150 ? 0.3031 0.2535 0.2605 -0.0788 0.0559  -0.0366 150 ARG A CA  
2517 C  C   . ARG A 150 ? 0.3084 0.2514 0.2697 -0.0564 0.0363  -0.0454 150 ARG A C   
2518 O  O   . ARG A 150 ? 0.3208 0.2719 0.2909 -0.0899 0.0485  -0.0603 150 ARG A O   
2519 C  CB  . ARG A 150 ? 0.2902 0.2445 0.2792 -0.0779 0.0652  -0.0506 150 ARG A CB  
2520 C  CG  . ARG A 150 ? 0.3055 0.2470 0.2788 -0.0537 0.0847  -0.0297 150 ARG A CG  
2521 C  CD  . ARG A 150 ? 0.3332 0.2980 0.3001 -0.0451 0.1040  -0.0306 150 ARG A CD  
2522 N  NE  . ARG A 150 ? 0.3319 0.2391 0.2999 -0.0373 0.1092  -0.0282 150 ARG A NE  
2523 C  CZ  . ARG A 150 ? 0.3112 0.2653 0.2990 -0.0378 0.0951  -0.0393 150 ARG A CZ  
2524 N  NH1 . ARG A 150 ? 0.2862 0.2888 0.3309 -0.0674 0.1009  -0.0340 150 ARG A NH1 
2525 N  NH2 . ARG A 150 ? 0.3014 0.2580 0.2935 -0.0567 0.0675  -0.0535 150 ARG A NH2 
2539 N  N   . SER A 151 ? 0.2859 0.2515 0.2651 -0.0536 0.0248  -0.0389 151 SER A N   
2540 C  CA  . SER A 151 ? 0.3355 0.2475 0.2627 -0.0432 0.0280  -0.0400 151 SER A CA  
2541 C  C   . SER A 151 ? 0.3502 0.2360 0.2542 -0.0226 0.0288  -0.0490 151 SER A C   
2542 O  O   . SER A 151 ? 0.3731 0.2567 0.2623 -0.0312 0.0157  -0.0557 151 SER A O   
2543 C  CB  . SER A 151 ? 0.3687 0.2221 0.2769 -0.0434 0.0514  -0.0248 151 SER A CB  
2544 O  OG  . SER A 151 ? 0.3861 0.2397 0.2836 -0.0148 0.0758  -0.0034 151 SER A OG  
2550 N  N   . TYR A 152 ? 0.3261 0.2614 0.2386 -0.0314 0.0461  -0.0348 152 TYR A N   
2551 C  CA  . TYR A 152 ? 0.3102 0.2631 0.2470 -0.0436 0.0515  -0.0336 152 TYR A CA  
2552 C  C   . TYR A 152 ? 0.3085 0.3190 0.2510 -0.0427 0.0581  -0.0081 152 TYR A C   
2553 O  O   . TYR A 152 ? 0.3501 0.3969 0.2630 -0.0046 0.0609  0.0000  152 TYR A O   
2554 C  CB  . TYR A 152 ? 0.2749 0.2838 0.2540 -0.0745 0.0638  -0.0412 152 TYR A CB  
2555 C  CG  . TYR A 152 ? 0.2896 0.2776 0.2540 -0.0363 0.0794  -0.0622 152 TYR A CG  
2556 C  CD1 . TYR A 152 ? 0.3011 0.3350 0.2569 0.0190  0.0871  -0.0571 152 TYR A CD1 
2557 C  CD2 . TYR A 152 ? 0.3210 0.2830 0.2685 0.0028  0.0634  -0.0718 152 TYR A CD2 
2558 C  CE1 . TYR A 152 ? 0.2919 0.3209 0.2741 0.0033  0.0837  -0.0708 152 TYR A CE1 
2559 C  CE2 . TYR A 152 ? 0.3103 0.3229 0.2785 0.0129  0.0603  -0.0685 152 TYR A CE2 
2560 C  CZ  . TYR A 152 ? 0.2833 0.3007 0.2908 -0.0122 0.0708  -0.0625 152 TYR A CZ  
2561 O  OH  . TYR A 152 ? 0.2962 0.3143 0.3217 -0.0112 0.0687  -0.0766 152 TYR A OH  
2571 N  N   . GLY A 153 ? 0.2940 0.2812 0.2701 -0.0589 0.0401  -0.0153 153 GLY A N   
2572 C  CA  . GLY A 153 ? 0.3010 0.2863 0.2673 -0.0524 0.0262  -0.0346 153 GLY A CA  
2573 C  C   . GLY A 153 ? 0.3017 0.2783 0.2653 -0.0370 0.0212  -0.0320 153 GLY A C   
2574 O  O   . GLY A 153 ? 0.3269 0.3119 0.2819 -0.0155 -0.0027 -0.0277 153 GLY A O   
2578 N  N   . MET A 154 ? 0.2828 0.2773 0.2515 -0.0187 0.0327  -0.0218 154 MET A N   
2579 C  CA  . MET A 154 ? 0.2992 0.2256 0.2450 -0.0486 0.0300  -0.0338 154 MET A CA  
2580 C  C   . MET A 154 ? 0.3525 0.2697 0.2454 -0.0103 0.0375  -0.0127 154 MET A C   
2581 O  O   . MET A 154 ? 0.4280 0.2709 0.2557 0.0237  0.0530  -0.0098 154 MET A O   
2582 C  CB  . MET A 154 ? 0.3135 0.2531 0.2601 -0.0175 0.0347  -0.0402 154 MET A CB  
2583 C  CG  . MET A 154 ? 0.2642 0.2591 0.2676 -0.0784 0.0328  -0.0381 154 MET A CG  
2584 S  SD  . MET A 154 ? 0.3113 0.2772 0.2770 -0.0386 0.0444  -0.0432 154 MET A SD  
2585 C  CE  . MET A 154 ? 0.3636 0.3212 0.2645 -0.0429 0.0627  -0.0323 154 MET A CE  
2595 N  N   . GLU A 155 ? 0.2795 0.2606 0.2396 -0.0354 0.0430  -0.0229 155 GLU A N   
2596 C  CA  . GLU A 155 ? 0.2422 0.2461 0.2291 -0.0342 0.0402  -0.0221 155 GLU A CA  
2597 C  C   . GLU A 155 ? 0.2640 0.1906 0.2117 -0.0161 0.0343  0.0065  155 GLU A C   
2598 O  O   . GLU A 155 ? 0.2844 0.2174 0.2018 -0.0188 0.0373  -0.0077 155 GLU A O   
2599 C  CB  . GLU A 155 ? 0.2768 0.2485 0.2592 -0.0222 0.0360  -0.0406 155 GLU A CB  
2600 C  CG  . GLU A 155 ? 0.3024 0.2823 0.2764 -0.0221 0.0507  -0.0280 155 GLU A CG  
2601 C  CD  . GLU A 155 ? 0.3641 0.2934 0.3003 -0.0312 0.0724  -0.0145 155 GLU A CD  
2602 O  OE1 . GLU A 155 ? 0.3956 0.2764 0.3010 -0.0256 0.0926  -0.0012 155 GLU A OE1 
2603 O  OE2 . GLU A 155 ? 0.3711 0.2990 0.3223 -0.0496 0.0736  -0.0047 155 GLU A OE2 
2610 N  N   . PRO A 156 ? 0.2675 0.2070 0.2208 -0.0257 0.0332  0.0034  156 PRO A N   
2611 C  CA  . PRO A 156 ? 0.2630 0.1848 0.2112 -0.0384 0.0322  -0.0116 156 PRO A CA  
2612 C  C   . PRO A 156 ? 0.2573 0.1960 0.1991 -0.0397 0.0571  -0.0115 156 PRO A C   
2613 O  O   . PRO A 156 ? 0.2608 0.2419 0.2074 -0.0166 0.0403  -0.0252 156 PRO A O   
2614 C  CB  . PRO A 156 ? 0.2990 0.2368 0.2283 -0.0275 0.0090  -0.0211 156 PRO A CB  
2615 C  CG  . PRO A 156 ? 0.3441 0.2655 0.2608 0.0031  -0.0206 -0.0091 156 PRO A CG  
2616 C  CD  . PRO A 156 ? 0.3291 0.2148 0.2416 -0.0088 -0.0228 -0.0179 156 PRO A CD  
2624 N  N   . LEU A 157 ? 0.2431 0.1987 0.1874 -0.0258 0.0538  -0.0161 157 LEU A N   
2625 C  CA  . LEU A 157 ? 0.2304 0.1941 0.1863 -0.0248 0.0321  -0.0311 157 LEU A CA  
2626 C  C   . LEU A 157 ? 0.2356 0.1998 0.1819 -0.0312 0.0237  -0.0173 157 LEU A C   
2627 O  O   . LEU A 157 ? 0.2358 0.2540 0.1881 -0.0120 0.0177  -0.0102 157 LEU A O   
2628 C  CB  . LEU A 157 ? 0.2483 0.1918 0.1976 -0.0204 0.0390  -0.0147 157 LEU A CB  
2629 C  CG  . LEU A 157 ? 0.2500 0.2021 0.2132 -0.0342 0.0321  -0.0020 157 LEU A CG  
2630 C  CD1 . LEU A 157 ? 0.2455 0.2057 0.1988 -0.0242 0.0092  0.0034  157 LEU A CD1 
2631 C  CD2 . LEU A 157 ? 0.3185 0.2180 0.2437 -0.0308 0.0448  0.0126  157 LEU A CD2 
2643 N  N   . ILE A 158 ? 0.2262 0.2265 0.1793 -0.0035 0.0292  0.0054  158 ILE A N   
2644 C  CA  . ILE A 158 ? 0.2380 0.2071 0.1925 0.0020  0.0320  -0.0041 158 ILE A CA  
2645 C  C   . ILE A 158 ? 0.2202 0.2319 0.1740 -0.0148 0.0395  -0.0182 158 ILE A C   
2646 O  O   . ILE A 158 ? 0.2422 0.2190 0.1794 -0.0033 0.0411  0.0045  158 ILE A O   
2647 C  CB  . ILE A 158 ? 0.2405 0.2361 0.2135 -0.0112 0.0139  -0.0156 158 ILE A CB  
2648 C  CG1 . ILE A 158 ? 0.2906 0.2992 0.2333 0.0069  0.0166  -0.0045 158 ILE A CG1 
2649 C  CG2 . ILE A 158 ? 0.2449 0.2735 0.2091 -0.0096 0.0210  -0.0098 158 ILE A CG2 
2650 C  CD1 . ILE A 158 ? 0.3538 0.3352 0.2480 0.0292  0.0145  -0.0075 158 ILE A CD1 
2662 N  N   . GLU A 159 ? 0.2453 0.2055 0.1799 -0.0145 0.0319  -0.0174 159 GLU A N   
2663 C  CA  . GLU A 159 ? 0.2414 0.1793 0.1795 -0.0159 0.0444  -0.0207 159 GLU A CA  
2664 C  C   . GLU A 159 ? 0.2358 0.1829 0.1783 -0.0077 0.0200  0.0049  159 GLU A C   
2665 O  O   . GLU A 159 ? 0.2346 0.2026 0.1824 0.0062  0.0134  0.0204  159 GLU A O   
2666 C  CB  . GLU A 159 ? 0.3054 0.1933 0.1981 -0.0189 0.0508  -0.0187 159 GLU A CB  
2667 C  CG  . GLU A 159 ? 0.3372 0.2769 0.2367 -0.0008 0.0650  0.0155  159 GLU A CG  
2668 C  CD  . GLU A 159 ? 0.3707 0.3520 0.2588 0.0387  0.0844  0.0451  159 GLU A CD  
2669 O  OE1 . GLU A 159 ? 0.3946 0.3595 0.2559 0.0471  0.1084  0.0541  159 GLU A OE1 
2670 O  OE2 . GLU A 159 ? 0.3781 0.3614 0.2766 -0.0167 0.0726  0.0436  159 GLU A OE2 
2677 N  N   . ILE A 160 ? 0.2679 0.1915 0.1590 -0.0204 0.0519  -0.0154 160 ILE A N   
2678 C  CA  . ILE A 160 ? 0.2700 0.1695 0.1541 -0.0044 0.0390  -0.0138 160 ILE A CA  
2679 C  C   . ILE A 160 ? 0.2496 0.1953 0.1715 -0.0275 0.0247  -0.0008 160 ILE A C   
2680 O  O   . ILE A 160 ? 0.2653 0.1851 0.1902 -0.0107 0.0202  0.0020  160 ILE A O   
2681 C  CB  . ILE A 160 ? 0.2775 0.1932 0.1541 -0.0114 0.0347  -0.0128 160 ILE A CB  
2682 C  CG1 . ILE A 160 ? 0.2575 0.2715 0.1486 -0.0522 0.0368  -0.0071 160 ILE A CG1 
2683 C  CG2 . ILE A 160 ? 0.2768 0.2130 0.1638 -0.0179 0.0278  -0.0161 160 ILE A CG2 
2684 C  CD1 . ILE A 160 ? 0.3231 0.3390 0.1611 -0.0153 0.0403  0.0096  160 ILE A CD1 
2696 N  N   . ASN A 161 ? 0.2724 0.2177 0.1740 -0.0158 0.0066  -0.0219 161 ASN A N   
2697 C  CA  . ASN A 161 ? 0.2795 0.2231 0.1825 -0.0494 -0.0035 -0.0357 161 ASN A CA  
2698 C  C   . ASN A 161 ? 0.3063 0.2065 0.1994 -0.0627 0.0251  -0.0372 161 ASN A C   
2699 O  O   . ASN A 161 ? 0.3988 0.2211 0.2292 0.0032  0.0525  -0.0401 161 ASN A O   
2700 C  CB  . ASN A 161 ? 0.2800 0.2594 0.1821 -0.0691 -0.0004 -0.0131 161 ASN A CB  
2701 C  CG  . ASN A 161 ? 0.3029 0.2408 0.1868 -0.0260 -0.0269 0.0008  161 ASN A CG  
2702 O  OD1 . ASN A 161 ? 0.3430 0.2810 0.2227 -0.0091 -0.0509 -0.0261 161 ASN A OD1 
2703 N  ND2 . ASN A 161 ? 0.2916 0.2508 0.1925 -0.0286 0.0113  -0.0087 161 ASN A ND2 
2710 N  N   . ASP A 162 ? 0.3211 0.2332 0.1930 -0.0587 0.0280  -0.0175 162 ASP A N   
2711 C  CA  . ASP A 162 ? 0.3325 0.2719 0.2012 -0.0002 0.0202  -0.0226 162 ASP A CA  
2712 C  C   . ASP A 162 ? 0.3172 0.2708 0.1949 -0.0181 0.0241  0.0016  162 ASP A C   
2713 O  O   . ASP A 162 ? 0.2830 0.2614 0.1963 -0.0114 0.0221  -0.0051 162 ASP A O   
2714 C  CB  . ASP A 162 ? 0.3386 0.3152 0.2196 -0.0291 0.0073  -0.0267 162 ASP A CB  
2715 C  CG  . ASP A 162 ? 0.3516 0.3754 0.2444 -0.0192 -0.0290 -0.0255 162 ASP A CG  
2716 O  OD1 . ASP A 162 ? 0.3804 0.3410 0.2372 0.0024  -0.0206 0.0173  162 ASP A OD1 
2717 O  OD2 . ASP A 162 ? 0.3876 0.4581 0.3029 -0.0064 -0.0415 -0.0381 162 ASP A OD2 
2722 N  N   . GLU A 163 ? 0.3491 0.2889 0.1940 -0.0455 0.0464  -0.0013 163 GLU A N   
2723 C  CA  . GLU A 163 ? 0.3959 0.3266 0.1972 -0.0782 0.0910  0.0075  163 GLU A CA  
2724 C  C   . GLU A 163 ? 0.3792 0.2967 0.1945 -0.0945 0.0624  -0.0191 163 GLU A C   
2725 O  O   . GLU A 163 ? 0.4059 0.3075 0.1970 -0.0838 0.0758  -0.0087 163 GLU A O   
2726 C  CB  . GLU A 163 ? 0.4779 0.4492 0.2151 -0.0643 0.1222  0.0379  163 GLU A CB  
2727 C  CG  . GLU A 163 ? 0.5460 0.5885 0.2556 0.0068  0.1628  0.0450  163 GLU A CG  
2728 C  CD  . GLU A 163 ? 0.6012 0.7409 0.3097 0.0444  0.1845  0.0484  163 GLU A CD  
2729 O  OE1 . GLU A 163 ? 0.6149 0.8106 0.3414 0.0324  0.2092  0.0586  163 GLU A OE1 
2730 O  OE2 . GLU A 163 ? 0.6289 0.7874 0.3223 0.0419  0.1906  0.0149  163 GLU A OE2 
2737 N  N   . ASN A 164 ? 0.3731 0.3152 0.1974 -0.0744 0.0480  -0.0263 164 ASN A N   
2738 C  CA  . ASN A 164 ? 0.3743 0.2899 0.1893 -0.0673 0.0435  0.0056  164 ASN A CA  
2739 C  C   . ASN A 164 ? 0.3480 0.2843 0.1929 -0.0568 0.0353  -0.0056 164 ASN A C   
2740 O  O   . ASN A 164 ? 0.3496 0.2933 0.1909 -0.0439 0.0416  0.0071  164 ASN A O   
2741 C  CB  . ASN A 164 ? 0.4288 0.3218 0.1843 0.0106  -0.0020 0.0096  164 ASN A CB  
2742 C  CG  . ASN A 164 ? 0.4673 0.3640 0.1792 0.0126  -0.0184 0.0019  164 ASN A CG  
2743 O  OD1 . ASN A 164 ? 0.5024 0.3515 0.2091 0.0038  -0.0238 0.0176  164 ASN A OD1 
2744 N  ND2 . ASN A 164 ? 0.4808 0.3215 0.1730 -0.0096 -0.0415 0.0073  164 ASN A ND2 
2751 N  N   . ASP A 165 ? 0.3201 0.3035 0.1882 -0.0478 0.0269  -0.0007 165 ASP A N   
2752 C  CA  . ASP A 165 ? 0.3136 0.2800 0.1869 -0.0242 0.0225  -0.0278 165 ASP A CA  
2753 C  C   . ASP A 165 ? 0.2738 0.2461 0.1799 -0.0480 0.0365  -0.0171 165 ASP A C   
2754 O  O   . ASP A 165 ? 0.2710 0.2514 0.1829 -0.0508 0.0352  0.0038  165 ASP A O   
2755 C  CB  . ASP A 165 ? 0.3218 0.2720 0.1709 -0.0094 0.0124  -0.0148 165 ASP A CB  
2756 C  CG  . ASP A 165 ? 0.3337 0.2755 0.1975 0.0220  0.0080  0.0079  165 ASP A CG  
2757 O  OD1 . ASP A 165 ? 0.3223 0.3235 0.2262 -0.0179 0.0257  0.0006  165 ASP A OD1 
2758 O  OD2 . ASP A 165 ? 0.3176 0.2386 0.2098 0.0028  -0.0001 0.0116  165 ASP A OD2 
2763 N  N   . LEU A 166 ? 0.2615 0.2694 0.1894 -0.0444 0.0310  -0.0013 166 LEU A N   
2764 C  CA  . LEU A 166 ? 0.2656 0.2398 0.2189 -0.0220 0.0290  -0.0055 166 LEU A CA  
2765 C  C   . LEU A 166 ? 0.2818 0.2392 0.2172 -0.0281 0.0341  0.0054  166 LEU A C   
2766 O  O   . LEU A 166 ? 0.2926 0.2652 0.2100 -0.0441 0.0262  0.0096  166 LEU A O   
2767 C  CB  . LEU A 166 ? 0.2791 0.2757 0.2470 -0.0316 0.0401  -0.0134 166 LEU A CB  
2768 C  CG  . LEU A 166 ? 0.2877 0.2975 0.2710 -0.0345 0.0336  -0.0208 166 LEU A CG  
2769 C  CD1 . LEU A 166 ? 0.2929 0.3409 0.2854 -0.0135 -0.0094 0.0111  166 LEU A CD1 
2770 C  CD2 . LEU A 166 ? 0.2532 0.2619 0.2784 -0.0563 0.0365  -0.0356 166 LEU A CD2 
2782 N  N   . ASP A 167 ? 0.2887 0.2618 0.2130 -0.0433 0.0514  0.0022  167 ASP A N   
2783 C  CA  . ASP A 167 ? 0.3083 0.3077 0.2026 -0.0389 0.0424  0.0083  167 ASP A CA  
2784 C  C   . ASP A 167 ? 0.2956 0.2659 0.1885 -0.0768 0.0581  0.0175  167 ASP A C   
2785 O  O   . ASP A 167 ? 0.2892 0.2922 0.1830 -0.0459 0.0433  0.0067  167 ASP A O   
2786 C  CB  . ASP A 167 ? 0.3331 0.4035 0.2075 -0.0454 0.0350  -0.0171 167 ASP A CB  
2787 C  CG  . ASP A 167 ? 0.4040 0.5653 0.2379 -0.0170 0.0218  -0.0218 167 ASP A CG  
2788 O  OD1 . ASP A 167 ? 0.3834 0.5898 0.2518 0.0099  0.0470  -0.0044 167 ASP A OD1 
2789 O  OD2 . ASP A 167 ? 0.4787 0.6722 0.2358 0.0208  -0.0132 -0.0688 167 ASP A OD2 
2794 N  N   . ILE A 168 ? 0.3192 0.2666 0.1909 -0.0612 0.0529  0.0207  168 ILE A N   
2795 C  CA  . ILE A 168 ? 0.3082 0.2594 0.1876 -0.0369 0.0487  0.0164  168 ILE A CA  
2796 C  C   . ILE A 168 ? 0.2995 0.2277 0.1882 -0.0125 0.0314  0.0153  168 ILE A C   
2797 O  O   . ILE A 168 ? 0.3119 0.2494 0.1882 -0.0342 0.0291  0.0095  168 ILE A O   
2798 C  CB  . ILE A 168 ? 0.3123 0.2464 0.1904 -0.0218 0.0234  0.0370  168 ILE A CB  
2799 C  CG1 . ILE A 168 ? 0.3267 0.3028 0.2064 -0.0396 -0.0025 0.0319  168 ILE A CG1 
2800 C  CG2 . ILE A 168 ? 0.3065 0.2662 0.2015 -0.0366 0.0129  -0.0003 168 ILE A CG2 
2801 C  CD1 . ILE A 168 ? 0.3489 0.3621 0.2172 -0.0174 -0.0263 0.0420  168 ILE A CD1 
2813 N  N   . ALA A 169 ? 0.2824 0.2527 0.1727 -0.0318 0.0272  0.0071  169 ALA A N   
2814 C  CA  . ALA A 169 ? 0.2547 0.2667 0.1696 -0.0708 0.0285  0.0149  169 ALA A CA  
2815 C  C   . ALA A 169 ? 0.2522 0.2738 0.1881 -0.0545 0.0239  0.0128  169 ALA A C   
2816 O  O   . ALA A 169 ? 0.2903 0.2932 0.2012 -0.0615 0.0071  0.0059  169 ALA A O   
2817 C  CB  . ALA A 169 ? 0.2583 0.2661 0.1798 -0.0735 0.0365  0.0293  169 ALA A CB  
2823 N  N   . LEU A 170 ? 0.2783 0.2924 0.2071 -0.0572 0.0262  0.0302  170 LEU A N   
2824 C  CA  . LEU A 170 ? 0.2715 0.3256 0.2141 -0.0784 0.0330  0.0350  170 LEU A CA  
2825 C  C   . LEU A 170 ? 0.2851 0.3400 0.2175 -0.0976 0.0279  0.0175  170 LEU A C   
2826 O  O   . LEU A 170 ? 0.3008 0.3505 0.2145 -0.0995 0.0378  0.0155  170 LEU A O   
2827 C  CB  . LEU A 170 ? 0.2906 0.3279 0.2370 -0.0682 0.0310  0.0272  170 LEU A CB  
2828 C  CG  . LEU A 170 ? 0.3290 0.3569 0.2600 -0.0381 0.0586  0.0437  170 LEU A CG  
2829 C  CD1 . LEU A 170 ? 0.3350 0.3867 0.2715 0.0055  0.0515  0.0477  170 LEU A CD1 
2830 C  CD2 . LEU A 170 ? 0.3742 0.3442 0.2770 -0.0392 0.0691  0.0825  170 LEU A CD2 
2842 N  N   . ARG A 171 ? 0.3188 0.3380 0.2306 -0.1005 0.0252  0.0384  171 ARG A N   
2843 C  CA  . ARG A 171 ? 0.3575 0.2974 0.2523 -0.0975 0.0033  0.0299  171 ARG A CA  
2844 C  C   . ARG A 171 ? 0.3967 0.2298 0.2617 -0.0888 0.0156  0.0407  171 ARG A C   
2845 O  O   . ARG A 171 ? 0.4575 0.2593 0.2768 -0.0705 0.0214  0.0419  171 ARG A O   
2846 C  CB  . ARG A 171 ? 0.3783 0.3612 0.2689 -0.0966 0.0092  0.0404  171 ARG A CB  
2847 C  CG  . ARG A 171 ? 0.4185 0.4190 0.2766 -0.0069 0.0173  0.0486  171 ARG A CG  
2848 C  CD  . ARG A 171 ? 0.4084 0.4323 0.2563 0.0257  0.0315  0.0587  171 ARG A CD  
2849 N  NE  . ARG A 171 ? 0.4168 0.4201 0.2361 0.0539  0.0437  0.0689  171 ARG A NE  
2850 C  CZ  . ARG A 171 ? 0.4031 0.3527 0.1990 0.0335  0.0546  0.0515  171 ARG A CZ  
2851 N  NH1 . ARG A 171 ? 0.4181 0.2652 0.2071 0.0204  0.0319  0.0478  171 ARG A NH1 
2852 N  NH2 . ARG A 171 ? 0.4144 0.3756 0.1769 0.0643  0.0901  0.0593  171 ARG A NH2 
2866 N  N   . ILE A 172 ? 0.3789 0.2579 0.2588 -0.0715 0.0116  0.0512  172 ILE A N   
2867 C  CA  . ILE A 172 ? 0.3860 0.2752 0.2615 -0.0734 0.0056  0.0140  172 ILE A CA  
2868 C  C   . ILE A 172 ? 0.3646 0.2501 0.2523 -0.0701 -0.0012 0.0111  172 ILE A C   
2869 O  O   . ILE A 172 ? 0.4172 0.2918 0.2732 -0.0393 0.0153  0.0054  172 ILE A O   
2870 C  CB  . ILE A 172 ? 0.4253 0.3431 0.2699 -0.0100 0.0093  0.0057  172 ILE A CB  
2871 C  CG1 . ILE A 172 ? 0.4343 0.2797 0.2890 -0.0664 0.0330  0.0210  172 ILE A CG1 
2872 C  CG2 . ILE A 172 ? 0.4584 0.4407 0.2832 0.0345  0.0035  -0.0171 172 ILE A CG2 
2873 C  CD1 . ILE A 172 ? 0.4970 0.3619 0.2890 0.0267  0.0365  0.0272  172 ILE A CD1 
2885 N  N   . GLY A 173 ? 0.3295 0.2781 0.2439 -0.1065 0.0019  0.0043  173 GLY A N   
2886 C  CA  . GLY A 173 ? 0.2982 0.2845 0.2417 -0.1389 0.0141  0.0315  173 GLY A CA  
2887 C  C   . GLY A 173 ? 0.2869 0.2566 0.2130 -0.1038 0.0288  0.0190  173 GLY A C   
2888 O  O   . GLY A 173 ? 0.3421 0.2686 0.2113 -0.0370 0.0200  0.0081  173 GLY A O   
2892 N  N   . ALA A 174 ? 0.2868 0.2349 0.2106 -0.0478 0.0339  0.0099  174 ALA A N   
2893 C  CA  . ALA A 174 ? 0.2656 0.2376 0.2253 -0.0306 0.0261  0.0203  174 ALA A CA  
2894 C  C   . ALA A 174 ? 0.2676 0.2669 0.2456 -0.0172 0.0363  0.0297  174 ALA A C   
2895 O  O   . ALA A 174 ? 0.3021 0.3507 0.2659 0.0151  0.0631  0.0192  174 ALA A O   
2896 C  CB  . ALA A 174 ? 0.2810 0.2392 0.2328 -0.0545 0.0380  0.0032  174 ALA A CB  
2902 N  N   . ARG A 175 ? 0.2592 0.2362 0.2413 -0.0324 0.0306  0.0358  175 ARG A N   
2903 C  CA  A ARG A 175 ? 0.2673 0.2536 0.2626 -0.0236 0.0084  0.0443  175 ARG A CA  
2904 C  CA  B ARG A 175 ? 0.2592 0.2511 0.2534 -0.0276 0.0045  0.0312  175 ARG A CA  
2905 C  C   . ARG A 175 ? 0.2381 0.2244 0.2379 -0.0355 0.0011  0.0257  175 ARG A C   
2906 O  O   . ARG A 175 ? 0.2502 0.2572 0.2460 -0.0245 0.0016  0.0125  175 ARG A O   
2907 C  CB  A ARG A 175 ? 0.3207 0.3115 0.3050 -0.0282 -0.0018 0.0761  175 ARG A CB  
2908 C  CB  B ARG A 175 ? 0.2970 0.2931 0.2774 -0.0439 -0.0142 0.0345  175 ARG A CB  
2909 C  CG  A ARG A 175 ? 0.3757 0.3814 0.3476 -0.0038 -0.0117 0.0830  175 ARG A CG  
2910 C  CG  B ARG A 175 ? 0.3362 0.3456 0.3025 -0.0260 -0.0324 0.0096  175 ARG A CG  
2911 C  CD  A ARG A 175 ? 0.3923 0.4201 0.3738 -0.0133 -0.0122 0.1098  175 ARG A CD  
2912 C  CD  B ARG A 175 ? 0.3355 0.3557 0.3109 -0.0557 -0.0357 0.0050  175 ARG A CD  
2913 N  NE  A ARG A 175 ? 0.3990 0.4497 0.3902 -0.0133 -0.0289 0.1211  175 ARG A NE  
2914 N  NE  B ARG A 175 ? 0.3520 0.4157 0.3227 -0.0340 -0.0225 -0.0035 175 ARG A NE  
2915 C  CZ  A ARG A 175 ? 0.4149 0.4905 0.4019 0.0243  -0.0467 0.1090  175 ARG A CZ  
2916 C  CZ  B ARG A 175 ? 0.3739 0.4721 0.3215 -0.0105 -0.0238 -0.0082 175 ARG A CZ  
2917 N  NH1 A ARG A 175 ? 0.4199 0.4978 0.4082 0.0126  -0.0512 0.1149  175 ARG A NH1 
2918 N  NH1 B ARG A 175 ? 0.3854 0.4758 0.3264 -0.0077 -0.0205 -0.0046 175 ARG A NH1 
2919 N  NH2 A ARG A 175 ? 0.4218 0.5094 0.4092 0.0551  -0.0611 0.0969  175 ARG A NH2 
2920 N  NH2 B ARG A 175 ? 0.3826 0.4978 0.3142 0.0161  -0.0139 -0.0239 175 ARG A NH2 
2945 N  N   . PHE A 176 ? 0.2134 0.2062 0.2010 -0.0280 0.0087  0.0003  176 PHE A N   
2946 C  CA  . PHE A 176 ? 0.2236 0.1899 0.1849 -0.0410 0.0055  0.0040  176 PHE A CA  
2947 C  C   . PHE A 176 ? 0.2429 0.1735 0.1820 -0.0297 0.0139  -0.0004 176 PHE A C   
2948 O  O   . PHE A 176 ? 0.2513 0.2164 0.1873 0.0037  0.0314  -0.0066 176 PHE A O   
2949 C  CB  . PHE A 176 ? 0.2435 0.2058 0.1827 -0.0267 0.0142  -0.0292 176 PHE A CB  
2950 C  CG  . PHE A 176 ? 0.2306 0.1968 0.1870 -0.0180 0.0096  -0.0237 176 PHE A CG  
2951 C  CD1 . PHE A 176 ? 0.2306 0.2022 0.1805 -0.0410 0.0227  -0.0139 176 PHE A CD1 
2952 C  CD2 . PHE A 176 ? 0.2490 0.1999 0.1966 -0.0021 0.0210  -0.0074 176 PHE A CD2 
2953 C  CE1 . PHE A 176 ? 0.2327 0.1768 0.1857 -0.0117 0.0192  -0.0218 176 PHE A CE1 
2954 C  CE2 . PHE A 176 ? 0.2539 0.2153 0.1989 0.0078  0.0320  -0.0054 176 PHE A CE2 
2955 C  CZ  . PHE A 176 ? 0.2529 0.1979 0.1953 0.0037  0.0216  -0.0107 176 PHE A CZ  
2965 N  N   . ILE A 177 ? 0.2338 0.1706 0.1811 -0.0395 0.0294  -0.0102 177 ILE A N   
2966 C  CA  . ILE A 177 ? 0.2296 0.1669 0.1605 -0.0306 0.0344  -0.0102 177 ILE A CA  
2967 C  C   . ILE A 177 ? 0.2383 0.2068 0.1686 -0.0083 0.0220  -0.0213 177 ILE A C   
2968 O  O   . ILE A 177 ? 0.2463 0.2036 0.1756 -0.0090 0.0294  0.0083  177 ILE A O   
2969 C  CB  . ILE A 177 ? 0.2348 0.2327 0.1547 -0.0182 0.0403  -0.0074 177 ILE A CB  
2970 C  CG1 . ILE A 177 ? 0.2486 0.2608 0.1556 -0.0307 0.0379  0.0393  177 ILE A CG1 
2971 C  CG2 . ILE A 177 ? 0.2437 0.2555 0.1560 -0.0028 0.0382  -0.0131 177 ILE A CG2 
2972 C  CD1 . ILE A 177 ? 0.2851 0.2574 0.1577 -0.0150 0.0223  0.0105  177 ILE A CD1 
2984 N  N   . GLY A 178 ? 0.2326 0.1850 0.1691 -0.0018 0.0354  -0.0222 178 GLY A N   
2985 C  CA  . GLY A 178 ? 0.2482 0.1751 0.1706 -0.0203 0.0207  -0.0274 178 GLY A CA  
2986 C  C   . GLY A 178 ? 0.2376 0.1832 0.1823 -0.0321 0.0169  -0.0209 178 GLY A C   
2987 O  O   . GLY A 178 ? 0.2884 0.2212 0.1930 0.0182  0.0013  -0.0233 178 GLY A O   
2991 N  N   . ILE A 179 ? 0.2436 0.1747 0.1851 -0.0244 0.0073  -0.0288 179 ILE A N   
2992 C  CA  . ILE A 179 ? 0.2118 0.1859 0.1869 -0.0099 0.0155  -0.0392 179 ILE A CA  
2993 C  C   . ILE A 179 ? 0.2089 0.1826 0.2054 -0.0136 0.0092  -0.0241 179 ILE A C   
2994 O  O   . ILE A 179 ? 0.2208 0.1949 0.2143 -0.0224 0.0048  -0.0250 179 ILE A O   
2995 C  CB  . ILE A 179 ? 0.2314 0.2347 0.1929 -0.0212 0.0230  -0.0316 179 ILE A CB  
2996 C  CG1 . ILE A 179 ? 0.2436 0.2586 0.1950 -0.0270 0.0339  -0.0388 179 ILE A CG1 
2997 C  CG2 . ILE A 179 ? 0.2604 0.2330 0.1865 -0.0217 0.0215  -0.0083 179 ILE A CG2 
2998 C  CD1 . ILE A 179 ? 0.2314 0.2778 0.1895 -0.0372 0.0353  -0.0347 179 ILE A CD1 
3010 N  N   . THR A 180 ? 0.2002 0.2053 0.2041 -0.0304 0.0136  -0.0208 180 THR A N   
3011 C  CA  . THR A 180 ? 0.2098 0.2355 0.2182 -0.0285 0.0044  -0.0254 180 THR A CA  
3012 C  C   . THR A 180 ? 0.2494 0.2037 0.2009 -0.0334 0.0087  -0.0196 180 THR A C   
3013 O  O   . THR A 180 ? 0.2875 0.2371 0.1921 -0.0086 -0.0005 -0.0095 180 THR A O   
3014 C  CB  . THR A 180 ? 0.2108 0.2146 0.2294 -0.0245 0.0296  0.0191  180 THR A CB  
3015 O  OG1 . THR A 180 ? 0.2459 0.2516 0.2365 -0.0067 0.0105  -0.0045 180 THR A OG1 
3016 C  CG2 . THR A 180 ? 0.2628 0.2358 0.2468 0.0009  0.0458  0.0363  180 THR A CG2 
3024 N  N   . SER A 181 ? 0.2177 0.2187 0.2129 -0.0241 -0.0127 -0.0303 181 SER A N   
3025 C  CA  . SER A 181 ? 0.2466 0.1937 0.2276 -0.0247 -0.0240 -0.0337 181 SER A CA  
3026 C  C   . SER A 181 ? 0.2621 0.2273 0.2399 -0.0088 -0.0138 -0.0483 181 SER A C   
3027 O  O   . SER A 181 ? 0.2775 0.2469 0.2507 -0.0097 -0.0306 -0.0715 181 SER A O   
3028 C  CB  . SER A 181 ? 0.3009 0.2078 0.2450 0.0054  -0.0171 -0.0475 181 SER A CB  
3029 O  OG  . SER A 181 ? 0.3228 0.2359 0.2524 -0.0027 -0.0094 -0.0387 181 SER A OG  
3035 N  N   . ARG A 182 ? 0.2268 0.2227 0.2500 -0.0019 -0.0122 -0.0470 182 ARG A N   
3036 C  CA  . ARG A 182 ? 0.2387 0.2222 0.2527 -0.0235 -0.0181 -0.0318 182 ARG A CA  
3037 C  C   . ARG A 182 ? 0.2431 0.2209 0.2501 -0.0091 -0.0173 -0.0530 182 ARG A C   
3038 O  O   . ARG A 182 ? 0.2547 0.2222 0.2559 -0.0225 -0.0145 -0.0719 182 ARG A O   
3039 C  CB  . ARG A 182 ? 0.2448 0.2465 0.2576 -0.0295 -0.0369 -0.0353 182 ARG A CB  
3040 C  CG  . ARG A 182 ? 0.2628 0.3068 0.2650 -0.0130 -0.0350 -0.0177 182 ARG A CG  
3041 C  CD  . ARG A 182 ? 0.3159 0.3654 0.2807 0.0390  -0.0150 -0.0015 182 ARG A CD  
3042 N  NE  . ARG A 182 ? 0.3736 0.4882 0.2949 0.1074  -0.0386 0.0058  182 ARG A NE  
3043 C  CZ  . ARG A 182 ? 0.4563 0.6188 0.3319 0.1730  0.0100  0.0214  182 ARG A CZ  
3044 N  NH1 . ARG A 182 ? 0.4433 0.6686 0.3419 0.1058  0.0370  0.0211  182 ARG A NH1 
3045 N  NH2 . ARG A 182 ? 0.4912 0.6590 0.3312 0.2385  0.0189  0.0445  182 ARG A NH2 
3059 N  N   . ASP A 183 ? 0.2442 0.2305 0.2417 0.0320  -0.0201 -0.0193 183 ASP A N   
3060 C  CA  . ASP A 183 ? 0.2340 0.2386 0.2388 -0.0155 0.0025  -0.0230 183 ASP A CA  
3061 C  C   . ASP A 183 ? 0.2798 0.2541 0.2613 0.0077  -0.0042 -0.0197 183 ASP A C   
3062 O  O   . ASP A 183 ? 0.3019 0.2503 0.2800 -0.0177 0.0112  0.0040  183 ASP A O   
3063 C  CB  . ASP A 183 ? 0.2782 0.2859 0.2284 0.0259  0.0054  -0.0381 183 ASP A CB  
3064 C  CG  . ASP A 183 ? 0.3415 0.3241 0.2262 0.0762  0.0019  -0.0438 183 ASP A CG  
3065 O  OD1 . ASP A 183 ? 0.3565 0.3602 0.2415 0.0679  -0.0034 -0.0224 183 ASP A OD1 
3066 O  OD2 . ASP A 183 ? 0.3512 0.3732 0.2353 0.0180  -0.0106 -0.0166 183 ASP A OD2 
3071 N  N   . GLU A 184 ? 0.2938 0.2110 0.2504 -0.0267 0.0061  -0.0162 184 GLU A N   
3072 C  CA  . GLU A 184 ? 0.2891 0.2659 0.2657 -0.0332 -0.0018 0.0046  184 GLU A CA  
3073 C  C   . GLU A 184 ? 0.2618 0.2919 0.2752 -0.0369 0.0005  0.0131  184 GLU A C   
3074 O  O   . GLU A 184 ? 0.2627 0.3761 0.2915 -0.0084 -0.0058 0.0190  184 GLU A O   
3075 C  CB  . GLU A 184 ? 0.3087 0.3357 0.2711 -0.0058 -0.0402 -0.0186 184 GLU A CB  
3076 C  CG  . GLU A 184 ? 0.3402 0.4037 0.2829 -0.0178 -0.0470 -0.0186 184 GLU A CG  
3077 C  CD  . GLU A 184 ? 0.3687 0.4647 0.3058 -0.0288 -0.0144 0.0051  184 GLU A CD  
3078 O  OE1 . GLU A 184 ? 0.3986 0.5506 0.3356 -0.0404 -0.0142 0.0474  184 GLU A OE1 
3079 O  OE2 . GLU A 184 ? 0.3991 0.4198 0.2970 -0.0279 0.0069  -0.0078 184 GLU A OE2 
3086 N  N   . GLU A 185 ? 0.2604 0.2787 0.2663 -0.0071 -0.0265 -0.0021 185 GLU A N   
3087 C  CA  . GLU A 185 ? 0.2916 0.3309 0.2918 -0.0139 -0.0101 0.0072  185 GLU A CA  
3088 C  C   . GLU A 185 ? 0.2745 0.3489 0.3007 -0.0049 -0.0232 -0.0039 185 GLU A C   
3089 O  O   . GLU A 185 ? 0.2980 0.4079 0.3309 -0.0348 -0.0371 -0.0324 185 GLU A O   
3090 C  CB  . GLU A 185 ? 0.3852 0.4442 0.3004 0.1083  0.0052  0.0406  185 GLU A CB  
3091 C  CG  . GLU A 185 ? 0.5695 0.5831 0.3212 0.2079  0.0455  0.0863  185 GLU A CG  
3092 C  CD  . GLU A 185 ? 0.7354 0.7145 0.3409 0.3214  0.0863  0.1161  185 GLU A CD  
3093 O  OE1 . GLU A 185 ? 0.8065 0.7777 0.3517 0.3583  0.0890  0.1244  185 GLU A OE1 
3094 O  OE2 . GLU A 185 ? 0.7775 0.7790 0.3564 0.3377  0.1185  0.1387  185 GLU A OE2 
3101 N  N   . THR A 186 ? 0.2605 0.3121 0.2922 0.0015  -0.0356 -0.0069 186 THR A N   
3102 C  CA  . THR A 186 ? 0.2609 0.2824 0.2896 -0.0417 -0.0389 0.0025  186 THR A CA  
3103 C  C   . THR A 186 ? 0.2691 0.2614 0.2908 -0.0756 -0.0422 -0.0100 186 THR A C   
3104 O  O   . THR A 186 ? 0.3054 0.3188 0.2806 -0.0873 -0.0478 -0.0200 186 THR A O   
3105 C  CB  . THR A 186 ? 0.3209 0.2863 0.2810 0.0137  -0.0494 -0.0162 186 THR A CB  
3106 O  OG1 . THR A 186 ? 0.3114 0.2564 0.2694 -0.0127 -0.0283 -0.0145 186 THR A OG1 
3107 C  CG2 . THR A 186 ? 0.3867 0.3480 0.2940 0.1028  -0.0437 -0.0172 186 THR A CG2 
3115 N  N   . LEU A 187 ? 0.2910 0.2674 0.2911 -0.0235 -0.0572 -0.0015 187 LEU A N   
3116 C  CA  . LEU A 187 ? 0.3257 0.2749 0.3160 -0.0473 -0.0586 0.0149  187 LEU A CA  
3117 C  C   . LEU A 187 ? 0.3499 0.2118 0.3303 -0.0468 -0.0826 -0.0128 187 LEU A C   
3118 O  O   . LEU A 187 ? 0.4038 0.2286 0.3359 -0.0374 -0.0873 0.0149  187 LEU A O   
3119 C  CB  . LEU A 187 ? 0.3466 0.3107 0.3241 -0.0804 -0.0406 0.0367  187 LEU A CB  
3120 C  CG  . LEU A 187 ? 0.3597 0.3378 0.3340 -0.1074 -0.0246 0.0494  187 LEU A CG  
3121 C  CD1 . LEU A 187 ? 0.3581 0.4108 0.3390 -0.1145 -0.0292 0.0383  187 LEU A CD1 
3122 C  CD2 . LEU A 187 ? 0.3849 0.3803 0.3332 -0.0809 -0.0038 0.0693  187 LEU A CD2 
3134 N  N   . GLU A 188 ? 0.3181 0.2233 0.3182 0.0157  -0.0893 -0.0573 188 GLU A N   
3135 C  CA  A GLU A 188 ? 0.3496 0.2522 0.3265 0.0172  -0.1007 -0.0676 188 GLU A CA  
3136 C  CA  B GLU A 188 ? 0.3551 0.2789 0.3312 0.0345  -0.0899 -0.0594 188 GLU A CA  
3137 C  C   . GLU A 188 ? 0.3620 0.2387 0.3319 0.0035  -0.0967 -0.0768 188 GLU A C   
3138 O  O   . GLU A 188 ? 0.3986 0.2562 0.3415 0.0297  -0.0962 -0.0846 188 GLU A O   
3139 C  CB  A GLU A 188 ? 0.3213 0.2614 0.3251 -0.0120 -0.1144 -0.0792 188 GLU A CB  
3140 C  CB  B GLU A 188 ? 0.3439 0.3292 0.3386 0.0391  -0.0756 -0.0466 188 GLU A CB  
3141 C  CG  A GLU A 188 ? 0.2994 0.2258 0.3265 -0.0675 -0.1171 -0.0744 188 GLU A CG  
3142 C  CG  B GLU A 188 ? 0.3592 0.3481 0.3506 0.0511  -0.0499 -0.0095 188 GLU A CG  
3143 C  CD  A GLU A 188 ? 0.3453 0.2638 0.3340 -0.0479 -0.1192 -0.0603 188 GLU A CD  
3144 C  CD  B GLU A 188 ? 0.3726 0.3641 0.3574 0.0286  -0.0198 0.0219  188 GLU A CD  
3145 O  OE1 A GLU A 188 ? 0.3519 0.3036 0.3417 -0.0335 -0.1250 -0.0794 188 GLU A OE1 
3146 O  OE1 B GLU A 188 ? 0.3968 0.4130 0.3617 0.0336  -0.0269 -0.0004 188 GLU A OE1 
3147 O  OE2 A GLU A 188 ? 0.3869 0.2743 0.3355 -0.0509 -0.1245 -0.0204 188 GLU A OE2 
3148 O  OE2 B GLU A 188 ? 0.3735 0.3134 0.3564 -0.0224 0.0212  0.0755  188 GLU A OE2 
3161 N  N   . ILE A 189 ? 0.3542 0.2382 0.3312 0.0040  -0.0769 -0.0555 189 ILE A N   
3162 C  CA  . ILE A 189 ? 0.3401 0.2287 0.3424 -0.0031 -0.0636 -0.0466 189 ILE A CA  
3163 C  C   . ILE A 189 ? 0.3396 0.2462 0.3412 -0.0069 -0.0382 -0.0688 189 ILE A C   
3164 O  O   . ILE A 189 ? 0.3489 0.2500 0.3598 -0.0037 -0.0270 -0.0778 189 ILE A O   
3165 C  CB  . ILE A 189 ? 0.3233 0.2678 0.3688 -0.0254 -0.0895 -0.0526 189 ILE A CB  
3166 C  CG1 . ILE A 189 ? 0.3581 0.3519 0.3833 -0.0282 -0.1057 -0.0725 189 ILE A CG1 
3167 C  CG2 . ILE A 189 ? 0.3423 0.2439 0.3800 -0.0367 -0.0775 -0.0275 189 ILE A CG2 
3168 C  CD1 . ILE A 189 ? 0.4309 0.4162 0.3927 0.0406  -0.0818 -0.0689 189 ILE A CD1 
3180 N  N   . ASN A 190 ? 0.3216 0.2340 0.3109 -0.0047 -0.0477 -0.0641 190 ASN A N   
3181 C  CA  . ASN A 190 ? 0.3198 0.2542 0.2892 -0.0099 -0.0445 -0.0576 190 ASN A CA  
3182 C  C   . ASN A 190 ? 0.3105 0.2157 0.2856 -0.0138 -0.0193 -0.0634 190 ASN A C   
3183 O  O   . ASN A 190 ? 0.3198 0.2604 0.2673 -0.0102 -0.0121 -0.0712 190 ASN A O   
3184 C  CB  . ASN A 190 ? 0.3600 0.3077 0.2853 0.0115  -0.0355 -0.0622 190 ASN A CB  
3185 C  CG  . ASN A 190 ? 0.3780 0.3741 0.2809 0.0173  -0.0366 -0.1116 190 ASN A CG  
3186 O  OD1 . ASN A 190 ? 0.4125 0.3600 0.2914 0.0204  -0.0265 -0.1053 190 ASN A OD1 
3187 N  ND2 . ASN A 190 ? 0.4327 0.5403 0.2959 0.0790  -0.0294 -0.0723 190 ASN A ND2 
3194 N  N   . LYS A 191 ? 0.3047 0.2388 0.3170 -0.0124 -0.0433 -0.0694 191 LYS A N   
3195 C  CA  . LYS A 191 ? 0.2886 0.2323 0.3587 -0.0300 -0.0470 -0.0431 191 LYS A CA  
3196 C  C   . LYS A 191 ? 0.2917 0.2587 0.3506 0.0074  -0.0085 -0.0696 191 LYS A C   
3197 O  O   . LYS A 191 ? 0.2639 0.2577 0.3466 -0.0191 0.0234  -0.0637 191 LYS A O   
3198 C  CB  . LYS A 191 ? 0.3190 0.2844 0.4083 -0.0165 -0.0641 -0.0172 191 LYS A CB  
3199 C  CG  . LYS A 191 ? 0.3360 0.3651 0.4429 -0.0304 -0.0719 0.0003  191 LYS A CG  
3200 C  CD  . LYS A 191 ? 0.3597 0.3915 0.4698 -0.0227 -0.0826 -0.0094 191 LYS A CD  
3201 C  CE  . LYS A 191 ? 0.3852 0.4294 0.4986 -0.0129 -0.0961 -0.0162 191 LYS A CE  
3202 N  NZ  . LYS A 191 ? 0.4070 0.4579 0.5226 0.0137  -0.1039 -0.0404 191 LYS A NZ  
3216 N  N   . GLU A 192 ? 0.3125 0.2626 0.3459 -0.0059 -0.0113 -0.1127 192 GLU A N   
3217 C  CA  . GLU A 192 ? 0.3700 0.3233 0.3338 0.0315  0.0087  -0.1229 192 GLU A CA  
3218 C  C   . GLU A 192 ? 0.3489 0.3335 0.2993 0.0309  0.0078  -0.1377 192 GLU A C   
3219 O  O   . GLU A 192 ? 0.3371 0.3751 0.2933 0.0143  0.0038  -0.1395 192 GLU A O   
3220 C  CB  . GLU A 192 ? 0.4540 0.3739 0.3492 0.0230  0.0114  -0.1370 192 GLU A CB  
3221 C  CG  . GLU A 192 ? 0.5563 0.4249 0.3559 0.0227  0.0165  -0.1609 192 GLU A CG  
3222 C  CD  . GLU A 192 ? 0.6395 0.4926 0.3802 0.0086  0.0149  -0.1430 192 GLU A CD  
3223 O  OE1 . GLU A 192 ? 0.6811 0.4927 0.4011 -0.0625 0.0082  -0.1200 192 GLU A OE1 
3224 O  OE2 . GLU A 192 ? 0.6598 0.5083 0.3776 0.0239  0.0256  -0.1461 192 GLU A OE2 
3231 N  N   . ASN A 193 ? 0.3037 0.3513 0.2801 0.0228  -0.0019 -0.1472 193 ASN A N   
3232 C  CA  . ASN A 193 ? 0.3074 0.3400 0.2838 0.0052  -0.0073 -0.1234 193 ASN A CA  
3233 C  C   . ASN A 193 ? 0.2823 0.3026 0.2705 -0.0162 0.0118  -0.0868 193 ASN A C   
3234 O  O   . ASN A 193 ? 0.3086 0.3160 0.2610 -0.0009 0.0298  -0.0781 193 ASN A O   
3235 C  CB  . ASN A 193 ? 0.3338 0.3873 0.3144 -0.0106 -0.0216 -0.1188 193 ASN A CB  
3236 C  CG  . ASN A 193 ? 0.4095 0.5698 0.3422 0.0296  -0.0090 -0.1113 193 ASN A CG  
3237 O  OD1 . ASN A 193 ? 0.4473 0.6329 0.3399 0.0624  -0.0069 -0.0822 193 ASN A OD1 
3238 N  ND2 . ASN A 193 ? 0.4696 0.6490 0.3647 0.0579  -0.0077 -0.0964 193 ASN A ND2 
3245 N  N   . GLN A 194 ? 0.2719 0.2587 0.2613 -0.0337 0.0271  -0.0563 194 GLN A N   
3246 C  CA  . GLN A 194 ? 0.2917 0.2236 0.2631 -0.0004 0.0227  -0.0602 194 GLN A CA  
3247 C  C   . GLN A 194 ? 0.2990 0.2393 0.2597 -0.0295 0.0279  -0.0690 194 GLN A C   
3248 O  O   . GLN A 194 ? 0.3033 0.2734 0.2292 -0.0288 0.0331  -0.0501 194 GLN A O   
3249 C  CB  . GLN A 194 ? 0.2929 0.2165 0.2566 -0.0036 0.0290  -0.0576 194 GLN A CB  
3250 C  CG  . GLN A 194 ? 0.3126 0.1862 0.2578 0.0150  0.0370  -0.0471 194 GLN A CG  
3251 C  CD  . GLN A 194 ? 0.3019 0.2001 0.2645 0.0124  0.0126  -0.0348 194 GLN A CD  
3252 O  OE1 . GLN A 194 ? 0.3256 0.2302 0.2808 0.0324  -0.0034 -0.0435 194 GLN A OE1 
3253 N  NE2 . GLN A 194 ? 0.2520 0.2141 0.2590 -0.0074 0.0154  -0.0467 194 GLN A NE2 
3262 N  N   . ARG A 195 ? 0.2734 0.2912 0.2858 -0.0308 0.0348  -0.0941 195 ARG A N   
3263 C  CA  . ARG A 195 ? 0.2902 0.2834 0.3144 -0.0209 0.0145  -0.1044 195 ARG A CA  
3264 C  C   . ARG A 195 ? 0.2782 0.2826 0.2962 -0.0250 0.0115  -0.1243 195 ARG A C   
3265 O  O   . ARG A 195 ? 0.2571 0.3192 0.3101 -0.0019 0.0440  -0.1258 195 ARG A O   
3266 C  CB  . ARG A 195 ? 0.3369 0.3386 0.3641 -0.0001 -0.0081 -0.1070 195 ARG A CB  
3267 C  CG  . ARG A 195 ? 0.4202 0.4006 0.4082 0.0377  -0.0470 -0.0963 195 ARG A CG  
3268 C  CD  . ARG A 195 ? 0.5199 0.4692 0.4540 0.0758  -0.0596 -0.0796 195 ARG A CD  
3269 N  NE  . ARG A 195 ? 0.5828 0.5047 0.4881 0.0646  -0.0624 -0.0784 195 ARG A NE  
3270 C  CZ  . ARG A 195 ? 0.6113 0.5319 0.5129 0.1083  -0.0706 -0.0736 195 ARG A CZ  
3271 N  NH1 . ARG A 195 ? 0.6395 0.5606 0.5257 0.1607  -0.0840 -0.0798 195 ARG A NH1 
3272 N  NH2 . ARG A 195 ? 0.6106 0.5199 0.5219 0.1078  -0.0708 -0.0450 195 ARG A NH2 
3286 N  N   . LYS A 196 ? 0.2826 0.3309 0.2702 0.0139  0.0311  -0.1196 196 LYS A N   
3287 C  CA  . LYS A 196 ? 0.2949 0.3941 0.2543 -0.0282 0.0419  -0.0722 196 LYS A CA  
3288 C  C   . LYS A 196 ? 0.3014 0.3996 0.2356 -0.0365 0.0524  -0.0624 196 LYS A C   
3289 O  O   . LYS A 196 ? 0.3246 0.3826 0.2244 -0.0479 0.0767  -0.0678 196 LYS A O   
3290 C  CB  . LYS A 196 ? 0.4097 0.4297 0.2464 0.0047  0.0379  -0.0596 196 LYS A CB  
3291 C  CG  . LYS A 196 ? 0.5270 0.5176 0.2707 0.0409  0.0029  -0.0297 196 LYS A CG  
3292 C  CD  . LYS A 196 ? 0.6230 0.5667 0.2923 0.0628  -0.0220 -0.0124 196 LYS A CD  
3293 C  CE  . LYS A 196 ? 0.6864 0.6138 0.2994 0.0907  -0.0228 -0.0102 196 LYS A CE  
3294 N  NZ  . LYS A 196 ? 0.7132 0.6127 0.2977 0.1068  -0.0139 -0.0251 196 LYS A NZ  
3308 N  N   . LEU A 197 ? 0.2792 0.3558 0.2315 -0.0153 0.0474  -0.0552 197 LEU A N   
3309 C  CA  . LEU A 197 ? 0.2673 0.3137 0.2342 -0.0247 0.0467  -0.0751 197 LEU A CA  
3310 C  C   . LEU A 197 ? 0.2581 0.3292 0.2367 -0.0166 0.0574  -0.0516 197 LEU A C   
3311 O  O   . LEU A 197 ? 0.2597 0.3409 0.2352 -0.0201 0.0593  -0.0403 197 LEU A O   
3312 C  CB  . LEU A 197 ? 0.2755 0.2747 0.2440 -0.0302 0.0464  -0.0512 197 LEU A CB  
3313 C  CG  . LEU A 197 ? 0.2913 0.3275 0.2648 -0.0337 0.0554  -0.0332 197 LEU A CG  
3314 C  CD1 . LEU A 197 ? 0.3232 0.3765 0.2772 -0.0048 0.0400  -0.0230 197 LEU A CD1 
3315 C  CD2 . LEU A 197 ? 0.2821 0.3592 0.2631 -0.0059 0.0728  -0.0296 197 LEU A CD2 
3327 N  N   . ILE A 198 ? 0.2526 0.3142 0.2316 -0.0154 0.0464  -0.0466 198 ILE A N   
3328 C  CA  . ILE A 198 ? 0.2324 0.3260 0.2488 -0.0357 0.0370  -0.0318 198 ILE A CA  
3329 C  C   . ILE A 198 ? 0.2638 0.3238 0.2637 -0.0118 0.0451  -0.0378 198 ILE A C   
3330 O  O   . ILE A 198 ? 0.2753 0.3157 0.2803 -0.0379 0.0352  -0.0484 198 ILE A O   
3331 C  CB  . ILE A 198 ? 0.2341 0.3434 0.2412 -0.0303 0.0265  -0.0417 198 ILE A CB  
3332 C  CG1 . ILE A 198 ? 0.2484 0.3128 0.2255 -0.0414 0.0217  -0.0576 198 ILE A CG1 
3333 C  CG2 . ILE A 198 ? 0.2428 0.3882 0.2322 0.0143  0.0184  -0.0409 198 ILE A CG2 
3334 C  CD1 . ILE A 198 ? 0.2780 0.3270 0.2149 -0.0549 0.0145  -0.0629 198 ILE A CD1 
3346 N  N   . SER A 199 ? 0.2640 0.3751 0.2751 0.0103  0.0715  -0.0319 199 SER A N   
3347 C  CA  . SER A 199 ? 0.2777 0.3984 0.2839 0.0025  0.0904  -0.0297 199 SER A CA  
3348 C  C   . SER A 199 ? 0.2886 0.4123 0.2773 -0.0133 0.0880  -0.0022 199 SER A C   
3349 O  O   . SER A 199 ? 0.3188 0.4362 0.2913 0.0072  0.0840  -0.0055 199 SER A O   
3350 C  CB  . SER A 199 ? 0.3000 0.4458 0.2959 0.0204  0.0759  -0.0647 199 SER A CB  
3351 O  OG  . SER A 199 ? 0.3278 0.4602 0.3140 -0.0025 0.0927  -0.0738 199 SER A OG  
3357 N  N   . MET A 200 ? 0.2727 0.3728 0.2558 -0.0253 0.0764  0.0049  200 MET A N   
3358 C  CA  . MET A 200 ? 0.3008 0.4236 0.2490 -0.0354 0.0740  0.0115  200 MET A CA  
3359 C  C   . MET A 200 ? 0.3163 0.4017 0.2660 -0.0312 0.0616  0.0230  200 MET A C   
3360 O  O   . MET A 200 ? 0.3873 0.4339 0.2705 0.0123  0.0733  0.0440  200 MET A O   
3361 C  CB  . MET A 200 ? 0.3409 0.4651 0.2509 -0.0104 0.0588  -0.0082 200 MET A CB  
3362 C  CG  . MET A 200 ? 0.3709 0.5279 0.2545 -0.0152 0.0236  -0.0410 200 MET A CG  
3363 S  SD  . MET A 200 ? 0.4690 0.6150 0.2857 0.0461  0.0090  -0.0276 200 MET A SD  
3364 C  CE  . MET A 200 ? 0.5412 0.6658 0.2982 0.1093  0.0004  -0.0245 200 MET A CE  
3374 N  N   . ILE A 201 ? 0.3022 0.3395 0.2654 -0.0455 0.0335  0.0201  201 ILE A N   
3375 C  CA  . ILE A 201 ? 0.2657 0.3138 0.2725 -0.0543 0.0383  0.0090  201 ILE A CA  
3376 C  C   . ILE A 201 ? 0.2643 0.3321 0.2975 -0.0170 0.0339  0.0197  201 ILE A C   
3377 O  O   . ILE A 201 ? 0.2816 0.3541 0.3111 -0.0200 0.0242  -0.0100 201 ILE A O   
3378 C  CB  . ILE A 201 ? 0.2478 0.2977 0.2495 -0.0369 0.0373  0.0000  201 ILE A CB  
3379 C  CG1 . ILE A 201 ? 0.2715 0.3009 0.2468 -0.0486 0.0580  0.0086  201 ILE A CG1 
3380 C  CG2 . ILE A 201 ? 0.2831 0.2647 0.2623 -0.0072 0.0326  -0.0336 201 ILE A CG2 
3381 C  CD1 . ILE A 201 ? 0.2738 0.2938 0.2513 -0.0763 0.0755  0.0142  201 ILE A CD1 
3393 N  N   . PRO A 202 ? 0.2589 0.3269 0.3200 -0.0496 0.0388  0.0394  202 PRO A N   
3394 C  CA  . PRO A 202 ? 0.2529 0.3667 0.3304 -0.0366 0.0269  0.0253  202 PRO A CA  
3395 C  C   . PRO A 202 ? 0.2370 0.4098 0.3464 -0.0572 0.0286  0.0060  202 PRO A C   
3396 O  O   . PRO A 202 ? 0.2474 0.3862 0.3410 -0.0255 0.0155  -0.0282 202 PRO A O   
3397 C  CB  . PRO A 202 ? 0.2992 0.3604 0.3285 -0.0249 0.0185  0.0300  202 PRO A CB  
3398 C  CG  . PRO A 202 ? 0.3067 0.3422 0.3244 -0.0583 0.0242  0.0528  202 PRO A CG  
3399 C  CD  . PRO A 202 ? 0.2877 0.3083 0.3180 -0.0417 0.0450  0.0721  202 PRO A CD  
3407 N  N   . SER A 203 ? 0.2451 0.5313 0.3675 -0.0493 0.0298  0.0183  203 SER A N   
3408 C  CA  . SER A 203 ? 0.2522 0.6042 0.3850 -0.0533 0.0443  0.0399  203 SER A CA  
3409 C  C   . SER A 203 ? 0.2886 0.5599 0.3802 -0.0367 0.0481  0.0357  203 SER A C   
3410 O  O   . SER A 203 ? 0.3581 0.5306 0.3870 0.0303  0.0431  0.0639  203 SER A O   
3411 C  CB  . SER A 203 ? 0.3135 0.7395 0.4122 -0.0017 0.0430  0.0505  203 SER A CB  
3412 O  OG  . SER A 203 ? 0.3944 0.8406 0.4356 0.0833  0.0263  0.0465  203 SER A OG  
3418 N  N   . ASN A 204 ? 0.2589 0.4898 0.3682 -0.1129 0.0466  0.0222  204 ASN A N   
3419 C  CA  . ASN A 204 ? 0.2856 0.4757 0.3678 -0.1192 0.0569  -0.0007 204 ASN A CA  
3420 C  C   . ASN A 204 ? 0.2719 0.4425 0.3402 -0.1197 0.0623  -0.0124 204 ASN A C   
3421 O  O   . ASN A 204 ? 0.2911 0.5075 0.3576 -0.1112 0.0591  -0.0704 204 ASN A O   
3422 C  CB  . ASN A 204 ? 0.3323 0.4515 0.3856 -0.1424 0.0466  0.0034  204 ASN A CB  
3423 C  CG  . ASN A 204 ? 0.3665 0.4520 0.3963 -0.1536 0.0264  -0.0205 204 ASN A CG  
3424 O  OD1 . ASN A 204 ? 0.3784 0.4067 0.3961 -0.1924 0.0297  -0.0241 204 ASN A OD1 
3425 N  ND2 . ASN A 204 ? 0.3612 0.4570 0.3996 -0.1401 0.0126  -0.0229 204 ASN A ND2 
3432 N  N   . VAL A 205 ? 0.2481 0.3364 0.2951 -0.1128 0.0537  0.0023  205 VAL A N   
3433 C  CA  . VAL A 205 ? 0.2384 0.2906 0.2785 -0.0848 0.0327  0.0069  205 VAL A CA  
3434 C  C   . VAL A 205 ? 0.2465 0.2759 0.2743 -0.0398 0.0312  0.0226  205 VAL A C   
3435 O  O   . VAL A 205 ? 0.2697 0.2971 0.2761 -0.0189 0.0601  0.0031  205 VAL A O   
3436 C  CB  . VAL A 205 ? 0.2287 0.3061 0.2738 -0.0702 0.0324  0.0103  205 VAL A CB  
3437 C  CG1 . VAL A 205 ? 0.2425 0.3006 0.2677 -0.0431 0.0138  -0.0160 205 VAL A CG1 
3438 C  CG2 . VAL A 205 ? 0.2440 0.3436 0.2771 -0.0473 0.0173  0.0151  205 VAL A CG2 
3448 N  N   . VAL A 206 ? 0.2105 0.2138 0.2593 -0.0231 0.0001  0.0197  206 VAL A N   
3449 C  CA  . VAL A 206 ? 0.2260 0.1910 0.2557 -0.0302 0.0127  0.0052  206 VAL A CA  
3450 C  C   . VAL A 206 ? 0.2354 0.2016 0.2424 -0.0293 0.0203  0.0087  206 VAL A C   
3451 O  O   . VAL A 206 ? 0.2472 0.2108 0.2389 -0.0314 0.0229  -0.0102 206 VAL A O   
3452 C  CB  . VAL A 206 ? 0.2410 0.2135 0.2706 -0.0623 0.0067  -0.0107 206 VAL A CB  
3453 C  CG1 . VAL A 206 ? 0.2662 0.2263 0.2782 -0.0307 0.0104  0.0134  206 VAL A CG1 
3454 C  CG2 . VAL A 206 ? 0.2631 0.2774 0.2870 -0.0366 0.0108  -0.0297 206 VAL A CG2 
3464 N  N   . LYS A 207 ? 0.2302 0.2078 0.2298 -0.0502 0.0271  -0.0009 207 LYS A N   
3465 C  CA  . LYS A 207 ? 0.2288 0.2258 0.2232 -0.0494 0.0230  -0.0083 207 LYS A CA  
3466 C  C   . LYS A 207 ? 0.2181 0.2045 0.2192 -0.0317 0.0278  -0.0030 207 LYS A C   
3467 O  O   . LYS A 207 ? 0.2145 0.2215 0.2316 -0.0152 0.0362  0.0077  207 LYS A O   
3468 C  CB  . LYS A 207 ? 0.2429 0.2323 0.2199 -0.0341 0.0424  -0.0232 207 LYS A CB  
3469 C  CG  . LYS A 207 ? 0.2498 0.2816 0.2444 -0.0183 0.0823  -0.0038 207 LYS A CG  
3470 C  CD  . LYS A 207 ? 0.2729 0.3547 0.2873 0.0226  0.0931  0.0231  207 LYS A CD  
3471 C  CE  . LYS A 207 ? 0.3026 0.3797 0.3347 0.0224  0.0846  0.0219  207 LYS A CE  
3472 N  NZ  . LYS A 207 ? 0.3174 0.3747 0.3653 0.0102  0.0684  0.0081  207 LYS A NZ  
3486 N  N   . VAL A 208 ? 0.1880 0.2087 0.1992 -0.0308 0.0288  -0.0177 208 VAL A N   
3487 C  CA  . VAL A 208 ? 0.1693 0.2133 0.2026 -0.0218 0.0365  -0.0009 208 VAL A CA  
3488 C  C   . VAL A 208 ? 0.2016 0.1993 0.1913 -0.0028 0.0233  0.0045  208 VAL A C   
3489 O  O   . VAL A 208 ? 0.2348 0.1974 0.2209 0.0008  -0.0028 -0.0087 208 VAL A O   
3490 C  CB  . VAL A 208 ? 0.1969 0.2022 0.2110 -0.0377 0.0463  0.0045  208 VAL A CB  
3491 C  CG1 . VAL A 208 ? 0.2227 0.2279 0.2089 -0.0255 0.0427  -0.0045 208 VAL A CG1 
3492 C  CG2 . VAL A 208 ? 0.2231 0.2327 0.2179 -0.0071 0.0300  -0.0109 208 VAL A CG2 
3502 N  N   . ALA A 209 ? 0.2010 0.1953 0.1904 -0.0062 -0.0002 0.0096  209 ALA A N   
3503 C  CA  . ALA A 209 ? 0.1964 0.1940 0.1927 -0.0140 -0.0069 -0.0077 209 ALA A CA  
3504 C  C   . ALA A 209 ? 0.2124 0.1924 0.1854 -0.0288 -0.0029 -0.0027 209 ALA A C   
3505 O  O   . ALA A 209 ? 0.2530 0.2284 0.1675 -0.0237 0.0141  0.0128  209 ALA A O   
3506 C  CB  . ALA A 209 ? 0.2294 0.2055 0.2130 0.0022  -0.0081 -0.0468 209 ALA A CB  
3512 N  N   . GLU A 210 ? 0.2133 0.2163 0.2052 -0.0420 0.0048  0.0143  210 GLU A N   
3513 C  CA  . GLU A 210 ? 0.2215 0.2580 0.2256 -0.0516 0.0243  0.0018  210 GLU A CA  
3514 C  C   . GLU A 210 ? 0.2271 0.2520 0.2367 -0.0186 0.0265  0.0153  210 GLU A C   
3515 O  O   . GLU A 210 ? 0.2178 0.2498 0.2257 -0.0244 0.0177  -0.0031 210 GLU A O   
3516 C  CB  . GLU A 210 ? 0.2434 0.2964 0.2707 -0.0185 0.0270  -0.0491 210 GLU A CB  
3517 C  CG  . GLU A 210 ? 0.3856 0.3955 0.3251 0.0759  0.0050  -0.0821 210 GLU A CG  
3518 C  CD  . GLU A 210 ? 0.5361 0.5081 0.3714 0.1779  0.0010  -0.0987 210 GLU A CD  
3519 O  OE1 . GLU A 210 ? 0.6190 0.5819 0.4011 0.2178  -0.0018 -0.1222 210 GLU A OE1 
3520 O  OE2 . GLU A 210 ? 0.6084 0.4813 0.3857 0.2114  -0.0111 -0.0765 210 GLU A OE2 
3527 N  N   . SER A 211 ? 0.2458 0.2496 0.2533 -0.0279 0.0114  0.0211  211 SER A N   
3528 C  CA  . SER A 211 ? 0.2596 0.2207 0.2653 -0.0293 0.0086  0.0128  211 SER A CA  
3529 C  C   . SER A 211 ? 0.2742 0.2510 0.2939 -0.0410 0.0028  0.0112  211 SER A C   
3530 O  O   . SER A 211 ? 0.3022 0.3209 0.3046 0.0324  0.0430  0.0165  211 SER A O   
3531 C  CB  . SER A 211 ? 0.2468 0.2191 0.2654 -0.0531 0.0083  0.0313  211 SER A CB  
3532 O  OG  . SER A 211 ? 0.2686 0.2800 0.2685 0.0089  -0.0074 0.0319  211 SER A OG  
3538 N  N   . GLY A 212 ? 0.2762 0.2174 0.3171 -0.0359 -0.0076 0.0044  212 GLY A N   
3539 C  CA  . GLY A 212 ? 0.3051 0.2306 0.3606 -0.0284 -0.0468 -0.0326 212 GLY A CA  
3540 C  C   . GLY A 212 ? 0.3052 0.2159 0.3846 -0.0338 -0.0576 -0.0508 212 GLY A C   
3541 O  O   . GLY A 212 ? 0.3681 0.2577 0.4144 0.0233  -0.0901 -0.0870 212 GLY A O   
3545 N  N   . ILE A 213 ? 0.2606 0.2110 0.3775 -0.0338 -0.0347 -0.0340 213 ILE A N   
3546 C  CA  . ILE A 213 ? 0.2462 0.2453 0.3757 -0.0274 -0.0158 -0.0259 213 ILE A CA  
3547 C  C   . ILE A 213 ? 0.2448 0.2574 0.3905 0.0126  -0.0128 -0.0161 213 ILE A C   
3548 O  O   . ILE A 213 ? 0.2680 0.2670 0.3929 0.0158  -0.0183 -0.0130 213 ILE A O   
3549 C  CB  . ILE A 213 ? 0.2417 0.2897 0.3584 -0.0481 -0.0034 -0.0319 213 ILE A CB  
3550 C  CG1 . ILE A 213 ? 0.2791 0.3270 0.3452 -0.0889 0.0007  -0.0265 213 ILE A CG1 
3551 C  CG2 . ILE A 213 ? 0.2554 0.3418 0.3577 -0.0170 0.0047  -0.0242 213 ILE A CG2 
3552 C  CD1 . ILE A 213 ? 0.3344 0.3708 0.3512 -0.0817 -0.0041 -0.0156 213 ILE A CD1 
3564 N  N   . SER A 214 ? 0.2492 0.2299 0.4031 0.0159  -0.0167 -0.0203 214 SER A N   
3565 C  CA  . SER A 214 ? 0.2518 0.2776 0.4189 0.0045  -0.0218 -0.0182 214 SER A CA  
3566 C  C   . SER A 214 ? 0.2883 0.2890 0.4453 0.0476  -0.0234 -0.0053 214 SER A C   
3567 O  O   . SER A 214 ? 0.2994 0.3426 0.4516 0.0292  -0.0174 -0.0037 214 SER A O   
3568 C  CB  . SER A 214 ? 0.2491 0.3191 0.4132 -0.0175 -0.0025 -0.0183 214 SER A CB  
3569 O  OG  . SER A 214 ? 0.2173 0.2848 0.4123 0.0341  0.0209  -0.0512 214 SER A OG  
3575 N  N   . GLU A 215 ? 0.2723 0.2687 0.4625 0.0380  -0.0215 -0.0073 215 GLU A N   
3576 C  CA  . GLU A 215 ? 0.2726 0.3166 0.4818 0.0267  -0.0221 -0.0258 215 GLU A CA  
3577 C  C   . GLU A 215 ? 0.2973 0.2914 0.4790 0.0383  -0.0041 -0.0110 215 GLU A C   
3578 O  O   . GLU A 215 ? 0.2825 0.2648 0.4720 0.0265  0.0000  -0.0217 215 GLU A O   
3579 C  CB  . GLU A 215 ? 0.3295 0.3541 0.5061 0.0048  -0.0348 -0.0413 215 GLU A CB  
3580 C  CG  . GLU A 215 ? 0.3947 0.3880 0.5278 0.0247  -0.0349 -0.0131 215 GLU A CG  
3581 C  CD  . GLU A 215 ? 0.4332 0.4223 0.5448 0.0296  -0.0393 0.0163  215 GLU A CD  
3582 O  OE1 . GLU A 215 ? 0.4480 0.4340 0.5506 0.0440  -0.0459 0.0215  215 GLU A OE1 
3583 O  OE2 . GLU A 215 ? 0.4624 0.3870 0.5452 0.0419  -0.0486 0.0241  215 GLU A OE2 
3590 N  N   . ARG A 216 ? 0.2588 0.2407 0.4766 -0.0242 -0.0088 0.0030  216 ARG A N   
3591 C  CA  . ARG A 216 ? 0.2688 0.2504 0.4779 -0.0368 0.0068  -0.0062 216 ARG A CA  
3592 C  C   . ARG A 216 ? 0.2960 0.2559 0.4793 -0.0198 0.0176  -0.0076 216 ARG A C   
3593 O  O   . ARG A 216 ? 0.2525 0.2379 0.4762 -0.0037 0.0060  0.0009  216 ARG A O   
3594 C  CB  . ARG A 216 ? 0.2629 0.3011 0.4749 -0.0627 0.0022  -0.0156 216 ARG A CB  
3595 C  CG  . ARG A 216 ? 0.2762 0.3370 0.4764 -0.0418 0.0059  -0.0258 216 ARG A CG  
3596 C  CD  . ARG A 216 ? 0.2492 0.3492 0.4729 -0.0368 0.0075  -0.0266 216 ARG A CD  
3597 N  NE  . ARG A 216 ? 0.2679 0.3552 0.4725 -0.0154 0.0061  -0.0480 216 ARG A NE  
3598 C  CZ  . ARG A 216 ? 0.2254 0.3384 0.4649 -0.0101 0.0105  -0.0645 216 ARG A CZ  
3599 N  NH1 . ARG A 216 ? 0.1442 0.2594 0.4495 -0.0370 0.0324  -0.0658 216 ARG A NH1 
3600 N  NH2 . ARG A 216 ? 0.2586 0.4113 0.4695 0.0482  0.0202  -0.0673 216 ARG A NH2 
3614 N  N   . ASN A 217 ? 0.3458 0.2817 0.4841 0.0189  0.0293  -0.0179 217 ASN A N   
3615 C  CA  . ASN A 217 ? 0.4137 0.3023 0.4892 0.0204  0.0285  -0.0537 217 ASN A CA  
3616 C  C   . ASN A 217 ? 0.3765 0.2709 0.4825 -0.0102 0.0138  -0.0502 217 ASN A C   
3617 O  O   . ASN A 217 ? 0.3785 0.2602 0.4758 0.0000  0.0266  -0.0517 217 ASN A O   
3618 C  CB  . ASN A 217 ? 0.5192 0.3412 0.5037 0.0897  0.0384  -0.0798 217 ASN A CB  
3619 C  CG  . ASN A 217 ? 0.5858 0.4222 0.5223 0.1339  0.0299  -0.0766 217 ASN A CG  
3620 O  OD1 . ASN A 217 ? 0.5913 0.4350 0.5283 0.1461  0.0318  -0.0740 217 ASN A OD1 
3621 N  ND2 . ASN A 217 ? 0.5983 0.4426 0.5251 0.1442  0.0241  -0.0808 217 ASN A ND2 
3628 N  N   . GLU A 218 ? 0.3389 0.2760 0.4752 -0.0276 -0.0150 -0.0375 218 GLU A N   
3629 C  CA  . GLU A 218 ? 0.3455 0.2685 0.4682 -0.0219 -0.0348 -0.0189 218 GLU A CA  
3630 C  C   . GLU A 218 ? 0.3127 0.2219 0.4198 0.0102  -0.0198 -0.0104 218 GLU A C   
3631 O  O   . GLU A 218 ? 0.3150 0.2491 0.4105 -0.0183 -0.0316 -0.0169 218 GLU A O   
3632 C  CB  . GLU A 218 ? 0.4009 0.2854 0.5025 -0.0867 -0.0788 -0.0093 218 GLU A CB  
3633 C  CG  . GLU A 218 ? 0.4680 0.3614 0.5423 -0.0558 -0.1029 0.0167  218 GLU A CG  
3634 C  CD  . GLU A 218 ? 0.5337 0.4481 0.6003 -0.0664 -0.1292 0.0460  218 GLU A CD  
3635 O  OE1 . GLU A 218 ? 0.5804 0.5347 0.6327 -0.0761 -0.1293 0.0593  218 GLU A OE1 
3636 O  OE2 . GLU A 218 ? 0.5388 0.5058 0.6179 -0.0738 -0.1375 0.0719  218 GLU A OE2 
3643 N  N   . ILE A 219 ? 0.2566 0.2291 0.3849 0.0106  0.0057  0.0066  219 ILE A N   
3644 C  CA  . ILE A 219 ? 0.2224 0.2442 0.3579 -0.0448 0.0303  0.0011  219 ILE A CA  
3645 C  C   . ILE A 219 ? 0.2297 0.2666 0.3596 -0.0241 0.0470  -0.0111 219 ILE A C   
3646 O  O   . ILE A 219 ? 0.2496 0.2717 0.3420 -0.0322 0.0395  -0.0274 219 ILE A O   
3647 C  CB  . ILE A 219 ? 0.2420 0.2340 0.3480 -0.0508 0.0280  -0.0004 219 ILE A CB  
3648 C  CG1 . ILE A 219 ? 0.2581 0.2667 0.3494 -0.0176 0.0661  0.0187  219 ILE A CG1 
3649 C  CG2 . ILE A 219 ? 0.2598 0.2873 0.3515 -0.0424 0.0177  0.0015  219 ILE A CG2 
3650 C  CD1 . ILE A 219 ? 0.3091 0.3000 0.3597 0.0234  0.0868  0.0068  219 ILE A CD1 
3662 N  N   . GLU A 220 ? 0.2168 0.2844 0.3908 -0.0139 0.0547  0.0210  220 GLU A N   
3663 C  CA  . GLU A 220 ? 0.2643 0.3231 0.4289 -0.0074 0.0249  0.0136  220 GLU A CA  
3664 C  C   . GLU A 220 ? 0.2785 0.3130 0.4334 0.0299  0.0478  -0.0073 220 GLU A C   
3665 O  O   . GLU A 220 ? 0.2716 0.3237 0.4369 0.0442  0.0678  -0.0025 220 GLU A O   
3666 C  CB  . GLU A 220 ? 0.3925 0.3998 0.4663 0.0710  -0.0045 0.0318  220 GLU A CB  
3667 C  CG  . GLU A 220 ? 0.5458 0.5133 0.5022 0.1927  -0.0142 0.0386  220 GLU A CG  
3668 C  CD  . GLU A 220 ? 0.6562 0.5860 0.5269 0.2725  -0.0120 0.0483  220 GLU A CD  
3669 O  OE1 . GLU A 220 ? 0.6930 0.6191 0.5309 0.3009  -0.0032 0.0340  220 GLU A OE1 
3670 O  OE2 . GLU A 220 ? 0.6949 0.6337 0.5503 0.2778  0.0038  0.0498  220 GLU A OE2 
3677 N  N   . GLU A 221 ? 0.2864 0.2465 0.4249 0.0049  0.0591  -0.0317 221 GLU A N   
3678 C  CA  . GLU A 221 ? 0.3704 0.2685 0.4136 0.0133  0.0650  -0.0497 221 GLU A CA  
3679 C  C   . GLU A 221 ? 0.3391 0.2728 0.3809 0.0294  0.0678  -0.0497 221 GLU A C   
3680 O  O   . GLU A 221 ? 0.3403 0.3235 0.3761 0.0367  0.0916  -0.0626 221 GLU A O   
3681 C  CB  . GLU A 221 ? 0.4831 0.3136 0.4413 0.0699  0.0492  -0.0592 221 GLU A CB  
3682 C  CG  . GLU A 221 ? 0.5999 0.3949 0.4717 0.1319  0.0336  -0.0766 221 GLU A CG  
3683 C  CD  . GLU A 221 ? 0.7181 0.5144 0.5062 0.2124  0.0204  -0.0864 221 GLU A CD  
3684 O  OE1 . GLU A 221 ? 0.7824 0.5617 0.5239 0.2059  0.0167  -0.0899 221 GLU A OE1 
3685 O  OE2 . GLU A 221 ? 0.7949 0.5791 0.5165 0.2064  0.0095  -0.0829 221 GLU A OE2 
3692 N  N   . LEU A 222 ? 0.2913 0.2610 0.3467 -0.0075 0.0376  -0.0703 222 LEU A N   
3693 C  CA  . LEU A 222 ? 0.2284 0.2579 0.3254 -0.0352 0.0247  -0.0543 222 LEU A CA  
3694 C  C   . LEU A 222 ? 0.2292 0.2637 0.3097 0.0006  0.0347  -0.0377 222 LEU A C   
3695 O  O   . LEU A 222 ? 0.2179 0.2527 0.2894 -0.0010 0.0296  -0.0281 222 LEU A O   
3696 C  CB  . LEU A 222 ? 0.2569 0.2413 0.3201 -0.0102 -0.0143 -0.0551 222 LEU A CB  
3697 C  CG  . LEU A 222 ? 0.3094 0.2672 0.3237 -0.0160 -0.0471 -0.0314 222 LEU A CG  
3698 C  CD1 . LEU A 222 ? 0.3080 0.2912 0.3440 -0.0205 -0.0480 -0.0366 222 LEU A CD1 
3699 C  CD2 . LEU A 222 ? 0.3646 0.3381 0.3177 0.0036  -0.0669 -0.0147 222 LEU A CD2 
3711 N  N   . ARG A 223 ? 0.2328 0.2482 0.3256 0.0018  0.0215  -0.0304 223 ARG A N   
3712 C  CA  . ARG A 223 ? 0.2136 0.2862 0.3405 -0.0432 0.0190  -0.0144 223 ARG A CA  
3713 C  C   . ARG A 223 ? 0.2392 0.3205 0.3551 -0.0074 0.0294  -0.0134 223 ARG A C   
3714 O  O   . ARG A 223 ? 0.2393 0.3354 0.3441 0.0067  0.0421  0.0076  223 ARG A O   
3715 C  CB  . ARG A 223 ? 0.2261 0.3117 0.3441 -0.0501 -0.0032 -0.0212 223 ARG A CB  
3716 C  CG  . ARG A 223 ? 0.2578 0.3112 0.3420 -0.0081 -0.0040 -0.0140 223 ARG A CG  
3717 C  CD  . ARG A 223 ? 0.2681 0.3071 0.3322 -0.0245 -0.0218 -0.0380 223 ARG A CD  
3718 N  NE  . ARG A 223 ? 0.3007 0.3570 0.3381 -0.0160 0.0023  -0.0419 223 ARG A NE  
3719 C  CZ  . ARG A 223 ? 0.3133 0.3763 0.3437 -0.0229 -0.0013 -0.0484 223 ARG A CZ  
3720 N  NH1 . ARG A 223 ? 0.3091 0.3803 0.3582 -0.0284 0.0105  -0.0373 223 ARG A NH1 
3721 N  NH2 . ARG A 223 ? 0.3134 0.4169 0.3465 -0.0266 -0.0085 -0.0651 223 ARG A NH2 
3735 N  N   . LYS A 224 ? 0.2396 0.3490 0.3761 0.0035  0.0644  -0.0216 224 LYS A N   
3736 C  CA  . LYS A 224 ? 0.2784 0.3919 0.4021 0.0007  0.0734  -0.0388 224 LYS A CA  
3737 C  C   . LYS A 224 ? 0.2811 0.4012 0.3849 -0.0230 0.0755  -0.0410 224 LYS A C   
3738 O  O   . LYS A 224 ? 0.2995 0.4314 0.3946 -0.0102 0.0732  -0.0293 224 LYS A O   
3739 C  CB  . LYS A 224 ? 0.3606 0.4619 0.4421 0.0903  0.0816  -0.0391 224 LYS A CB  
3740 C  CG  . LYS A 224 ? 0.4666 0.5572 0.4814 0.1569  0.0602  -0.0453 224 LYS A CG  
3741 C  CD  . LYS A 224 ? 0.5471 0.6426 0.5141 0.2325  0.0428  -0.0329 224 LYS A CD  
3742 C  CE  . LYS A 224 ? 0.5978 0.6895 0.5436 0.2726  0.0271  -0.0290 224 LYS A CE  
3743 N  NZ  . LYS A 224 ? 0.6076 0.6970 0.5525 0.2877  0.0255  -0.0385 224 LYS A NZ  
3757 N  N   . LEU A 225 ? 0.2707 0.3742 0.3608 -0.0135 0.0635  -0.0796 225 LEU A N   
3758 C  CA  . LEU A 225 ? 0.2794 0.3633 0.3403 -0.0273 0.0754  -0.0654 225 LEU A CA  
3759 C  C   . LEU A 225 ? 0.2713 0.3545 0.3205 0.0055  0.0803  -0.0418 225 LEU A C   
3760 O  O   . LEU A 225 ? 0.2642 0.3771 0.3283 -0.0192 0.0626  -0.0470 225 LEU A O   
3761 C  CB  . LEU A 225 ? 0.3046 0.3874 0.3384 -0.0196 0.0801  -0.0720 225 LEU A CB  
3762 C  CG  . LEU A 225 ? 0.3471 0.4333 0.3454 -0.0545 0.0556  -0.0842 225 LEU A CG  
3763 C  CD1 . LEU A 225 ? 0.3703 0.4552 0.3530 -0.0893 0.0511  -0.0748 225 LEU A CD1 
3764 C  CD2 . LEU A 225 ? 0.3960 0.4441 0.3438 0.0301  0.0387  -0.1239 225 LEU A CD2 
3776 N  N   . GLY A 226 ? 0.2645 0.3110 0.2993 -0.0090 0.0861  -0.0327 226 GLY A N   
3777 C  CA  . GLY A 226 ? 0.2428 0.2832 0.2891 -0.0272 0.0815  -0.0213 226 GLY A CA  
3778 C  C   . GLY A 226 ? 0.2215 0.2817 0.2748 -0.0311 0.0760  -0.0442 226 GLY A C   
3779 O  O   . GLY A 226 ? 0.2593 0.3087 0.2925 -0.0194 0.0813  -0.0376 226 GLY A O   
3783 N  N   . VAL A 227 ? 0.2073 0.2610 0.2468 -0.0277 0.0502  -0.0487 227 VAL A N   
3784 C  CA  . VAL A 227 ? 0.1998 0.2532 0.2357 -0.0320 0.0352  -0.0299 227 VAL A CA  
3785 C  C   . VAL A 227 ? 0.1937 0.2540 0.2295 -0.0083 0.0292  -0.0325 227 VAL A C   
3786 O  O   . VAL A 227 ? 0.2098 0.2614 0.2254 0.0198  0.0128  -0.0331 227 VAL A O   
3787 C  CB  . VAL A 227 ? 0.2206 0.2418 0.2232 -0.0168 0.0266  -0.0277 227 VAL A CB  
3788 C  CG1 . VAL A 227 ? 0.2219 0.2372 0.2347 -0.0195 0.0310  -0.0354 227 VAL A CG1 
3789 C  CG2 . VAL A 227 ? 0.2424 0.2571 0.2327 0.0070  0.0214  -0.0423 227 VAL A CG2 
3799 N  N   . ASN A 228 ? 0.1663 0.2496 0.2108 -0.0182 0.0212  -0.0194 228 ASN A N   
3800 C  CA  . ASN A 228 ? 0.1979 0.2240 0.2179 -0.0364 -0.0009 -0.0245 228 ASN A CA  
3801 C  C   . ASN A 228 ? 0.2039 0.2286 0.2118 -0.0301 0.0134  -0.0077 228 ASN A C   
3802 O  O   . ASN A 228 ? 0.2049 0.2587 0.2219 -0.0162 0.0088  -0.0068 228 ASN A O   
3803 C  CB  . ASN A 228 ? 0.1891 0.2343 0.2372 -0.0355 0.0077  -0.0162 228 ASN A CB  
3804 C  CG  . ASN A 228 ? 0.1884 0.2739 0.2403 -0.0222 0.0089  0.0253  228 ASN A CG  
3805 O  OD1 . ASN A 228 ? 0.2148 0.2258 0.2335 -0.0297 0.0153  0.0107  228 ASN A OD1 
3806 N  ND2 . ASN A 228 ? 0.2292 0.3433 0.2721 -0.0622 -0.0025 0.0384  228 ASN A ND2 
3813 N  N   . ALA A 229 ? 0.1917 0.2384 0.2050 -0.0276 0.0189  -0.0163 229 ALA A N   
3814 C  CA  . ALA A 229 ? 0.1779 0.2367 0.1996 -0.0210 0.0351  -0.0077 229 ALA A CA  
3815 C  C   . ALA A 229 ? 0.1660 0.2088 0.1968 -0.0047 0.0124  0.0064  229 ALA A C   
3816 O  O   . ALA A 229 ? 0.1932 0.2067 0.2016 -0.0200 0.0044  0.0033  229 ALA A O   
3817 C  CB  . ALA A 229 ? 0.1976 0.2195 0.2009 -0.0117 0.0138  -0.0258 229 ALA A CB  
3823 N  N   . PHE A 230 ? 0.1703 0.2507 0.1985 -0.0235 0.0142  0.0010  230 PHE A N   
3824 C  CA  . PHE A 230 ? 0.1917 0.2438 0.1887 -0.0150 0.0092  -0.0138 230 PHE A CA  
3825 C  C   . PHE A 230 ? 0.2103 0.2553 0.1803 -0.0430 0.0198  -0.0039 230 PHE A C   
3826 O  O   . PHE A 230 ? 0.2446 0.2901 0.1687 -0.0240 0.0089  -0.0071 230 PHE A O   
3827 C  CB  . PHE A 230 ? 0.2112 0.2172 0.2069 -0.0021 0.0125  0.0106  230 PHE A CB  
3828 C  CG  . PHE A 230 ? 0.2367 0.2269 0.2343 -0.0139 0.0106  -0.0057 230 PHE A CG  
3829 C  CD1 . PHE A 230 ? 0.2245 0.2444 0.2543 -0.0032 0.0049  -0.0024 230 PHE A CD1 
3830 C  CD2 . PHE A 230 ? 0.2886 0.2076 0.2503 0.0056  0.0181  -0.0105 230 PHE A CD2 
3831 C  CE1 . PHE A 230 ? 0.2513 0.2781 0.2618 0.0197  -0.0019 0.0105  230 PHE A CE1 
3832 C  CE2 . PHE A 230 ? 0.3223 0.2649 0.2654 0.0421  0.0028  -0.0098 230 PHE A CE2 
3833 C  CZ  . PHE A 230 ? 0.2621 0.2880 0.2659 0.0271  0.0062  0.0252  230 PHE A CZ  
3843 N  N   . LEU A 231 ? 0.1967 0.2509 0.1725 -0.0233 0.0283  0.0173  231 LEU A N   
3844 C  CA  . LEU A 231 ? 0.2011 0.2338 0.1979 -0.0391 0.0171  0.0321  231 LEU A CA  
3845 C  C   . LEU A 231 ? 0.1719 0.2537 0.1945 -0.0539 0.0257  0.0358  231 LEU A C   
3846 O  O   . LEU A 231 ? 0.2322 0.2994 0.2152 -0.0509 0.0197  0.0090  231 LEU A O   
3847 C  CB  . LEU A 231 ? 0.2715 0.2706 0.2472 0.0229  0.0335  0.0843  231 LEU A CB  
3848 C  CG  . LEU A 231 ? 0.3557 0.3671 0.3161 0.1051  0.0267  0.1046  231 LEU A CG  
3849 C  CD1 . LEU A 231 ? 0.4144 0.3453 0.3300 0.1368  0.0691  0.1158  231 LEU A CD1 
3850 C  CD2 . LEU A 231 ? 0.4514 0.4759 0.3496 0.1597  0.0473  0.1099  231 LEU A CD2 
3862 N  N   . ILE A 232 ? 0.1946 0.2294 0.1984 -0.0406 0.0311  0.0354  232 ILE A N   
3863 C  CA  . ILE A 232 ? 0.1979 0.2307 0.2101 -0.0206 0.0100  0.0410  232 ILE A CA  
3864 C  C   . ILE A 232 ? 0.2172 0.2236 0.2047 0.0020  0.0156  0.0471  232 ILE A C   
3865 O  O   . ILE A 232 ? 0.2256 0.2196 0.1967 0.0038  0.0219  0.0377  232 ILE A O   
3866 C  CB  . ILE A 232 ? 0.2113 0.2230 0.2289 -0.0326 0.0029  0.0459  232 ILE A CB  
3867 C  CG1 . ILE A 232 ? 0.1961 0.2747 0.2370 -0.0039 -0.0060 0.0083  232 ILE A CG1 
3868 C  CG2 . ILE A 232 ? 0.2597 0.2616 0.2436 0.0119  -0.0225 0.0126  232 ILE A CG2 
3869 C  CD1 . ILE A 232 ? 0.2270 0.2800 0.2487 0.0298  -0.0056 0.0011  232 ILE A CD1 
3881 N  N   . GLY A 233 ? 0.2184 0.2367 0.2163 -0.0220 0.0186  0.0635  233 GLY A N   
3882 C  CA  . GLY A 233 ? 0.2246 0.1957 0.2340 -0.0202 0.0178  0.0835  233 GLY A CA  
3883 C  C   . GLY A 233 ? 0.2111 0.2122 0.2302 -0.0244 0.0214  0.0659  233 GLY A C   
3884 O  O   . GLY A 233 ? 0.2042 0.2153 0.2269 -0.0081 0.0204  0.0580  233 GLY A O   
3888 N  N   . SER A 234 ? 0.2074 0.2382 0.2173 -0.0306 0.0166  0.0624  234 SER A N   
3889 C  CA  . SER A 234 ? 0.2158 0.2418 0.1818 -0.0124 0.0103  0.0603  234 SER A CA  
3890 C  C   . SER A 234 ? 0.2096 0.2253 0.1885 -0.0054 0.0318  0.0590  234 SER A C   
3891 O  O   . SER A 234 ? 0.2321 0.2054 0.1778 -0.0177 0.0012  0.0336  234 SER A O   
3892 C  CB  . SER A 234 ? 0.2612 0.2195 0.1753 -0.0335 -0.0038 0.0535  234 SER A CB  
3893 O  OG  . SER A 234 ? 0.2991 0.2474 0.1847 -0.0330 -0.0040 0.0492  234 SER A OG  
3899 N  N   . SER A 235 ? 0.2055 0.2252 0.2050 -0.0106 0.0207  0.0563  235 SER A N   
3900 C  CA  A SER A 235 ? 0.1977 0.2158 0.2071 -0.0211 0.0171  0.0617  235 SER A CA  
3901 C  CA  B SER A 235 ? 0.2209 0.2282 0.2093 -0.0068 0.0139  0.0545  235 SER A CA  
3902 C  CA  C SER A 235 ? 0.2036 0.2272 0.1877 -0.0239 0.0152  0.0640  235 SER A CA  
3903 C  C   . SER A 235 ? 0.2211 0.2108 0.2068 0.0005  0.0132  0.0485  235 SER A C   
3904 O  O   . SER A 235 ? 0.2410 0.2138 0.2153 -0.0121 0.0143  0.0389  235 SER A O   
3905 C  CB  A SER A 235 ? 0.2185 0.2597 0.2274 0.0084  0.0128  0.0515  235 SER A CB  
3906 C  CB  B SER A 235 ? 0.2619 0.2480 0.2256 0.0140  0.0074  0.0501  235 SER A CB  
3907 C  CB  C SER A 235 ? 0.2113 0.2571 0.1709 -0.0323 0.0118  0.0724  235 SER A CB  
3908 O  OG  A SER A 235 ? 0.2275 0.2524 0.2381 -0.0086 0.0241  0.0410  235 SER A OG  
3909 O  OG  B SER A 235 ? 0.2896 0.2659 0.2346 0.0219  0.0082  0.0596  235 SER A OG  
3910 O  OG  C SER A 235 ? 0.2116 0.2795 0.1570 -0.0457 0.0183  0.0893  235 SER A OG  
3926 N  N   . LEU A 236 ? 0.1976 0.1983 0.2056 -0.0065 0.0061  0.0348  236 LEU A N   
3927 C  CA  . LEU A 236 ? 0.1820 0.2082 0.2030 -0.0109 0.0029  0.0322  236 LEU A CA  
3928 C  C   . LEU A 236 ? 0.1958 0.2189 0.1897 -0.0122 0.0196  0.0117  236 LEU A C   
3929 O  O   . LEU A 236 ? 0.2183 0.2298 0.1829 0.0020  0.0199  0.0084  236 LEU A O   
3930 C  CB  . LEU A 236 ? 0.1873 0.2052 0.2247 -0.0270 0.0022  0.0411  236 LEU A CB  
3931 C  CG  . LEU A 236 ? 0.1971 0.1936 0.2370 -0.0308 -0.0074 0.0471  236 LEU A CG  
3932 C  CD1 . LEU A 236 ? 0.2404 0.2795 0.2454 -0.0094 0.0071  0.0774  236 LEU A CD1 
3933 C  CD2 . LEU A 236 ? 0.2176 0.2098 0.2684 0.0143  0.0010  0.0376  236 LEU A CD2 
3945 N  N   . MET A 237 ? 0.1962 0.2217 0.2028 -0.0038 0.0183  0.0401  237 MET A N   
3946 C  CA  . MET A 237 ? 0.2046 0.2023 0.2112 -0.0035 0.0068  0.0513  237 MET A CA  
3947 C  C   . MET A 237 ? 0.1876 0.2445 0.2183 -0.0116 0.0239  0.0434  237 MET A C   
3948 O  O   . MET A 237 ? 0.2056 0.2286 0.2121 -0.0208 0.0340  0.0231  237 MET A O   
3949 C  CB  . MET A 237 ? 0.2251 0.2270 0.2178 0.0151  0.0001  0.0381  237 MET A CB  
3950 C  CG  . MET A 237 ? 0.2228 0.2083 0.2100 -0.0186 -0.0004 0.0289  237 MET A CG  
3951 S  SD  . MET A 237 ? 0.2278 0.2283 0.2277 0.0137  0.0248  0.0298  237 MET A SD  
3952 C  CE  . MET A 237 ? 0.2291 0.2731 0.2395 -0.0296 0.0425  0.0250  237 MET A CE  
3962 N  N   . ARG A 238 ? 0.2003 0.2303 0.2086 -0.0042 0.0163  0.0474  238 ARG A N   
3963 C  CA  . ARG A 238 ? 0.2132 0.1873 0.2055 -0.0182 0.0127  0.0462  238 ARG A CA  
3964 C  C   . ARG A 238 ? 0.2281 0.1945 0.2219 0.0176  0.0046  0.0437  238 ARG A C   
3965 O  O   . ARG A 238 ? 0.2374 0.2155 0.2379 -0.0200 -0.0199 0.0669  238 ARG A O   
3966 C  CB  . ARG A 238 ? 0.2217 0.2055 0.2084 -0.0173 0.0026  0.0237  238 ARG A CB  
3967 C  CG  . ARG A 238 ? 0.2438 0.2154 0.2123 -0.0187 0.0055  0.0234  238 ARG A CG  
3968 C  CD  . ARG A 238 ? 0.2833 0.2467 0.2135 -0.0043 -0.0032 0.0284  238 ARG A CD  
3969 N  NE  . ARG A 238 ? 0.2971 0.2586 0.2113 -0.0398 -0.0082 0.0300  238 ARG A NE  
3970 C  CZ  . ARG A 238 ? 0.3032 0.2636 0.2093 -0.0505 0.0015  0.0039  238 ARG A CZ  
3971 N  NH1 . ARG A 238 ? 0.2913 0.2601 0.2325 -0.0669 0.0075  -0.0089 238 ARG A NH1 
3972 N  NH2 . ARG A 238 ? 0.2967 0.3059 0.1934 -0.0644 0.0109  0.0185  238 ARG A NH2 
3986 N  N   . ASN A 239 ? 0.2075 0.2121 0.2267 0.0047  0.0010  0.0480  239 ASN A N   
3987 C  CA  . ASN A 239 ? 0.2087 0.2095 0.2353 0.0006  -0.0051 0.0479  239 ASN A CA  
3988 C  C   . ASN A 239 ? 0.1940 0.2183 0.2333 -0.0078 -0.0009 0.0334  239 ASN A C   
3989 O  O   . ASN A 239 ? 0.2097 0.2346 0.2376 0.0116  0.0003  0.0461  239 ASN A O   
3990 C  CB  . ASN A 239 ? 0.2335 0.2091 0.2410 -0.0033 -0.0168 0.0422  239 ASN A CB  
3991 C  CG  . ASN A 239 ? 0.2687 0.2329 0.2369 0.0409  0.0054  0.0399  239 ASN A CG  
3992 O  OD1 . ASN A 239 ? 0.2594 0.2666 0.2420 0.0167  0.0055  0.0379  239 ASN A OD1 
3993 N  ND2 . ASN A 239 ? 0.3460 0.2579 0.2419 0.0802  0.0299  0.0323  239 ASN A ND2 
4000 N  N   . PRO A 240 ? 0.1832 0.2168 0.2334 -0.0117 0.0142  0.0395  240 PRO A N   
4001 C  CA  . PRO A 240 ? 0.1691 0.2305 0.2377 -0.0247 0.0093  0.0509  240 PRO A CA  
4002 C  C   . PRO A 240 ? 0.1954 0.2256 0.2528 -0.0222 -0.0106 0.0441  240 PRO A C   
4003 O  O   . PRO A 240 ? 0.2049 0.2347 0.2426 -0.0046 -0.0213 0.0457  240 PRO A O   
4004 C  CB  . PRO A 240 ? 0.1984 0.2574 0.2292 0.0336  0.0128  0.0514  240 PRO A CB  
4005 C  CG  . PRO A 240 ? 0.2111 0.2359 0.2284 0.0331  0.0258  0.0526  240 PRO A CG  
4006 C  CD  . PRO A 240 ? 0.1961 0.2461 0.2369 0.0009  0.0413  0.0280  240 PRO A CD  
4014 N  N   . GLU A 241 ? 0.2020 0.2348 0.2817 -0.0017 0.0038  0.0571  241 GLU A N   
4015 C  CA  . GLU A 241 ? 0.2057 0.2578 0.2929 -0.0226 0.0065  0.0736  241 GLU A CA  
4016 C  C   . GLU A 241 ? 0.1891 0.2654 0.3001 0.0019  -0.0142 0.0617  241 GLU A C   
4017 O  O   . GLU A 241 ? 0.1898 0.2725 0.3123 -0.0041 -0.0106 0.0649  241 GLU A O   
4018 C  CB  . GLU A 241 ? 0.2885 0.2887 0.3020 0.0221  0.0367  0.0930  241 GLU A CB  
4019 C  CG  . GLU A 241 ? 0.3581 0.3015 0.3059 0.0183  0.0574  0.0661  241 GLU A CG  
4020 C  CD  . GLU A 241 ? 0.3910 0.3035 0.3174 0.0188  0.0484  0.0674  241 GLU A CD  
4021 O  OE1 . GLU A 241 ? 0.4385 0.3196 0.3228 -0.0163 0.0393  0.0977  241 GLU A OE1 
4022 O  OE2 . GLU A 241 ? 0.3707 0.2436 0.3302 0.0519  0.0349  0.0599  241 GLU A OE2 
4029 N  N   . LYS A 242 ? 0.2018 0.2466 0.3104 0.0159  0.0081  0.0666  242 LYS A N   
4030 C  CA  . LYS A 242 ? 0.1994 0.2473 0.3270 0.0332  0.0088  0.0451  242 LYS A CA  
4031 C  C   . LYS A 242 ? 0.1976 0.2295 0.3210 0.0249  0.0306  0.0593  242 LYS A C   
4032 O  O   . LYS A 242 ? 0.2210 0.2333 0.3258 0.0109  0.0526  0.0597  242 LYS A O   
4033 C  CB  . LYS A 242 ? 0.2991 0.2834 0.3599 0.0576  -0.0147 0.0273  242 LYS A CB  
4034 C  CG  . LYS A 242 ? 0.3669 0.2891 0.3879 0.0502  -0.0206 0.0454  242 LYS A CG  
4035 C  CD  . LYS A 242 ? 0.4403 0.3247 0.4057 0.0314  -0.0160 0.0500  242 LYS A CD  
4036 C  CE  . LYS A 242 ? 0.5201 0.3547 0.4313 0.0402  -0.0004 0.0588  242 LYS A CE  
4037 N  NZ  . LYS A 242 ? 0.6001 0.3803 0.4675 0.0545  -0.0061 0.0898  242 LYS A NZ  
4051 N  N   . ILE A 243 ? 0.1951 0.2459 0.3150 0.0376  0.0251  0.0815  243 ILE A N   
4052 C  CA  . ILE A 243 ? 0.1628 0.2522 0.3176 -0.0079 0.0040  0.0967  243 ILE A CA  
4053 C  C   . ILE A 243 ? 0.1993 0.2250 0.3421 -0.0298 -0.0075 0.0753  243 ILE A C   
4054 O  O   . ILE A 243 ? 0.1728 0.2776 0.3405 -0.0210 -0.0085 0.0794  243 ILE A O   
4055 C  CB  . ILE A 243 ? 0.2077 0.2526 0.2967 -0.0202 -0.0033 0.0793  243 ILE A CB  
4056 C  CG1 . ILE A 243 ? 0.2061 0.2645 0.3013 -0.0135 0.0033  0.0558  243 ILE A CG1 
4057 C  CG2 . ILE A 243 ? 0.1933 0.2851 0.2951 -0.0334 -0.0214 0.0488  243 ILE A CG2 
4058 C  CD1 . ILE A 243 ? 0.1971 0.3432 0.2832 0.0174  0.0006  0.0633  243 ILE A CD1 
4070 N  N   . LYS A 244 ? 0.2024 0.2479 0.3627 0.0056  -0.0287 0.0848  244 LYS A N   
4071 C  CA  . LYS A 244 ? 0.2108 0.2713 0.4060 -0.0068 -0.0261 0.0954  244 LYS A CA  
4072 C  C   . LYS A 244 ? 0.2164 0.2932 0.4447 0.0241  0.0063  0.0790  244 LYS A C   
4073 O  O   . LYS A 244 ? 0.2256 0.3491 0.4669 0.0417  0.0139  0.0586  244 LYS A O   
4074 C  CB  . LYS A 244 ? 0.2520 0.3232 0.4189 0.0151  -0.0335 0.1147  244 LYS A CB  
4075 C  CG  . LYS A 244 ? 0.3369 0.3674 0.4316 -0.0342 -0.0356 0.1363  244 LYS A CG  
4076 C  CD  . LYS A 244 ? 0.4338 0.3696 0.4427 -0.0375 -0.0338 0.1520  244 LYS A CD  
4077 C  CE  . LYS A 244 ? 0.4704 0.4102 0.4510 0.0012  -0.0581 0.1569  244 LYS A CE  
4078 N  NZ  . LYS A 244 ? 0.5060 0.4441 0.4491 0.0077  -0.0680 0.1710  244 LYS A NZ  
4092 N  N   . GLU A 245 ? 0.2281 0.2618 0.4644 0.0139  0.0102  0.0831  245 GLU A N   
4093 C  CA  . GLU A 245 ? 0.3087 0.3372 0.4844 0.0649  0.0461  0.0613  245 GLU A CA  
4094 C  C   . GLU A 245 ? 0.2701 0.2887 0.4602 0.0449  0.0459  0.0247  245 GLU A C   
4095 O  O   . GLU A 245 ? 0.2839 0.3591 0.4719 0.0514  0.0384  0.0224  245 GLU A O   
4096 C  CB  . GLU A 245 ? 0.4621 0.4916 0.5195 0.1724  0.0643  0.0636  245 GLU A CB  
4097 C  CG  . GLU A 245 ? 0.6193 0.6623 0.5514 0.2942  0.0719  0.0619  245 GLU A CG  
4098 C  CD  . GLU A 245 ? 0.7232 0.7938 0.5855 0.4069  0.0721  0.0709  245 GLU A CD  
4099 O  OE1 . GLU A 245 ? 0.7597 0.8394 0.6122 0.4248  0.0753  0.0636  245 GLU A OE1 
4100 O  OE2 . GLU A 245 ? 0.7761 0.8408 0.6126 0.4312  0.0787  0.0746  245 GLU A OE2 
4107 N  N   . LEU A 246 ? 0.2237 0.2196 0.4300 0.0073  0.0277  0.0230  246 LEU A N   
4108 C  CA  . LEU A 246 ? 0.2337 0.2332 0.4117 -0.0250 0.0313  0.0294  246 LEU A CA  
4109 C  C   . LEU A 246 ? 0.2481 0.2998 0.4156 -0.0434 0.0274  0.0197  246 LEU A C   
4110 O  O   . LEU A 246 ? 0.2624 0.3470 0.4071 -0.0520 0.0473  -0.0078 246 LEU A O   
4111 C  CB  . LEU A 246 ? 0.2702 0.2357 0.3979 0.0099  0.0327  0.0055  246 LEU A CB  
4112 C  CG  . LEU A 246 ? 0.2596 0.2698 0.3791 0.0005  0.0449  0.0380  246 LEU A CG  
4113 C  CD1 . LEU A 246 ? 0.2393 0.3282 0.3775 0.0227  0.0284  0.0145  246 LEU A CD1 
4114 C  CD2 . LEU A 246 ? 0.2589 0.3144 0.3860 0.0047  0.0351  0.0287  246 LEU A CD2 
4126 N  N   . ILE A 247 ? 0.2315 0.3382 0.4325 0.0001  0.0035  0.0660  247 ILE A N   
4127 C  CA  . ILE A 247 ? 0.2551 0.3724 0.4757 -0.0218 -0.0243 0.0671  247 ILE A CA  
4128 C  C   . ILE A 247 ? 0.2771 0.4590 0.5433 -0.0570 -0.0333 0.0490  247 ILE A C   
4129 O  O   . ILE A 247 ? 0.2676 0.4689 0.5495 -0.0973 -0.0155 0.0655  247 ILE A O   
4130 C  CB  . ILE A 247 ? 0.2606 0.3909 0.4637 -0.0452 -0.0404 0.0571  247 ILE A CB  
4131 C  CG1 . ILE A 247 ? 0.2527 0.4099 0.4621 -0.0279 -0.0444 0.0553  247 ILE A CG1 
4132 C  CG2 . ILE A 247 ? 0.2669 0.3894 0.4625 -0.0887 -0.0401 0.0546  247 ILE A CG2 
4133 C  CD1 . ILE A 247 ? 0.2468 0.4149 0.4577 -0.0162 -0.0439 0.0629  247 ILE A CD1 
4145 N  N   . GLU A 248 ? 0.3284 0.5220 0.6119 -0.0374 -0.0494 0.0180  248 GLU A N   
4146 C  CA  . GLU A 248 ? 0.5013 0.7281 0.6793 0.0944  -0.0614 0.0042  248 GLU A CA  
4147 C  C   . GLU A 248 ? 0.5483 0.8408 0.6941 0.1832  -0.0660 -0.0078 248 GLU A C   
4148 O  O   . GLU A 248 ? 0.5669 0.9217 0.7002 0.2191  -0.0605 -0.0057 248 GLU A O   
4149 C  CB  . GLU A 248 ? 0.6513 0.7680 0.7269 0.1369  -0.0588 0.0216  248 GLU A CB  
4150 C  CG  . GLU A 248 ? 0.8132 0.8714 0.7804 0.2055  -0.0558 0.0280  248 GLU A CG  
4151 C  CD  . GLU A 248 ? 0.9599 0.9186 0.8547 0.2833  -0.0564 0.0229  248 GLU A CD  
4152 O  OE1 . GLU A 248 ? 1.0011 0.9382 0.8827 0.3076  -0.0591 0.0168  248 GLU A OE1 
4153 O  OE2 . GLU A 248 ? 1.0282 0.9432 0.8800 0.3064  -0.0549 0.0275  248 GLU A OE2 
4160 S  S   . SO4 B .   ? 0.2742 0.2781 0.2531 -0.0179 0.0309  0.0732  301 SO4 A S   
4161 O  O1  . SO4 B .   ? 0.4057 0.3833 0.2952 0.0431  0.0710  0.1343  301 SO4 A O1  
4162 O  O2  . SO4 B .   ? 0.2997 0.3517 0.2784 -0.0154 -0.0067 0.0080  301 SO4 A O2  
4163 O  O3  . SO4 B .   ? 0.2664 0.2821 0.2609 0.0032  0.0286  0.0878  301 SO4 A O3  
4164 O  O4  . SO4 B .   ? 0.2854 0.3416 0.2637 -0.0104 0.0047  -0.0098 301 SO4 A O4  
4165 S  S   . SO4 C .   ? 0.7230 0.5201 0.3096 0.1874  0.1288  0.1263  302 SO4 A S   
4166 O  O1  . SO4 C .   ? 0.7043 0.5999 0.3095 0.3015  0.1341  0.0844  302 SO4 A O1  
4167 O  O2  . SO4 C .   ? 0.7205 0.5171 0.3197 0.1610  0.1363  0.1424  302 SO4 A O2  
4168 O  O3  . SO4 C .   ? 0.7436 0.5038 0.3029 0.2029  0.1166  0.1366  302 SO4 A O3  
4169 O  O4  . SO4 C .   ? 0.7585 0.5656 0.3215 0.2273  0.0899  0.1167  302 SO4 A O4  
4170 S  S   . SO4 D .   ? 1.0666 0.7866 0.9251 -0.3939 -0.4773 0.1410  303 SO4 A S   
4171 O  O1  . SO4 D .   ? 1.0677 0.7963 0.9232 -0.3815 -0.4821 0.1201  303 SO4 A O1  
4172 O  O2  . SO4 D .   ? 1.0813 0.7992 0.9289 -0.3836 -0.5012 0.1516  303 SO4 A O2  
4173 O  O3  . SO4 D .   ? 1.0613 0.7939 0.9285 -0.3907 -0.4718 0.1213  303 SO4 A O3  
4174 O  O4  . SO4 D .   ? 1.0809 0.7875 0.9256 -0.3979 -0.4729 0.1284  303 SO4 A O4  
4175 S  S   . SO4 E .   ? 0.9091 1.5473 1.8393 -0.0159 0.6352  0.2947  304 SO4 A S   
4176 O  O1  . SO4 E .   ? 0.9098 1.5532 1.8426 -0.0131 0.6356  0.2973  304 SO4 A O1  
4177 O  O2  . SO4 E .   ? 0.9086 1.5457 1.8432 -0.0067 0.6349  0.3014  304 SO4 A O2  
4178 O  O3  . SO4 E .   ? 0.9098 1.5451 1.8394 0.0023  0.6368  0.3029  304 SO4 A O3  
4179 O  O4  . SO4 E .   ? 0.9066 1.5451 1.8390 0.0018  0.6355  0.2990  304 SO4 A O4  
4180 ZN ZN  . ZN  F .   ? 0.2787 0.2893 0.2549 -0.0172 0.0469  -0.0206 305 ZN  A ZN  
4181 O  O   . HOH G .   ? 1.0059 0.6312 0.4875 -0.0706 -0.2162 -0.1253 401 HOH A O   
4182 O  O   . HOH G .   ? 0.3674 0.6358 0.9358 0.1616  0.0953  0.2946  402 HOH A O   
4183 O  O   . HOH G .   ? 0.7812 0.6941 0.4793 -0.3516 0.2204  -0.0346 403 HOH A O   
4185 O  O   . HOH G .   ? 0.5897 1.1369 0.8200 0.0206  0.0962  0.4163  405 HOH A O   
4186 O  O   . HOH G .   ? 0.8713 0.3709 1.1799 -0.1548 -0.1618 -0.0688 406 HOH A O   
4187 O  O   . HOH G .   ? 0.6705 0.5780 0.5842 0.0982  -0.1587 0.0180  407 HOH A O   
4188 O  O   . HOH G .   ? 1.0449 0.9284 0.7160 0.1811  -0.0186 -0.1959 408 HOH A O   
4189 O  O   . HOH G .   ? 0.7903 0.5745 0.5999 0.0938  0.2236  0.1628  409 HOH A O   
4190 O  O   . HOH G .   ? 0.6643 0.9168 0.6809 -0.4185 0.1371  -0.2761 410 HOH A O   
4191 O  O   . HOH G .   ? 1.0730 0.9397 0.3005 -0.0764 0.0161  0.1207  411 HOH A O   
4192 O  O   . HOH G .   ? 0.8780 1.0177 0.4864 -0.0962 -0.0906 0.2348  412 HOH A O   
4193 O  O   . HOH G .   ? 0.3684 0.5007 0.8275 0.0694  -0.1802 -0.3295 413 HOH A O   
4194 O  O   . HOH G .   ? 0.2821 0.3745 0.5544 0.0917  0.1103  0.1817  414 HOH A O   
4195 O  O   . HOH G .   ? 0.7125 1.4157 0.4554 0.5123  0.0684  0.0856  415 HOH A O   
4196 O  O   . HOH G .   ? 0.5720 0.9711 0.6833 0.3324  0.2428  0.1404  416 HOH A O   
4197 O  O   . HOH G .   ? 1.1329 0.6509 0.4160 0.4012  0.1282  -0.0086 417 HOH A O   
4198 O  O   . HOH G .   ? 0.9300 0.7683 1.1778 0.1874  0.4833  -0.0226 418 HOH A O   
4199 O  O   . HOH G .   ? 0.9071 0.7221 0.2824 -0.1890 -0.1076 0.0067  419 HOH A O   
4200 O  O   . HOH G .   ? 0.5634 1.0844 0.8125 0.0505  0.1676  0.4979  420 HOH A O   
4201 O  O   . HOH G .   ? 1.0257 0.6979 0.5200 -0.4230 -0.1106 0.1918  421 HOH A O   
4202 O  O   . HOH G .   ? 1.0377 0.9866 0.3072 0.0160  0.1294  -0.1187 422 HOH A O   
4203 O  O   . HOH G .   ? 0.6451 0.6178 0.7001 -0.1907 -0.3032 0.0906  423 HOH A O   
4204 O  O   . HOH G .   ? 0.8994 0.4841 0.7161 0.1357  0.4536  0.0380  424 HOH A O   
4205 O  O   . HOH G .   ? 0.7913 0.8752 0.4213 0.0314  0.0267  -0.0872 425 HOH A O   
4206 O  O   . HOH G .   ? 1.4040 0.5931 0.4580 -0.3201 -0.1013 0.1162  426 HOH A O   
4207 O  O   . HOH G .   ? 0.7544 0.3408 0.5740 -0.1406 -0.2799 0.1643  427 HOH A O   
4208 O  O   . HOH G .   ? 0.4352 0.3292 0.5882 -0.0208 -0.0024 0.1393  428 HOH A O   
4209 O  O   . HOH G .   ? 0.7170 0.7773 0.7117 -0.1820 -0.2276 0.4116  429 HOH A O   
4210 O  O   . HOH G .   ? 0.4021 0.2917 0.2767 0.0006  0.0882  0.0284  430 HOH A O   
4211 O  O   . HOH G .   ? 0.4598 0.6230 0.9564 -0.0251 0.0432  0.3803  431 HOH A O   
4212 O  O   . HOH G .   ? 0.7218 0.4766 1.3352 0.1047  -0.1127 -0.1179 432 HOH A O   
4213 O  O   . HOH G .   ? 0.4625 0.6294 0.3486 0.0881  0.0345  0.1381  433 HOH A O   
4214 O  O   . HOH G .   ? 0.3651 0.2665 0.3082 0.0160  -0.0034 0.0648  434 HOH A O   
4215 O  O   . HOH G .   ? 0.3964 1.2097 0.3686 -0.2071 0.0306  0.0458  435 HOH A O   
4216 O  O   . HOH G .   ? 0.3946 0.8241 0.5730 0.0776  -0.0633 -0.2311 436 HOH A O   
4217 O  O   . HOH G .   ? 0.2560 0.2721 0.5306 0.0716  0.0624  0.1298  437 HOH A O   
4218 O  O   . HOH G .   ? 0.2826 0.4538 0.4889 0.0739  -0.0118 -0.1304 438 HOH A O   
4219 O  O   . HOH G .   ? 0.3770 0.3390 0.7354 -0.0759 -0.2501 0.1447  439 HOH A O   
4220 O  O   . HOH G .   ? 0.4997 0.3971 1.4875 -0.0037 0.3005  0.0211  440 HOH A O   
4221 O  O   . HOH G .   ? 0.9990 0.3660 0.7249 -0.0027 -0.4495 -0.0520 441 HOH A O   
4222 O  O   . HOH G .   ? 0.3882 0.4002 0.2559 -0.0236 0.0742  -0.1110 442 HOH A O   
4223 O  O   . HOH G .   ? 0.2689 0.3472 0.2444 -0.0376 -0.0285 -0.0401 443 HOH A O   
4224 O  O   . HOH G .   ? 0.5853 0.5137 0.2889 0.0165  -0.0447 0.1177  444 HOH A O   
4225 O  O   . HOH G .   ? 0.7576 0.3947 0.7716 0.1470  0.4029  0.1085  445 HOH A O   
4226 O  O   . HOH G .   ? 0.6260 0.8871 0.4455 -0.1265 -0.0399 0.1846  446 HOH A O   
4227 O  O   . HOH G .   ? 0.9167 0.5077 0.4022 0.2544  -0.1556 -0.0571 447 HOH A O   
4228 O  O   . HOH G .   ? 0.5482 0.7086 0.5213 0.1422  0.0914  0.3211  448 HOH A O   
4229 O  O   . HOH G .   ? 1.1437 0.4208 0.5065 0.0500  0.2356  0.1346  449 HOH A O   
4230 O  O   . HOH G .   ? 0.5857 0.5052 0.4244 -0.2460 0.0822  0.0454  450 HOH A O   
4231 O  O   . HOH G .   ? 1.0878 0.2970 0.4232 0.0400  -0.0691 0.0514  451 HOH A O   
4232 O  O   . HOH G .   ? 0.5370 0.4726 0.5977 0.1392  0.2676  0.2438  452 HOH A O   
4233 O  O   . HOH G .   ? 0.2843 0.4743 0.4598 -0.0844 -0.0227 -0.0507 453 HOH A O   
4234 O  O   . HOH G .   ? 0.2629 0.2262 0.2214 0.0135  0.0276  0.0028  454 HOH A O   
4235 O  O   . HOH G .   ? 0.3284 0.3541 0.5899 0.0748  -0.1034 -0.0363 455 HOH A O   
4236 O  O   . HOH G .   ? 0.9726 0.5724 0.3467 0.0575  -0.0393 -0.1560 456 HOH A O   
4237 O  O   . HOH G .   ? 0.2870 0.2694 0.2523 0.0161  0.0620  0.0544  457 HOH A O   
4238 O  O   . HOH G .   ? 0.3614 0.2666 0.2034 0.0369  0.0756  -0.0182 458 HOH A O   
4239 O  O   . HOH G .   ? 0.3948 0.4970 0.8793 -0.0714 0.0914  -0.2518 459 HOH A O   
4240 O  O   . HOH G .   ? 0.6258 0.6343 1.1651 -0.0143 -0.3782 0.0446  460 HOH A O   
4241 O  O   . HOH G .   ? 0.6221 0.3164 0.3493 0.0563  0.1391  -0.0002 461 HOH A O   
4242 O  O   . HOH G .   ? 0.3624 0.2764 0.4074 -0.0178 0.1969  -0.0440 462 HOH A O   
4243 O  O   . HOH G .   ? 0.5449 0.2321 0.2313 0.0692  0.1315  0.0332  463 HOH A O   
4244 O  O   . HOH G .   ? 0.5807 0.7760 0.6598 0.2977  -0.1396 -0.1619 464 HOH A O   
4245 O  O   . HOH G .   ? 0.3408 0.2444 0.2832 0.0572  0.0287  0.0885  465 HOH A O   
4246 O  O   . HOH G .   ? 0.5743 0.9242 0.7867 -0.0183 0.3771  0.0638  466 HOH A O   
4247 O  O   . HOH G .   ? 0.2614 0.7421 0.3926 0.0300  -0.0275 -0.2418 467 HOH A O   
4248 O  O   . HOH G .   ? 0.7888 0.6414 0.4401 -0.1546 0.2707  0.0324  468 HOH A O   
4249 O  O   . HOH G .   ? 0.3600 0.2764 0.3148 -0.0291 0.0014  -0.0403 469 HOH A O   
4250 O  O   . HOH G .   ? 0.3297 0.7414 0.4240 -0.0745 -0.0636 0.1212  470 HOH A O   
4251 O  O   . HOH G .   ? 0.2246 0.2386 0.2622 -0.0416 -0.0105 0.0214  471 HOH A O   
4252 O  O   . HOH G .   ? 0.6443 1.3441 0.4600 -0.1171 0.1151  0.2028  472 HOH A O   
4253 O  O   . HOH G .   ? 0.3057 0.3560 0.3782 0.0412  -0.0115 -0.0423 473 HOH A O   
4254 O  O   . HOH G .   ? 0.4502 0.5866 0.3286 0.1273  -0.0402 -0.1170 474 HOH A O   
4255 O  O   . HOH G .   ? 0.5445 0.4184 0.4143 -0.0442 -0.1130 -0.1153 475 HOH A O   
4256 O  O   . HOH G .   ? 0.5540 0.3904 1.0796 0.0839  -0.2972 0.0548  476 HOH A O   
4257 O  O   . HOH G .   ? 0.5580 0.4330 0.6249 -0.1859 -0.0648 -0.0424 477 HOH A O   
4258 O  O   . HOH G .   ? 0.7023 0.3458 0.6904 0.0147  0.3668  -0.0347 478 HOH A O   
4259 O  O   . HOH G .   ? 0.6197 0.4619 0.6510 0.0429  0.0306  0.2753  479 HOH A O   
4260 O  O   . HOH G .   ? 0.8289 0.5164 0.5863 0.0266  -0.3009 -0.1893 480 HOH A O   
4261 O  O   . HOH G .   ? 0.9117 0.5234 1.3307 0.2204  -0.3551 -0.0582 481 HOH A O   
4262 O  O   . HOH G .   ? 0.7341 0.6142 0.4484 -0.3719 0.1237  -0.1465 482 HOH A O   
4263 O  O   . HOH G .   ? 0.8273 0.7857 1.1965 0.2487  -0.3017 -0.2086 483 HOH A O   
4264 O  O   . HOH G .   ? 0.3972 0.4276 0.3399 -0.0818 0.0055  0.0534  484 HOH A O   
4265 O  O   . HOH G .   ? 0.3209 0.2652 0.2434 0.0552  0.0490  -0.0307 485 HOH A O   
4266 O  O   . HOH G .   ? 0.2697 0.3918 0.2961 0.0090  0.0831  0.0343  486 HOH A O   
4267 O  O   . HOH G .   ? 0.9717 1.0447 0.6577 0.4440  -0.1674 -0.3760 487 HOH A O   
4268 O  O   . HOH G .   ? 0.3663 0.4116 0.2127 -0.0135 -0.0363 0.0168  488 HOH A O   
4269 O  O   . HOH G .   ? 0.7310 0.4835 0.7491 -0.0926 0.0534  0.0262  489 HOH A O   
4270 O  O   . HOH G .   ? 0.7621 0.6385 0.5798 0.3101  0.1129  -0.1364 490 HOH A O   
4271 O  O   . HOH G .   ? 0.3000 0.2739 0.2799 0.0402  0.0258  0.0256  491 HOH A O   
4272 O  O   . HOH G .   ? 0.4250 1.2353 0.8813 -0.0442 0.0414  0.3558  492 HOH A O   
4273 O  O   . HOH G .   ? 0.6107 0.4418 0.5004 0.2261  0.2972  0.1919  493 HOH A O   
4274 O  O   . HOH G .   ? 0.3091 0.4126 0.2779 -0.0723 0.0058  -0.0558 494 HOH A O   
4275 O  O   . HOH G .   ? 0.5071 0.6368 0.4545 -0.0925 0.0482  -0.0059 495 HOH A O   
4276 O  O   . HOH G .   ? 0.3464 0.7125 0.8533 0.0026  0.1035  0.3854  496 HOH A O   
4277 O  O   . HOH G .   ? 0.3765 0.4187 0.3566 0.0442  0.0362  -0.0646 497 HOH A O   
4278 O  O   . HOH G .   ? 0.5752 0.9348 0.4922 0.0295  0.0501  0.3490  498 HOH A O   
4279 O  O   . HOH G .   ? 0.5174 1.1753 0.3296 0.3296  -0.0075 -0.0303 499 HOH A O   
4280 O  O   . HOH G .   ? 0.3844 0.3752 0.3542 -0.1188 -0.0104 0.0456  500 HOH A O   
4281 O  O   . HOH G .   ? 1.1925 0.5172 0.4228 0.3247  -0.0926 0.0359  501 HOH A O   
4282 O  O   . HOH G .   ? 0.4089 0.3113 0.3462 -0.0094 0.0828  -0.0429 502 HOH A O   
4283 O  O   . HOH G .   ? 0.8158 0.6189 0.2677 -0.1235 0.1479  -0.0577 503 HOH A O   
4284 O  O   . HOH G .   ? 0.4627 1.0119 0.5040 0.1171  0.1808  0.2488  504 HOH A O   
4285 O  O   . HOH G .   ? 0.4025 0.3907 0.3191 0.0125  0.0346  -0.0107 505 HOH A O   
4286 O  O   . HOH G .   ? 0.4415 1.0221 1.0631 -0.0789 0.1194  0.3734  506 HOH A O   
4287 O  O   . HOH G .   ? 0.2529 0.2185 0.2295 -0.0041 0.0130  -0.0139 507 HOH A O   
4288 O  O   . HOH G .   ? 0.1994 0.2518 0.2506 0.0291  -0.0017 0.0088  508 HOH A O   
4289 O  O   . HOH G .   ? 0.7730 0.8976 1.0282 0.4791  0.1480  0.0754  509 HOH A O   
4290 O  O   . HOH G .   ? 0.2943 1.0449 0.4602 0.1364  0.0241  0.0748  510 HOH A O   
4291 O  O   . HOH G .   ? 0.7837 0.8222 0.4040 -0.4482 0.1307  -0.1762 511 HOH A O   
4292 O  O   . HOH G .   ? 0.8356 0.5779 0.7991 0.1445  -0.1892 -0.1183 512 HOH A O   
4293 O  O   . HOH G .   ? 0.2639 0.2836 0.2000 -0.0081 0.0377  0.0412  513 HOH A O   
4294 O  O   . HOH G .   ? 0.3383 0.2565 0.5287 -0.0230 -0.0727 0.0472  514 HOH A O   
4295 O  O   . HOH G .   ? 0.5374 0.5878 0.2952 0.0104  -0.0192 0.0461  515 HOH A O   
4296 O  O   . HOH G .   ? 0.3563 0.4712 0.5127 0.0447  0.1495  0.1471  516 HOH A O   
4297 O  O   . HOH G .   ? 0.4029 0.3609 0.4358 -0.1231 0.1256  -0.0531 517 HOH A O   
4298 O  O   . HOH G .   ? 0.6538 0.3911 0.5702 0.1083  -0.2317 0.0003  518 HOH A O   
4299 O  O   . HOH G .   ? 0.3012 0.3177 0.4421 0.0413  0.0396  0.0554  519 HOH A O   
4300 O  O   . HOH G .   ? 0.4511 0.8427 0.4127 -0.0723 0.0422  -0.0731 520 HOH A O   
4301 O  O   . HOH G .   ? 0.2916 0.2774 0.2825 0.0073  0.0331  0.0426  521 HOH A O   
4302 O  O   . HOH G .   ? 0.5579 1.0508 0.5743 -0.0835 0.2666  0.0957  522 HOH A O   
4303 O  O   . HOH G .   ? 0.5906 0.5572 0.3173 0.0288  -0.0754 0.0281  523 HOH A O   
4304 O  O   . HOH G .   ? 0.4470 0.3649 0.3363 0.0336  0.0391  0.0514  524 HOH A O   
4305 O  O   . HOH G .   ? 0.3017 0.2469 0.3100 -0.0514 0.0182  -0.0137 525 HOH A O   
4306 O  O   . HOH G .   ? 0.3180 0.2895 0.2319 0.0129  0.0396  0.0169  526 HOH A O   
4307 O  O   . HOH G .   ? 0.9053 0.3644 0.3011 -0.1581 -0.1345 -0.0047 527 HOH A O   
4308 O  O   . HOH G .   ? 0.4065 0.7351 1.2673 -0.0310 -0.2542 -0.0139 528 HOH A O   
4309 O  O   . HOH G .   ? 0.6974 0.9651 0.8303 -0.2012 -0.1865 -0.3745 529 HOH A O   
4310 O  O   . HOH G .   ? 0.3278 0.8870 0.4210 0.1642  -0.0606 -0.2919 530 HOH A O   
4311 O  O   . HOH G .   ? 0.3968 0.2737 0.2928 0.0053  -0.0276 0.0016  531 HOH A O   
4312 O  O   . HOH G .   ? 0.2996 0.5382 0.8727 0.0472  -0.0212 0.1084  532 HOH A O   
4313 O  O   . HOH G .   ? 0.4155 0.5780 0.7185 -0.0231 -0.0493 0.3089  533 HOH A O   
4314 O  O   . HOH G .   ? 1.0117 0.4989 0.4517 -0.3711 -0.0097 -0.0174 534 HOH A O   
4315 O  O   . HOH G .   ? 0.7335 0.4031 0.3534 -0.1717 -0.0154 0.0215  535 HOH A O   
4316 O  O   . HOH G .   ? 0.7737 0.4241 0.2655 -0.2382 0.1282  -0.0734 536 HOH A O   
4317 O  O   . HOH G .   ? 0.3857 0.8841 0.5298 0.1342  0.1150  0.3667  537 HOH A O   
4318 O  O   . HOH G .   ? 0.3906 0.4656 0.3922 0.0256  -0.0912 -0.1115 538 HOH A O   
4319 O  O   . HOH G .   ? 0.5144 1.0205 0.3985 -0.0362 0.0476  0.2120  539 HOH A O   
4320 O  O   . HOH G .   ? 0.5145 0.4022 0.5679 0.1544  -0.1354 -0.1727 540 HOH A O   
4321 O  O   . HOH G .   ? 0.5706 0.7511 0.4496 0.3215  0.1238  0.0165  541 HOH A O   
4322 O  O   . HOH G .   ? 0.1900 0.2915 0.2281 -0.0021 0.0096  -0.0065 542 HOH A O   
4323 O  O   . HOH G .   ? 0.5006 0.2514 0.4247 0.1488  -0.1227 -0.0680 543 HOH A O   
4324 O  O   . HOH G .   ? 0.9344 1.1364 0.6143 -0.5938 -0.0437 0.1436  544 HOH A O   
4325 O  O   . HOH G .   ? 0.5266 0.3643 0.4741 -0.0578 0.1883  -0.0173 545 HOH A O   
4326 O  O   . HOH G .   ? 0.6746 0.3432 1.2358 -0.0409 -0.2180 -0.0630 546 HOH A O   
4327 O  O   . HOH G .   ? 0.8907 0.6935 0.2818 -0.0286 0.1074  0.0406  547 HOH A O   
4328 O  O   . HOH G .   ? 0.7139 0.8435 0.3081 -0.1529 0.1598  -0.0686 548 HOH A O   
4329 O  O   . HOH G .   ? 0.3673 0.5858 1.1010 0.0418  0.1657  -0.0932 549 HOH A O   
4330 O  O   . HOH G .   ? 0.4975 0.5557 0.5010 0.1545  0.0181  -0.1346 550 HOH A O   
4331 O  O   . HOH G .   ? 0.3998 0.4660 0.3949 0.0581  0.0272  -0.1481 551 HOH A O   
4332 O  O   . HOH G .   ? 0.3452 0.3068 0.3063 -0.1208 -0.0770 0.0409  552 HOH A O   
4333 O  O   . HOH G .   ? 0.5239 0.7267 1.0094 -0.1326 -0.1851 0.2246  553 HOH A O   
4334 O  O   . HOH G .   ? 0.6146 0.4219 0.4990 0.1592  0.1642  -0.0587 554 HOH A O   
4335 O  O   . HOH G .   ? 0.3387 0.3605 0.4609 0.0141  -0.0397 0.0007  555 HOH A O   
4336 O  O   . HOH G .   ? 0.4926 0.2754 0.2956 -0.0550 0.0555  0.0040  556 HOH A O   
4337 O  O   . HOH G .   ? 0.4979 0.5608 0.3221 0.0351  0.0201  0.0484  557 HOH A O   
4338 O  O   . HOH G .   ? 0.6648 0.4052 0.4429 0.0100  -0.1274 0.1000  558 HOH A O   
4339 O  O   . HOH G .   ? 0.4130 0.3291 0.5233 0.0039  0.0796  0.0486  559 HOH A O   
4340 O  O   . HOH G .   ? 0.3809 0.2737 0.5459 0.0044  0.2054  -0.0212 560 HOH A O   
4341 O  O   . HOH G .   ? 0.3230 0.2606 0.2578 0.0134  -0.0276 -0.0295 561 HOH A O   
4342 O  O   . HOH G .   ? 0.5839 0.3095 0.7052 -0.0810 0.3552  -0.0368 562 HOH A O   
4343 O  O   . HOH G .   ? 0.6281 0.8374 0.4415 -0.3670 -0.0240 0.1165  563 HOH A O   
4344 O  O   . HOH G .   ? 0.9668 0.8210 0.9109 0.4075  -0.0342 -0.1282 564 HOH A O   
4345 O  O   . HOH G .   ? 0.6394 0.3673 0.2835 0.0211  -0.0764 0.0726  565 HOH A O   
4346 O  O   . HOH G .   ? 0.7526 0.3877 0.6282 0.0713  -0.2778 -0.0300 566 HOH A O   
4347 O  O   . HOH G .   ? 0.6889 0.9340 0.7003 0.3150  -0.2616 -0.3594 567 HOH A O   
4348 O  O   . HOH G .   ? 0.3363 0.9404 0.5932 0.0043  0.1763  0.1057  568 HOH A O   
4349 O  O   . HOH G .   ? 0.3137 0.4608 0.9854 0.0211  -0.0284 0.1224  569 HOH A O   
4350 O  O   . HOH G .   ? 0.8665 0.5000 0.7758 0.0265  -0.1629 -0.3073 570 HOH A O   
4351 O  O   . HOH G .   ? 0.4643 0.4363 0.3360 0.0385  -0.0376 -0.1216 571 HOH A O   
4352 O  O   . HOH G .   ? 0.5763 1.0039 0.5858 0.3841  0.1742  0.1497  572 HOH A O   
4353 O  O   . HOH G .   ? 0.5014 0.8513 0.9593 -0.2885 -0.0763 0.3089  573 HOH A O   
4354 O  O   . HOH G .   ? 0.2743 0.6611 0.3304 0.0917  0.0579  0.1994  574 HOH A O   
4355 O  O   . HOH G .   ? 0.2811 0.2926 0.4795 0.0138  0.0074  0.1818  575 HOH A O   
4356 O  O   . HOH G .   ? 0.6754 0.6223 0.8723 0.2578  -0.2123 -0.3673 576 HOH A O   
4357 O  O   . HOH G .   ? 0.4663 0.3879 0.2205 -0.0356 -0.0606 0.0214  577 HOH A O   
4358 O  O   . HOH G .   ? 0.5561 0.4558 0.6892 -0.1097 -0.0296 -0.0088 578 HOH A O   
4359 O  O   . HOH G .   ? 1.1045 0.9820 0.5003 0.3371  0.0426  0.2000  579 HOH A O   
4360 O  O   . HOH G .   ? 0.5804 0.5216 0.7865 -0.0322 0.1745  -0.2971 580 HOH A O   
4361 O  O   . HOH G .   ? 0.4425 1.1513 0.5483 0.0095  -0.0529 0.0563  581 HOH A O   
4362 O  O   . HOH G .   ? 0.6066 0.3725 0.7970 -0.1485 -0.0579 -0.1799 582 HOH A O   
4363 O  O   . HOH G .   ? 0.4899 0.6756 0.5440 -0.1658 0.2202  -0.2382 583 HOH A O   
4364 O  O   . HOH G .   ? 0.4818 0.3525 0.3592 -0.0846 -0.0002 0.0991  584 HOH A O   
4365 O  O   . HOH G .   ? 0.3525 0.2638 0.3074 0.0745  0.0245  0.0338  585 HOH A O   
4366 O  O   . HOH G .   ? 0.4139 0.8718 0.5281 -0.1890 0.0116  -0.2848 586 HOH A O   
4367 O  O   . HOH G .   ? 0.4958 0.6960 0.5565 0.0486  0.0385  0.0078  587 HOH A O   
4368 O  O   . HOH G .   ? 1.0701 0.5973 0.3499 0.1465  -0.1679 0.0000  588 HOH A O   
4369 O  O   . HOH G .   ? 0.7542 0.5501 0.5481 -0.1388 0.2425  -0.2687 589 HOH A O   
4370 O  O   . HOH G .   ? 0.5407 0.4601 0.4724 0.1604  -0.0489 0.0707  590 HOH A O   
4371 O  O   . HOH G .   ? 0.9438 1.0244 0.3375 -0.2419 -0.0097 0.1328  591 HOH A O   
4372 O  O   . HOH G .   ? 0.4973 0.7302 1.0815 0.1463  0.0819  -0.0083 592 HOH A O   
4373 O  O   . HOH G .   ? 0.6964 0.2878 0.4502 0.0805  -0.2537 -0.0043 593 HOH A O   
4374 O  O   . HOH G .   ? 0.4740 0.4816 0.6076 0.0413  -0.0608 0.0036  594 HOH A O   
4375 O  O   . HOH G .   ? 0.2838 0.3305 0.3032 -0.0377 0.0065  0.0149  595 HOH A O   
4376 O  O   . HOH G .   ? 0.3648 0.4219 0.3819 0.0424  -0.0029 -0.0516 596 HOH A O   
4377 O  O   . HOH G .   ? 0.4303 0.4469 0.2594 0.0037  -0.0197 -0.0555 597 HOH A O   
4378 O  O   . HOH G .   ? 0.5065 0.9932 0.3931 0.0799  0.1174  0.0945  598 HOH A O   
4379 O  O   . HOH G .   ? 0.6204 1.1004 0.6804 0.4043  0.1178  0.2575  599 HOH A O   
4380 O  O   . HOH G .   ? 0.4084 0.6685 0.9517 0.0202  0.0952  -0.4010 600 HOH A O   
4381 O  O   . HOH G .   ? 0.4222 0.3348 0.8719 0.0339  0.1359  0.0659  601 HOH A O   
4382 O  O   . HOH G .   ? 0.3411 0.3240 0.5021 -0.0856 0.0636  0.0084  602 HOH A O   
4383 O  O   . HOH G .   ? 0.7140 0.5914 0.4896 -0.1795 0.2249  -0.0251 603 HOH A O   
4384 O  O   . HOH G .   ? 0.4626 0.5753 0.7041 -0.1570 -0.0927 0.1802  604 HOH A O   
4385 O  O   . HOH G .   ? 1.1300 0.4838 0.3404 -0.0833 0.0425  -0.1036 605 HOH A O   
4386 O  O   . HOH G .   ? 0.5198 0.7392 0.5200 0.3174  -0.1900 -0.2119 606 HOH A O   
4387 O  O   . HOH G .   ? 0.5306 0.5426 0.6019 -0.1037 0.0233  0.1461  607 HOH A O   
4388 O  O   . HOH G .   ? 0.8741 1.0398 0.9868 -0.5103 0.3202  -0.3274 608 HOH A O   
4389 O  O   . HOH G .   ? 0.5132 0.3550 0.3583 -0.0653 -0.0056 0.0189  609 HOH A O   
4390 O  O   . HOH G .   ? 0.2904 0.3701 0.3118 -0.0253 0.0019  0.0112  610 HOH A O   
4391 O  O   . HOH G .   ? 0.4627 0.5843 0.4744 0.1621  0.0808  0.2032  611 HOH A O   
4392 O  O   . HOH G .   ? 0.4539 1.3113 0.7180 -0.1889 0.0227  -0.4144 612 HOH A O   
4393 O  O   . HOH G .   ? 0.6891 0.7031 0.3064 0.2760  0.0997  0.1313  613 HOH A O   
4394 O  O   . HOH G .   ? 0.6034 0.7272 0.4968 -0.1331 0.2311  -0.0071 614 HOH A O   
4395 O  O   . HOH G .   ? 0.7707 0.5282 0.6924 0.1342  0.1973  0.0217  615 HOH A O   
4396 O  O   . HOH G .   ? 0.4482 0.5874 0.2664 -0.1007 0.0087  0.0871  616 HOH A O   
4397 O  O   . HOH G .   ? 1.1489 0.5047 0.4805 0.3497  -0.0615 0.0410  617 HOH A O   
4398 O  O   . HOH G .   ? 0.9072 0.4080 0.8238 0.0444  -0.0021 -0.1202 618 HOH A O   
4399 O  O   . HOH G .   ? 0.8901 0.8789 0.2385 -0.0152 -0.0540 -0.0752 619 HOH A O   
4400 O  O   . HOH G .   ? 0.6206 0.9315 0.9316 0.0804  0.3150  0.4169  620 HOH A O   
4401 O  O   . HOH G .   ? 0.6874 0.6064 1.0044 -0.1447 -0.3870 0.1065  621 HOH A O   
4402 O  O   . HOH G .   ? 1.0845 0.3896 0.5564 0.1281  -0.3016 -0.0544 622 HOH A O   
4403 O  O   . HOH G .   ? 0.6442 1.7224 0.6223 0.4303  0.0234  0.2039  623 HOH A O   
4404 O  O   . HOH G .   ? 0.7468 0.5918 1.1603 0.2039  -0.2936 -0.3937 624 HOH A O   
4405 O  O   . HOH G .   ? 1.1020 0.4108 0.5368 0.2315  -0.1673 -0.0518 625 HOH A O   
4406 O  O   . HOH G .   ? 0.6205 0.6445 1.1235 -0.0246 0.3870  0.2179  626 HOH A O   
4407 O  O   . HOH G .   ? 0.5175 0.3927 1.0209 0.1487  -0.0218 -0.0430 627 HOH A O   
4408 O  O   . HOH G .   ? 1.1197 0.4084 0.3066 -0.0314 -0.0977 0.0421  628 HOH A O   
4409 O  O   . HOH G .   ? 0.5524 0.5573 0.3315 0.0653  0.0103  -0.0774 629 HOH A O   
4410 O  O   . HOH G .   ? 1.1429 0.3417 0.5507 -0.0878 0.1932  0.0597  630 HOH A O   
4411 O  O   . HOH G .   ? 0.6383 0.4512 1.1674 0.1081  0.0209  0.1389  631 HOH A O   
4412 O  O   . HOH G .   ? 0.6001 0.6175 0.7550 0.2992  0.2542  0.0910  632 HOH A O   
4413 O  O   . HOH G .   ? 0.6507 0.5464 0.4560 -0.1638 -0.1783 0.0417  633 HOH A O   
4414 O  O   . HOH G .   ? 0.4205 1.2659 0.8498 0.0209  0.1069  -0.3908 634 HOH A O   
4415 O  O   . HOH G .   ? 0.8618 0.8938 0.4665 -0.5099 0.0623  -0.0004 635 HOH A O   
4416 O  O   . HOH G .   ? 0.9013 0.3676 0.6340 -0.1305 -0.2772 0.1729  636 HOH A O   
4417 O  O   . HOH G .   ? 0.4238 0.6314 0.5050 0.1268  -0.1348 -0.2839 637 HOH A O   
4418 O  O   . HOH G .   ? 0.6091 0.8124 0.8613 0.0062  0.3117  0.2653  638 HOH A O   
4419 O  O   . HOH G .   ? 0.7841 0.4382 1.3930 -0.0697 0.4840  -0.0361 639 HOH A O   
4420 O  O   . HOH G .   ? 0.9540 0.7082 1.3245 0.2966  0.5904  0.4234  640 HOH A O   
4421 O  O   . HOH G .   ? 0.9838 0.8495 0.4948 0.1347  0.1463  0.3199  641 HOH A O   
4422 O  O   . HOH G .   ? 0.7991 1.4726 1.1317 0.5168  -0.2353 0.0560  642 HOH A O   
4423 O  O   . HOH G .   ? 1.4131 0.3744 0.5525 -0.0459 0.2414  -0.0292 643 HOH A O   
4424 O  O   . HOH G .   ? 0.5171 1.1746 0.9220 -0.0555 -0.0070 0.3377  644 HOH A O   
4425 O  O   . HOH G .   ? 0.5634 0.9803 0.4592 -0.1831 -0.0206 0.0500  645 HOH A O   
4426 O  O   . HOH G .   ? 0.9001 0.7538 1.0278 0.0092  0.4435  -0.2171 646 HOH A O   
4427 O  O   . HOH G .   ? 0.7715 0.9653 0.4990 0.3740  0.1596  0.3045  647 HOH A O   
4428 O  O   . HOH G .   ? 0.4265 0.5951 0.4665 0.0223  0.0258  -0.0657 648 HOH A O   
4429 O  O   . HOH G .   ? 0.9364 0.6391 0.6670 0.1791  0.1281  0.1109  649 HOH A O   
4430 O  O   . HOH G .   ? 0.3772 0.6784 0.6248 -0.0188 0.0927  0.2966  650 HOH A O   
4431 O  O   . HOH G .   ? 0.4481 0.3167 0.3891 -0.0526 0.1423  -0.0096 651 HOH A O   
4432 O  O   . HOH G .   ? 0.4061 0.5224 0.6572 -0.0511 0.1325  -0.0224 652 HOH A O   
4433 O  O   . HOH G .   ? 0.7085 0.7199 0.7159 0.0865  0.2630  0.0364  653 HOH A O   
4434 O  O   . HOH G .   ? 0.5026 0.8321 0.6704 0.0077  0.0355  0.4412  654 HOH A O   
4435 O  O   . HOH G .   ? 0.3350 0.7058 1.1281 -0.0236 0.0571  -0.0727 655 HOH A O   
4436 O  O   . HOH G .   ? 0.6471 0.7533 0.7268 0.0460  -0.0631 -0.0884 656 HOH A O   
4437 O  O   . HOH G .   ? 0.7301 0.4643 1.0513 -0.1457 0.4529  -0.2534 657 HOH A O   
4438 O  O   . HOH G .   ? 0.5914 0.7966 0.7174 -0.3197 0.1737  -0.3644 658 HOH A O   
4439 O  O   . HOH G .   ? 1.0775 0.4484 0.4724 -0.2736 -0.3124 0.0954  659 HOH A O   
4440 O  O   . HOH G .   ? 0.9832 0.6460 0.7085 0.1748  0.0874  -0.0837 660 HOH A O   
4441 O  O   . HOH G .   ? 0.5710 0.4071 1.0903 -0.0326 -0.2951 -0.1643 661 HOH A O   
4442 O  O   . HOH G .   ? 0.3458 1.1759 0.6760 -0.1184 -0.0361 0.2801  662 HOH A O   
4443 O  O   . HOH G .   ? 0.5245 0.5713 0.5789 -0.1465 0.0750  -0.0990 663 HOH A O   
4444 O  O   . HOH G .   ? 1.0050 0.5084 0.8308 0.0626  0.4975  -0.0693 664 HOH A O   
4445 O  O   . HOH G .   ? 1.0695 0.5339 0.7314 -0.1854 0.0311  -0.2708 665 HOH A O   
4446 O  O   . HOH G .   ? 0.6793 1.2818 0.3899 -0.1543 -0.0180 -0.2001 666 HOH A O   
4447 O  O   . HOH G .   ? 0.7059 0.7012 0.8903 -0.1007 -0.2073 -0.1381 667 HOH A O   
4448 O  O   . HOH G .   ? 1.2211 0.5325 0.4842 -0.0878 -0.0573 -0.1250 668 HOH A O   
4449 O  O   . HOH G .   ? 0.9040 0.6034 0.6490 -0.1144 -0.1584 0.1689  669 HOH A O   
4450 O  O   . HOH G .   ? 1.0031 0.4703 0.4753 -0.0804 0.1048  -0.0246 670 HOH A O   
4451 O  O   . HOH G .   ? 0.5728 0.8932 0.8864 -0.1505 0.3010  -0.2561 671 HOH A O   
4452 O  O   . HOH G .   ? 1.1893 0.5843 0.4500 -0.0727 0.0105  -0.1626 672 HOH A O   
4453 O  O   . HOH G .   ? 1.2283 1.1394 0.5580 0.5536  0.2625  0.1576  673 HOH A O   
4454 O  O   . HOH G .   ? 0.7887 0.8019 0.5456 -0.0907 -0.0841 -0.3006 674 HOH A O   
4455 O  O   . HOH G .   ? 1.2162 0.5790 0.6394 0.1652  0.2331  0.0969  675 HOH A O   
4456 O  O   . HOH G .   ? 1.0793 0.6554 0.6602 -0.3485 0.1824  -0.2545 676 HOH A O   
4457 O  O   . HOH G .   ? 0.7124 0.5413 0.5904 0.1693  -0.2412 -0.0814 677 HOH A O   
4458 O  O   . HOH G .   ? 0.5735 0.6158 0.3071 0.0397  -0.0848 0.0052  678 HOH A O   
4459 O  O   . HOH G .   ? 0.6567 0.5854 0.5442 -0.1234 -0.1320 0.3180  679 HOH A O   
4460 O  O   . HOH G .   ? 0.3706 0.5498 0.4151 0.0879  0.0577  -0.0573 680 HOH A O   
4461 O  O   . HOH G .   ? 0.5857 0.7632 0.5062 -0.2951 0.1672  -0.3120 681 HOH A O   
4462 O  O   . HOH G .   ? 0.4320 0.6964 1.2019 0.1064  0.1347  0.0231  682 HOH A O   
4463 O  O   . HOH G .   ? 0.9385 0.4203 0.4958 -0.1247 0.1166  0.1481  683 HOH A O   
4464 O  O   . HOH G .   ? 0.4738 1.0335 1.1656 -0.2834 -0.1122 0.1003  684 HOH A O   
4465 O  O   . HOH G .   ? 0.6460 1.4694 0.6766 0.2275  0.1696  -0.1046 685 HOH A O   
4466 O  O   . HOH G .   ? 0.6747 0.4986 1.4500 0.0667  -0.4079 -0.0590 686 HOH A O   
4467 O  O   . HOH G .   ? 0.5529 0.7074 0.9014 0.0382  -0.2833 -0.2663 687 HOH A O   
4468 O  O   . HOH G .   ? 0.9653 1.0542 0.4733 0.5305  0.0040  -0.0735 688 HOH A O   
4469 O  O   . HOH G .   ? 0.3363 0.3111 0.4089 -0.0269 -0.0509 0.0704  689 HOH A O   
4470 O  O   . HOH G .   ? 0.4878 0.2405 0.2579 -0.0182 -0.0116 -0.0362 690 HOH A O   
4472 O  O   . HOH G .   ? 1.0947 0.5330 0.6514 -0.1364 0.0983  0.1053  692 HOH A O   
4473 O  O   . HOH G .   ? 0.4739 1.1269 0.8361 0.1616  0.1951  0.4715  693 HOH A O   
4474 O  O   . HOH G .   ? 0.7444 0.9803 0.4548 0.1040  0.2725  -0.0159 694 HOH A O   
4475 O  O   . HOH G .   ? 0.4479 0.6105 0.4439 -0.0133 -0.0579 -0.0615 695 HOH A O   
4476 O  O   . HOH G .   ? 0.7356 0.6515 1.0081 -0.1531 0.4245  0.0101  696 HOH A O   
4477 O  O   . HOH G .   ? 0.5708 1.3768 0.6874 -0.2676 0.1732  0.1151  697 HOH A O   
4478 O  O   . HOH G .   ? 0.7619 1.0703 0.5723 -0.0280 0.1529  0.0279  698 HOH A O   
4479 O  O   . HOH G .   ? 0.7440 0.3451 0.7365 0.1507  -0.3901 -0.1310 699 HOH A O   
4480 O  O   . HOH G .   ? 0.8522 0.5058 0.5188 -0.0411 -0.1238 0.1744  700 HOH A O   
4481 O  O   . HOH G .   ? 0.4920 0.8460 1.0023 -0.0911 0.2728  0.2372  701 HOH A O   
4482 O  O   . HOH G .   ? 0.3114 0.3198 0.4969 0.0191  0.1083  -0.0588 702 HOH A O   
4483 O  O   . HOH G .   ? 0.5777 0.6319 1.5184 -0.1602 0.1005  -0.0081 703 HOH A O   
4484 O  O   . HOH G .   ? 0.4899 0.5461 0.8460 0.0148  0.1227  0.3717  704 HOH A O   
4485 O  O   . HOH G .   ? 1.0473 1.3713 0.6990 0.0450  0.0455  0.4379  705 HOH A O   
4486 O  O   . HOH G .   ? 0.8060 0.8858 0.4253 0.4730  0.0698  0.1225  706 HOH A O   
4487 O  O   . HOH G .   ? 1.1118 0.5588 0.7773 0.0146  0.4133  0.0406  707 HOH A O   
4488 O  O   . HOH G .   ? 0.7968 0.5132 1.1526 0.0186  0.5031  0.1665  708 HOH A O   
4489 O  O   . HOH G .   ? 0.6152 0.4038 0.5527 0.1048  0.2801  0.1512  709 HOH A O   
4490 O  O   . HOH G .   ? 0.6954 1.0040 1.0130 0.2991  -0.0470 0.1676  710 HOH A O   
4491 O  O   . HOH G .   ? 0.9859 0.9733 0.7923 -0.1957 0.3371  0.2942  711 HOH A O   
4492 O  O   . HOH G .   ? 0.8377 0.6436 0.6203 -0.0330 0.1270  -0.1029 712 HOH A O   
4493 O  O   . HOH G .   ? 1.2480 0.6798 0.9348 0.1209  -0.6252 -0.1375 713 HOH A O   
# 
