data_8RWP
# 
_entry.id   8RWP 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.401 
_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   8RWP         pdb_00008rwp 10.2210/pdb8rwp/pdb 
WWPDB D_1292136318 ?            ?                   
# 
_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       2025-01-22 
# 
_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                        8RWP 
_pdbx_database_status.recvd_initial_deposition_date   2024-02-05 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           N 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              jim.spencer@bristol.ac.uk 
_pdbx_contact_author.name_first         James 
_pdbx_contact_author.name_last          Spencer 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-4602-0571 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Beer, M.'       1 0000-0002-3879-3339 
'Hinchliffe, P.' 2 ?                   
'Tooke, C.L.'    3 ?                   
'Spencer, J.'    4 ?                   
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   UK 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Chem Sci' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2041-6520 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            15 
_citation.language                  ? 
_citation.page_first                17232 
_citation.page_last                 17244 
_citation.title                     
'Dynamical responses predict a distal site that modulates activity in an antibiotic resistance enzyme.' 
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1039/d4sc03295k 
_citation.pdbx_database_id_PubMed   39364073 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Beer, M.'         1 0000-0002-3879-3339 
primary 'Oliveira, A.S.F.' 2 0000-0001-8753-4950 
primary 'Tooke, C.L.'      3 ?                   
primary 'Hinchliffe, P.'   4 0000-0001-8611-4743 
primary 'Tsz Yan Li, A.'   5 ?                   
primary 'Balega, B.'       6 ?                   
primary 'Spencer, J.'      7 0000-0002-4602-0571 
primary 'Mulholland, A.J.' 8 0000-0003-1015-4567 
# 
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 'Carbapenem-hydrolyzing beta-lactamase KPC'                    30864.666 1   3.5.2.6 ? ? ? 
2 non-polymer syn GLYCEROL                                                       92.094    1   ?       ? ? ? 
3 non-polymer syn '(2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide' 267.260   1   ?       ? ? ? 
4 non-polymer syn '(2~{S})-5-azanylidene-1-methanoyl-piperidine-2-carboxamide'   169.181   1   ?       ? ? ? 
5 non-polymer syn 'SULFATE ION'                                                  96.063    2   ?       ? ? ? 
6 water       nat water                                                          18.015    360 ?       ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'Carbapenem-hydrolyzing beta-lactamase KPC-1' 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;MGSSHHHHHHSSGLVPRGSHMLTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSFKGFLAAAVLARS
QQQADLLDTPIRYGKNALVPWSPISEKYLTTGMTVAELSAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDR
WELELNSAIPGDARDTSSPRAVTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIRAAVPADWAVGDKTGTCGVYGTA
NDYAVVWPTGRAPIVLAVYTRAPNKDDKHSEAVIAAAARLALEGLGVNGQ
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MGSSHHHHHHSSGLVPRGSHMLTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSFKGFLAAAVLARS
QQQADLLDTPIRYGKNALVPWSPISEKYLTTGMTVAELSAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDR
WELELNSAIPGDARDTSSPRAVTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIRAAVPADWAVGDKTGTCGVYGTA
NDYAVVWPTGRAPIVLAVYTRAPNKDDKHSEAVIAAAARLALEGLGVNGQ
;
_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 GLYCEROL                                                       GOL   
3 '(2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide' NXL   
4 '(2~{S})-5-azanylidene-1-methanoyl-piperidine-2-carboxamide'   A1H3M 
5 'SULFATE ION'                                                  SO4   
6 water                                                          HOH   
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   GLY n 
1 3   SER n 
1 4   SER n 
1 5   HIS n 
1 6   HIS n 
1 7   HIS n 
1 8   HIS n 
1 9   HIS n 
1 10  HIS n 
1 11  SER n 
1 12  SER n 
1 13  GLY n 
1 14  LEU n 
1 15  VAL n 
1 16  PRO n 
1 17  ARG n 
1 18  GLY n 
1 19  SER n 
1 20  HIS n 
1 21  MET n 
1 22  LEU n 
1 23  THR n 
1 24  ASN n 
1 25  LEU n 
1 26  VAL n 
1 27  ALA n 
1 28  GLU n 
1 29  PRO n 
1 30  PHE n 
1 31  ALA n 
1 32  LYS n 
1 33  LEU n 
1 34  GLU n 
1 35  GLN n 
1 36  ASP n 
1 37  PHE n 
1 38  GLY n 
1 39  GLY n 
1 40  SER n 
1 41  ILE n 
1 42  GLY n 
1 43  VAL n 
1 44  TYR n 
1 45  ALA n 
1 46  MET n 
1 47  ASP n 
1 48  THR n 
1 49  GLY n 
1 50  SER n 
1 51  GLY n 
1 52  ALA n 
1 53  THR n 
1 54  VAL n 
1 55  SER n 
1 56  TYR n 
1 57  ARG n 
1 58  ALA n 
1 59  GLU n 
1 60  GLU n 
1 61  ARG n 
1 62  PHE n 
1 63  PRO n 
1 64  LEU n 
1 65  CYS n 
1 66  SER n 
1 67  SER n 
1 68  PHE n 
1 69  LYS n 
1 70  GLY n 
1 71  PHE n 
1 72  LEU n 
1 73  ALA n 
1 74  ALA n 
1 75  ALA n 
1 76  VAL n 
1 77  LEU n 
1 78  ALA n 
1 79  ARG n 
1 80  SER n 
1 81  GLN n 
1 82  GLN n 
1 83  GLN n 
1 84  ALA n 
1 85  ASP n 
1 86  LEU n 
1 87  LEU n 
1 88  ASP n 
1 89  THR n 
1 90  PRO n 
1 91  ILE n 
1 92  ARG n 
1 93  TYR n 
1 94  GLY n 
1 95  LYS n 
1 96  ASN n 
1 97  ALA n 
1 98  LEU n 
1 99  VAL n 
1 100 PRO n 
1 101 TRP n 
1 102 SER n 
1 103 PRO n 
1 104 ILE n 
1 105 SER n 
1 106 GLU n 
1 107 LYS n 
1 108 TYR n 
1 109 LEU n 
1 110 THR n 
1 111 THR n 
1 112 GLY n 
1 113 MET n 
1 114 THR n 
1 115 VAL n 
1 116 ALA n 
1 117 GLU n 
1 118 LEU n 
1 119 SER n 
1 120 ALA n 
1 121 ALA n 
1 122 ALA n 
1 123 VAL n 
1 124 GLN n 
1 125 TYR n 
1 126 SER n 
1 127 ASP n 
1 128 ASN n 
1 129 ALA n 
1 130 ALA n 
1 131 ALA n 
1 132 ASN n 
1 133 LEU n 
1 134 LEU n 
1 135 LEU n 
1 136 LYS n 
1 137 GLU n 
1 138 LEU n 
1 139 GLY n 
1 140 GLY n 
1 141 PRO n 
1 142 ALA n 
1 143 GLY n 
1 144 LEU n 
1 145 THR n 
1 146 ALA n 
1 147 PHE n 
1 148 MET n 
1 149 ARG n 
1 150 SER n 
1 151 ILE n 
1 152 GLY n 
1 153 ASP n 
1 154 THR n 
1 155 THR n 
1 156 PHE n 
1 157 ARG n 
1 158 LEU n 
1 159 ASP n 
1 160 ARG n 
1 161 TRP n 
1 162 GLU n 
1 163 LEU n 
1 164 GLU n 
1 165 LEU n 
1 166 ASN n 
1 167 SER n 
1 168 ALA n 
1 169 ILE n 
1 170 PRO n 
1 171 GLY n 
1 172 ASP n 
1 173 ALA n 
1 174 ARG n 
1 175 ASP n 
1 176 THR n 
1 177 SER n 
1 178 SER n 
1 179 PRO n 
1 180 ARG n 
1 181 ALA n 
1 182 VAL n 
1 183 THR n 
1 184 GLU n 
1 185 SER n 
1 186 LEU n 
1 187 GLN n 
1 188 LYS n 
1 189 LEU n 
1 190 THR n 
1 191 LEU n 
1 192 GLY n 
1 193 SER n 
1 194 ALA n 
1 195 LEU n 
1 196 ALA n 
1 197 ALA n 
1 198 PRO n 
1 199 GLN n 
1 200 ARG n 
1 201 GLN n 
1 202 GLN n 
1 203 PHE n 
1 204 VAL n 
1 205 ASP n 
1 206 TRP n 
1 207 LEU n 
1 208 LYS n 
1 209 GLY n 
1 210 ASN n 
1 211 THR n 
1 212 THR n 
1 213 GLY n 
1 214 ASN n 
1 215 HIS n 
1 216 ARG n 
1 217 ILE n 
1 218 ARG n 
1 219 ALA n 
1 220 ALA n 
1 221 VAL n 
1 222 PRO n 
1 223 ALA n 
1 224 ASP n 
1 225 TRP n 
1 226 ALA n 
1 227 VAL n 
1 228 GLY n 
1 229 ASP n 
1 230 LYS n 
1 231 THR n 
1 232 GLY n 
1 233 THR n 
1 234 CYS n 
1 235 GLY n 
1 236 VAL n 
1 237 TYR n 
1 238 GLY n 
1 239 THR n 
1 240 ALA n 
1 241 ASN n 
1 242 ASP n 
1 243 TYR n 
1 244 ALA n 
1 245 VAL n 
1 246 VAL n 
1 247 TRP n 
1 248 PRO n 
1 249 THR n 
1 250 GLY n 
1 251 ARG n 
1 252 ALA n 
1 253 PRO n 
1 254 ILE n 
1 255 VAL n 
1 256 LEU n 
1 257 ALA n 
1 258 VAL n 
1 259 TYR n 
1 260 THR n 
1 261 ARG n 
1 262 ALA n 
1 263 PRO n 
1 264 ASN n 
1 265 LYS n 
1 266 ASP n 
1 267 ASP n 
1 268 LYS n 
1 269 HIS n 
1 270 SER n 
1 271 GLU n 
1 272 ALA n 
1 273 VAL n 
1 274 ILE n 
1 275 ALA n 
1 276 ALA n 
1 277 ALA n 
1 278 ALA n 
1 279 ARG n 
1 280 LEU n 
1 281 ALA n 
1 282 LEU n 
1 283 GLU n 
1 284 GLY n 
1 285 LEU n 
1 286 GLY n 
1 287 VAL n 
1 288 ASN n 
1 289 GLY n 
1 290 GLN 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                   290 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'bla, kpc, kpc1' 
_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      'Klebsiella pneumoniae' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     573 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Escherichia coli BL21(DE3)' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     469008 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
A1H3M non-polymer         . '(2~{S})-5-azanylidene-1-methanoyl-piperidine-2-carboxamide'   Avibactam 'C7 H11 N3 O2'   169.181 
ALA   'L-peptide linking' y ALANINE                                                        ? 'C3 H7 N O2'     89.093  
ARG   'L-peptide linking' y ARGININE                                                       ? 'C6 H15 N4 O2 1' 175.209 
ASN   'L-peptide linking' y ASPARAGINE                                                     ? 'C4 H8 N2 O3'    132.118 
ASP   'L-peptide linking' y 'ASPARTIC ACID'                                                ? 'C4 H7 N O4'     133.103 
CYS   'L-peptide linking' y CYSTEINE                                                       ? 'C3 H7 N O2 S'   121.158 
GLN   'L-peptide linking' y GLUTAMINE                                                      ? 'C5 H10 N2 O3'   146.144 
GLU   'L-peptide linking' y 'GLUTAMIC ACID'                                                ? 'C5 H9 N O4'     147.129 
GLY   'peptide linking'   y GLYCINE                                                        ? 'C2 H5 N O2'     75.067  
GOL   non-polymer         . GLYCEROL                                                       'GLYCERIN; PROPANE-1,2,3-TRIOL' 
'C3 H8 O3'       92.094  
HIS   'L-peptide linking' y HISTIDINE                                                      ? 'C6 H10 N3 O2 1' 156.162 
HOH   non-polymer         . WATER                                                          ? 'H2 O'           18.015  
ILE   'L-peptide linking' y ISOLEUCINE                                                     ? 'C6 H13 N O2'    131.173 
LEU   'L-peptide linking' y LEUCINE                                                        ? 'C6 H13 N O2'    131.173 
LYS   'L-peptide linking' y LYSINE                                                         ? 'C6 H15 N2 O2 1' 147.195 
MET   'L-peptide linking' y METHIONINE                                                     ? 'C5 H11 N O2 S'  149.211 
NXL   non-polymer         . '(2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide' 
'avibactam, bound form; NXL104, bound form' 'C7 H13 N3 O6 S' 267.260 
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 
# 
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   4   ?   ?   ?   A . n 
A 1 2   GLY 2   5   ?   ?   ?   A . n 
A 1 3   SER 3   6   ?   ?   ?   A . n 
A 1 4   SER 4   7   ?   ?   ?   A . n 
A 1 5   HIS 5   8   ?   ?   ?   A . n 
A 1 6   HIS 6   9   ?   ?   ?   A . n 
A 1 7   HIS 7   10  ?   ?   ?   A . n 
A 1 8   HIS 8   11  ?   ?   ?   A . n 
A 1 9   HIS 9   12  ?   ?   ?   A . n 
A 1 10  HIS 10  13  ?   ?   ?   A . n 
A 1 11  SER 11  14  ?   ?   ?   A . n 
A 1 12  SER 12  15  ?   ?   ?   A . n 
A 1 13  GLY 13  16  ?   ?   ?   A . n 
A 1 14  LEU 14  17  ?   ?   ?   A . n 
A 1 15  VAL 15  18  ?   ?   ?   A . n 
A 1 16  PRO 16  19  ?   ?   ?   A . n 
A 1 17  ARG 17  20  ?   ?   ?   A . n 
A 1 18  GLY 18  21  ?   ?   ?   A . n 
A 1 19  SER 19  22  ?   ?   ?   A . n 
A 1 20  HIS 20  23  23  HIS HIS A . n 
A 1 21  MET 21  24  24  MET MET A . n 
A 1 22  LEU 22  25  25  LEU LEU A . n 
A 1 23  THR 23  26  26  THR THR A . n 
A 1 24  ASN 24  27  27  ASN ASN A . n 
A 1 25  LEU 25  28  28  LEU LEU A . n 
A 1 26  VAL 26  29  29  VAL VAL A . n 
A 1 27  ALA 27  30  30  ALA ALA A . n 
A 1 28  GLU 28  31  31  GLU GLU A . n 
A 1 29  PRO 29  32  32  PRO PRO A . n 
A 1 30  PHE 30  33  33  PHE PHE A . n 
A 1 31  ALA 31  34  34  ALA ALA A . n 
A 1 32  LYS 32  35  35  LYS LYS A . n 
A 1 33  LEU 33  36  36  LEU LEU A . n 
A 1 34  GLU 34  37  37  GLU GLU A . n 
A 1 35  GLN 35  38  38  GLN GLN A . n 
A 1 36  ASP 36  39  39  ASP ASP A . n 
A 1 37  PHE 37  40  40  PHE PHE A . n 
A 1 38  GLY 38  41  41  GLY GLY A . n 
A 1 39  GLY 39  42  42  GLY GLY A . n 
A 1 40  SER 40  43  43  SER SER A . n 
A 1 41  ILE 41  44  44  ILE ILE A . n 
A 1 42  GLY 42  45  45  GLY GLY A . n 
A 1 43  VAL 43  46  46  VAL VAL A . n 
A 1 44  TYR 44  47  47  TYR TYR A . n 
A 1 45  ALA 45  48  48  ALA ALA A . n 
A 1 46  MET 46  49  49  MET MET A . n 
A 1 47  ASP 47  50  50  ASP ASP A . n 
A 1 48  THR 48  51  51  THR THR A . n 
A 1 49  GLY 49  52  52  GLY GLY A . n 
A 1 50  SER 50  53  53  SER SER A . n 
A 1 51  GLY 51  54  54  GLY GLY A . n 
A 1 52  ALA 52  55  55  ALA ALA A . n 
A 1 53  THR 53  56  56  THR THR A . n 
A 1 54  VAL 54  57  57  VAL VAL A . n 
A 1 55  SER 55  59  59  SER SER A . n 
A 1 56  TYR 56  60  60  TYR TYR A . n 
A 1 57  ARG 57  61  61  ARG ARG A . n 
A 1 58  ALA 58  62  62  ALA ALA A . n 
A 1 59  GLU 59  63  63  GLU GLU A . n 
A 1 60  GLU 60  64  64  GLU GLU A . n 
A 1 61  ARG 61  65  65  ARG ARG A . n 
A 1 62  PHE 62  66  66  PHE PHE A . n 
A 1 63  PRO 63  67  67  PRO PRO A . n 
A 1 64  LEU 64  68  68  LEU LEU A . n 
A 1 65  CYS 65  69  69  CYS CYS A . n 
A 1 66  SER 66  70  70  SER SER A . n 
A 1 67  SER 67  71  71  SER SER A . n 
A 1 68  PHE 68  72  72  PHE PHE A . n 
A 1 69  LYS 69  73  73  LYS LYS A . n 
A 1 70  GLY 70  74  74  GLY GLY A . n 
A 1 71  PHE 71  75  75  PHE PHE A . n 
A 1 72  LEU 72  76  76  LEU LEU A . n 
A 1 73  ALA 73  77  77  ALA ALA A . n 
A 1 74  ALA 74  78  78  ALA ALA A . n 
A 1 75  ALA 75  79  79  ALA ALA A . n 
A 1 76  VAL 76  80  80  VAL VAL A . n 
A 1 77  LEU 77  81  81  LEU LEU A . n 
A 1 78  ALA 78  82  82  ALA ALA A . n 
A 1 79  ARG 79  83  83  ARG ARG A . n 
A 1 80  SER 80  84  84  SER SER A . n 
A 1 81  GLN 81  85  85  GLN GLN A . n 
A 1 82  GLN 82  86  86  GLN GLN A . n 
A 1 83  GLN 83  87  87  GLN GLN A . n 
A 1 84  ALA 84  88  88  ALA ALA A . n 
A 1 85  ASP 85  89  89  ASP ASP A . n 
A 1 86  LEU 86  90  90  LEU LEU A . n 
A 1 87  LEU 87  91  91  LEU LEU A . n 
A 1 88  ASP 88  92  92  ASP ASP A . n 
A 1 89  THR 89  93  93  THR THR A . n 
A 1 90  PRO 90  94  94  PRO PRO A . n 
A 1 91  ILE 91  95  95  ILE ILE A . n 
A 1 92  ARG 92  96  96  ARG ARG A . n 
A 1 93  TYR 93  97  97  TYR TYR A . n 
A 1 94  GLY 94  98  98  GLY GLY A . n 
A 1 95  LYS 95  99  99  LYS LYS A . n 
A 1 96  ASN 96  100 100 ASN ASN A . n 
A 1 97  ALA 97  101 101 ALA ALA A . n 
A 1 98  LEU 98  102 102 LEU LEU A . n 
A 1 99  VAL 99  103 103 VAL VAL A . n 
A 1 100 PRO 100 104 104 PRO PRO A . n 
A 1 101 TRP 101 105 105 TRP TRP A . n 
A 1 102 SER 102 106 106 SER SER A . n 
A 1 103 PRO 103 107 107 PRO PRO A . n 
A 1 104 ILE 104 108 108 ILE ILE A . n 
A 1 105 SER 105 109 109 SER SER A . n 
A 1 106 GLU 106 110 110 GLU GLU A . n 
A 1 107 LYS 107 111 111 LYS LYS A . n 
A 1 108 TYR 108 112 112 TYR TYR A . n 
A 1 109 LEU 109 113 113 LEU LEU A . n 
A 1 110 THR 110 114 114 THR THR A . n 
A 1 111 THR 111 115 115 THR THR A . n 
A 1 112 GLY 112 116 116 GLY GLY A . n 
A 1 113 MET 113 117 117 MET MET A . n 
A 1 114 THR 114 118 118 THR THR A . n 
A 1 115 VAL 115 119 119 VAL VAL A . n 
A 1 116 ALA 116 120 120 ALA ALA A . n 
A 1 117 GLU 117 121 121 GLU GLU A . n 
A 1 118 LEU 118 122 122 LEU LEU A . n 
A 1 119 SER 119 123 123 SER SER A . n 
A 1 120 ALA 120 124 124 ALA ALA A . n 
A 1 121 ALA 121 125 125 ALA ALA A . n 
A 1 122 ALA 122 126 126 ALA ALA A . n 
A 1 123 VAL 123 127 127 VAL VAL A . n 
A 1 124 GLN 124 128 128 GLN GLN A . n 
A 1 125 TYR 125 129 129 TYR TYR A . n 
A 1 126 SER 126 130 130 SER SER A . n 
A 1 127 ASP 127 131 131 ASP ASP A . n 
A 1 128 ASN 128 132 132 ASN ASN A . n 
A 1 129 ALA 129 133 133 ALA ALA A . n 
A 1 130 ALA 130 134 134 ALA ALA A . n 
A 1 131 ALA 131 135 135 ALA ALA A . n 
A 1 132 ASN 132 136 136 ASN ASN A . n 
A 1 133 LEU 133 137 137 LEU LEU A . n 
A 1 134 LEU 134 138 138 LEU LEU A . n 
A 1 135 LEU 135 139 139 LEU LEU A . n 
A 1 136 LYS 136 140 140 LYS LYS A . n 
A 1 137 GLU 137 141 141 GLU GLU A . n 
A 1 138 LEU 138 142 142 LEU LEU A . n 
A 1 139 GLY 139 143 143 GLY GLY A . n 
A 1 140 GLY 140 144 144 GLY GLY A . n 
A 1 141 PRO 141 145 145 PRO PRO A . n 
A 1 142 ALA 142 146 146 ALA ALA A . n 
A 1 143 GLY 143 147 147 GLY GLY A . n 
A 1 144 LEU 144 148 148 LEU LEU A . n 
A 1 145 THR 145 149 149 THR THR A . n 
A 1 146 ALA 146 150 150 ALA ALA A . n 
A 1 147 PHE 147 151 151 PHE PHE A . n 
A 1 148 MET 148 152 152 MET MET A . n 
A 1 149 ARG 149 153 153 ARG ARG A . n 
A 1 150 SER 150 154 154 SER SER A . n 
A 1 151 ILE 151 155 155 ILE ILE A . n 
A 1 152 GLY 152 156 156 GLY GLY A . n 
A 1 153 ASP 153 157 157 ASP ASP A . n 
A 1 154 THR 154 158 158 THR THR A . n 
A 1 155 THR 155 159 159 THR THR A . n 
A 1 156 PHE 156 160 160 PHE PHE A . n 
A 1 157 ARG 157 161 161 ARG ARG A . n 
A 1 158 LEU 158 162 162 LEU LEU A . n 
A 1 159 ASP 159 163 163 ASP ASP A . n 
A 1 160 ARG 160 164 164 ARG ARG A . n 
A 1 161 TRP 161 165 165 TRP TRP A . n 
A 1 162 GLU 162 166 166 GLU GLU A . n 
A 1 163 LEU 163 167 167 LEU LEU A . n 
A 1 164 GLU 164 168 168 GLU GLU A . n 
A 1 165 LEU 165 169 169 LEU LEU A . n 
A 1 166 ASN 166 170 170 ASN ASN A . n 
A 1 167 SER 167 171 171 SER SER A . n 
A 1 168 ALA 168 172 172 ALA ALA A . n 
A 1 169 ILE 169 173 173 ILE ILE A . n 
A 1 170 PRO 170 174 174 PRO PRO A . n 
A 1 171 GLY 171 175 175 GLY GLY A . n 
A 1 172 ASP 172 176 176 ASP ASP A . n 
A 1 173 ALA 173 177 177 ALA ALA A . n 
A 1 174 ARG 174 178 178 ARG ARG A . n 
A 1 175 ASP 175 179 179 ASP ASP A . n 
A 1 176 THR 176 180 180 THR THR A . n 
A 1 177 SER 177 181 181 SER SER A . n 
A 1 178 SER 178 182 182 SER SER A . n 
A 1 179 PRO 179 183 183 PRO PRO A . n 
A 1 180 ARG 180 184 184 ARG ARG A . n 
A 1 181 ALA 181 185 185 ALA ALA A . n 
A 1 182 VAL 182 186 186 VAL VAL A . n 
A 1 183 THR 183 187 187 THR THR A . n 
A 1 184 GLU 184 188 188 GLU GLU A . n 
A 1 185 SER 185 189 189 SER SER A . n 
A 1 186 LEU 186 190 190 LEU LEU A . n 
A 1 187 GLN 187 191 191 GLN GLN A . n 
A 1 188 LYS 188 192 192 LYS LYS A . n 
A 1 189 LEU 189 193 193 LEU LEU A . n 
A 1 190 THR 190 194 194 THR THR A . n 
A 1 191 LEU 191 195 195 LEU LEU A . n 
A 1 192 GLY 192 196 196 GLY GLY A . n 
A 1 193 SER 193 197 197 SER SER A . n 
A 1 194 ALA 194 198 198 ALA ALA A . n 
A 1 195 LEU 195 199 199 LEU LEU A . n 
A 1 196 ALA 196 200 200 ALA ALA A . n 
A 1 197 ALA 197 201 201 ALA ALA A . n 
A 1 198 PRO 198 202 202 PRO PRO A . n 
A 1 199 GLN 199 203 203 GLN GLN A . n 
A 1 200 ARG 200 204 204 ARG ARG A . n 
A 1 201 GLN 201 205 205 GLN GLN A . n 
A 1 202 GLN 202 206 206 GLN GLN A . n 
A 1 203 PHE 203 207 207 PHE PHE A . n 
A 1 204 VAL 204 208 208 VAL VAL A . n 
A 1 205 ASP 205 209 209 ASP ASP A . n 
A 1 206 TRP 206 210 210 TRP TRP A . n 
A 1 207 LEU 207 211 211 LEU LEU A . n 
A 1 208 LYS 208 212 212 LYS LYS A . n 
A 1 209 GLY 209 213 213 GLY GLY A . n 
A 1 210 ASN 210 214 214 ASN ASN A . n 
A 1 211 THR 211 215 215 THR THR A . n 
A 1 212 THR 212 216 216 THR THR A . n 
A 1 213 GLY 213 217 217 GLY GLY A . n 
A 1 214 ASN 214 218 218 ASN ASN A . n 
A 1 215 HIS 215 219 219 HIS HIS A . n 
A 1 216 ARG 216 220 220 ARG ARG A . n 
A 1 217 ILE 217 221 221 ILE ILE A . n 
A 1 218 ARG 218 222 222 ARG ARG A . n 
A 1 219 ALA 219 223 223 ALA ALA A . n 
A 1 220 ALA 220 224 224 ALA ALA A . n 
A 1 221 VAL 221 225 225 VAL VAL A . n 
A 1 222 PRO 222 226 226 PRO PRO A . n 
A 1 223 ALA 223 227 227 ALA ALA A . n 
A 1 224 ASP 224 228 228 ASP ASP A . n 
A 1 225 TRP 225 229 229 TRP TRP A . n 
A 1 226 ALA 226 230 230 ALA ALA A . n 
A 1 227 VAL 227 231 231 VAL VAL A . n 
A 1 228 GLY 228 232 232 GLY GLY A . n 
A 1 229 ASP 229 233 233 ASP ASP A . n 
A 1 230 LYS 230 234 234 LYS LYS A . n 
A 1 231 THR 231 235 235 THR THR A . n 
A 1 232 GLY 232 236 236 GLY GLY A . n 
A 1 233 THR 233 237 237 THR THR A . n 
A 1 234 CYS 234 238 238 CYS CYS A . n 
A 1 235 GLY 235 239 239 GLY GLY A . n 
A 1 236 VAL 236 240 240 VAL VAL A . n 
A 1 237 TYR 237 241 241 TYR TYR A . n 
A 1 238 GLY 238 242 242 GLY GLY A . n 
A 1 239 THR 239 243 243 THR THR A . n 
A 1 240 ALA 240 244 244 ALA ALA A . n 
A 1 241 ASN 241 245 245 ASN ASN A . n 
A 1 242 ASP 242 246 246 ASP ASP A . n 
A 1 243 TYR 243 247 247 TYR TYR A . n 
A 1 244 ALA 244 248 248 ALA ALA A . n 
A 1 245 VAL 245 249 249 VAL VAL A . n 
A 1 246 VAL 246 250 250 VAL VAL A . n 
A 1 247 TRP 247 251 251 TRP TRP A . n 
A 1 248 PRO 248 252 252 PRO PRO A . n 
A 1 249 THR 249 254 254 THR THR A . n 
A 1 250 GLY 250 255 255 GLY GLY A . n 
A 1 251 ARG 251 256 256 ARG ARG A . n 
A 1 252 ALA 252 257 257 ALA ALA A . n 
A 1 253 PRO 253 258 258 PRO PRO A . n 
A 1 254 ILE 254 259 259 ILE ILE A . n 
A 1 255 VAL 255 260 260 VAL VAL A . n 
A 1 256 LEU 256 261 261 LEU LEU A . n 
A 1 257 ALA 257 262 262 ALA ALA A . n 
A 1 258 VAL 258 263 263 VAL VAL A . n 
A 1 259 TYR 259 264 264 TYR TYR A . n 
A 1 260 THR 260 265 265 THR THR A . n 
A 1 261 ARG 261 266 266 ARG ARG A . n 
A 1 262 ALA 262 267 267 ALA ALA A . n 
A 1 263 PRO 263 268 268 PRO PRO A . n 
A 1 264 ASN 264 269 269 ASN ASN A . n 
A 1 265 LYS 265 270 270 LYS LYS A . n 
A 1 266 ASP 266 271 271 ASP ASP A . n 
A 1 267 ASP 267 272 272 ASP ASP A . n 
A 1 268 LYS 268 273 273 LYS LYS A . n 
A 1 269 HIS 269 274 274 HIS HIS A . n 
A 1 270 SER 270 275 275 SER SER A . n 
A 1 271 GLU 271 276 276 GLU GLU A . n 
A 1 272 ALA 272 277 277 ALA ALA A . n 
A 1 273 VAL 273 278 278 VAL VAL A . n 
A 1 274 ILE 274 279 279 ILE ILE A . n 
A 1 275 ALA 275 280 280 ALA ALA A . n 
A 1 276 ALA 276 281 281 ALA ALA A . n 
A 1 277 ALA 277 282 282 ALA ALA A . n 
A 1 278 ALA 278 283 283 ALA ALA A . n 
A 1 279 ARG 279 284 284 ARG ARG A . n 
A 1 280 LEU 280 285 285 LEU LEU A . n 
A 1 281 ALA 281 286 286 ALA ALA A . n 
A 1 282 LEU 282 287 287 LEU LEU A . n 
A 1 283 GLU 283 288 288 GLU GLU A . n 
A 1 284 GLY 284 289 289 GLY GLY A . n 
A 1 285 LEU 285 290 290 LEU LEU A . n 
A 1 286 GLY 286 291 291 GLY GLY A . n 
A 1 287 VAL 287 292 292 VAL VAL A . n 
A 1 288 ASN 288 293 293 ASN ASN A . n 
A 1 289 GLY 289 294 294 GLY GLY A . n 
A 1 290 GLN 290 295 ?   ?   ?   A . n 
# 
loop_
_pdbx_entity_instance_feature.ordinal 
_pdbx_entity_instance_feature.comp_id 
_pdbx_entity_instance_feature.asym_id 
_pdbx_entity_instance_feature.seq_num 
_pdbx_entity_instance_feature.auth_comp_id 
_pdbx_entity_instance_feature.auth_asym_id 
_pdbx_entity_instance_feature.auth_seq_num 
_pdbx_entity_instance_feature.feature_type 
_pdbx_entity_instance_feature.details 
1 A1H3M ? ? A1H3M ? ? 'SUBJECT OF INVESTIGATION' ? 
2 NXL   ? ? NXL   ? ? 'SUBJECT OF INVESTIGATION' ? 
# 
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 GOL   1   501 501 GOL   GOL A . 
C 3 NXL   1   502 502 NXL   NXL A . 
D 4 A1H3M 1   503 503 A1H3M ADS A . 
E 5 SO4   1   504 3   SO4   SO4 A . 
F 5 SO4   1   505 4   SO4   SO4 A . 
G 6 HOH   1   601 372 HOH   HOH A . 
G 6 HOH   2   602 159 HOH   HOH A . 
G 6 HOH   3   603 318 HOH   HOH A . 
G 6 HOH   4   604 156 HOH   HOH A . 
G 6 HOH   5   605 174 HOH   HOH A . 
G 6 HOH   6   606 206 HOH   HOH A . 
G 6 HOH   7   607 374 HOH   HOH A . 
G 6 HOH   8   608 353 HOH   HOH A . 
G 6 HOH   9   609 223 HOH   HOH A . 
G 6 HOH   10  610 221 HOH   HOH A . 
G 6 HOH   11  611 49  HOH   HOH A . 
G 6 HOH   12  612 163 HOH   HOH A . 
G 6 HOH   13  613 149 HOH   HOH A . 
G 6 HOH   14  614 375 HOH   HOH A . 
G 6 HOH   15  615 304 HOH   HOH A . 
G 6 HOH   16  616 90  HOH   HOH A . 
G 6 HOH   17  617 22  HOH   HOH A . 
G 6 HOH   18  618 113 HOH   HOH A . 
G 6 HOH   19  619 33  HOH   HOH A . 
G 6 HOH   20  620 4   HOH   HOH A . 
G 6 HOH   21  621 64  HOH   HOH A . 
G 6 HOH   22  622 196 HOH   HOH A . 
G 6 HOH   23  623 192 HOH   HOH A . 
G 6 HOH   24  624 276 HOH   HOH A . 
G 6 HOH   25  625 69  HOH   HOH A . 
G 6 HOH   26  626 301 HOH   HOH A . 
G 6 HOH   27  627 51  HOH   HOH A . 
G 6 HOH   28  628 349 HOH   HOH A . 
G 6 HOH   29  629 240 HOH   HOH A . 
G 6 HOH   30  630 114 HOH   HOH A . 
G 6 HOH   31  631 137 HOH   HOH A . 
G 6 HOH   32  632 30  HOH   HOH A . 
G 6 HOH   33  633 191 HOH   HOH A . 
G 6 HOH   34  634 232 HOH   HOH A . 
G 6 HOH   35  635 313 HOH   HOH A . 
G 6 HOH   36  636 124 HOH   HOH A . 
G 6 HOH   37  637 34  HOH   HOH A . 
G 6 HOH   38  638 340 HOH   HOH A . 
G 6 HOH   39  639 23  HOH   HOH A . 
G 6 HOH   40  640 27  HOH   HOH A . 
G 6 HOH   41  641 58  HOH   HOH A . 
G 6 HOH   42  642 269 HOH   HOH A . 
G 6 HOH   43  643 79  HOH   HOH A . 
G 6 HOH   44  644 297 HOH   HOH A . 
G 6 HOH   45  645 250 HOH   HOH A . 
G 6 HOH   46  646 107 HOH   HOH A . 
G 6 HOH   47  647 29  HOH   HOH A . 
G 6 HOH   48  648 3   HOH   HOH A . 
G 6 HOH   49  649 74  HOH   HOH A . 
G 6 HOH   50  650 272 HOH   HOH A . 
G 6 HOH   51  651 45  HOH   HOH A . 
G 6 HOH   52  652 218 HOH   HOH A . 
G 6 HOH   53  653 193 HOH   HOH A . 
G 6 HOH   54  654 143 HOH   HOH A . 
G 6 HOH   55  655 238 HOH   HOH A . 
G 6 HOH   56  656 25  HOH   HOH A . 
G 6 HOH   57  657 101 HOH   HOH A . 
G 6 HOH   58  658 12  HOH   HOH A . 
G 6 HOH   59  659 109 HOH   HOH A . 
G 6 HOH   60  660 95  HOH   HOH A . 
G 6 HOH   61  661 39  HOH   HOH A . 
G 6 HOH   62  662 6   HOH   HOH A . 
G 6 HOH   63  663 91  HOH   HOH A . 
G 6 HOH   64  664 119 HOH   HOH A . 
G 6 HOH   65  665 233 HOH   HOH A . 
G 6 HOH   66  666 142 HOH   HOH A . 
G 6 HOH   67  667 363 HOH   HOH A . 
G 6 HOH   68  668 271 HOH   HOH A . 
G 6 HOH   69  669 11  HOH   HOH A . 
G 6 HOH   70  670 63  HOH   HOH A . 
G 6 HOH   71  671 237 HOH   HOH A . 
G 6 HOH   72  672 110 HOH   HOH A . 
G 6 HOH   73  673 93  HOH   HOH A . 
G 6 HOH   74  674 1   HOH   HOH A . 
G 6 HOH   75  675 122 HOH   HOH A . 
G 6 HOH   76  676 132 HOH   HOH A . 
G 6 HOH   77  677 168 HOH   HOH A . 
G 6 HOH   78  678 54  HOH   HOH A . 
G 6 HOH   79  679 242 HOH   HOH A . 
G 6 HOH   80  680 108 HOH   HOH A . 
G 6 HOH   81  681 131 HOH   HOH A . 
G 6 HOH   82  682 20  HOH   HOH A . 
G 6 HOH   83  683 31  HOH   HOH A . 
G 6 HOH   84  684 333 HOH   HOH A . 
G 6 HOH   85  685 66  HOH   HOH A . 
G 6 HOH   86  686 15  HOH   HOH A . 
G 6 HOH   87  687 169 HOH   HOH A . 
G 6 HOH   88  688 85  HOH   HOH A . 
G 6 HOH   89  689 150 HOH   HOH A . 
G 6 HOH   90  690 262 HOH   HOH A . 
G 6 HOH   91  691 5   HOH   HOH A . 
G 6 HOH   92  692 24  HOH   HOH A . 
G 6 HOH   93  693 127 HOH   HOH A . 
G 6 HOH   94  694 40  HOH   HOH A . 
G 6 HOH   95  695 59  HOH   HOH A . 
G 6 HOH   96  696 71  HOH   HOH A . 
G 6 HOH   97  697 86  HOH   HOH A . 
G 6 HOH   98  698 9   HOH   HOH A . 
G 6 HOH   99  699 13  HOH   HOH A . 
G 6 HOH   100 700 190 HOH   HOH A . 
G 6 HOH   101 701 171 HOH   HOH A . 
G 6 HOH   102 702 8   HOH   HOH A . 
G 6 HOH   103 703 144 HOH   HOH A . 
G 6 HOH   104 704 157 HOH   HOH A . 
G 6 HOH   105 705 68  HOH   HOH A . 
G 6 HOH   106 706 236 HOH   HOH A . 
G 6 HOH   107 707 323 HOH   HOH A . 
G 6 HOH   108 708 10  HOH   HOH A . 
G 6 HOH   109 709 320 HOH   HOH A . 
G 6 HOH   110 710 209 HOH   HOH A . 
G 6 HOH   111 711 121 HOH   HOH A . 
G 6 HOH   112 712 125 HOH   HOH A . 
G 6 HOH   113 713 57  HOH   HOH A . 
G 6 HOH   114 714 92  HOH   HOH A . 
G 6 HOH   115 715 100 HOH   HOH A . 
G 6 HOH   116 716 239 HOH   HOH A . 
G 6 HOH   117 717 41  HOH   HOH A . 
G 6 HOH   118 718 201 HOH   HOH A . 
G 6 HOH   119 719 355 HOH   HOH A . 
G 6 HOH   120 720 179 HOH   HOH A . 
G 6 HOH   121 721 217 HOH   HOH A . 
G 6 HOH   122 722 81  HOH   HOH A . 
G 6 HOH   123 723 199 HOH   HOH A . 
G 6 HOH   124 724 274 HOH   HOH A . 
G 6 HOH   125 725 61  HOH   HOH A . 
G 6 HOH   126 726 138 HOH   HOH A . 
G 6 HOH   127 727 148 HOH   HOH A . 
G 6 HOH   128 728 94  HOH   HOH A . 
G 6 HOH   129 729 21  HOH   HOH A . 
G 6 HOH   130 730 135 HOH   HOH A . 
G 6 HOH   131 731 112 HOH   HOH A . 
G 6 HOH   132 732 141 HOH   HOH A . 
G 6 HOH   133 733 126 HOH   HOH A . 
G 6 HOH   134 734 72  HOH   HOH A . 
G 6 HOH   135 735 37  HOH   HOH A . 
G 6 HOH   136 736 158 HOH   HOH A . 
G 6 HOH   137 737 28  HOH   HOH A . 
G 6 HOH   138 738 7   HOH   HOH A . 
G 6 HOH   139 739 208 HOH   HOH A . 
G 6 HOH   140 740 195 HOH   HOH A . 
G 6 HOH   141 741 133 HOH   HOH A . 
G 6 HOH   142 742 327 HOH   HOH A . 
G 6 HOH   143 743 175 HOH   HOH A . 
G 6 HOH   144 744 50  HOH   HOH A . 
G 6 HOH   145 745 102 HOH   HOH A . 
G 6 HOH   146 746 247 HOH   HOH A . 
G 6 HOH   147 747 307 HOH   HOH A . 
G 6 HOH   148 748 128 HOH   HOH A . 
G 6 HOH   149 749 17  HOH   HOH A . 
G 6 HOH   150 750 55  HOH   HOH A . 
G 6 HOH   151 751 103 HOH   HOH A . 
G 6 HOH   152 752 47  HOH   HOH A . 
G 6 HOH   153 753 82  HOH   HOH A . 
G 6 HOH   154 754 166 HOH   HOH A . 
G 6 HOH   155 755 225 HOH   HOH A . 
G 6 HOH   156 756 105 HOH   HOH A . 
G 6 HOH   157 757 317 HOH   HOH A . 
G 6 HOH   158 758 198 HOH   HOH A . 
G 6 HOH   159 759 111 HOH   HOH A . 
G 6 HOH   160 760 118 HOH   HOH A . 
G 6 HOH   161 761 19  HOH   HOH A . 
G 6 HOH   162 762 89  HOH   HOH A . 
G 6 HOH   163 763 183 HOH   HOH A . 
G 6 HOH   164 764 331 HOH   HOH A . 
G 6 HOH   165 765 67  HOH   HOH A . 
G 6 HOH   166 766 46  HOH   HOH A . 
G 6 HOH   167 767 76  HOH   HOH A . 
G 6 HOH   168 768 210 HOH   HOH A . 
G 6 HOH   169 769 35  HOH   HOH A . 
G 6 HOH   170 770 16  HOH   HOH A . 
G 6 HOH   171 771 248 HOH   HOH A . 
G 6 HOH   172 772 98  HOH   HOH A . 
G 6 HOH   173 773 335 HOH   HOH A . 
G 6 HOH   174 774 266 HOH   HOH A . 
G 6 HOH   175 775 97  HOH   HOH A . 
G 6 HOH   176 776 283 HOH   HOH A . 
G 6 HOH   177 777 167 HOH   HOH A . 
G 6 HOH   178 778 87  HOH   HOH A . 
G 6 HOH   179 779 106 HOH   HOH A . 
G 6 HOH   180 780 44  HOH   HOH A . 
G 6 HOH   181 781 211 HOH   HOH A . 
G 6 HOH   182 782 32  HOH   HOH A . 
G 6 HOH   183 783 328 HOH   HOH A . 
G 6 HOH   184 784 350 HOH   HOH A . 
G 6 HOH   185 785 84  HOH   HOH A . 
G 6 HOH   186 786 70  HOH   HOH A . 
G 6 HOH   187 787 203 HOH   HOH A . 
G 6 HOH   188 788 2   HOH   HOH A . 
G 6 HOH   189 789 370 HOH   HOH A . 
G 6 HOH   190 790 48  HOH   HOH A . 
G 6 HOH   191 791 162 HOH   HOH A . 
G 6 HOH   192 792 78  HOH   HOH A . 
G 6 HOH   193 793 65  HOH   HOH A . 
G 6 HOH   194 794 292 HOH   HOH A . 
G 6 HOH   195 795 42  HOH   HOH A . 
G 6 HOH   196 796 52  HOH   HOH A . 
G 6 HOH   197 797 73  HOH   HOH A . 
G 6 HOH   198 798 60  HOH   HOH A . 
G 6 HOH   199 799 62  HOH   HOH A . 
G 6 HOH   200 800 295 HOH   HOH A . 
G 6 HOH   201 801 312 HOH   HOH A . 
G 6 HOH   202 802 38  HOH   HOH A . 
G 6 HOH   203 803 319 HOH   HOH A . 
G 6 HOH   204 804 220 HOH   HOH A . 
G 6 HOH   205 805 347 HOH   HOH A . 
G 6 HOH   206 806 83  HOH   HOH A . 
G 6 HOH   207 807 339 HOH   HOH A . 
G 6 HOH   208 808 308 HOH   HOH A . 
G 6 HOH   209 809 136 HOH   HOH A . 
G 6 HOH   210 810 155 HOH   HOH A . 
G 6 HOH   211 811 154 HOH   HOH A . 
G 6 HOH   212 812 177 HOH   HOH A . 
G 6 HOH   213 813 129 HOH   HOH A . 
G 6 HOH   214 814 204 HOH   HOH A . 
G 6 HOH   215 815 300 HOH   HOH A . 
G 6 HOH   216 816 139 HOH   HOH A . 
G 6 HOH   217 817 321 HOH   HOH A . 
G 6 HOH   218 818 202 HOH   HOH A . 
G 6 HOH   219 819 296 HOH   HOH A . 
G 6 HOH   220 820 346 HOH   HOH A . 
G 6 HOH   221 821 284 HOH   HOH A . 
G 6 HOH   222 822 187 HOH   HOH A . 
G 6 HOH   223 823 14  HOH   HOH A . 
G 6 HOH   224 824 234 HOH   HOH A . 
G 6 HOH   225 825 257 HOH   HOH A . 
G 6 HOH   226 826 184 HOH   HOH A . 
G 6 HOH   227 827 286 HOH   HOH A . 
G 6 HOH   228 828 75  HOH   HOH A . 
G 6 HOH   229 829 134 HOH   HOH A . 
G 6 HOH   230 830 182 HOH   HOH A . 
G 6 HOH   231 831 26  HOH   HOH A . 
G 6 HOH   232 832 264 HOH   HOH A . 
G 6 HOH   233 833 130 HOH   HOH A . 
G 6 HOH   234 834 332 HOH   HOH A . 
G 6 HOH   235 835 275 HOH   HOH A . 
G 6 HOH   236 836 360 HOH   HOH A . 
G 6 HOH   237 837 56  HOH   HOH A . 
G 6 HOH   238 838 336 HOH   HOH A . 
G 6 HOH   239 839 293 HOH   HOH A . 
G 6 HOH   240 840 253 HOH   HOH A . 
G 6 HOH   241 841 289 HOH   HOH A . 
G 6 HOH   242 842 212 HOH   HOH A . 
G 6 HOH   243 843 241 HOH   HOH A . 
G 6 HOH   244 844 151 HOH   HOH A . 
G 6 HOH   245 845 365 HOH   HOH A . 
G 6 HOH   246 846 326 HOH   HOH A . 
G 6 HOH   247 847 303 HOH   HOH A . 
G 6 HOH   248 848 315 HOH   HOH A . 
G 6 HOH   249 849 228 HOH   HOH A . 
G 6 HOH   250 850 373 HOH   HOH A . 
G 6 HOH   251 851 330 HOH   HOH A . 
G 6 HOH   252 852 227 HOH   HOH A . 
G 6 HOH   253 853 197 HOH   HOH A . 
G 6 HOH   254 854 230 HOH   HOH A . 
G 6 HOH   255 855 342 HOH   HOH A . 
G 6 HOH   256 856 173 HOH   HOH A . 
G 6 HOH   257 857 258 HOH   HOH A . 
G 6 HOH   258 858 299 HOH   HOH A . 
G 6 HOH   259 859 146 HOH   HOH A . 
G 6 HOH   260 860 324 HOH   HOH A . 
G 6 HOH   261 861 115 HOH   HOH A . 
G 6 HOH   262 862 368 HOH   HOH A . 
G 6 HOH   263 863 229 HOH   HOH A . 
G 6 HOH   264 864 316 HOH   HOH A . 
G 6 HOH   265 865 348 HOH   HOH A . 
G 6 HOH   266 866 256 HOH   HOH A . 
G 6 HOH   267 867 147 HOH   HOH A . 
G 6 HOH   268 868 364 HOH   HOH A . 
G 6 HOH   269 869 282 HOH   HOH A . 
G 6 HOH   270 870 280 HOH   HOH A . 
G 6 HOH   271 871 222 HOH   HOH A . 
G 6 HOH   272 872 153 HOH   HOH A . 
G 6 HOH   273 873 181 HOH   HOH A . 
G 6 HOH   274 874 231 HOH   HOH A . 
G 6 HOH   275 875 243 HOH   HOH A . 
G 6 HOH   276 876 145 HOH   HOH A . 
G 6 HOH   277 877 117 HOH   HOH A . 
G 6 HOH   278 878 36  HOH   HOH A . 
G 6 HOH   279 879 287 HOH   HOH A . 
G 6 HOH   280 880 205 HOH   HOH A . 
G 6 HOH   281 881 43  HOH   HOH A . 
G 6 HOH   282 882 116 HOH   HOH A . 
G 6 HOH   283 883 246 HOH   HOH A . 
G 6 HOH   284 884 224 HOH   HOH A . 
G 6 HOH   285 885 273 HOH   HOH A . 
G 6 HOH   286 886 178 HOH   HOH A . 
G 6 HOH   287 887 359 HOH   HOH A . 
G 6 HOH   288 888 77  HOH   HOH A . 
G 6 HOH   289 889 345 HOH   HOH A . 
G 6 HOH   290 890 216 HOH   HOH A . 
G 6 HOH   291 891 260 HOH   HOH A . 
G 6 HOH   292 892 354 HOH   HOH A . 
G 6 HOH   293 893 356 HOH   HOH A . 
G 6 HOH   294 894 180 HOH   HOH A . 
G 6 HOH   295 895 120 HOH   HOH A . 
G 6 HOH   296 896 362 HOH   HOH A . 
G 6 HOH   297 897 215 HOH   HOH A . 
G 6 HOH   298 898 165 HOH   HOH A . 
G 6 HOH   299 899 294 HOH   HOH A . 
G 6 HOH   300 900 53  HOH   HOH A . 
G 6 HOH   301 901 188 HOH   HOH A . 
G 6 HOH   302 902 170 HOH   HOH A . 
G 6 HOH   303 903 270 HOH   HOH A . 
G 6 HOH   304 904 99  HOH   HOH A . 
G 6 HOH   305 905 200 HOH   HOH A . 
G 6 HOH   306 906 281 HOH   HOH A . 
G 6 HOH   307 907 288 HOH   HOH A . 
G 6 HOH   308 908 160 HOH   HOH A . 
G 6 HOH   309 909 176 HOH   HOH A . 
G 6 HOH   310 910 164 HOH   HOH A . 
G 6 HOH   311 911 255 HOH   HOH A . 
G 6 HOH   312 912 245 HOH   HOH A . 
G 6 HOH   313 913 96  HOH   HOH A . 
G 6 HOH   314 914 334 HOH   HOH A . 
G 6 HOH   315 915 306 HOH   HOH A . 
G 6 HOH   316 916 172 HOH   HOH A . 
G 6 HOH   317 917 214 HOH   HOH A . 
G 6 HOH   318 918 352 HOH   HOH A . 
G 6 HOH   319 919 213 HOH   HOH A . 
G 6 HOH   320 920 341 HOH   HOH A . 
G 6 HOH   321 921 366 HOH   HOH A . 
G 6 HOH   322 922 123 HOH   HOH A . 
G 6 HOH   323 923 358 HOH   HOH A . 
G 6 HOH   324 924 265 HOH   HOH A . 
G 6 HOH   325 925 189 HOH   HOH A . 
G 6 HOH   326 926 311 HOH   HOH A . 
G 6 HOH   327 927 251 HOH   HOH A . 
G 6 HOH   328 928 152 HOH   HOH A . 
G 6 HOH   329 929 207 HOH   HOH A . 
G 6 HOH   330 930 268 HOH   HOH A . 
G 6 HOH   331 931 18  HOH   HOH A . 
G 6 HOH   332 932 80  HOH   HOH A . 
G 6 HOH   333 933 161 HOH   HOH A . 
G 6 HOH   334 934 367 HOH   HOH A . 
G 6 HOH   335 935 351 HOH   HOH A . 
G 6 HOH   336 936 263 HOH   HOH A . 
G 6 HOH   337 937 252 HOH   HOH A . 
G 6 HOH   338 938 244 HOH   HOH A . 
G 6 HOH   339 939 310 HOH   HOH A . 
G 6 HOH   340 940 277 HOH   HOH A . 
G 6 HOH   341 941 88  HOH   HOH A . 
G 6 HOH   342 942 278 HOH   HOH A . 
G 6 HOH   343 943 259 HOH   HOH A . 
G 6 HOH   344 944 329 HOH   HOH A . 
G 6 HOH   345 945 261 HOH   HOH A . 
G 6 HOH   346 946 194 HOH   HOH A . 
G 6 HOH   347 947 104 HOH   HOH A . 
G 6 HOH   348 948 298 HOH   HOH A . 
G 6 HOH   349 949 249 HOH   HOH A . 
G 6 HOH   350 950 185 HOH   HOH A . 
G 6 HOH   351 951 235 HOH   HOH A . 
G 6 HOH   352 952 267 HOH   HOH A . 
G 6 HOH   353 953 186 HOH   HOH A . 
G 6 HOH   354 954 369 HOH   HOH A . 
G 6 HOH   355 955 290 HOH   HOH A . 
G 6 HOH   356 956 361 HOH   HOH A . 
G 6 HOH   357 957 343 HOH   HOH A . 
G 6 HOH   358 958 140 HOH   HOH A . 
G 6 HOH   359 959 302 HOH   HOH A . 
G 6 HOH   360 960 305 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 reduction' ? ? ? ? ? ? ? ? ? ? ? DIALS  ? ? ? .           2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? DIALS  ? ? ? .           3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .           4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8RWP 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     60.140 
_cell.length_a_esd                 ? 
_cell.length_b                     78.490 
_cell.length_b_esd                 ? 
_cell.length_c                     55.640 
_cell.length_c_esd                 ? 
_cell.volume                       262642.422 
_cell.volume_esd                   ? 
_cell.Z_PDB                        4 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         8RWP 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                18 
_symmetry.space_group_name_Hall            'P 2 2ab' 
_symmetry.space_group_name_H-M             'P 21 21 2' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   8RWP 
_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             2.13 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          42.18 
_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, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '2.0 M Ammonium Sulphate, 5% ethanol' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293.15 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER2 XE 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2022-02-25 
_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   0.8153 
_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                        'DIAMOND BEAMLINE I03' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.8153 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   I03 
_diffrn_source.pdbx_synchrotron_site       Diamond 
# 
_reflns.B_iso_Wilson_estimate                          16.15 
_reflns.entry_id                                       8RWP 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.19 
_reflns.d_resolution_low                               45.39 
_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                                     84567 
_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                           100 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                13.5 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          10 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                ? 
_reflns.pdbx_Rpim_I_all                                0.033 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   1.000 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.19 
_reflns_shell.d_res_low                                     1.21 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           0.4 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             8048 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               13.9 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_reflns_shell.pdbx_Rpim_I_all                               1.005 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.295 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          100 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               23.41 
_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                                 8RWP 
_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                            1.19 
_refine.ls_d_res_low                             45.39 
_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                     84567 
_refine.ls_number_reflns_R_free                  4145 
_refine.ls_number_reflns_R_work                  80422 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.48 
_refine.ls_percent_reflns_R_free                 4.90 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1566 
_refine.ls_R_factor_R_free                       0.1794 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1554 
_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                          1.33 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'GeoStd + Monomer Library + CDL v1.2' 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.1000 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.9000 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 24.9511 
_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                            0.1835 
_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                       1.19 
_refine_hist.d_res_low                        45.39 
_refine_hist.number_atoms_solvent             360 
_refine_hist.number_atoms_total               2426 
_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        2021 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         45 
_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' ? 0.0081  ? 2247 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.9988  ? 3078 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0724  ? 338  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0124  ? 405  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 12.2906 ? 824  ? f_dihedral_angle_d ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.19 1.20  . . 129 2562 95.90  . . . . 0.4620 . . . . . . . . . . . 0.4549 
'X-RAY DIFFRACTION' 1.20 1.22  . . 126 2511 95.10  . . . . 0.4555 . . . . . . . . . . . 0.4516 
'X-RAY DIFFRACTION' 1.22 1.23  . . 135 2585 97.14  . . . . 0.4280 . . . . . . . . . . . 0.4454 
'X-RAY DIFFRACTION' 1.23 1.25  . . 165 2600 99.03  . . . . 0.4063 . . . . . . . . . . . 0.4072 
'X-RAY DIFFRACTION' 1.25 1.26  . . 147 2643 99.61  . . . . 0.3767 . . . . . . . . . . . 0.3838 
'X-RAY DIFFRACTION' 1.26 1.28  . . 134 2656 99.57  . . . . 0.3593 . . . . . . . . . . . 0.4081 
'X-RAY DIFFRACTION' 1.28 1.30  . . 153 2671 99.96  . . . . 0.3501 . . . . . . . . . . . 0.3590 
'X-RAY DIFFRACTION' 1.30 1.32  . . 117 2675 99.79  . . . . 0.3271 . . . . . . . . . . . 0.3438 
'X-RAY DIFFRACTION' 1.32 1.34  . . 132 2635 99.78  . . . . 0.3118 . . . . . . . . . . . 0.2978 
'X-RAY DIFFRACTION' 1.34 1.36  . . 134 2679 99.68  . . . . 0.2939 . . . . . . . . . . . 0.3367 
'X-RAY DIFFRACTION' 1.36 1.39  . . 131 2666 99.89  . . . . 0.2802 . . . . . . . . . . . 0.2816 
'X-RAY DIFFRACTION' 1.39 1.41  . . 126 2675 99.79  . . . . 0.2459 . . . . . . . . . . . 0.2690 
'X-RAY DIFFRACTION' 1.41 1.44  . . 143 2688 99.82  . . . . 0.2232 . . . . . . . . . . . 0.2503 
'X-RAY DIFFRACTION' 1.44 1.47  . . 140 2659 100.00 . . . . 0.1972 . . . . . . . . . . . 0.2540 
'X-RAY DIFFRACTION' 1.47 1.50  . . 143 2675 100.00 . . . . 0.1932 . . . . . . . . . . . 0.2227 
'X-RAY DIFFRACTION' 1.50 1.53  . . 128 2679 99.96  . . . . 0.1670 . . . . . . . . . . . 0.2217 
'X-RAY DIFFRACTION' 1.53 1.57  . . 138 2701 99.93  . . . . 0.1562 . . . . . . . . . . . 0.2272 
'X-RAY DIFFRACTION' 1.57 1.62  . . 156 2632 99.79  . . . . 0.1467 . . . . . . . . . . . 0.1897 
'X-RAY DIFFRACTION' 1.62 1.66  . . 132 2690 99.89  . . . . 0.1398 . . . . . . . . . . . 0.1928 
'X-RAY DIFFRACTION' 1.66 1.72  . . 133 2708 99.93  . . . . 0.1342 . . . . . . . . . . . 0.1700 
'X-RAY DIFFRACTION' 1.72 1.78  . . 131 2709 100.00 . . . . 0.1269 . . . . . . . . . . . 0.1764 
'X-RAY DIFFRACTION' 1.78 1.85  . . 137 2677 100.00 . . . . 0.1185 . . . . . . . . . . . 0.1592 
'X-RAY DIFFRACTION' 1.85 1.93  . . 167 2679 99.89  . . . . 0.1179 . . . . . . . . . . . 0.1890 
'X-RAY DIFFRACTION' 1.93 2.03  . . 145 2699 99.96  . . . . 0.1018 . . . . . . . . . . . 0.1358 
'X-RAY DIFFRACTION' 2.03 2.16  . . 141 2718 99.97  . . . . 0.1108 . . . . . . . . . . . 0.1392 
'X-RAY DIFFRACTION' 2.16 2.33  . . 134 2732 100.00 . . . . 0.1153 . . . . . . . . . . . 0.1514 
'X-RAY DIFFRACTION' 2.33 2.56  . . 151 2731 100.00 . . . . 0.1118 . . . . . . . . . . . 0.1317 
'X-RAY DIFFRACTION' 2.56 2.93  . . 112 2784 99.97  . . . . 0.1228 . . . . . . . . . . . 0.1236 
'X-RAY DIFFRACTION' 2.93 3.70  . . 143 2779 99.93  . . . . 0.1363 . . . . . . . . . . . 0.1506 
'X-RAY DIFFRACTION' 3.70 45.39 . . 142 2924 99.93  . . . . 0.1531 . . . . . . . . . . . 0.1580 
# 
_struct.entry_id                     8RWP 
_struct.title                        'KPC-2 G89D Mutant in Complex with Avibactam' 
_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        8RWP 
_struct_keywords.text            'Beta-Lactamase, Inhibitor, Antibiotic Resistance, ANTIMICROBIAL PROTEIN' 
_struct_keywords.pdbx_keywords   'ANTIMICROBIAL 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 3 ? 
D N N 4 ? 
E N N 5 ? 
F N N 5 ? 
G N N 6 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    BLKPC_KLEPN 
_struct_ref.pdbx_db_accession          Q9F663 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;LTNLVAEPFAKLEQDFGGSIGVYAMDTGSGATVSYRAEERFPLCSSFKGFLAAAVLARSQQQAGLLDTPIRYGKNALVPW
SPISEKYLTTGMTVAELSAAAVQYSDNAAANLLLKELGGPAGLTAFMRSIGDTTFRLDRWELELNSAIPGDARDTSSPRA
VTESLQKLTLGSALAAPQRQQFVDWLKGNTTGNHRIRAAVPADWAVGDKTGTCGVYGTANDYAVVWPTGRAPIVLAVYTR
APNKDDKHSEAVIAAAARLALEGLGVNGQ
;
_struct_ref.pdbx_align_begin           0 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              8RWP 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 22 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 290 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             Q9F663 
_struct_ref_seq.db_align_beg                  25 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  293 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       25 
_struct_ref_seq.pdbx_auth_seq_align_end       295 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 8RWP MET A 1  ? UNP Q9F663 ?   ?  'initiating methionine' 4  1  
1 8RWP GLY A 2  ? UNP Q9F663 ?   ?  'expression tag'        5  2  
1 8RWP SER A 3  ? UNP Q9F663 ?   ?  'expression tag'        6  3  
1 8RWP SER A 4  ? UNP Q9F663 ?   ?  'expression tag'        7  4  
1 8RWP HIS A 5  ? UNP Q9F663 ?   ?  'expression tag'        8  5  
1 8RWP HIS A 6  ? UNP Q9F663 ?   ?  'expression tag'        9  6  
1 8RWP HIS A 7  ? UNP Q9F663 ?   ?  'expression tag'        10 7  
1 8RWP HIS A 8  ? UNP Q9F663 ?   ?  'expression tag'        11 8  
1 8RWP HIS A 9  ? UNP Q9F663 ?   ?  'expression tag'        12 9  
1 8RWP HIS A 10 ? UNP Q9F663 ?   ?  'expression tag'        13 10 
1 8RWP SER A 11 ? UNP Q9F663 ?   ?  'expression tag'        14 11 
1 8RWP SER A 12 ? UNP Q9F663 ?   ?  'expression tag'        15 12 
1 8RWP GLY A 13 ? UNP Q9F663 ?   ?  'expression tag'        16 13 
1 8RWP LEU A 14 ? UNP Q9F663 ?   ?  'expression tag'        17 14 
1 8RWP VAL A 15 ? UNP Q9F663 ?   ?  'expression tag'        18 15 
1 8RWP PRO A 16 ? UNP Q9F663 ?   ?  'expression tag'        19 16 
1 8RWP ARG A 17 ? UNP Q9F663 ?   ?  'expression tag'        20 17 
1 8RWP GLY A 18 ? UNP Q9F663 ?   ?  'expression tag'        21 18 
1 8RWP SER A 19 ? UNP Q9F663 ?   ?  'expression tag'        22 19 
1 8RWP HIS A 20 ? UNP Q9F663 ?   ?  'expression tag'        23 20 
1 8RWP MET A 21 ? UNP Q9F663 ?   ?  'expression tag'        24 21 
1 8RWP ASP A 85 ? UNP Q9F663 GLY 88 'engineered mutation'   89 22 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 560   ? 
1 MORE         -30   ? 
1 'SSA (A^2)'  11010 ? 
# 
_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   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 PRO A 29  ? GLY A 38  ? PRO A 32  GLY A 41  1 ? 10 
HELX_P HELX_P2  AA2 SER A 67  ? GLN A 81  ? SER A 71  GLN A 85  1 ? 15 
HELX_P HELX_P3  AA3 GLY A 94  ? LEU A 98  ? GLY A 98  LEU A 102 5 ? 5  
HELX_P HELX_P4  AA4 ILE A 104 ? LEU A 109 ? ILE A 108 LEU A 113 5 ? 6  
HELX_P HELX_P5  AA5 VAL A 115 ? TYR A 125 ? VAL A 119 TYR A 129 1 ? 11 
HELX_P HELX_P6  AA6 ASP A 127 ? LEU A 138 ? ASP A 131 LEU A 142 1 ? 12 
HELX_P HELX_P7  AA7 GLY A 139 ? ILE A 151 ? GLY A 143 ILE A 155 1 ? 13 
HELX_P HELX_P8  AA8 LEU A 163 ? SER A 167 ? LEU A 167 SER A 171 5 ? 5  
HELX_P HELX_P9  AA9 SER A 178 ? LEU A 191 ? SER A 182 LEU A 195 1 ? 14 
HELX_P HELX_P10 AB1 ALA A 196 ? GLY A 209 ? ALA A 200 GLY A 213 1 ? 14 
HELX_P HELX_P11 AB2 ARG A 216 ? VAL A 221 ? ARG A 220 VAL A 225 5 ? 6  
HELX_P HELX_P12 AB3 SER A 270 ? LEU A 285 ? SER A 275 LEU A 290 1 ? 16 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1 disulf ?    ? A CYS 65 SG ? ? ? 1_555 A CYS   234 SG  ? ? A CYS 69 A CYS   238 1_555 ? ? ? ? ? ? ? 2.064 ? ? 
covale1 covale none ? A SER 66 OG ? ? ? 1_555 C NXL   .   CAN A ? A SER 70 A NXL   502 1_555 ? ? ? ? ? ? ? 1.373 ? ? 
covale2 covale none ? A SER 66 OG ? ? ? 1_555 D A1H3M .   C   B ? A SER 70 A A1H3M 503 1_555 ? ? ? ? ? ? ? 1.372 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1 NXL   C .  A SER A 66  ? NXL   A 502 ? 1_555 SER A 70  ? 1_555 CAN OG SER 2 NXL   None 'Covalent chemical modification' 
2 A1H3M D .  B SER A 66  ? A1H3M A 503 ? 1_555 SER A 70  ? 1_555 C   OG SER 1 A1H3M None 'Covalent chemical modification' 
3 CYS   A 65 ? CYS A 234 ? CYS   A 69  ? 1_555 CYS A 238 ? 1_555 SG  SG .   . .     None 'Disulfide bridge'               
# 
_struct_mon_prot_cis.pdbx_id                1 
_struct_mon_prot_cis.label_comp_id          GLU 
_struct_mon_prot_cis.label_seq_id           162 
_struct_mon_prot_cis.label_asym_id          A 
_struct_mon_prot_cis.label_alt_id           . 
_struct_mon_prot_cis.pdbx_PDB_ins_code      ? 
_struct_mon_prot_cis.auth_comp_id           GLU 
_struct_mon_prot_cis.auth_seq_id            166 
_struct_mon_prot_cis.auth_asym_id           A 
_struct_mon_prot_cis.pdbx_label_comp_id_2   LEU 
_struct_mon_prot_cis.pdbx_label_seq_id_2    163 
_struct_mon_prot_cis.pdbx_label_asym_id_2   A 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2    ? 
_struct_mon_prot_cis.pdbx_auth_comp_id_2    LEU 
_struct_mon_prot_cis.pdbx_auth_seq_id_2     167 
_struct_mon_prot_cis.pdbx_auth_asym_id_2    A 
_struct_mon_prot_cis.pdbx_PDB_model_num     1 
_struct_mon_prot_cis.pdbx_omega_angle       6.99 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 2 ? 
AA3 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA3 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 THR A 53  ? TYR A 56  ? THR A 56  TYR A 60  
AA1 2 SER A 40  ? ASP A 47  ? SER A 43  ASP A 50  
AA1 3 ILE A 254 ? ARG A 261 ? ILE A 259 ARG A 266 
AA1 4 ALA A 240 ? TRP A 247 ? ALA A 244 TRP A 251 
AA1 5 ALA A 226 ? THR A 233 ? ALA A 230 THR A 237 
AA2 1 PHE A 62  ? PRO A 63  ? PHE A 66  PRO A 67  
AA2 2 THR A 176 ? SER A 177 ? THR A 180 SER A 181 
AA3 1 PRO A 90  ? ILE A 91  ? PRO A 94  ILE A 95  
AA3 2 MET A 113 ? THR A 114 ? MET A 117 THR A 118 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 O TYR A 56  ? O TYR A 60  N VAL A 43  ? N VAL A 46  
AA1 2 3 N GLY A 42  ? N GLY A 45  O TYR A 259 ? O TYR A 264 
AA1 3 4 O ILE A 254 ? O ILE A 259 N VAL A 246 ? N VAL A 250 
AA1 4 5 O TRP A 247 ? O TRP A 251 N ALA A 226 ? N ALA A 230 
AA2 1 2 N PHE A 62  ? N PHE A 66  O SER A 177 ? O SER A 181 
AA3 1 2 N ILE A 91  ? N ILE A 95  O MET A 113 ? O MET A 117 
# 
_pdbx_entry_details.entry_id                   8RWP 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1  1 O A HOH 635 ? ? O A HOH 668 ? ? 1.68 
2  1 O A HOH 875 ? ? O A HOH 956 ? ? 1.73 
3  1 O A HOH 624 ? ? O A HOH 801 ? ? 1.74 
4  1 O A HOH 940 ? ? O A HOH 956 ? ? 1.77 
5  1 O A HOH 601 ? ? O A HOH 603 ? ? 1.78 
6  1 O A HOH 655 ? ? O A HOH 887 ? ? 1.78 
7  1 O A HOH 742 ? ? O A HOH 755 ? ? 1.85 
8  1 O A HOH 789 ? ? O A HOH 864 ? ? 1.87 
9  1 O A HOH 849 ? ? O A HOH 857 ? ? 1.87 
10 1 O A HOH 800 ? ? O A HOH 879 ? ? 1.88 
11 1 O A HOH 757 ? ? O A HOH 914 ? ? 1.88 
12 1 O A HOH 628 ? A O A HOH 865 ? A 1.90 
13 1 O A HOH 763 ? ? O A HOH 846 ? ? 1.93 
14 1 O A HOH 860 ? ? O A HOH 887 ? ? 1.99 
15 1 O A HOH 816 ? ? O A HOH 855 ? ? 2.01 
16 1 O A HOH 608 ? ? O A HOH 837 ? ? 2.04 
17 1 O A HOH 892 ? ? O A HOH 914 ? ? 2.05 
18 1 O A HOH 835 ? ? O A HOH 842 ? ? 2.08 
19 1 O A HOH 718 ? ? O A HOH 852 ? ? 2.08 
20 1 O A HOH 854 ? ? O A HOH 873 ? ? 2.09 
21 1 O A HOH 774 ? ? O A HOH 821 ? ? 2.17 
22 1 O A HOH 929 ? ? O A HOH 936 ? ? 2.17 
23 1 O A HOH 631 ? ? O A HOH 676 ? ? 2.19 
# 
loop_
_pdbx_validate_symm_contact.id 
_pdbx_validate_symm_contact.PDB_model_num 
_pdbx_validate_symm_contact.auth_atom_id_1 
_pdbx_validate_symm_contact.auth_asym_id_1 
_pdbx_validate_symm_contact.auth_comp_id_1 
_pdbx_validate_symm_contact.auth_seq_id_1 
_pdbx_validate_symm_contact.PDB_ins_code_1 
_pdbx_validate_symm_contact.label_alt_id_1 
_pdbx_validate_symm_contact.site_symmetry_1 
_pdbx_validate_symm_contact.auth_atom_id_2 
_pdbx_validate_symm_contact.auth_asym_id_2 
_pdbx_validate_symm_contact.auth_comp_id_2 
_pdbx_validate_symm_contact.auth_seq_id_2 
_pdbx_validate_symm_contact.PDB_ins_code_2 
_pdbx_validate_symm_contact.label_alt_id_2 
_pdbx_validate_symm_contact.site_symmetry_2 
_pdbx_validate_symm_contact.dist 
1 1 O A HOH 817 ? ? 1_555 O A HOH 875 ? ? 4_556 1.74 
2 1 O A HOH 638 ? ? 1_555 O A HOH 817 ? ? 4_456 1.86 
3 1 O A HOH 820 ? ? 1_555 O A HOH 935 ? ? 4_455 1.86 
4 1 O A HOH 652 ? ? 1_555 O A HOH 903 ? ? 1_554 1.87 
5 1 O A HOH 606 ? ? 1_555 O A HOH 930 ? ? 4_455 1.97 
6 1 O A HOH 869 ? ? 1_555 O A HOH 948 ? ? 3_556 2.01 
7 1 O A HOH 709 ? ? 1_555 O A HOH 805 ? ? 4_455 2.04 
8 1 O A HOH 610 ? ? 1_555 O A HOH 735 ? ? 4_556 2.18 
# 
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 CYS A 69  ? ? 51.43   -142.31 
2 1 TRP A 105 ? C 70.36   55.77   
3 1 ARG A 220 ? ? -116.24 -123.55 
# 
_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     153 
_pdbx_validate_planes.PDB_ins_code    ? 
_pdbx_validate_planes.label_alt_id    ? 
_pdbx_validate_planes.rmsd            0.080 
_pdbx_validate_planes.type            'SIDE CHAIN' 
# 
loop_
_pdbx_struct_special_symmetry.id 
_pdbx_struct_special_symmetry.PDB_model_num 
_pdbx_struct_special_symmetry.auth_asym_id 
_pdbx_struct_special_symmetry.auth_comp_id 
_pdbx_struct_special_symmetry.auth_seq_id 
_pdbx_struct_special_symmetry.PDB_ins_code 
_pdbx_struct_special_symmetry.label_asym_id 
_pdbx_struct_special_symmetry.label_comp_id 
_pdbx_struct_special_symmetry.label_seq_id 
1 1 A HOH 698 ? G HOH . 
2 1 A HOH 889 ? G HOH . 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z           
2 x+1/2,-y+1/2,-z 
3 -x+1/2,y+1/2,-z 
4 -x,-y,z         
# 
_pdbx_distant_solvent_atoms.id                                1 
_pdbx_distant_solvent_atoms.PDB_model_num                     1 
_pdbx_distant_solvent_atoms.auth_atom_id                      O 
_pdbx_distant_solvent_atoms.label_alt_id                      ? 
_pdbx_distant_solvent_atoms.auth_asym_id                      A 
_pdbx_distant_solvent_atoms.auth_comp_id                      HOH 
_pdbx_distant_solvent_atoms.auth_seq_id                       960 
_pdbx_distant_solvent_atoms.PDB_ins_code                      ? 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance   5.93 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance          . 
# 
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 4   ? A MET 1   
2  1 Y 1 A GLY 5   ? A GLY 2   
3  1 Y 1 A SER 6   ? A SER 3   
4  1 Y 1 A SER 7   ? A SER 4   
5  1 Y 1 A HIS 8   ? A HIS 5   
6  1 Y 1 A HIS 9   ? A HIS 6   
7  1 Y 1 A HIS 10  ? A HIS 7   
8  1 Y 1 A HIS 11  ? A HIS 8   
9  1 Y 1 A HIS 12  ? A HIS 9   
10 1 Y 1 A HIS 13  ? A HIS 10  
11 1 Y 1 A SER 14  ? A SER 11  
12 1 Y 1 A SER 15  ? A SER 12  
13 1 Y 1 A GLY 16  ? A GLY 13  
14 1 Y 1 A LEU 17  ? A LEU 14  
15 1 Y 1 A VAL 18  ? A VAL 15  
16 1 Y 1 A PRO 19  ? A PRO 16  
17 1 Y 1 A ARG 20  ? A ARG 17  
18 1 Y 1 A GLY 21  ? A GLY 18  
19 1 Y 1 A SER 22  ? A SER 19  
20 1 Y 1 A GLN 295 ? A GLN 290 
# 
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 
A1H3M C5   C N N 1   
A1H3M C6   C N N 2   
A1H3M N1   N N N 3   
A1H3M C2   C N N 4   
A1H3M C4   C N N 5   
A1H3M N    N N N 6   
A1H3M C    C N N 7   
A1H3M O    O N N 8   
A1H3M C1   C N N 9   
A1H3M C3   C N S 10  
A1H3M N2   N N N 11  
A1H3M O1   O N N 12  
A1H3M H7   H N N 13  
A1H3M H8   H N N 14  
A1H3M H4   H N N 15  
A1H3M H6   H N N 16  
A1H3M H5   H N N 17  
A1H3M H    H N N 18  
A1H3M H3   H N N 19  
A1H3M H2   H N N 20  
A1H3M H1   H N N 21  
A1H3M H9   H N N 22  
A1H3M H10  H N N 23  
ALA   N    N N N 24  
ALA   CA   C N S 25  
ALA   C    C N N 26  
ALA   O    O N N 27  
ALA   CB   C N N 28  
ALA   OXT  O N N 29  
ALA   H    H N N 30  
ALA   H2   H N N 31  
ALA   HA   H N N 32  
ALA   HB1  H N N 33  
ALA   HB2  H N N 34  
ALA   HB3  H N N 35  
ALA   HXT  H N N 36  
ARG   N    N N N 37  
ARG   CA   C N S 38  
ARG   C    C N N 39  
ARG   O    O N N 40  
ARG   CB   C N N 41  
ARG   CG   C N N 42  
ARG   CD   C N N 43  
ARG   NE   N N N 44  
ARG   CZ   C N N 45  
ARG   NH1  N N N 46  
ARG   NH2  N N N 47  
ARG   OXT  O N N 48  
ARG   H    H N N 49  
ARG   H2   H N N 50  
ARG   HA   H N N 51  
ARG   HB2  H N N 52  
ARG   HB3  H N N 53  
ARG   HG2  H N N 54  
ARG   HG3  H N N 55  
ARG   HD2  H N N 56  
ARG   HD3  H N N 57  
ARG   HE   H N N 58  
ARG   HH11 H N N 59  
ARG   HH12 H N N 60  
ARG   HH21 H N N 61  
ARG   HH22 H N N 62  
ARG   HXT  H N N 63  
ASN   N    N N N 64  
ASN   CA   C N S 65  
ASN   C    C N N 66  
ASN   O    O N N 67  
ASN   CB   C N N 68  
ASN   CG   C N N 69  
ASN   OD1  O N N 70  
ASN   ND2  N N N 71  
ASN   OXT  O N N 72  
ASN   H    H N N 73  
ASN   H2   H N N 74  
ASN   HA   H N N 75  
ASN   HB2  H N N 76  
ASN   HB3  H N N 77  
ASN   HD21 H N N 78  
ASN   HD22 H N N 79  
ASN   HXT  H N N 80  
ASP   N    N N N 81  
ASP   CA   C N S 82  
ASP   C    C N N 83  
ASP   O    O N N 84  
ASP   CB   C N N 85  
ASP   CG   C N N 86  
ASP   OD1  O N N 87  
ASP   OD2  O N N 88  
ASP   OXT  O N N 89  
ASP   H    H N N 90  
ASP   H2   H N N 91  
ASP   HA   H N N 92  
ASP   HB2  H N N 93  
ASP   HB3  H N N 94  
ASP   HD2  H N N 95  
ASP   HXT  H N N 96  
CYS   N    N N N 97  
CYS   CA   C N R 98  
CYS   C    C N N 99  
CYS   O    O N N 100 
CYS   CB   C N N 101 
CYS   SG   S N N 102 
CYS   OXT  O N N 103 
CYS   H    H N N 104 
CYS   H2   H N N 105 
CYS   HA   H N N 106 
CYS   HB2  H N N 107 
CYS   HB3  H N N 108 
CYS   HG   H N N 109 
CYS   HXT  H N N 110 
GLN   N    N N N 111 
GLN   CA   C N S 112 
GLN   C    C N N 113 
GLN   O    O N N 114 
GLN   CB   C N N 115 
GLN   CG   C N N 116 
GLN   CD   C N N 117 
GLN   OE1  O N N 118 
GLN   NE2  N N N 119 
GLN   OXT  O N N 120 
GLN   H    H N N 121 
GLN   H2   H N N 122 
GLN   HA   H N N 123 
GLN   HB2  H N N 124 
GLN   HB3  H N N 125 
GLN   HG2  H N N 126 
GLN   HG3  H N N 127 
GLN   HE21 H N N 128 
GLN   HE22 H N N 129 
GLN   HXT  H N N 130 
GLU   N    N N N 131 
GLU   CA   C N S 132 
GLU   C    C N N 133 
GLU   O    O N N 134 
GLU   CB   C N N 135 
GLU   CG   C N N 136 
GLU   CD   C N N 137 
GLU   OE1  O N N 138 
GLU   OE2  O N N 139 
GLU   OXT  O N N 140 
GLU   H    H N N 141 
GLU   H2   H N N 142 
GLU   HA   H N N 143 
GLU   HB2  H N N 144 
GLU   HB3  H N N 145 
GLU   HG2  H N N 146 
GLU   HG3  H N N 147 
GLU   HE2  H N N 148 
GLU   HXT  H N N 149 
GLY   N    N N N 150 
GLY   CA   C N N 151 
GLY   C    C N N 152 
GLY   O    O N N 153 
GLY   OXT  O N N 154 
GLY   H    H N N 155 
GLY   H2   H N N 156 
GLY   HA2  H N N 157 
GLY   HA3  H N N 158 
GLY   HXT  H N N 159 
GOL   C1   C N N 160 
GOL   O1   O N N 161 
GOL   C2   C N N 162 
GOL   O2   O N N 163 
GOL   C3   C N N 164 
GOL   O3   O N N 165 
GOL   H11  H N N 166 
GOL   H12  H N N 167 
GOL   HO1  H N N 168 
GOL   H2   H N N 169 
GOL   HO2  H N N 170 
GOL   H31  H N N 171 
GOL   H32  H N N 172 
GOL   HO3  H N N 173 
HIS   N    N N N 174 
HIS   CA   C N S 175 
HIS   C    C N N 176 
HIS   O    O N N 177 
HIS   CB   C N N 178 
HIS   CG   C Y N 179 
HIS   ND1  N Y N 180 
HIS   CD2  C Y N 181 
HIS   CE1  C Y N 182 
HIS   NE2  N Y N 183 
HIS   OXT  O N N 184 
HIS   H    H N N 185 
HIS   H2   H N N 186 
HIS   HA   H N N 187 
HIS   HB2  H N N 188 
HIS   HB3  H N N 189 
HIS   HD1  H N N 190 
HIS   HD2  H N N 191 
HIS   HE1  H N N 192 
HIS   HE2  H N N 193 
HIS   HXT  H N N 194 
HOH   O    O N N 195 
HOH   H1   H N N 196 
HOH   H2   H N N 197 
ILE   N    N N N 198 
ILE   CA   C N S 199 
ILE   C    C N N 200 
ILE   O    O N N 201 
ILE   CB   C N S 202 
ILE   CG1  C N N 203 
ILE   CG2  C N N 204 
ILE   CD1  C N N 205 
ILE   OXT  O N N 206 
ILE   H    H N N 207 
ILE   H2   H N N 208 
ILE   HA   H N N 209 
ILE   HB   H N N 210 
ILE   HG12 H N N 211 
ILE   HG13 H N N 212 
ILE   HG21 H N N 213 
ILE   HG22 H N N 214 
ILE   HG23 H N N 215 
ILE   HD11 H N N 216 
ILE   HD12 H N N 217 
ILE   HD13 H N N 218 
ILE   HXT  H N N 219 
LEU   N    N N N 220 
LEU   CA   C N S 221 
LEU   C    C N N 222 
LEU   O    O N N 223 
LEU   CB   C N N 224 
LEU   CG   C N N 225 
LEU   CD1  C N N 226 
LEU   CD2  C N N 227 
LEU   OXT  O N N 228 
LEU   H    H N N 229 
LEU   H2   H N N 230 
LEU   HA   H N N 231 
LEU   HB2  H N N 232 
LEU   HB3  H N N 233 
LEU   HG   H N N 234 
LEU   HD11 H N N 235 
LEU   HD12 H N N 236 
LEU   HD13 H N N 237 
LEU   HD21 H N N 238 
LEU   HD22 H N N 239 
LEU   HD23 H N N 240 
LEU   HXT  H N N 241 
LYS   N    N N N 242 
LYS   CA   C N S 243 
LYS   C    C N N 244 
LYS   O    O N N 245 
LYS   CB   C N N 246 
LYS   CG   C N N 247 
LYS   CD   C N N 248 
LYS   CE   C N N 249 
LYS   NZ   N N N 250 
LYS   OXT  O N N 251 
LYS   H    H N N 252 
LYS   H2   H N N 253 
LYS   HA   H N N 254 
LYS   HB2  H N N 255 
LYS   HB3  H N N 256 
LYS   HG2  H N N 257 
LYS   HG3  H N N 258 
LYS   HD2  H N N 259 
LYS   HD3  H N N 260 
LYS   HE2  H N N 261 
LYS   HE3  H N N 262 
LYS   HZ1  H N N 263 
LYS   HZ2  H N N 264 
LYS   HZ3  H N N 265 
LYS   HXT  H N N 266 
MET   N    N N N 267 
MET   CA   C N S 268 
MET   C    C N N 269 
MET   O    O N N 270 
MET   CB   C N N 271 
MET   CG   C N N 272 
MET   SD   S N N 273 
MET   CE   C N N 274 
MET   OXT  O N N 275 
MET   H    H N N 276 
MET   H2   H N N 277 
MET   HA   H N N 278 
MET   HB2  H N N 279 
MET   HB3  H N N 280 
MET   HG2  H N N 281 
MET   HG3  H N N 282 
MET   HE1  H N N 283 
MET   HE2  H N N 284 
MET   HE3  H N N 285 
MET   HXT  H N N 286 
NXL   OAC  O N N 287 
NXL   CAN  C N N 288 
NXL   N    N N N 289 
NXL   CAJ  C N N 290 
NXL   CA   C N S 291 
NXL   C    C N N 292 
NXL   O    O N N 293 
NXL   NAA  N N N 294 
NXL   CB   C N N 295 
NXL   CAH  C N N 296 
NXL   CAO  C N R 297 
NXL   NAK  N N N 298 
NXL   OAL  O N N 299 
NXL   SAR  S N N 300 
NXL   OAD  O N N 301 
NXL   OAE  O N N 302 
NXL   OAG  O N N 303 
NXL   H1   H N N 304 
NXL   H2   H N N 305 
NXL   H3   H N N 306 
NXL   H4   H N N 307 
NXL   H5   H N N 308 
NXL   H6   H N N 309 
NXL   H7   H N N 310 
NXL   H8   H N N 311 
NXL   H9   H N N 312 
NXL   H10  H N N 313 
NXL   H11  H N N 314 
NXL   H12  H N N 315 
NXL   H13  H N N 316 
PHE   N    N N N 317 
PHE   CA   C N S 318 
PHE   C    C N N 319 
PHE   O    O N N 320 
PHE   CB   C N N 321 
PHE   CG   C Y N 322 
PHE   CD1  C Y N 323 
PHE   CD2  C Y N 324 
PHE   CE1  C Y N 325 
PHE   CE2  C Y N 326 
PHE   CZ   C Y N 327 
PHE   OXT  O N N 328 
PHE   H    H N N 329 
PHE   H2   H N N 330 
PHE   HA   H N N 331 
PHE   HB2  H N N 332 
PHE   HB3  H N N 333 
PHE   HD1  H N N 334 
PHE   HD2  H N N 335 
PHE   HE1  H N N 336 
PHE   HE2  H N N 337 
PHE   HZ   H N N 338 
PHE   HXT  H N N 339 
PRO   N    N N N 340 
PRO   CA   C N S 341 
PRO   C    C N N 342 
PRO   O    O N N 343 
PRO   CB   C N N 344 
PRO   CG   C N N 345 
PRO   CD   C N N 346 
PRO   OXT  O N N 347 
PRO   H    H N N 348 
PRO   HA   H N N 349 
PRO   HB2  H N N 350 
PRO   HB3  H N N 351 
PRO   HG2  H N N 352 
PRO   HG3  H N N 353 
PRO   HD2  H N N 354 
PRO   HD3  H N N 355 
PRO   HXT  H N N 356 
SER   N    N N N 357 
SER   CA   C N S 358 
SER   C    C N N 359 
SER   O    O N N 360 
SER   CB   C N N 361 
SER   OG   O N N 362 
SER   OXT  O N N 363 
SER   H    H N N 364 
SER   H2   H N N 365 
SER   HA   H N N 366 
SER   HB2  H N N 367 
SER   HB3  H N N 368 
SER   HG   H N N 369 
SER   HXT  H N N 370 
SO4   S    S N N 371 
SO4   O1   O N N 372 
SO4   O2   O N N 373 
SO4   O3   O N N 374 
SO4   O4   O N N 375 
THR   N    N N N 376 
THR   CA   C N S 377 
THR   C    C N N 378 
THR   O    O N N 379 
THR   CB   C N R 380 
THR   OG1  O N N 381 
THR   CG2  C N N 382 
THR   OXT  O N N 383 
THR   H    H N N 384 
THR   H2   H N N 385 
THR   HA   H N N 386 
THR   HB   H N N 387 
THR   HG1  H N N 388 
THR   HG21 H N N 389 
THR   HG22 H N N 390 
THR   HG23 H N N 391 
THR   HXT  H N N 392 
TRP   N    N N N 393 
TRP   CA   C N S 394 
TRP   C    C N N 395 
TRP   O    O N N 396 
TRP   CB   C N N 397 
TRP   CG   C Y N 398 
TRP   CD1  C Y N 399 
TRP   CD2  C Y N 400 
TRP   NE1  N Y N 401 
TRP   CE2  C Y N 402 
TRP   CE3  C Y N 403 
TRP   CZ2  C Y N 404 
TRP   CZ3  C Y N 405 
TRP   CH2  C Y N 406 
TRP   OXT  O N N 407 
TRP   H    H N N 408 
TRP   H2   H N N 409 
TRP   HA   H N N 410 
TRP   HB2  H N N 411 
TRP   HB3  H N N 412 
TRP   HD1  H N N 413 
TRP   HE1  H N N 414 
TRP   HE3  H N N 415 
TRP   HZ2  H N N 416 
TRP   HZ3  H N N 417 
TRP   HH2  H N N 418 
TRP   HXT  H N N 419 
TYR   N    N N N 420 
TYR   CA   C N S 421 
TYR   C    C N N 422 
TYR   O    O N N 423 
TYR   CB   C N N 424 
TYR   CG   C Y N 425 
TYR   CD1  C Y N 426 
TYR   CD2  C Y N 427 
TYR   CE1  C Y N 428 
TYR   CE2  C Y N 429 
TYR   CZ   C Y N 430 
TYR   OH   O N N 431 
TYR   OXT  O N N 432 
TYR   H    H N N 433 
TYR   H2   H N N 434 
TYR   HA   H N N 435 
TYR   HB2  H N N 436 
TYR   HB3  H N N 437 
TYR   HD1  H N N 438 
TYR   HD2  H N N 439 
TYR   HE1  H N N 440 
TYR   HE2  H N N 441 
TYR   HH   H N N 442 
TYR   HXT  H N N 443 
VAL   N    N N N 444 
VAL   CA   C N S 445 
VAL   C    C N N 446 
VAL   O    O N N 447 
VAL   CB   C N N 448 
VAL   CG1  C N N 449 
VAL   CG2  C N N 450 
VAL   OXT  O N N 451 
VAL   H    H N N 452 
VAL   H2   H N N 453 
VAL   HA   H N N 454 
VAL   HB   H N N 455 
VAL   HG11 H N N 456 
VAL   HG12 H N N 457 
VAL   HG13 H N N 458 
VAL   HG21 H N N 459 
VAL   HG22 H N N 460 
VAL   HG23 H N N 461 
VAL   HXT  H N N 462 
# 
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 
A1H3M O   C    doub N N 1   
A1H3M C   N    sing N N 2   
A1H3M N   C1   sing N N 3   
A1H3M C1  C2   sing N N 4   
A1H3M N1  C2   doub N N 5   
A1H3M N   C3   sing N N 6   
A1H3M C4  C3   sing N N 7   
A1H3M C5  C4   sing N N 8   
A1H3M C2  C5   sing N N 9   
A1H3M C3  C6   sing N N 10  
A1H3M N2  C6   sing N N 11  
A1H3M C6  O1   doub N N 12  
A1H3M C5  H7   sing N N 13  
A1H3M C5  H8   sing N N 14  
A1H3M N1  H4   sing N N 15  
A1H3M C4  H6   sing N N 16  
A1H3M C4  H5   sing N N 17  
A1H3M C   H    sing N N 18  
A1H3M C1  H3   sing N N 19  
A1H3M C1  H2   sing N N 20  
A1H3M C3  H1   sing N N 21  
A1H3M N2  H9   sing N N 22  
A1H3M N2  H10  sing N N 23  
ALA   N   CA   sing N N 24  
ALA   N   H    sing N N 25  
ALA   N   H2   sing N N 26  
ALA   CA  C    sing N N 27  
ALA   CA  CB   sing N N 28  
ALA   CA  HA   sing N N 29  
ALA   C   O    doub N N 30  
ALA   C   OXT  sing N N 31  
ALA   CB  HB1  sing N N 32  
ALA   CB  HB2  sing N N 33  
ALA   CB  HB3  sing N N 34  
ALA   OXT HXT  sing N N 35  
ARG   N   CA   sing N N 36  
ARG   N   H    sing N N 37  
ARG   N   H2   sing N N 38  
ARG   CA  C    sing N N 39  
ARG   CA  CB   sing N N 40  
ARG   CA  HA   sing N N 41  
ARG   C   O    doub N N 42  
ARG   C   OXT  sing N N 43  
ARG   CB  CG   sing N N 44  
ARG   CB  HB2  sing N N 45  
ARG   CB  HB3  sing N N 46  
ARG   CG  CD   sing N N 47  
ARG   CG  HG2  sing N N 48  
ARG   CG  HG3  sing N N 49  
ARG   CD  NE   sing N N 50  
ARG   CD  HD2  sing N N 51  
ARG   CD  HD3  sing N N 52  
ARG   NE  CZ   sing N N 53  
ARG   NE  HE   sing N N 54  
ARG   CZ  NH1  sing N N 55  
ARG   CZ  NH2  doub N N 56  
ARG   NH1 HH11 sing N N 57  
ARG   NH1 HH12 sing N N 58  
ARG   NH2 HH21 sing N N 59  
ARG   NH2 HH22 sing N N 60  
ARG   OXT HXT  sing N N 61  
ASN   N   CA   sing N N 62  
ASN   N   H    sing N N 63  
ASN   N   H2   sing N N 64  
ASN   CA  C    sing N N 65  
ASN   CA  CB   sing N N 66  
ASN   CA  HA   sing N N 67  
ASN   C   O    doub N N 68  
ASN   C   OXT  sing N N 69  
ASN   CB  CG   sing N N 70  
ASN   CB  HB2  sing N N 71  
ASN   CB  HB3  sing N N 72  
ASN   CG  OD1  doub N N 73  
ASN   CG  ND2  sing N N 74  
ASN   ND2 HD21 sing N N 75  
ASN   ND2 HD22 sing N N 76  
ASN   OXT HXT  sing N N 77  
ASP   N   CA   sing N N 78  
ASP   N   H    sing N N 79  
ASP   N   H2   sing N N 80  
ASP   CA  C    sing N N 81  
ASP   CA  CB   sing N N 82  
ASP   CA  HA   sing N N 83  
ASP   C   O    doub N N 84  
ASP   C   OXT  sing N N 85  
ASP   CB  CG   sing N N 86  
ASP   CB  HB2  sing N N 87  
ASP   CB  HB3  sing N N 88  
ASP   CG  OD1  doub N N 89  
ASP   CG  OD2  sing N N 90  
ASP   OD2 HD2  sing N N 91  
ASP   OXT HXT  sing N N 92  
CYS   N   CA   sing N N 93  
CYS   N   H    sing N N 94  
CYS   N   H2   sing N N 95  
CYS   CA  C    sing N N 96  
CYS   CA  CB   sing N N 97  
CYS   CA  HA   sing N N 98  
CYS   C   O    doub N N 99  
CYS   C   OXT  sing N N 100 
CYS   CB  SG   sing N N 101 
CYS   CB  HB2  sing N N 102 
CYS   CB  HB3  sing N N 103 
CYS   SG  HG   sing N N 104 
CYS   OXT HXT  sing N N 105 
GLN   N   CA   sing N N 106 
GLN   N   H    sing N N 107 
GLN   N   H2   sing N N 108 
GLN   CA  C    sing N N 109 
GLN   CA  CB   sing N N 110 
GLN   CA  HA   sing N N 111 
GLN   C   O    doub N N 112 
GLN   C   OXT  sing N N 113 
GLN   CB  CG   sing N N 114 
GLN   CB  HB2  sing N N 115 
GLN   CB  HB3  sing N N 116 
GLN   CG  CD   sing N N 117 
GLN   CG  HG2  sing N N 118 
GLN   CG  HG3  sing N N 119 
GLN   CD  OE1  doub N N 120 
GLN   CD  NE2  sing N N 121 
GLN   NE2 HE21 sing N N 122 
GLN   NE2 HE22 sing N N 123 
GLN   OXT HXT  sing N N 124 
GLU   N   CA   sing N N 125 
GLU   N   H    sing N N 126 
GLU   N   H2   sing N N 127 
GLU   CA  C    sing N N 128 
GLU   CA  CB   sing N N 129 
GLU   CA  HA   sing N N 130 
GLU   C   O    doub N N 131 
GLU   C   OXT  sing N N 132 
GLU   CB  CG   sing N N 133 
GLU   CB  HB2  sing N N 134 
GLU   CB  HB3  sing N N 135 
GLU   CG  CD   sing N N 136 
GLU   CG  HG2  sing N N 137 
GLU   CG  HG3  sing N N 138 
GLU   CD  OE1  doub N N 139 
GLU   CD  OE2  sing N N 140 
GLU   OE2 HE2  sing N N 141 
GLU   OXT HXT  sing N N 142 
GLY   N   CA   sing N N 143 
GLY   N   H    sing N N 144 
GLY   N   H2   sing N N 145 
GLY   CA  C    sing N N 146 
GLY   CA  HA2  sing N N 147 
GLY   CA  HA3  sing N N 148 
GLY   C   O    doub N N 149 
GLY   C   OXT  sing N N 150 
GLY   OXT HXT  sing N N 151 
GOL   C1  O1   sing N N 152 
GOL   C1  C2   sing N N 153 
GOL   C1  H11  sing N N 154 
GOL   C1  H12  sing N N 155 
GOL   O1  HO1  sing N N 156 
GOL   C2  O2   sing N N 157 
GOL   C2  C3   sing N N 158 
GOL   C2  H2   sing N N 159 
GOL   O2  HO2  sing N N 160 
GOL   C3  O3   sing N N 161 
GOL   C3  H31  sing N N 162 
GOL   C3  H32  sing N N 163 
GOL   O3  HO3  sing N N 164 
HIS   N   CA   sing N N 165 
HIS   N   H    sing N N 166 
HIS   N   H2   sing N N 167 
HIS   CA  C    sing N N 168 
HIS   CA  CB   sing N N 169 
HIS   CA  HA   sing N N 170 
HIS   C   O    doub N N 171 
HIS   C   OXT  sing N N 172 
HIS   CB  CG   sing N N 173 
HIS   CB  HB2  sing N N 174 
HIS   CB  HB3  sing N N 175 
HIS   CG  ND1  sing Y N 176 
HIS   CG  CD2  doub Y N 177 
HIS   ND1 CE1  doub Y N 178 
HIS   ND1 HD1  sing N N 179 
HIS   CD2 NE2  sing Y N 180 
HIS   CD2 HD2  sing N N 181 
HIS   CE1 NE2  sing Y N 182 
HIS   CE1 HE1  sing N N 183 
HIS   NE2 HE2  sing N N 184 
HIS   OXT HXT  sing N N 185 
HOH   O   H1   sing N N 186 
HOH   O   H2   sing N N 187 
ILE   N   CA   sing N N 188 
ILE   N   H    sing N N 189 
ILE   N   H2   sing N N 190 
ILE   CA  C    sing N N 191 
ILE   CA  CB   sing N N 192 
ILE   CA  HA   sing N N 193 
ILE   C   O    doub N N 194 
ILE   C   OXT  sing N N 195 
ILE   CB  CG1  sing N N 196 
ILE   CB  CG2  sing N N 197 
ILE   CB  HB   sing N N 198 
ILE   CG1 CD1  sing N N 199 
ILE   CG1 HG12 sing N N 200 
ILE   CG1 HG13 sing N N 201 
ILE   CG2 HG21 sing N N 202 
ILE   CG2 HG22 sing N N 203 
ILE   CG2 HG23 sing N N 204 
ILE   CD1 HD11 sing N N 205 
ILE   CD1 HD12 sing N N 206 
ILE   CD1 HD13 sing N N 207 
ILE   OXT HXT  sing N N 208 
LEU   N   CA   sing N N 209 
LEU   N   H    sing N N 210 
LEU   N   H2   sing N N 211 
LEU   CA  C    sing N N 212 
LEU   CA  CB   sing N N 213 
LEU   CA  HA   sing N N 214 
LEU   C   O    doub N N 215 
LEU   C   OXT  sing N N 216 
LEU   CB  CG   sing N N 217 
LEU   CB  HB2  sing N N 218 
LEU   CB  HB3  sing N N 219 
LEU   CG  CD1  sing N N 220 
LEU   CG  CD2  sing N N 221 
LEU   CG  HG   sing N N 222 
LEU   CD1 HD11 sing N N 223 
LEU   CD1 HD12 sing N N 224 
LEU   CD1 HD13 sing N N 225 
LEU   CD2 HD21 sing N N 226 
LEU   CD2 HD22 sing N N 227 
LEU   CD2 HD23 sing N N 228 
LEU   OXT HXT  sing N N 229 
LYS   N   CA   sing N N 230 
LYS   N   H    sing N N 231 
LYS   N   H2   sing N N 232 
LYS   CA  C    sing N N 233 
LYS   CA  CB   sing N N 234 
LYS   CA  HA   sing N N 235 
LYS   C   O    doub N N 236 
LYS   C   OXT  sing N N 237 
LYS   CB  CG   sing N N 238 
LYS   CB  HB2  sing N N 239 
LYS   CB  HB3  sing N N 240 
LYS   CG  CD   sing N N 241 
LYS   CG  HG2  sing N N 242 
LYS   CG  HG3  sing N N 243 
LYS   CD  CE   sing N N 244 
LYS   CD  HD2  sing N N 245 
LYS   CD  HD3  sing N N 246 
LYS   CE  NZ   sing N N 247 
LYS   CE  HE2  sing N N 248 
LYS   CE  HE3  sing N N 249 
LYS   NZ  HZ1  sing N N 250 
LYS   NZ  HZ2  sing N N 251 
LYS   NZ  HZ3  sing N N 252 
LYS   OXT HXT  sing N N 253 
MET   N   CA   sing N N 254 
MET   N   H    sing N N 255 
MET   N   H2   sing N N 256 
MET   CA  C    sing N N 257 
MET   CA  CB   sing N N 258 
MET   CA  HA   sing N N 259 
MET   C   O    doub N N 260 
MET   C   OXT  sing N N 261 
MET   CB  CG   sing N N 262 
MET   CB  HB2  sing N N 263 
MET   CB  HB3  sing N N 264 
MET   CG  SD   sing N N 265 
MET   CG  HG2  sing N N 266 
MET   CG  HG3  sing N N 267 
MET   SD  CE   sing N N 268 
MET   CE  HE1  sing N N 269 
MET   CE  HE2  sing N N 270 
MET   CE  HE3  sing N N 271 
MET   OXT HXT  sing N N 272 
NXL   NAK CAO  sing N N 273 
NXL   CAJ CAO  sing N N 274 
NXL   CAJ N    sing N N 275 
NXL   OAL SAR  sing N N 276 
NXL   CAO CAH  sing N N 277 
NXL   CAN N    sing N N 278 
NXL   CAN OAC  doub N N 279 
NXL   OAG SAR  doub N N 280 
NXL   N   CA   sing N N 281 
NXL   SAR OAE  doub N N 282 
NXL   SAR OAD  sing N N 283 
NXL   O   C    doub N N 284 
NXL   CAH CB   sing N N 285 
NXL   CA  C    sing N N 286 
NXL   CA  CB   sing N N 287 
NXL   C   NAA  sing N N 288 
NXL   NAK OAL  sing N N 289 
NXL   CAN H1   sing N N 290 
NXL   CAJ H2   sing N N 291 
NXL   CAJ H3   sing N N 292 
NXL   CA  H4   sing N N 293 
NXL   NAA H5   sing N N 294 
NXL   NAA H6   sing N N 295 
NXL   CB  H7   sing N N 296 
NXL   CB  H8   sing N N 297 
NXL   CAH H9   sing N N 298 
NXL   CAH H10  sing N N 299 
NXL   CAO H11  sing N N 300 
NXL   NAK H12  sing N N 301 
NXL   OAD H13  sing N N 302 
PHE   N   CA   sing N N 303 
PHE   N   H    sing N N 304 
PHE   N   H2   sing N N 305 
PHE   CA  C    sing N N 306 
PHE   CA  CB   sing N N 307 
PHE   CA  HA   sing N N 308 
PHE   C   O    doub N N 309 
PHE   C   OXT  sing N N 310 
PHE   CB  CG   sing N N 311 
PHE   CB  HB2  sing N N 312 
PHE   CB  HB3  sing N N 313 
PHE   CG  CD1  doub Y N 314 
PHE   CG  CD2  sing Y N 315 
PHE   CD1 CE1  sing Y N 316 
PHE   CD1 HD1  sing N N 317 
PHE   CD2 CE2  doub Y N 318 
PHE   CD2 HD2  sing N N 319 
PHE   CE1 CZ   doub Y N 320 
PHE   CE1 HE1  sing N N 321 
PHE   CE2 CZ   sing Y N 322 
PHE   CE2 HE2  sing N N 323 
PHE   CZ  HZ   sing N N 324 
PHE   OXT HXT  sing N N 325 
PRO   N   CA   sing N N 326 
PRO   N   CD   sing N N 327 
PRO   N   H    sing N N 328 
PRO   CA  C    sing N N 329 
PRO   CA  CB   sing N N 330 
PRO   CA  HA   sing N N 331 
PRO   C   O    doub N N 332 
PRO   C   OXT  sing N N 333 
PRO   CB  CG   sing N N 334 
PRO   CB  HB2  sing N N 335 
PRO   CB  HB3  sing N N 336 
PRO   CG  CD   sing N N 337 
PRO   CG  HG2  sing N N 338 
PRO   CG  HG3  sing N N 339 
PRO   CD  HD2  sing N N 340 
PRO   CD  HD3  sing N N 341 
PRO   OXT HXT  sing N N 342 
SER   N   CA   sing N N 343 
SER   N   H    sing N N 344 
SER   N   H2   sing N N 345 
SER   CA  C    sing N N 346 
SER   CA  CB   sing N N 347 
SER   CA  HA   sing N N 348 
SER   C   O    doub N N 349 
SER   C   OXT  sing N N 350 
SER   CB  OG   sing N N 351 
SER   CB  HB2  sing N N 352 
SER   CB  HB3  sing N N 353 
SER   OG  HG   sing N N 354 
SER   OXT HXT  sing N N 355 
SO4   S   O1   doub N N 356 
SO4   S   O2   doub N N 357 
SO4   S   O3   sing N N 358 
SO4   S   O4   sing N N 359 
THR   N   CA   sing N N 360 
THR   N   H    sing N N 361 
THR   N   H2   sing N N 362 
THR   CA  C    sing N N 363 
THR   CA  CB   sing N N 364 
THR   CA  HA   sing N N 365 
THR   C   O    doub N N 366 
THR   C   OXT  sing N N 367 
THR   CB  OG1  sing N N 368 
THR   CB  CG2  sing N N 369 
THR   CB  HB   sing N N 370 
THR   OG1 HG1  sing N N 371 
THR   CG2 HG21 sing N N 372 
THR   CG2 HG22 sing N N 373 
THR   CG2 HG23 sing N N 374 
THR   OXT HXT  sing N N 375 
TRP   N   CA   sing N N 376 
TRP   N   H    sing N N 377 
TRP   N   H2   sing N N 378 
TRP   CA  C    sing N N 379 
TRP   CA  CB   sing N N 380 
TRP   CA  HA   sing N N 381 
TRP   C   O    doub N N 382 
TRP   C   OXT  sing N N 383 
TRP   CB  CG   sing N N 384 
TRP   CB  HB2  sing N N 385 
TRP   CB  HB3  sing N N 386 
TRP   CG  CD1  doub Y N 387 
TRP   CG  CD2  sing Y N 388 
TRP   CD1 NE1  sing Y N 389 
TRP   CD1 HD1  sing N N 390 
TRP   CD2 CE2  doub Y N 391 
TRP   CD2 CE3  sing Y N 392 
TRP   NE1 CE2  sing Y N 393 
TRP   NE1 HE1  sing N N 394 
TRP   CE2 CZ2  sing Y N 395 
TRP   CE3 CZ3  doub Y N 396 
TRP   CE3 HE3  sing N N 397 
TRP   CZ2 CH2  doub Y N 398 
TRP   CZ2 HZ2  sing N N 399 
TRP   CZ3 CH2  sing Y N 400 
TRP   CZ3 HZ3  sing N N 401 
TRP   CH2 HH2  sing N N 402 
TRP   OXT HXT  sing N N 403 
TYR   N   CA   sing N N 404 
TYR   N   H    sing N N 405 
TYR   N   H2   sing N N 406 
TYR   CA  C    sing N N 407 
TYR   CA  CB   sing N N 408 
TYR   CA  HA   sing N N 409 
TYR   C   O    doub N N 410 
TYR   C   OXT  sing N N 411 
TYR   CB  CG   sing N N 412 
TYR   CB  HB2  sing N N 413 
TYR   CB  HB3  sing N N 414 
TYR   CG  CD1  doub Y N 415 
TYR   CG  CD2  sing Y N 416 
TYR   CD1 CE1  sing Y N 417 
TYR   CD1 HD1  sing N N 418 
TYR   CD2 CE2  doub Y N 419 
TYR   CD2 HD2  sing N N 420 
TYR   CE1 CZ   doub Y N 421 
TYR   CE1 HE1  sing N N 422 
TYR   CE2 CZ   sing Y N 423 
TYR   CE2 HE2  sing N N 424 
TYR   CZ  OH   sing N N 425 
TYR   OH  HH   sing N N 426 
TYR   OXT HXT  sing N N 427 
VAL   N   CA   sing N N 428 
VAL   N   H    sing N N 429 
VAL   N   H2   sing N N 430 
VAL   CA  C    sing N N 431 
VAL   CA  CB   sing N N 432 
VAL   CA  HA   sing N N 433 
VAL   C   O    doub N N 434 
VAL   C   OXT  sing N N 435 
VAL   CB  CG1  sing N N 436 
VAL   CB  CG2  sing N N 437 
VAL   CB  HB   sing N N 438 
VAL   CG1 HG11 sing N N 439 
VAL   CG1 HG12 sing N N 440 
VAL   CG1 HG13 sing N N 441 
VAL   CG2 HG21 sing N N 442 
VAL   CG2 HG22 sing N N 443 
VAL   CG2 HG23 sing N N 444 
VAL   OXT HXT  sing N N 445 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Biotechnology and Biological Sciences Research Council (BBSRC)' 'United Kingdom' BB/T008741/10 1 
'European Research Council (ERC)'                                'European Union' 101021207     2 
# 
_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   8AKL 
_pdbx_initial_refinement_model.details          ? 
# 
_space_group.name_H-M_alt     'P 21 21 2' 
_space_group.name_Hall        'P 2 2ab' 
_space_group.IT_number        18 
_space_group.crystal_system   orthorhombic 
_space_group.id               1 
# 
_atom_sites.entry_id                    8RWP 
_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]   0.016628 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.012740 
_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]   0.017973 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.scat_dispersion_real 
_atom_type.scat_dispersion_imag 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
_atom_type.scat_source 
_atom_type.scat_dispersion_source 
C   ? ? 3.54356 2.42580 ?       ? 25.62398 1.50364  ?       ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
H   ? ? 0.51345 0.48472 ?       ? 24.73122 6.32584  ?       ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
N   ? ? 4.01032 2.96436 ?       ? 19.97189 1.75589  ?       ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O   ? ? 4.49882 3.47563 ?       ? 15.80542 1.70748  ?       ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O1- ? ? 4.31557 2.79156 1.86576 ? 8.03600  32.36470 0.29580 ? 0.0 
;3-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
S   ? ? 9.55732 6.39887 ?       ? 1.23737  29.19336 ?       ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N N    . HIS   A 1 20  ? 3.72300  26.57900 -6.66000  1.000 99.67774  ?  23  HIS   A N    1 
ATOM   2    C CA   . HIS   A 1 20  ? 3.78100  25.28000 -7.32300  1.000 93.61912  ?  23  HIS   A CA   1 
ATOM   3    C C    . HIS   A 1 20  ? 4.76600  25.28500 -8.47800  1.000 73.28773  ?  23  HIS   A C    1 
ATOM   4    O O    . HIS   A 1 20  ? 5.34800  24.25300 -8.79300  1.000 70.74532  ?  23  HIS   A O    1 
ATOM   5    C CB   . HIS   A 1 20  ? 2.39300  24.86000 -7.82700  1.000 100.39098 ?  23  HIS   A CB   1 
ATOM   6    C CG   . HIS   A 1 20  ? 1.36000  24.77100 -6.74800  1.000 94.59818  ?  23  HIS   A CG   1 
ATOM   7    N ND1  . HIS   A 1 20  ? 1.65400  24.98000 -5.41700  1.000 97.74067  ?  23  HIS   A ND1  1 
ATOM   8    C CD2  . HIS   A 1 20  ? 0.03400  24.50200 -6.80300  1.000 92.86113  ?  23  HIS   A CD2  1 
ATOM   9    C CE1  . HIS   A 1 20  ? 0.55300  24.84200 -4.70000  1.000 87.59998  ?  23  HIS   A CE1  1 
ATOM   10   N NE2  . HIS   A 1 20  ? -0.44500 24.55600 -5.51700  1.000 86.29982  ?  23  HIS   A NE2  1 
ATOM   11   N N    . MET   A 1 21  ? 4.95500  26.45200 -9.10500  1.000 65.03411  ?  24  MET   A N    1 
ATOM   12   C CA   . MET   A 1 21  ? 5.80300  26.54300 -10.29100 1.000 61.38631  ?  24  MET   A CA   1 
ATOM   13   C C    . MET   A 1 21  ? 7.24400  26.14800 -9.99600  1.000 44.24741  ?  24  MET   A C    1 
ATOM   14   O O    . MET   A 1 21  ? 7.93700  25.64500 -10.88300 1.000 40.56013  ?  24  MET   A O    1 
ATOM   15   C CB   . MET   A 1 21  ? 5.77100  27.97100 -10.84500 1.000 78.35413  ?  24  MET   A CB   1 
ATOM   16   C CG   . MET   A 1 21  ? 4.47600  28.36200 -11.53800 1.000 97.40642  ?  24  MET   A CG   1 
ATOM   17   S SD   . MET   A 1 21  ? 4.17700  27.44100 -13.06000 1.000 115.07169 ?  24  MET   A SD   1 
ATOM   18   C CE   . MET   A 1 21  ? 3.13600  26.11200 -12.46400 1.000 122.44363 ?  24  MET   A CE   1 
ATOM   19   H H    . MET   A 1 21  ? 4.60400  27.19900 -8.86300  1.000 78.07000  ?  24  MET   A H    1 
ATOM   20   H HA   . MET   A 1 21  ? 5.44400  25.94100 -10.96100 1.000 73.70000  ?  24  MET   A HA   1 
ATOM   21   N N    . LEU   A 1 22  ? 7.69100  26.35800 -8.78700  1.000 30.23257  ?  25  LEU   A N    1 
ATOM   22   C CA   . LEU   A 1 22  ? 9.06300  26.04400 -8.40500  1.000 27.82176  ?  25  LEU   A CA   1 
ATOM   23   C C    . LEU   A 1 22  ? 9.15900  24.80600 -7.52200  1.000 25.47411  ?  25  LEU   A C    1 
ATOM   24   O O    . LEU   A 1 22  ? 10.23900 24.52300 -6.98900  1.000 24.27923  ?  25  LEU   A O    1 
ATOM   25   C CB   . LEU   A 1 22  ? 9.69100  27.24300 -7.70100  1.000 28.58237  ?  25  LEU   A CB   1 
ATOM   26   C CG   . LEU   A 1 22  ? 9.73700  28.55700 -8.46800  1.000 29.83779  ?  25  LEU   A CG   1 
ATOM   27   C CD1  . LEU   A 1 22  ? 10.31000 29.62100 -7.54300  1.000 31.54852  ?  25  LEU   A CD1  1 
ATOM   28   C CD2  . LEU   A 1 22  ? 10.55600 28.42200 -9.73600  1.000 31.60905  ?  25  LEU   A CD2  1 
ATOM   29   H H    . LEU   A 1 22  ? 7.21900  26.68900 -8.15000  1.000 36.33000  ?  25  LEU   A H    1 
ATOM   30   H HA   . LEU   A 1 22  ? 9.57400  25.86400 -9.20900  1.000 33.44000  ?  25  LEU   A HA   1 
ATOM   31   H HB2  . LEU   A 1 22  ? 9.18600  27.40900 -6.88900  1.000 34.35000  ?  25  LEU   A HB2  1 
ATOM   32   H HB3  . LEU   A 1 22  ? 10.60700 27.01300 -7.48100  1.000 34.35000  ?  25  LEU   A HB3  1 
ATOM   33   H HG   . LEU   A 1 22  ? 8.84700  28.82100 -8.75000  1.000 35.86000  ?  25  LEU   A HG   1 
ATOM   34   H HD11 . LEU   A 1 22  ? 10.33100 30.47000 -8.01200  1.000 37.91000  ?  25  LEU   A HD11 1 
ATOM   35   H HD12 . LEU   A 1 22  ? 9.74700  29.69100 -6.75600  1.000 37.91000  ?  25  LEU   A HD12 1 
ATOM   36   H HD13 . LEU   A 1 22  ? 11.20900 29.36400 -7.28400  1.000 37.91000  ?  25  LEU   A HD13 1 
ATOM   37   H HD21 . LEU   A 1 22  ? 10.75000 29.30700 -10.08300 1.000 37.98000  ?  25  LEU   A HD21 1 
ATOM   38   H HD22 . LEU   A 1 22  ? 11.38400 27.95900 -9.53000  1.000 37.98000  ?  25  LEU   A HD22 1 
ATOM   39   H HD23 . LEU   A 1 22  ? 10.04800 27.91500 -10.38900 1.000 37.98000  ?  25  LEU   A HD23 1 
ATOM   40   N N    . THR   A 1 23  ? 8.06900  24.05600 -7.37200  1.000 25.31356  ?  26  THR   A N    1 
ATOM   41   C CA   . THR   A 1 23  ? 8.06000  22.82700 -6.59600  1.000 24.20817  ?  26  THR   A CA   1 
ATOM   42   C C    . THR   A 1 23  ? 8.34300  21.63400 -7.50400  1.000 23.12909  ?  26  THR   A C    1 
ATOM   43   O O    . THR   A 1 23  ? 7.69700  21.46100 -8.54100  1.000 23.28174  ?  26  THR   A O    1 
ATOM   44   C CB   . THR   A 1 23  ? 6.71100  22.63700 -5.89900  1.000 24.99510  ?  26  THR   A CB   1 
ATOM   45   O OG1  . THR   A 1 23  ? 6.42500  23.77300 -5.07300  1.000 26.80585  ?  26  THR   A OG1  1 
ATOM   46   C CG2  . THR   A 1 23  ? 6.74200  21.38100 -5.04000  1.000 24.73718  ?  26  THR   A CG2  1 
ATOM   47   H H    . THR   A 1 23  ? 7.30600  24.24600 -7.72000  1.000 30.43000  ?  26  THR   A H    1 
ATOM   48   H HA   . THR   A 1 23  ? 8.75500  22.87300 -5.92100  1.000 29.10000  ?  26  THR   A HA   1 
ATOM   49   H HB   . THR   A 1 23  ? 6.01000  22.54600 -6.56300  1.000 30.04000  ?  26  THR   A HB   1 
ATOM   50   H HG1  . THR   A 1 23  ? 6.99000  23.82700 -4.45400  1.000 32.22000  ?  26  THR   A HG1  1 
ATOM   51   H HG21 . THR   A 1 23  ? 6.13000  21.47500 -4.29300  1.000 29.73000  ?  26  THR   A HG21 1 
ATOM   52   H HG22 . THR   A 1 23  ? 6.47800  20.61100 -5.56800  1.000 29.73000  ?  26  THR   A HG22 1 
ATOM   53   H HG23 . THR   A 1 23  ? 7.63700  21.23500 -4.69700  1.000 29.73000  ?  26  THR   A HG23 1 
ATOM   54   N N    . ASN   A 1 24  ? 9.29700  20.80300 -7.10100  1.000 22.20003  ?  27  ASN   A N    1 
ATOM   55   C CA   . ASN   A 1 24  ? 9.63900  19.58200 -7.83100  1.000 22.34215  ?  27  ASN   A CA   1 
ATOM   56   C C    . ASN   A 1 24  ? 9.90900  19.85100 -9.31300  1.000 23.57914  ?  27  ASN   A C    1 
ATOM   57   O O    . ASN   A 1 24  ? 9.39200  19.17400 -10.20600 1.000 24.15290  ?  27  ASN   A O    1 
ATOM   58   C CB   . ASN   A 1 24  ? 8.57800  18.50100 -7.62900  1.000 23.11856  ?  27  ASN   A CB   1 
ATOM   59   C CG   . ASN   A 1 24  ? 8.46300  18.08100 -6.17700  1.000 21.77893  ?  27  ASN   A CG   1 
ATOM   60   O OD1  . ASN   A 1 24  ? 9.45900  18.04000 -5.46000  1.000 21.41836  ?  27  ASN   A OD1  1 
ATOM   61   N ND2  . ASN   A 1 24  ? 7.24300  17.77600 -5.72400  1.000 21.86315  ?  27  ASN   A ND2  1 
ATOM   62   H H    . ASN   A 1 24  ? 9.77100  20.92400 -6.39400  1.000 26.69000  ?  27  ASN   A H    1 
ATOM   63   H HA   . ASN   A 1 24  ? 10.47100 19.24600 -7.46400  1.000 26.86000  ?  27  ASN   A HA   1 
ATOM   64   H HB2  . ASN   A 1 24  ? 7.71700  18.84100 -7.91500  1.000 27.79000  ?  27  ASN   A HB2  1 
ATOM   65   H HB3  . ASN   A 1 24  ? 8.81600  17.71900 -8.15200  1.000 27.79000  ?  27  ASN   A HB3  1 
ATOM   66   H HD21 . ASN   A 1 24  ? 7.13600  17.53400 -4.90600  1.000 26.29000  ?  27  ASN   A HD21 1 
ATOM   67   H HD22 . ASN   A 1 24  ? 6.56500  17.82300 -6.25100  1.000 26.29000  ?  27  ASN   A HD22 1 
ATOM   68   N N    . LEU   A 1 25  ? 10.76200 20.84200 -9.57300  1.000 24.48978  ?  28  LEU   A N    1 
ATOM   69   C CA   . LEU   A 1 25  ? 11.21100 21.08200 -10.94000 1.000 26.09260  ?  28  LEU   A CA   1 
ATOM   70   C C    . LEU   A 1 25  ? 11.92200 19.86200 -11.51200 1.000 26.22946  ?  28  LEU   A C    1 
ATOM   71   O O    . LEU   A 1 25  ? 11.88900 19.63500 -12.72700 1.000 27.61910  ?  28  LEU   A O    1 
ATOM   72   C CB   . LEU   A 1 25  ? 12.14800 22.28800 -10.96400 1.000 28.54290  ?  28  LEU   A CB   1 
ATOM   73   C CG   . LEU   A 1 25  ? 11.52300 23.64400 -10.63400 1.000 30.87212  ?  28  LEU   A CG   1 
ATOM   74   C CD1  . LEU   A 1 25  ? 12.58300 24.70900 -10.34700 1.000 31.95909  ?  28  LEU   A CD1  1 
ATOM   75   C CD2  . LEU   A 1 25  ? 10.61900 24.10200 -11.77700 1.000 31.61958  ?  28  LEU   A CD2  1 
ATOM   76   H H    . LEU   A 1 25  ? 11.08800 21.38000 -8.98600  1.000 29.44000  ?  28  LEU   A H    1 
ATOM   77   H HA   . LEU   A 1 25  ? 10.44300 21.27500 -11.49900 1.000 31.36000  ?  28  LEU   A HA   1 
ATOM   78   H HB2  . LEU   A 1 25  ? 12.85300 22.13400 -10.31600 1.000 34.30000  ?  28  LEU   A HB2  1 
ATOM   79   H HB3  . LEU   A 1 25  ? 12.52600 22.35800 -11.85500 1.000 34.30000  ?  28  LEU   A HB3  1 
ATOM   80   H HG   . LEU   A 1 25  ? 10.99200 23.53900 -9.82900  1.000 37.09000  ?  28  LEU   A HG   1 
ATOM   81   H HD11 . LEU   A 1 25  ? 12.14000 25.54600 -10.13800 1.000 38.40000  ?  28  LEU   A HD11 1 
ATOM   82   H HD12 . LEU   A 1 25  ? 13.12300 24.42300 -9.59400  1.000 38.40000  ?  28  LEU   A HD12 1 
ATOM   83   H HD13 . LEU   A 1 25  ? 13.14200 24.81700 -11.13200 1.000 38.40000  ?  28  LEU   A HD13 1 
ATOM   84   H HD21 . LEU   A 1 25  ? 10.32600 25.01000 -11.60300 1.000 37.99000  ?  28  LEU   A HD21 1 
ATOM   85   H HD22 . LEU   A 1 25  ? 11.11900 24.07000 -12.60700 1.000 37.99000  ?  28  LEU   A HD22 1 
ATOM   86   H HD23 . LEU   A 1 25  ? 9.85200  23.51100 -11.82900 1.000 37.99000  ?  28  LEU   A HD23 1 
ATOM   87   N N    . VAL   A 1 26  ? 12.56300 19.07100 -10.65500 1.000 25.05827  ?  29  VAL   A N    1 
ATOM   88   C CA   . VAL   A 1 26  ? 13.34200 17.89900 -11.04300 1.000 25.00826  ?  29  VAL   A CA   1 
ATOM   89   C C    . VAL   A 1 26  ? 12.82700 16.73400 -10.20600 1.000 25.54254  ?  29  VAL   A C    1 
ATOM   90   O O    . VAL   A 1 26  ? 12.94100 16.75800 -8.97500  1.000 26.69004  ?  29  VAL   A O    1 
ATOM   91   C CB   . VAL   A 1 26  ? 14.84400 18.12000 -10.78100 1.000 25.99522  ?  29  VAL   A CB   1 
ATOM   92   C CG1  . VAL   A 1 26  ? 15.65500 16.84500 -11.06700 1.000 26.70057  ?  29  VAL   A CG1  1 
ATOM   93   C CG2  . VAL   A 1 26  ? 15.37700 19.29200 -11.61100 1.000 27.43487  ?  29  VAL   A CG2  1 
ATOM   94   H H    . VAL   A 1 26  ? 12.56100 19.20000 -9.80500  1.000 30.12000  ?  29  VAL   A H    1 
ATOM   95   H HA   . VAL   A 1 26  ? 13.21300 17.69700 -11.98300 1.000 30.06000  ?  29  VAL   A HA   1 
ATOM   96   H HB   . VAL   A 1 26  ? 14.95600 18.33800 -9.84200  1.000 31.25000  ?  29  VAL   A HB   1 
ATOM   97   H HG11 . VAL   A 1 26  ? 16.60100 17.06000 -11.04100 1.000 32.09000  ?  29  VAL   A HG11 1 
ATOM   98   H HG12 . VAL   A 1 26  ? 15.44800 16.18100 -10.39100 1.000 32.09000  ?  29  VAL   A HG12 1 
ATOM   99   H HG13 . VAL   A 1 26  ? 15.41600 16.50900 -11.94500 1.000 32.09000  ?  29  VAL   A HG13 1 
ATOM   100  H HG21 . VAL   A 1 26  ? 16.34500 19.31100 -11.54800 1.000 32.97000  ?  29  VAL   A HG21 1 
ATOM   101  H HG22 . VAL   A 1 26  ? 15.10900 19.17200 -12.53600 1.000 32.97000  ?  29  VAL   A HG22 1 
ATOM   102  H HG23 . VAL   A 1 26  ? 15.00700 20.11900 -11.26400 1.000 32.97000  ?  29  VAL   A HG23 1 
ATOM   103  N N    . ALA   A 1 27  ? 12.27700 15.71300 -10.86300 1.000 25.52148  ?  30  ALA   A N    1 
ATOM   104  C CA   . ALA   A 1 27  ? 11.75300 14.57500 -10.12100 1.000 25.12933  ?  30  ALA   A CA   1 
ATOM   105  C C    . ALA   A 1 27  ? 12.89500 13.72100 -9.58700  1.000 22.86327  ?  30  ALA   A C    1 
ATOM   106  O O    . ALA   A 1 27  ? 13.94800 13.59800 -10.21200 1.000 23.48176  ?  30  ALA   A O    1 
ATOM   107  C CB   . ALA   A 1 27  ? 10.86800 13.71500 -11.01500 1.000 25.60307  ?  30  ALA   A CB   1 
ATOM   108  H H    . ALA   A 1 27  ? 12.19700 15.66000 -11.71800 1.000 30.68000  ?  30  ALA   A H    1 
ATOM   109  H HA   . ALA   A 1 27  ? 11.22200 14.89700 -9.37700  1.000 30.21000  ?  30  ALA   A HA   1 
ATOM   110  H HB1  . ALA   A 1 27  ? 10.53400 12.96400 -10.50000 1.000 30.77000  ?  30  ALA   A HB1  1 
ATOM   111  H HB2  . ALA   A 1 27  ? 10.12700 14.25200 -11.33600 1.000 30.77000  ?  30  ALA   A HB2  1 
ATOM   112  H HB3  . ALA   A 1 27  ? 11.39300 13.39400 -11.76500 1.000 30.77000  ?  30  ALA   A HB3  1 
ATOM   113  N N    . GLU   A 1 28  ? 12.66900 13.11900 -8.42700  1.000 22.42374  ?  31  GLU   A N    1 
ATOM   114  C CA   . GLU   A 1 28  ? 13.62100 12.25900 -7.74900  1.000 22.35531  ?  31  GLU   A CA   1 
ATOM   115  C C    . GLU   A 1 28  ? 12.92700 10.98400 -7.30000  1.000 22.08949  ?  31  GLU   A C    1 
ATOM   116  O O    . GLU   A 1 28  ? 11.73300 11.00500 -6.96500  1.000 22.67377  ?  31  GLU   A O    1 
ATOM   117  C CB   . GLU   A 1 28  ? 14.21000 12.97000 -6.52700  1.000 22.58955  ?  31  GLU   A CB   1 
ATOM   118  C CG   . GLU   A 1 28  ? 14.98900 14.23700 -6.86400  1.000 22.76852  ?  31  GLU   A CG   1 
ATOM   119  C CD   . GLU   A 1 28  ? 16.23600 13.97400 -7.70200  1.000 25.05300  ?  31  GLU   A CD   1 
ATOM   120  O OE1  . GLU   A 1 28  ? 16.71600 12.80800 -7.76200  1.000 26.18998  ?  31  GLU   A OE1  1 
ATOM   121  O OE2  . GLU   A 1 28  ? 16.73200 14.94300 -8.30400  1.000 25.46884  -1 31  GLU   A OE2  1 
ATOM   122  H H    . GLU   A 1 28  ? 11.93200 13.19900 -7.99100  1.000 26.96000  ?  31  GLU   A H    1 
ATOM   123  H HA   . GLU   A 1 28  ? 14.34400 12.02100 -8.35100  1.000 26.88000  ?  31  GLU   A HA   1 
ATOM   124  H HB2  . GLU   A 1 28  ? 13.48500 13.21800 -5.93300  1.000 27.16000  ?  31  GLU   A HB2  1 
ATOM   125  H HB3  . GLU   A 1 28  ? 14.81600 12.36200 -6.07600  1.000 27.16000  ?  31  GLU   A HB3  1 
ATOM   126  H HG2  . GLU   A 1 28  ? 14.41400 14.83600 -7.36500  1.000 27.37000  ?  31  GLU   A HG2  1 
ATOM   127  H HG3  . GLU   A 1 28  ? 15.27000 14.66100 -6.03800  1.000 27.37000  ?  31  GLU   A HG3  1 
ATOM   128  N N    . PRO   A 1 29  ? 13.65600 9.85700  -7.26500  1.000 22.35794  ?  32  PRO   A N    1 
ATOM   129  C CA   . PRO   A 1 29  ? 13.02900 8.54600  -7.00700  1.000 22.22635  ?  32  PRO   A CA   1 
ATOM   130  C C    . PRO   A 1 29  ? 12.75900 8.26900  -5.53000  1.000 21.51311  ?  32  PRO   A C    1 
ATOM   131  O O    . PRO   A 1 29  ? 13.22600 7.27900  -4.95500  1.000 21.50521  ?  32  PRO   A O    1 
ATOM   132  C CB   . PRO   A 1 29  ? 14.04800 7.57100  -7.61400  1.000 22.76852  ?  32  PRO   A CB   1 
ATOM   133  C CG   . PRO   A 1 29  ? 15.36600 8.26200  -7.43800  1.000 22.62640  ?  32  PRO   A CG   1 
ATOM   134  C CD   . PRO   A 1 29  ? 15.05800 9.72000  -7.71100  1.000 22.40005  ?  32  PRO   A CD   1 
ATOM   135  H HA   . PRO   A 1 29  ? 12.19000 8.49300  -7.49200  1.000 26.72000  ?  32  PRO   A HA   1 
ATOM   136  H HB2  . PRO   A 1 29  ? 14.02800 6.72700  -7.13600  1.000 27.37000  ?  32  PRO   A HB2  1 
ATOM   137  H HB3  . PRO   A 1 29  ? 13.85200 7.42400  -8.55300  1.000 27.37000  ?  32  PRO   A HB3  1 
ATOM   138  H HG2  . PRO   A 1 29  ? 15.69100 8.13700  -6.53200  1.000 27.20000  ?  32  PRO   A HG2  1 
ATOM   139  H HG3  . PRO   A 1 29  ? 16.01200 7.91600  -8.07300  1.000 27.20000  ?  32  PRO   A HG3  1 
ATOM   140  H HD2  . PRO   A 1 29  ? 15.64300 10.29900 -7.19700  1.000 26.93000  ?  32  PRO   A HD2  1 
ATOM   141  H HD3  . PRO   A 1 29  ? 15.14100 9.92000  -8.65600  1.000 26.93000  ?  32  PRO   A HD3  1 
ATOM   142  N N    . PHE   A 1 30  ? 11.93500 9.11800  -4.91600  1.000 20.32612  ?  33  PHE   A N    1 
ATOM   143  C CA   . PHE   A 1 30  ? 11.58000 8.89300  -3.51900  1.000 20.50509  ?  33  PHE   A CA   1 
ATOM   144  C C    . PHE   A 1 30  ? 10.72500 7.64100  -3.34500  1.000 20.85513  ?  33  PHE   A C    1 
ATOM   145  O O    . PHE   A 1 30  ? 10.84000 6.94000  -2.33500  1.000 21.22360  ?  33  PHE   A O    1 
ATOM   146  C CB   . PHE   A 1 30  ? 10.83200 10.10200 -2.94800  1.000 20.03398  ?  33  PHE   A CB   1 
ATOM   147  C CG   . PHE   A 1 30  ? 11.68700 11.32100 -2.75600  1.000 18.56802  ?  33  PHE   A CG   1 
ATOM   148  C CD1  . PHE   A 1 30  ? 12.65200 11.35600 -1.76500  1.000 19.80237  ?  33  PHE   A CD1  1 
ATOM   149  C CD2  . PHE   A 1 30  ? 11.51000 12.44400 -3.54400  1.000 18.17060  ?  33  PHE   A CD2  1 
ATOM   150  C CE1  . PHE   A 1 30  ? 13.44200 12.49800 -1.58000  1.000 19.10755  ?  33  PHE   A CE1  1 
ATOM   151  C CE2  . PHE   A 1 30  ? 12.27100 13.56300 -3.37800  1.000 19.14966  ?  33  PHE   A CE2  1 
ATOM   152  C CZ   . PHE   A 1 30  ? 13.24300 13.59800 -2.39500  1.000 19.33653  ?  33  PHE   A CZ   1 
ATOM   153  H H    . PHE   A 1 30  ? 11.57700 9.81200  -5.27600  1.000 24.44000  ?  33  PHE   A H    1 
ATOM   154  H HA   . PHE   A 1 30  ? 12.40600 8.77800  -3.02300  1.000 24.66000  ?  33  PHE   A HA   1 
ATOM   155  H HB2  . PHE   A 1 30  ? 10.11500 10.33800 -3.55700  1.000 24.09000  ?  33  PHE   A HB2  1 
ATOM   156  H HB3  . PHE   A 1 30  ? 10.46600 9.86000  -2.08300  1.000 24.09000  ?  33  PHE   A HB3  1 
ATOM   157  H HD1  . PHE   A 1 30  ? 12.77800 10.61500 -1.21700  1.000 23.81000  ?  33  PHE   A HD1  1 
ATOM   158  H HD2  . PHE   A 1 30  ? 10.85400 12.43600 -4.20300  1.000 21.85000  ?  33  PHE   A HD2  1 
ATOM   159  H HE1  . PHE   A 1 30  ? 14.09200 12.51700 -0.91600  1.000 22.98000  ?  33  PHE   A HE1  1 
ATOM   160  H HE2  . PHE   A 1 30  ? 12.13700 14.30300 -3.92600  1.000 23.03000  ?  33  PHE   A HE2  1 
ATOM   161  H HZ   . PHE   A 1 30  ? 13.76400 14.36100 -2.28200  1.000 23.26000  ?  33  PHE   A HZ   1 
ATOM   162  N N    . ALA   A 1 31  ? 9.83200  7.36300  -4.29400  1.000 22.06580  ?  34  ALA   A N    1 
ATOM   163  C CA   . ALA   A 1 31  ? 8.96300  6.19700  -4.16000  1.000 21.88947  ?  34  ALA   A CA   1 
ATOM   164  C C    . ALA   A 1 31  ? 9.76800  4.90800  -4.11500  1.000 22.46848  ?  34  ALA   A C    1 
ATOM   165  O O    . ALA   A 1 31  ? 9.51900  4.04500  -3.26500  1.000 22.45532  ?  34  ALA   A O    1 
ATOM   166  C CB   . ALA   A 1 31  ? 7.93200  6.17300  -5.28400  1.000 22.96065  ?  34  ALA   A CB   1 
ATOM   167  H H    . ALA   A 1 31  ? 9.71100  7.82300  -5.01000  1.000 26.53000  ?  34  ALA   A H    1 
ATOM   168  H HA   . ALA   A 1 31  ? 8.47600  6.26300  -3.32400  1.000 26.32000  ?  34  ALA   A HA   1 
ATOM   169  H HB1  . ALA   A 1 31  ? 7.37700  5.38300  -5.18600  1.000 27.60000  ?  34  ALA   A HB1  1 
ATOM   170  H HB2  . ALA   A 1 31  ? 7.38400  6.97200  -5.22600  1.000 27.60000  ?  34  ALA   A HB2  1 
ATOM   171  H HB3  . ALA   A 1 31  ? 8.39400  6.15000  -6.13600  1.000 27.60000  ?  34  ALA   A HB3  1 
ATOM   172  N N    . LYS   A 1 32  ? 10.77900 4.77800  -4.97500  1.000 23.00013  ?  35  LYS   A N    1 
ATOM   173  C CA   . LYS   A 1 32  ? 11.61000 3.58400  -4.91300  1.000 24.08447  ?  35  LYS   A CA   1 
ATOM   174  C C    . LYS   A 1 32  ? 12.32900 3.49800  -3.57400  1.000 22.63166  ?  35  LYS   A C    1 
ATOM   175  O O    . LYS   A 1 32  ? 12.45000 2.41800  -2.98700  1.000 22.60797  ?  35  LYS   A O    1 
ATOM   176  C CB   . LYS   A 1 32  ? 12.64100 3.59100  -6.03100  1.000 27.34275  ?  35  LYS   A CB   1 
ATOM   177  C CG   . LYS   A 1 32  ? 13.52100 2.33000  -6.00500  1.000 31.69064  ?  35  LYS   A CG   1 
ATOM   178  C CD   . LYS   A 1 32  ? 14.92000 2.59300  -6.53800  1.000 36.34910  ?  35  LYS   A CD   1 
ATOM   179  C CE   . LYS   A 1 32  ? 15.83300 1.38800  -6.30600  1.000 39.18365  ?  35  LYS   A CE   1 
ATOM   180  N NZ   . LYS   A 1 32  ? 17.27400 1.80300  -6.27900  1.000 40.89174  ?  35  LYS   A NZ   1 
ATOM   181  H H    . LYS   A 1 32  ? 10.99600 5.34800  -5.58100  1.000 27.65000  ?  35  LYS   A H    1 
ATOM   182  H HA   . LYS   A 1 32  ? 11.03800 2.80800  -5.02500  1.000 28.95000  ?  35  LYS   A HA   1 
ATOM   183  H HB2  . LYS   A 1 32  ? 12.18400 3.62500  -6.88600  1.000 32.86000  ?  35  LYS   A HB2  1 
ATOM   184  H HB3  . LYS   A 1 32  ? 13.21600 4.36600  -5.93100  1.000 32.86000  ?  35  LYS   A HB3  1 
ATOM   185  H HG2  . LYS   A 1 32  ? 13.60100 2.01700  -5.09000  1.000 38.08000  ?  35  LYS   A HG2  1 
ATOM   186  H HG3  . LYS   A 1 32  ? 13.11200 1.64500  -6.55600  1.000 38.08000  ?  35  LYS   A HG3  1 
ATOM   187  H HD2  . LYS   A 1 32  ? 14.87400 2.76400  -7.49100  1.000 43.67000  ?  35  LYS   A HD2  1 
ATOM   188  H HD3  . LYS   A 1 32  ? 15.30100 3.35900  -6.08000  1.000 43.67000  ?  35  LYS   A HD3  1 
ATOM   189  H HE2  . LYS   A 1 32  ? 15.61600 0.97700  -5.45500  1.000 47.07000  ?  35  LYS   A HE2  1 
ATOM   190  H HE3  . LYS   A 1 32  ? 15.71200 0.74800  -7.02400  1.000 47.07000  ?  35  LYS   A HE3  1 
ATOM   191  H HZ1  . LYS   A 1 32  ? 17.40700 2.39900  -5.63100  1.000 49.12000  ?  35  LYS   A HZ1  1 
ATOM   192  H HZ2  . LYS   A 1 32  ? 17.79200 1.09500  -6.13000  1.000 49.12000  ?  35  LYS   A HZ2  1 
ATOM   193  H HZ3  . LYS   A 1 32  ? 17.50100 2.16800  -7.05800  1.000 49.12000  ?  35  LYS   A HZ3  1 
ATOM   194  N N    . LEU   A 1 33  ? 12.80100 4.63100  -3.06400  1.000 21.40783  ?  36  LEU   A N    1 
ATOM   195  C CA   . LEU   A 1 33  ? 13.49700 4.61600  -1.78200  1.000 20.28664  ?  36  LEU   A CA   1 
ATOM   196  C C    . LEU   A 1 33  ? 12.58300 4.12700  -0.65600  1.000 19.45496  ?  36  LEU   A C    1 
ATOM   197  O O    . LEU   A 1 33  ? 12.99400 3.31700  0.18500   1.000 19.08124  ?  36  LEU   A O    1 
ATOM   198  C CB   . LEU   A 1 33  ? 14.02600 6.01200  -1.48300  1.000 21.00252  ?  36  LEU   A CB   1 
ATOM   199  C CG   . LEU   A 1 33  ? 14.89600 6.12800  -0.24600  1.000 21.68944  ?  36  LEU   A CG   1 
ATOM   200  C CD1  . LEU   A 1 33  ? 16.17900 5.31000  -0.40200  1.000 24.32397  ?  36  LEU   A CD1  1 
ATOM   201  C CD2  . LEU   A 1 33  ? 15.22400 7.60600  0.00800   1.000 22.04475  ?  36  LEU   A CD2  1 
ATOM   202  H H    . LEU   A 1 33  ? 12.73400 5.40600  -3.43200  1.000 25.74000  ?  36  LEU   A H    1 
ATOM   203  H HA   . LEU   A 1 33  ? 14.24900 4.00500  -1.83300  1.000 24.39000  ?  36  LEU   A HA   1 
ATOM   204  H HB2  . LEU   A 1 33  ? 14.55700 6.30400  -2.24000  1.000 25.25000  ?  36  LEU   A HB2  1 
ATOM   205  H HB3  . LEU   A 1 33  ? 13.26800 6.60500  -1.36100  1.000 25.25000  ?  36  LEU   A HB3  1 
ATOM   206  H HG   . LEU   A 1 33  ? 14.41900 5.77400  0.52100   1.000 26.08000  ?  36  LEU   A HG   1 
ATOM   207  H HD11 . LEU   A 1 33  ? 16.73800 5.44600  0.37900   1.000 29.24000  ?  36  LEU   A HD11 1 
ATOM   208  H HD12 . LEU   A 1 33  ? 15.94800 4.37100  -0.48300  1.000 29.24000  ?  36  LEU   A HD12 1 
ATOM   209  H HD13 . LEU   A 1 33  ? 16.64700 5.60500  -1.19900  1.000 29.24000  ?  36  LEU   A HD13 1 
ATOM   210  H HD21 . LEU   A 1 33  ? 15.74400 7.67800  0.82400   1.000 26.51000  ?  36  LEU   A HD21 1 
ATOM   211  H HD22 . LEU   A 1 33  ? 15.73400 7.94900  -0.74100  1.000 26.51000  ?  36  LEU   A HD22 1 
ATOM   212  H HD23 . LEU   A 1 33  ? 14.39500 8.10200  0.09900   1.000 26.51000  ?  36  LEU   A HD23 1 
ATOM   213  N N    . GLU   A 1 34  ? 11.34200 4.62500  -0.59700  1.000 20.12347  ?  37  GLU   A N    1 
ATOM   214  C CA   . GLU   A 1 34  ? 10.50400 4.22800  0.53400   1.000 20.92356  ?  37  GLU   A CA   1 
ATOM   215  C C    . GLU   A 1 34  ? 10.03100 2.78600  0.37300   1.000 21.86052  ?  37  GLU   A C    1 
ATOM   216  O O    . GLU   A 1 34  ? 9.81400  2.08700  1.36800   1.000 22.56586  ?  37  GLU   A O    1 
ATOM   217  C CB   . GLU   A 1 34  ? 9.34600  5.22500  0.76700   1.000 21.64733  ?  37  GLU   A CB   1 
ATOM   218  C CG   . GLU   A 1 34  ? 8.25400  5.13200  -0.22500  1.000 21.13674  ?  37  GLU   A CG   1 
ATOM   219  C CD   . GLU   A 1 34  ? 7.17400  6.20000  -0.07900  1.000 18.52064  ?  37  GLU   A CD   1 
ATOM   220  O OE1  . GLU   A 1 34  ? 7.09000  6.94700  0.93900   1.000 17.08363  ?  37  GLU   A OE1  1 
ATOM   221  O OE2  . GLU   A 1 34  ? 6.38900  6.24400  -1.03100  1.000 19.35495  -1 37  GLU   A OE2  1 
ATOM   222  H H    . GLU   A 1 34  ? 10.98500 5.16200  -1.16600  1.000 24.20000  ?  37  GLU   A H    1 
ATOM   223  H HA   . GLU   A 1 34  ? 11.02400 4.27300  1.35200   1.000 25.16000  ?  37  GLU   A HA   1 
ATOM   224  H HB2  . GLU   A 1 34  ? 8.96400  5.05500  1.64300   1.000 26.03000  ?  37  GLU   A HB2  1 
ATOM   225  H HB3  . GLU   A 1 34  ? 9.70200  6.12600  0.73000   1.000 26.03000  ?  37  GLU   A HB3  1 
ATOM   226  H HG2  . GLU   A 1 34  ? 8.63400  5.22100  -1.11300  1.000 25.41000  ?  37  GLU   A HG2  1 
ATOM   227  H HG3  . GLU   A 1 34  ? 7.82400  4.26800  -0.13200  1.000 25.41000  ?  37  GLU   A HG3  1 
ATOM   228  N N    . GLN   A 1 35  ? 9.88300  2.31900  -0.86800  1.000 23.22647  ?  38  GLN   A N    1 
ATOM   229  C CA   . GLN   A 1 35  ? 9.49900  0.92900  -1.08200  1.000 25.19776  ?  38  GLN   A CA   1 
ATOM   230  C C    . GLN   A 1 35  ? 10.60300 -0.02500 -0.64400  1.000 25.32935  ?  38  GLN   A C    1 
ATOM   231  O O    . GLN   A 1 35  ? 10.32600 -1.05900 -0.02500  1.000 25.71624  ?  38  GLN   A O    1 
ATOM   232  C CB   . GLN   A 1 35  ? 9.10800  0.73100  -2.54000  1.000 27.02692  ?  38  GLN   A CB   1 
ATOM   233  C CG   . GLN   A 1 35  ? 7.79800  1.43500  -2.85200  1.000 29.00611  ?  38  GLN   A CG   1 
ATOM   234  C CD   . GLN   A 1 35  ? 7.57300  1.61000  -4.32900  1.000 30.15888  ?  38  GLN   A CD   1 
ATOM   235  O OE1  . GLN   A 1 35  ? 8.16200  0.90300  -5.15500  1.000 31.64853  ?  38  GLN   A OE1  1 
ATOM   236  N NE2  . GLN   A 1 35  ? 6.72600  2.56600  -4.67700  1.000 29.15876  ?  38  GLN   A NE2  1 
ATOM   237  H H    . GLN   A 1 35  ? 9.99700  2.77800  -1.58600  1.000 27.92000  ?  38  GLN   A H    1 
ATOM   238  H HA   . GLN   A 1 35  ? 8.72100  0.71500  -0.54400  1.000 30.29000  ?  38  GLN   A HA   1 
ATOM   239  H HB2  . GLN   A 1 35  ? 9.79900  1.09900  -3.11200  1.000 32.48000  ?  38  GLN   A HB2  1 
ATOM   240  H HB3  . GLN   A 1 35  ? 8.99900  -0.21600 -2.71900  1.000 32.48000  ?  38  GLN   A HB3  1 
ATOM   241  H HG2  . GLN   A 1 35  ? 7.06400  0.90900  -2.49700  1.000 34.86000  ?  38  GLN   A HG2  1 
ATOM   242  H HG3  . GLN   A 1 35  ? 7.80600  2.31400  -2.44300  1.000 34.86000  ?  38  GLN   A HG3  1 
ATOM   243  H HE21 . GLN   A 1 35  ? 6.34200  3.04200  -4.07200  1.000 35.04000  ?  38  GLN   A HE21 1 
ATOM   244  H HE22 . GLN   A 1 35  ? 6.55900  2.71000  -5.50800  1.000 35.04000  ?  38  GLN   A HE22 1 
ATOM   245  N N    . ASP   A 1 36  ? 11.86400 0.33000  -0.90400  1.000 25.08459  ?  39  ASP   A N    1 
ATOM   246  C CA   . ASP   A 1 36  ? 12.97200 -0.47400 -0.40200  1.000 25.68466  ?  39  ASP   A CA   1 
ATOM   247  C C    . ASP   A 1 36  ? 13.06400 -0.42300 1.11800   1.000 23.54230  ?  39  ASP   A C    1 
ATOM   248  O O    . ASP   A 1 36  ? 13.45300 -1.41200 1.75800   1.000 25.50043  ?  39  ASP   A O    1 
ATOM   249  C CB   . ASP   A 1 36  ? 14.27500 0.03100  -0.99900  1.000 28.46657  ?  39  ASP   A CB   1 
ATOM   250  C CG   . ASP   A 1 36  ? 14.41100 -0.29900 -2.47300  1.000 32.03016  ?  39  ASP   A CG   1 
ATOM   251  O OD1  . ASP   A 1 36  ? 13.62400 -1.10200 -3.02000  1.000 33.74352  ?  39  ASP   A OD1  1 
ATOM   252  O OD2  . ASP   A 1 36  ? 15.32300 0.26900  -3.07400  1.000 32.69076  -1 39  ASP   A OD2  1 
ATOM   253  H H    . ASP   A 1 36  ? 12.09800 1.02000  -1.36100  1.000 30.15000  ?  39  ASP   A H    1 
ATOM   254  H HA   . ASP   A 1 36  ? 12.82700 -1.39400 -0.67000  1.000 30.87000  ?  39  ASP   A HA   1 
ATOM   255  H HB2  . ASP   A 1 36  ? 14.31500 0.99500  -0.90200  1.000 34.21000  ?  39  ASP   A HB2  1 
ATOM   256  H HB3  . ASP   A 1 36  ? 15.01800 -0.38100 -0.53000  1.000 34.21000  ?  39  ASP   A HB3  1 
ATOM   257  N N    . PHE   A 1 37  ? 12.74800 0.73100  1.70700   1.000 21.31835  ?  40  PHE   A N    1 
ATOM   258  C CA   . PHE   A 1 37  ? 12.71800 0.86700  3.15800   1.000 19.82080  ?  40  PHE   A CA   1 
ATOM   259  C C    . PHE   A 1 37  ? 11.57000 0.07600  3.77800   1.000 19.99187  ?  40  PHE   A C    1 
ATOM   260  O O    . PHE   A 1 37  ? 11.67100 -0.36800 4.93600   1.000 20.94988  ?  40  PHE   A O    1 
ATOM   261  C CB   . PHE   A 1 37  ? 12.58400 2.35900  3.47600   1.000 19.40233  ?  40  PHE   A CB   1 
ATOM   262  C CG   . PHE   A 1 37  ? 12.25600 2.66200  4.90300   1.000 18.61013  ?  40  PHE   A CG   1 
ATOM   263  C CD1  . PHE   A 1 37  ? 13.11500 2.28700  5.93000   1.000 19.80237  ?  40  PHE   A CD1  1 
ATOM   264  C CD2  . PHE   A 1 37  ? 11.09300 3.34300  5.22300   1.000 18.77330  ?  40  PHE   A CD2  1 
ATOM   265  C CE1  . PHE   A 1 37  ? 12.81400 2.56800  7.24500   1.000 19.56287  ?  40  PHE   A CE1  1 
ATOM   266  C CE2  . PHE   A 1 37  ? 10.80200 3.62900  6.54200   1.000 18.98649  ?  40  PHE   A CE2  1 
ATOM   267  C CZ   . PHE   A 1 37  ? 11.64800 3.23700  7.54200   1.000 18.80489  ?  40  PHE   A CZ   1 
ATOM   268  H H    . PHE   A 1 37  ? 12.54600 1.45300  1.28600   1.000 25.63000  ?  40  PHE   A H    1 
ATOM   269  H HA   . PHE   A 1 37  ? 13.53600 0.52400  3.55000   1.000 23.84000  ?  40  PHE   A HA   1 
ATOM   270  H HB2  . PHE   A 1 37  ? 13.42500 2.79600  3.26900   1.000 23.33000  ?  40  PHE   A HB2  1 
ATOM   271  H HB3  . PHE   A 1 37  ? 11.87500 2.73000  2.92700   1.000 23.33000  ?  40  PHE   A HB3  1 
ATOM   272  H HD1  . PHE   A 1 37  ? 13.90400 1.83900  5.72600   1.000 23.81000  ?  40  PHE   A HD1  1 
ATOM   273  H HD2  . PHE   A 1 37  ? 10.50800 3.60800  4.55000   1.000 22.58000  ?  40  PHE   A HD2  1 
ATOM   274  H HE1  . PHE   A 1 37  ? 13.39400 2.30800  7.92500   1.000 23.53000  ?  40  PHE   A HE1  1 
ATOM   275  H HE2  . PHE   A 1 37  ? 10.02300 4.09200  6.75300   1.000 22.83000  ?  40  PHE   A HE2  1 
ATOM   276  H HZ   . PHE   A 1 37  ? 11.43500 3.42300  8.42800   1.000 22.61000  ?  40  PHE   A HZ   1 
ATOM   277  N N    . GLY   A 1 38  ? 10.48300 -0.11000 3.03000   1.000 20.12083  ?  41  GLY   A N    1 
ATOM   278  C CA   . GLY   A 1 38  ? 9.31600  -0.79800 3.54700   1.000 20.09978  ?  41  GLY   A CA   1 
ATOM   279  C C    . GLY   A 1 38  ? 8.36800  0.09000  4.31500   1.000 19.22862  ?  41  GLY   A C    1 
ATOM   280  O O    . GLY   A 1 38  ? 7.66300  -0.39500 5.19900   1.000 20.63405  ?  41  GLY   A O    1 
ATOM   281  H H    . GLY   A 1 38  ? 10.40100 0.15600  2.21600   1.000 24.20000  ?  41  GLY   A H    1 
ATOM   282  H HA2  . GLY   A 1 38  ? 8.82700  -1.18700 2.80600   1.000 24.17000  ?  41  GLY   A HA2  1 
ATOM   283  H HA3  . GLY   A 1 38  ? 9.60800  -1.50800 4.14000   1.000 24.17000  ?  41  GLY   A HA3  1 
ATOM   284  N N    . GLY   A 1 39  ? 8.33400  1.37600  4.01400   1.000 17.51526  ?  42  GLY   A N    1 
ATOM   285  C CA   . GLY   A 1 39  ? 7.47200  2.29800  4.72400   1.000 17.73107  ?  42  GLY   A CA   1 
ATOM   286  C C    . GLY   A 1 39  ? 7.23300  3.54300  3.94700   1.000 17.73107  ?  42  GLY   A C    1 
ATOM   287  O O    . GLY   A 1 39  ? 7.21200  3.52300  2.71500   1.000 21.55258  ?  42  GLY   A O    1 
ATOM   288  H H    . GLY   A 1 39  ? 8.80700  1.74200  3.39600   1.000 21.07000  ?  42  GLY   A H    1 
ATOM   289  H HA2  . GLY   A 1 39  ? 6.61700  1.87400  4.89500   1.000 21.33000  ?  42  GLY   A HA2  1 
ATOM   290  H HA3  . GLY   A 1 39  ? 7.88100  2.53700  5.57000   1.000 21.33000  ?  42  GLY   A HA3  1 
ATOM   291  N N    . SER   A 1 40  ? 7.02800  4.63600  4.67400   1.000 15.94402  ?  43  SER   A N    1 
ATOM   292  C CA   . SER   A 1 40  ? 6.75900  5.93900  4.08500   1.000 16.16510  ?  43  SER   A CA   1 
ATOM   293  C C    . SER   A 1 40  ? 7.85600  6.92000  4.45900   1.000 15.72820  ?  43  SER   A C    1 
ATOM   294  O O    . SER   A 1 40  ? 8.29300  6.95100  5.61100   1.000 16.28090  ?  43  SER   A O    1 
ATOM   295  C CB   . SER   A 1 40  ? 5.43100  6.51000  4.58500   1.000 16.99941  ?  43  SER   A CB   1 
ATOM   296  O OG   . SER   A 1 40  ? 4.34400  5.66300  4.25200   1.000 18.56538  ?  43  SER   A OG   1 
ATOM   297  H H    . SER   A 1 40  ? 7.03900  4.64500  5.53400   1.000 19.18000  ?  43  SER   A H    1 
ATOM   298  H HA   . SER   A 1 40  ? 6.73200  5.83900  3.12100   1.000 19.45000  ?  43  SER   A HA   1 
ATOM   299  H HB2  . SER   A 1 40  ? 5.47300  6.60200  5.55000   1.000 20.45000  ?  43  SER   A HB2  1 
ATOM   300  H HB3  . SER   A 1 40  ? 5.28900  7.37800  4.17500   1.000 20.45000  ?  43  SER   A HB3  1 
ATOM   301  H HG   . SER   A 1 40  ? 4.29800  5.56900  3.41900   1.000 22.32000  ?  43  SER   A HG   1 
ATOM   302  N N    . ILE   A 1 41  ? 8.25500  7.73700  3.49100   1.000 15.97034  ?  44  ILE   A N    1 
ATOM   303  C CA   . ILE   A 1 41  ? 9.21500  8.80500  3.70200   1.000 16.42302  ?  44  ILE   A CA   1 
ATOM   304  C C    . ILE   A 1 41  ? 8.55900  10.12000 3.30100   1.000 15.94665  ?  44  ILE   A C    1 
ATOM   305  O O    . ILE   A 1 41  ? 7.95700  10.23300 2.22100   1.000 17.02046  ?  44  ILE   A O    1 
ATOM   306  C CB   . ILE   A 1 41  ? 10.49100 8.55600  2.87800   1.000 18.46274  ?  44  ILE   A CB   1 
ATOM   307  C CG1  . ILE   A 1 41  ? 11.14100 7.22500  3.27700   1.000 19.71815  ?  44  ILE   A CG1  1 
ATOM   308  C CG2  . ILE   A 1 41  ? 11.45200 9.69900  3.03700   1.000 20.22874  ?  44  ILE   A CG2  1 
ATOM   309  C CD1  . ILE   A 1 41  ? 12.22200 6.76300  2.30900   1.000 22.52375  ?  44  ILE   A CD1  1 
ATOM   310  H H    . ILE   A 1 41  ? 7.97200  7.68800  2.68000   1.000 19.21000  ?  44  ILE   A H    1 
ATOM   311  H HA   . ILE   A 1 41  ? 9.45000  8.85900  4.64200   1.000 19.76000  ?  44  ILE   A HA   1 
ATOM   312  H HB   . ILE   A 1 41  ? 10.24400 8.49800  1.94100   1.000 22.21000  ?  44  ILE   A HB   1 
ATOM   313  H HG12 . ILE   A 1 41  ? 11.54900 7.32600  4.15100   1.000 23.71000  ?  44  ILE   A HG12 1 
ATOM   314  H HG13 . ILE   A 1 41  ? 10.45600 6.53900  3.30700   1.000 23.71000  ?  44  ILE   A HG13 1 
ATOM   315  H HG21 . ILE   A 1 41  ? 12.26900 9.49500  2.55500   1.000 24.32000  ?  44  ILE   A HG21 1 
ATOM   316  H HG22 . ILE   A 1 41  ? 11.04800 10.50400 2.67800   1.000 24.32000  ?  44  ILE   A HG22 1 
ATOM   317  H HG23 . ILE   A 1 41  ? 11.64700 9.81900  3.98000   1.000 24.32000  ?  44  ILE   A HG23 1 
ATOM   318  H HD11 . ILE   A 1 41  ? 12.41600 5.82800  2.47600   1.000 27.08000  ?  44  ILE   A HD11 1 
ATOM   319  H HD12 . ILE   A 1 41  ? 11.90100 6.87700  1.40100   1.000 27.08000  ?  44  ILE   A HD12 1 
ATOM   320  H HD13 . ILE   A 1 41  ? 13.01900 7.29700  2.44800   1.000 27.08000  ?  44  ILE   A HD13 1 
ATOM   321  N N    . GLY   A 1 42  ? 8.71200  11.11700 4.16200   1.000 15.17550  ?  45  GLY   A N    1 
ATOM   322  C CA   . GLY   A 1 42  ? 8.23900  12.45900 3.90800   1.000 14.58859  ?  45  GLY   A CA   1 
ATOM   323  C C    . GLY   A 1 42  ? 9.37300  13.45500 3.87600   1.000 14.63333  ?  45  GLY   A C    1 
ATOM   324  O O    . GLY   A 1 42  ? 10.20200 13.47500 4.79600   1.000 14.66228  ?  45  GLY   A O    1 
ATOM   325  H H    . GLY   A 1 42  ? 9.10000  11.03500 4.92400   1.000 18.26000  ?  45  GLY   A H    1 
ATOM   326  H HA2  . GLY   A 1 42  ? 7.78100  12.48500 3.05400   1.000 17.55000  ?  45  GLY   A HA2  1 
ATOM   327  H HA3  . GLY   A 1 42  ? 7.61800  12.72000 4.60700   1.000 17.55000  ?  45  GLY   A HA3  1 
ATOM   328  N N    . VAL   A 1 43  ? 9.39900  14.29000 2.84500   1.000 14.86757  ?  46  VAL   A N    1 
ATOM   329  C CA   . VAL   A 1 43  ? 10.53000 15.17800 2.58500   1.000 15.78084  ?  46  VAL   A CA   1 
ATOM   330  C C    . VAL   A 1 43  ? 9.99400  16.54200 2.19500   1.000 16.04929  ?  46  VAL   A C    1 
ATOM   331  O O    . VAL   A 1 43  ? 9.11800  16.64800 1.32700   1.000 16.08088  ?  46  VAL   A O    1 
ATOM   332  C CB   . VAL   A 1 43  ? 11.43400 14.63600 1.45600   1.000 16.68095  ?  46  VAL   A CB   1 
ATOM   333  C CG1  . VAL   A 1 43  ? 12.55400 15.64200 1.13600   1.000 17.93636  ?  46  VAL   A CG1  1 
ATOM   334  C CG2  . VAL   A 1 43  ? 11.94700 13.26100 1.82300   1.000 18.24956  ?  46  VAL   A CG2  1 
ATOM   335  H H    . VAL   A 1 43  ? 8.76300  14.36400 2.27100   1.000 17.89000  ?  46  VAL   A H    1 
ATOM   336  H HA   . VAL   A 1 43  ? 11.05400 15.26700 3.39600   1.000 18.99000  ?  46  VAL   A HA   1 
ATOM   337  H HB   . VAL   A 1 43  ? 10.92700 14.53100 0.63600   1.000 20.07000  ?  46  VAL   A HB   1 
ATOM   338  H HG11 . VAL   A 1 43  ? 13.24500 15.19400 0.62400   1.000 21.57000  ?  46  VAL   A HG11 1 
ATOM   339  H HG12 . VAL   A 1 43  ? 12.18200 16.37500 0.62000   1.000 21.57000  ?  46  VAL   A HG12 1 
ATOM   340  H HG13 . VAL   A 1 43  ? 12.92300 15.97800 1.96800   1.000 21.57000  ?  46  VAL   A HG13 1 
ATOM   341  H HG21 . VAL   A 1 43  ? 12.55700 12.95700 1.13300   1.000 21.95000  ?  46  VAL   A HG21 1 
ATOM   342  H HG22 . VAL   A 1 43  ? 12.41000 13.31300 2.67400   1.000 21.95000  ?  46  VAL   A HG22 1 
ATOM   343  H HG23 . VAL   A 1 43  ? 11.19600 12.65200 1.89200   1.000 21.95000  ?  46  VAL   A HG23 1 
ATOM   344  N N    . TYR   A 1 44  ? 10.52900 17.58800 2.81000   1.000 16.02561  ?  47  TYR   A N    1 
ATOM   345  C CA   . TYR   A 1 44  ? 10.33600 18.94000 2.31400   1.000 16.42039  ?  47  TYR   A CA   1 
ATOM   346  C C    . TYR   A 1 44  ? 11.67200 19.65400 2.41500   1.000 17.64685  ?  47  TYR   A C    1 
ATOM   347  O O    . TYR   A 1 44  ? 12.31200 19.62100 3.46500   1.000 18.99175  ?  47  TYR   A O    1 
ATOM   348  C CB   . TYR   A 1 44  ? 9.23200  19.68700 3.06500   1.000 16.81517  ?  47  TYR   A CB   1 
ATOM   349  C CG   . TYR   A 1 44  ? 8.72000  20.90600 2.34500   1.000 17.54684  ?  47  TYR   A CG   1 
ATOM   350  C CD1  . TYR   A 1 44  ? 7.84800  20.78900 1.26900   1.000 17.32839  ?  47  TYR   A CD1  1 
ATOM   351  C CD2  . TYR   A 1 44  ? 9.05700  22.18200 2.76700   1.000 18.65750  ?  47  TYR   A CD2  1 
ATOM   352  C CE1  . TYR   A 1 44  ? 7.35300  21.89600 0.63100   1.000 18.52327  ?  47  TYR   A CE1  1 
ATOM   353  C CE2  . TYR   A 1 44  ? 8.57000  23.29600 2.13100   1.000 19.66025  ?  47  TYR   A CE2  1 
ATOM   354  C CZ   . TYR   A 1 44  ? 7.69700  23.14800 1.06600   1.000 19.90239  ?  47  TYR   A CZ   1 
ATOM   355  O OH   . TYR   A 1 44  ? 7.17900  24.23900 0.42000   1.000 23.24226  ?  47  TYR   A OH   1 
ATOM   356  H H    . TYR   A 1 44  ? 11.01000 17.53800 3.52100   1.000 19.28000  ?  47  TYR   A H    1 
ATOM   357  H HA   . TYR   A 1 44  ? 10.05900 18.92400 1.38500   1.000 19.75000  ?  47  TYR   A HA   1 
ATOM   358  H HB2  . TYR   A 1 44  ? 8.48300  19.08500 3.19600   1.000 20.23000  ?  47  TYR   A HB2  1 
ATOM   359  H HB3  . TYR   A 1 44  ? 9.58000  19.97500 3.92400   1.000 20.23000  ?  47  TYR   A HB3  1 
ATOM   360  H HD1  . TYR   A 1 44  ? 7.59500  19.94300 0.97800   1.000 20.84000  ?  47  TYR   A HD1  1 
ATOM   361  H HD2  . TYR   A 1 44  ? 9.62500  22.28600 3.49600   1.000 22.44000  ?  47  TYR   A HD2  1 
ATOM   362  H HE1  . TYR   A 1 44  ? 6.78400  21.79700 -0.09800  1.000 22.28000  ?  47  TYR   A HE1  1 
ATOM   363  H HE2  . TYR   A 1 44  ? 8.82500  24.14500 2.41300   1.000 23.64000  ?  47  TYR   A HE2  1 
ATOM   364  H HH   . TYR   A 1 44  ? 6.63700  23.99100 -0.17200  1.000 27.94000  ?  47  TYR   A HH   1 
ATOM   365  N N    . ALA   A 1 45  ? 12.10200 20.25300 1.31000   1.000 16.38354  ?  48  ALA   A N    1 
ATOM   366  C CA   . ALA   A 1 45  ? 13.38000 20.96200 1.26200   1.000 16.38618  ?  48  ALA   A CA   1 
ATOM   367  C C    . ALA   A 1 45  ? 13.16300 22.27800 0.54000   1.000 17.44156  ?  48  ALA   A C    1 
ATOM   368  O O    . ALA   A 1 45  ? 12.51800 22.31600 -0.51400  1.000 18.11796  ?  48  ALA   A O    1 
ATOM   369  C CB   . ALA   A 1 45  ? 14.48200 20.15800 0.57000   1.000 16.92308  ?  48  ALA   A CB   1 
ATOM   370  H H    . ALA   A 1 45  ? 11.66900 20.26300 0.56700   1.000 19.71000  ?  48  ALA   A H    1 
ATOM   371  H HA   . ALA   A 1 45  ? 13.68500 21.13500 2.16600   1.000 19.71000  ?  48  ALA   A HA   1 
ATOM   372  H HB1  . ALA   A 1 45  ? 15.30200 20.67600 0.57600   1.000 20.36000  ?  48  ALA   A HB1  1 
ATOM   373  H HB2  . ALA   A 1 45  ? 14.61400 19.32500 1.05000   1.000 20.36000  ?  48  ALA   A HB2  1 
ATOM   374  H HB3  . ALA   A 1 45  ? 14.21300 19.97400 -0.34400  1.000 20.36000  ?  48  ALA   A HB3  1 
ATOM   375  N N    A MET   A 1 46  ? 13.73600 23.35400 1.07900   0.110 18.45748  ?  49  MET   A N    1 
ATOM   376  N N    B MET   A 1 46  ? 13.66500 23.35700 1.13000   0.390 17.93110  ?  49  MET   A N    1 
ATOM   377  N N    C MET   A 1 46  ? 13.73900 23.34300 1.09300   0.500 18.92595  ?  49  MET   A N    1 
ATOM   378  C CA   A MET   A 1 46  ? 13.50300 24.70000 0.56600   0.110 19.50234  ?  49  MET   A CA   1 
ATOM   379  C CA   B MET   A 1 46  ? 13.53100 24.69400 0.57300   0.390 19.24968  ?  49  MET   A CA   1 
ATOM   380  C CA   C MET   A 1 46  ? 13.54600 24.70200 0.60400   0.500 20.41824  ?  49  MET   A CA   1 
ATOM   381  C C    A MET   A 1 46  ? 14.83000 25.40700 0.33900   0.110 19.21283  ?  49  MET   A C    1 
ATOM   382  C C    B MET   A 1 46  ? 14.90600 25.28200 0.29700   0.390 18.77594  ?  49  MET   A C    1 
ATOM   383  C C    C MET   A 1 46  ? 14.89200 25.34800 0.32300   0.500 19.17862  ?  49  MET   A C    1 
ATOM   384  O O    A MET   A 1 46  ? 15.61600 25.57800 1.27800   0.110 19.12598  ?  49  MET   A O    1 
ATOM   385  O O    B MET   A 1 46  ? 15.78300 25.26400 1.16800   0.390 18.33378  ?  49  MET   A O    1 
ATOM   386  O O    C MET   A 1 46  ? 15.74200 25.43900 1.21600   0.500 18.46537  ?  49  MET   A O    1 
ATOM   387  C CB   A MET   A 1 46  ? 12.64000 25.48600 1.55900   0.110 20.91040  ?  49  MET   A CB   1 
ATOM   388  C CB   B MET   A 1 46  ? 12.77400 25.59000 1.55500   0.390 21.38151  ?  49  MET   A CB   1 
ATOM   389  C CB   C MET   A 1 46  ? 12.80500 25.49700 1.67900   0.500 23.36333  ?  49  MET   A CB   1 
ATOM   390  C CG   A MET   A 1 46  ? 11.99600 26.74200 1.02100   0.110 22.12107  ?  49  MET   A CG   1 
ATOM   391  C CG   B MET   A 1 46  ? 12.85800 27.06900 1.26400   0.390 23.24752  ?  49  MET   A CG   1 
ATOM   392  C CG   C MET   A 1 46  ? 12.61200 26.96600 1.45000   0.500 27.07167  ?  49  MET   A CG   1 
ATOM   393  S SD   A MET   A 1 46  ? 10.40700 27.05100 1.82000   0.110 22.98170  ?  49  MET   A SD   1 
ATOM   394  S SD   B MET   A 1 46  ? 11.79700 27.56400 -0.09600  0.390 25.01616  ?  49  MET   A SD   1 
ATOM   395  S SD   C MET   A 1 46  ? 12.12700 27.72600 3.01900   0.500 29.85095  ?  49  MET   A SD   1 
ATOM   396  C CE   A MET   A 1 46  ? 10.75900 26.62100 3.52900   0.110 22.79484  ?  49  MET   A CE   1 
ATOM   397  C CE   B MET   A 1 46  ? 10.16300 27.42600 0.62300   0.390 24.85561  ?  49  MET   A CE   1 
ATOM   398  C CE   C MET   A 1 46  ? 10.67000 26.76000 3.46700   0.500 28.93242  ?  49  MET   A CE   1 
ATOM   399  H H    A MET   A 1 46  ? 14.27100 23.32700 1.75100   0.110 22.20000  ?  49  MET   A H    1 
ATOM   400  H H    B MET   A 1 46  ? 14.09900 23.33800 1.87300   0.390 21.57000  ?  49  MET   A H    1 
ATOM   401  H H    C MET   A 1 46  ? 14.26200 23.30100 1.77400   0.500 22.76000  ?  49  MET   A H    1 
ATOM   402  H HA   A MET   A 1 46  ? 13.04700 24.64400 -0.28800  0.110 23.45000  ?  49  MET   A HA   1 
ATOM   403  H HA   B MET   A 1 46  ? 13.04400 24.64700 -0.26400  0.390 23.15000  ?  49  MET   A HA   1 
ATOM   404  H HA   C MET   A 1 46  ? 13.04400 24.68900 -0.22600  0.500 24.55000  ?  49  MET   A HA   1 
ATOM   405  H HB2  A MET   A 1 46  ? 11.92600 24.90600 1.86700   0.110 25.14000  ?  49  MET   A HB2  1 
ATOM   406  H HB2  B MET   A 1 46  ? 11.83600 25.34300 1.53600   0.390 25.71000  ?  49  MET   A HB2  1 
ATOM   407  H HB2  C MET   A 1 46  ? 11.92000 25.11100 1.77500   0.500 28.08000  ?  49  MET   A HB2  1 
ATOM   408  H HB3  A MET   A 1 46  ? 13.20000 25.74800 2.30700   0.110 25.14000  ?  49  MET   A HB3  1 
ATOM   409  H HB3  B MET   A 1 46  ? 13.13700 25.44800 2.44300   0.390 25.71000  ?  49  MET   A HB3  1 
ATOM   410  H HB3  C MET   A 1 46  ? 13.29900 25.40600 2.50800   0.500 28.08000  ?  49  MET   A HB3  1 
ATOM   411  H HG2  A MET   A 1 46  ? 12.57700 27.50000 1.19000   0.110 26.60000  ?  49  MET   A HG2  1 
ATOM   412  H HG2  B MET   A 1 46  ? 12.58600 27.56400 2.05300   0.390 27.94000  ?  49  MET   A HG2  1 
ATOM   413  H HG2  C MET   A 1 46  ? 13.44100 27.36700 1.14400   0.500 32.54000  ?  49  MET   A HG2  1 
ATOM   414  H HG3  A MET   A 1 46  ? 11.84600 26.64400 0.06800   0.110 26.60000  ?  49  MET   A HG3  1 
ATOM   415  H HG3  B MET   A 1 46  ? 13.77200 27.29500 1.02900   0.390 27.94000  ?  49  MET   A HG3  1 
ATOM   416  H HG3  C MET   A 1 46  ? 11.91200 27.11200 0.79500   0.500 32.54000  ?  49  MET   A HG3  1 
ATOM   417  H HE1  A MET   A 1 46  ? 10.11300 27.06000 4.10400   0.110 27.40000  ?  49  MET   A HE1  1 
ATOM   418  H HE1  B MET   A 1 46  ? 9.50700  27.73800 -0.02000  0.390 29.88000  ?  49  MET   A HE1  1 
ATOM   419  H HE1  C MET   A 1 46  ? 10.26700 27.14700 4.26000   0.500 34.77000  ?  49  MET   A HE1  1 
ATOM   420  H HE2  A MET   A 1 46  ? 10.69300 25.65900 3.63200   0.110 27.40000  ?  49  MET   A HE2  1 
ATOM   421  H HE2  B MET   A 1 46  ? 9.99300  26.49700 0.84500   0.390 29.88000  ?  49  MET   A HE2  1 
ATOM   422  H HE2  C MET   A 1 46  ? 10.03900 26.78100 2.73100   0.500 34.77000  ?  49  MET   A HE2  1 
ATOM   423  H HE3  A MET   A 1 46  ? 11.65500 26.91700 3.75100   0.110 27.40000  ?  49  MET   A HE3  1 
ATOM   424  H HE3  B MET   A 1 46  ? 10.12400 27.97000 1.42600   0.390 29.88000  ?  49  MET   A HE3  1 
ATOM   425  H HE3  C MET   A 1 46  ? 10.94000 25.84600 3.64500   0.500 34.77000  ?  49  MET   A HE3  1 
ATOM   426  N N    . ASP   A 1 47  ? 15.07300 25.81900 -0.90600  1.000 19.08124  ?  50  ASP   A N    1 
ATOM   427  C CA   . ASP   A 1 47  ? 16.21300 26.65900 -1.24800  1.000 19.38917  ?  50  ASP   A CA   1 
ATOM   428  C C    . ASP   A 1 47  ? 15.79700 28.08200 -0.89400  1.000 19.99713  ?  50  ASP   A C    1 
ATOM   429  O O    . ASP   A 1 47  ? 14.92000 28.65600 -1.54700  1.000 21.17886  ?  50  ASP   A O    1 
ATOM   430  C CB   . ASP   A 1 47  ? 16.53900 26.53300 -2.73700  1.000 21.08148  ?  50  ASP   A CB   1 
ATOM   431  C CG   . ASP   A 1 47  ? 17.72900 27.35700 -3.15100  1.000 22.59481  ?  50  ASP   A CG   1 
ATOM   432  O OD1  . ASP   A 1 47  ? 18.02500 28.36500 -2.48800  1.000 23.51335  ?  50  ASP   A OD1  1 
ATOM   433  O OD2  . ASP   A 1 47  ? 18.33800 27.02100 -4.18700  1.000 24.70823  -1 50  ASP   A OD2  1 
ATOM   434  H H    A ASP   A 1 47  ? 14.58000 25.61800 -1.58100  0.110 22.95000  ?  50  ASP   A H    1 
ATOM   435  H H    B ASP   A 1 47  ? 14.52400 25.70700 -1.55900  0.390 22.95000  ?  50  ASP   A H    1 
ATOM   436  H H    C ASP   A 1 47  ? 14.54300 25.66300 -1.56500  0.500 22.95000  ?  50  ASP   A H    1 
ATOM   437  H HA   . ASP   A 1 47  ? 17.00600 26.40300 -0.75300  1.000 23.32000  ?  50  ASP   A HA   1 
ATOM   438  H HB2  . ASP   A 1 47  ? 16.73300 25.60400 -2.94000  1.000 25.35000  ?  50  ASP   A HB2  1 
ATOM   439  H HB3  . ASP   A 1 47  ? 15.77400 26.83200 -3.25400  1.000 25.35000  ?  50  ASP   A HB3  1 
ATOM   440  N N    . THR   A 1 48  ? 16.38300 28.64900 0.16300   1.000 19.84448  ?  51  THR   A N    1 
ATOM   441  C CA   . THR   A 1 48  ? 15.92800 29.95600 0.62400   1.000 20.69459  ?  51  THR   A CA   1 
ATOM   442  C C    . THR   A 1 48  ? 16.33400 31.09000 -0.30500  1.000 22.10002  ?  51  THR   A C    1 
ATOM   443  O O    . THR   A 1 48  ? 15.85200 32.21700 -0.13100  1.000 24.15290  ?  51  THR   A O    1 
ATOM   444  C CB   . THR   A 1 48  ? 16.38900 30.26300 2.05800   1.000 21.19201  ?  51  THR   A CB   1 
ATOM   445  O OG1  . THR   A 1 48  ? 17.81400 30.42400 2.10200   1.000 20.81302  ?  51  THR   A OG1  1 
ATOM   446  C CG2  . THR   A 1 48  ? 15.98200 29.16400 3.00600   1.000 21.43941  ?  51  THR   A CG2  1 
ATOM   447  H H    . THR   A 1 48  ? 17.02700 28.30400 0.61600   1.000 23.86000  ?  51  THR   A H    1 
ATOM   448  H HA   . THR   A 1 48  ? 14.95900 29.92200 0.65400   1.000 24.88000  ?  51  THR   A HA   1 
ATOM   449  H HB   . THR   A 1 48  ? 15.96700 31.08700 2.34800   1.000 25.48000  ?  51  THR   A HB   1 
ATOM   450  H HG1  . THR   A 1 48  ? 18.19100 29.72000 1.84100   1.000 25.02000  ?  51  THR   A HG1  1 
ATOM   451  H HG21 . THR   A 1 48  ? 16.22300 29.40400 3.91500   1.000 25.78000  ?  51  THR   A HG21 1 
ATOM   452  H HG22 . THR   A 1 48  ? 15.02300 29.02500 2.96100   1.000 25.78000  ?  51  THR   A HG22 1 
ATOM   453  H HG23 . THR   A 1 48  ? 16.43200 28.33800 2.77000   1.000 25.78000  ?  51  THR   A HG23 1 
ATOM   454  N N    . GLY   A 1 49  ? 17.18000 30.83400 -1.29300  1.000 22.36847  ?  52  GLY   A N    1 
ATOM   455  C CA   . GLY   A 1 49  ? 17.53700 31.88400 -2.22300  1.000 24.53452  ?  52  GLY   A CA   1 
ATOM   456  C C    . GLY   A 1 49  ? 16.48000 32.08000 -3.28400  1.000 26.69531  ?  52  GLY   A C    1 
ATOM   457  O O    . GLY   A 1 49  ? 16.00500 33.19400 -3.51200  1.000 29.52459  ?  52  GLY   A O    1 
ATOM   458  H H    . GLY   A 1 49  ? 17.55300 30.07300 -1.43900  1.000 26.89000  ?  52  GLY   A H    1 
ATOM   459  H HA2  . GLY   A 1 49  ? 17.64700 32.71900 -1.74100  1.000 29.49000  ?  52  GLY   A HA2  1 
ATOM   460  H HA3  . GLY   A 1 49  ? 18.37300 31.65900 -2.66000  1.000 29.49000  ?  52  GLY   A HA3  1 
ATOM   461  N N    . SER   A 1 50  ? 16.09700 30.99000 -3.93300  1.000 26.34790  ?  53  SER   A N    1 
ATOM   462  C CA   . SER   A 1 50  ? 15.17300 31.06400 -5.05100  1.000 27.34538  ?  53  SER   A CA   1 
ATOM   463  C C    . SER   A 1 50  ? 13.73400 30.77200 -4.66700  1.000 27.74017  ?  53  SER   A C    1 
ATOM   464  O O    . SER   A 1 50  ? 12.82500 31.13500 -5.42700  1.000 28.49552  ?  53  SER   A O    1 
ATOM   465  C CB   . SER   A 1 50  ? 15.57500 30.03300 -6.10300  1.000 27.73754  ?  53  SER   A CB   1 
ATOM   466  O OG   . SER   A 1 50  ? 15.44700 28.73100 -5.56200  1.000 27.23748  ?  53  SER   A OG   1 
ATOM   467  H H    . SER   A 1 50  ? 16.35900 30.19300 -3.74400  1.000 31.67000  ?  53  SER   A H    1 
ATOM   468  H HA   . SER   A 1 50  ? 15.21700 31.95700 -5.42800  1.000 32.86000  ?  53  SER   A HA   1 
ATOM   469  H HB2  . SER   A 1 50  ? 14.99300 30.11900 -6.87500  1.000 33.33000  ?  53  SER   A HB2  1 
ATOM   470  H HB3  . SER   A 1 50  ? 16.49700 30.18300 -6.36400  1.000 33.33000  ?  53  SER   A HB3  1 
ATOM   471  H HG   . SER   A 1 50  ? 15.71000 28.16100 -6.12000  1.000 32.74000  ?  53  SER   A HG   1 
ATOM   472  N N    . GLY   A 1 51  ? 13.51400 30.09500 -3.54400  1.000 27.56909  ?  54  GLY   A N    1 
ATOM   473  C CA   . GLY   A 1 51  ? 12.20200 29.61600 -3.18300  1.000 27.34538  ?  54  GLY   A CA   1 
ATOM   474  C C    . GLY   A 1 51  ? 11.85100 28.27100 -3.76200  1.000 26.11366  ?  54  GLY   A C    1 
ATOM   475  O O    . GLY   A 1 51  ? 10.75900 27.76400 -3.49100  1.000 26.96902  ?  54  GLY   A O    1 
ATOM   476  H H    . GLY   A 1 51  ? 14.12500 29.90200 -2.97000  1.000 33.13000  ?  54  GLY   A H    1 
ATOM   477  H HA2  . GLY   A 1 51  ? 12.14900 29.54700 -2.21600  1.000 32.86000  ?  54  GLY   A HA2  1 
ATOM   478  H HA3  . GLY   A 1 51  ? 11.54000 30.25500 -3.49000  1.000 32.86000  ?  54  GLY   A HA3  1 
ATOM   479  N N    . ALA   A 1 52  ? 12.74300 27.66400 -4.53600  1.000 23.93708  ?  55  ALA   A N    1 
ATOM   480  C CA   . ALA   A 1 52  ? 12.46300 26.35100 -5.08900  1.000 22.96328  ?  55  ALA   A CA   1 
ATOM   481  C C    . ALA   A 1 52  ? 12.39600 25.31300 -3.97700  1.000 21.12885  ?  55  ALA   A C    1 
ATOM   482  O O    . ALA   A 1 52  ? 13.11300 25.39600 -2.97200  1.000 20.92093  ?  55  ALA   A O    1 
ATOM   483  C CB   . ALA   A 1 52  ? 13.53200 25.96600 -6.10300  1.000 23.42649  ?  55  ALA   A CB   1 
ATOM   484  H H    . ALA   A 1 52  ? 13.50900 27.99000 -4.75200  1.000 28.77000  ?  55  ALA   A H    1 
ATOM   485  H HA   . ALA   A 1 52  ? 11.60800 26.36400 -5.54600  1.000 27.60000  ?  55  ALA   A HA   1 
ATOM   486  H HB1  . ALA   A 1 52  ? 13.33200 25.08400 -6.45300  1.000 28.16000  ?  55  ALA   A HB1  1 
ATOM   487  H HB2  . ALA   A 1 52  ? 13.53200 26.61600 -6.82400  1.000 28.16000  ?  55  ALA   A HB2  1 
ATOM   488  H HB3  . ALA   A 1 52  ? 14.39700 25.96000 -5.66400  1.000 28.16000  ?  55  ALA   A HB3  1 
ATOM   489  N N    . THR   A 1 53  ? 11.52500 24.32200 -4.16900  1.000 20.43140  ?  56  THR   A N    1 
ATOM   490  C CA   . THR   A 1 53  ? 11.32400 23.29200 -3.16900  1.000 19.73395  ?  56  THR   A CA   1 
ATOM   491  C C    . THR   A 1 53  ? 11.32700 21.90200 -3.78900  1.000 18.64960  ?  56  THR   A C    1 
ATOM   492  O O    . THR   A 1 53  ? 11.07200 21.72000 -4.98400  1.000 18.85752  ?  56  THR   A O    1 
ATOM   493  C CB   . THR   A 1 53  ? 10.00500 23.51300 -2.40100  1.000 22.81326  ?  56  THR   A CB   1 
ATOM   494  O OG1  . THR   A 1 53  ? 8.92900  23.55000 -3.34200  1.000 23.52914  ?  56  THR   A OG1  1 
ATOM   495  C CG2  . THR   A 1 53  ? 10.06400 24.81200 -1.61100  1.000 23.69758  ?  56  THR   A CG2  1 
ATOM   496  H H    . THR   A 1 53  ? 11.04000 24.23100 -4.87400  1.000 24.57000  ?  56  THR   A H    1 
ATOM   497  H HA   . THR   A 1 53  ? 12.06900 23.32400 -2.54900  1.000 23.73000  ?  56  THR   A HA   1 
ATOM   498  H HB   . THR   A 1 53  ? 9.85400  22.79300 -1.76800  1.000 27.43000  ?  56  THR   A HB   1 
ATOM   499  H HG1  . THR   A 1 53  ? 8.19400  23.60000 -2.93700  1.000 28.28000  ?  56  THR   A HG1  1 
ATOM   500  H HG21 . THR   A 1 53  ? 9.24000  24.93500 -1.11300  1.000 28.49000  ?  56  THR   A HG21 1 
ATOM   501  H HG22 . THR   A 1 53  ? 10.80700 24.78900 -0.98900  1.000 28.49000  ?  56  THR   A HG22 1 
ATOM   502  H HG23 . THR   A 1 53  ? 10.18100 25.56200 -2.21400  1.000 28.49000  ?  56  THR   A HG23 1 
ATOM   503  N N    . VAL   A 1 54  ? 11.64100 20.92600 -2.94000  1.000 19.11019  ?  57  VAL   A N    1 
ATOM   504  C CA   . VAL   A 1 54  ? 11.41600 19.50600 -3.18400  1.000 17.92583  ?  57  VAL   A CA   1 
ATOM   505  C C    . VAL   A 1 54  ? 10.40400 19.04200 -2.14400  1.000 18.29167  ?  57  VAL   A C    1 
ATOM   506  O O    . VAL   A 1 54  ? 10.54000 19.35900 -0.95600  1.000 18.43116  ?  57  VAL   A O    1 
ATOM   507  C CB   . VAL   A 1 54  ? 12.74200 18.72600 -3.07500  1.000 18.88121  ?  57  VAL   A CB   1 
ATOM   508  C CG1  . VAL   A 1 54  ? 12.49400 17.25300 -3.04400  1.000 19.63920  ?  57  VAL   A CG1  1 
ATOM   509  C CG2  . VAL   A 1 54  ? 13.66100 19.10200 -4.23700  1.000 19.99450  ?  57  VAL   A CG2  1 
ATOM   510  H H    . VAL   A 1 54  ? 12.00600 21.07100 -2.17500  1.000 22.98000  ?  57  VAL   A H    1 
ATOM   511  H HA   . VAL   A 1 54  ? 11.04800 19.34900 -4.06800  1.000 21.56000  ?  57  VAL   A HA   1 
ATOM   512  H HB   . VAL   A 1 54  ? 13.18300 18.96300 -2.24400  1.000 22.71000  ?  57  VAL   A HB   1 
ATOM   513  H HG11 . VAL   A 1 54  ? 13.33400 16.78900 -3.18100  1.000 23.62000  ?  57  VAL   A HG11 1 
ATOM   514  H HG12 . VAL   A 1 54  ? 12.12100 17.01400 -2.18100  1.000 23.62000  ?  57  VAL   A HG12 1 
ATOM   515  H HG13 . VAL   A 1 54  ? 11.86900 17.02300 -3.74900  1.000 23.62000  ?  57  VAL   A HG13 1 
ATOM   516  H HG21 . VAL   A 1 54  ? 14.48900 18.60400 -4.15800  1.000 24.04000  ?  57  VAL   A HG21 1 
ATOM   517  H HG22 . VAL   A 1 54  ? 13.22000 18.88000 -5.07200  1.000 24.04000  ?  57  VAL   A HG22 1 
ATOM   518  H HG23 . VAL   A 1 54  ? 13.84200 20.05400 -4.20100  1.000 24.04000  ?  57  VAL   A HG23 1 
ATOM   519  N N    A SER   A 1 55  ? 9.42400  18.25200 -2.58200  0.750 17.99953  ?  59  SER   A N    1 
ATOM   520  N N    B SER   A 1 55  ? 9.35200  18.35700 -2.59100  0.250 18.00742  ?  59  SER   A N    1 
ATOM   521  C CA   A SER   A 1 55  ? 8.28300  17.92800 -1.74100  0.750 17.10731  ?  59  SER   A CA   1 
ATOM   522  C CA   B SER   A 1 55  ? 8.29600  17.93800 -1.67900  0.250 17.70739  ?  59  SER   A CA   1 
ATOM   523  C C    A SER   A 1 55  ? 7.79800  16.52900 -2.07800  0.750 16.23353  ?  59  SER   A C    1 
ATOM   524  C C    B SER   A 1 55  ? 7.79500  16.55500 -2.05900  0.250 17.11784  ?  59  SER   A C    1 
ATOM   525  O O    A SER   A 1 55  ? 7.44100  16.24800 -3.22800  0.750 17.31787  ?  59  SER   A O    1 
ATOM   526  O O    B SER   A 1 55  ? 7.42700  16.31400 -3.21300  0.250 17.66001  ?  59  SER   A O    1 
ATOM   527  C CB   A SER   A 1 55  ? 7.18400  18.95100 -1.99800  0.750 17.71265  ?  59  SER   A CB   1 
ATOM   528  C CB   B SER   A 1 55  ? 7.13500  18.94300 -1.65900  0.250 18.20481  ?  59  SER   A CB   1 
ATOM   529  O OG   A SER   A 1 55  ? 6.04800  18.66100 -1.21900  0.750 18.06269  ?  59  SER   A OG   1 
ATOM   530  O OG   B SER   A 1 55  ? 6.51000  19.06400 -2.92300  0.250 18.36273  ?  59  SER   A OG   1 
ATOM   531  H H    A SER   A 1 55  ? 9.40000  17.89300 -3.36300  0.750 21.65000  ?  59  SER   A H    1 
ATOM   532  H H    B SER   A 1 55  ? 9.23100  18.12700 -3.41100  0.250 21.66000  ?  59  SER   A H    1 
ATOM   533  H HA   A SER   A 1 55  ? 8.53500  17.93100 -0.80400  0.750 20.58000  ?  59  SER   A HA   1 
ATOM   534  H HA   B SER   A 1 55  ? 8.66500  17.88000 -0.78300  0.250 21.30000  ?  59  SER   A HA   1 
ATOM   535  H HB2  A SER   A 1 55  ? 7.51100  19.83400 -1.76300  0.750 21.30000  ?  59  SER   A HB2  1 
ATOM   536  H HB2  B SER   A 1 55  ? 6.47600  18.64200 -1.01400  0.250 21.90000  ?  59  SER   A HB2  1 
ATOM   537  H HB3  A SER   A 1 55  ? 6.94000  18.92600 -2.93600  0.750 21.30000  ?  59  SER   A HB3  1 
ATOM   538  H HB3  B SER   A 1 55  ? 7.48100  19.81100 -1.39900  0.250 21.90000  ?  59  SER   A HB3  1 
ATOM   539  H HG   A SER   A 1 55  ? 5.42500  19.19000 -1.41200  0.750 21.73000  ?  59  SER   A HG   1 
ATOM   540  H HG   B SER   A 1 55  ? 5.87100  19.60700 -2.87600  0.250 22.09000  ?  59  SER   A HG   1 
ATOM   541  N N    . TYR   A 1 56  ? 7.77400  15.66000 -1.07400  1.000 16.54935  ?  60  TYR   A N    1 
ATOM   542  C CA   . TYR   A 1 56  ? 7.30400  14.28900 -1.24400  1.000 15.85453  ?  60  TYR   A CA   1 
ATOM   543  C C    . TYR   A 1 56  ? 6.61900  13.87500 0.04900   1.000 16.15194  ?  60  TYR   A C    1 
ATOM   544  O O    . TYR   A 1 56  ? 7.24600  13.86800 1.10700   1.000 16.33091  ?  60  TYR   A O    1 
ATOM   545  C CB   . TYR   A 1 56  ? 8.47300  13.34100 -1.56800  1.000 16.88624  ?  60  TYR   A CB   1 
ATOM   546  C CG   . TYR   A 1 56  ? 7.99500  11.94300 -1.90100  1.000 17.32313  ?  60  TYR   A CG   1 
ATOM   547  C CD1  . TYR   A 1 56  ? 7.54300  11.62100 -3.17500  1.000 19.28389  ?  60  TYR   A CD1  1 
ATOM   548  C CD2  . TYR   A 1 56  ? 7.95500  10.95400 -0.92500  1.000 17.10731  ?  60  TYR   A CD2  1 
ATOM   549  C CE1  . TYR   A 1 56  ? 7.09200  10.36100 -3.47500  1.000 19.28915  ?  60  TYR   A CE1  1 
ATOM   550  C CE2  . TYR   A 1 56  ? 7.48600  9.68000  -1.21000  1.000 17.46788  ?  60  TYR   A CE2  1 
ATOM   551  C CZ   . TYR   A 1 56  ? 7.03700  9.39600  -2.48700  1.000 18.86542  ?  60  TYR   A CZ   1 
ATOM   552  O OH   . TYR   A 1 56  ? 6.55500  8.15200  -2.83500  1.000 21.53416  ?  60  TYR   A OH   1 
ATOM   553  H H    A TYR   A 1 56  ? 8.02800  15.84200 -0.27200  0.750 19.91000  ?  60  TYR   A H    1 
ATOM   554  H H    B TYR   A 1 56  ? 8.03600  15.82900 -0.27200  0.250 19.91000  ?  60  TYR   A H    1 
ATOM   555  H HA   . TYR   A 1 56  ? 6.66500  14.24100 -1.97300  1.000 19.08000  ?  60  TYR   A HA   1 
ATOM   556  H HB2  . TYR   A 1 56  ? 8.96100  13.68500 -2.33200  1.000 20.31000  ?  60  TYR   A HB2  1 
ATOM   557  H HB3  . TYR   A 1 56  ? 9.06100  13.28500 -0.79700  1.000 20.31000  ?  60  TYR   A HB3  1 
ATOM   558  H HD1  . TYR   A 1 56  ? 7.54700  12.27400 -3.83800  1.000 23.19000  ?  60  TYR   A HD1  1 
ATOM   559  H HD2  . TYR   A 1 56  ? 8.24900  11.15000 -0.06500  1.000 20.58000  ?  60  TYR   A HD2  1 
ATOM   560  H HE1  . TYR   A 1 56  ? 6.82400  10.15600 -4.34100  1.000 23.19000  ?  60  TYR   A HE1  1 
ATOM   561  H HE2  . TYR   A 1 56  ? 7.47300  9.02500  -0.55000  1.000 21.01000  ?  60  TYR   A HE2  1 
ATOM   562  H HH   . TYR   A 1 56  ? 6.54100  7.65000  -2.16100  1.000 25.89000  ?  60  TYR   A HH   1 
ATOM   563  N N    . ARG   A 1 57  ? 5.31300  13.58800 -0.02300  1.000 15.48344  ?  61  ARG   A N    1 
ATOM   564  C CA   . ARG   A 1 57  ? 4.52900  13.32500 1.17900   1.000 15.05444  ?  61  ARG   A CA   1 
ATOM   565  C C    . ARG   A 1 57  ? 4.67600  14.45200 2.20200   1.000 15.28868  ?  61  ARG   A C    1 
ATOM   566  O O    . ARG   A 1 57  ? 4.59200  14.22700 3.41300   1.000 15.39132  ?  61  ARG   A O    1 
ATOM   567  C CB   . ARG   A 1 57  ? 4.83100  11.96300 1.79000   1.000 15.67820  ?  61  ARG   A CB   1 
ATOM   568  C CG   . ARG   A 1 57  ? 4.57900  10.76400 0.92000   1.000 16.56251  ?  61  ARG   A CG   1 
ATOM   569  C CD   . ARG   A 1 57  ? 4.65400  9.50400  1.74700   1.000 16.80201  ?  61  ARG   A CD   1 
ATOM   570  N NE   . ARG   A 1 57  ? 4.58900  8.29800  0.94100   1.000 17.23365  ?  61  ARG   A NE   1 
ATOM   571  C CZ   . ARG   A 1 57  ? 3.47400  7.79200  0.43700   1.000 19.03649  ?  61  ARG   A CZ   1 
ATOM   572  N NH1  . ARG   A 1 57  ? 2.29400  8.33200  0.70300   1.000 19.36285  ?  61  ARG   A NH1  1 
ATOM   573  N NH2  . ARG   A 1 57  ? 3.54500  6.72200  -0.35100  1.000 20.45772  ?  61  ARG   A NH2  1 
ATOM   574  H H    . ARG   A 1 57  ? 4.86500  13.54100 -0.75600  1.000 18.63000  ?  61  ARG   A H    1 
ATOM   575  H HA   . ARG   A 1 57  ? 3.59500  13.30000 0.91900   1.000 18.12000  ?  61  ARG   A HA   1 
ATOM   576  H HB2  . ARG   A 1 57  ? 5.77000  11.94400 2.03300   1.000 18.87000  ?  61  ARG   A HB2  1 
ATOM   577  H HB3  . ARG   A 1 57  ? 4.28100  11.85900 2.58200   1.000 18.87000  ?  61  ARG   A HB3  1 
ATOM   578  H HG2  . ARG   A 1 57  ? 3.69400  10.82500 0.52700   1.000 19.92000  ?  61  ARG   A HG2  1 
ATOM   579  H HG3  . ARG   A 1 57  ? 5.25100  10.71900 0.22200   1.000 19.92000  ?  61  ARG   A HG3  1 
ATOM   580  H HD2  . ARG   A 1 57  ? 5.49400  9.49500  2.23300   1.000 20.22000  ?  61  ARG   A HD2  1 
ATOM   581  H HD3  . ARG   A 1 57  ? 3.91000  9.48900  2.36900   1.000 20.22000  ?  61  ARG   A HD3  1 
ATOM   582  H HE   . ARG   A 1 57  ? 5.32500  7.88400  0.78100   1.000 20.73000  ?  61  ARG   A HE   1 
ATOM   583  H HH11 . ARG   A 1 57  ? 2.24200  9.02300  1.21200   1.000 23.28000  ?  61  ARG   A HH11 1 
ATOM   584  H HH12 . ARG   A 1 57  ? 1.58000  7.99000  0.36700   1.000 23.28000  ?  61  ARG   A HH12 1 
ATOM   585  H HH21 . ARG   A 1 57  ? 4.30900  6.36800  -0.52700  1.000 24.60000  ?  61  ARG   A HH21 1 
ATOM   586  H HH22 . ARG   A 1 57  ? 2.82800  6.38500  -0.68400  1.000 24.60000  ?  61  ARG   A HH22 1 
ATOM   587  N N    . ALA   A 1 58  ? 4.83900  15.68700 1.71800   1.000 15.42817  ?  62  ALA   A N    1 
ATOM   588  C CA   . ALA   A 1 58  ? 5.29400  16.75600 2.60900   1.000 15.97823  ?  62  ALA   A CA   1 
ATOM   589  C C    . ALA   A 1 58  ? 4.23400  17.23000 3.58700   1.000 16.52303  ?  62  ALA   A C    1 
ATOM   590  O O    . ALA   A 1 58  ? 4.57200  17.87200 4.58200   1.000 15.35184  ?  62  ALA   A O    1 
ATOM   591  C CB   . ALA   A 1 58  ? 5.80400  17.95700 1.82300   1.000 16.69937  ?  62  ALA   A CB   1 
ATOM   592  H H    . ALA   A 1 58  ? 4.69800  15.92400 0.90300   1.000 18.56000  ?  62  ALA   A H    1 
ATOM   593  H HA   . ALA   A 1 58  ? 6.03200  16.38800 3.11900   1.000 19.22000  ?  62  ALA   A HA   1 
ATOM   594  H HB1  . ALA   A 1 58  ? 6.13200  18.62500 2.44500   1.000 20.09000  ?  62  ALA   A HB1  1 
ATOM   595  H HB2  . ALA   A 1 58  ? 6.52200  17.67000 1.23700   1.000 20.09000  ?  62  ALA   A HB2  1 
ATOM   596  H HB3  . ALA   A 1 58  ? 5.07500  18.32400 1.29800   1.000 20.09000  ?  62  ALA   A HB3  1 
ATOM   597  N N    . GLU   A 1 59  ? 2.95900  17.00100 3.28600   1.000 15.11234  ?  63  GLU   A N    1 
ATOM   598  C CA   . GLU   A 1 59  ? 1.88400  17.44500 4.14800   1.000 15.74399  ?  63  GLU   A CA   1 
ATOM   599  C C    . GLU   A 1 59  ? 1.26900  16.30600 4.94300   1.000 16.14667  ?  63  GLU   A C    1 
ATOM   600  O O    . GLU   A 1 59  ? 0.25600  16.52000 5.62700   1.000 18.55749  ?  63  GLU   A O    1 
ATOM   601  C CB   . GLU   A 1 59  ? 0.82200  18.17600 3.31900   1.000 16.55988  ?  63  GLU   A CB   1 
ATOM   602  C CG   . GLU   A 1 59  ? 1.32500  19.45800 2.67200   1.000 17.32839  ?  63  GLU   A CG   1 
ATOM   603  C CD   . GLU   A 1 59  ? 1.98500  19.24200 1.33600   1.000 18.34694  ?  63  GLU   A CD   1 
ATOM   604  O OE1  . GLU   A 1 59  ? 1.74700  18.18000 0.73200   1.000 18.02321  ?  63  GLU   A OE1  1 
ATOM   605  O OE2  . GLU   A 1 59  ? 2.73400  20.14400 0.89300   1.000 18.53380  -1 63  GLU   A OE2  1 
ATOM   606  H H    . GLU   A 1 59  ? 2.69600  16.58600 2.58100   1.000 18.18000  ?  63  GLU   A H    1 
ATOM   607  H HA   . GLU   A 1 59  ? 2.23300  18.08200 4.79100   1.000 18.94000  ?  63  GLU   A HA   1 
ATOM   608  H HB2  . GLU   A 1 59  ? 0.51900  17.58700 2.61100   1.000 19.92000  ?  63  GLU   A HB2  1 
ATOM   609  H HB3  . GLU   A 1 59  ? 0.08000  18.40900 3.89900   1.000 19.92000  ?  63  GLU   A HB3  1 
ATOM   610  H HG2  . GLU   A 1 59  ? 0.57300  20.05600 2.53800   1.000 20.85000  ?  63  GLU   A HG2  1 
ATOM   611  H HG3  . GLU   A 1 59  ? 1.97700  19.87000 3.26100   1.000 20.85000  ?  63  GLU   A HG3  1 
ATOM   612  N N    . GLU   A 1 60  ? 1.82800  15.10200 4.86300   1.000 15.20182  ?  64  GLU   A N    1 
ATOM   613  C CA   . GLU   A 1 60  ? 1.39700  14.02200 5.73800   1.000 15.18866  ?  64  GLU   A CA   1 
ATOM   614  C C    . GLU   A 1 60  ? 1.97400  14.20200 7.13500   1.000 15.46238  ?  64  GLU   A C    1 
ATOM   615  O O    . GLU   A 1 60  ? 3.04200  14.79200 7.31600   1.000 15.95981  ?  64  GLU   A O    1 
ATOM   616  C CB   . GLU   A 1 60  ? 1.86200  12.66700 5.21300   1.000 16.43618  ?  64  GLU   A CB   1 
ATOM   617  C CG   . GLU   A 1 60  ? 1.28500  12.26900 3.87800   1.000 17.16522  ?  64  GLU   A CG   1 
ATOM   618  C CD   . GLU   A 1 60  ? 1.63900  10.86300 3.46000   1.000 17.13627  ?  64  GLU   A CD   1 
ATOM   619  O OE1  . GLU   A 1 60  ? 1.97000  10.01900 4.32300   1.000 19.99450  ?  64  GLU   A OE1  1 
ATOM   620  O OE2  . GLU   A 1 60  ? 1.62900  10.59100 2.25300   1.000 17.38893  -1 64  GLU   A OE2  1 
ATOM   621  H H    . GLU   A 1 60  ? 2.45500  14.88800 4.31400   1.000 18.29000  ?  64  GLU   A H    1 
ATOM   622  H HA   . GLU   A 1 60  ? 0.42800  14.03100 5.77700   1.000 18.28000  ?  64  GLU   A HA   1 
ATOM   623  H HB2  . GLU   A 1 60  ? 2.82700  12.69000 5.11800   1.000 19.77000  ?  64  GLU   A HB2  1 
ATOM   624  H HB3  . GLU   A 1 60  ? 1.60800  11.98600 5.85500   1.000 19.77000  ?  64  GLU   A HB3  1 
ATOM   625  H HG2  . GLU   A 1 60  ? 0.31800  12.33000 3.92400   1.000 20.65000  ?  64  GLU   A HG2  1 
ATOM   626  H HG3  . GLU   A 1 60  ? 1.62300  12.87300 3.19800   1.000 20.65000  ?  64  GLU   A HG3  1 
ATOM   627  N N    . ARG   A 1 61  ? 1.26200  13.67800 8.12800   1.000 15.21235  ?  65  ARG   A N    1 
ATOM   628  C CA   . ARG   A 1 61  ? 1.74800  13.71900 9.49300   1.000 14.69913  ?  65  ARG   A CA   1 
ATOM   629  C C    . ARG   A 1 61  ? 2.70000  12.56600 9.76700   1.000 14.82283  ?  65  ARG   A C    1 
ATOM   630  O O    . ARG   A 1 61  ? 2.47900  11.42700 9.33700   1.000 14.30435  ?  65  ARG   A O    1 
ATOM   631  C CB   . ARG   A 1 61  ? 0.58500  13.68600 10.47700  1.000 16.13351  ?  65  ARG   A CB   1 
ATOM   632  C CG   . ARG   A 1 61  ? -0.17000 14.97500 10.53200  1.000 16.50198  ?  65  ARG   A CG   1 
ATOM   633  C CD   . ARG   A 1 61  ? -1.29000 14.96900 11.57000  1.000 17.15206  ?  65  ARG   A CD   1 
ATOM   634  N NE   . ARG   A 1 61  ? -1.87200 16.29700 11.70200  1.000 17.49683  ?  65  ARG   A NE   1 
ATOM   635  C CZ   . ARG   A 1 61  ? -1.31000 17.31800 12.33300  1.000 17.01257  ?  65  ARG   A CZ   1 
ATOM   636  N NH1  . ARG   A 1 61  ? -0.17500 17.17700 13.01400  1.000 16.23353  ?  65  ARG   A NH1  1 
ATOM   637  N NH2  . ARG   A 1 61  ? -1.88800 18.51300 12.26400  1.000 18.02848  ?  65  ARG   A NH2  1 
ATOM   638  H H    . ARG   A 1 61  ? 0.49700  13.29600 8.03300   1.000 18.31000  ?  65  ARG   A H    1 
ATOM   639  H HA   . ARG   A 1 61  ? 2.23700  14.54500 9.63000   1.000 17.69000  ?  65  ARG   A HA   1 
ATOM   640  H HB2  . ARG   A 1 61  ? -0.03400 12.98900 10.20900  1.000 19.41000  ?  65  ARG   A HB2  1 
ATOM   641  H HB3  . ARG   A 1 61  ? 0.92800  13.50200 11.36500  1.000 19.41000  ?  65  ARG   A HB3  1 
ATOM   642  H HG2  . ARG   A 1 61  ? 0.44500  15.69000 10.76100  1.000 19.85000  ?  65  ARG   A HG2  1 
ATOM   643  H HG3  . ARG   A 1 61  ? -0.56800 15.14400 9.66400   1.000 19.85000  ?  65  ARG   A HG3  1 
ATOM   644  H HD2  . ARG   A 1 61  ? -1.98600 14.35200 11.29300  1.000 20.63000  ?  65  ARG   A HD2  1 
ATOM   645  H HD3  . ARG   A 1 61  ? -0.93300 14.70100 12.43100  1.000 20.63000  ?  65  ARG   A HD3  1 
ATOM   646  H HE   . ARG   A 1 61  ? -2.64200 16.43000 11.34200  1.000 21.05000  ?  65  ARG   A HE   1 
ATOM   647  H HH11 . ARG   A 1 61  ? 0.21100  16.40900 13.05200  1.000 19.53000  ?  65  ARG   A HH11 1 
ATOM   648  H HH12 . ARG   A 1 61  ? 0.17200  17.85300 13.41600  1.000 19.53000  ?  65  ARG   A HH12 1 
ATOM   649  H HH21 . ARG   A 1 61  ? -2.61400 18.61400 11.81500  1.000 21.69000  ?  65  ARG   A HH21 1 
ATOM   650  H HH22 . ARG   A 1 61  ? -1.53500 19.18500 12.66800  1.000 21.69000  ?  65  ARG   A HH22 1 
ATOM   651  N N    . PHE   A 1 62  ? 3.76800  12.87500 10.50400  1.000 13.74375  ?  66  PHE   A N    1 
ATOM   652  C CA   . PHE   A 1 62  ? 4.69900  11.87800 10.99700  1.000 13.97010  ?  66  PHE   A CA   1 
ATOM   653  C C    . PHE   A 1 62  ? 4.98100  12.18800 12.45900  1.000 13.78586  ?  66  PHE   A C    1 
ATOM   654  O O    . PHE   A 1 62  ? 4.97300  13.35500 12.84200  1.000 14.02010  ?  66  PHE   A O    1 
ATOM   655  C CB   . PHE   A 1 62  ? 6.03200  11.94000 10.23300  1.000 13.97010  ?  66  PHE   A CB   1 
ATOM   656  C CG   . PHE   A 1 62  ? 5.97200  11.50000 8.78400   1.000 14.34646  ?  66  PHE   A CG   1 
ATOM   657  C CD1  . PHE   A 1 62  ? 5.48000  12.34500 7.81100   1.000 14.63597  ?  66  PHE   A CD1  1 
ATOM   658  C CD2  . PHE   A 1 62  ? 6.45300  10.26500 8.39700   1.000 14.35172  ?  66  PHE   A CD2  1 
ATOM   659  C CE1  . PHE   A 1 62  ? 5.45300  11.96000 6.48000   1.000 15.27815  ?  66  PHE   A CE1  1 
ATOM   660  C CE2  . PHE   A 1 62  ? 6.44400  9.87500  7.06600   1.000 14.97285  ?  66  PHE   A CE2  1 
ATOM   661  C CZ   . PHE   A 1 62  ? 5.91900  10.72000 6.11300   1.000 15.04917  ?  66  PHE   A CZ   1 
ATOM   662  H H    . PHE   A 1 62  ? 3.97400  13.67800 10.73300  1.000 16.54000  ?  66  PHE   A H    1 
ATOM   663  H HA   . PHE   A 1 62  ? 4.32600  10.98800 10.89900  1.000 16.81000  ?  66  PHE   A HA   1 
ATOM   664  H HB2  . PHE   A 1 62  ? 6.34800  12.85700 10.24400  1.000 16.81000  ?  66  PHE   A HB2  1 
ATOM   665  H HB3  . PHE   A 1 62  ? 6.67000  11.36500 10.68400  1.000 16.81000  ?  66  PHE   A HB3  1 
ATOM   666  H HD1  . PHE   A 1 62  ? 5.16100  13.18400 8.05300   1.000 17.61000  ?  66  PHE   A HD1  1 
ATOM   667  H HD2  . PHE   A 1 62  ? 6.79000  9.68400  9.04100   1.000 17.27000  ?  66  PHE   A HD2  1 
ATOM   668  H HE1  . PHE   A 1 62  ? 5.12100  12.54200 5.83500   1.000 18.38000  ?  66  PHE   A HE1  1 
ATOM   669  H HE2  . PHE   A 1 62  ? 6.79000  9.04800  6.81900   1.000 18.02000  ?  66  PHE   A HE2  1 
ATOM   670  H HZ   . PHE   A 1 62  ? 5.87900  10.45200 5.22400   1.000 18.11000  ?  66  PHE   A HZ   1 
ATOM   671  N N    . PRO   A 1 63  ? 5.22500  11.17500 13.29300  1.000 13.88588  ?  67  PRO   A N    1 
ATOM   672  C CA   . PRO   A 1 63  ? 5.59900  11.45500 14.68400  1.000 14.07537  ?  67  PRO   A CA   1 
ATOM   673  C C    . PRO   A 1 63  ? 6.87200  12.27800 14.77300  1.000 14.34646  ?  67  PRO   A C    1 
ATOM   674  O O    . PRO   A 1 63  ? 7.83500  12.04700 14.03600  1.000 14.17275  ?  67  PRO   A O    1 
ATOM   675  C CB   . PRO   A 1 63  ? 5.78500  10.05900 15.29600  1.000 14.11485  ?  67  PRO   A CB   1 
ATOM   676  C CG   . PRO   A 1 63  ? 4.91500  9.14900  14.42700  1.000 14.62544  ?  67  PRO   A CG   1 
ATOM   677  C CD   . PRO   A 1 63  ? 5.10300  9.73400  13.05400  1.000 14.03326  ?  67  PRO   A CD   1 
ATOM   678  H HA   . PRO   A 1 63  ? 4.88100  11.92100 15.13900  1.000 16.94000  ?  67  PRO   A HA   1 
ATOM   679  H HB2  . PRO   A 1 63  ? 6.71800  9.79800  15.25200  1.000 16.98000  ?  67  PRO   A HB2  1 
ATOM   680  H HB3  . PRO   A 1 63  ? 5.48300  10.05600 16.21700  1.000 16.98000  ?  67  PRO   A HB3  1 
ATOM   681  H HG2  . PRO   A 1 63  ? 5.23200  8.23300  14.47000  1.000 17.60000  ?  67  PRO   A HG2  1 
ATOM   682  H HG3  . PRO   A 1 63  ? 3.98800  9.19300  14.70900  1.000 17.60000  ?  67  PRO   A HG3  1 
ATOM   683  H HD2  . PRO   A 1 63  ? 5.90900  9.38700  12.64100  1.000 16.89000  ?  67  PRO   A HD2  1 
ATOM   684  H HD3  . PRO   A 1 63  ? 4.33400  9.54400  12.49300  1.000 16.89000  ?  67  PRO   A HD3  1 
ATOM   685  N N    . LEU   A 1 64  ? 6.86200  13.22300 15.71000  1.000 13.99115  ?  68  LEU   A N    1 
ATOM   686  C CA   . LEU   A 1 64  ? 8.03100  14.05900 15.98000  1.000 14.17012  ?  68  LEU   A CA   1 
ATOM   687  C C    . LEU   A 1 64  ? 9.13800  13.27000 16.67100  1.000 13.80429  ?  68  LEU   A C    1 
ATOM   688  O O    . LEU   A 1 64  ? 10.33600 13.46700 16.38200  1.000 13.99115  ?  68  LEU   A O    1 
ATOM   689  C CB   . LEU   A 1 64  ? 7.61000  15.22600 16.86600  1.000 14.45963  ?  68  LEU   A CB   1 
ATOM   690  C CG   . LEU   A 1 64  ? 6.71300  16.25700 16.18700  1.000 15.73610  ?  68  LEU   A CG   1 
ATOM   691  C CD1  . LEU   A 1 64  ? 5.88800  17.10200 17.14700  1.000 16.46776  ?  68  LEU   A CD1  1 
ATOM   692  C CD2  . LEU   A 1 64  ? 7.58200  17.14400 15.27500  1.000 17.17048  ?  68  LEU   A CD2  1 
ATOM   693  H H    . LEU   A 1 64  ? 6.18600  13.40400 16.21000  1.000 16.84000  ?  68  LEU   A H    1 
ATOM   694  H HA   . LEU   A 1 64  ? 8.37900  14.39500 15.13900  1.000 17.05000  ?  68  LEU   A HA   1 
ATOM   695  H HB2  . LEU   A 1 64  ? 7.12400  14.87300 17.62800  1.000 17.40000  ?  68  LEU   A HB2  1 
ATOM   696  H HB3  . LEU   A 1 64  ? 8.40900  15.68700 17.16700  1.000 17.40000  ?  68  LEU   A HB3  1 
ATOM   697  H HG   . LEU   A 1 64  ? 6.05300  15.77600 15.66400  1.000 18.93000  ?  68  LEU   A HG   1 
ATOM   698  H HD11 . LEU   A 1 64  ? 5.31900  17.69700 16.63400  1.000 19.81000  ?  68  LEU   A HD11 1 
ATOM   699  H HD12 . LEU   A 1 64  ? 5.34400  16.51600 17.69600  1.000 19.81000  ?  68  LEU   A HD12 1 
ATOM   700  H HD13 . LEU   A 1 64  ? 6.48700  17.61900 17.70800  1.000 19.81000  ?  68  LEU   A HD13 1 
ATOM   701  H HD21 . LEU   A 1 64  ? 7.02500  17.83600 14.88500  1.000 20.65000  ?  68  LEU   A HD21 1 
ATOM   702  H HD22 . LEU   A 1 64  ? 8.28700  17.54700 15.80500  1.000 20.65000  ?  68  LEU   A HD22 1 
ATOM   703  H HD23 . LEU   A 1 64  ? 7.96700  16.59400 14.57500  1.000 20.65000  ?  68  LEU   A HD23 1 
ATOM   704  N N    . CYS   A 1 65  ? 8.77200  12.36800 17.57700  1.000 14.08064  ?  69  CYS   A N    1 
ATOM   705  C CA   . CYS   A 1 65  ? 9.76300  11.70000 18.42200  1.000 14.15170  ?  69  CYS   A CA   1 
ATOM   706  C C    . CYS   A 1 65  ? 10.62400 12.78800 19.05400  1.000 13.95957  ?  69  CYS   A C    1 
ATOM   707  O O    . CYS   A 1 65  ? 10.12200 13.86400 19.39500  1.000 14.85178  ?  69  CYS   A O    1 
ATOM   708  C CB   . CYS   A 1 65  ? 10.58500 10.68600 17.60900  1.000 15.33868  ?  69  CYS   A CB   1 
ATOM   709  S SG   . CYS   A 1 65  ? 9.63700  9.65000  16.44300  1.000 15.39921  ?  69  CYS   A SG   1 
ATOM   710  H H    . CYS   A 1 65  ? 7.96000  12.12500 17.72300  1.000 16.95000  ?  69  CYS   A H    1 
ATOM   711  H HA   . CYS   A 1 65  ? 9.34800  11.17600 19.12500  1.000 17.03000  ?  69  CYS   A HA   1 
ATOM   712  H HB2  . CYS   A 1 65  ? 11.24300 11.17400 17.09000  1.000 18.46000  ?  69  CYS   A HB2  1 
ATOM   713  H HB3  . CYS   A 1 65  ? 11.03000 10.08700 18.23000  1.000 18.46000  ?  69  CYS   A HB3  1 
ATOM   714  N N    . SER   A 1 66  ? 11.93300 12.54600 19.19800  1.000 13.89114  ?  70  SER   A N    1 
ATOM   715  C CA   . SER   A 1 66  ? 12.79100 13.51500 19.87000  1.000 15.09655  ?  70  SER   A CA   1 
ATOM   716  C C    . SER   A 1 66  ? 12.90600 14.84100 19.11900  1.000 14.51753  ?  70  SER   A C    1 
ATOM   717  O O    . SER   A 1 66  ? 13.44000 15.81100 19.67100  1.000 15.49923  ?  70  SER   A O    1 
ATOM   718  C CB   . SER   A 1 66  ? 14.23100 12.99200 20.02600  1.000 14.81230  ?  70  SER   A CB   1 
ATOM   719  O OG   . SER   A 1 66  ? 14.38900 12.04100 21.03500  1.000 15.38079  ?  70  SER   A OG   1 
ATOM   720  H H    . SER   A 1 66  ? 12.33700 11.84000 18.91900  1.000 16.72000  ?  70  SER   A H    1 
ATOM   721  H HA   . SER   A 1 66  ? 12.39200 13.65100 20.74400  1.000 18.17000  ?  70  SER   A HA   1 
ATOM   722  H HB2  . SER   A 1 66  ? 14.49900 12.58900 19.18600  1.000 17.82000  ?  70  SER   A HB2  1 
ATOM   723  H HB3  . SER   A 1 66  ? 14.80600 13.74700 20.23000  1.000 17.82000  ?  70  SER   A HB3  1 
ATOM   724  N N    . SER   A 1 67  ? 12.49500 14.89200 17.84800  1.000 15.21235  ?  71  SER   A N    1 
ATOM   725  C CA   . SER   A 1 67  ? 12.74400 16.10000 17.07100  1.000 14.37804  ?  71  SER   A CA   1 
ATOM   726  C C    . SER   A 1 67  ? 11.99300 17.30900 17.61800  1.000 14.04379  ?  71  SER   A C    1 
ATOM   727  O O    . SER   A 1 67  ? 12.35400 18.43700 17.30200  1.000 14.03589  ?  71  SER   A O    1 
ATOM   728  C CB   . SER   A 1 67  ? 12.48300 15.89100 15.57100  1.000 14.62017  ?  71  SER   A CB   1 
ATOM   729  O OG   . SER   A 1 67  ? 11.08900 15.89100 15.27500  1.000 14.03589  ?  71  SER   A OG   1 
ATOM   730  H H    . SER   A 1 67  ? 12.08500 14.26200 17.43100  1.000 18.30000  ?  71  SER   A H    1 
ATOM   731  H HA   . SER   A 1 67  ? 13.69100 16.30200 17.13200  1.000 17.31000  ?  71  SER   A HA   1 
ATOM   732  H HB2  . SER   A 1 67  ? 12.90800 16.60900 15.07700  1.000 17.59000  ?  71  SER   A HB2  1 
ATOM   733  H HB3  . SER   A 1 67  ? 12.85900 15.03700 15.30500  1.000 17.59000  ?  71  SER   A HB3  1 
ATOM   734  H HG   . SER   A 1 67  ? 10.71300 15.24800 15.66300  1.000 16.90000  ?  71  SER   A HG   1 
ATOM   735  N N    . PHE   A 1 68  ? 10.94600 17.11900 18.43800  1.000 14.24908  ?  72  PHE   A N    1 
ATOM   736  C CA   . PHE   A 1 68  ? 10.29400 18.28800 19.02700  1.000 14.65965  ?  72  PHE   A CA   1 
ATOM   737  C C    . PHE   A 1 68  ? 11.23800 19.10200 19.89800  1.000 14.36751  ?  72  PHE   A C    1 
ATOM   738  O O    . PHE   A 1 68  ? 10.97600 20.27900 20.14500  1.000 14.32277  ?  72  PHE   A O    1 
ATOM   739  C CB   . PHE   A 1 68  ? 9.05200  17.90000 19.85400  1.000 15.46501  ?  72  PHE   A CB   1 
ATOM   740  C CG   . PHE   A 1 68  ? 9.36100  17.48100 21.27800  1.000 15.36763  ?  72  PHE   A CG   1 
ATOM   741  C CD1  . PHE   A 1 68  ? 9.69200  16.18000 21.58600  1.000 15.40448  ?  72  PHE   A CD1  1 
ATOM   742  C CD2  . PHE   A 1 68  ? 9.29900  18.41100 22.30500  1.000 16.06772  ?  72  PHE   A CD2  1 
ATOM   743  C CE1  . PHE   A 1 68  ? 9.96500  15.82100 22.89300  1.000 15.91507  ?  72  PHE   A CE1  1 
ATOM   744  C CE2  . PHE   A 1 68  ? 9.59500  18.05300 23.60900  1.000 16.68621  ?  72  PHE   A CE2  1 
ATOM   745  C CZ   . PHE   A 1 68  ? 9.92400  16.75700 23.90000  1.000 16.36249  ?  72  PHE   A CZ   1 
ATOM   746  H H    . PHE   A 1 68  ? 10.61300 16.35700 18.65700  1.000 17.15000  ?  72  PHE   A H    1 
ATOM   747  H HA   . PHE   A 1 68  ? 9.98900  18.84100 18.29100  1.000 17.64000  ?  72  PHE   A HA   1 
ATOM   748  H HB2  . PHE   A 1 68  ? 8.45500  18.66400 19.89400  1.000 18.61000  ?  72  PHE   A HB2  1 
ATOM   749  H HB3  . PHE   A 1 68  ? 8.60900  17.15600 19.41800  1.000 18.61000  ?  72  PHE   A HB3  1 
ATOM   750  H HD1  . PHE   A 1 68  ? 9.73300  15.54100 20.91200  1.000 18.53000  ?  72  PHE   A HD1  1 
ATOM   751  H HD2  . PHE   A 1 68  ? 9.05400  19.28800 22.11500  1.000 19.33000  ?  72  PHE   A HD2  1 
ATOM   752  H HE1  . PHE   A 1 68  ? 10.17700 14.93800 23.09300  1.000 19.15000  ?  72  PHE   A HE1  1 
ATOM   753  H HE2  . PHE   A 1 68  ? 9.57000  18.69100 24.28400  1.000 20.07000  ?  72  PHE   A HE2  1 
ATOM   754  H HZ   . PHE   A 1 68  ? 10.12000 16.51100 24.77500  1.000 19.69000  ?  72  PHE   A HZ   1 
ATOM   755  N N    . LYS   A 1 69  ? 12.35800 18.51100 20.34100  1.000 15.52818  ?  73  LYS   A N    1 
ATOM   756  C CA   . LYS   A 1 69  ? 13.22900 19.16800 21.30500  1.000 15.63872  ?  73  LYS   A CA   1 
ATOM   757  C C    . LYS   A 1 69  ? 13.93400 20.37200 20.70500  1.000 15.37553  ?  73  LYS   A C    1 
ATOM   758  O O    . LYS   A 1 69  ? 14.28400 21.30100 21.43100  1.000 15.43606  ?  73  LYS   A O    1 
ATOM   759  C CB   . LYS   A 1 69  ? 14.24400 18.16200 21.86200  1.000 16.03087  ?  73  LYS   A CB   1 
ATOM   760  C CG   . LYS   A 1 69  ? 13.64100 17.07200 22.71400  1.000 15.82295  ?  73  LYS   A CG   1 
ATOM   761  C CD   . LYS   A 1 69  ? 14.58900 15.91900 22.95300  1.000 17.11521  ?  73  LYS   A CD   1 
ATOM   762  C CE   . LYS   A 1 69  ? 13.90700 14.78100 23.69000  1.000 17.40209  ?  73  LYS   A CE   1 
ATOM   763  N NZ   . LYS   A 1 69  ? 14.56500 13.44900 23.60600  1.000 18.36536  ?  73  LYS   A NZ   1 
ATOM   764  H H    . LYS   A 1 69  ? 12.63000 17.73200 20.09600  1.000 18.69000  ?  73  LYS   A H    1 
ATOM   765  H HA   . LYS   A 1 69  ? 12.69100 19.48900 22.04500  1.000 18.82000  ?  73  LYS   A HA   1 
ATOM   766  H HB2  . LYS   A 1 69  ? 14.69700 17.73600 21.11800  1.000 19.29000  ?  73  LYS   A HB2  1 
ATOM   767  H HB3  . LYS   A 1 69  ? 14.88400 18.64200 22.41100  1.000 19.29000  ?  73  LYS   A HB3  1 
ATOM   768  H HG2  . LYS   A 1 69  ? 13.39800 17.44300 23.57600  1.000 19.04000  ?  73  LYS   A HG2  1 
ATOM   769  H HG3  . LYS   A 1 69  ? 12.85300 16.72400 22.26900  1.000 19.04000  ?  73  LYS   A HG3  1 
ATOM   770  H HD2  . LYS   A 1 69  ? 14.90700 15.58200 22.10100  1.000 20.59000  ?  73  LYS   A HD2  1 
ATOM   771  H HD3  . LYS   A 1 69  ? 15.33700 16.22400 23.48900  1.000 20.59000  ?  73  LYS   A HD3  1 
ATOM   772  H HE2  . LYS   A 1 69  ? 13.85900 15.01500 24.63000  1.000 20.93000  ?  73  LYS   A HE2  1 
ATOM   773  H HE3  . LYS   A 1 69  ? 13.01300 14.67900 23.32800  1.000 20.93000  ?  73  LYS   A HE3  1 
ATOM   774  H HZ1  . LYS   A 1 69  ? 14.11400 12.85500 24.09100  1.000 22.09000  ?  73  LYS   A HZ1  1 
ATOM   775  H HZ2  . LYS   A 1 69  ? 14.58800 13.17400 22.76000  1.000 22.09000  ?  73  LYS   A HZ2  1 
ATOM   776  H HZ3  . LYS   A 1 69  ? 15.39800 13.50200 23.91500  1.000 22.09000  ?  73  LYS   A HZ3  1 
ATOM   777  N N    . GLY   A 1 70  ? 14.14500 20.39900 19.39100  1.000 15.60713  ?  74  GLY   A N    1 
ATOM   778  C CA   . GLY   A 1 70  ? 14.65000 21.62000 18.79000  1.000 15.70715  ?  74  GLY   A CA   1 
ATOM   779  C C    . GLY   A 1 70  ? 13.68000 22.77800 18.95800  1.000 15.09128  ?  74  GLY   A C    1 
ATOM   780  O O    . GLY   A 1 70  ? 14.05100 23.86600 19.40200  1.000 15.40974  ?  74  GLY   A O    1 
ATOM   781  H H    . GLY   A 1 70  ? 14.00900 19.74600 18.84800  1.000 18.78000  ?  74  GLY   A H    1 
ATOM   782  H HA2  . GLY   A 1 70  ? 15.49200 21.86200 19.20800  1.000 18.90000  ?  74  GLY   A HA2  1 
ATOM   783  H HA3  . GLY   A 1 70  ? 14.79800 21.47700 17.84300  1.000 18.90000  ?  74  GLY   A HA3  1 
ATOM   784  N N    . PHE   A 1 71  ? 12.40400 22.55200 18.62300  1.000 15.48607  ?  75  PHE   A N    1 
ATOM   785  C CA   . PHE   A 1 71  ? 11.40400 23.60400 18.77300  1.000 15.25709  ?  75  PHE   A CA   1 
ATOM   786  C C    . PHE   A 1 71  ? 11.21100 23.97100 20.24000  1.000 14.89389  ?  75  PHE   A C    1 
ATOM   787  O O    . PHE   A 1 71  ? 10.97800 25.13700 20.56400  1.000 16.14667  ?  75  PHE   A O    1 
ATOM   788  C CB   . PHE   A 1 71  ? 10.10200 23.15100 18.10100  1.000 15.41764  ?  75  PHE   A CB   1 
ATOM   789  C CG   . PHE   A 1 71  ? 10.27000 22.94800 16.61600  1.000 14.88336  ?  75  PHE   A CG   1 
ATOM   790  C CD1  . PHE   A 1 71  ? 10.63300 24.01300 15.80700  1.000 15.25972  ?  75  PHE   A CD1  1 
ATOM   791  C CD2  . PHE   A 1 71  ? 10.10800 21.70500 16.04000  1.000 15.28868  ?  75  PHE   A CD2  1 
ATOM   792  C CE1  . PHE   A 1 71  ? 10.80700 23.84600 14.44200  1.000 15.55186  ?  75  PHE   A CE1  1 
ATOM   793  C CE2  . PHE   A 1 71  ? 10.29700 21.52300 14.67200  1.000 15.19393  ?  75  PHE   A CE2  1 
ATOM   794  C CZ   . PHE   A 1 71  ? 10.64600 22.59600 13.88200  1.000 14.39909  ?  75  PHE   A CZ   1 
ATOM   795  H H    . PHE   A 1 71  ? 12.10000 21.80900 18.31400  1.000 18.63000  ?  75  PHE   A H    1 
ATOM   796  H HA   . PHE   A 1 71  ? 11.68900 24.41500 18.32300  1.000 18.35000  ?  75  PHE   A HA   1 
ATOM   797  H HB2  . PHE   A 1 71  ? 9.81900  22.30900 18.49200  1.000 18.55000  ?  75  PHE   A HB2  1 
ATOM   798  H HB3  . PHE   A 1 71  ? 9.42100  23.82700 18.24000  1.000 18.55000  ?  75  PHE   A HB3  1 
ATOM   799  H HD1  . PHE   A 1 71  ? 10.76100 24.85300 16.18600  1.000 18.36000  ?  75  PHE   A HD1  1 
ATOM   800  H HD2  . PHE   A 1 71  ? 9.86900  20.98000 16.57100  1.000 18.40000  ?  75  PHE   A HD2  1 
ATOM   801  H HE1  . PHE   A 1 71  ? 11.03000 24.57300 13.90600  1.000 18.71000  ?  75  PHE   A HE1  1 
ATOM   802  H HE2  . PHE   A 1 71  ? 10.18700 20.68000 14.29300  1.000 18.28000  ?  75  PHE   A HE2  1 
ATOM   803  H HZ   . PHE   A 1 71  ? 10.77400 22.47700 12.96900  1.000 17.33000  ?  75  PHE   A HZ   1 
ATOM   804  N N    . LEU   A 1 72  ? 11.35400 22.99700 21.13500  1.000 14.95969  ?  76  LEU   A N    1 
ATOM   805  C CA   . LEU   A 1 72  ? 11.30400 23.26800 22.56600  1.000 15.14918  ?  76  LEU   A CA   1 
ATOM   806  C C    . LEU   A 1 72  ? 12.36600 24.28200 22.97000  1.000 14.73861  ?  76  LEU   A C    1 
ATOM   807  O O    . LEU   A 1 72  ? 12.07800 25.24500 23.68400  1.000 15.81242  ?  76  LEU   A O    1 
ATOM   808  C CB   . LEU   A 1 72  ? 11.48800 21.95300 23.31400  1.000 15.87032  ?  76  LEU   A CB   1 
ATOM   809  C CG   . LEU   A 1 72  ? 11.54000 21.98800 24.83500  1.000 17.69686  ?  76  LEU   A CG   1 
ATOM   810  C CD1  . LEU   A 1 72  ? 10.18900 22.35300 25.40200  1.000 18.89700  ?  76  LEU   A CD1  1 
ATOM   811  C CD2  . LEU   A 1 72  ? 12.00300 20.65100 25.34800  1.000 19.72605  ?  76  LEU   A CD2  1 
ATOM   812  H H    . LEU   A 1 72  ? 11.48100 22.16900 20.93900  1.000 18.00000  ?  76  LEU   A H    1 
ATOM   813  H HA   . LEU   A 1 72  ? 10.44200 23.64500 22.80100  1.000 18.23000  ?  76  LEU   A HA   1 
ATOM   814  H HB2  . LEU   A 1 72  ? 10.74700 21.37400 23.07600  1.000 19.09000  ?  76  LEU   A HB2  1 
ATOM   815  H HB3  . LEU   A 1 72  ? 12.32400 21.56200 23.01700  1.000 19.09000  ?  76  LEU   A HB3  1 
ATOM   816  H HG   . LEU   A 1 72  ? 12.16900 22.66400 25.13200  1.000 21.29000  ?  76  LEU   A HG   1 
ATOM   817  H HD11 . LEU   A 1 72  ? 10.25500 22.40400 26.36800  1.000 22.73000  ?  76  LEU   A HD11 1 
ATOM   818  H HD12 . LEU   A 1 72  ? 9.91900  23.21300 25.04300  1.000 22.73000  ?  76  LEU   A HD12 1 
ATOM   819  H HD13 . LEU   A 1 72  ? 9.54600  21.67300 25.14900  1.000 22.73000  ?  76  LEU   A HD13 1 
ATOM   820  H HD21 . LEU   A 1 72  ? 11.96300 20.65300 26.31700  1.000 23.72000  ?  76  LEU   A HD21 1 
ATOM   821  H HD22 . LEU   A 1 72  ? 11.42200 19.95900 24.99500  1.000 23.72000  ?  76  LEU   A HD22 1 
ATOM   822  H HD23 . LEU   A 1 72  ? 12.91500 20.49800 25.05500  1.000 23.72000  ?  76  LEU   A HD23 1 
ATOM   823  N N    . ALA   A 1 73  ? 13.61200 24.06700 22.53200  1.000 15.28078  ?  77  ALA   A N    1 
ATOM   824  C CA   . ALA   A 1 73  ? 14.68500 25.00000 22.85100  1.000 15.91770  ?  77  ALA   A CA   1 
ATOM   825  C C    . ALA   A 1 73  ? 14.42300 26.36800 22.24800  1.000 17.39682  ?  77  ALA   A C    1 
ATOM   826  O O    . ALA   A 1 73  ? 14.71600 27.39500 22.86900  1.000 17.69686  ?  77  ALA   A O    1 
ATOM   827  C CB   . ALA   A 1 73  ? 16.02400 24.42600 22.38200  1.000 16.47040  ?  77  ALA   A CB   1 
ATOM   828  H H    . ALA   A 1 73  ? 13.85600 23.39600 22.05300  1.000 18.38000  ?  77  ALA   A H    1 
ATOM   829  H HA   . ALA   A 1 73  ? 14.73500 25.11500 23.81300  1.000 19.15000  ?  77  ALA   A HA   1 
ATOM   830  H HB1  . ALA   A 1 73  ? 16.73100 25.05200 22.60400  1.000 19.81000  ?  77  ALA   A HB1  1 
ATOM   831  H HB2  . ALA   A 1 73  ? 16.17900 23.57900 22.82900  1.000 19.81000  ?  77  ALA   A HB2  1 
ATOM   832  H HB3  . ALA   A 1 73  ? 15.99100 24.29100 21.42200  1.000 19.81000  ?  77  ALA   A HB3  1 
ATOM   833  N N    . ALA   A 1 74  ? 13.86700 26.41000 21.03400  1.000 17.01520  ?  78  ALA   A N    1 
ATOM   834  C CA   . ALA   A 1 74  ? 13.52700 27.69600 20.43900  1.000 17.42841  ?  78  ALA   A CA   1 
ATOM   835  C C    . ALA   A 1 74  ? 12.48300 28.42200 21.27100  1.000 17.95478  ?  78  ALA   A C    1 
ATOM   836  O O    . ALA   A 1 74  ? 12.55200 29.64500 21.43800  1.000 18.25482  ?  78  ALA   A O    1 
ATOM   837  C CB   . ALA   A 1 74  ? 13.03500 27.51200 19.01000  1.000 18.95490  ?  78  ALA   A CB   1 
ATOM   838  H H    . ALA   A 1 74  ? 13.68200 25.72400 20.55000  1.000 20.47000  ?  78  ALA   A H    1 
ATOM   839  H HA   . ALA   A 1 74  ? 14.32700 28.24300 20.40600  1.000 20.96000  ?  78  ALA   A HA   1 
ATOM   840  H HB1  . ALA   A 1 74  ? 12.84400 28.38300 18.62700  1.000 22.80000  ?  78  ALA   A HB1  1 
ATOM   841  H HB2  . ALA   A 1 74  ? 13.72500 27.06800 18.49300  1.000 22.80000  ?  78  ALA   A HB2  1 
ATOM   842  H HB3  . ALA   A 1 74  ? 12.23000 26.97100 19.02000  1.000 22.80000  ?  78  ALA   A HB3  1 
ATOM   843  N N    . ALA   A 1 75  ? 11.48900 27.68300 21.77300  1.000 17.03625  ?  79  ALA   A N    1 
ATOM   844  C CA   . ALA   A 1 75  ? 10.45400 28.29000 22.60000  1.000 17.04941  ?  79  ALA   A CA   1 
ATOM   845  C C    . ALA   A 1 75  ? 11.02700 28.82500 23.90100  1.000 16.53883  ?  79  ALA   A C    1 
ATOM   846  O O    . ALA   A 1 75  ? 10.61200 29.89100 24.37400  1.000 18.10743  ?  79  ALA   A O    1 
ATOM   847  C CB   . ALA   A 1 75  ? 9.35400  27.27700 22.88700  1.000 17.00730  ?  79  ALA   A CB   1 
ATOM   848  H H    . ALA   A 1 75  ? 11.39600 26.83700 21.64800  1.000 20.49000  ?  79  ALA   A H    1 
ATOM   849  H HA   . ALA   A 1 75  ? 10.06500 29.03300 22.11300  1.000 20.51000  ?  79  ALA   A HA   1 
ATOM   850  H HB1  . ALA   A 1 75  ? 8.66300  27.70300 23.41800  1.000 20.46000  ?  79  ALA   A HB1  1 
ATOM   851  H HB2  . ALA   A 1 75  ? 8.98200  26.96700 22.04700  1.000 20.46000  ?  79  ALA   A HB2  1 
ATOM   852  H HB3  . ALA   A 1 75  ? 9.73300  26.52900 23.37600  1.000 20.46000  ?  79  ALA   A HB3  1 
ATOM   853  N N    . VAL   A 1 76  ? 11.99600 28.11100 24.48600  1.000 17.68107  ?  80  VAL   A N    1 
ATOM   854  C CA   . VAL   A 1 76  ? 12.67300 28.60400 25.68300  1.000 18.49432  ?  80  VAL   A CA   1 
ATOM   855  C C    . VAL   A 1 76  ? 13.41900 29.88900 25.35800  1.000 17.87846  ?  80  VAL   A C    1 
ATOM   856  O O    . VAL   A 1 76  ? 13.38400 30.85600 26.12200  1.000 19.04176  ?  80  VAL   A O    1 
ATOM   857  C CB   . VAL   A 1 76  ? 13.61100 27.52400 26.25700  1.000 19.94713  ?  80  VAL   A CB   1 
ATOM   858  C CG1  . VAL   A 1 76  ? 14.53400 28.11200 27.34100  1.000 21.16306  ?  80  VAL   A CG1  1 
ATOM   859  C CG2  . VAL   A 1 76  ? 12.80500 26.32400 26.76600  1.000 21.12885  ?  80  VAL   A CG2  1 
ATOM   860  H H    . VAL   A 1 76  ? 12.27500 27.34600 24.21100  1.000 21.26000  ?  80  VAL   A H    1 
ATOM   861  H HA   . VAL   A 1 76  ? 12.00900 28.80200 26.36200  1.000 22.24000  ?  80  VAL   A HA   1 
ATOM   862  H HB   . VAL   A 1 76  ? 14.18900 27.19800 25.54900  1.000 23.99000  ?  80  VAL   A HB   1 
ATOM   863  H HG11 . VAL   A 1 76  ? 14.90800 27.38600 27.86500  1.000 25.45000  ?  80  VAL   A HG11 1 
ATOM   864  H HG12 . VAL   A 1 76  ? 15.24700 28.61100 26.91200  1.000 25.45000  ?  80  VAL   A HG12 1 
ATOM   865  H HG13 . VAL   A 1 76  ? 14.01600 28.70000 27.91200  1.000 25.45000  ?  80  VAL   A HG13 1 
ATOM   866  H HG21 . VAL   A 1 76  ? 13.41500 25.67000 27.14200  1.000 25.41000  ?  80  VAL   A HG21 1 
ATOM   867  H HG22 . VAL   A 1 76  ? 12.18400 26.62700 27.44700  1.000 25.41000  ?  80  VAL   A HG22 1 
ATOM   868  H HG23 . VAL   A 1 76  ? 12.31800 25.93300 26.02400  1.000 25.41000  ?  80  VAL   A HG23 1 
ATOM   869  N N    . LEU   A 1 77  ? 14.10900 29.92300 24.21300  1.000 18.15218  ?  81  LEU   A N    1 
ATOM   870  C CA   . LEU   A 1 77  ? 14.82100 31.14000 23.83600  1.000 19.33916  ?  81  LEU   A CA   1 
ATOM   871  C C    . LEU   A 1 77  ? 13.86100 32.30200 23.63600  1.000 19.70499  ?  81  LEU   A C    1 
ATOM   872  O O    . LEU   A 1 77  ? 14.13600 33.42900 24.06800  1.000 20.80513  ?  81  LEU   A O    1 
ATOM   873  C CB   . LEU   A 1 77  ? 15.64600 30.89600 22.57500  1.000 19.78658  ?  81  LEU   A CB   1 
ATOM   874  C CG   . LEU   A 1 77  ? 16.90800 30.05400 22.77300  1.000 19.79448  ?  81  LEU   A CG   1 
ATOM   875  C CD1  . LEU   A 1 77  ? 17.47200 29.60300 21.42700  1.000 20.37350  ?  81  LEU   A CD1  1 
ATOM   876  C CD2  . LEU   A 1 77  ? 17.96600 30.83600 23.55900  1.000 20.30770  ?  81  LEU   A CD2  1 
ATOM   877  H H    . LEU   A 1 77  ? 14.17800 29.27200 23.65500  1.000 21.83000  ?  81  LEU   A H    1 
ATOM   878  H HA   . LEU   A 1 77  ? 15.43300 31.37900 24.55000  1.000 23.26000  ?  81  LEU   A HA   1 
ATOM   879  H HB2  . LEU   A 1 77  ? 15.08800 30.43500 21.93000  1.000 23.79000  ?  81  LEU   A HB2  1 
ATOM   880  H HB3  . LEU   A 1 77  ? 15.92300 31.75500 22.22000  1.000 23.79000  ?  81  LEU   A HB3  1 
ATOM   881  H HG   . LEU   A 1 77  ? 16.67700 29.26300 23.28500  1.000 23.80000  ?  81  LEU   A HG   1 
ATOM   882  H HD11 . LEU   A 1 77  ? 18.29200 29.10600 21.57800  1.000 24.50000  ?  81  LEU   A HD11 1 
ATOM   883  H HD12 . LEU   A 1 77  ? 16.82000 29.03700 20.98500  1.000 24.50000  ?  81  LEU   A HD12 1 
ATOM   884  H HD13 . LEU   A 1 77  ? 17.65500 30.38500 20.88300  1.000 24.50000  ?  81  LEU   A HD13 1 
ATOM   885  H HD21 . LEU   A 1 77  ? 18.78300 30.31500 23.59300  1.000 24.42000  ?  81  LEU   A HD21 1 
ATOM   886  H HD22 . LEU   A 1 77  ? 18.13100 31.68100 23.11100  1.000 24.42000  ?  81  LEU   A HD22 1 
ATOM   887  H HD23 . LEU   A 1 77  ? 17.63800 30.99700 24.45700  1.000 24.42000  ?  81  LEU   A HD23 1 
ATOM   888  N N    . ALA   A 1 78  ? 12.71600 32.04900 22.99900  1.000 20.84460  ?  82  ALA   A N    1 
ATOM   889  C CA   . ALA   A 1 78  ? 11.70200 33.09400 22.86100  1.000 21.87894  ?  82  ALA   A CA   1 
ATOM   890  C C    . ALA   A 1 78  ? 11.27300 33.63300 24.22300  1.000 22.58692  ?  82  ALA   A C    1 
ATOM   891  O O    . ALA   A 1 78  ? 11.19300 34.85000 24.42200  1.000 23.33438  ?  82  ALA   A O    1 
ATOM   892  C CB   . ALA   A 1 78  ? 10.51200 32.56100 22.06500  1.000 21.90789  ?  82  ALA   A CB   1 
ATOM   893  H H    . ALA   A 1 78  ? 12.50500 31.29500 22.64500  1.000 25.06000  ?  82  ALA   A H    1 
ATOM   894  H HA   . ALA   A 1 78  ? 12.07800 33.83700 22.36300  1.000 26.30000  ?  82  ALA   A HA   1 
ATOM   895  H HB1  . ALA   A 1 78  ? 9.84400  33.26000 21.98900  1.000 26.34000  ?  82  ALA   A HB1  1 
ATOM   896  H HB2  . ALA   A 1 78  ? 10.81500 32.29700 21.18200  1.000 26.34000  ?  82  ALA   A HB2  1 
ATOM   897  H HB3  . ALA   A 1 78  ? 10.13900 31.79600 22.52900  1.000 26.34000  ?  82  ALA   A HB3  1 
ATOM   898  N N    . ARG   A 1 79  ? 11.02100 32.74000 25.18400  1.000 22.61850  ?  83  ARG   A N    1 
ATOM   899  C CA   . ARG   A 1 79  ? 10.63700 33.19000 26.51900  1.000 24.55294  ?  83  ARG   A CA   1 
ATOM   900  C C    . ARG   A 1 79  ? 11.74300 34.02400 27.14600  1.000 24.97142  ?  83  ARG   A C    1 
ATOM   901  O O    . ARG   A 1 79  ? 11.46800 35.01200 27.83600  1.000 26.77426  ?  83  ARG   A O    1 
ATOM   902  C CB   . ARG   A 1 79  ? 10.31000 31.98700 27.39700  1.000 28.27181  ?  83  ARG   A CB   1 
ATOM   903  C CG   . ARG   A 1 79  ? 9.87200  32.30400 28.81300  1.000 33.18819  ?  83  ARG   A CG   1 
ATOM   904  C CD   . ARG   A 1 79  ? 8.92500  31.23500 29.32900  1.000 38.04140  ?  83  ARG   A CD   1 
ATOM   905  N NE   . ARG   A 1 79  ? 8.90800  31.11500 30.78300  1.000 41.73658  ?  83  ARG   A NE   1 
ATOM   906  C CZ   . ARG   A 1 79  ? 9.69700  30.30200 31.47600  1.000 44.59482  ?  83  ARG   A CZ   1 
ATOM   907  N NH1  . ARG   A 1 79  ? 10.62200 29.56400 30.88600  1.000 46.09500  ?  83  ARG   A NH1  1 
ATOM   908  N NH2  . ARG   A 1 79  ? 9.55500  30.22600 32.79400  1.000 45.65547  ?  83  ARG   A NH2  1 
ATOM   909  H H    . ARG   A 1 79  ? 11.06500 31.88600 25.08900  1.000 27.19000  ?  83  ARG   A H    1 
ATOM   910  H HA   . ARG   A 1 79  ? 9.84100  33.74100 26.45500  1.000 29.51000  ?  83  ARG   A HA   1 
ATOM   911  H HB2  . ARG   A 1 79  ? 9.58900  31.49200 26.97700  1.000 33.98000  ?  83  ARG   A HB2  1 
ATOM   912  H HB3  . ARG   A 1 79  ? 11.10200 31.43100 27.45800  1.000 33.98000  ?  83  ARG   A HB3  1 
ATOM   913  H HG2  . ARG   A 1 79  ? 10.64900 32.33500 29.39400  1.000 39.87000  ?  83  ARG   A HG2  1 
ATOM   914  H HG3  . ARG   A 1 79  ? 9.41300  33.15800 28.82800  1.000 39.87000  ?  83  ARG   A HG3  1 
ATOM   915  H HD2  . ARG   A 1 79  ? 8.02400  31.44900 29.03900  1.000 45.70000  ?  83  ARG   A HD2  1 
ATOM   916  H HD3  . ARG   A 1 79  ? 9.19500  30.37700 28.96500  1.000 45.70000  ?  83  ARG   A HD3  1 
ATOM   917  H HE   . ARG   A 1 79  ? 8.35000  31.60300 31.22000  1.000 50.13000  ?  83  ARG   A HE   1 
ATOM   918  H HH11 . ARG   A 1 79  ? 10.72400 29.60300 30.03300  1.000 55.37000  ?  83  ARG   A HH11 1 
ATOM   919  H HH12 . ARG   A 1 79  ? 11.12100 29.04400 31.35500  1.000 55.37000  ?  83  ARG   A HH12 1 
ATOM   920  H HH21 . ARG   A 1 79  ? 8.95700  30.70100 33.19100  1.000 54.84000  ?  83  ARG   A HH21 1 
ATOM   921  H HH22 . ARG   A 1 79  ? 10.06100 29.70300 33.25200  1.000 54.84000  ?  83  ARG   A HH22 1 
ATOM   922  N N    . SER   A 1 80  ? 13.00400 33.65600 26.89600  1.000 24.18448  ?  84  SER   A N    1 
ATOM   923  C CA   . SER   A 1 80  ? 14.13400 34.37600 27.47300  1.000 26.05839  ?  84  SER   A CA   1 
ATOM   924  C C    . SER   A 1 80  ? 14.25000 35.80100 26.94600  1.000 27.01113  ?  84  SER   A C    1 
ATOM   925  O O    . SER   A 1 80  ? 14.94900 36.61900 27.55900  1.000 27.40329  ?  84  SER   A O    1 
ATOM   926  C CB   . SER   A 1 80  ? 15.43600 33.60500 27.22600  1.000 25.75309  ?  84  SER   A CB   1 
ATOM   927  O OG   . SER   A 1 80  ? 15.93100 33.80400 25.91300  1.000 26.22683  ?  84  SER   A OG   1 
ATOM   928  H H    . SER   A 1 80  ? 13.22800 32.99300 26.39500  1.000 29.07000  ?  84  SER   A H    1 
ATOM   929  H HA   . SER   A 1 80  ? 14.00700 34.43200 28.43300  1.000 31.32000  ?  84  SER   A HA   1 
ATOM   930  H HB2  . SER   A 1 80  ? 16.10300 33.91100 27.86000  1.000 30.95000  ?  84  SER   A HB2  1 
ATOM   931  H HB3  . SER   A 1 80  ? 15.26600 32.65900 27.35400  1.000 30.95000  ?  84  SER   A HB3  1 
ATOM   932  H HG   . SER   A 1 80  ? 15.35900 33.55700 25.35000  1.000 31.52000  ?  84  SER   A HG   1 
ATOM   933  N N    . GLN   A 1 81  ? 13.59600 36.12100 25.82800  1.000 28.35866  ?  85  GLN   A N    1 
ATOM   934  C CA   . GLN   A 1 81  ? 13.62400 37.49800 25.34900  1.000 30.57472  ?  85  GLN   A CA   1 
ATOM   935  C C    . GLN   A 1 81  ? 12.85800 38.42400 26.28200  1.000 33.62245  ?  85  GLN   A C    1 
ATOM   936  O O    . GLN   A 1 81  ? 13.14600 39.62400 26.33200  1.000 35.81219  ?  85  GLN   A O    1 
ATOM   937  C CB   . GLN   A 1 81  ? 13.05400 37.58900 23.93100  1.000 30.19573  ?  85  GLN   A CB   1 
ATOM   938  C CG   . GLN   A 1 81  ? 13.81400 36.74900 22.92600  1.000 30.65104  ?  85  GLN   A CG   1 
ATOM   939  C CD   . GLN   A 1 81  ? 13.21100 36.77300 21.53400  1.000 31.17216  ?  85  GLN   A CD   1 
ATOM   940  O OE1  . GLN   A 1 81  ? 13.59600 35.98200 20.67100  1.000 31.39324  ?  85  GLN   A OE1  1 
ATOM   941  N NE2  . GLN   A 1 81  ? 12.26700 37.67800 21.30400  1.000 31.81434  ?  85  GLN   A NE2  1 
ATOM   942  H H    . GLN   A 1 81  ? 13.14200 35.57500 25.34300  1.000 34.08000  ?  85  GLN   A H    1 
ATOM   943  H HA   . GLN   A 1 81  ? 14.54800 37.79200 25.31300  1.000 36.74000  ?  85  GLN   A HA   1 
ATOM   944  H HB2  . GLN   A 1 81  ? 12.13400 37.28000 23.94300  1.000 36.29000  ?  85  GLN   A HB2  1 
ATOM   945  H HB3  . GLN   A 1 81  ? 13.09100 38.51200 23.63700  1.000 36.29000  ?  85  GLN   A HB3  1 
ATOM   946  H HG2  . GLN   A 1 81  ? 14.72100 37.08500 22.86100  1.000 36.83000  ?  85  GLN   A HG2  1 
ATOM   947  H HG3  . GLN   A 1 81  ? 13.82100 35.82800 23.23000  1.000 36.83000  ?  85  GLN   A HG3  1 
ATOM   948  H HE21 . GLN   A 1 81  ? 12.02600 38.21600 21.92900  1.000 38.23000  ?  85  GLN   A HE21 1 
ATOM   949  H HE22 . GLN   A 1 81  ? 11.89800 37.72700 20.52800  1.000 38.23000  ?  85  GLN   A HE22 1 
ATOM   950  N N    . GLN   A 1 82  ? 11.86800 37.89600 27.00500  1.000 35.12526  ?  86  GLN   A N    1 
ATOM   951  C CA   . GLN   A 1 82  ? 11.11700 38.67400 27.98000  1.000 37.86507  ?  86  GLN   A CA   1 
ATOM   952  C C    . GLN   A 1 82  ? 11.56000 38.41300 29.41400  1.000 37.79137  ?  86  GLN   A C    1 
ATOM   953  O O    . GLN   A 1 82  ? 11.15200 39.15100 30.31800  1.000 38.05983  ?  86  GLN   A O    1 
ATOM   954  C CB   . GLN   A 1 82  ? 9.61900  38.36800 27.87200  1.000 40.75752  ?  86  GLN   A CB   1 
ATOM   955  C CG   . GLN   A 1 82  ? 9.03200  38.52100 26.47900  1.000 43.67103  ?  86  GLN   A CG   1 
ATOM   956  C CD   . GLN   A 1 82  ? 9.40700  39.83100 25.82200  1.000 46.30555  ?  86  GLN   A CD   1 
ATOM   957  O OE1  . GLN   A 1 82  ? 9.03400  40.90800 26.28800  1.000 47.58728  ?  86  GLN   A OE1  1 
ATOM   958  N NE2  . GLN   A 1 82  ? 10.15600 39.74500 24.73000  1.000 47.48464  ?  86  GLN   A NE2  1 
ATOM   959  H H    . GLN   A 1 82  ? 11.61200 37.07700 26.94600  1.000 42.20000  ?  86  GLN   A H    1 
ATOM   960  H HA   . GLN   A 1 82  ? 11.24800 39.61500 27.78200  1.000 45.49000  ?  86  GLN   A HA   1 
ATOM   961  H HB2  . GLN   A 1 82  ? 9.47200  37.45100 28.15100  1.000 48.96000  ?  86  GLN   A HB2  1 
ATOM   962  H HB3  . GLN   A 1 82  ? 9.13900  38.97400 28.45800  1.000 48.96000  ?  86  GLN   A HB3  1 
ATOM   963  H HG2  . GLN   A 1 82  ? 9.35900  37.80000 25.91800  1.000 52.45000  ?  86  GLN   A HG2  1 
ATOM   964  H HG3  . GLN   A 1 82  ? 8.06400  38.48200 26.53900  1.000 52.45000  ?  86  GLN   A HG3  1 
ATOM   965  H HE21 . GLN   A 1 82  ? 10.39900 38.97400 24.43600  1.000 57.03000  ?  86  GLN   A HE21 1 
ATOM   966  H HE22 . GLN   A 1 82  ? 10.39700 40.45900 24.31700  1.000 57.03000  ?  86  GLN   A HE22 1 
ATOM   967  N N    . GLN   A 1 83  ? 12.37800 37.39000 29.65100  1.000 37.56503  ?  87  GLN   A N    1 
ATOM   968  C CA   . GLN   A 1 83  ? 12.83300 37.04500 31.00000  1.000 37.71505  ?  87  GLN   A CA   1 
ATOM   969  C C    . GLN   A 1 83  ? 14.35100 36.89400 30.94900  1.000 37.01760  ?  87  GLN   A C    1 
ATOM   970  O O    . GLN   A 1 83  ? 14.87800 35.80200 30.70900  1.000 36.30172  ?  87  GLN   A O    1 
ATOM   971  C CB   . GLN   A 1 83  ? 12.15200 35.78000 31.50200  1.000 38.81781  ?  87  GLN   A CB   1 
ATOM   972  C CG   . GLN   A 1 83  ? 12.47800 35.45700 32.94300  1.000 40.51802  ?  87  GLN   A CG   1 
ATOM   973  C CD   . GLN   A 1 83  ? 11.87200 34.14500 33.39600  1.000 42.12084  ?  87  GLN   A CD   1 
ATOM   974  O OE1  . GLN   A 1 83  ? 10.94900 33.62100 32.76100  1.000 43.86315  ?  87  GLN   A OE1  1 
ATOM   975  N NE2  . GLN   A 1 83  ? 12.40100 33.59300 34.48800  1.000 41.59446  ?  87  GLN   A NE2  1 
ATOM   976  H H    . GLN   A 1 83  ? 12.68700 36.87200 29.03900  1.000 45.13000  ?  87  GLN   A H    1 
ATOM   977  H HA   . GLN   A 1 83  ? 12.61700 37.77000 31.60700  1.000 45.31000  ?  87  GLN   A HA   1 
ATOM   978  H HB2  . GLN   A 1 83  ? 11.19200 35.89200 31.43200  1.000 46.63000  ?  87  GLN   A HB2  1 
ATOM   979  H HB3  . GLN   A 1 83  ? 12.44000 35.03100 30.95700  1.000 46.63000  ?  87  GLN   A HB3  1 
ATOM   980  H HG2  . GLN   A 1 83  ? 13.44100 35.39500 33.04400  1.000 48.67000  ?  87  GLN   A HG2  1 
ATOM   981  H HG3  . GLN   A 1 83  ? 12.13000 36.16100 33.51200  1.000 48.67000  ?  87  GLN   A HG3  1 
ATOM   982  H HE21 . GLN   A 1 83  ? 13.05100 33.98300 34.89500  1.000 49.96000  ?  87  GLN   A HE21 1 
ATOM   983  H HE22 . GLN   A 1 83  ? 12.09300 32.84800 34.78600  1.000 49.96000  ?  87  GLN   A HE22 1 
ATOM   984  N N    . ALA   A 1 84  ? 15.05400 37.99900 31.19500  1.000 36.94654  ?  88  ALA   A N    1 
ATOM   985  C CA   . ALA   A 1 84  ? 16.49500 38.04200 30.98200  1.000 37.91507  ?  88  ALA   A CA   1 
ATOM   986  C C    . ALA   A 1 84  ? 17.27200 37.10600 31.89700  1.000 38.11773  ?  88  ALA   A C    1 
ATOM   987  O O    . ALA   A 1 84  ? 18.41900 36.77400 31.58600  1.000 39.42578  ?  88  ALA   A O    1 
ATOM   988  C CB   . ALA   A 1 84  ? 17.00100 39.47500 31.15500  1.000 38.98099  ?  88  ALA   A CB   1 
ATOM   989  H H    . ALA   A 1 84  ? 14.71900 38.73600 31.48600  1.000 44.39000  ?  88  ALA   A H    1 
ATOM   990  H HA   . ALA   A 1 84  ? 16.67200 37.75800 30.07100  1.000 45.55000  ?  88  ALA   A HA   1 
ATOM   991  H HB1  . ALA   A 1 84  ? 17.96200 39.48900 31.02300  1.000 46.83000  ?  88  ALA   A HB1  1 
ATOM   992  H HB2  . ALA   A 1 84  ? 16.56900 40.04400 30.49800  1.000 46.83000  ?  88  ALA   A HB2  1 
ATOM   993  H HB3  . ALA   A 1 84  ? 16.78500 39.78000 32.05000  1.000 46.83000  ?  88  ALA   A HB3  1 
ATOM   994  N N    . ASP   A 1 85  ? 16.69100 36.66100 33.00300  1.000 36.92548  ?  89  ASP   A N    1 
ATOM   995  C CA   . ASP   A 1 85  ? 17.40000 35.77000 33.90900  1.000 36.87284  ?  89  ASP   A CA   1 
ATOM   996  C C    . ASP   A 1 85  ? 17.04100 34.30500 33.70300  1.000 34.41728  ?  89  ASP   A C    1 
ATOM   997  O O    . ASP   A 1 85  ? 17.48600 33.45200 34.47700  1.000 34.25411  ?  89  ASP   A O    1 
ATOM   998  C CB   . ASP   A 1 85  ? 17.16600 36.17800 35.36700  1.000 39.17575  ?  89  ASP   A CB   1 
ATOM   999  C CG   . ASP   A 1 85  ? 15.73300 35.98500 35.81200  1.000 41.49708  ?  89  ASP   A CG   1 
ATOM   1000 O OD1  . ASP   A 1 85  ? 14.88300 35.65200 34.97100  1.000 43.39994  ?  89  ASP   A OD1  1 
ATOM   1001 O OD2  . ASP   A 1 85  ? 15.45900 36.17500 37.01900  1.000 42.50246  -1 89  ASP   A OD2  1 
ATOM   1002 H H    . ASP   A 1 85  ? 15.89100 36.86100 33.24900  1.000 44.36000  ?  89  ASP   A H    1 
ATOM   1003 H HA   . ASP   A 1 85  ? 18.35000 35.86200 33.73500  1.000 44.30000  ?  89  ASP   A HA   1 
ATOM   1004 H HB2  . ASP   A 1 85  ? 17.73200 35.63700 35.94000  1.000 47.06000  ?  89  ASP   A HB2  1 
ATOM   1005 H HB3  . ASP   A 1 85  ? 17.38800 37.11600 35.47100  1.000 47.06000  ?  89  ASP   A HB3  1 
ATOM   1006 N N    . LEU   A 1 86  ? 16.26600 33.98600 32.67100  1.000 32.14859  ?  90  LEU   A N    1 
ATOM   1007 C CA   . LEU   A 1 86  ? 15.76400 32.62400 32.53000  1.000 29.53775  ?  90  LEU   A CA   1 
ATOM   1008 C C    . LEU   A 1 86  ? 16.88500 31.64000 32.22800  1.000 28.21654  ?  90  LEU   A C    1 
ATOM   1009 O O    . LEU   A 1 86  ? 16.97000 30.57500 32.84800  1.000 27.40855  ?  90  LEU   A O    1 
ATOM   1010 C CB   . LEU   A 1 86  ? 14.69900 32.56800 31.43500  1.000 28.42446  ?  90  LEU   A CB   1 
ATOM   1011 C CG   . LEU   A 1 86  ? 14.20800 31.16300 31.09400  1.000 27.77701  ?  90  LEU   A CG   1 
ATOM   1012 C CD1  . LEU   A 1 86  ? 13.60600 30.48800 32.29400  1.000 28.17706  ?  90  LEU   A CD1  1 
ATOM   1013 C CD2  . LEU   A 1 86  ? 13.18800 31.20800 29.94200  1.000 27.36644  ?  90  LEU   A CD2  1 
ATOM   1014 H H    . LEU   A 1 86  ? 16.02000 34.52800 32.05000  1.000 38.63000  ?  90  LEU   A H    1 
ATOM   1015 H HA   . LEU   A 1 86  ? 15.35600 32.36300 33.37100  1.000 35.49000  ?  90  LEU   A HA   1 
ATOM   1016 H HB2  . LEU   A 1 86  ? 13.93100 33.08400 31.72500  1.000 34.16000  ?  90  LEU   A HB2  1 
ATOM   1017 H HB3  . LEU   A 1 86  ? 15.07000 32.95200 30.62500  1.000 34.16000  ?  90  LEU   A HB3  1 
ATOM   1018 H HG   . LEU   A 1 86  ? 14.97200 30.63700 30.81000  1.000 33.38000  ?  90  LEU   A HG   1 
ATOM   1019 H HD11 . LEU   A 1 86  ? 13.16300 29.67400 32.00900  1.000 33.86000  ?  90  LEU   A HD11 1 
ATOM   1020 H HD12 . LEU   A 1 86  ? 14.31200 30.27700 32.92500  1.000 33.86000  ?  90  LEU   A HD12 1 
ATOM   1021 H HD13 . LEU   A 1 86  ? 12.96400 31.08800 32.70500  1.000 33.86000  ?  90  LEU   A HD13 1 
ATOM   1022 H HD21 . LEU   A 1 86  ? 13.11300 30.32300 29.55300  1.000 32.89000  ?  90  LEU   A HD21 1 
ATOM   1023 H HD22 . LEU   A 1 86  ? 12.32800 31.48900 30.29300  1.000 32.89000  ?  90  LEU   A HD22 1 
ATOM   1024 H HD23 . LEU   A 1 86  ? 13.49500 31.83900 29.27300  1.000 32.89000  ?  90  LEU   A HD23 1 
ATOM   1025 N N    . LEU   A 1 87  ? 17.73700 31.95600 31.25000  1.000 27.71122  ?  91  LEU   A N    1 
ATOM   1026 C CA   . LEU   A 1 87  ? 18.70000 30.95700 30.78800  1.000 26.56898  ?  91  LEU   A CA   1 
ATOM   1027 C C    . LEU   A 1 87  ? 19.70300 30.59200 31.87100  1.000 25.56359  ?  91  LEU   A C    1 
ATOM   1028 O O    . LEU   A 1 87  ? 20.16200 29.44500 31.92900  1.000 23.96603  ?  91  LEU   A O    1 
ATOM   1029 C CB   . LEU   A 1 87  ? 19.44600 31.44800 29.55600  1.000 26.41369  ?  91  LEU   A CB   1 
ATOM   1030 C CG   . LEU   A 1 87  ? 18.59500 31.60300 28.29600  1.000 27.44540  ?  91  LEU   A CG   1 
ATOM   1031 C CD1  . LEU   A 1 87  ? 19.47000 32.06200 27.14600  1.000 29.32983  ?  91  LEU   A CD1  1 
ATOM   1032 C CD2  . LEU   A 1 87  ? 17.90400 30.31300 27.93600  1.000 27.61647  ?  91  LEU   A CD2  1 
ATOM   1033 H H    . LEU   A 1 87  ? 17.77700 32.71700 30.85100  1.000 33.30000  ?  91  LEU   A H    1 
ATOM   1034 H HA   . LEU   A 1 87  ? 18.20100 30.16200 30.54300  1.000 31.93000  ?  91  LEU   A HA   1 
ATOM   1035 H HB2  . LEU   A 1 87  ? 19.82800 32.31700 29.75600  1.000 31.75000  ?  91  LEU   A HB2  1 
ATOM   1036 H HB3  . LEU   A 1 87  ? 20.15200 30.81400 29.35300  1.000 31.75000  ?  91  LEU   A HB3  1 
ATOM   1037 H HG   . LEU   A 1 87  ? 17.90700 32.26500 28.46200  1.000 32.98000  ?  91  LEU   A HG   1 
ATOM   1038 H HD11 . LEU   A 1 87  ? 18.91300 32.21600 26.36700  1.000 35.25000  ?  91  LEU   A HD11 1 
ATOM   1039 H HD12 . LEU   A 1 87  ? 19.91900 32.88400 27.39900  1.000 35.25000  ?  91  LEU   A HD12 1 
ATOM   1040 H HD13 . LEU   A 1 87  ? 20.12600 31.37400 26.95300  1.000 35.25000  ?  91  LEU   A HD13 1 
ATOM   1041 H HD21 . LEU   A 1 87  ? 17.55900 30.38100 27.03100  1.000 33.19000  ?  91  LEU   A HD21 1 
ATOM   1042 H HD22 . LEU   A 1 87  ? 18.54300 29.58600 27.99200  1.000 33.19000  ?  91  LEU   A HD22 1 
ATOM   1043 H HD23 . LEU   A 1 87  ? 17.17500 30.16100 28.55700  1.000 33.19000  ?  91  LEU   A HD23 1 
ATOM   1044 N N    . ASP   A 1 88  ? 20.04900 31.54300 32.73300  1.000 26.16103  ?  92  ASP   A N    1 
ATOM   1045 C CA   . ASP   A 1 88  ? 21.00000 31.29200 33.80300  1.000 25.77414  ?  92  ASP   A CA   1 
ATOM   1046 C C    . ASP   A 1 88  ? 20.36900 30.63200 35.01700  1.000 24.47925  ?  92  ASP   A C    1 
ATOM   1047 O O    . ASP   A 1 88  ? 21.07600 30.40600 36.00200  1.000 24.47136  ?  92  ASP   A O    1 
ATOM   1048 C CB   . ASP   A 1 88  ? 21.62000 32.60100 34.30000  1.000 28.71660  ?  92  ASP   A CB   1 
ATOM   1049 C CG   . ASP   A 1 88  ? 22.67500 33.15500 33.36800  1.000 32.30124  ?  92  ASP   A CG   1 
ATOM   1050 O OD1  . ASP   A 1 88  ? 23.18400 32.40700 32.50700  1.000 34.45413  ?  92  ASP   A OD1  1 
ATOM   1051 O OD2  . ASP   A 1 88  ? 23.01500 34.34700 33.53000  1.000 33.54613  -1 92  ASP   A OD2  1 
ATOM   1052 H H    . ASP   A 1 88  ? 19.74300 32.34700 32.71600  1.000 31.44000  ?  92  ASP   A H    1 
ATOM   1053 H HA   . ASP   A 1 88  ? 21.69200 30.72200 33.43300  1.000 30.98000  ?  92  ASP   A HA   1 
ATOM   1054 H HB2  . ASP   A 1 88  ? 20.92000 33.26700 34.38600  1.000 34.51000  ?  92  ASP   A HB2  1 
ATOM   1055 H HB3  . ASP   A 1 88  ? 22.03600 32.44400 35.16200  1.000 34.51000  ?  92  ASP   A HB3  1 
ATOM   1056 N N    . THR   A 1 89  ? 19.07000 30.36500 35.00600  1.000 23.89234  ?  93  THR   A N    1 
ATOM   1057 C CA   . THR   A 1 89  ? 18.41100 29.89200 36.21500  1.000 23.01065  ?  93  THR   A CA   1 
ATOM   1058 C C    . THR   A 1 89  ? 18.83200 28.46100 36.51500  1.000 20.90514  ?  93  THR   A C    1 
ATOM   1059 O O    . THR   A 1 89  ? 18.69900 27.59000 35.64800  1.000 20.16821  ?  93  THR   A O    1 
ATOM   1060 C CB   . THR   A 1 89  ? 16.89500 29.95900 36.03300  1.000 23.78706  ?  93  THR   A CB   1 
ATOM   1061 O OG1  . THR   A 1 89  ? 16.47500 31.32600 35.99700  1.000 25.03721  ?  93  THR   A OG1  1 
ATOM   1062 C CG2  . THR   A 1 89  ? 16.20100 29.24300 37.18400  1.000 24.24764  ?  93  THR   A CG2  1 
ATOM   1063 H H    . THR   A 1 89  ? 18.55600 30.44700 34.32200  1.000 28.72000  ?  93  THR   A H    1 
ATOM   1064 H HA   . THR   A 1 89  ? 18.66500 30.45100 36.96500  1.000 27.66000  ?  93  THR   A HA   1 
ATOM   1065 H HB   . THR   A 1 89  ? 16.64200 29.52700 35.20200  1.000 28.59000  ?  93  THR   A HB   1 
ATOM   1066 H HG1  . THR   A 1 89  ? 16.88600 31.73700 35.39100  1.000 30.09000  ?  93  THR   A HG1  1 
ATOM   1067 H HG21 . THR   A 1 89  ? 15.28200 29.54600 37.25700  1.000 29.15000  ?  93  THR   A HG21 1 
ATOM   1068 H HG22 . THR   A 1 89  ? 16.20500 28.28500 37.03000  1.000 29.15000  ?  93  THR   A HG22 1 
ATOM   1069 H HG23 . THR   A 1 89  ? 16.66100 29.43000 38.01700  1.000 29.15000  ?  93  THR   A HG23 1 
ATOM   1070 N N    A PRO   A 1 90  ? 19.36800 28.17600 37.70400  0.490 20.66827  ?  94  PRO   A N    1 
ATOM   1071 N N    B PRO   A 1 90  ? 19.30800 28.15600 37.73000  0.510 20.37086  ?  94  PRO   A N    1 
ATOM   1072 C CA   A PRO   A 1 90  ? 19.67000 26.78800 38.06400  0.490 20.69195  ?  94  PRO   A CA   1 
ATOM   1073 C CA   B PRO   A 1 90  ? 19.70900 26.77300 38.03900  0.510 20.12347  ?  94  PRO   A CA   1 
ATOM   1074 C C    A PRO   A 1 90  ? 18.38300 25.99800 38.26200  0.490 21.13674  ?  94  PRO   A C    1 
ATOM   1075 C C    B PRO   A 1 90  ? 18.50700 25.91600 38.43100  0.510 20.54457  ?  94  PRO   A C    1 
ATOM   1076 O O    A PRO   A 1 90  ? 17.40600 26.49600 38.83100  0.490 21.90789  ?  94  PRO   A O    1 
ATOM   1077 O O    B PRO   A 1 90  ? 17.72100 26.28400 39.31200  0.510 20.58931  ?  94  PRO   A O    1 
ATOM   1078 C CB   A PRO   A 1 90  ? 20.45800 26.92400 39.37700  0.490 20.79197  ?  94  PRO   A CB   1 
ATOM   1079 C CB   B PRO   A 1 90  ? 20.68500 26.94000 39.21300  0.510 20.20769  ?  94  PRO   A CB   1 
ATOM   1080 C CG   A PRO   A 1 90  ? 20.95800 28.35500 39.38400  0.490 21.12622  ?  94  PRO   A CG   1 
ATOM   1081 C CG   B PRO   A 1 90  ? 20.19800 28.16200 39.91800  0.510 20.83408  ?  94  PRO   A CG   1 
ATOM   1082 C CD   A PRO   A 1 90  ? 19.86600 29.12900 38.71400  0.490 20.83671  ?  94  PRO   A CD   1 
ATOM   1083 C CD   B PRO   A 1 90  ? 19.60200 29.07500 38.84900  0.510 20.55510  ?  94  PRO   A CD   1 
ATOM   1084 H HA   A PRO   A 1 90  ? 20.22700 26.35900 37.39600  0.490 24.88000  ?  94  PRO   A HA   1 
ATOM   1085 H HA   B PRO   A 1 90  ? 20.16000 26.36900 37.28200  0.510 24.20000  ?  94  PRO   A HA   1 
ATOM   1086 H HB2  A PRO   A 1 90  ? 19.87300 26.75600 40.13300  0.490 25.00000  ?  94  PRO   A HB2  1 
ATOM   1087 H HB2  B PRO   A 1 90  ? 20.64700 26.16300 39.79200  0.510 24.30000  ?  94  PRO   A HB2  1 
ATOM   1088 H HB3  A PRO   A 1 90  ? 21.19800 26.29700 39.38500  0.490 25.00000  ?  94  PRO   A HB3  1 
ATOM   1089 H HB3  B PRO   A 1 90  ? 21.58800 27.06200 38.88100  0.510 24.30000  ?  94  PRO   A HB3  1 
ATOM   1090 H HG2  A PRO   A 1 90  ? 21.09200 28.65800 40.29600  0.490 25.40000  ?  94  PRO   A HG2  1 
ATOM   1091 H HG2  B PRO   A 1 90  ? 19.52400 27.91400 40.56900  0.510 25.05000  ?  94  PRO   A HG2  1 
ATOM   1092 H HG3  A PRO   A 1 90  ? 21.78800 28.42100 38.88700  0.490 25.40000  ?  94  PRO   A HG3  1 
ATOM   1093 H HG3  B PRO   A 1 90  ? 20.94300 28.59800 40.36100  0.510 25.05000  ?  94  PRO   A HG3  1 
ATOM   1094 H HD2  A PRO   A 1 90  ? 19.16800 29.36300 39.34500  0.490 25.05000  ?  94  PRO   A HD2  1 
ATOM   1095 H HD2  B PRO   A 1 90  ? 18.78900 29.49500 39.17100  0.510 24.72000  ?  94  PRO   A HD2  1 
ATOM   1096 H HD3  A PRO   A 1 90  ? 20.21500 29.93000 38.29300  0.490 25.05000  ?  94  PRO   A HD3  1 
ATOM   1097 H HD3  B PRO   A 1 90  ? 20.24200 29.75200 38.57900  0.510 24.72000  ?  94  PRO   A HD3  1 
ATOM   1098 N N    . ILE   A 1 91  ? 18.39400 24.75500 37.78400  1.000 20.31823  ?  95  ILE   A N    1 
ATOM   1099 C CA   . ILE   A 1 91  ? 17.28600 23.81600 37.95900  1.000 20.43929  ?  95  ILE   A CA   1 
ATOM   1100 C C    . ILE   A 1 91  ? 17.82800 22.56500 38.64600  1.000 20.54983  ?  95  ILE   A C    1 
ATOM   1101 O O    . ILE   A 1 91  ? 18.66300 21.85000 38.07900  1.000 19.59709  ?  95  ILE   A O    1 
ATOM   1102 C CB   . ILE   A 1 91  ? 16.64400 23.43300 36.61400  1.000 21.49995  ?  95  ILE   A CB   1 
ATOM   1103 C CG1  . ILE   A 1 91  ? 16.17700 24.68300 35.88300  1.000 22.99749  ?  95  ILE   A CG1  1 
ATOM   1104 C CG2  . ILE   A 1 91  ? 15.51200 22.43400 36.85500  1.000 21.86315  ?  95  ILE   A CG2  1 
ATOM   1105 C CD1  . ILE   A 1 91  ? 15.05700 25.38800 36.56300  1.000 23.03434  ?  95  ILE   A CD1  1 
ATOM   1106 H H    A ILE   A 1 91  ? 19.05200 24.42200 37.34100  0.490 24.43000  ?  95  ILE   A H    1 
ATOM   1107 H H    B ILE   A 1 91  ? 18.97400 24.47700 37.21300  0.510 24.43000  ?  95  ILE   A H    1 
ATOM   1108 H HA   . ILE   A 1 91  ? 16.61700 24.22800 38.52700  1.000 24.58000  ?  95  ILE   A HA   1 
ATOM   1109 H HB   . ILE   A 1 91  ? 17.29900 23.00100 36.04300  1.000 25.85000  ?  95  ILE   A HB   1 
ATOM   1110 H HG12 . ILE   A 1 91  ? 16.92000 25.30300 35.81700  1.000 27.65000  ?  95  ILE   A HG12 1 
ATOM   1111 H HG13 . ILE   A 1 91  ? 15.87400 24.43200 34.99600  1.000 27.65000  ?  95  ILE   A HG13 1 
ATOM   1112 H HG21 . ILE   A 1 91  ? 14.97500 22.36600 36.05100  1.000 26.29000  ?  95  ILE   A HG21 1 
ATOM   1113 H HG22 . ILE   A 1 91  ? 15.89500 21.57000 37.07200  1.000 26.29000  ?  95  ILE   A HG22 1 
ATOM   1114 H HG23 . ILE   A 1 91  ? 14.96600 22.74800 37.59300  1.000 26.29000  ?  95  ILE   A HG23 1 
ATOM   1115 H HD11 . ILE   A 1 91  ? 14.86600 26.21100 36.08700  1.000 27.69000  ?  95  ILE   A HD11 1 
ATOM   1116 H HD12 . ILE   A 1 91  ? 14.27400 24.81500 36.55800  1.000 27.69000  ?  95  ILE   A HD12 1 
ATOM   1117 H HD13 . ILE   A 1 91  ? 15.31600 25.58600 37.47600  1.000 27.69000  ?  95  ILE   A HD13 1 
ATOM   1118 N N    . ARG   A 1 92  ? 17.33000 22.27600 39.84800  1.000 22.21056  ?  96  ARG   A N    1 
ATOM   1119 C CA   . ARG   A 1 92  ? 17.60200 21.02200 40.53300  1.000 22.81063  ?  96  ARG   A CA   1 
ATOM   1120 C C    . ARG   A 1 92  ? 16.43600 20.06000 40.33500  1.000 22.00527  ?  96  ARG   A C    1 
ATOM   1121 O O    . ARG   A 1 92  ? 15.28500 20.47800 40.20300  1.000 23.70547  ?  96  ARG   A O    1 
ATOM   1122 C CB   . ARG   A 1 92  ? 17.87100 21.25700 42.02700  1.000 25.82941  ?  96  ARG   A CB   1 
ATOM   1123 C CG   . ARG   A 1 92  ? 19.27200 21.84900 42.28000  1.000 29.12981  ?  96  ARG   A CG   1 
ATOM   1124 C CD   . ARG   A 1 92  ? 19.72400 21.74300 43.74700  1.000 31.28270  ?  96  ARG   A CD   1 
ATOM   1125 N NE   . ARG   A 1 92  ? 21.10100 22.20200 43.95900  1.000 33.13555  ?  96  ARG   A NE   1 
ATOM   1126 C CZ   . ARG   A 1 92  ? 22.15300 21.40200 44.11200  1.000 32.64602  ?  96  ARG   A CZ   1 
ATOM   1127 N NH1  . ARG   A 1 92  ? 22.04100 20.08600 44.05600  1.000 32.79077  ?  96  ARG   A NH1  1 
ATOM   1128 N NH2  . ARG   A 1 92  ? 23.34600 21.93700 44.35000  1.000 34.33833  ?  96  ARG   A NH2  1 
ATOM   1129 H H    . ARG   A 1 92  ? 16.81900 22.80600 40.29300  1.000 26.70000  ?  96  ARG   A H    1 
ATOM   1130 H HA   . ARG   A 1 92  ? 18.39700 20.60700 40.16200  1.000 27.42000  ?  96  ARG   A HA   1 
ATOM   1131 H HB2  . ARG   A 1 92  ? 17.21200 21.87800 42.37500  1.000 31.04000  ?  96  ARG   A HB2  1 
ATOM   1132 H HB3  . ARG   A 1 92  ? 17.81100 20.41100 42.49800  1.000 31.04000  ?  96  ARG   A HB3  1 
ATOM   1133 H HG2  . ARG   A 1 92  ? 19.91800 21.37300 41.73500  1.000 35.00000  ?  96  ARG   A HG2  1 
ATOM   1134 H HG3  . ARG   A 1 92  ? 19.26400 22.78900 42.03900  1.000 35.00000  ?  96  ARG   A HG3  1 
ATOM   1135 H HD2  . ARG   A 1 92  ? 19.14000 22.28800 44.29700  1.000 37.59000  ?  96  ARG   A HD2  1 
ATOM   1136 H HD3  . ARG   A 1 92  ? 19.67200 20.81500 44.02600  1.000 37.59000  ?  96  ARG   A HD3  1 
ATOM   1137 H HE   . ARG   A 1 92  ? 21.23800 23.05000 43.98700  1.000 39.81000  ?  96  ARG   A HE   1 
ATOM   1138 H HH11 . ARG   A 1 92  ? 21.27200 19.72500 43.91800  1.000 39.40000  ?  96  ARG   A HH11 1 
ATOM   1139 H HH12 . ARG   A 1 92  ? 22.73600 19.59000 44.15800  1.000 39.40000  ?  96  ARG   A HH12 1 
ATOM   1140 H HH21 . ARG   A 1 92  ? 23.43100 22.79100 44.40300  1.000 41.25000  ?  96  ARG   A HH21 1 
ATOM   1141 H HH22 . ARG   A 1 92  ? 24.03200 21.42800 44.45000  1.000 41.25000  ?  96  ARG   A HH22 1 
ATOM   1142 N N    . TYR   A 1 93  ? 16.74800 18.76600 40.27400  1.000 19.72079  ?  97  TYR   A N    1 
ATOM   1143 C CA   . TYR   A 1 93  ? 15.76200 17.75300 39.92000  1.000 20.84724  ?  97  TYR   A CA   1 
ATOM   1144 C C    . TYR   A 1 93  ? 16.10200 16.49500 40.69700  1.000 21.72103  ?  97  TYR   A C    1 
ATOM   1145 O O    . TYR   A 1 93  ? 17.25600 16.26000 41.06300  1.000 21.44204  ?  97  TYR   A O    1 
ATOM   1146 C CB   . TYR   A 1 93  ? 15.66500 17.48800 38.39500  1.000 19.55761  ?  97  TYR   A CB   1 
ATOM   1147 C CG   . TYR   A 1 93  ? 17.00800 17.36400 37.72600  1.000 18.96806  ?  97  TYR   A CG   1 
ATOM   1148 C CD1  . TYR   A 1 93  ? 17.66300 18.48900 37.23800  1.000 18.87858  ?  97  TYR   A CD1  1 
ATOM   1149 C CD2  . TYR   A 1 93  ? 17.62700 16.13300 37.58400  1.000 18.86279  ?  97  TYR   A CD2  1 
ATOM   1150 C CE1  . TYR   A 1 93  ? 18.90900 18.39200 36.63100  1.000 18.15481  ?  97  TYR   A CE1  1 
ATOM   1151 C CE2  . TYR   A 1 93  ? 18.89600 16.02500 36.97500  1.000 18.93911  ?  97  TYR   A CE2  1 
ATOM   1152 C CZ   . TYR   A 1 93  ? 19.50600 17.17000 36.49500  1.000 17.97584  ?  97  TYR   A CZ   1 
ATOM   1153 O OH   . TYR   A 1 93  ? 20.73800 17.13100 35.89500  1.000 18.82068  ?  97  TYR   A OH   1 
ATOM   1154 H H    A TYR   A 1 93  ? 17.53100 18.44900 40.43500  0.370 23.72000  ?  97  TYR   A H    1 
ATOM   1155 H H    B TYR   A 1 93  ? 17.53100 18.44900 40.43500  0.630 23.72000  ?  97  TYR   A H    1 
ATOM   1156 H HA   . TYR   A 1 93  ? 14.87600 18.05100 40.18100  1.000 25.07000  ?  97  TYR   A HA   1 
ATOM   1157 H HB2  . TYR   A 1 93  ? 15.18300 16.65800 38.25200  1.000 23.52000  ?  97  TYR   A HB2  1 
ATOM   1158 H HB3  . TYR   A 1 93  ? 15.19000 18.22400 37.97800  1.000 23.52000  ?  97  TYR   A HB3  1 
ATOM   1159 H HD1  . TYR   A 1 93  ? 17.25800 19.32300 37.31900  1.000 22.70000  ?  97  TYR   A HD1  1 
ATOM   1160 H HD2  . TYR   A 1 93  ? 17.20000 15.36700 37.89400  1.000 22.68000  ?  97  TYR   A HD2  1 
ATOM   1161 H HE1  . TYR   A 1 93  ? 19.33600 19.15700 36.31800  1.000 21.83000  ?  97  TYR   A HE1  1 
ATOM   1162 H HE2  . TYR   A 1 93  ? 19.31500 15.19800 36.89700  1.000 22.78000  ?  97  TYR   A HE2  1 
ATOM   1163 H HH   . TYR   A 1 93  ? 21.01000 16.33800 35.84900  1.000 22.63000  ?  97  TYR   A HH   1 
ATOM   1164 N N    . GLY   A 1 94  ? 15.09300 15.69600 40.95000  1.000 23.23436  ?  98  GLY   A N    1 
ATOM   1165 C CA   . GLY   A 1 94  ? 15.29600 14.44900 41.64900  1.000 23.09224  ?  98  GLY   A CA   1 
ATOM   1166 C C    . GLY   A 1 94  ? 15.53600 13.27700 40.71300  1.000 21.81841  ?  98  GLY   A C    1 
ATOM   1167 O O    . GLY   A 1 94  ? 15.39800 13.35400 39.49200  1.000 22.02896  ?  98  GLY   A O    1 
ATOM   1168 H H    . GLY   A 1 94  ? 14.27700 15.85200 40.72600  1.000 27.93000  ?  98  GLY   A H    1 
ATOM   1169 H HA2  . GLY   A 1 94  ? 16.06600 14.53300 42.23400  1.000 27.76000  ?  98  GLY   A HA2  1 
ATOM   1170 H HA3  . GLY   A 1 94  ? 14.51200 14.25400 42.18600  1.000 27.76000  ?  98  GLY   A HA3  1 
ATOM   1171 N N    . LYS   A 1 95  ? 15.92600 12.15500 41.31500  1.000 22.37637  ?  99  LYS   A N    1 
ATOM   1172 C CA   . LYS   A 1 95  ? 16.18000 10.95900 40.52400  1.000 23.92129  ?  99  LYS   A CA   1 
ATOM   1173 C C    . LYS   A 1 95  ? 14.95000 10.56100 39.72200  1.000 25.18197  ?  99  LYS   A C    1 
ATOM   1174 O O    . LYS   A 1 95  ? 15.08000 10.04100 38.60300  1.000 24.54242  ?  99  LYS   A O    1 
ATOM   1175 C CB   . LYS   A 1 95  ? 16.63000 9.82100  41.43400  1.000 26.43475  ?  99  LYS   A CB   1 
ATOM   1176 C CG   . LYS   A 1 95  ? 17.17500 8.61900  40.68600  1.000 30.19309  ?  99  LYS   A CG   1 
ATOM   1177 C CD   . LYS   A 1 95  ? 17.72100 7.57800  41.66200  1.000 33.85932  ?  99  LYS   A CD   1 
ATOM   1178 C CE   . LYS   A 1 95  ? 18.17600 6.33300  40.93000  1.000 37.03602  ?  99  LYS   A CE   1 
ATOM   1179 N NZ   . LYS   A 1 95  ? 18.27300 5.15100  41.83500  1.000 39.49421  ?  99  LYS   A NZ   1 
ATOM   1180 H H    . LYS   A 1 95  ? 16.04900 12.06300 42.16200  1.000 26.90000  ?  99  LYS   A H    1 
ATOM   1181 H HA   . LYS   A 1 95  ? 16.89900 11.13400 39.89700  1.000 28.75000  ?  99  LYS   A HA   1 
ATOM   1182 H HB2  . LYS   A 1 95  ? 17.33000 10.14800 42.01900  1.000 31.77000  ?  99  LYS   A HB2  1 
ATOM   1183 H HB3  . LYS   A 1 95  ? 15.87100 9.52300  41.95900  1.000 31.77000  ?  99  LYS   A HB3  1 
ATOM   1184 H HG2  . LYS   A 1 95  ? 16.46600 8.21100  40.16600  1.000 36.28000  ?  99  LYS   A HG2  1 
ATOM   1185 H HG3  . LYS   A 1 95  ? 17.89600 8.90000  40.10100  1.000 36.28000  ?  99  LYS   A HG3  1 
ATOM   1186 H HD2  . LYS   A 1 95  ? 18.48100 7.94800  42.13900  1.000 40.68000  ?  99  LYS   A HD2  1 
ATOM   1187 H HD3  . LYS   A 1 95  ? 17.02500 7.32800  42.29000  1.000 40.68000  ?  99  LYS   A HD3  1 
ATOM   1188 H HE2  . LYS   A 1 95  ? 17.53900 6.12500  40.22900  1.000 44.49000  ?  99  LYS   A HE2  1 
ATOM   1189 H HE3  . LYS   A 1 95  ? 19.05200 6.49100  40.54600  1.000 44.49000  ?  99  LYS   A HE3  1 
ATOM   1190 H HZ1  . LYS   A 1 95  ? 18.55100 4.44000  41.37900  1.000 47.44000  ?  99  LYS   A HZ1  1 
ATOM   1191 H HZ2  . LYS   A 1 95  ? 18.85100 5.31700  42.49200  1.000 47.44000  ?  99  LYS   A HZ2  1 
ATOM   1192 H HZ3  . LYS   A 1 95  ? 17.47600 4.97400  42.19000  1.000 47.44000  ?  99  LYS   A HZ3  1 
ATOM   1193 N N    . ASN   A 1 96  ? 13.75400 10.84700 40.25600  1.000 25.46621  ?  100 ASN   A N    1 
ATOM   1194 C CA   . ASN   A 1 96  ? 12.51300 10.51000 39.56200  1.000 27.52172  ?  100 ASN   A CA   1 
ATOM   1195 C C    . ASN   A 1 96  ? 12.35700 11.24200 38.22900  1.000 27.22168  ?  100 ASN   A C    1 
ATOM   1196 O O    . ASN   A 1 96  ? 11.57800 10.79400 37.37600  1.000 28.39025  ?  100 ASN   A O    1 
ATOM   1197 C CB   . ASN   A 1 96  ? 11.28800 10.68900 40.49100  1.000 29.07717  ?  100 ASN   A CB   1 
ATOM   1198 C CG   . ASN   A 1 96  ? 11.04500 12.13300 40.93900  1.000 30.83264  ?  100 ASN   A CG   1 
ATOM   1199 O OD1  . ASN   A 1 96  ? 11.90800 12.99900 40.83900  1.000 33.26451  ?  100 ASN   A OD1  1 
ATOM   1200 N ND2  . ASN   A 1 96  ? 9.84500  12.37700 41.48300  1.000 31.87224  ?  100 ASN   A ND2  1 
ATOM   1201 H H    . ASN   A 1 96  ? 13.63800 11.23400 41.01500  1.000 30.61000  ?  100 ASN   A H    1 
ATOM   1202 H HA   . ASN   A 1 96  ? 12.53200 9.56600  39.34100  1.000 33.08000  ?  100 ASN   A HA   1 
ATOM   1203 H HB2  . ASN   A 1 96  ? 10.49500 10.39000 40.02000  1.000 34.94000  ?  100 ASN   A HB2  1 
ATOM   1204 H HB3  . ASN   A 1 96  ? 11.42200 10.15300 41.28900  1.000 34.94000  ?  100 ASN   A HB3  1 
ATOM   1205 H HD21 . ASN   A 1 96  ? 9.64900  13.16900 41.75400  1.000 38.30000  ?  100 ASN   A HD21 1 
ATOM   1206 H HD22 . ASN   A 1 96  ? 9.27200  11.74100 41.56200  1.000 38.30000  ?  100 ASN   A HD22 1 
ATOM   1207 N N    . ALA   A 1 97  ? 13.10200 12.32300 38.00600  1.000 24.76086  ?  101 ALA   A N    1 
ATOM   1208 C CA   . ALA   A 1 97  ? 13.06400 13.01600 36.72400  1.000 24.60032  ?  101 ALA   A CA   1 
ATOM   1209 C C    . ALA   A 1 97  ? 13.85800 12.30500 35.63600  1.000 23.20805  ?  101 ALA   A C    1 
ATOM   1210 O O    . ALA   A 1 97  ? 13.65100 12.59700 34.44700  1.000 24.07394  ?  101 ALA   A O    1 
ATOM   1211 C CB   . ALA   A 1 97  ? 13.58800 14.44300 36.88700  1.000 25.27935  ?  101 ALA   A CB   1 
ATOM   1212 H H    . ALA   A 1 97  ? 13.63700 12.67300 38.58100  1.000 29.76000  ?  101 ALA   A H    1 
ATOM   1213 H HA   . ALA   A 1 97  ? 12.14100 13.06300 36.42900  1.000 29.57000  ?  101 ALA   A HA   1 
ATOM   1214 H HB1  . ALA   A 1 97  ? 13.53700 14.89700 36.03200  1.000 30.39000  ?  101 ALA   A HB1  1 
ATOM   1215 H HB2  . ALA   A 1 97  ? 13.04200 14.90600 37.54100  1.000 30.39000  ?  101 ALA   A HB2  1 
ATOM   1216 H HB3  . ALA   A 1 97  ? 14.50900 14.40800 37.18900  1.000 30.39000  ?  101 ALA   A HB3  1 
ATOM   1217 N N    . LEU   A 1 98  ? 14.74900 11.38200 36.00500  1.000 22.34478  ?  102 LEU   A N    1 
ATOM   1218 C CA   . LEU   A 1 98  ? 15.68900 10.78600 35.05600  1.000 22.27899  ?  102 LEU   A CA   1 
ATOM   1219 C C    . LEU   A 1 98  ? 15.08200 9.59600  34.32600  1.000 25.25829  ?  102 LEU   A C    1 
ATOM   1220 O O    . LEU   A 1 98  ? 15.35400 8.42900  34.61700  1.000 26.91112  ?  102 LEU   A O    1 
ATOM   1221 C CB   . LEU   A 1 98  ? 16.95500 10.34100 35.76700  1.000 21.53679  ?  102 LEU   A CB   1 
ATOM   1222 C CG   . LEU   A 1 98  ? 17.82100 11.43500 36.34100  1.000 21.19728  ?  102 LEU   A CG   1 
ATOM   1223 C CD1  . LEU   A 1 98  ? 19.01200 10.84500 37.02500  1.000 22.05001  ?  102 LEU   A CD1  1 
ATOM   1224 C CD2  . LEU   A 1 98  ? 18.28500 12.37000 35.25500  1.000 21.27097  ?  102 LEU   A CD2  1 
ATOM   1225 H H    . LEU   A 1 98  ? 14.82800 11.08200 36.80700  1.000 26.86000  ?  102 LEU   A H    1 
ATOM   1226 H HA   . LEU   A 1 98  ? 15.87600 11.47600 34.40000  1.000 26.79000  ?  102 LEU   A HA   1 
ATOM   1227 H HB2  . LEU   A 1 98  ? 16.70000 9.76300  36.50300  1.000 25.89000  ?  102 LEU   A HB2  1 
ATOM   1228 H HB3  . LEU   A 1 98  ? 17.50000 9.84900  35.13200  1.000 25.89000  ?  102 LEU   A HB3  1 
ATOM   1229 H HG   . LEU   A 1 98  ? 17.29900 11.93900 36.98500  1.000 25.48000  ?  102 LEU   A HG   1 
ATOM   1230 H HD11 . LEU   A 1 98  ? 19.53500 11.55900 37.42100  1.000 26.51000  ?  102 LEU   A HD11 1 
ATOM   1231 H HD12 . LEU   A 1 98  ? 18.70900 10.23500 37.71600  1.000 26.51000  ?  102 LEU   A HD12 1 
ATOM   1232 H HD13 . LEU   A 1 98  ? 19.54600 10.36600 36.37200  1.000 26.51000  ?  102 LEU   A HD13 1 
ATOM   1233 H HD21 . LEU   A 1 98  ? 18.96900 12.95700 35.61400  1.000 25.57000  ?  102 LEU   A HD21 1 
ATOM   1234 H HD22 . LEU   A 1 98  ? 18.64900 11.84800 34.52300  1.000 25.57000  ?  102 LEU   A HD22 1 
ATOM   1235 H HD23 . LEU   A 1 98  ? 17.53000 12.89400 34.94500  1.000 25.57000  ?  102 LEU   A HD23 1 
ATOM   1236 N N    . VAL   A 1 99  ? 14.31900 9.90000  33.29300  1.000 25.44252  ?  103 VAL   A N    1 
ATOM   1237 C CA   . VAL   A 1 99  ? 13.71800 8.86000  32.46900  1.000 24.10289  ?  103 VAL   A CA   1 
ATOM   1238 C C    . VAL   A 1 99  ? 14.77800 8.33300  31.51000  1.000 22.29741  ?  103 VAL   A C    1 
ATOM   1239 O O    . VAL   A 1 99  ? 15.85000 8.93900  31.36900  1.000 23.17120  ?  103 VAL   A O    1 
ATOM   1240 C CB   . VAL   A 1 99  ? 12.48600 9.39900  31.73400  1.000 24.38187  ?  103 VAL   A CB   1 
ATOM   1241 C CG1  . VAL   A 1 99  ? 11.41300 9.81600  32.73500  1.000 25.61097  ?  103 VAL   A CG1  1 
ATOM   1242 C CG2  . VAL   A 1 99  ? 12.88200 10.55200 30.85200  1.000 24.09763  ?  103 VAL   A CG2  1 
ATOM   1243 H H    . VAL   A 1 99  ? 14.13300 10.70200 33.04600  1.000 30.58000  ?  103 VAL   A H    1 
ATOM   1244 H HA   . VAL   A 1 99  ? 13.42900 8.11900  33.02400  1.000 28.97000  ?  103 VAL   A HA   1 
ATOM   1245 H HB   . VAL   A 1 99  ? 12.11100 8.70300  31.17300  1.000 29.31000  ?  103 VAL   A HB   1 
ATOM   1246 H HG11 . VAL   A 1 99  ? 10.64100 10.14600 32.25000  1.000 30.78000  ?  103 VAL   A HG11 1 
ATOM   1247 H HG12 . VAL   A 1 99  ? 11.16500 9.04600  33.27000  1.000 30.78000  ?  103 VAL   A HG12 1 
ATOM   1248 H HG13 . VAL   A 1 99  ? 11.76900 10.51400 33.30600  1.000 30.78000  ?  103 VAL   A HG13 1 
ATOM   1249 H HG21 . VAL   A 1 99  ? 12.08500 10.92500 30.44300  1.000 28.97000  ?  103 VAL   A HG21 1 
ATOM   1250 H HG22 . VAL   A 1 99  ? 13.32300 11.22700 31.39200  1.000 28.97000  ?  103 VAL   A HG22 1 
ATOM   1251 H HG23 . VAL   A 1 99  ? 13.48700 10.23100 30.16500  1.000 28.97000  ?  103 VAL   A HG23 1 
ATOM   1252 N N    . PRO   A 1 100 ? 14.53500 7.20300  30.85600  1.000 22.32373  ?  104 PRO   A N    1 
ATOM   1253 C CA   . PRO   A 1 100 ? 15.54800 6.63800  29.95600  1.000 22.32110  ?  104 PRO   A CA   1 
ATOM   1254 C C    . PRO   A 1 100 ? 16.02500 7.63400  28.90700  1.000 21.53942  ?  104 PRO   A C    1 
ATOM   1255 O O    . PRO   A 1 100 ? 15.26000 8.46800  28.40700  1.000 21.99211  ?  104 PRO   A O    1 
ATOM   1256 C CB   . PRO   A 1 100 ? 14.83200 5.43200  29.33800  1.000 23.92392  ?  104 PRO   A CB   1 
ATOM   1257 C CG   . PRO   A 1 100 ? 13.87200 5.00500  30.42000  1.000 24.82403  ?  104 PRO   A CG   1 
ATOM   1258 C CD   . PRO   A 1 100 ? 13.38500 6.29800  31.04100  1.000 23.74232  ?  104 PRO   A CD   1 
ATOM   1259 H HA   . PRO   A 1 100 ? 16.31800 6.33800  30.46500  1.000 26.83000  ?  104 PRO   A HA   1 
ATOM   1260 H HB2  . PRO   A 1 100 ? 14.36100 5.69700  28.53200  1.000 28.76000  ?  104 PRO   A HB2  1 
ATOM   1261 H HB3  . PRO   A 1 100 ? 15.46900 4.73000  29.13400  1.000 28.76000  ?  104 PRO   A HB3  1 
ATOM   1262 H HG2  . PRO   A 1 100 ? 13.13600 4.50800  30.03200  1.000 29.84000  ?  104 PRO   A HG2  1 
ATOM   1263 H HG3  . PRO   A 1 100 ? 14.33400 4.45800  31.07400  1.000 29.84000  ?  104 PRO   A HG3  1 
ATOM   1264 H HD2  . PRO   A 1 100 ? 12.60100 6.63200  30.57700  1.000 28.54000  ?  104 PRO   A HD2  1 
ATOM   1265 H HD3  . PRO   A 1 100 ? 13.18600 6.17700  31.98300  1.000 28.54000  ?  104 PRO   A HD3  1 
ATOM   1266 N N    A TRP   A 1 101 ? 17.31600 7.53300  28.59000  0.400 22.42900  ?  105 TRP   A N    1 
ATOM   1267 N N    C TRP   A 1 101 ? 17.31500 7.54000  28.56100  0.600 22.01317  ?  105 TRP   A N    1 
ATOM   1268 C CA   A TRP   A 1 101 ? 17.98600 8.39800  27.62800  0.400 22.80010  ?  105 TRP   A CA   1 
ATOM   1269 C CA   C TRP   A 1 101 ? 17.96400 8.41200  27.58100  0.600 21.61838  ?  105 TRP   A CA   1 
ATOM   1270 C C    A TRP   A 1 101 ? 18.12500 9.82800  28.12100  0.400 21.21570  ?  105 TRP   A C    1 
ATOM   1271 C C    C TRP   A 1 101 ? 18.12500 9.83100  28.11300  0.600 20.47877  ?  105 TRP   A C    1 
ATOM   1272 O O    A TRP   A 1 101 ? 17.64100 10.77400 27.49400  0.400 21.10779  ?  105 TRP   A O    1 
ATOM   1273 O O    C TRP   A 1 101 ? 17.67000 10.78800 27.48600  0.600 20.30243  ?  105 TRP   A O    1 
ATOM   1274 C CB   A TRP   A 1 101 ? 17.31900 8.31400  26.26200  0.400 26.07681  ?  105 TRP   A CB   1 
ATOM   1275 C CB   C TRP   A 1 101 ? 17.20900 8.39000  26.23600  0.600 24.33186  ?  105 TRP   A CB   1 
ATOM   1276 C CG   A TRP   A 1 101 ? 18.27700 7.74200  25.29400  0.400 30.30890  ?  105 TRP   A CG   1 
ATOM   1277 C CG   C TRP   A 1 101 ? 16.98000 7.01300  25.68300  0.600 28.04810  ?  105 TRP   A CG   1 
ATOM   1278 C CD1  A TRP   A 1 101 ? 18.30200 6.46300  24.82200  0.400 31.65906  ?  105 TRP   A CD1  1 
ATOM   1279 C CD1  C TRP   A 1 101 ? 17.90700 6.18700  25.11800  0.600 30.94582  ?  105 TRP   A CD1  1 
ATOM   1280 C CD2  A TRP   A 1 101 ? 19.37700 8.41800  24.67500  0.400 32.06437  ?  105 TRP   A CD2  1 
ATOM   1281 C CD2  C TRP   A 1 101 ? 15.74300 6.29600  25.66800  0.600 30.42207  ?  105 TRP   A CD2  1 
ATOM   1282 N NE1  A TRP   A 1 101 ? 19.34200 6.30400  23.94400  0.400 32.38020  ?  105 TRP   A NE1  1 
ATOM   1283 N NE1  C TRP   A 1 101 ? 17.32000 4.99900  24.75100  0.600 32.31966  ?  105 TRP   A NE1  1 
ATOM   1284 C CE2  A TRP   A 1 101 ? 20.01600 7.49100  23.83300  0.400 32.82499  ?  105 TRP   A CE2  1 
ATOM   1285 C CE2  C TRP   A 1 101 ? 15.99200 5.04100  25.08000  0.600 31.99331  ?  105 TRP   A CE2  1 
ATOM   1286 C CE3  A TRP   A 1 101 ? 19.87300 9.72200  24.74100  0.400 33.10660  ?  105 TRP   A CE3  1 
ATOM   1287 C CE3  C TRP   A 1 101 ? 14.45000 6.59400  26.09000  0.600 31.76433  ?  105 TRP   A CE3  1 
ATOM   1288 C CZ2  A TRP   A 1 101 ? 21.13200 7.82200  23.06900  0.400 33.62772  ?  105 TRP   A CZ2  1 
ATOM   1289 C CZ2  C TRP   A 1 101 ? 14.99600 4.08400  24.90600  0.600 33.34874  ?  105 TRP   A CZ2  1 
ATOM   1290 C CZ3  A TRP   A 1 101 ? 20.97000 10.04800 23.98400  0.400 33.94354  ?  105 TRP   A CZ3  1 
ATOM   1291 C CZ3  C TRP   A 1 101 ? 13.45300 5.63000  25.92300  0.600 33.27241  ?  105 TRP   A CZ3  1 
ATOM   1292 C CH2  A TRP   A 1 101 ? 21.59500 9.10400  23.16100  0.400 33.94881  ?  105 TRP   A CH2  1 
ATOM   1293 C CH2  C TRP   A 1 101 ? 13.73500 4.39700  25.33500  0.600 33.73036  ?  105 TRP   A CH2  1 
ATOM   1294 H H    A TRP   A 1 101 ? 17.84400 6.94700  28.93300  0.400 26.96000  ?  105 TRP   A H    1 
ATOM   1295 H H    C TRP   A 1 101 ? 17.85400 6.95800  28.89400  0.600 26.46000  ?  105 TRP   A H    1 
ATOM   1296 H HA   A TRP   A 1 101 ? 18.89500 8.07800  27.51600  0.400 27.41000  ?  105 TRP   A HA   1 
ATOM   1297 H HA   C TRP   A 1 101 ? 18.85700 8.07300  27.41200  0.600 25.99000  ?  105 TRP   A HA   1 
ATOM   1298 H HB2  A TRP   A 1 101 ? 16.53800 7.74000  26.31100  0.400 31.34000  ?  105 TRP   A HB2  1 
ATOM   1299 H HB2  C TRP   A 1 101 ? 16.34100 8.80500  26.36000  0.600 29.25000  ?  105 TRP   A HB2  1 
ATOM   1300 H HB3  A TRP   A 1 101 ? 17.06100 9.20100  25.96600  0.400 31.34000  ?  105 TRP   A HB3  1 
ATOM   1301 H HB3  C TRP   A 1 101 ? 17.72500 8.88700  25.58200  0.600 29.25000  ?  105 TRP   A HB3  1 
ATOM   1302 H HD1  A TRP   A 1 101 ? 17.70000 5.79500  25.06100  0.400 38.04000  ?  105 TRP   A HD1  1 
ATOM   1303 H HD1  C TRP   A 1 101 ? 18.80500 6.39600  24.99800  0.600 37.18000  ?  105 TRP   A HD1  1 
ATOM   1304 H HE1  A TRP   A 1 101 ? 19.54000 5.57700  23.53000  0.400 38.91000  ?  105 TRP   A HE1  1 
ATOM   1305 H HE1  C TRP   A 1 101 ? 17.72100 4.33800  24.37500  0.600 38.83000  ?  105 TRP   A HE1  1 
ATOM   1306 H HE3  A TRP   A 1 101 ? 19.46800 10.35600 25.28600  0.400 39.78000  ?  105 TRP   A HE3  1 
ATOM   1307 H HE3  C TRP   A 1 101 ? 14.25400 7.41700  26.47600  0.600 38.16000  ?  105 TRP   A HE3  1 
ATOM   1308 H HZ2  A TRP   A 1 101 ? 21.54500 7.19600  22.52000  0.400 40.40000  ?  105 TRP   A HZ2  1 
ATOM   1309 H HZ2  C TRP   A 1 101 ? 15.18100 3.26200  24.51300  0.600 40.07000  ?  105 TRP   A HZ2  1 
ATOM   1310 H HZ3  A TRP   A 1 101 ? 21.30500 10.91500 24.01900  0.400 40.78000  ?  105 TRP   A HZ3  1 
ATOM   1311 H HZ3  C TRP   A 1 101 ? 12.58700 5.81400  26.20800  0.600 39.98000  ?  105 TRP   A HZ3  1 
ATOM   1312 H HH2  A TRP   A 1 101 ? 22.34100 9.35400  22.66700  0.400 40.79000  ?  105 TRP   A HH2  1 
ATOM   1313 H HH2  C TRP   A 1 101 ? 13.05100 3.77500  25.23200  0.600 40.53000  ?  105 TRP   A HH2  1 
ATOM   1314 N N    . SER   A 1 102 ? 18.77700 9.97100  29.26800  1.000 19.81027  ?  106 SER   A N    1 
ATOM   1315 C CA   . SER   A 1 102 ? 19.09400 11.26800 29.84800  1.000 18.71277  ?  106 SER   A CA   1 
ATOM   1316 C C    . SER   A 1 102 ? 20.60100 11.33600 30.09300  1.000 19.50760  ?  106 SER   A C    1 
ATOM   1317 O O    . SER   A 1 102 ? 21.05100 11.45500 31.22800  1.000 20.61037  ?  106 SER   A O    1 
ATOM   1318 C CB   . SER   A 1 102 ? 18.30000 11.42200 31.13700  1.000 19.08124  ?  106 SER   A CB   1 
ATOM   1319 O OG   . SER   A 1 102 ? 16.90800 11.50700 30.83700  1.000 19.51550  ?  106 SER   A OG   1 
ATOM   1320 H H    A SER   A 1 102 ? 19.05400 9.31000  29.74400  0.400 23.82000  ?  106 SER   A H    1 
ATOM   1321 H H    C SER   A 1 102 ? 19.05100 9.30900  29.74400  0.600 23.82000  ?  106 SER   A H    1 
ATOM   1322 H HA   . SER   A 1 102 ? 18.86200 11.99600 29.24900  1.000 22.51000  ?  106 SER   A HA   1 
ATOM   1323 H HB2  . SER   A 1 102 ? 18.45900 10.65200 31.70500  1.000 22.95000  ?  106 SER   A HB2  1 
ATOM   1324 H HB3  . SER   A 1 102 ? 18.57900 12.23300 31.59000  1.000 22.95000  ?  106 SER   A HB3  1 
ATOM   1325 H HG   . SER   A 1 102 ? 16.63700 10.77700 30.52100  1.000 23.47000  ?  106 SER   A HG   1 
ATOM   1326 N N    . PRO   A 1 103 ? 21.41100 11.23700 29.03600  1.000 19.76816  ?  107 PRO   A N    1 
ATOM   1327 C CA   . PRO   A 1 103 ? 22.86500 11.05700 29.23000  1.000 20.73933  ?  107 PRO   A CA   1 
ATOM   1328 C C    . PRO   A 1 103 ? 23.57900 12.24100 29.85000  1.000 21.12622  ?  107 PRO   A C    1 
ATOM   1329 O O    . PRO   A 1 103 ? 24.63200 12.04100 30.47400  1.000 22.54481  ?  107 PRO   A O    1 
ATOM   1330 C CB   . PRO   A 1 103 ? 23.37700 10.78500 27.80900  1.000 22.15266  ?  107 PRO   A CB   1 
ATOM   1331 C CG   . PRO   A 1 103 ? 22.36400 11.41500 26.91500  1.000 22.06317  ?  107 PRO   A CG   1 
ATOM   1332 C CD   . PRO   A 1 103 ? 21.04600 11.21700 27.61400  1.000 20.81829  ?  107 PRO   A CD   1 
ATOM   1333 H HA   . PRO   A 1 103 ? 23.01000 10.28100 29.79400  1.000 24.94000  ?  107 PRO   A HA   1 
ATOM   1334 H HB2  . PRO   A 1 103 ? 24.25000 11.19100 27.68700  1.000 26.63000  ?  107 PRO   A HB2  1 
ATOM   1335 H HB3  . PRO   A 1 103 ? 23.43100 9.82900  27.65400  1.000 26.63000  ?  107 PRO   A HB3  1 
ATOM   1336 H HG2  . PRO   A 1 103 ? 22.56100 12.35900 26.80800  1.000 26.52000  ?  107 PRO   A HG2  1 
ATOM   1337 H HG3  . PRO   A 1 103 ? 22.36700 10.97600 26.05100  1.000 26.52000  ?  107 PRO   A HG3  1 
ATOM   1338 H HD2  . PRO   A 1 103 ? 20.43300 11.93900 27.40400  1.000 25.03000  ?  107 PRO   A HD2  1 
ATOM   1339 H HD3  . PRO   A 1 103 ? 20.65100 10.36500 27.37100  1.000 25.03000  ?  107 PRO   A HD3  1 
ATOM   1340 N N    . ILE   A 1 104 ? 23.09100 13.46200 29.66000  1.000 19.45760  ?  108 ILE   A N    1 
ATOM   1341 C CA   . ILE   A 1 104 ? 23.71900 14.62700 30.27000  1.000 17.93110  ?  108 ILE   A CA   1 
ATOM   1342 C C    . ILE   A 1 104 ? 23.15000 14.89000 31.65200  1.000 18.14691  ?  108 ILE   A C    1 
ATOM   1343 O O    . ILE   A 1 104 ? 23.88900 15.02200 32.63400  1.000 18.64434  ?  108 ILE   A O    1 
ATOM   1344 C CB   . ILE   A 1 104 ? 23.59900 15.87700 29.37400  1.000 19.52603  ?  108 ILE   A CB   1 
ATOM   1345 C CG1  . ILE   A 1 104 ? 24.14900 15.61300 27.95800  1.000 20.13926  ?  108 ILE   A CG1  1 
ATOM   1346 C CG2  . ILE   A 1 104 ? 24.29900 17.06200 30.03800  1.000 20.63932  ?  108 ILE   A CG2  1 
ATOM   1347 C CD1  . ILE   A 1 104 ? 25.63300 15.24700 27.89500  1.000 21.42625  ?  108 ILE   A CD1  1 
ATOM   1348 H H    . ILE   A 1 104 ? 22.39800 13.64100 29.18200  1.000 23.40000  ?  108 ILE   A H    1 
ATOM   1349 H HA   . ILE   A 1 104 ? 24.66600 14.43400 30.35500  1.000 21.57000  ?  108 ILE   A HA   1 
ATOM   1350 H HB   . ILE   A 1 104 ? 22.65900 16.09000 29.27200  1.000 23.48000  ?  108 ILE   A HB   1 
ATOM   1351 H HG12 . ILE   A 1 104 ? 23.65100 14.87700 27.56800  1.000 24.22000  ?  108 ILE   A HG12 1 
ATOM   1352 H HG13 . ILE   A 1 104 ? 24.02400 16.41500 27.42600  1.000 24.22000  ?  108 ILE   A HG13 1 
ATOM   1353 H HG21 . ILE   A 1 104 ? 24.39800 17.77500 29.38700  1.000 24.82000  ?  108 ILE   A HG21 1 
ATOM   1354 H HG22 . ILE   A 1 104 ? 23.76200 17.36800 30.78500  1.000 24.82000  ?  108 ILE   A HG22 1 
ATOM   1355 H HG23 . ILE   A 1 104 ? 25.17200 16.77800 30.35200  1.000 24.82000  ?  108 ILE   A HG23 1 
ATOM   1356 H HD11 . ILE   A 1 104 ? 25.90200 15.18000 26.96500  1.000 25.76000  ?  108 ILE   A HD11 1 
ATOM   1357 H HD12 . ILE   A 1 104 ? 26.14700 15.93900 28.34000  1.000 25.76000  ?  108 ILE   A HD12 1 
ATOM   1358 H HD13 . ILE   A 1 104 ? 25.76700 14.39700 28.34100  1.000 25.76000  ?  108 ILE   A HD13 1 
ATOM   1359 N N    A SER   A 1 105 ? 21.82000 14.93700 31.77500  0.810 18.86805  ?  109 SER   A N    1 
ATOM   1360 N N    B SER   A 1 105 ? 21.81700 14.95800 31.74100  0.190 18.30219  ?  109 SER   A N    1 
ATOM   1361 C CA   A SER   A 1 105 ? 21.22900 15.30000 33.05800  0.810 19.08387  ?  109 SER   A CA   1 
ATOM   1362 C CA   B SER   A 1 105 ? 21.16100 15.24900 33.01000  0.190 18.34694  ?  109 SER   A CA   1 
ATOM   1363 C C    A SER   A 1 105 ? 21.53700 14.27400 34.15000  0.810 18.63118  ?  109 SER   A C    1 
ATOM   1364 C C    B SER   A 1 105 ? 21.62300 14.30200 34.10800  0.190 18.13112  ?  109 SER   A C    1 
ATOM   1365 O O    A SER   A 1 105 ? 21.59300 14.62000 35.33400  0.810 18.29430  ?  109 SER   A O    1 
ATOM   1366 O O    B SER   A 1 105 ? 21.83800 14.72100 35.25100  0.190 17.55737  ?  109 SER   A O    1 
ATOM   1367 C CB   A SER   A 1 105 ? 19.72500 15.51900 32.90900  0.810 19.13650  ?  109 SER   A CB   1 
ATOM   1368 C CB   B SER   A 1 105 ? 19.64300 15.14100 32.85300  0.190 18.61276  ?  109 SER   A CB   1 
ATOM   1369 O OG   A SER   A 1 105 ? 19.10200 14.39800 32.33800  0.810 17.97058  ?  109 SER   A OG   1 
ATOM   1370 O OG   B SER   A 1 105 ? 19.13200 16.09600 31.94300  0.190 18.82594  ?  109 SER   A OG   1 
ATOM   1371 H H    A SER   A 1 105 ? 21.25700 14.76700 31.14700  0.810 22.69000  ?  109 SER   A H    1 
ATOM   1372 H H    B SER   A 1 105 ? 21.27600 14.84000 31.08200  0.190 22.01000  ?  109 SER   A H    1 
ATOM   1373 H HA   A SER   A 1 105 ? 21.61500 16.14200 33.34600  0.810 22.95000  ?  109 SER   A HA   1 
ATOM   1374 H HA   B SER   A 1 105 ? 21.38800 16.15600 33.26800  0.190 22.07000  ?  109 SER   A HA   1 
ATOM   1375 H HB2  A SER   A 1 105 ? 19.34200 15.67800 33.78600  0.810 23.01000  ?  109 SER   A HB2  1 
ATOM   1376 H HB2  B SER   A 1 105 ? 19.42700 14.25400 32.52600  0.190 22.39000  ?  109 SER   A HB2  1 
ATOM   1377 H HB3  A SER   A 1 105 ? 19.57400 16.28700 32.33600  0.810 23.01000  ?  109 SER   A HB3  1 
ATOM   1378 H HB3  B SER   A 1 105 ? 19.23000 15.28500 33.71900  0.190 22.39000  ?  109 SER   A HB3  1 
ATOM   1379 H HG   A SER   A 1 105 ? 19.41300 14.25700 31.57000  0.810 21.62000  ?  109 SER   A HG   1 
ATOM   1380 H HG   B SER   A 1 105 ? 18.29300 16.05400 31.92200  0.190 22.64000  ?  109 SER   A HG   1 
ATOM   1381 N N    . GLU   A 1 106 ? 21.77400 13.01500 33.78400  1.000 18.24692  ?  110 GLU   A N    1 
ATOM   1382 C CA   . GLU   A 1 106 ? 22.14400 12.04300 34.80200  1.000 19.22862  ?  110 GLU   A CA   1 
ATOM   1383 C C    . GLU   A 1 106 ? 23.49900 12.34900 35.43700  1.000 18.52064  ?  110 GLU   A C    1 
ATOM   1384 O O    . GLU   A 1 106 ? 23.72900 11.94500 36.58100  1.000 19.08124  ?  110 GLU   A O    1 
ATOM   1385 C CB   . GLU   A 1 106 ? 22.12600 10.62700 34.24400  1.000 21.93947  ?  110 GLU   A CB   1 
ATOM   1386 C CG   . GLU   A 1 106 ? 23.22700 10.35100 33.25500  1.000 24.49504  ?  110 GLU   A CG   1 
ATOM   1387 C CD   . GLU   A 1 106 ? 23.12900 8.99200  32.61000  1.000 26.97165  ?  110 GLU   A CD   1 
ATOM   1388 O OE1  . GLU   A 1 106 ? 22.08200 8.32300  32.73600  1.000 27.02166  ?  110 GLU   A OE1  1 
ATOM   1389 O OE2  . GLU   A 1 106 ? 24.11700 8.59300  31.95700  1.000 29.55091  -1 110 GLU   A OE2  1 
ATOM   1390 H H    A GLU   A 1 106 ? 21.72900 12.71100 32.98100  0.810 21.95000  ?  110 GLU   A H    1 
ATOM   1391 H H    B GLU   A 1 106 ? 21.67000 12.69000 32.99500  0.190 21.95000  ?  110 GLU   A H    1 
ATOM   1392 H HA   . GLU   A 1 106 ? 21.47600 12.08000 35.50400  1.000 23.12000  ?  110 GLU   A HA   1 
ATOM   1393 H HB2  . GLU   A 1 106 ? 22.22300 10.00100 34.97800  1.000 26.38000  ?  110 GLU   A HB2  1 
ATOM   1394 H HB3  . GLU   A 1 106 ? 21.28000 10.48100 33.79300  1.000 26.38000  ?  110 GLU   A HB3  1 
ATOM   1395 H HG2  . GLU   A 1 106 ? 23.19000 11.01700 32.55000  1.000 29.44000  ?  110 GLU   A HG2  1 
ATOM   1396 H HG3  . GLU   A 1 106 ? 24.08000 10.40000 33.71400  1.000 29.44000  ?  110 GLU   A HG3  1 
ATOM   1397 N N    A LYS   A 1 107 ? 24.38400 13.05100 34.72700  0.510 17.86793  ?  111 LYS   A N    1 
ATOM   1398 N N    B LYS   A 1 107 ? 24.38400 13.05800 34.72900  0.490 17.94689  ?  111 LYS   A N    1 
ATOM   1399 C CA   A LYS   A 1 107 ? 25.69800 13.39200 35.25300  0.510 18.18113  ?  111 LYS   A CA   1 
ATOM   1400 C CA   B LYS   A 1 107 ? 25.70600 13.40500 35.23200  0.490 18.26008  ?  111 LYS   A CA   1 
ATOM   1401 C C    A LYS   A 1 107 ? 25.66700 14.59300 36.18200  0.510 17.63633  ?  111 LYS   A C    1 
ATOM   1402 C C    B LYS   A 1 107 ? 25.69500 14.64200 36.11400  0.490 17.72581  ?  111 LYS   A C    1 
ATOM   1403 O O    A LYS   A 1 107 ? 26.65200 14.82100 36.89200  0.510 17.67844  ?  111 LYS   A O    1 
ATOM   1404 O O    B LYS   A 1 107 ? 26.72300 14.94600 36.72700  0.490 17.99953  ?  111 LYS   A O    1 
ATOM   1405 C CB   A LYS   A 1 107 ? 26.66800 13.68400 34.10900  0.510 19.44444  ?  111 LYS   A CB   1 
ATOM   1406 C CB   B LYS   A 1 107 ? 26.66200 13.64000 34.06100  0.490 19.45760  ?  111 LYS   A CB   1 
ATOM   1407 C CG   A LYS   A 1 107 ? 26.73000 12.61000 33.03400  0.510 20.63932  ?  111 LYS   A CG   1 
ATOM   1408 C CG   B LYS   A 1 107 ? 26.95100 12.40200 33.22000  0.490 20.52615  ?  111 LYS   A CG   1 
ATOM   1409 C CD   A LYS   A 1 107 ? 27.07000 11.25900 33.62000  0.510 21.81841  ?  111 LYS   A CD   1 
ATOM   1410 C CD   B LYS   A 1 107 ? 27.43400 12.76600 31.81700  0.490 21.49731  ?  111 LYS   A CD   1 
ATOM   1411 C CE   A LYS   A 1 107 ? 27.15200 10.17900 32.55300  0.510 22.62640  ?  111 LYS   A CE   1 
ATOM   1412 C CE   B LYS   A 1 107 ? 27.73000 11.51300 30.99000  0.490 22.31057  ?  111 LYS   A CE   1 
ATOM   1413 N NZ   A LYS   A 1 107 ? 27.07900 8.82800  33.15900  0.510 23.19752  ?  111 LYS   A NZ   1 
ATOM   1414 N NZ   B LYS   A 1 107 ? 26.57100 10.57400 30.86200  0.490 23.42912  ?  111 LYS   A NZ   1 
ATOM   1415 H H    A LYS   A 1 107 ? 24.24200 13.34200 33.93000  0.510 21.49000  ?  111 LYS   A H    1 
ATOM   1416 H H    B LYS   A 1 107 ? 24.23400 13.35400 33.93500  0.490 21.58000  ?  111 LYS   A H    1 
ATOM   1417 H HA   A LYS   A 1 107 ? 26.03200 12.62800 35.74900  0.510 21.86000  ?  111 LYS   A HA   1 
ATOM   1418 H HA   B LYS   A 1 107 ? 26.04100 12.66200 35.75800  0.490 21.96000  ?  111 LYS   A HA   1 
ATOM   1419 H HB2  A LYS   A 1 107 ? 26.39700 14.51100 33.67900  0.510 23.38000  ?  111 LYS   A HB2  1 
ATOM   1420 H HB2  B LYS   A 1 107 ? 26.27400 14.30800 33.47500  0.490 23.40000  ?  111 LYS   A HB2  1 
ATOM   1421 H HB3  A LYS   A 1 107 ? 27.56000 13.77900 34.47800  0.510 23.38000  ?  111 LYS   A HB3  1 
ATOM   1422 H HB3  B LYS   A 1 107 ? 27.50900 13.95800 34.41300  0.490 23.40000  ?  111 LYS   A HB3  1 
ATOM   1423 H HG2  A LYS   A 1 107 ? 25.86700 12.54400 32.59600  0.510 24.82000  ?  111 LYS   A HG2  1 
ATOM   1424 H HG2  B LYS   A 1 107 ? 27.64200 11.87600 33.65200  0.490 24.68000  ?  111 LYS   A HG2  1 
ATOM   1425 H HG3  A LYS   A 1 107 ? 27.41400 12.84300 32.38700  0.510 24.82000  ?  111 LYS   A HG3  1 
ATOM   1426 H HG3  B LYS   A 1 107 ? 26.13900 11.87700 33.13500  0.490 24.68000  ?  111 LYS   A HG3  1 
ATOM   1427 H HD2  A LYS   A 1 107 ? 27.93000 11.31100 34.06500  0.510 26.23000  ?  111 LYS   A HD2  1 
ATOM   1428 H HD2  B LYS   A 1 107 ? 26.74700 13.27700 31.36200  0.490 25.85000  ?  111 LYS   A HD2  1 
ATOM   1429 H HD3  A LYS   A 1 107 ? 26.38300 11.00400 34.25600  0.510 26.23000  ?  111 LYS   A HD3  1 
ATOM   1430 H HD3  B LYS   A 1 107 ? 28.24900 13.28900 31.88200  0.490 25.85000  ?  111 LYS   A HD3  1 
ATOM   1431 H HE2  A LYS   A 1 107 ? 26.41100 10.27900 31.93400  0.510 27.20000  ?  111 LYS   A HE2  1 
ATOM   1432 H HE2  B LYS   A 1 107 ? 27.98700 11.78600 30.09500  0.490 26.82000  ?  111 LYS   A HE2  1 
ATOM   1433 H HE3  A LYS   A 1 107 ? 27.99400 10.25700 32.07800  0.510 27.20000  ?  111 LYS   A HE3  1 
ATOM   1434 H HE3  B LYS   A 1 107 ? 28.45600 11.02800 31.41100  0.490 26.82000  ?  111 LYS   A HE3  1 
ATOM   1435 H HZ1  A LYS   A 1 107 ? 27.12300 8.20700  32.52400  0.510 27.88000  ?  111 LYS   A HZ1  1 
ATOM   1436 H HZ1  B LYS   A 1 107 ? 26.81900 9.84400  30.41700  0.490 28.16000  ?  111 LYS   A HZ1  1 
ATOM   1437 H HZ2  A LYS   A 1 107 ? 27.75600 8.71200  33.72500  0.510 27.88000  ?  111 LYS   A HZ2  1 
ATOM   1438 H HZ2  B LYS   A 1 107 ? 26.28100 10.33600 31.66900  0.490 28.16000  ?  111 LYS   A HZ2  1 
ATOM   1439 H HZ3  A LYS   A 1 107 ? 26.31300 8.73500  33.60200  0.510 27.88000  ?  111 LYS   A HZ3  1 
ATOM   1440 H HZ3  B LYS   A 1 107 ? 25.90600 10.96800 30.42100  0.490 28.16000  ?  111 LYS   A HZ3  1 
ATOM   1441 N N    . TYR   A 1 108 ? 24.56400 15.34500 36.20600  1.000 17.44420  ?  112 TYR   A N    1 
ATOM   1442 C CA   . TYR   A 1 108 ? 24.41800 16.54500 37.02100  1.000 17.17048  ?  112 TYR   A CA   1 
ATOM   1443 C C    . TYR   A 1 108 ? 23.25100 16.41300 37.98700  1.000 18.44168  ?  112 TYR   A C    1 
ATOM   1444 O O    . TYR   A 1 108 ? 22.79900 17.41300 38.54500  1.000 18.53906  ?  112 TYR   A O    1 
ATOM   1445 C CB   . TYR   A 1 108 ? 24.25500 17.78900 36.13500  1.000 16.74148  ?  112 TYR   A CB   1 
ATOM   1446 C CG   . TYR   A 1 108 ? 25.48200 18.04500 35.24500  1.000 17.44946  ?  112 TYR   A CG   1 
ATOM   1447 C CD1  . TYR   A 1 108 ? 25.61700 17.40600 34.02200  1.000 17.57316  ?  112 TYR   A CD1  1 
ATOM   1448 C CD2  . TYR   A 1 108 ? 26.49700 18.91300 35.63200  1.000 17.23891  ?  112 TYR   A CD2  1 
ATOM   1449 C CE1  . TYR   A 1 108 ? 26.72600 17.60300 33.21000  1.000 17.03889  ?  112 TYR   A CE1  1 
ATOM   1450 C CE2  . TYR   A 1 108 ? 27.62100 19.12900 34.80500  1.000 17.10205  ?  112 TYR   A CE2  1 
ATOM   1451 C CZ   . TYR   A 1 108 ? 27.70700 18.48000 33.59600  1.000 16.31775  ?  112 TYR   A CZ   1 
ATOM   1452 O OH   . TYR   A 1 108 ? 28.79900 18.65100 32.74500  1.000 18.12849  ?  112 TYR   A OH   1 
ATOM   1453 H H    A TYR   A 1 108 ? 23.86200 15.17000 35.74100  0.510 20.98000  ?  112 TYR   A H    1 
ATOM   1454 H H    B TYR   A 1 108 ? 23.84100 15.13600 35.78900  0.490 20.98000  ?  112 TYR   A H    1 
ATOM   1455 H HA   . TYR   A 1 108 ? 25.22300 16.67400 37.54500  1.000 20.66000  ?  112 TYR   A HA   1 
ATOM   1456 H HB2  . TYR   A 1 108 ? 23.48500 17.66800 35.55800  1.000 20.14000  ?  112 TYR   A HB2  1 
ATOM   1457 H HB3  . TYR   A 1 108 ? 24.12600 18.56600 36.70100  1.000 20.14000  ?  112 TYR   A HB3  1 
ATOM   1458 H HD1  . TYR   A 1 108 ? 24.94600 16.82900 33.73800  1.000 21.14000  ?  112 TYR   A HD1  1 
ATOM   1459 H HD2  . TYR   A 1 108 ? 26.43500 19.35800 36.44600  1.000 20.74000  ?  112 TYR   A HD2  1 
ATOM   1460 H HE1  . TYR   A 1 108 ? 26.80300 17.14200 32.40600  1.000 20.50000  ?  112 TYR   A HE1  1 
ATOM   1461 H HE2  . TYR   A 1 108 ? 28.29800 19.70700 35.07600  1.000 20.57000  ?  112 TYR   A HE2  1 
ATOM   1462 H HH   . TYR   A 1 108 ? 29.37300 19.14400 33.11000  1.000 21.81000  ?  112 TYR   A HH   1 
ATOM   1463 N N    . LEU   A 1 109 ? 22.80200 15.18400 38.23200  1.000 19.61288  ?  113 LEU   A N    1 
ATOM   1464 C CA   . LEU   A 1 109 ? 21.70700 14.96200 39.16800  1.000 19.38127  ?  113 LEU   A CA   1 
ATOM   1465 C C    . LEU   A 1 109 ? 22.00600 15.58400 40.51900  1.000 18.25482  ?  113 LEU   A C    1 
ATOM   1466 O O    . LEU   A 1 109 ? 21.11600 16.16600 41.16000  1.000 17.82319  ?  113 LEU   A O    1 
ATOM   1467 C CB   . LEU   A 1 109 ? 21.49400 13.46100 39.34100  1.000 19.18388  ?  113 LEU   A CB   1 
ATOM   1468 C CG   . LEU   A 1 109 ? 20.48300 13.02600 40.39700  1.000 20.17084  ?  113 LEU   A CG   1 
ATOM   1469 C CD1  . LEU   A 1 109 ? 19.10400 13.50300 40.02300  1.000 20.67880  ?  113 LEU   A CD1  1 
ATOM   1470 C CD2  . LEU   A 1 109 ? 20.53500 11.53100 40.58200  1.000 22.06844  ?  113 LEU   A CD2  1 
ATOM   1471 H H    . LEU   A 1 109 ? 23.11200 14.46700 37.87100  1.000 23.59000  ?  113 LEU   A H    1 
ATOM   1472 H HA   . LEU   A 1 109 ? 20.90000 15.36600 38.81200  1.000 23.31000  ?  113 LEU   A HA   1 
ATOM   1473 H HB2  . LEU   A 1 109 ? 21.19100 13.10200 38.49300  1.000 23.07000  ?  113 LEU   A HB2  1 
ATOM   1474 H HB3  . LEU   A 1 109 ? 22.34500 13.06400 39.58400  1.000 23.07000  ?  113 LEU   A HB3  1 
ATOM   1475 H HG   . LEU   A 1 109 ? 20.70100 13.42700 41.25200  1.000 24.25000  ?  113 LEU   A HG   1 
ATOM   1476 H HD11 . LEU   A 1 109 ? 18.46300 13.14500 40.65700  1.000 24.87000  ?  113 LEU   A HD11 1 
ATOM   1477 H HD12 . LEU   A 1 109 ? 19.08800 14.47200 40.04700  1.000 24.87000  ?  113 LEU   A HD12 1 
ATOM   1478 H HD13 . LEU   A 1 109 ? 18.89400 13.19100 39.12900  1.000 24.87000  ?  113 LEU   A HD13 1 
ATOM   1479 H HD21 . LEU   A 1 109 ? 19.90400 11.27600 41.27300  1.000 26.53000  ?  113 LEU   A HD21 1 
ATOM   1480 H HD22 . LEU   A 1 109 ? 20.30100 11.10100 39.74500  1.000 26.53000  ?  113 LEU   A HD22 1 
ATOM   1481 H HD23 . LEU   A 1 109 ? 21.43400 11.27700 40.84500  1.000 26.53000  ?  113 LEU   A HD23 1 
ATOM   1482 N N    . THR   A 1 110 ? 23.24000 15.42900 40.99200  1.000 19.04439  ?  114 THR   A N    1 
ATOM   1483 C CA   . THR   A 1 110 ? 23.58000 15.87500 42.32900  1.000 18.88384  ?  114 THR   A CA   1 
ATOM   1484 C C    . THR   A 1 110 ? 23.95400 17.34700 42.38100  1.000 18.59697  ?  114 THR   A C    1 
ATOM   1485 O O    . THR   A 1 110 ? 24.25700 17.85300 43.46400  1.000 20.35770  ?  114 THR   A O    1 
ATOM   1486 C CB   . THR   A 1 110 ? 24.73200 15.03600 42.88100  1.000 20.25243  ?  114 THR   A CB   1 
ATOM   1487 O OG1  . THR   A 1 110 ? 25.81700 15.03500 41.93900  1.000 19.59709  ?  114 THR   A OG1  1 
ATOM   1488 C CG2  . THR   A 1 110 ? 24.28800 13.61000 43.14400  1.000 20.58142  ?  114 THR   A CG2  1 
ATOM   1489 H H    . THR   A 1 110 ? 23.88900 15.07100 40.55700  1.000 22.90000  ?  114 THR   A H    1 
ATOM   1490 H HA   . THR   A 1 110 ? 22.81100 15.74400 42.90500  1.000 22.71000  ?  114 THR   A HA   1 
ATOM   1491 H HB   . THR   A 1 110 ? 25.03000 15.41500 43.72200  1.000 24.35000  ?  114 THR   A HB   1 
ATOM   1492 H HG1  . THR   A 1 110 ? 25.61300 14.57700 41.26500  1.000 23.57000  ?  114 THR   A HG1  1 
ATOM   1493 H HG21 . THR   A 1 110 ? 25.02500 13.09500 43.50800  1.000 24.75000  ?  114 THR   A HG21 1 
ATOM   1494 H HG22 . THR   A 1 110 ? 23.55500 13.60200 43.77900  1.000 24.75000  ?  114 THR   A HG22 1 
ATOM   1495 H HG23 . THR   A 1 110 ? 23.99300 13.19600 42.31700  1.000 24.75000  ?  114 THR   A HG23 1 
ATOM   1496 N N    . THR   A 1 111 ? 23.96500 18.03600 41.24500  1.000 18.35483  ?  115 THR   A N    1 
ATOM   1497 C CA   . THR   A 1 111 ? 24.35200 19.43500 41.19100  1.000 17.87320  ?  115 THR   A CA   1 
ATOM   1498 C C    . THR   A 1 111 ? 23.29900 20.36900 40.61300  1.000 18.19429  ?  115 THR   A C    1 
ATOM   1499 O O    . THR   A 1 111 ? 23.30400 21.55600 40.94500  1.000 19.06281  ?  115 THR   A O    1 
ATOM   1500 C CB   . THR   A 1 111 ? 25.62900 19.61700 40.34900  1.000 17.27049  ?  115 THR   A CB   1 
ATOM   1501 O OG1  . THR   A 1 111 ? 25.40800 19.27200 38.97800  1.000 17.76002  ?  115 THR   A OG1  1 
ATOM   1502 C CG2  . THR   A 1 111 ? 26.75300 18.73300 40.86700  1.000 18.69435  ?  115 THR   A CG2  1 
ATOM   1503 H H    . THR   A 1 111 ? 23.74900 17.70700 40.48100  1.000 22.07000  ?  115 THR   A H    1 
ATOM   1504 H HA   . THR   A 1 111 ? 24.53200 19.71300 42.10300  1.000 21.50000  ?  115 THR   A HA   1 
ATOM   1505 H HB   . THR   A 1 111 ? 25.88500 20.55000 40.41000  1.000 20.77000  ?  115 THR   A HB   1 
ATOM   1506 H HG1  . THR   A 1 111 ? 24.83500 19.78600 38.64200  1.000 21.36000  ?  115 THR   A HG1  1 
ATOM   1507 H HG21 . THR   A 1 111 ? 27.55100 18.86300 40.33100  1.000 22.49000  ?  115 THR   A HG21 1 
ATOM   1508 H HG22 . THR   A 1 111 ? 26.95400 18.95900 41.78900  1.000 22.49000  ?  115 THR   A HG22 1 
ATOM   1509 H HG23 . THR   A 1 111 ? 26.49100 17.80100 40.82100  1.000 22.49000  ?  115 THR   A HG23 1 
ATOM   1510 N N    . GLY   A 1 112 ? 22.41800 19.87600 39.75800  1.000 17.23365  ?  116 GLY   A N    1 
ATOM   1511 C CA   . GLY   A 1 112 ? 21.56000 20.73100 38.96400  1.000 17.73107  ?  116 GLY   A CA   1 
ATOM   1512 C C    . GLY   A 1 112 ? 22.24500 21.19000 37.68200  1.000 17.07310  ?  116 GLY   A C    1 
ATOM   1513 O O    . GLY   A 1 112 ? 23.45400 21.02900 37.48800  1.000 17.48631  ?  116 GLY   A O    1 
ATOM   1514 H H    . GLY   A 1 112 ? 22.29700 19.03600 39.62000  1.000 20.73000  ?  116 GLY   A H    1 
ATOM   1515 H HA2  . GLY   A 1 112 ? 20.75400 20.24700 38.72500  1.000 21.33000  ?  116 GLY   A HA2  1 
ATOM   1516 H HA3  . GLY   A 1 112 ? 21.31700 21.51500 39.48100  1.000 21.33000  ?  116 GLY   A HA3  1 
ATOM   1517 N N    A MET   A 1 113 ? 21.44200 21.78400 36.79200  0.500 18.41273  ?  117 MET   A N    1 
ATOM   1518 N N    B MET   A 1 113 ? 21.43200 21.75700 36.78100  0.500 17.66264  ?  117 MET   A N    1 
ATOM   1519 C CA   A MET   A 1 113 ? 21.92900 22.37200 35.55200  0.500 19.07071  ?  117 MET   A CA   1 
ATOM   1520 C CA   B MET   A 1 113 ? 21.87700 22.34000 35.52100  0.500 17.62053  ?  117 MET   A CA   1 
ATOM   1521 C C    A MET   A 1 113 ? 21.08400 23.59200 35.22400  0.500 18.62592  ?  117 MET   A C    1 
ATOM   1522 C C    B MET   A 1 113 ? 21.12200 23.65100 35.32800  0.500 18.21797  ?  117 MET   A C    1 
ATOM   1523 O O    A MET   A 1 113 ? 19.89900 23.65100 35.56600  0.500 17.55737  ?  117 MET   A O    1 
ATOM   1524 O O    B MET   A 1 113 ? 20.04300 23.85300 35.89400  0.500 18.02585  ?  117 MET   A O    1 
ATOM   1525 C CB   A MET   A 1 113 ? 21.80400 21.40200 34.37900  0.500 20.28664  ?  117 MET   A CB   1 
ATOM   1526 C CB   B MET   A 1 113 ? 21.59000 21.39400 34.33700  0.500 17.46262  ?  117 MET   A CB   1 
ATOM   1527 C CG   A MET   A 1 113 ? 22.71800 20.21300 34.44700  0.500 20.98936  ?  117 MET   A CG   1 
ATOM   1528 C CG   B MET   A 1 113 ? 22.19100 19.98700 34.47300  0.500 16.55198  ?  117 MET   A CG   1 
ATOM   1529 S SD   A MET   A 1 113 ? 22.48500 19.10600 33.04500  0.500 22.23951  ?  117 MET   A SD   1 
ATOM   1530 S SD   B MET   A 1 113 ? 21.65700 18.82100 33.18000  0.500 17.76266  ?  117 MET   A SD   1 
ATOM   1531 C CE   A MET   A 1 113 ? 22.73400 20.16900 31.63400  0.500 23.87655  ?  117 MET   A CE   1 
ATOM   1532 C CE   B MET   A 1 113 ? 21.96100 19.76400 31.69900  0.500 18.35483  ?  117 MET   A CE   1 
ATOM   1533 H H    A MET   A 1 113 ? 20.59100 21.85900 36.89100  0.500 22.15000  ?  117 MET   A H    1 
ATOM   1534 H H    B MET   A 1 113 ? 20.58100 21.81500 36.88600  0.500 21.25000  ?  117 MET   A H    1 
ATOM   1535 H HA   A MET   A 1 113 ? 22.86000 22.61600 35.67700  0.500 22.93000  ?  117 MET   A HA   1 
ATOM   1536 H HA   B MET   A 1 113 ? 22.83200 22.50700 35.54800  0.500 21.19000  ?  117 MET   A HA   1 
ATOM   1537 H HB2  A MET   A 1 113 ? 20.89300 21.06900 34.35000  0.500 24.39000  ?  117 MET   A HB2  1 
ATOM   1538 H HB2  B MET   A 1 113 ? 20.62900 21.29400 34.25000  0.500 21.01000  ?  117 MET   A HB2  1 
ATOM   1539 H HB3  A MET   A 1 113 ? 22.00800 21.88100 33.56000  0.500 24.39000  ?  117 MET   A HB3  1 
ATOM   1540 H HB3  B MET   A 1 113 ? 21.95600 21.79100 33.53100  0.500 21.01000  ?  117 MET   A HB3  1 
ATOM   1541 H HG2  A MET   A 1 113 ? 23.63900 20.51800 34.44400  0.500 25.23000  ?  117 MET   A HG2  1 
ATOM   1542 H HG2  B MET   A 1 113 ? 23.15800 20.05500 34.42500  0.500 19.91000  ?  117 MET   A HG2  1 
ATOM   1543 H HG3  A MET   A 1 113 ? 22.53600 19.71700 35.26000  0.500 25.23000  ?  117 MET   A HG3  1 
ATOM   1544 H HG3  B MET   A 1 113 ? 21.92600 19.61700 35.33000  0.500 19.91000  ?  117 MET   A HG3  1 
ATOM   1545 H HE1  A MET   A 1 113 ? 22.67300 19.63800 30.82400  0.500 28.70000  ?  117 MET   A HE1  1 
ATOM   1546 H HE1  B MET   A 1 113 ? 21.84400 19.18800 30.92700  0.500 22.07000  ?  117 MET   A HE1  1 
ATOM   1547 H HE2  A MET   A 1 113 ? 22.05000 20.85600 31.63200  0.500 28.70000  ?  117 MET   A HE2  1 
ATOM   1548 H HE2  B MET   A 1 113 ? 21.33300 20.50200 31.65900  0.500 22.07000  ?  117 MET   A HE2  1 
ATOM   1549 H HE3  A MET   A 1 113 ? 23.61200 20.57600 31.69600  0.500 28.70000  ?  117 MET   A HE3  1 
ATOM   1550 H HE3  B MET   A 1 113 ? 22.86900 20.10500 31.72200  0.500 22.07000  ?  117 MET   A HE3  1 
ATOM   1551 N N    . THR   A 1 114 ? 21.67500 24.54400 34.51100  1.000 18.45221  ?  118 THR   A N    1 
ATOM   1552 C CA   . THR   A 1 114 ? 20.91000 25.73200 34.14200  1.000 18.66540  ?  118 THR   A CA   1 
ATOM   1553 C C    . THR   A 1 114 ? 19.90600 25.43000 33.01700  1.000 18.19429  ?  118 THR   A C    1 
ATOM   1554 O O    . THR   A 1 114 ? 20.00700 24.43000 32.29100  1.000 17.44683  ?  118 THR   A O    1 
ATOM   1555 C CB   . THR   A 1 114 ? 21.79800 26.88100 33.69900  1.000 19.99187  ?  118 THR   A CB   1 
ATOM   1556 O OG1  . THR   A 1 114 ? 22.34900 26.56400 32.42500  1.000 20.26296  ?  118 THR   A OG1  1 
ATOM   1557 C CG2  . THR   A 1 114 ? 22.92900 27.13300 34.70900  1.000 21.41573  ?  118 THR   A CG2  1 
ATOM   1558 H H    A THR   A 1 114 ? 22.49000 24.52800 34.23800  0.500 22.19000  ?  118 THR   A H    1 
ATOM   1559 H H    B THR   A 1 114 ? 22.46300 24.48700 34.17000  0.500 22.19000  ?  118 THR   A H    1 
ATOM   1560 H HA   . THR   A 1 114 ? 20.42800 26.01200 34.93500  1.000 22.45000  ?  118 THR   A HA   1 
ATOM   1561 H HB   . THR   A 1 114 ? 21.27700 27.69700 33.64300  1.000 24.04000  ?  118 THR   A HB   1 
ATOM   1562 H HG1  . THR   A 1 114 ? 22.80000 27.21200 32.13800  1.000 24.37000  ?  118 THR   A HG1  1 
ATOM   1563 H HG21 . THR   A 1 114 ? 23.42900 27.92500 34.45600  1.000 25.75000  ?  118 THR   A HG21 1 
ATOM   1564 H HG22 . THR   A 1 114 ? 22.55900 27.26500 35.59600  1.000 25.75000  ?  118 THR   A HG22 1 
ATOM   1565 H HG23 . THR   A 1 114 ? 23.53100 26.37300 34.72900  1.000 25.75000  ?  118 THR   A HG23 1 
ATOM   1566 N N    . VAL   A 1 115 ? 18.92400 26.33300 32.87800  1.000 18.80489  ?  119 VAL   A N    1 
ATOM   1567 C CA   . VAL   A 1 115 ? 17.95200 26.23300 31.79000  1.000 19.07334  ?  119 VAL   A CA   1 
ATOM   1568 C C    . VAL   A 1 115 ? 18.66500 26.17000 30.44600  1.000 19.00754  ?  119 VAL   A C    1 
ATOM   1569 O O    . VAL   A 1 115 ? 18.30100 25.37400 29.57300  1.000 19.23652  ?  119 VAL   A O    1 
ATOM   1570 C CB   . VAL   A 1 115 ? 16.92400 27.38600 31.84600  1.000 19.68394  ?  119 VAL   A CB   1 
ATOM   1571 C CG1  . VAL   A 1 115 ? 16.08500 27.44700 30.54900  1.000 19.87607  ?  119 VAL   A CG1  1 
ATOM   1572 C CG2  . VAL   A 1 115 ? 16.02100 27.24000 33.07100  1.000 20.56036  ?  119 VAL   A CG2  1 
ATOM   1573 H H    . VAL   A 1 115 ? 18.80300 27.00800 33.39700  1.000 22.61000  ?  119 VAL   A H    1 
ATOM   1574 H HA   . VAL   A 1 115 ? 17.45600 25.40800 31.90600  1.000 22.94000  ?  119 VAL   A HA   1 
ATOM   1575 H HB   . VAL   A 1 115 ? 17.40600 28.22400 31.92400  1.000 23.67000  ?  119 VAL   A HB   1 
ATOM   1576 H HG11 . VAL   A 1 115 ? 15.31400 28.01700 30.69800  1.000 23.90000  ?  119 VAL   A HG11 1 
ATOM   1577 H HG12 . VAL   A 1 115 ? 16.63300 27.81200 29.83600  1.000 23.90000  ?  119 VAL   A HG12 1 
ATOM   1578 H HG13 . VAL   A 1 115 ? 15.79500 26.55100 30.31700  1.000 23.90000  ?  119 VAL   A HG13 1 
ATOM   1579 H HG21 . VAL   A 1 115 ? 15.38200 27.97000 33.08200  1.000 24.72000  ?  119 VAL   A HG21 1 
ATOM   1580 H HG22 . VAL   A 1 115 ? 15.55200 26.39200 33.01900  1.000 24.72000  ?  119 VAL   A HG22 1 
ATOM   1581 H HG23 . VAL   A 1 115 ? 16.56700 27.26700 33.87200  1.000 24.72000  ?  119 VAL   A HG23 1 
ATOM   1582 N N    . ALA   A 1 116 ? 19.68500 27.01600 30.25000  1.000 19.23389  ?  120 ALA   A N    1 
ATOM   1583 C CA   . ALA   A 1 116 ? 20.43300 26.96900 28.99800  1.000 19.27336  ?  120 ALA   A CA   1 
ATOM   1584 C C    . ALA   A 1 116 ? 21.13400 25.62200 28.81700  1.000 19.06544  ?  120 ALA   A C    1 
ATOM   1585 O O    . ALA   A 1 116 ? 21.18200 25.08000 27.70300  1.000 19.51813  ?  120 ALA   A O    1 
ATOM   1586 C CB   . ALA   A 1 116 ? 21.45400 28.10300 28.96700  1.000 20.47088  ?  120 ALA   A CB   1 
ATOM   1587 H H    . ALA   A 1 116 ? 19.95300 27.60800 30.81300  1.000 23.13000  ?  120 ALA   A H    1 
ATOM   1588 H HA   . ALA   A 1 116 ? 19.81600 27.08900 28.26000  1.000 23.18000  ?  120 ALA   A HA   1 
ATOM   1589 H HB1  . ALA   A 1 116 ? 22.07100 27.95300 28.23300  1.000 24.61000  ?  120 ALA   A HB1  1 
ATOM   1590 H HB2  . ALA   A 1 116 ? 20.98800 28.94500 28.84100  1.000 24.61000  ?  120 ALA   A HB2  1 
ATOM   1591 H HB3  . ALA   A 1 116 ? 21.93800 28.11600 29.80800  1.000 24.61000  ?  120 ALA   A HB3  1 
ATOM   1592 N N    . GLU   A 1 117 ? 21.72200 25.08300 29.89400  1.000 18.60486  ?  121 GLU   A N    1 
ATOM   1593 C CA   . GLU   A 1 117 ? 22.37700 23.78100 29.80000  1.000 18.42326  ?  121 GLU   A CA   1 
ATOM   1594 C C    . GLU   A 1 117 ? 21.37200 22.67800 29.50100  1.000 17.58369  ?  121 GLU   A C    1 
ATOM   1595 O O    . GLU   A 1 117 ? 21.66000 21.75800 28.72900  1.000 18.11007  ?  121 GLU   A O    1 
ATOM   1596 C CB   . GLU   A 1 117 ? 23.14200 23.49300 31.09000  1.000 18.79436  ?  121 GLU   A CB   1 
ATOM   1597 C CG   . GLU   A 1 117 ? 24.36600 24.38100 31.26200  1.000 18.80225  ?  121 GLU   A CG   1 
ATOM   1598 C CD   . GLU   A 1 117 ? 25.12300 24.04400 32.50900  1.000 20.85250  ?  121 GLU   A CD   1 
ATOM   1599 O OE1  . GLU   A 1 117 ? 24.52700 23.86100 33.58700  1.000 20.70248  ?  121 GLU   A OE1  1 
ATOM   1600 O OE2  . GLU   A 1 117 ? 26.35900 23.93800 32.40800  1.000 22.46059  -1 121 GLU   A OE2  1 
ATOM   1601 H H    . GLU   A 1 117 ? 21.75400 25.44600 30.67200  1.000 22.38000  ?  121 GLU   A H    1 
ATOM   1602 H HA   . GLU   A 1 117 ? 23.01800 23.79900 29.07200  1.000 22.16000  ?  121 GLU   A HA   1 
ATOM   1603 H HB2  . GLU   A 1 117 ? 22.55300 23.64400 31.84600  1.000 22.60000  ?  121 GLU   A HB2  1 
ATOM   1604 H HB3  . GLU   A 1 117 ? 23.43900 22.57000 31.08000  1.000 22.60000  ?  121 GLU   A HB3  1 
ATOM   1605 H HG2  . GLU   A 1 117 ? 24.95800 24.26000 30.50300  1.000 22.61000  ?  121 GLU   A HG2  1 
ATOM   1606 H HG3  . GLU   A 1 117 ? 24.08400 25.30700 31.31800  1.000 22.61000  ?  121 GLU   A HG3  1 
ATOM   1607 N N    . LEU   A 1 118 ? 20.18900 22.73800 30.11200  1.000 17.65212  ?  122 LEU   A N    1 
ATOM   1608 C CA   . LEU   A 1 118 ? 19.16200 21.75200 29.78800  1.000 17.41525  ?  122 LEU   A CA   1 
ATOM   1609 C C    . LEU   A 1 118 ? 18.74500 21.86500 28.32500  1.000 17.40472  ?  122 LEU   A C    1 
ATOM   1610 O O    . LEU   A 1 118 ? 18.52700 20.85400 27.65700  1.000 17.10205  ?  122 LEU   A O    1 
ATOM   1611 C CB   . LEU   A 1 118 ? 17.96200 21.95100 30.70700  1.000 17.90478  ?  122 LEU   A CB   1 
ATOM   1612 C CG   . LEU   A 1 118 ? 18.18300 21.61000 32.17700  1.000 19.13914  ?  122 LEU   A CG   1 
ATOM   1613 C CD1  . LEU   A 1 118 ? 16.98200 22.11400 32.94700  1.000 20.13662  ?  122 LEU   A CD1  1 
ATOM   1614 C CD2  . LEU   A 1 118 ? 18.35300 20.13600 32.37400  1.000 19.69973  ?  122 LEU   A CD2  1 
ATOM   1615 H H    . LEU   A 1 118 ? 19.96200 23.32300 30.70100  1.000 21.23000  ?  122 LEU   A H    1 
ATOM   1616 H HA   . LEU   A 1 118 ? 19.51200 20.85900 29.93200  1.000 20.95000  ?  122 LEU   A HA   1 
ATOM   1617 H HB2  . LEU   A 1 118 ? 17.69900 22.88400 30.66500  1.000 21.54000  ?  122 LEU   A HB2  1 
ATOM   1618 H HB3  . LEU   A 1 118 ? 17.23900 21.38800 30.38700  1.000 21.54000  ?  122 LEU   A HB3  1 
ATOM   1619 H HG   . LEU   A 1 118 ? 18.99500 22.02700 32.50400  1.000 23.02000  ?  122 LEU   A HG   1 
ATOM   1620 H HD11 . LEU   A 1 118 ? 17.07000 21.85200 33.87600  1.000 24.21000  ?  122 LEU   A HD11 1 
ATOM   1621 H HD12 . LEU   A 1 118 ? 16.94600 23.08100 32.87800  1.000 24.21000  ?  122 LEU   A HD12 1 
ATOM   1622 H HD13 . LEU   A 1 118 ? 16.17800 21.72600 32.56800  1.000 24.21000  ?  122 LEU   A HD13 1 
ATOM   1623 H HD21 . LEU   A 1 118 ? 18.51800 19.96000 33.31400  1.000 23.69000  ?  122 LEU   A HD21 1 
ATOM   1624 H HD22 . LEU   A 1 118 ? 17.54300 19.68400 32.09100  1.000 23.69000  ?  122 LEU   A HD22 1 
ATOM   1625 H HD23 . LEU   A 1 118 ? 19.10600 19.83100 31.84300  1.000 23.69000  ?  122 LEU   A HD23 1 
ATOM   1626 N N    . SER   A 1 119 ? 18.64800 23.09200 27.81600  1.000 17.64948  ?  123 SER   A N    1 
ATOM   1627 C CA   . SER   A 1 119 ? 18.27600 23.29000 26.41700  1.000 17.95215  ?  123 SER   A CA   1 
ATOM   1628 C C    . SER   A 1 119 ? 19.34000 22.71600 25.48900  1.000 17.17048  ?  123 SER   A C    1 
ATOM   1629 O O    . SER   A 1 119 ? 19.03200 22.00400 24.52600  1.000 17.38366  ?  123 SER   A O    1 
ATOM   1630 C CB   . SER   A 1 119 ? 18.07200 24.77500 26.13200  1.000 18.46800  ?  123 SER   A CB   1 
ATOM   1631 O OG   . SER   A 1 119 ? 16.99800 25.29700 26.90300  1.000 19.29968  ?  123 SER   A OG   1 
ATOM   1632 H H    . SER   A 1 119 ? 18.79100 23.81800 28.25400  1.000 21.23000  ?  123 SER   A H    1 
ATOM   1633 H HA   . SER   A 1 119 ? 17.43800 22.83200 26.24800  1.000 21.59000  ?  123 SER   A HA   1 
ATOM   1634 H HB2  . SER   A 1 119 ? 18.88500 25.25400 26.35800  1.000 22.21000  ?  123 SER   A HB2  1 
ATOM   1635 H HB3  . SER   A 1 119 ? 17.87000 24.89100 25.19100  1.000 22.21000  ?  123 SER   A HB3  1 
ATOM   1636 H HG   . SER   A 1 119 ? 17.16600 25.21500 27.72200  1.000 23.21000  ?  123 SER   A HG   1 
ATOM   1637 N N    . ALA   A 1 120 ? 20.61100 23.00200 25.78000  1.000 17.59685  ?  124 ALA   A N    1 
ATOM   1638 C CA   . ALA   A 1 120 ? 21.68100 22.43100 24.96800  1.000 18.34167  ?  124 ALA   A CA   1 
ATOM   1639 C C    . ALA   A 1 120 ? 21.66100 20.90700 25.02600  1.000 17.56000  ?  124 ALA   A C    1 
ATOM   1640 O O    . ALA   A 1 120 ? 21.87500 20.23600 24.01300  1.000 18.56275  ?  124 ALA   A O    1 
ATOM   1641 C CB   . ALA   A 1 120 ? 23.05100 22.97800 25.40400  1.000 19.69710  ?  124 ALA   A CB   1 
ATOM   1642 H H    . ALA   A 1 120 ? 20.87200 23.50900 26.42300  1.000 21.17000  ?  124 ALA   A H    1 
ATOM   1643 H HA   . ALA   A 1 120 ? 21.54500 22.70100 24.04700  1.000 22.06000  ?  124 ALA   A HA   1 
ATOM   1644 H HB1  . ALA   A 1 120 ? 23.74300 22.56200 24.86700  1.000 23.68000  ?  124 ALA   A HB1  1 
ATOM   1645 H HB2  . ALA   A 1 120 ? 23.06400 23.93900 25.27300  1.000 23.68000  ?  124 ALA   A HB2  1 
ATOM   1646 H HB3  . ALA   A 1 120 ? 23.19000 22.77100 26.34100  1.000 23.68000  ?  124 ALA   A HB3  1 
ATOM   1647 N N    . ALA   A 1 121 ? 21.41400 20.33600 26.20800  1.000 17.58106  ?  125 ALA   A N    1 
ATOM   1648 C CA   . ALA   A 1 121 ? 21.40000 18.88200 26.32300  1.000 17.25996  ?  125 ALA   A CA   1 
ATOM   1649 C C    . ALA   A 1 121 ? 20.22300 18.27300 25.57100  1.000 16.63094  ?  125 ALA   A C    1 
ATOM   1650 O O    . ALA   A 1 121 ? 20.35800 17.21700 24.93700  1.000 17.19417  ?  125 ALA   A O    1 
ATOM   1651 C CB   . ALA   A 1 121 ? 21.30400 18.46600 27.79100  1.000 17.46262  ?  125 ALA   A CB   1 
ATOM   1652 H H    . ALA   A 1 121 ? 21.25700 20.75900 26.93900  1.000 21.15000  ?  125 ALA   A H    1 
ATOM   1653 H HA   . ALA   A 1 121 ? 22.22900 18.54900 25.94700  1.000 20.76000  ?  125 ALA   A HA   1 
ATOM   1654 H HB1  . ALA   A 1 121 ? 21.29800 17.49700 27.84500  1.000 21.00000  ?  125 ALA   A HB1  1 
ATOM   1655 H HB2  . ALA   A 1 121 ? 22.07000 18.81900 28.27000  1.000 21.00000  ?  125 ALA   A HB2  1 
ATOM   1656 H HB3  . ALA   A 1 121 ? 20.48500 18.82300 28.16800  1.000 21.00000  ?  125 ALA   A HB3  1 
ATOM   1657 N N    . ALA   A 1 122 ? 19.04600 18.91500 25.64200  1.000 16.56514  ?  126 ALA   A N    1 
ATOM   1658 C CA   . ALA   A 1 122 ? 17.88800 18.42700 24.89400  1.000 17.09415  ?  126 ALA   A CA   1 
ATOM   1659 C C    . ALA   A 1 122 ? 18.14500 18.45100 23.39300  1.000 16.13878  ?  126 ALA   A C    1 
ATOM   1660 O O    . ALA   A 1 122 ? 17.76100 17.52000 22.67600  1.000 16.71253  ?  126 ALA   A O    1 
ATOM   1661 C CB   . ALA   A 1 122 ? 16.66000 19.27400 25.20300  1.000 16.95730  ?  126 ALA   A CB   1 
ATOM   1662 H H    . ALA   A 1 122 ? 18.89800 19.62300 26.10900  1.000 19.93000  ?  126 ALA   A H    1 
ATOM   1663 H HA   . ALA   A 1 122 ? 17.71800 17.51400 25.17200  1.000 20.56000  ?  126 ALA   A HA   1 
ATOM   1664 H HB1  . ALA   A 1 122 ? 15.90300 18.92400 24.70800  1.000 20.40000  ?  126 ALA   A HB1  1 
ATOM   1665 H HB2  . ALA   A 1 122 ? 16.48000 19.23300 26.15500  1.000 20.40000  ?  126 ALA   A HB2  1 
ATOM   1666 H HB3  . ALA   A 1 122 ? 16.83400 20.19100 24.93800  1.000 20.40000  ?  126 ALA   A HB3  1 
ATOM   1667 N N    . VAL   A 1 123 ? 18.82000 19.49200 22.90000  1.000 16.52567  ?  127 VAL   A N    1 
ATOM   1668 C CA   . VAL   A 1 123 ? 19.06600 19.60200 21.46600  1.000 16.34143  ?  127 VAL   A CA   1 
ATOM   1669 C C    . VAL   A 1 123 ? 20.19900 18.68600 21.03000  1.000 17.00993  ?  127 VAL   A C    1 
ATOM   1670 O O    . VAL   A 1 123 ? 20.08700 17.97100 20.03200  1.000 17.66791  ?  127 VAL   A O    1 
ATOM   1671 C CB   . VAL   A 1 123 ? 19.35100 21.06600 21.07200  1.000 16.79675  ?  127 VAL   A CB   1 
ATOM   1672 C CG1  . VAL   A 1 123 ? 19.77700 21.17200 19.59300  1.000 17.40209  ?  127 VAL   A CG1  1 
ATOM   1673 C CG2  . VAL   A 1 123 ? 18.12200 21.94200 21.37300  1.000 18.07322  ?  127 VAL   A CG2  1 
ATOM   1674 H H    . VAL   A 1 123 ? 19.14100 20.13700 23.36900  1.000 19.88000  ?  127 VAL   A H    1 
ATOM   1675 H HA   . VAL   A 1 123 ? 18.26000 19.31800 21.00800  1.000 19.66000  ?  127 VAL   A HA   1 
ATOM   1676 H HB   . VAL   A 1 123 ? 20.09300 21.39800 21.60200  1.000 20.21000  ?  127 VAL   A HB   1 
ATOM   1677 H HG11 . VAL   A 1 123 ? 19.67900 22.09200 19.30200  1.000 20.93000  ?  127 VAL   A HG11 1 
ATOM   1678 H HG12 . VAL   A 1 123 ? 20.70300 20.89600 19.51000  1.000 20.93000  ?  127 VAL   A HG12 1 
ATOM   1679 H HG13 . VAL   A 1 123 ? 19.21000 20.59400 19.05900  1.000 20.93000  ?  127 VAL   A HG13 1 
ATOM   1680 H HG21 . VAL   A 1 123 ? 18.30500 22.85100 21.08800  1.000 21.74000  ?  127 VAL   A HG21 1 
ATOM   1681 H HG22 . VAL   A 1 123 ? 17.35800 21.59100 20.88900  1.000 21.74000  ?  127 VAL   A HG22 1 
ATOM   1682 H HG23 . VAL   A 1 123 ? 17.94700 21.92300 22.32700  1.000 21.74000  ?  127 VAL   A HG23 1 
ATOM   1683 N N    . GLN   A 1 124 ? 21.31500 18.71000 21.76100  1.000 17.42841  ?  128 GLN   A N    1 
ATOM   1684 C CA   . GLN   A 1 124 ? 22.57200 18.16200 21.25400  1.000 17.81266  ?  128 GLN   A CA   1 
ATOM   1685 C C    . GLN   A 1 124 ? 22.79400 16.71300 21.64600  1.000 17.85477  ?  128 GLN   A C    1 
ATOM   1686 O O    . GLN   A 1 124 ? 23.58000 16.01800 20.98400  1.000 17.97058  ?  128 GLN   A O    1 
ATOM   1687 C CB   . GLN   A 1 124 ? 23.74400 19.01200 21.75700  1.000 19.42338  ?  128 GLN   A CB   1 
ATOM   1688 C CG   . GLN   A 1 124 ? 23.63200 20.44600 21.30700  1.000 20.26822  ?  128 GLN   A CG   1 
ATOM   1689 C CD   . GLN   A 1 124 ? 24.78800 21.30900 21.73100  1.000 22.26056  ?  128 GLN   A CD   1 
ATOM   1690 O OE1  . GLN   A 1 124 ? 25.36600 21.11800 22.80700  1.000 25.50306  ?  128 GLN   A OE1  1 
ATOM   1691 N NE2  . GLN   A 1 124 ? 25.10300 22.29700 20.90800  1.000 22.63692  ?  128 GLN   A NE2  1 
ATOM   1692 H H    . GLN   A 1 124 ? 21.37000 19.03900 22.55300  1.000 20.96000  ?  128 GLN   A H    1 
ATOM   1693 H HA   . GLN   A 1 124 ? 22.56500 18.20000 20.28500  1.000 21.42000  ?  128 GLN   A HA   1 
ATOM   1694 H HB2  . GLN   A 1 124 ? 23.75500 18.99800 22.72700  1.000 23.36000  ?  128 GLN   A HB2  1 
ATOM   1695 H HB3  . GLN   A 1 124 ? 24.57300 18.64800 21.41100  1.000 23.36000  ?  128 GLN   A HB3  1 
ATOM   1696 H HG2  . GLN   A 1 124 ? 23.58900 20.46600 20.33800  1.000 24.37000  ?  128 GLN   A HG2  1 
ATOM   1697 H HG3  . GLN   A 1 124 ? 22.82400 20.82900 21.68300  1.000 24.37000  ?  128 GLN   A HG3  1 
ATOM   1698 H HE21 . GLN   A 1 124 ? 24.65600 22.41200 20.18300  1.000 27.21000  ?  128 GLN   A HE21 1 
ATOM   1699 H HE22 . GLN   A 1 124 ? 25.75600 22.82300 21.09900  1.000 27.21000  ?  128 GLN   A HE22 1 
ATOM   1700 N N    . TYR   A 1 125 ? 22.15800 16.26300 22.72300  1.000 18.56012  ?  129 TYR   A N    1 
ATOM   1701 C CA   . TYR   A 1 125 ? 22.21000 14.88400 23.18000  1.000 17.96794  ?  129 TYR   A CA   1 
ATOM   1702 C C    . TYR   A 1 125 ? 20.82700 14.25800 23.27200  1.000 17.61264  ?  129 TYR   A C    1 
ATOM   1703 O O    . TYR   A 1 125 ? 20.71600 13.10800 23.71200  1.000 18.38642  ?  129 TYR   A O    1 
ATOM   1704 C CB   . TYR   A 1 125 ? 22.93000 14.80300 24.53300  1.000 18.84963  ?  129 TYR   A CB   1 
ATOM   1705 C CG   . TYR   A 1 125 ? 24.39700 15.13600 24.41100  1.000 20.19979  ?  129 TYR   A CG   1 
ATOM   1706 C CD1  . TYR   A 1 125 ? 24.83400 16.43900 24.51000  1.000 21.76314  ?  129 TYR   A CD1  1 
ATOM   1707 C CD2  . TYR   A 1 125 ? 25.32900 14.14700 24.16600  1.000 21.99737  ?  129 TYR   A CD2  1 
ATOM   1708 C CE1  . TYR   A 1 125 ? 26.16500 16.75700 24.38400  1.000 23.23436  ?  129 TYR   A CE1  1 
ATOM   1709 C CE2  . TYR   A 1 125 ? 26.67700 14.46000 24.04000  1.000 22.29215  ?  129 TYR   A CE2  1 
ATOM   1710 C CZ   . TYR   A 1 125 ? 27.06800 15.76900 24.13100  1.000 24.10815  ?  129 TYR   A CZ   1 
ATOM   1711 O OH   . TYR   A 1 125 ? 28.40100 16.09300 24.00400  1.000 26.21104  ?  129 TYR   A OH   1 
ATOM   1712 H H    . TYR   A 1 125 ? 21.67000 16.76100 23.22600  1.000 22.32000  ?  129 TYR   A H    1 
ATOM   1713 H HA   . TYR   A 1 125 ? 22.72900 14.35300 22.55700  1.000 21.61000  ?  129 TYR   A HA   1 
ATOM   1714 H HB2  . TYR   A 1 125 ? 22.52600 15.43400 25.14800  1.000 22.67000  ?  129 TYR   A HB2  1 
ATOM   1715 H HB3  . TYR   A 1 125 ? 22.85100 13.90200 24.88300  1.000 22.67000  ?  129 TYR   A HB3  1 
ATOM   1716 H HD1  . TYR   A 1 125 ? 24.21600 17.11700 24.66400  1.000 26.17000  ?  129 TYR   A HD1  1 
ATOM   1717 H HD2  . TYR   A 1 125 ? 25.05200 13.26300 24.08400  1.000 26.45000  ?  129 TYR   A HD2  1 
ATOM   1718 H HE1  . TYR   A 1 125 ? 26.44700 17.63900 24.47100  1.000 27.93000  ?  129 TYR   A HE1  1 
ATOM   1719 H HE2  . TYR   A 1 125 ? 27.30600 13.78900 23.89700  1.000 26.80000  ?  129 TYR   A HE2  1 
ATOM   1720 H HH   . TYR   A 1 125 ? 28.85200 15.40100 23.85600  1.000 31.50000  ?  129 TYR   A HH   1 
ATOM   1721 N N    . SER   A 1 126 ? 19.78000 14.98700 22.87300  1.000 17.42051  ?  130 SER   A N    1 
ATOM   1722 C CA   . SER   A 1 126 ? 18.41800 14.47600 22.88100  1.000 16.66252  ?  130 SER   A CA   1 
ATOM   1723 C C    . SER   A 1 126 ? 17.98200 14.05700 24.28300  1.000 16.98888  ?  130 SER   A C    1 
ATOM   1724 O O    . SER   A 1 126 ? 17.16400 13.14600 24.44300  1.000 17.73371  ?  130 SER   A O    1 
ATOM   1725 C CB   . SER   A 1 126 ? 18.27100 13.32400 21.88500  1.000 17.34418  ?  130 SER   A CB   1 
ATOM   1726 O OG   . SER   A 1 126 ? 16.98200 13.39500 21.28900  1.000 17.10468  ?  130 SER   A OG   1 
ATOM   1727 H H    . SER   A 1 126 ? 19.84000 15.79700 22.58800  1.000 20.95000  ?  130 SER   A H    1 
ATOM   1728 H HA   . SER   A 1 126 ? 17.81500 15.18400 22.60600  1.000 20.05000  ?  130 SER   A HA   1 
ATOM   1729 H HB2  . SER   A 1 126 ? 18.95000 13.40200 21.19700  1.000 20.86000  ?  130 SER   A HB2  1 
ATOM   1730 H HB3  . SER   A 1 126 ? 18.36600 12.47900 22.35100  1.000 20.86000  ?  130 SER   A HB3  1 
ATOM   1731 H HG   . SER   A 1 126 ? 16.93000 12.85200 20.65100  1.000 20.58000  ?  130 SER   A HG   1 
ATOM   1732 N N    . ASP   A 1 127 ? 18.51600 14.72700 25.29900  1.000 16.91255  ?  131 ASP   A N    1 
ATOM   1733 C CA   . ASP   A 1 127 ? 18.27900 14.35000 26.68900  1.000 16.24405  ?  131 ASP   A CA   1 
ATOM   1734 C C    . ASP   A 1 127 ? 16.79000 14.42700 27.05500  1.000 16.17299  ?  131 ASP   A C    1 
ATOM   1735 O O    . ASP   A 1 127 ? 16.16700 15.49400 26.96500  1.000 16.91519  ?  131 ASP   A O    1 
ATOM   1736 C CB   . ASP   A 1 127 ? 19.11800 15.29200 27.55300  1.000 16.29932  ?  131 ASP   A CB   1 
ATOM   1737 C CG   . ASP   A 1 127 ? 19.26000 14.82300 28.97400  1.000 17.48104  ?  131 ASP   A CG   1 
ATOM   1738 O OD1  . ASP   A 1 127 ? 18.26700 14.86400 29.73800  1.000 17.60737  ?  131 ASP   A OD1  1 
ATOM   1739 O OD2  . ASP   A 1 127 ? 20.39100 14.42000 29.35100  1.000 17.61527  -1 131 ASP   A OD2  1 
ATOM   1740 H H    . ASP   A 1 127 ? 19.02700 15.41400 25.21000  1.000 20.34000  ?  131 ASP   A H    1 
ATOM   1741 H HA   . ASP   A 1 127 ? 18.53900 13.42900 26.84400  1.000 19.54000  ?  131 ASP   A HA   1 
ATOM   1742 H HB2  . ASP   A 1 127 ? 20.00700 15.36000 27.17200  1.000 19.61000  ?  131 ASP   A HB2  1 
ATOM   1743 H HB3  . ASP   A 1 127 ? 18.69600 16.16500 27.56800  1.000 19.61000  ?  131 ASP   A HB3  1 
ATOM   1744 N N    . ASN   A 1 128 ? 16.23500 13.30400 27.52900  1.000 16.00192  ?  132 ASN   A N    1 
ATOM   1745 C CA   . ASN   A 1 128 ? 14.78800 13.23800 27.78900  1.000 15.99402  ?  132 ASN   A CA   1 
ATOM   1746 C C    . ASN   A 1 128 ? 14.38400 13.90800 29.10400  1.000 16.55725  ?  132 ASN   A C    1 
ATOM   1747 O O    . ASN   A 1 128 ? 13.37200 14.62100 29.14800  1.000 16.86518  ?  132 ASN   A O    1 
ATOM   1748 C CB   . ASN   A 1 128 ? 14.33300 11.78100 27.81600  1.000 15.96244  ?  132 ASN   A CB   1 
ATOM   1749 C CG   . ASN   A 1 128 ? 13.92500 11.27000 26.44400  1.000 15.71767  ?  132 ASN   A CG   1 
ATOM   1750 O OD1  . ASN   A 1 128 ? 13.53000 12.05500 25.58200  1.000 17.12047  ?  132 ASN   A OD1  1 
ATOM   1751 N ND2  . ASN   A 1 128 ? 14.03400 9.96400  26.23100  1.000 16.02034  ?  132 ASN   A ND2  1 
ATOM   1752 H H    . ASN   A 1 128 ? 16.66400 12.58000 27.70600  1.000 19.25000  ?  132 ASN   A H    1 
ATOM   1753 H HA   . ASN   A 1 128 ? 14.34300 13.70700 27.06700  1.000 19.24000  ?  132 ASN   A HA   1 
ATOM   1754 H HB2  . ASN   A 1 128 ? 15.06200 11.22800 28.13900  1.000 19.21000  ?  132 ASN   A HB2  1 
ATOM   1755 H HB3  . ASN   A 1 128 ? 13.56800 11.69900 28.40700  1.000 19.21000  ?  132 ASN   A HB3  1 
ATOM   1756 H HD21 . ASN   A 1 128 ? 13.81400 9.63300  25.46900  1.000 19.27000  ?  132 ASN   A HD21 1 
ATOM   1757 H HD22 . ASN   A 1 128 ? 14.32400 9.45000  26.85600  1.000 19.27000  ?  132 ASN   A HD22 1 
ATOM   1758 N N    . ALA   A 1 129 ? 15.15500 13.72200 30.18500  1.000 16.47829  ?  133 ALA   A N    1 
ATOM   1759 C CA   . ALA   A 1 129 ? 14.84700 14.44600 31.41400  1.000 17.23101  ?  133 ALA   A CA   1 
ATOM   1760 C C    . ALA   A 1 129 ? 14.90000 15.94800 31.18100  1.000 16.93361  ?  133 ALA   A C    1 
ATOM   1761 O O    . ALA   A 1 129 ? 14.03000 16.69500 31.64400  1.000 17.07573  ?  133 ALA   A O    1 
ATOM   1762 C CB   . ALA   A 1 129 ? 15.83000 14.04600 32.51900  1.000 18.13639  ?  133 ALA   A CB   1 
ATOM   1763 H H    . ALA   A 1 129 ? 15.83700 13.19900 30.22700  1.000 19.82000  ?  133 ALA   A H    1 
ATOM   1764 H HA   . ALA   A 1 129 ? 13.95300 14.21000 31.70500  1.000 20.73000  ?  133 ALA   A HA   1 
ATOM   1765 H HB1  . ALA   A 1 129 ? 15.61300 14.53600 33.32800  1.000 21.81000  ?  133 ALA   A HB1  1 
ATOM   1766 H HB2  . ALA   A 1 129 ? 15.75400 13.09300 32.68000  1.000 21.81000  ?  133 ALA   A HB2  1 
ATOM   1767 H HB3  . ALA   A 1 129 ? 16.73200 14.26200 32.23400  1.000 21.81000  ?  133 ALA   A HB3  1 
ATOM   1768 N N    . ALA   A 1 130 ? 15.92800 16.41600 30.47100  1.000 16.64673  ?  134 ALA   A N    1 
ATOM   1769 C CA   . ALA   A 1 130 ? 16.01800 17.84300 30.17800  1.000 16.68884  ?  134 ALA   A CA   1 
ATOM   1770 C C    . ALA   A 1 130 ? 14.77800 18.31600 29.42800  1.000 17.10731  ?  134 ALA   A C    1 
ATOM   1771 O O    . ALA   A 1 130 ? 14.23700 19.39200 29.70500  1.000 17.18101  ?  134 ALA   A O    1 
ATOM   1772 C CB   . ALA   A 1 130 ? 17.28700 18.14200 29.36900  1.000 16.56778  ?  134 ALA   A CB   1 
ATOM   1773 H H    . ALA   A 1 130 ? 16.57100 15.93900 30.15600  1.000 20.03000  ?  134 ALA   A H    1 
ATOM   1774 H HA   . ALA   A 1 130 ? 16.07800 18.33400 31.01200  1.000 20.08000  ?  134 ALA   A HA   1 
ATOM   1775 H HB1  . ALA   A 1 130 ? 17.34800 19.09800 29.21900  1.000 19.93000  ?  134 ALA   A HB1  1 
ATOM   1776 H HB2  . ALA   A 1 130 ? 18.06000 17.83600 29.87000  1.000 19.93000  ?  134 ALA   A HB2  1 
ATOM   1777 H HB3  . ALA   A 1 130 ? 17.23700 17.67600 28.52000  1.000 19.93000  ?  134 ALA   A HB3  1 
ATOM   1778 N N    . ALA   A 1 131 ? 14.32600 17.52700 28.45800  1.000 17.10468  ?  135 ALA   A N    1 
ATOM   1779 C CA   . ALA   A 1 131 ? 13.15400 17.93100 27.68700  1.000 17.10995  ?  135 ALA   A CA   1 
ATOM   1780 C C    . ALA   A 1 131 ? 11.91400 18.03700 28.56700  1.000 16.95993  ?  135 ALA   A C    1 
ATOM   1781 O O    . ALA   A 1 131 ? 11.12800 18.98100 28.43400  1.000 17.24944  ?  135 ALA   A O    1 
ATOM   1782 C CB   . ALA   A 1 131 ? 12.93700 16.94800 26.54800  1.000 16.63357  ?  135 ALA   A CB   1 
ATOM   1783 H H    . ALA   A 1 131 ? 14.67000 16.77200 28.23100  1.000 20.57000  ?  135 ALA   A H    1 
ATOM   1784 H HA   . ALA   A 1 131 ? 13.31000 18.80900 27.30400  1.000 20.58000  ?  135 ALA   A HA   1 
ATOM   1785 H HB1  . ALA   A 1 131 ? 12.14600 17.20900 26.05100  1.000 20.01000  ?  135 ALA   A HB1  1 
ATOM   1786 H HB2  . ALA   A 1 131 ? 13.71200 16.96200 25.96500  1.000 20.01000  ?  135 ALA   A HB2  1 
ATOM   1787 H HB3  . ALA   A 1 131 ? 12.81700 16.05900 26.91700  1.000 20.01000  ?  135 ALA   A HB3  1 
ATOM   1788 N N    . ASN   A 1 132 ? 11.72500 17.09200 29.48100  1.000 16.70990  ?  136 ASN   A N    1 
ATOM   1789 C CA   . ASN   A 1 132 ? 10.54800 17.17600 30.34100  1.000 16.40986  ?  136 ASN   A CA   1 
ATOM   1790 C C    . ASN   A 1 132 ? 10.63800 18.37700 31.27300  1.000 17.69423  ?  136 ASN   A C    1 
ATOM   1791 O O    . ASN   A 1 132 ? 9.63000  19.04400 31.54500  1.000 17.75213  ?  136 ASN   A O    1 
ATOM   1792 C CB   . ASN   A 1 132 ? 10.35100 15.90900 31.14700  1.000 17.02046  ?  136 ASN   A CB   1 
ATOM   1793 C CG   . ASN   A 1 132 ? 9.61500  14.82500 30.39600  1.000 18.17850  ?  136 ASN   A CG   1 
ATOM   1794 O OD1  . ASN   A 1 132 ? 9.00300  15.05200 29.33900  1.000 17.94162  ?  136 ASN   A OD1  1 
ATOM   1795 N ND2  . ASN   A 1 132 ? 9.66400  13.62400 30.94800  1.000 19.48918  ?  136 ASN   A ND2  1 
ATOM   1796 H H    . ASN   A 1 132 ? 12.24100 16.41800 29.62000  1.000 20.10000  ?  136 ASN   A H    1 
ATOM   1797 H HA   . ASN   A 1 132 ? 9.77200  17.27400 29.76700  1.000 19.74000  ?  136 ASN   A HA   1 
ATOM   1798 H HB2  . ASN   A 1 132 ? 11.22000 15.55900 31.39800  1.000 20.47000  ?  136 ASN   A HB2  1 
ATOM   1799 H HB3  . ASN   A 1 132 ? 9.83600  16.12000 31.94200  1.000 20.47000  ?  136 ASN   A HB3  1 
ATOM   1800 H HD21 . ASN   A 1 132 ? 9.26600  12.96100 30.57100  1.000 23.44000  ?  136 ASN   A HD21 1 
ATOM   1801 H HD22 . ASN   A 1 132 ? 10.09300 13.50600 31.68400  1.000 23.44000  ?  136 ASN   A HD22 1 
ATOM   1802 N N    . LEU   A 1 133 ? 11.83100 18.65000 31.80800  1.000 17.39419  ?  137 LEU   A N    1 
ATOM   1803 C CA   . LEU   A 1 133 ? 11.98600 19.80200 32.68800  1.000 17.82582  ?  137 LEU   A CA   1 
ATOM   1804 C C    . LEU   A 1 133 ? 11.69300 21.10700 31.95300  1.000 18.56802  ?  137 LEU   A C    1 
ATOM   1805 O O    . LEU   A 1 133 ? 11.05900 22.01400 32.50100  1.000 20.21821  ?  137 LEU   A O    1 
ATOM   1806 C CB   . LEU   A 1 133 ? 13.39700 19.80500 33.28100  1.000 18.49959  ?  137 LEU   A CB   1 
ATOM   1807 C CG   . LEU   A 1 133 ? 13.69500 18.72300 34.31300  1.000 19.03386  ?  137 LEU   A CG   1 
ATOM   1808 C CD1  . LEU   A 1 133 ? 15.20200 18.61300 34.58300  1.000 20.49719  ?  137 LEU   A CD1  1 
ATOM   1809 C CD2  . LEU   A 1 133 ? 12.93000 19.03300 35.59300  1.000 20.33665  ?  137 LEU   A CD2  1 
ATOM   1810 H H    . LEU   A 1 133 ? 12.54800 18.19300 31.67800  1.000 20.92000  ?  137 LEU   A H    1 
ATOM   1811 H HA   . LEU   A 1 133 ? 11.35300 19.73600 33.42000  1.000 21.44000  ?  137 LEU   A HA   1 
ATOM   1812 H HB2  . LEU   A 1 133 ? 14.02900 19.69000 32.55500  1.000 22.25000  ?  137 LEU   A HB2  1 
ATOM   1813 H HB3  . LEU   A 1 133 ? 13.54000 20.66100 33.71400  1.000 22.25000  ?  137 LEU   A HB3  1 
ATOM   1814 H HG   . LEU   A 1 133 ? 13.40900 17.86000 33.97500  1.000 22.89000  ?  137 LEU   A HG   1 
ATOM   1815 H HD11 . LEU   A 1 133 ? 15.35500 17.92000 35.24500  1.000 24.64000  ?  137 LEU   A HD11 1 
ATOM   1816 H HD12 . LEU   A 1 133 ? 15.65600 18.38700 33.75600  1.000 24.64000  ?  137 LEU   A HD12 1 
ATOM   1817 H HD13 . LEU   A 1 133 ? 15.52600 19.46500 34.91600  1.000 24.64000  ?  137 LEU   A HD13 1 
ATOM   1818 H HD21 . LEU   A 1 133 ? 13.18000 18.38900 36.27400  1.000 24.45000  ?  137 LEU   A HD21 1 
ATOM   1819 H HD22 . LEU   A 1 133 ? 13.15600 19.92900 35.88600  1.000 24.45000  ?  137 LEU   A HD22 1 
ATOM   1820 H HD23 . LEU   A 1 133 ? 11.97800 18.97400 35.41400  1.000 24.45000  ?  137 LEU   A HD23 1 
ATOM   1821 N N    . LEU   A 1 134 ? 12.11400 21.21000 30.69300  1.000 17.80740  ?  138 LEU   A N    1 
ATOM   1822 C CA   . LEU   A 1 134 ? 11.86200 22.42900 29.94000  1.000 18.41273  ?  138 LEU   A CA   1 
ATOM   1823 C C    . LEU   A 1 134 ? 10.40000 22.53000 29.53000  1.000 18.54959  ?  138 LEU   A C    1 
ATOM   1824 O O    . LEU   A 1 134 ? 9.83400  23.63200 29.49100  1.000 19.13650  ?  138 LEU   A O    1 
ATOM   1825 C CB   . LEU   A 1 134 ? 12.76200 22.45700 28.71100  1.000 17.71265  ?  138 LEU   A CB   1 
ATOM   1826 C CG   . LEU   A 1 134 ? 14.26400 22.62000 29.02400  1.000 17.50736  ?  138 LEU   A CG   1 
ATOM   1827 C CD1  . LEU   A 1 134 ? 15.04100 22.39800 27.74300  1.000 18.58381  ?  138 LEU   A CD1  1 
ATOM   1828 C CD2  . LEU   A 1 134 ? 14.53900 23.97200 29.62700  1.000 19.03649  ?  138 LEU   A CD2  1 
ATOM   1829 H H    . LEU   A 1 134 ? 12.54000 20.60000 30.26200  1.000 21.42000  ?  138 LEU   A H    1 
ATOM   1830 H HA   . LEU   A 1 134 ? 12.07000 23.19700 30.49500  1.000 22.15000  ?  138 LEU   A HA   1 
ATOM   1831 H HB2  . LEU   A 1 134 ? 12.65100 21.62200 28.22800  1.000 21.31000  ?  138 LEU   A HB2  1 
ATOM   1832 H HB3  . LEU   A 1 134 ? 12.49600 23.20200 28.15000  1.000 21.31000  ?  138 LEU   A HB3  1 
ATOM   1833 H HG   . LEU   A 1 134 ? 14.55400 21.96900 29.68200  1.000 21.06000  ?  138 LEU   A HG   1 
ATOM   1834 H HD11 . LEU   A 1 134 ? 15.99000 22.40400 27.94400  1.000 22.35000  ?  138 LEU   A HD11 1 
ATOM   1835 H HD12 . LEU   A 1 134 ? 14.78900 21.54000 27.36600  1.000 22.35000  ?  138 LEU   A HD12 1 
ATOM   1836 H HD13 . LEU   A 1 134 ? 14.83000 23.10900 27.11800  1.000 22.35000  ?  138 LEU   A HD13 1 
ATOM   1837 H HD21 . LEU   A 1 134 ? 15.49800 24.08800 29.71700  1.000 22.90000  ?  138 LEU   A HD21 1 
ATOM   1838 H HD22 . LEU   A 1 134 ? 14.17600 24.65700 29.04500  1.000 22.90000  ?  138 LEU   A HD22 1 
ATOM   1839 H HD23 . LEU   A 1 134 ? 14.11600 24.02100 30.49900  1.000 22.90000  ?  138 LEU   A HD23 1 
ATOM   1840 N N    . LEU   A 1 135 ? 9.79100  21.40200 29.17500  1.000 17.59948  ?  139 LEU   A N    1 
ATOM   1841 C CA   . LEU   A 1 135 ? 8.35600  21.41100 28.91000  1.000 18.38905  ?  139 LEU   A CA   1 
ATOM   1842 C C    . LEU   A 1 135 ? 7.59100  21.98200 30.10600  1.000 19.98924  ?  139 LEU   A C    1 
ATOM   1843 O O    . LEU   A 1 135 ? 6.66900  22.78900 29.94600  1.000 20.33139  ?  139 LEU   A O    1 
ATOM   1844 C CB   . LEU   A 1 135 ? 7.88700  19.99800 28.60200  1.000 18.97859  ?  139 LEU   A CB   1 
ATOM   1845 C CG   . LEU   A 1 135 ? 7.95800  19.55800 27.14900  1.000 19.57077  ?  139 LEU   A CG   1 
ATOM   1846 C CD1  . LEU   A 1 135 ? 7.63100  18.06400 27.06800  1.000 19.78658  ?  139 LEU   A CD1  1 
ATOM   1847 C CD2  . LEU   A 1 135 ? 7.03500  20.37600 26.22300  1.000 19.73921  ?  139 LEU   A CD2  1 
ATOM   1848 H H    . LEU   A 1 135 ? 10.17400 20.63800 29.08300  1.000 21.17000  ?  139 LEU   A H    1 
ATOM   1849 H HA   . LEU   A 1 135 ? 8.17100  21.96600 28.13600  1.000 22.12000  ?  139 LEU   A HA   1 
ATOM   1850 H HB2  . LEU   A 1 135 ? 8.43600  19.38300 29.11300  1.000 22.82000  ?  139 LEU   A HB2  1 
ATOM   1851 H HB3  . LEU   A 1 135 ? 6.96000  19.92300 28.87700  1.000 22.82000  ?  139 LEU   A HB3  1 
ATOM   1852 H HG   . LEU   A 1 135 ? 8.85800  19.71700 26.82200  1.000 23.53000  ?  139 LEU   A HG   1 
ATOM   1853 H HD11 . LEU   A 1 135 ? 7.69000  17.77700 26.14300  1.000 23.79000  ?  139 LEU   A HD11 1 
ATOM   1854 H HD12 . LEU   A 1 135 ? 8.26800  17.57100 27.60800  1.000 23.79000  ?  139 LEU   A HD12 1 
ATOM   1855 H HD13 . LEU   A 1 135 ? 6.73200  17.91900 27.40300  1.000 23.79000  ?  139 LEU   A HD13 1 
ATOM   1856 H HD21 . LEU   A 1 135 ? 7.02900  19.96900 25.34300  1.000 23.74000  ?  139 LEU   A HD21 1 
ATOM   1857 H HD22 . LEU   A 1 135 ? 6.13800  20.37700 26.59300  1.000 23.74000  ?  139 LEU   A HD22 1 
ATOM   1858 H HD23 . LEU   A 1 135 ? 7.37000  21.28400 26.16600  1.000 23.74000  ?  139 LEU   A HD23 1 
ATOM   1859 N N    . LYS   A 1 136 ? 7.98000  21.59100 31.32100  1.000 20.86040  ?  140 LYS   A N    1 
ATOM   1860 C CA   . LYS   A 1 136 ? 7.31300  22.11700 32.50800  1.000 23.77917  ?  140 LYS   A CA   1 
ATOM   1861 C C    . LYS   A 1 136 ? 7.46800  23.63000 32.59400  1.000 24.60821  ?  140 LYS   A C    1 
ATOM   1862 O O    . LYS   A 1 136 ? 6.51800  24.34200 32.93800  1.000 25.53727  ?  140 LYS   A O    1 
ATOM   1863 C CB   . LYS   A 1 136 ? 7.89400  21.42300 33.73400  1.000 25.88205  ?  140 LYS   A CB   1 
ATOM   1864 C CG   . LYS   A 1 136 ? 7.07900  21.52500 35.00300  1.000 30.73526  ?  140 LYS   A CG   1 
ATOM   1865 C CD   . LYS   A 1 136 ? 7.63500  20.57600 36.08000  1.000 35.82535  ?  140 LYS   A CD   1 
ATOM   1866 C CE   . LYS   A 1 136 ? 6.94500  19.19000 36.09400  1.000 39.67844  ?  140 LYS   A CE   1 
ATOM   1867 N NZ   . LYS   A 1 136 ? 7.13400  18.34900 34.86600  1.000 41.88660  ?  140 LYS   A NZ   1 
ATOM   1868 H H    . LYS   A 1 136 ? 8.61500  21.03400 31.48100  1.000 25.08000  ?  140 LYS   A H    1 
ATOM   1869 H HA   . LYS   A 1 136 ? 6.36200  21.93200 32.47200  1.000 28.58000  ?  140 LYS   A HA   1 
ATOM   1870 H HB2  . LYS   A 1 136 ? 7.99000  20.47900 33.53000  1.000 31.11000  ?  140 LYS   A HB2  1 
ATOM   1871 H HB3  . LYS   A 1 136 ? 8.76300  21.81200 33.91900  1.000 31.11000  ?  140 LYS   A HB3  1 
ATOM   1872 H HG2  . LYS   A 1 136 ? 7.11800  22.43300 35.34200  1.000 36.93000  ?  140 LYS   A HG2  1 
ATOM   1873 H HG3  . LYS   A 1 136 ? 6.15900  21.27800 34.81900  1.000 36.93000  ?  140 LYS   A HG3  1 
ATOM   1874 H HD2  . LYS   A 1 136 ? 8.58100  20.43500 35.91600  1.000 43.04000  ?  140 LYS   A HD2  1 
ATOM   1875 H HD3  . LYS   A 1 136 ? 7.50600  20.98000 36.95200  1.000 43.04000  ?  140 LYS   A HD3  1 
ATOM   1876 H HE2  . LYS   A 1 136 ? 7.29500  18.68300 36.84300  1.000 47.67000  ?  140 LYS   A HE2  1 
ATOM   1877 H HE3  . LYS   A 1 136 ? 5.99100  19.32700 36.20300  1.000 47.67000  ?  140 LYS   A HE3  1 
ATOM   1878 H HZ1  . LYS   A 1 136 ? 6.85100  18.79200 34.14700  1.000 50.31000  ?  140 LYS   A HZ1  1 
ATOM   1879 H HZ2  . LYS   A 1 136 ? 7.99500  18.15100 34.76200  1.000 50.31000  ?  140 LYS   A HZ2  1 
ATOM   1880 H HZ3  . LYS   A 1 136 ? 6.67000  17.59400 34.94000  1.000 50.31000  ?  140 LYS   A HZ3  1 
ATOM   1881 N N    . GLU   A 1 137 ? 8.63900  24.14700 32.22200  1.000 24.45030  ?  141 GLU   A N    1 
ATOM   1882 C CA   . GLU   A 1 137 ? 8.83900  25.58900 32.22800  1.000 26.51107  ?  141 GLU   A CA   1 
ATOM   1883 C C    . GLU   A 1 137 ? 7.86800  26.30300 31.30200  1.000 26.42422  ?  141 GLU   A C    1 
ATOM   1884 O O    . GLU   A 1 137 ? 7.45500  27.43300 31.59400  1.000 28.81924  ?  141 GLU   A O    1 
ATOM   1885 C CB   . GLU   A 1 137 ? 10.27000 25.92000 31.80900  1.000 30.21678  ?  141 GLU   A CB   1 
ATOM   1886 C CG   . GLU   A 1 137 ? 11.29800 25.51100 32.82100  1.000 34.83049  ?  141 GLU   A CG   1 
ATOM   1887 C CD   . GLU   A 1 137 ? 11.21000 26.32200 34.08400  1.000 38.20984  ?  141 GLU   A CD   1 
ATOM   1888 O OE1  . GLU   A 1 137 ? 10.87500 27.53000 33.99600  1.000 38.65990  ?  141 GLU   A OE1  1 
ATOM   1889 O OE2  . GLU   A 1 137 ? 11.46600 25.74200 35.16000  1.000 40.64961  -1 141 GLU   A OE2  1 
ATOM   1890 H H    . GLU   A 1 137 ? 9.32100  23.69100 31.96600  1.000 29.39000  ?  141 GLU   A H    1 
ATOM   1891 H HA   . GLU   A 1 137 ? 8.69300  25.91000 33.13100  1.000 31.86000  ?  141 GLU   A HA   1 
ATOM   1892 H HB2  . GLU   A 1 137 ? 10.46800 25.45800 30.97900  1.000 36.31000  ?  141 GLU   A HB2  1 
ATOM   1893 H HB3  . GLU   A 1 137 ? 10.34500 26.87900 31.68000  1.000 36.31000  ?  141 GLU   A HB3  1 
ATOM   1894 H HG2  . GLU   A 1 137 ? 11.16300 24.57800 33.05100  1.000 41.85000  ?  141 GLU   A HG2  1 
ATOM   1895 H HG3  . GLU   A 1 137 ? 12.18300 25.63500 32.44400  1.000 41.85000  ?  141 GLU   A HG3  1 
ATOM   1896 N N    . LEU   A 1 138 ? 7.51200  25.67600 30.18000  1.000 23.82128  ?  142 LEU   A N    1 
ATOM   1897 C CA   . LEU   A 1 138 ? 6.67000  26.29600 29.17100  1.000 22.97644  ?  142 LEU   A CA   1 
ATOM   1898 C C    . LEU   A 1 138 ? 5.18800  26.02500 29.38200  1.000 22.66588  ?  142 LEU   A C    1 
ATOM   1899 O O    . LEU   A 1 138 ? 4.36100  26.46800 28.57100  1.000 24.87403  ?  142 LEU   A O    1 
ATOM   1900 C CB   . LEU   A 1 138 ? 7.04700  25.75400 27.79600  1.000 25.42410  ?  142 LEU   A CB   1 
ATOM   1901 C CG   . LEU   A 1 138 ? 8.42600  26.12300 27.26900  1.000 27.19010  ?  142 LEU   A CG   1 
ATOM   1902 C CD1  . LEU   A 1 138 ? 8.56300  25.45800 25.91200  1.000 28.43499  ?  142 LEU   A CD1  1 
ATOM   1903 C CD2  . LEU   A 1 138 ? 8.55400  27.61800 27.17500  1.000 28.17969  ?  142 LEU   A CD2  1 
ATOM   1904 H H    . LEU   A 1 138 ? 7.75300  24.87400 29.98200  1.000 28.64000  ?  142 LEU   A H    1 
ATOM   1905 H HA   . LEU   A 1 138 ? 6.81800  27.25400 29.19900  1.000 27.62000  ?  142 LEU   A HA   1 
ATOM   1906 H HB2  . LEU   A 1 138 ? 7.00700  24.78600 27.83500  1.000 30.56000  ?  142 LEU   A HB2  1 
ATOM   1907 H HB3  . LEU   A 1 138 ? 6.39900  26.08700 27.15500  1.000 30.56000  ?  142 LEU   A HB3  1 
ATOM   1908 H HG   . LEU   A 1 138 ? 9.13900  25.82300 27.85500  1.000 32.68000  ?  142 LEU   A HG   1 
ATOM   1909 H HD11 . LEU   A 1 138 ? 9.47000  25.58200 25.59000  1.000 34.17000  ?  142 LEU   A HD11 1 
ATOM   1910 H HD12 . LEU   A 1 138 ? 8.37200  24.51100 26.00400  1.000 34.17000  ?  142 LEU   A HD12 1 
ATOM   1911 H HD13 . LEU   A 1 138 ? 7.93400  25.86400 25.29600  1.000 34.17000  ?  142 LEU   A HD13 1 
ATOM   1912 H HD21 . LEU   A 1 138 ? 9.33400  27.83500 26.64000  1.000 33.86000  ?  142 LEU   A HD21 1 
ATOM   1913 H HD22 . LEU   A 1 138 ? 7.75600  27.97800 26.75700  1.000 33.86000  ?  142 LEU   A HD22 1 
ATOM   1914 H HD23 . LEU   A 1 138 ? 8.65400  27.98300 28.06800  1.000 33.86000  ?  142 LEU   A HD23 1 
ATOM   1915 N N    . GLY   A 1 139 ? 4.82600  25.29800 30.42500  1.000 22.50533  ?  143 GLY   A N    1 
ATOM   1916 C CA   . GLY   A 1 139 ? 3.43400  24.94200 30.61200  1.000 22.61587  ?  143 GLY   A CA   1 
ATOM   1917 C C    . GLY   A 1 139 ? 3.00700  23.69200 29.87400  1.000 22.41058  ?  143 GLY   A C    1 
ATOM   1918 O O    . GLY   A 1 139 ? 1.81600  23.54100 29.56000  1.000 25.20302  ?  143 GLY   A O    1 
ATOM   1919 H H    . GLY   A 1 139 ? 5.36100  25.00200 31.03000  1.000 27.05000  ?  143 GLY   A H    1 
ATOM   1920 H HA2  . GLY   A 1 139 ? 3.27200  24.80100 31.55800  1.000 27.19000  ?  143 GLY   A HA2  1 
ATOM   1921 H HA3  . GLY   A 1 139 ? 2.88000  25.67500 30.30200  1.000 27.19000  ?  143 GLY   A HA3  1 
ATOM   1922 N N    . GLY   A 1 140 ? 3.93900  22.79200 29.57700  1.000 19.63656  ?  144 GLY   A N    1 
ATOM   1923 C CA   . GLY   A 1 140 ? 3.61700  21.49100 29.06000  1.000 18.89174  ?  144 GLY   A CA   1 
ATOM   1924 C C    . GLY   A 1 140 ? 3.45200  21.47400 27.56000  1.000 18.89963  ?  144 GLY   A C    1 
ATOM   1925 O O    . GLY   A 1 140 ? 3.70800  22.46400 26.87700  1.000 18.37852  ?  144 GLY   A O    1 
ATOM   1926 H H    . GLY   A 1 140 ? 4.78300  22.92600 29.67300  1.000 23.61000  ?  144 GLY   A H    1 
ATOM   1927 H HA2  . GLY   A 1 140 ? 4.32600  20.87100 29.29400  1.000 22.72000  ?  144 GLY   A HA2  1 
ATOM   1928 H HA3  . GLY   A 1 140 ? 2.78700  21.18600 29.45900  1.000 22.72000  ?  144 GLY   A HA3  1 
ATOM   1929 N N    . PRO   A 1 141 ? 3.04600  20.31600 27.02500  1.000 18.43905  ?  145 PRO   A N    1 
ATOM   1930 C CA   . PRO   A 1 141 ? 2.82600  20.19200 25.57200  1.000 18.03637  ?  145 PRO   A CA   1 
ATOM   1931 C C    . PRO   A 1 141 ? 1.95300  21.27000 24.94900  1.000 17.42314  ?  145 PRO   A C    1 
ATOM   1932 O O    . PRO   A 1 141 ? 2.21500  21.68400 23.80800  1.000 17.15732  ?  145 PRO   A O    1 
ATOM   1933 C CB   . PRO   A 1 141 ? 2.22400  18.78600 25.43100  1.000 18.82594  ?  145 PRO   A CB   1 
ATOM   1934 C CG   . PRO   A 1 141 ? 2.77000  18.03300 26.64900  1.000 18.98912  ?  145 PRO   A CG   1 
ATOM   1935 C CD   . PRO   A 1 141 ? 2.83400  19.04100 27.73800  1.000 18.83647  ?  145 PRO   A CD   1 
ATOM   1936 H HA   . PRO   A 1 141 ? 3.68600  20.22100 25.12500  1.000 21.69000  ?  145 PRO   A HA   1 
ATOM   1937 H HB2  . PRO   A 1 141 ? 1.25500  18.83300 25.45200  1.000 22.64000  ?  145 PRO   A HB2  1 
ATOM   1938 H HB3  . PRO   A 1 141 ? 2.51900  18.37700 24.60300  1.000 22.64000  ?  145 PRO   A HB3  1 
ATOM   1939 H HG2  . PRO   A 1 141 ? 2.17000  17.30800 26.88300  1.000 22.84000  ?  145 PRO   A HG2  1 
ATOM   1940 H HG3  . PRO   A 1 141 ? 3.65200  17.68200 26.45000  1.000 22.84000  ?  145 PRO   A HG3  1 
ATOM   1941 H HD2  . PRO   A 1 141 ? 2.00200  19.06100 28.23600  1.000 22.66000  ?  145 PRO   A HD2  1 
ATOM   1942 H HD3  . PRO   A 1 141 ? 3.57500  18.85400 28.33500  1.000 22.66000  ?  145 PRO   A HD3  1 
ATOM   1943 N N    . ALA   A 1 142 ? 0.88500  21.70100 25.63000  1.000 17.56790  ?  146 ALA   A N    1 
ATOM   1944 C CA   . ALA   A 1 142 ? 0.05600  22.75500 25.06100  1.000 18.29430  ?  146 ALA   A CA   1 
ATOM   1945 C C    . ALA   A 1 142 ? 0.81200  24.07100 24.98200  1.000 18.38115  ?  146 ALA   A C    1 
ATOM   1946 O O    . ALA   A 1 142 ? 0.58200  24.86500 24.06000  1.000 18.64697  ?  146 ALA   A O    1 
ATOM   1947 C CB   . ALA   A 1 142 ? -1.21600 22.94100 25.88500  1.000 19.80501  ?  146 ALA   A CB   1 
ATOM   1948 H H    . ALA   A 1 142 ? 0.63100  21.40600 26.39700  1.000 21.13000  ?  146 ALA   A H    1 
ATOM   1949 H HA   . ALA   A 1 142 ? -0.20400 22.48900 24.16500  1.000 22.00000  ?  146 ALA   A HA   1 
ATOM   1950 H HB1  . ALA   A 1 142 ? -1.75300 23.64100 25.48300  1.000 23.81000  ?  146 ALA   A HB1  1 
ATOM   1951 H HB2  . ALA   A 1 142 ? -1.71200 22.10700 25.89300  1.000 23.81000  ?  146 ALA   A HB2  1 
ATOM   1952 H HB3  . ALA   A 1 142 ? -0.97300 23.18900 26.79100  1.000 23.81000  ?  146 ALA   A HB3  1 
ATOM   1953 N N    . GLY   A 1 143 ? 1.73300  24.31200 25.92400  1.000 18.31535  ?  147 GLY   A N    1 
ATOM   1954 C CA   . GLY   A 1 143 ? 2.52900  25.52800 25.87300  1.000 18.87332  ?  147 GLY   A CA   1 
ATOM   1955 C C    . GLY   A 1 143 ? 3.50200  25.55000 24.70700  1.000 18.26272  ?  147 GLY   A C    1 
ATOM   1956 O O    . GLY   A 1 143 ? 3.69200  26.58800 24.07000  1.000 18.63118  ?  147 GLY   A O    1 
ATOM   1957 H H    . GLY   A 1 143 ? 1.90800  23.79400 26.58800  1.000 22.03000  ?  147 GLY   A H    1 
ATOM   1958 H HA2  . GLY   A 1 143 ? 1.93800  26.29300 25.78900  1.000 22.70000  ?  147 GLY   A HA2  1 
ATOM   1959 H HA3  . GLY   A 1 143 ? 3.03800  25.61000 26.69400  1.000 22.70000  ?  147 GLY   A HA3  1 
ATOM   1960 N N    . LEU   A 1 144 ? 4.12600  24.41200 24.40300  1.000 16.94940  ?  148 LEU   A N    1 
ATOM   1961 C CA   . LEU   A 1 144 ? 4.97700  24.35700 23.21300  1.000 17.14679  ?  148 LEU   A CA   1 
ATOM   1962 C C    . LEU   A 1 144 ? 4.14200  24.49800 21.94700  1.000 17.08626  ?  148 LEU   A C    1 
ATOM   1963 O O    . LEU   A 1 144 ? 4.51800  25.23600 21.03200  1.000 16.66516  ?  148 LEU   A O    1 
ATOM   1964 C CB   . LEU   A 1 144 ? 5.79700  23.06700 23.18200  1.000 17.01783  ?  148 LEU   A CB   1 
ATOM   1965 C CG   . LEU   A 1 144 ? 6.72800  22.92200 21.97900  1.000 17.16522  ?  148 LEU   A CG   1 
ATOM   1966 C CD1  . LEU   A 1 144 ? 7.60600  24.14600 21.84700  1.000 17.40472  ?  148 LEU   A CD1  1 
ATOM   1967 C CD2  . LEU   A 1 144 ? 7.57100  21.67200 22.07800  1.000 17.34682  ?  148 LEU   A CD2  1 
ATOM   1968 H H    . LEU   A 1 144 ? 4.07600  23.68100 24.85300  1.000 20.39000  ?  148 LEU   A H    1 
ATOM   1969 H HA   . LEU   A 1 144 ? 5.60900  25.09200 23.25100  1.000 20.63000  ?  148 LEU   A HA   1 
ATOM   1970 H HB2  . LEU   A 1 144 ? 6.34600  23.03400 23.98100  1.000 20.47000  ?  148 LEU   A HB2  1 
ATOM   1971 H HB3  . LEU   A 1 144 ? 5.18500  22.31500 23.16900  1.000 20.47000  ?  148 LEU   A HB3  1 
ATOM   1972 H HG   . LEU   A 1 144 ? 6.18600  22.84200 21.17900  1.000 20.65000  ?  148 LEU   A HG   1 
ATOM   1973 H HD11 . LEU   A 1 144 ? 8.29700  23.97000 21.19000  1.000 20.94000  ?  148 LEU   A HD11 1 
ATOM   1974 H HD12 . LEU   A 1 144 ? 7.06100  24.89600 21.56000  1.000 20.94000  ?  148 LEU   A HD12 1 
ATOM   1975 H HD13 . LEU   A 1 144 ? 8.00900  24.34000 22.70800  1.000 20.94000  ?  148 LEU   A HD13 1 
ATOM   1976 H HD21 . LEU   A 1 144 ? 8.13800  21.61100 21.29300  1.000 20.86000  ?  148 LEU   A HD21 1 
ATOM   1977 H HD22 . LEU   A 1 144 ? 8.11700  21.72200 22.87800  1.000 20.86000  ?  148 LEU   A HD22 1 
ATOM   1978 H HD23 . LEU   A 1 144 ? 6.98600  20.90000 22.12400  1.000 20.86000  ?  148 LEU   A HD23 1 
ATOM   1979 N N    . THR   A 1 145 ? 2.98000  23.83100 21.90000  1.000 16.33880  ?  149 THR   A N    1 
ATOM   1980 C CA   . THR   A 1 145 ? 2.08500  23.97300 20.75300  1.000 15.64661  ?  149 THR   A CA   1 
ATOM   1981 C C    . THR   A 1 145 ? 1.68900  25.43400 20.55000  1.000 15.50975  ?  149 THR   A C    1 
ATOM   1982 O O    . THR   A 1 145 ? 1.71000  25.95200 19.42000  1.000 16.58620  ?  149 THR   A O    1 
ATOM   1983 C CB   . THR   A 1 145 ? 0.86000  23.07400 20.95800  1.000 15.60977  ?  149 THR   A CB   1 
ATOM   1984 O OG1  . THR   A 1 145 ? 1.28900  21.71200 21.06900  1.000 15.52291  ?  149 THR   A OG1  1 
ATOM   1985 C CG2  . THR   A 1 145 ? -0.08800 23.18500 19.77700  1.000 15.68872  ?  149 THR   A CG2  1 
ATOM   1986 H H    . THR   A 1 145 ? 2.69400  23.29900 22.51200  1.000 19.66000  ?  149 THR   A H    1 
ATOM   1987 H HA   . THR   A 1 145 ? 2.53300  23.68400 19.94300  1.000 18.82000  ?  149 THR   A HA   1 
ATOM   1988 H HB   . THR   A 1 145 ? 0.39000  23.34700 21.76200  1.000 18.78000  ?  149 THR   A HB   1 
ATOM   1989 H HG1  . THR   A 1 145 ? 1.72800  21.60600 21.77700  1.000 18.68000  ?  149 THR   A HG1  1 
ATOM   1990 H HG21 . THR   A 1 145 ? -0.80800 22.54200 19.86800  1.000 18.88000  ?  149 THR   A HG21 1 
ATOM   1991 H HG22 . THR   A 1 145 ? -0.46600 24.07800 19.73800  1.000 18.88000  ?  149 THR   A HG22 1 
ATOM   1992 H HG23 . THR   A 1 145 ? 0.38900  23.00900 18.95100  1.000 18.88000  ?  149 THR   A HG23 1 
ATOM   1993 N N    . ALA   A 1 146 ? 1.36900  26.12800 21.64300  1.000 16.68095  ?  150 ALA   A N    1 
ATOM   1994 C CA   . ALA   A 1 146 ? 1.02900  27.54500 21.56100  1.000 17.99163  ?  150 ALA   A CA   1 
ATOM   1995 C C    . ALA   A 1 146 ? 2.17300  28.37000 20.98100  1.000 17.45209  ?  150 ALA   A C    1 
ATOM   1996 O O    . ALA   A 1 146 ? 1.94000  29.29600 20.19300  1.000 18.06796  ?  150 ALA   A O    1 
ATOM   1997 C CB   . ALA   A 1 146 ? 0.64700  28.07700 22.94300  1.000 19.09966  ?  150 ALA   A CB   1 
ATOM   1998 H H    . ALA   A 1 146 ? 1.34100  25.80400 22.43900  1.000 20.07000  ?  150 ALA   A H    1 
ATOM   1999 H HA   . ALA   A 1 146 ? 0.26300  27.63700 20.97200  1.000 21.64000  ?  150 ALA   A HA   1 
ATOM   2000 H HB1  . ALA   A 1 146 ? 0.20200  28.93300 22.84000  1.000 22.97000  ?  150 ALA   A HB1  1 
ATOM   2001 H HB2  . ALA   A 1 146 ? 0.05000  27.44300 23.37100  1.000 22.97000  ?  150 ALA   A HB2  1 
ATOM   2002 H HB3  . ALA   A 1 146 ? 1.45200  28.18400 23.47300  1.000 22.97000  ?  150 ALA   A HB3  1 
ATOM   2003 N N    . PHE   A 1 147 ? 3.41900  28.07300 21.36400  1.000 16.70463  ?  151 PHE   A N    1 
ATOM   2004 C CA   . PHE   A 1 147 ? 4.53000  28.79600 20.76800  1.000 17.20733  ?  151 PHE   A CA   1 
ATOM   2005 C C    . PHE   A 1 147 ? 4.56500  28.57500 19.26100  1.000 17.01520  ?  151 PHE   A C    1 
ATOM   2006 O O    . PHE   A 1 147 ? 4.75900  29.51400 18.48300  1.000 17.48631  ?  151 PHE   A O    1 
ATOM   2007 C CB   . PHE   A 1 147 ? 5.86200  28.37500 21.38400  1.000 17.17311  ?  151 PHE   A CB   1 
ATOM   2008 C CG   . PHE   A 1 147 ? 7.03500  28.96100 20.66000  1.000 17.21785  ?  151 PHE   A CG   1 
ATOM   2009 C CD1  . PHE   A 1 147 ? 7.32100  30.31900 20.75900  1.000 17.73897  ?  151 PHE   A CD1  1 
ATOM   2010 C CD2  . PHE   A 1 147 ? 7.82000  28.17400 19.83000  1.000 17.74423  ?  151 PHE   A CD2  1 
ATOM   2011 C CE1  . PHE   A 1 147 ? 8.36700  30.86300 20.04700  1.000 18.64171  ?  151 PHE   A CE1  1 
ATOM   2012 C CE2  . PHE   A 1 147 ? 8.86300  28.72400 19.13100  1.000 18.07322  ?  151 PHE   A CE2  1 
ATOM   2013 C CZ   . PHE   A 1 147 ? 9.12900  30.06000 19.24600  1.000 18.29693  ?  151 PHE   A CZ   1 
ATOM   2014 H H    . PHE   A 1 147 ? 3.63400  27.47800 21.94700  1.000 20.10000  ?  151 PHE   A H    1 
ATOM   2015 H HA   . PHE   A 1 147 ? 4.40600  29.74000 20.95400  1.000 20.70000  ?  151 PHE   A HA   1 
ATOM   2016 H HB2  . PHE   A 1 147 ? 5.89500  28.67700 22.30600  1.000 20.66000  ?  151 PHE   A HB2  1 
ATOM   2017 H HB3  . PHE   A 1 147 ? 5.93700  27.40900 21.34800  1.000 20.66000  ?  151 PHE   A HB3  1 
ATOM   2018 H HD1  . PHE   A 1 147 ? 6.80300  30.86300 21.30800  1.000 21.34000  ?  151 PHE   A HD1  1 
ATOM   2019 H HD2  . PHE   A 1 147 ? 7.63600  27.26600 19.74700  1.000 21.34000  ?  151 PHE   A HD2  1 
ATOM   2020 H HE1  . PHE   A 1 147 ? 8.55400  31.77200 20.11100  1.000 22.42000  ?  151 PHE   A HE1  1 
ATOM   2021 H HE2  . PHE   A 1 147 ? 9.38800  28.18900 18.58100  1.000 21.74000  ?  151 PHE   A HE2  1 
ATOM   2022 H HZ   . PHE   A 1 147 ? 9.83900  30.42800 18.77100  1.000 22.01000  ?  151 PHE   A HZ   1 
ATOM   2023 N N    . MET   A 1 148 ? 4.40800  27.32500 18.83200  1.000 15.92823  ?  152 MET   A N    1 
ATOM   2024 C CA   . MET   A 1 148 ? 4.41700  27.03500 17.40700  1.000 16.71253  ?  152 MET   A CA   1 
ATOM   2025 C C    . MET   A 1 148 ? 3.28700  27.75600 16.69500  1.000 16.20721  ?  152 MET   A C    1 
ATOM   2026 O O    . MET   A 1 148 ? 3.48900  28.31400 15.61100  1.000 16.76254  ?  152 MET   A O    1 
ATOM   2027 C CB   . MET   A 1 148 ? 4.39900  25.53000 17.19300  1.000 15.77031  ?  152 MET   A CB   1 
ATOM   2028 C CG   . MET   A 1 148 ? 5.67100  24.85200 17.78300  1.000 16.25984  ?  152 MET   A CG   1 
ATOM   2029 S SD   . MET   A 1 148 ? 7.22200  25.43200 17.02500  1.000 17.09415  ?  152 MET   A SD   1 
ATOM   2030 C CE   . MET   A 1 148 ? 7.12600  24.52700 15.47800  1.000 17.24944  ?  152 MET   A CE   1 
ATOM   2031 H H    . MET   A 1 148 ? 4.29700  26.63900 19.33800  1.000 19.17000  ?  152 MET   A H    1 
ATOM   2032 H HA   . MET   A 1 148 ? 5.24300  27.35300 17.01000  1.000 20.11000  ?  152 MET   A HA   1 
ATOM   2033 H HB2  . MET   A 1 148 ? 3.62000  25.15400 17.63300  1.000 18.97000  ?  152 MET   A HB2  1 
ATOM   2034 H HB3  . MET   A 1 148 ? 4.36600  25.34200 16.24200  1.000 18.97000  ?  152 MET   A HB3  1 
ATOM   2035 H HG2  . MET   A 1 148 ? 5.71600  25.04300 18.73300  1.000 19.56000  ?  152 MET   A HG2  1 
ATOM   2036 H HG3  . MET   A 1 148 ? 5.61100  23.89500 17.64000  1.000 19.56000  ?  152 MET   A HG3  1 
ATOM   2037 H HE1  . MET   A 1 148 ? 7.92200  24.71000 14.95500  1.000 20.75000  ?  152 MET   A HE1  1 
ATOM   2038 H HE2  . MET   A 1 148 ? 7.06800  23.57800 15.67000  1.000 20.75000  ?  152 MET   A HE2  1 
ATOM   2039 H HE3  . MET   A 1 148 ? 6.33800  24.81500 14.99200  1.000 20.75000  ?  152 MET   A HE3  1 
ATOM   2040 N N    . ARG   A 1 149 ? 2.09400  27.80000 17.29900  1.000 17.73371  ?  153 ARG   A N    1 
ATOM   2041 C CA   . ARG   A 1 149 ? 1.01900  28.58400 16.69700  1.000 17.67317  ?  153 ARG   A CA   1 
ATOM   2042 C C    . ARG   A 1 149 ? 1.40700  30.04800 16.56200  1.000 18.46800  ?  153 ARG   A C    1 
ATOM   2043 O O    . ARG   A 1 149 ? 1.04300  30.70600 15.58000  1.000 18.88647  ?  153 ARG   A O    1 
ATOM   2044 C CB   . ARG   A 1 149 ? -0.26400 28.48300 17.53400  1.000 18.33641  ?  153 ARG   A CB   1 
ATOM   2045 C CG   . ARG   A 1 149 ? -0.86900 27.11500 17.58200  1.000 17.22049  ?  153 ARG   A CG   1 
ATOM   2046 C CD   . ARG   A 1 149 ? -1.56500 26.69700 16.25700  1.000 17.19943  ?  153 ARG   A CD   1 
ATOM   2047 N NE   . ARG   A 1 149 ? -2.03000 25.33300 16.41100  1.000 15.83874  ?  153 ARG   A NE   1 
ATOM   2048 C CZ   . ARG   A 1 149 ? -1.28600 24.24300 16.29700  1.000 16.56778  ?  153 ARG   A CZ   1 
ATOM   2049 N NH1  . ARG   A 1 149 ? -0.09400 24.27100 15.73000  1.000 16.79149  ?  153 ARG   A NH1  1 
ATOM   2050 N NH2  . ARG   A 1 149 ? -1.73900 23.10100 16.78400  1.000 16.26248  ?  153 ARG   A NH2  1 
ATOM   2051 H H    . ARG   A 1 149 ? 1.89100  27.39900 18.03200  1.000 21.33000  ?  153 ARG   A H    1 
ATOM   2052 H HA   . ARG   A 1 149 ? 0.84500  28.21600 15.81700  1.000 21.26000  ?  153 ARG   A HA   1 
ATOM   2053 H HB2  . ARG   A 1 149 ? -0.05900 28.74400 18.44500  1.000 22.05000  ?  153 ARG   A HB2  1 
ATOM   2054 H HB3  . ARG   A 1 149 ? -0.92600 29.08300 17.15700  1.000 22.05000  ?  153 ARG   A HB3  1 
ATOM   2055 H HG2  . ARG   A 1 149 ? -0.17000 26.46800 17.76600  1.000 20.72000  ?  153 ARG   A HG2  1 
ATOM   2056 H HG3  . ARG   A 1 149 ? -1.53600 27.09100 18.28600  1.000 20.72000  ?  153 ARG   A HG3  1 
ATOM   2057 H HD2  . ARG   A 1 149 ? -2.32300 27.27500 16.07900  1.000 20.69000  ?  153 ARG   A HD2  1 
ATOM   2058 H HD3  . ARG   A 1 149 ? -0.93600 26.73900 15.52000  1.000 20.69000  ?  153 ARG   A HD3  1 
ATOM   2059 H HE   . ARG   A 1 149 ? -2.86300 25.22100 16.59300  1.000 19.06000  ?  153 ARG   A HE   1 
ATOM   2060 H HH11 . ARG   A 1 149 ? 0.21900  25.01100 15.42200  1.000 20.20000  ?  153 ARG   A HH11 1 
ATOM   2061 H HH12 . ARG   A 1 149 ? 0.37000  23.54900 15.66800  1.000 20.20000  ?  153 ARG   A HH12 1 
ATOM   2062 H HH21 . ARG   A 1 149 ? -2.50700 23.07300 17.16900  1.000 19.56000  ?  153 ARG   A HH21 1 
ATOM   2063 H HH22 . ARG   A 1 149 ? -1.26500 22.38700 16.71600  1.000 19.56000  ?  153 ARG   A HH22 1 
ATOM   2064 N N    . SER   A 1 150 ? 2.14700  30.58100 17.54100  1.000 19.31811  ?  154 SER   A N    1 
ATOM   2065 C CA   . SER   A 1 150 ? 2.49500  31.99500 17.54300  1.000 20.05240  ?  154 SER   A CA   1 
ATOM   2066 C C    . SER   A 1 150 ? 3.44000  32.37500 16.41400  1.000 20.34191  ?  154 SER   A C    1 
ATOM   2067 O O    . SER   A 1 150 ? 3.51300  33.55900 16.07200  1.000 21.51311  ?  154 SER   A O    1 
ATOM   2068 C CB   . SER   A 1 150 ? 3.08900  32.40300 18.89300  1.000 20.86829  ?  154 SER   A CB   1 
ATOM   2069 O OG   . SER   A 1 150 ? 4.47900  32.10300 19.01700  1.000 20.79723  ?  154 SER   A OG   1 
ATOM   2070 H H    . SER   A 1 150 ? 2.45700  30.14200 18.21300  1.000 23.23000  ?  154 SER   A H    1 
ATOM   2071 H HA   . SER   A 1 150 ? 1.67800  32.50300 17.41900  1.000 24.12000  ?  154 SER   A HA   1 
ATOM   2072 H HB2  . SER   A 1 150 ? 2.97200  33.36000 19.00100  1.000 25.09000  ?  154 SER   A HB2  1 
ATOM   2073 H HB3  . SER   A 1 150 ? 2.61100  31.93000 19.59200  1.000 25.09000  ?  154 SER   A HB3  1 
ATOM   2074 H HG   . SER   A 1 150 ? 4.60500  31.27800 18.91800  1.000 25.00000  ?  154 SER   A HG   1 
ATOM   2075 N N    . ILE   A 1 151 ? 4.16800  31.41800 15.84000  1.000 19.67868  ?  155 ILE   A N    1 
ATOM   2076 C CA   . ILE   A 1 151 ? 5.01200  31.69400 14.68400  1.000 19.29705  ?  155 ILE   A CA   1 
ATOM   2077 C C    . ILE   A 1 151 ? 4.32500  31.31500 13.37700  1.000 19.68394  ?  155 ILE   A C    1 
ATOM   2078 O O    . ILE   A 1 151 ? 4.93500  31.40800 12.31200  1.000 20.83671  ?  155 ILE   A O    1 
ATOM   2079 C CB   . ILE   A 1 151 ? 6.41900  31.06900 14.79500  1.000 19.70499  ?  155 ILE   A CB   1 
ATOM   2080 C CG1  . ILE   A 1 151 ? 6.35700  29.54400 14.70100  1.000 19.03386  ?  155 ILE   A CG1  1 
ATOM   2081 C CG2  . ILE   A 1 151 ? 7.07000  31.47800 16.10000  1.000 20.43666  ?  155 ILE   A CG2  1 
ATOM   2082 C CD1  . ILE   A 1 151 ? 7.72000  28.85700 14.55200  1.000 20.62616  ?  155 ILE   A CD1  1 
ATOM   2083 H H    . ILE   A 1 151 ? 4.18900  30.60000 16.10400  1.000 23.66000  ?  155 ILE   A H    1 
ATOM   2084 H HA   . ILE   A 1 151 ? 5.15700  32.65300 14.66300  1.000 23.21000  ?  155 ILE   A HA   1 
ATOM   2085 H HB   . ILE   A 1 151 ? 6.94800  31.39900 14.05200  1.000 23.70000  ?  155 ILE   A HB   1 
ATOM   2086 H HG12 . ILE   A 1 151 ? 5.94400  29.20200 15.50900  1.000 22.89000  ?  155 ILE   A HG12 1 
ATOM   2087 H HG13 . ILE   A 1 151 ? 5.82300  29.30500 13.92700  1.000 22.89000  ?  155 ILE   A HG13 1 
ATOM   2088 H HG21 . ILE   A 1 151 ? 7.98900  31.16800 16.10400  1.000 24.58000  ?  155 ILE   A HG21 1 
ATOM   2089 H HG22 . ILE   A 1 151 ? 7.04600  32.44500 16.17500  1.000 24.58000  ?  155 ILE   A HG22 1 
ATOM   2090 H HG23 . ILE   A 1 151 ? 6.58200  31.07600 16.83600  1.000 24.58000  ?  155 ILE   A HG23 1 
ATOM   2091 H HD11 . ILE   A 1 151 ? 7.58300  27.90200 14.45300  1.000 24.80000  ?  155 ILE   A HD11 1 
ATOM   2092 H HD12 . ILE   A 1 151 ? 8.16800  29.21000 13.76700  1.000 24.80000  ?  155 ILE   A HD12 1 
ATOM   2093 H HD13 . ILE   A 1 151 ? 8.25100  29.03400 15.34400  1.000 24.80000  ?  155 ILE   A HD13 1 
ATOM   2094 N N    . GLY   A 1 152 ? 3.04800  30.93100 13.43200  1.000 19.96292  ?  156 GLY   A N    1 
ATOM   2095 C CA   . GLY   A 1 152 ? 2.29000  30.64700 12.23500  1.000 19.29442  ?  156 GLY   A CA   1 
ATOM   2096 C C    . GLY   A 1 152 ? 2.21900  29.19200 11.83000  1.000 18.66540  ?  156 GLY   A C    1 
ATOM   2097 O O    . GLY   A 1 152 ? 1.77700  28.90700 10.71400  1.000 20.33665  ?  156 GLY   A O    1 
ATOM   2098 H H    . GLY   A 1 152 ? 2.60400  30.83000 14.16100  1.000 24.00000  ?  156 GLY   A H    1 
ATOM   2099 H HA2  . GLY   A 1 152 ? 1.38100  30.95700 12.36700  1.000 23.20000  ?  156 GLY   A HA2  1 
ATOM   2100 H HA3  . GLY   A 1 152 ? 2.68700  31.13600 11.49700  1.000 23.20000  ?  156 GLY   A HA3  1 
ATOM   2101 N N    . ASP   A 1 153 ? 2.66200  28.27100 12.67800  1.000 16.91255  ?  157 ASP   A N    1 
ATOM   2102 C CA   . ASP   A 1 153 ? 2.61100  26.83800 12.38700  1.000 16.46250  ?  157 ASP   A CA   1 
ATOM   2103 C C    . ASP   A 1 153 ? 1.28800  26.29400 12.91500  1.000 16.41776  ?  157 ASP   A C    1 
ATOM   2104 O O    . ASP   A 1 153 ? 1.09100  26.20400 14.13300  1.000 16.72569  ?  157 ASP   A O    1 
ATOM   2105 C CB   . ASP   A 1 153 ? 3.80300  26.16700 13.06100  1.000 15.81242  ?  157 ASP   A CB   1 
ATOM   2106 C CG   . ASP   A 1 153 ? 3.92700  24.68600 12.74000  1.000 15.74136  ?  157 ASP   A CG   1 
ATOM   2107 O OD1  . ASP   A 1 153 ? 2.90000  24.02300 12.46100  1.000 16.66516  ?  157 ASP   A OD1  1 
ATOM   2108 O OD2  . ASP   A 1 153 ? 5.08400  24.19000 12.74300  1.000 15.95191  -1 157 ASP   A OD2  1 
ATOM   2109 H H    . ASP   A 1 153 ? 3.00300  28.45300 13.44600  1.000 20.35000  ?  157 ASP   A H    1 
ATOM   2110 H HA   . ASP   A 1 153 ? 2.64400  26.66900 11.43200  1.000 19.81000  ?  157 ASP   A HA   1 
ATOM   2111 H HB2  . ASP   A 1 153 ? 4.61700  26.60400 12.76600  1.000 19.02000  ?  157 ASP   A HB2  1 
ATOM   2112 H HB3  . ASP   A 1 153 ? 3.70900  26.25400 14.02300  1.000 19.02000  ?  157 ASP   A HB3  1 
ATOM   2113 N N    . THR   A 1 154 ? 0.38500  25.92800 11.99500  1.000 17.06257  ?  158 THR   A N    1 
ATOM   2114 C CA   . THR   A 1 154 ? -0.92800 25.38800 12.34200  1.000 16.95993  ?  158 THR   A CA   1 
ATOM   2115 C C    . THR   A 1 154 ? -0.97400 23.86300 12.29800  1.000 16.64673  ?  158 THR   A C    1 
ATOM   2116 O O    . THR   A 1 154 ? -2.03900 23.27100 12.54000  1.000 17.79161  ?  158 THR   A O    1 
ATOM   2117 C CB   . THR   A 1 154 ? -2.00200 25.94500 11.41100  1.000 19.47865  ?  158 THR   A CB   1 
ATOM   2118 O OG1  . THR   A 1 154 ? -1.62900 25.69100 10.05100  1.000 20.46561  ?  158 THR   A OG1  1 
ATOM   2119 C CG2  . THR   A 1 154 ? -2.18200 27.42600 11.64400  1.000 20.88935  ?  158 THR   A CG2  1 
ATOM   2120 H H    . THR   A 1 154 ? 0.51600  25.98700 11.14800  1.000 20.52000  ?  158 THR   A H    1 
ATOM   2121 H HA   . THR   A 1 154 ? -1.13900 25.67200 13.24500  1.000 20.40000  ?  158 THR   A HA   1 
ATOM   2122 H HB   . THR   A 1 154 ? -2.85400 25.51600 11.58700  1.000 23.42000  ?  158 THR   A HB   1 
ATOM   2123 H HG1  . THR   A 1 154 ? -1.54700 24.86400 9.92600   1.000 24.61000  ?  158 THR   A HG1  1 
ATOM   2124 H HG21 . THR   A 1 154 ? -2.85400 27.77800 11.03900  1.000 25.12000  ?  158 THR   A HG21 1 
ATOM   2125 H HG22 . THR   A 1 154 ? -2.46700 27.58600 12.55800  1.000 25.12000  ?  158 THR   A HG22 1 
ATOM   2126 H HG23 . THR   A 1 154 ? -1.34500 27.89000 11.49000  1.000 25.12000  ?  158 THR   A HG23 1 
ATOM   2127 N N    . THR   A 1 155 ? 0.15400  23.21100 12.02100  1.000 16.55462  ?  159 THR   A N    1 
ATOM   2128 C CA   . THR   A 1 155 ? 0.22000  21.76600 11.87100  1.000 16.43881  ?  159 THR   A CA   1 
ATOM   2129 C C    . THR   A 1 155 ? 0.78400  21.09900 13.11300  1.000 16.39407  ?  159 THR   A C    1 
ATOM   2130 O O    . THR   A 1 155 ? 0.28500  20.07500 13.56400  1.000 16.09930  ?  159 THR   A O    1 
ATOM   2131 C CB   . THR   A 1 155 ? 1.12200  21.43600 10.66600  1.000 16.75201  ?  159 THR   A CB   1 
ATOM   2132 O OG1  . THR   A 1 155 ? 0.64100  22.13900 9.51600   1.000 17.43893  ?  159 THR   A OG1  1 
ATOM   2133 C CG2  . THR   A 1 155 ? 1.14800  19.95100 10.37600  1.000 17.82582  ?  159 THR   A CG2  1 
ATOM   2134 H H    . THR   A 1 155 ? 0.91400  23.59800 11.91200  1.000 19.92000  ?  159 THR   A H    1 
ATOM   2135 H HA   . THR   A 1 155 ? -0.66800 21.41100 11.71000  1.000 19.78000  ?  159 THR   A HA   1 
ATOM   2136 H HB   . THR   A 1 155 ? 2.03100  21.70600 10.86800  1.000 20.15000  ?  159 THR   A HB   1 
ATOM   2137 H HG1  . THR   A 1 155 ? 1.04500  21.87500 8.82800   1.000 20.98000  ?  159 THR   A HG1  1 
ATOM   2138 H HG21 . THR   A 1 155 ? 1.56900  19.78800 9.51800   1.000 21.44000  ?  159 THR   A HG21 1 
ATOM   2139 H HG22 . THR   A 1 155 ? 1.64900  19.48700 11.06500  1.000 21.44000  ?  159 THR   A HG22 1 
ATOM   2140 H HG23 . THR   A 1 155 ? 0.24400  19.60100 10.35400  1.000 21.44000  ?  159 THR   A HG23 1 
ATOM   2141 N N    . PHE   A 1 156 ? 1.87200  21.64500 13.64100  1.000 15.43080  ?  160 PHE   A N    1 
ATOM   2142 C CA   . PHE   A 1 156 ? 2.54000  21.06100 14.79400  1.000 14.98338  ?  160 PHE   A CA   1 
ATOM   2143 C C    . PHE   A 1 156 ? 1.57100  20.81500 15.94600  1.000 15.16761  ?  160 PHE   A C    1 
ATOM   2144 O O    . PHE   A 1 156 ? 0.78500  21.69600 16.33000  1.000 15.58082  ?  160 PHE   A O    1 
ATOM   2145 C CB   . PHE   A 1 156 ? 3.61400  22.04500 15.26200  1.000 15.56239  ?  160 PHE   A CB   1 
ATOM   2146 C CG   . PHE   A 1 156 ? 4.40000  21.60000 16.47800  1.000 14.95179  ?  160 PHE   A CG   1 
ATOM   2147 C CD1  . PHE   A 1 156 ? 3.88500  21.70600 17.76600  1.000 15.25972  ?  160 PHE   A CD1  1 
ATOM   2148 C CD2  . PHE   A 1 156 ? 5.70300  21.13800 16.33300  1.000 15.45712  ?  160 PHE   A CD2  1 
ATOM   2149 C CE1  . PHE   A 1 156 ? 4.62500  21.31400 18.85400  1.000 15.60713  ?  160 PHE   A CE1  1 
ATOM   2150 C CE2  . PHE   A 1 156 ? 6.45700  20.74400 17.43900  1.000 16.11509  ?  160 PHE   A CE2  1 
ATOM   2151 C CZ   . PHE   A 1 156 ? 5.91500  20.83400 18.69900  1.000 15.68872  ?  160 PHE   A CZ   1 
ATOM   2152 H H    . PHE   A 1 156 ? 2.24700  22.36100 13.34700  1.000 18.57000  ?  160 PHE   A H    1 
ATOM   2153 H HA   . PHE   A 1 156 ? 2.92900  20.20900 14.54300  1.000 18.03000  ?  160 PHE   A HA   1 
ATOM   2154 H HB2  . PHE   A 1 156 ? 4.24700  22.17700 14.53900  1.000 18.72000  ?  160 PHE   A HB2  1 
ATOM   2155 H HB3  . PHE   A 1 156 ? 3.18500  22.88600 15.48500  1.000 18.72000  ?  160 PHE   A HB3  1 
ATOM   2156 H HD1  . PHE   A 1 156 ? 3.02900  22.04800 17.89200  1.000 18.36000  ?  160 PHE   A HD1  1 
ATOM   2157 H HD2  . PHE   A 1 156 ? 6.07900  21.09000 15.48300  1.000 18.60000  ?  160 PHE   A HD2  1 
ATOM   2158 H HE1  . PHE   A 1 156 ? 4.25600  21.37100 19.70600  1.000 18.78000  ?  160 PHE   A HE1  1 
ATOM   2159 H HE2  . PHE   A 1 156 ? 7.32200  20.42200 17.32500  1.000 19.39000  ?  160 PHE   A HE2  1 
ATOM   2160 H HZ   . PHE   A 1 156 ? 6.41100  20.57400 19.44100  1.000 18.87000  ?  160 PHE   A HZ   1 
ATOM   2161 N N    . ARG   A 1 157 ? 1.66700  19.63200 16.55100  1.000 15.43869  ?  161 ARG   A N    1 
ATOM   2162 C CA   . ARG   A 1 157 ? 1.02100  19.42300 17.84400  1.000 15.23867  ?  161 ARG   A CA   1 
ATOM   2163 C C    . ARG   A 1 157 ? 1.90400  18.55600 18.71900  1.000 14.05958  ?  161 ARG   A C    1 
ATOM   2164 O O    . ARG   A 1 157 ? 2.32600  17.47200 18.30100  1.000 15.01759  ?  161 ARG   A O    1 
ATOM   2165 C CB   . ARG   A 1 157 ? -0.38700 18.80500 17.68900  1.000 15.77294  ?  161 ARG   A CB   1 
ATOM   2166 C CG   . ARG   A 1 157 ? -0.43800 17.53400 16.88500  1.000 15.34921  ?  161 ARG   A CG   1 
ATOM   2167 C CD   . ARG   A 1 157 ? -1.87400 17.08000 16.61000  1.000 15.90191  ?  161 ARG   A CD   1 
ATOM   2168 N NE   . ARG   A 1 157 ? -2.50500 16.63100 17.83900  1.000 15.85453  ?  161 ARG   A NE   1 
ATOM   2169 C CZ   . ARG   A 1 157 ? -3.75300 16.18700 17.91100  1.000 17.04941  ?  161 ARG   A CZ   1 
ATOM   2170 N NH1  . ARG   A 1 157 ? -4.50500 16.06500 16.83200  1.000 18.03637  ?  161 ARG   A NH1  1 
ATOM   2171 N NH2  . ARG   A 1 157 ? -4.25500 15.84900 19.09000  1.000 17.44156  ?  161 ARG   A NH2  1 
ATOM   2172 H H    . ARG   A 1 157 ? 2.09100  18.95100 16.23900  1.000 18.58000  ?  161 ARG   A H    1 
ATOM   2173 H HA   . ARG   A 1 157 ? 0.91600  20.27900 18.28900  1.000 18.34000  ?  161 ARG   A HA   1 
ATOM   2174 H HB2  . ARG   A 1 157 ? -0.73300 18.60500 18.57300  1.000 18.98000  ?  161 ARG   A HB2  1 
ATOM   2175 H HB3  . ARG   A 1 157 ? -0.95900 19.45200 17.24700  1.000 18.98000  ?  161 ARG   A HB3  1 
ATOM   2176 H HG2  . ARG   A 1 157 ? 0.00100  17.67900 16.03200  1.000 18.47000  ?  161 ARG   A HG2  1 
ATOM   2177 H HG3  . ARG   A 1 157 ? 0.01300  16.82900 17.37500  1.000 18.47000  ?  161 ARG   A HG3  1 
ATOM   2178 H HD2  . ARG   A 1 157 ? -2.38700 17.82100 16.25200  1.000 19.13000  ?  161 ARG   A HD2  1 
ATOM   2179 H HD3  . ARG   A 1 157 ? -1.86800 16.34400 15.97800  1.000 19.13000  ?  161 ARG   A HD3  1 
ATOM   2180 H HE   . ARG   A 1 157 ? -2.04200 16.65400 18.56300  1.000 19.07000  ?  161 ARG   A HE   1 
ATOM   2181 H HH11 . ARG   A 1 157 ? -4.18800 16.27500 16.06100  1.000 21.70000  ?  161 ARG   A HH11 1 
ATOM   2182 H HH12 . ARG   A 1 157 ? -5.31200 15.77500 16.90100  1.000 21.70000  ?  161 ARG   A HH12 1 
ATOM   2183 H HH21 . ARG   A 1 157 ? -3.77300 15.91900 19.79900  1.000 20.98000  ?  161 ARG   A HH21 1 
ATOM   2184 H HH22 . ARG   A 1 157 ? -5.06300 15.56000 19.14700  1.000 20.98000  ?  161 ARG   A HH22 1 
ATOM   2185 N N    . LEU   A 1 158 ? 2.13800  19.01800 19.95200  1.000 14.23065  ?  162 LEU   A N    1 
ATOM   2186 C CA   . LEU   A 1 158 ? 2.64000  18.15700 21.01000  1.000 14.57806  ?  162 LEU   A CA   1 
ATOM   2187 C C    . LEU   A 1 158 ? 1.49900  17.94700 21.99200  1.000 15.49396  ?  162 LEU   A C    1 
ATOM   2188 O O    . LEU   A 1 158 ? 0.80200  18.90400 22.36100  1.000 15.67293  ?  162 LEU   A O    1 
ATOM   2189 C CB   . LEU   A 1 158 ? 3.86800  18.72000 21.73600  1.000 14.65702  ?  162 LEU   A CB   1 
ATOM   2190 C CG   . LEU   A 1 158 ? 4.72000  17.62100 22.37200  1.000 15.50186  ?  162 LEU   A CG   1 
ATOM   2191 C CD1  . LEU   A 1 158 ? 5.48800  16.82300 21.31900  1.000 16.02297  ?  162 LEU   A CD1  1 
ATOM   2192 C CD2  . LEU   A 1 158 ? 5.66100  18.17700 23.44900  1.000 16.94414  ?  162 LEU   A CD2  1 
ATOM   2193 H H    . LEU   A 1 158 ? 2.01100  19.83300 20.19400  1.000 17.13000  ?  162 LEU   A H    1 
ATOM   2194 H HA   . LEU   A 1 158 ? 2.93500  17.31300 20.63200  1.000 17.54000  ?  162 LEU   A HA   1 
ATOM   2195 H HB2  . LEU   A 1 158 ? 4.42000  19.20100 21.10000  1.000 17.64000  ?  162 LEU   A HB2  1 
ATOM   2196 H HB3  . LEU   A 1 158 ? 3.57400  19.32000 22.44000  1.000 17.64000  ?  162 LEU   A HB3  1 
ATOM   2197 H HG   . LEU   A 1 158 ? 4.11700  17.00400 22.81500  1.000 18.65000  ?  162 LEU   A HG   1 
ATOM   2198 H HD11 . LEU   A 1 158 ? 6.05100  16.17000 21.76500  1.000 19.28000  ?  162 LEU   A HD11 1 
ATOM   2199 H HD12 . LEU   A 1 158 ? 4.85400  16.37100 20.74000  1.000 19.28000  ?  162 LEU   A HD12 1 
ATOM   2200 H HD13 . LEU   A 1 158 ? 6.03600  17.43100 20.79900  1.000 19.28000  ?  162 LEU   A HD13 1 
ATOM   2201 H HD21 . LEU   A 1 158 ? 6.22400  17.45800 23.77800  1.000 20.39000  ?  162 LEU   A HD21 1 
ATOM   2202 H HD22 . LEU   A 1 158 ? 6.21000  18.87500 23.05900  1.000 20.39000  ?  162 LEU   A HD22 1 
ATOM   2203 H HD23 . LEU   A 1 158 ? 5.13100  18.54000 24.17500  1.000 20.39000  ?  162 LEU   A HD23 1 
ATOM   2204 N N    . ASP   A 1 159 ? 1.33700  16.70900 22.40300  1.000 14.56754  ?  163 ASP   A N    1 
ATOM   2205 C CA   . ASP   A 1 159 ? 0.22900  16.28900 23.23700  1.000 15.14129  ?  163 ASP   A CA   1 
ATOM   2206 C C    . ASP   A 1 159 ? 0.65500  15.61300 24.52600  1.000 15.80453  ?  163 ASP   A C    1 
ATOM   2207 O O    . ASP   A 1 159 ? -0.10700 15.64000 25.51000  1.000 17.66528  ?  163 ASP   A O    1 
ATOM   2208 C CB   . ASP   A 1 159 ? -0.62300 15.29800 22.43900  1.000 15.38606  ?  163 ASP   A CB   1 
ATOM   2209 C CG   . ASP   A 1 159 ? -1.27000 15.92300 21.21600  1.000 16.41776  ?  163 ASP   A CG   1 
ATOM   2210 O OD1  . ASP   A 1 159 ? -0.61200 16.06200 20.16600  1.000 15.48080  ?  163 ASP   A OD1  1 
ATOM   2211 O OD2  . ASP   A 1 159 ? -2.48600 16.24700 21.29000  1.000 17.30207  -1 163 ASP   A OD2  1 
ATOM   2212 H H    . ASP   A 1 159 ? 1.87500  16.06700 22.20700  1.000 17.53000  ?  163 ASP   A H    1 
ATOM   2213 H HA   . ASP   A 1 159 ? -0.30600 17.06100 23.47900  1.000 18.22000  ?  163 ASP   A HA   1 
ATOM   2214 H HB2  . ASP   A 1 159 ? -0.06000 14.56800 22.13900  1.000 18.51000  ?  163 ASP   A HB2  1 
ATOM   2215 H HB3  . ASP   A 1 159 ? -1.33000 14.95800 23.01000  1.000 18.51000  ?  163 ASP   A HB3  1 
ATOM   2216 N N    . ARG   A 1 160 ? 1.83200  14.99900 24.55200  1.000 15.38869  ?  164 ARG   A N    1 
ATOM   2217 C CA   . ARG   A 1 160 ? 2.27900  14.17100 25.66100  1.000 15.69399  ?  164 ARG   A CA   1 
ATOM   2218 C C    . ARG   A 1 160 ? 3.72600  14.51400 26.01300  1.000 15.97823  ?  164 ARG   A C    1 
ATOM   2219 O O    . ARG   A 1 160 ? 4.37900  15.31400 25.34400  1.000 16.38881  ?  164 ARG   A O    1 
ATOM   2220 C CB   . ARG   A 1 160 ? 2.12200  12.69000 25.31100  1.000 16.68358  ?  164 ARG   A CB   1 
ATOM   2221 C CG   . ARG   A 1 160 ? 0.64400  12.21200 25.27300  1.000 15.83348  ?  164 ARG   A CG   1 
ATOM   2222 C CD   . ARG   A 1 160 ? 0.52400  10.81400 24.73400  1.000 15.96244  ?  164 ARG   A CD   1 
ATOM   2223 N NE   . ARG   A 1 160 ? 0.94900  10.77000 23.33800  1.000 15.96507  ?  164 ARG   A NE   1 
ATOM   2224 C CZ   . ARG   A 1 160 ? 1.13800  9.66800  22.62600  1.000 16.29406  ?  164 ARG   A CZ   1 
ATOM   2225 N NH1  . ARG   A 1 160 ? 0.86400  8.47900  23.11900  1.000 17.18364  ?  164 ARG   A NH1  1 
ATOM   2226 N NH2  . ARG   A 1 160 ? 1.65500  9.76600  21.39400  1.000 15.62029  ?  164 ARG   A NH2  1 
ATOM   2227 H H    . ARG   A 1 160 ? 2.40800  15.05000 23.91600  1.000 18.51000  ?  164 ARG   A H    1 
ATOM   2228 H HA   . ARG   A 1 160 ? 1.75000  14.36300 26.45100  1.000 18.88000  ?  164 ARG   A HA   1 
ATOM   2229 H HB2  . ARG   A 1 160 ? 2.50700  12.53300 24.43400  1.000 20.07000  ?  164 ARG   A HB2  1 
ATOM   2230 H HB3  . ARG   A 1 160 ? 2.58800  12.16000 25.97700  1.000 20.07000  ?  164 ARG   A HB3  1 
ATOM   2231 H HG2  . ARG   A 1 160 ? 0.28100  12.22400 26.17200  1.000 19.05000  ?  164 ARG   A HG2  1 
ATOM   2232 H HG3  . ARG   A 1 160 ? 0.13100  12.80400 24.70000  1.000 19.05000  ?  164 ARG   A HG3  1 
ATOM   2233 H HD2  . ARG   A 1 160 ? 1.08900  10.21700 25.24900  1.000 19.20000  ?  164 ARG   A HD2  1 
ATOM   2234 H HD3  . ARG   A 1 160 ? -0.40000 10.52400 24.78700  1.000 19.20000  ?  164 ARG   A HD3  1 
ATOM   2235 H HE   . ARG   A 1 160 ? 1.08700  11.52300 22.94500  1.000 19.21000  ?  164 ARG   A HE   1 
ATOM   2236 H HH11 . ARG   A 1 160 ? 0.55500  8.40500  23.91900  1.000 20.67000  ?  164 ARG   A HH11 1 
ATOM   2237 H HH12 . ARG   A 1 160 ? 0.99300  7.77500  22.64200  1.000 20.67000  ?  164 ARG   A HH12 1 
ATOM   2238 H HH21 . ARG   A 1 160 ? 1.85900  10.53700 21.07300  1.000 18.79000  ?  164 ARG   A HH21 1 
ATOM   2239 H HH22 . ARG   A 1 160 ? 1.78100  9.05700  20.92400  1.000 18.79000  ?  164 ARG   A HH22 1 
ATOM   2240 N N    . TRP   A 1 161 ? 4.20600  13.89600 27.09000  1.000 16.86255  ?  165 TRP   A N    1 
ATOM   2241 C CA   . TRP   A 1 161 ? 5.53600  14.10700 27.64000  1.000 17.28628  ?  165 TRP   A CA   1 
ATOM   2242 C C    . TRP   A 1 161 ? 6.43000  12.93400 27.25600  1.000 16.59146  ?  165 TRP   A C    1 
ATOM   2243 O O    . TRP   A 1 161 ? 5.98900  11.95300 26.66100  1.000 17.31260  ?  165 TRP   A O    1 
ATOM   2244 C CB   . TRP   A 1 161 ? 5.42200  14.22700 29.15500  1.000 18.28114  ?  165 TRP   A CB   1 
ATOM   2245 C CG   . TRP   A 1 161 ? 4.54200  15.32300 29.65500  1.000 19.40233  ?  165 TRP   A CG   1 
ATOM   2246 C CD1  . TRP   A 1 161 ? 3.17100  15.36400 29.62200  1.000 19.69447  ?  165 TRP   A CD1  1 
ATOM   2247 C CD2  . TRP   A 1 161 ? 4.96400  16.52500 30.29900  1.000 18.92069  ?  165 TRP   A CD2  1 
ATOM   2248 N NE1  . TRP   A 1 161 ? 2.72300  16.52500 30.21200  1.000 19.82869  ?  165 TRP   A NE1  1 
ATOM   2249 C CE2  . TRP   A 1 161 ? 3.80200  17.25600 30.63400  1.000 19.19704  ?  165 TRP   A CE2  1 
ATOM   2250 C CE3  . TRP   A 1 161 ? 6.21800  17.05400 30.63900  1.000 19.57340  ?  165 TRP   A CE3  1 
ATOM   2251 C CZ2  . TRP   A 1 161 ? 3.85700  18.48400 31.30100  1.000 19.92344  ?  165 TRP   A CZ2  1 
ATOM   2252 C CZ3  . TRP   A 1 161 ? 6.27400  18.27800 31.28900  1.000 20.32349  ?  165 TRP   A CZ3  1 
ATOM   2253 C CH2  . TRP   A 1 161 ? 5.10600  18.98000 31.61300  1.000 20.59194  ?  165 TRP   A CH2  1 
ATOM   2254 H H    . TRP   A 1 161 ? 3.75400  13.32000 27.54000  1.000 20.28000  ?  165 TRP   A H    1 
ATOM   2255 H HA   . TRP   A 1 161 ? 5.92500  14.92000 27.28200  1.000 20.79000  ?  165 TRP   A HA   1 
ATOM   2256 H HB2  . TRP   A 1 161 ? 5.06600  13.39300 29.50000  1.000 21.99000  ?  165 TRP   A HB2  1 
ATOM   2257 H HB3  . TRP   A 1 161 ? 6.30900  14.38300 29.51500  1.000 21.99000  ?  165 TRP   A HB3  1 
ATOM   2258 H HD1  . TRP   A 1 161 ? 2.62500  14.70600 29.25500  1.000 23.68000  ?  165 TRP   A HD1  1 
ATOM   2259 H HE1  . TRP   A 1 161 ? 1.89900  16.75400 30.30100  1.000 23.84000  ?  165 TRP   A HE1  1 
ATOM   2260 H HE3  . TRP   A 1 161 ? 6.99800  16.59100 30.43400  1.000 23.53000  ?  165 TRP   A HE3  1 
ATOM   2261 H HZ2  . TRP   A 1 161 ? 3.08200  18.94800 31.52500  1.000 23.95000  ?  165 TRP   A HZ2  1 
ATOM   2262 H HZ3  . TRP   A 1 161 ? 7.10100  18.64000 31.51300  1.000 24.43000  ?  165 TRP   A HZ3  1 
ATOM   2263 H HH2  . TRP   A 1 161 ? 5.17400  19.79900 32.04900  1.000 24.76000  ?  165 TRP   A HH2  1 
ATOM   2264 N N    . GLU   A 1 162 ? 7.71500  13.02500 27.60900  1.000 17.14153  ?  166 GLU   A N    1 
ATOM   2265 C CA   . GLU   A 1 162 ? 8.60700  11.88400 27.44500  1.000 16.61778  ?  166 GLU   A CA   1 
ATOM   2266 C C    . GLU   A 1 162 ? 8.29900  10.89400 28.56200  1.000 18.44695  ?  166 GLU   A C    1 
ATOM   2267 O O    . GLU   A 1 162 ? 8.15600  11.30400 29.71800  1.000 19.12335  ?  166 GLU   A O    1 
ATOM   2268 C CB   . GLU   A 1 162 ? 10.06300 12.35400 27.53800  1.000 16.54146  ?  166 GLU   A CB   1 
ATOM   2269 C CG   . GLU   A 1 162 ? 10.52300 13.16800 26.36300  1.000 17.04678  ?  166 GLU   A CG   1 
ATOM   2270 C CD   . GLU   A 1 162 ? 10.71700 12.33300 25.10600  1.000 16.63357  ?  166 GLU   A CD   1 
ATOM   2271 O OE1  . GLU   A 1 162 ? 10.52200 11.10200 25.15200  1.000 16.30459  ?  166 GLU   A OE1  1 
ATOM   2272 O OE2  . GLU   A 1 162 ? 11.09200 12.92900 24.07500  1.000 16.74938  -1 166 GLU   A OE2  1 
ATOM   2273 H H    . GLU   A 1 162 ? 8.08500  13.72800 27.93900  1.000 20.62000  ?  166 GLU   A H    1 
ATOM   2274 H HA   . GLU   A 1 162 ? 8.48300  11.45600 26.58300  1.000 19.99000  ?  166 GLU   A HA   1 
ATOM   2275 H HB2  . GLU   A 1 162 ? 10.16200 12.90100 28.33300  1.000 19.90000  ?  166 GLU   A HB2  1 
ATOM   2276 H HB3  . GLU   A 1 162 ? 10.63700 11.57400 27.59800  1.000 19.90000  ?  166 GLU   A HB3  1 
ATOM   2277 H HG2  . GLU   A 1 162 ? 9.85900  13.84900 26.17100  1.000 20.51000  ?  166 GLU   A HG2  1 
ATOM   2278 H HG3  . GLU   A 1 162 ? 11.37200 13.58400 26.58000  1.000 20.51000  ?  166 GLU   A HG3  1 
ATOM   2279 N N    . LEU   A 1 163 ? 8.18100  9.59500  28.24700  1.000 17.04415  ?  167 LEU   A N    1 
ATOM   2280 C CA   . LEU   A 1 163 ? 8.45100  8.98400  26.96600  1.000 17.81793  ?  167 LEU   A CA   1 
ATOM   2281 C C    . LEU   A 1 163 ? 7.21300  8.65500  26.14500  1.000 16.47040  ?  167 LEU   A C    1 
ATOM   2282 O O    . LEU   A 1 163 ? 7.32000  8.09500  25.04800  1.000 16.69674  ?  167 LEU   A O    1 
ATOM   2283 C CB   . LEU   A 1 163 ? 9.14500  7.63600  27.19700  1.000 20.58931  ?  167 LEU   A CB   1 
ATOM   2284 C CG   . LEU   A 1 163 ? 10.45800 7.48900  27.93900  1.000 23.33964  ?  167 LEU   A CG   1 
ATOM   2285 C CD1  . LEU   A 1 163 ? 10.73800 6.03100  28.26400  1.000 24.77402  ?  167 LEU   A CD1  1 
ATOM   2286 C CD2  . LEU   A 1 163 ? 11.49400 8.05900  27.04900  1.000 22.19477  ?  167 LEU   A CD2  1 
ATOM   2287 H H    . LEU   A 1 163 ? 7.92200  9.00500  28.81700  1.000 20.50000  ?  167 LEU   A H    1 
ATOM   2288 H HA   . LEU   A 1 163 ? 8.98700  9.62300  26.47100  1.000 21.43000  ?  167 LEU   A HA   1 
ATOM   2289 H HB2  . LEU   A 1 163 ? 8.51400  7.08400  27.68600  1.000 24.76000  ?  167 LEU   A HB2  1 
ATOM   2290 H HB3  . LEU   A 1 163 ? 9.30600  7.25700  26.31900  1.000 24.76000  ?  167 LEU   A HB3  1 
ATOM   2291 H HG   . LEU   A 1 163 ? 10.44800 7.95000  28.79300  1.000 28.06000  ?  167 LEU   A HG   1 
ATOM   2292 H HD11 . LEU   A 1 163 ? 11.65900 5.94500  28.55700  1.000 29.78000  ?  167 LEU   A HD11 1 
ATOM   2293 H HD12 . LEU   A 1 163 ? 10.13800 5.74300  28.96900  1.000 29.78000  ?  167 LEU   A HD12 1 
ATOM   2294 H HD13 . LEU   A 1 163 ? 10.59400 5.49700  27.46700  1.000 29.78000  ?  167 LEU   A HD13 1 
ATOM   2295 H HD21 . LEU   A 1 163 ? 12.35800 7.98700  27.48400  1.000 26.69000  ?  167 LEU   A HD21 1 
ATOM   2296 H HD22 . LEU   A 1 163 ? 11.50100 7.56400  26.21500  1.000 26.69000  ?  167 LEU   A HD22 1 
ATOM   2297 H HD23 . LEU   A 1 163 ? 11.28600 8.99100  26.87900  1.000 26.69000  ?  167 LEU   A HD23 1 
ATOM   2298 N N    . GLU   A 1 164 ? 6.02700  8.94200  26.69600  1.000 16.98625  ?  168 GLU   A N    1 
ATOM   2299 C CA   . GLU   A 1 164 ? 4.79400  8.48900  26.05000  1.000 17.25207  ?  168 GLU   A CA   1 
ATOM   2300 C C    . GLU   A 1 164 ? 4.63300  9.04300  24.63600  1.000 15.82032  ?  168 GLU   A C    1 
ATOM   2301 O O    . GLU   A 1 164 ? 3.97800  8.41300  23.79200  1.000 16.29143  ?  168 GLU   A O    1 
ATOM   2302 C CB   . GLU   A 1 164 ? 3.59400  8.88800  26.90800  1.000 19.22599  ?  168 GLU   A CB   1 
ATOM   2303 C CG   . GLU   A 1 164 ? 3.45700  8.10100  28.19800  1.000 21.47363  ?  168 GLU   A CG   1 
ATOM   2304 C CD   . GLU   A 1 164 ? 4.31500  8.60200  29.37700  1.000 24.62927  ?  168 GLU   A CD   1 
ATOM   2305 O OE1  . GLU   A 1 164 ? 5.00100  9.66400  29.30400  1.000 25.20302  ?  168 GLU   A OE1  1 
ATOM   2306 O OE2  . GLU   A 1 164 ? 4.28700  7.89300  30.40600  0.450 24.32134  -1 168 GLU   A OE2  1 
ATOM   2307 H H    . GLU   A 1 164 ? 5.91300  9.38500  27.42500  1.000 20.43000  ?  168 GLU   A H    1 
ATOM   2308 H HA   . GLU   A 1 164 ? 4.82600  7.52200  25.97700  1.000 20.75000  ?  168 GLU   A HA   1 
ATOM   2309 H HB2  . GLU   A 1 164 ? 3.68100  9.82500  27.14400  1.000 23.12000  ?  168 GLU   A HB2  1 
ATOM   2310 H HB3  . GLU   A 1 164 ? 2.78500  8.74900  26.39200  1.000 23.12000  ?  168 GLU   A HB3  1 
ATOM   2311 H HG2  . GLU   A 1 164 ? 2.53000  8.13700  28.48100  1.000 25.82000  ?  168 GLU   A HG2  1 
ATOM   2312 H HG3  . GLU   A 1 164 ? 3.71500  7.18200  28.02400  1.000 25.82000  ?  168 GLU   A HG3  1 
ATOM   2313 N N    . LEU   A 1 165 ? 5.18500  10.22400 24.36200  1.000 16.33091  ?  169 LEU   A N    1 
ATOM   2314 C CA   . LEU   A 1 165 ? 5.03000  10.85300 23.05700  1.000 15.02812  ?  169 LEU   A CA   1 
ATOM   2315 C C    . LEU   A 1 165 ? 5.69200  10.07600 21.92800  1.000 15.62029  ?  169 LEU   A C    1 
ATOM   2316 O O    . LEU   A 1 165 ? 5.46700  10.41900 20.76400  1.000 16.49935  ?  169 LEU   A O    1 
ATOM   2317 C CB   . LEU   A 1 165 ? 5.52900  12.29400 23.08800  1.000 14.66492  ?  169 LEU   A CB   1 
ATOM   2318 C CG   . LEU   A 1 165 ? 7.03600  12.50000 23.35800  1.000 15.05970  ?  169 LEU   A CG   1 
ATOM   2319 C CD1  . LEU   A 1 165 ? 7.88700  12.35900 22.08800  1.000 15.97823  ?  169 LEU   A CD1  1 
ATOM   2320 C CD2  . LEU   A 1 165 ? 7.25800  13.85500 23.96000  1.000 15.08339  ?  169 LEU   A CD2  1 
ATOM   2321 H H    . LEU   A 1 165 ? 5.65600  10.68100 24.91700  1.000 19.65000  ?  169 LEU   A H    1 
ATOM   2322 H HA   . LEU   A 1 165 ? 4.08200  10.88900 22.85600  1.000 18.08000  ?  169 LEU   A HA   1 
ATOM   2323 H HB2  . LEU   A 1 165 ? 5.33700  12.69600 22.22600  1.000 17.64000  ?  169 LEU   A HB2  1 
ATOM   2324 H HB3  . LEU   A 1 165 ? 5.04800  12.76300 23.78800  1.000 17.64000  ?  169 LEU   A HB3  1 
ATOM   2325 H HG   . LEU   A 1 165 ? 7.32500  11.80700 23.97300  1.000 18.12000  ?  169 LEU   A HG   1 
ATOM   2326 H HD11 . LEU   A 1 165 ? 8.75600  12.76100 22.24400  1.000 19.22000  ?  169 LEU   A HD11 1 
ATOM   2327 H HD12 . LEU   A 1 165 ? 7.99100  11.41800 21.87900  1.000 19.22000  ?  169 LEU   A HD12 1 
ATOM   2328 H HD13 . LEU   A 1 165 ? 7.44000  12.81300 21.35600  1.000 19.22000  ?  169 LEU   A HD13 1 
ATOM   2329 H HD21 . LEU   A 1 165 ? 8.19400  13.94500 24.20000  1.000 18.15000  ?  169 LEU   A HD21 1 
ATOM   2330 H HD22 . LEU   A 1 165 ? 7.01800  14.53300 23.30900  1.000 18.15000  ?  169 LEU   A HD22 1 
ATOM   2331 H HD23 . LEU   A 1 165 ? 6.70400  13.94400 24.75100  1.000 18.15000  ?  169 LEU   A HD23 1 
ATOM   2332 N N    . ASN   A 1 166 ? 6.46200  9.02800  22.22300  1.000 14.91495  ?  170 ASN   A N    1 
ATOM   2333 C CA   . ASN   A 1 166 ? 7.14700  8.26100  21.19000  1.000 15.55713  ?  170 ASN   A CA   1 
ATOM   2334 C C    . ASN   A 1 166 ? 6.35100  7.07500  20.63700  1.000 15.62819  ?  170 ASN   A C    1 
ATOM   2335 O O    . ASN   A 1 166 ? 6.89400  6.30200  19.83800  1.000 16.49145  ?  170 ASN   A O    1 
ATOM   2336 C CB   . ASN   A 1 166 ? 8.48500  7.75400  21.72100  1.000 15.76242  ?  170 ASN   A CB   1 
ATOM   2337 C CG   . ASN   A 1 166 ? 9.42000  8.86900  22.09700  1.000 16.44934  ?  170 ASN   A CG   1 
ATOM   2338 O OD1  . ASN   A 1 166 ? 9.90300  9.61200  21.25300  1.000 16.96782  ?  170 ASN   A OD1  1 
ATOM   2339 N ND2  . ASN   A 1 166 ? 9.65300  9.01300  23.39700  1.000 17.55210  ?  170 ASN   A ND2  1 
ATOM   2340 H H    . ASN   A 1 166 ? 6.60200  8.74200  23.02200  1.000 17.95000  ?  170 ASN   A H    1 
ATOM   2341 H HA   . ASN   A 1 166 ? 7.30200  8.86600  20.44800  1.000 18.72000  ?  170 ASN   A HA   1 
ATOM   2342 H HB2  . ASN   A 1 166 ? 8.32900  7.21400  22.51100  1.000 18.96000  ?  170 ASN   A HB2  1 
ATOM   2343 H HB3  . ASN   A 1 166 ? 8.91600  7.22000  21.03400  1.000 18.96000  ?  170 ASN   A HB3  1 
ATOM   2344 H HD21 . ASN   A 1 166 ? 10.17900 9.63500  23.67400  1.000 21.11000  ?  170 ASN   A HD21 1 
ATOM   2345 H HD22 . ASN   A 1 166 ? 9.27600  8.48600  23.96200  1.000 21.11000  ?  170 ASN   A HD22 1 
ATOM   2346 N N    . SER   A 1 167 ? 5.07400  6.92000  21.00600  1.000 14.96232  ?  171 SER   A N    1 
ATOM   2347 C CA   . SER   A 1 167 ? 4.38100  5.68300  20.68100  1.000 14.86757  ?  171 SER   A CA   1 
ATOM   2348 C C    . SER   A 1 167 ? 4.18000  5.48200  19.17900  1.000 15.15445  ?  171 SER   A C    1 
ATOM   2349 O O    . SER   A 1 167 ? 4.06000  4.34200  18.73600  1.000 15.79137  ?  171 SER   A O    1 
ATOM   2350 C CB   . SER   A 1 167 ? 3.03000  5.59500  21.40700  1.000 15.75978  ?  171 SER   A CB   1 
ATOM   2351 O OG   . SER   A 1 167 ? 2.27200  6.77300  21.23600  1.000 15.46501  ?  171 SER   A OG   1 
ATOM   2352 H H    . SER   A 1 167 ? 4.60500  7.50100  21.43300  1.000 18.00000  ?  171 SER   A H    1 
ATOM   2353 H HA   . SER   A 1 167 ? 4.94100  4.95900  21.00100  1.000 17.89000  ?  171 SER   A HA   1 
ATOM   2354 H HB2  . SER   A 1 167 ? 2.53000  4.84600  21.04600  1.000 18.96000  ?  171 SER   A HB2  1 
ATOM   2355 H HB3  . SER   A 1 167 ? 3.19200  5.46200  22.35400  1.000 18.96000  ?  171 SER   A HB3  1 
ATOM   2356 H HG   . SER   A 1 167 ? 2.16600  6.93100  20.41800  1.000 18.61000  ?  171 SER   A HG   1 
ATOM   2357 N N    . ALA   A 1 168 ? 4.09800  6.55300  18.39300  1.000 15.12813  ?  172 ALA   A N    1 
ATOM   2358 C CA   . ALA   A 1 168 ? 4.15200  6.47600  16.92800  1.000 14.35172  ?  172 ALA   A CA   1 
ATOM   2359 C C    . ALA   A 1 168 ? 3.08000  5.55800  16.33700  1.000 14.69650  ?  172 ALA   A C    1 
ATOM   2360 O O    . ALA   A 1 168 ? 3.29200  4.86600  15.34000  1.000 14.90968  ?  172 ALA   A O    1 
ATOM   2361 C CB   . ALA   A 1 168 ? 5.55200  6.07600  16.44800  1.000 14.49647  ?  172 ALA   A CB   1 
ATOM   2362 H H    . ALA   A 1 168 ? 4.00900  7.35600  18.68800  1.000 18.21000  ?  172 ALA   A H    1 
ATOM   2363 H HA   . ALA   A 1 168 ? 3.95500  7.36300  16.58700  1.000 17.28000  ?  172 ALA   A HA   1 
ATOM   2364 H HB1  . ALA   A 1 168 ? 5.54800  6.01100  15.48000  1.000 17.44000  ?  172 ALA   A HB1  1 
ATOM   2365 H HB2  . ALA   A 1 168 ? 6.18800  6.75200  16.73100  1.000 17.44000  ?  172 ALA   A HB2  1 
ATOM   2366 H HB3  . ALA   A 1 168 ? 5.78600  5.21900  16.83600  1.000 17.44000  ?  172 ALA   A HB3  1 
ATOM   2367 N N    . ILE   A 1 169 ? 1.88600  5.58800  16.93100  1.000 14.50437  ?  173 ILE   A N    1 
ATOM   2368 C CA   . ILE   A 1 169 ? 0.82400  4.66400  16.52700  1.000 15.03601  ?  173 ILE   A CA   1 
ATOM   2369 C C    . ILE   A 1 169 ? 0.29500  5.06100  15.15200  1.000 14.36488  ?  173 ILE   A C    1 
ATOM   2370 O O    . ILE   A 1 169 ? -0.02600 6.23900  14.93300  1.000 15.11234  ?  173 ILE   A O    1 
ATOM   2371 C CB   . ILE   A 1 169 ? -0.29200 4.70100  17.56000  1.000 15.32815  ?  173 ILE   A CB   1 
ATOM   2372 C CG1  . ILE   A 1 169 ? 0.20400  4.10000  18.87600  1.000 17.04678  ?  173 ILE   A CG1  1 
ATOM   2373 C CG2  . ILE   A 1 169 ? -1.52600 3.94400  17.05400  1.000 15.99665  ?  173 ILE   A CG2  1 
ATOM   2374 C CD1  . ILE   A 1 169 ? -0.70600 4.38900  20.05100  1.000 19.03123  ?  173 ILE   A CD1  1 
ATOM   2375 H H    . ILE   A 1 169 ? 1.66700  6.12700  17.56400  1.000 17.45000  ?  173 ILE   A H    1 
ATOM   2376 H HA   . ILE   A 1 169 ? 1.18100  3.76400  16.46400  1.000 18.09000  ?  173 ILE   A HA   1 
ATOM   2377 H HB   . ILE   A 1 169 ? -0.54700 5.62500  17.70900  1.000 18.44000  ?  173 ILE   A HB   1 
ATOM   2378 H HG12 . ILE   A 1 169 ? 0.26500  3.13700  18.77700  1.000 20.50000  ?  173 ILE   A HG12 1 
ATOM   2379 H HG13 . ILE   A 1 169 ? 1.07800  4.46900  19.07900  1.000 20.50000  ?  173 ILE   A HG13 1 
ATOM   2380 H HG21 . ILE   A 1 169 ? -2.12600 3.78300  17.79900  1.000 19.25000  ?  173 ILE   A HG21 1 
ATOM   2381 H HG22 . ILE   A 1 169 ? -1.97200 4.48200  16.38100  1.000 19.25000  ?  173 ILE   A HG22 1 
ATOM   2382 H HG23 . ILE   A 1 169 ? -1.24300 3.10000  16.66900  1.000 19.25000  ?  173 ILE   A HG23 1 
ATOM   2383 H HD11 . ILE   A 1 169 ? -0.24300 4.15900  20.87200  1.000 22.89000  ?  173 ILE   A HD11 1 
ATOM   2384 H HD12 . ILE   A 1 169 ? -0.93100 5.33200  20.05200  1.000 22.89000  ?  173 ILE   A HD12 1 
ATOM   2385 H HD13 . ILE   A 1 169 ? -1.51200 3.85600  19.96500  1.000 22.89000  ?  173 ILE   A HD13 1 
ATOM   2386 N N    . PRO   A 1 170 ? 0.17800  4.13500  14.20200  1.000 14.56227  ?  174 PRO   A N    1 
ATOM   2387 C CA   . PRO   A 1 170 ? -0.30900 4.51300  12.86800  1.000 15.22551  ?  174 PRO   A CA   1 
ATOM   2388 C C    . PRO   A 1 170 ? -1.66200 5.21200  12.93900  1.000 15.16761  ?  174 PRO   A C    1 
ATOM   2389 O O    . PRO   A 1 170 ? -2.61600 4.72300  13.56600  1.000 15.43869  ?  174 PRO   A O    1 
ATOM   2390 C CB   . PRO   A 1 170 ? -0.40400 3.17200  12.14200  1.000 15.56239  ?  174 PRO   A CB   1 
ATOM   2391 C CG   . PRO   A 1 170 ? 0.70400  2.33000  12.78500  1.000 15.79663  ?  174 PRO   A CG   1 
ATOM   2392 C CD   . PRO   A 1 170 ? 0.59800  2.72700  14.25400  1.000 15.24920  ?  174 PRO   A CD   1 
ATOM   2393 H HA   . PRO   A 1 170 ? 0.32900  5.09200  12.42100  1.000 18.32000  ?  174 PRO   A HA   1 
ATOM   2394 H HB2  . PRO   A 1 170 ? -1.27600 2.77300  12.28600  1.000 18.73000  ?  174 PRO   A HB2  1 
ATOM   2395 H HB3  . PRO   A 1 170 ? -0.24700 3.29200  11.19200  1.000 18.73000  ?  174 PRO   A HB3  1 
ATOM   2396 H HG2  . PRO   A 1 170 ? 0.53200  1.38400  12.65700  1.000 19.01000  ?  174 PRO   A HG2  1 
ATOM   2397 H HG3  . PRO   A 1 170 ? 1.57000  2.56300  12.41300  1.000 19.01000  ?  174 PRO   A HG3  1 
ATOM   2398 H HD2  . PRO   A 1 170 ? -0.06600 2.18600  14.70900  1.000 18.35000  ?  174 PRO   A HD2  1 
ATOM   2399 H HD3  . PRO   A 1 170 ? 1.45700  2.64000  14.69700  1.000 18.35000  ?  174 PRO   A HD3  1 
ATOM   2400 N N    . GLY   A 1 171 ? -1.73600 6.37400  12.29500  1.000 15.42290  ?  175 GLY   A N    1 
ATOM   2401 C CA   . GLY   A 1 171 ? -2.96900 7.13900  12.22100  1.000 15.14392  ?  175 GLY   A CA   1 
ATOM   2402 C C    . GLY   A 1 171 ? -3.20600 8.07700  13.38200  1.000 17.01783  ?  175 GLY   A C    1 
ATOM   2403 O O    . GLY   A 1 171 ? -4.12000 8.89300  13.31500  1.000 18.55749  ?  175 GLY   A O    1 
ATOM   2404 H H    . GLY   A 1 171 ? -1.07400 6.74300  11.88800  1.000 18.56000  ?  175 GLY   A H    1 
ATOM   2405 H HA2  . GLY   A 1 171 ? -2.95700 7.67000  11.40900  1.000 18.22000  ?  175 GLY   A HA2  1 
ATOM   2406 H HA3  . GLY   A 1 171 ? -3.71600 6.52100  12.18200  1.000 18.22000  ?  175 GLY   A HA3  1 
ATOM   2407 N N    . ASP   A 1 172 ? -2.38900 8.00300  14.43200  1.000 15.83611  ?  176 ASP   A N    1 
ATOM   2408 C CA   . ASP   A 1 172 ? -2.55600 8.83100  15.61900  1.000 15.57818  ?  176 ASP   A CA   1 
ATOM   2409 C C    . ASP   A 1 172 ? -1.88500 10.17100 15.37500  1.000 15.35447  ?  176 ASP   A C    1 
ATOM   2410 O O    . ASP   A 1 172 ? -0.68000 10.23500 15.11900  1.000 16.22563  ?  176 ASP   A O    1 
ATOM   2411 C CB   . ASP   A 1 172 ? -1.95300 8.06500  16.79900  1.000 15.95191  ?  176 ASP   A CB   1 
ATOM   2412 C CG   . ASP   A 1 172 ? -2.14100 8.74000  18.15100  1.000 15.20972  ?  176 ASP   A CG   1 
ATOM   2413 O OD1  . ASP   A 1 172 ? -2.63800 9.87700  18.25800  1.000 16.60725  ?  176 ASP   A OD1  1 
ATOM   2414 O OD2  . ASP   A 1 172 ? -1.73800 8.08500  19.14000  1.000 17.21522  -1 176 ASP   A OD2  1 
ATOM   2415 H H    . ASP   A 1 172 ? -1.71700 7.46800  14.47900  1.000 19.05000  ?  176 ASP   A H    1 
ATOM   2416 H HA   . ASP   A 1 172 ? -3.48600 9.02000  15.81900  1.000 18.74000  ?  176 ASP   A HA   1 
ATOM   2417 H HB2  . ASP   A 1 172 ? -2.37200 7.19100  16.84700  1.000 19.19000  ?  176 ASP   A HB2  1 
ATOM   2418 H HB3  . ASP   A 1 172 ? -0.99900 7.96700  16.65000  1.000 19.19000  ?  176 ASP   A HB3  1 
ATOM   2419 N N    . ALA   A 1 173 ? -2.65500 11.23900 15.39600  1.000 15.27025  ?  177 ALA   A N    1 
ATOM   2420 C CA   . ALA   A 1 173 ? -2.09300 12.55700 15.15000  1.000 15.83085  ?  177 ALA   A CA   1 
ATOM   2421 C C    . ALA   A 1 173 ? -1.37800 13.15100 16.35900  1.000 15.46501  ?  177 ALA   A C    1 
ATOM   2422 O O    . ALA   A 1 173 ? -0.72200 14.18600 16.22500  1.000 15.76242  ?  177 ALA   A O    1 
ATOM   2423 C CB   . ALA   A 1 173 ? -3.19200 13.52000 14.67400  1.000 16.45197  ?  177 ALA   A CB   1 
ATOM   2424 H H    . ALA   A 1 173 ? -3.50200 11.23100 15.54800  1.000 18.37000  ?  177 ALA   A H    1 
ATOM   2425 H HA   . ALA   A 1 173 ? -1.43700 12.47700 14.44000  1.000 19.05000  ?  177 ALA   A HA   1 
ATOM   2426 H HB1  . ALA   A 1 173 ? -2.79800 14.39100 14.50900  1.000 19.79000  ?  177 ALA   A HB1  1 
ATOM   2427 H HB2  . ALA   A 1 173 ? -3.58300 13.17400 13.85700  1.000 19.79000  ?  177 ALA   A HB2  1 
ATOM   2428 H HB3  . ALA   A 1 173 ? -3.87100 13.59000 15.36300  1.000 19.79000  ?  177 ALA   A HB3  1 
ATOM   2429 N N    . ARG   A 1 174 ? -1.50300 12.56200 17.53700  1.000 15.46501  ?  178 ARG   A N    1 
ATOM   2430 C CA   . ARG   A 1 174 ? -0.81500 13.14100 18.68300  1.000 14.80704  ?  178 ARG   A CA   1 
ATOM   2431 C C    . ARG   A 1 174 ? 0.69000  13.19100 18.44900  1.000 14.65702  ?  178 ARG   A C    1 
ATOM   2432 O O    . ARG   A 1 174 ? 1.28500  12.24500 17.93300  1.000 14.63597  ?  178 ARG   A O    1 
ATOM   2433 C CB   . ARG   A 1 174 ? -1.08800 12.33200 19.94900  1.000 15.67820  ?  178 ARG   A CB   1 
ATOM   2434 C CG   . ARG   A 1 174 ? -2.53800 12.40800 20.43500  1.000 16.29932  ?  178 ARG   A CG   1 
ATOM   2435 C CD   . ARG   A 1 174 ? -2.72800 11.57100 21.68900  1.000 17.04941  ?  178 ARG   A CD   1 
ATOM   2436 N NE   . ARG   A 1 174 ? -2.54300 10.16200 21.41000  1.000 17.54947  ?  178 ARG   A NE   1 
ATOM   2437 C CZ   . ARG   A 1 174 ? -2.51200 9.20500  22.32300  1.000 18.33641  ?  178 ARG   A CZ   1 
ATOM   2438 N NH1  . ARG   A 1 174 ? -2.68900 9.46900  23.60400  1.000 19.38653  ?  178 ARG   A NH1  1 
ATOM   2439 N NH2  . ARG   A 1 174 ? -2.30100 7.95400  21.93300  1.000 17.96794  ?  178 ARG   A NH2  1 
ATOM   2440 H H    . ARG   A 1 174 ? -1.96200 11.85200 17.69600  1.000 18.61000  ?  178 ARG   A H    1 
ATOM   2441 H HA   . ARG   A 1 174 ? -1.14800 14.04300 18.80900  1.000 17.82000  ?  178 ARG   A HA   1 
ATOM   2442 H HB2  . ARG   A 1 174 ? -0.88500 11.40000 19.77200  1.000 18.86000  ?  178 ARG   A HB2  1 
ATOM   2443 H HB3  . ARG   A 1 174 ? -0.52100 12.66700 20.66100  1.000 18.86000  ?  178 ARG   A HB3  1 
ATOM   2444 H HG2  . ARG   A 1 174 ? -2.76400 13.32800 20.64100  1.000 19.61000  ?  178 ARG   A HG2  1 
ATOM   2445 H HG3  . ARG   A 1 174 ? -3.13000 12.06800 19.74600  1.000 19.61000  ?  178 ARG   A HG3  1 
ATOM   2446 H HD2  . ARG   A 1 174 ? -2.07700 11.84000 22.35600  1.000 20.51000  ?  178 ARG   A HD2  1 
ATOM   2447 H HD3  . ARG   A 1 174 ? -3.62600 11.70100 22.03000  1.000 20.51000  ?  178 ARG   A HD3  1 
ATOM   2448 H HE   . ARG   A 1 174 ? -2.44700 9.92900  20.58800  1.000 21.11000  ?  178 ARG   A HE   1 
ATOM   2449 H HH11 . ARG   A 1 174 ? -2.82900 10.27800 23.86200  1.000 23.31000  ?  178 ARG   A HH11 1 
ATOM   2450 H HH12 . ARG   A 1 174 ? -2.66500 8.83200  24.18200  1.000 23.31000  ?  178 ARG   A HH12 1 
ATOM   2451 H HH21 . ARG   A 1 174 ? -2.18700 7.77600  21.09900  1.000 21.61000  ?  178 ARG   A HH21 1 
ATOM   2452 H HH22 . ARG   A 1 174 ? -2.27800 7.32000  22.51400  1.000 21.61000  ?  178 ARG   A HH22 1 
ATOM   2453 N N    . ASP   A 1 175 ? 1.30200  14.28600 18.86600  1.000 14.32803  ?  179 ASP   A N    1 
ATOM   2454 C CA   . ASP   A 1 175 ? 2.77000  14.39500 18.82600  1.000 13.26475  ?  179 ASP   A CA   1 
ATOM   2455 C C    . ASP   A 1 175 ? 3.31100  14.22300 17.41500  1.000 13.63848  ?  179 ASP   A C    1 
ATOM   2456 O O    . ASP   A 1 175 ? 4.33600  13.55800 17.18700  1.000 13.04104  ?  179 ASP   A O    1 
ATOM   2457 C CB   . ASP   A 1 175 ? 3.38300  13.40100 19.79600  1.000 14.28329  ?  179 ASP   A CB   1 
ATOM   2458 C CG   . ASP   A 1 175 ? 2.76500  13.52600 21.16900  1.000 14.88073  ?  179 ASP   A CG   1 
ATOM   2459 O OD1  . ASP   A 1 175 ? 2.90000  14.60400 21.78900  1.000 14.94916  ?  179 ASP   A OD1  1 
ATOM   2460 O OD2  . ASP   A 1 175 ? 2.09900  12.56400 21.62500  1.000 16.33091  -1 179 ASP   A OD2  1 
ATOM   2461 H H    . ASP   A 1 175 ? 0.90100  14.98100 19.17600  1.000 17.24000  ?  179 ASP   A H    1 
ATOM   2462 H HA   . ASP   A 1 175 ? 3.03300  15.28800 19.09800  1.000 15.97000  ?  179 ASP   A HA   1 
ATOM   2463 H HB2  . ASP   A 1 175 ? 3.23000  12.49900 19.47300  1.000 17.19000  ?  179 ASP   A HB2  1 
ATOM   2464 H HB3  . ASP   A 1 175 ? 4.33500  13.57000 19.87200  1.000 17.19000  ?  179 ASP   A HB3  1 
ATOM   2465 N N    . THR   A 1 176 ? 2.66300  14.89500 16.46700  1.000 13.95694  ?  180 THR   A N    1 
ATOM   2466 C CA   . THR   A 1 176 ? 3.07000  14.83600 15.07700  1.000 14.40173  ?  180 THR   A CA   1 
ATOM   2467 C C    . THR   A 1 176 ? 3.18800  16.23000 14.48000  1.000 13.98326  ?  180 THR   A C    1 
ATOM   2468 O O    . THR   A 1 176 ? 2.64400  17.21700 14.98700  1.000 14.06748  ?  180 THR   A O    1 
ATOM   2469 C CB   . THR   A 1 176 ? 2.07500  14.05500 14.17300  1.000 15.31236  ?  180 THR   A CB   1 
ATOM   2470 O OG1  . THR   A 1 176 ? 0.80700  14.73500 14.14200  1.000 15.46501  ?  180 THR   A OG1  1 
ATOM   2471 C CG2  . THR   A 1 176 ? 1.89700  12.61700 14.60800  1.000 15.68083  ?  180 THR   A CG2  1 
ATOM   2472 H H    . THR   A 1 176 ? 1.97900  15.39500 16.61100  1.000 16.80000  ?  180 THR   A H    1 
ATOM   2473 H HA   . THR   A 1 176 ? 3.93400  14.39500 15.07500  1.000 17.33000  ?  180 THR   A HA   1 
ATOM   2474 H HB   . THR   A 1 176 ? 2.44200  14.02100 13.27600  1.000 18.42000  ?  180 THR   A HB   1 
ATOM   2475 H HG1  . THR   A 1 176 ? 0.50900  14.82400 14.92200  1.000 18.61000  ?  180 THR   A HG1  1 
ATOM   2476 H HG21 . THR   A 1 176 ? 1.22600  12.18400 14.05700  1.000 18.87000  ?  180 THR   A HG21 1 
ATOM   2477 H HG22 . THR   A 1 176 ? 2.73500  12.13700 14.52000  1.000 18.87000  ?  180 THR   A HG22 1 
ATOM   2478 H HG23 . THR   A 1 176 ? 1.61200  12.58300 15.53500  1.000 18.87000  ?  180 THR   A HG23 1 
ATOM   2479 N N    . SER   A 1 177 ? 3.92400  16.29900 13.37300  1.000 13.98852  ?  181 SER   A N    1 
ATOM   2480 C CA   . SER   A 1 177 ? 3.80600  17.42200 12.46200  1.000 15.01233  ?  181 SER   A CA   1 
ATOM   2481 C C    . SER   A 1 177 ? 4.00200  16.89900 11.04500  1.000 14.20697  ?  181 SER   A C    1 
ATOM   2482 O O    . SER   A 1 177 ? 4.02700  15.68900 10.81900  1.000 15.65714  ?  181 SER   A O    1 
ATOM   2483 C CB   . SER   A 1 177 ? 4.79400  18.54800 12.79800  1.000 14.69913  ?  181 SER   A CB   1 
ATOM   2484 O OG   . SER   A 1 177 ? 4.37700  19.72400 12.12600  1.000 15.02812  ?  181 SER   A OG   1 
ATOM   2485 H H    . SER   A 1 177 ? 4.49800  15.70500 13.13300  1.000 16.84000  ?  181 SER   A H    1 
ATOM   2486 H HA   . SER   A 1 177 ? 2.91000  17.78300 12.55400  1.000 18.06000  ?  181 SER   A HA   1 
ATOM   2487 H HB2  . SER   A 1 177 ? 4.79800  18.70300 13.75500  1.000 17.69000  ?  181 SER   A HB2  1 
ATOM   2488 H HB3  . SER   A 1 177 ? 5.68300  18.30000 12.49900  1.000 17.69000  ?  181 SER   A HB3  1 
ATOM   2489 H HG   . SER   A 1 177 ? 4.95800  20.32500 12.21100  1.000 18.08000  ?  181 SER   A HG   1 
ATOM   2490 N N    . SER   A 1 178 ? 4.13800  17.80900 10.09500  1.000 14.42278  ?  182 SER   A N    1 
ATOM   2491 C CA   . SER   A 1 178 ? 4.41700  17.43400 8.71100   1.000 14.22802  ?  182 SER   A CA   1 
ATOM   2492 C C    . SER   A 1 178 ? 5.82800  17.86300 8.34100   1.000 14.56754  ?  182 SER   A C    1 
ATOM   2493 O O    . SER   A 1 178 ? 6.33800  18.83200 8.89700   1.000 15.28604  ?  182 SER   A O    1 
ATOM   2494 C CB   . SER   A 1 178 ? 3.46500  18.10200 7.71500   1.000 14.59122  ?  182 SER   A CB   1 
ATOM   2495 O OG   . SER   A 1 178 ? 3.62500  19.48500 7.70700   1.000 14.78862  ?  182 SER   A OG   1 
ATOM   2496 H H    . SER   A 1 178 ? 4.07400  18.65700 10.22300  1.000 17.36000  ?  182 SER   A H    1 
ATOM   2497 H HA   . SER   A 1 178 ? 4.31200  16.47300 8.62800   1.000 17.12000  ?  182 SER   A HA   1 
ATOM   2498 H HB2  . SER   A 1 178 ? 3.65000  17.76000 6.82600   1.000 17.56000  ?  182 SER   A HB2  1 
ATOM   2499 H HB3  . SER   A 1 178 ? 2.55100  17.89400 7.96600   1.000 17.56000  ?  182 SER   A HB3  1 
ATOM   2500 H HG   . SER   A 1 178 ? 3.13900  19.82700 7.11300   1.000 17.80000  ?  182 SER   A HG   1 
ATOM   2501 N N    . PRO   A 1 179 ? 6.46800  17.18700 7.39400   1.000 13.91746  ?  183 PRO   A N    1 
ATOM   2502 C CA   . PRO   A 1 179 ? 7.78900  17.66400 6.94200   1.000 14.68597  ?  183 PRO   A CA   1 
ATOM   2503 C C    . PRO   A 1 179 ? 7.77200  19.12100 6.49400   1.000 15.26762  ?  183 PRO   A C    1 
ATOM   2504 O O    . PRO   A 1 179 ? 8.69100  19.89500 6.79400   1.000 15.77821  ?  183 PRO   A O    1 
ATOM   2505 C CB   . PRO   A 1 179 ? 8.12900  16.69500 5.80600   1.000 15.79137  ?  183 PRO   A CB   1 
ATOM   2506 C CG   . PRO   A 1 179 ? 7.44800  15.44000 6.17300   1.000 15.34658  ?  183 PRO   A CG   1 
ATOM   2507 C CD   . PRO   A 1 179 ? 6.12400  15.89300 6.79700   1.000 14.88863  ?  183 PRO   A CD   1 
ATOM   2508 H HA   . PRO   A 1 179 ? 8.45000  17.55800 7.64400   1.000 17.67000  ?  183 PRO   A HA   1 
ATOM   2509 H HB2  . PRO   A 1 179 ? 7.79500  17.04100 4.96400   1.000 19.00000  ?  183 PRO   A HB2  1 
ATOM   2510 H HB3  . PRO   A 1 179 ? 9.09000  16.56900 5.75500   1.000 19.00000  ?  183 PRO   A HB3  1 
ATOM   2511 H HG2  . PRO   A 1 179 ? 7.29500  14.90100 5.38100   1.000 18.47000  ?  183 PRO   A HG2  1 
ATOM   2512 H HG3  . PRO   A 1 179 ? 7.98400  14.94500 6.81200   1.000 18.47000  ?  183 PRO   A HG3  1 
ATOM   2513 H HD2  . PRO   A 1 179 ? 5.43800  15.99500 6.11800   1.000 17.91000  ?  183 PRO   A HD2  1 
ATOM   2514 H HD3  . PRO   A 1 179 ? 5.82800  15.26500 7.47500   1.000 17.91000  ?  183 PRO   A HD3  1 
ATOM   2515 N N    . ARG   A 1 180 ? 6.71000  19.52900 5.80400   1.000 14.75703  ?  184 ARG   A N    1 
ATOM   2516 C CA   . ARG   A 1 180 ? 6.61700  20.90300 5.33700   1.000 15.22025  ?  184 ARG   A CA   1 
ATOM   2517 C C    . ARG   A 1 180 ? 6.56600  21.89100 6.50100   1.000 14.94653  ?  184 ARG   A C    1 
ATOM   2518 O O    . ARG   A 1 180 ? 7.26100  22.91300 6.49500   1.000 15.73610  ?  184 ARG   A O    1 
ATOM   2519 C CB   . ARG   A 1 180 ? 5.39300  21.06600 4.42300   1.000 15.84664  ?  184 ARG   A CB   1 
ATOM   2520 C CG   . ARG   A 1 180 ? 5.22300  22.45500 3.92800   1.000 16.13351  ?  184 ARG   A CG   1 
ATOM   2521 C CD   . ARG   A 1 180 ? 4.18200  22.51200 2.84700   1.000 17.50210  ?  184 ARG   A CD   1 
ATOM   2522 N NE   . ARG   A 1 180 ? 4.07100  23.84800 2.29700   1.000 19.77342  ?  184 ARG   A NE   1 
ATOM   2523 C CZ   . ARG   A 1 180 ? 3.46200  24.10700 1.14800   1.000 22.63166  ?  184 ARG   A CZ   1 
ATOM   2524 N NH1  . ARG   A 1 180 ? 2.84500  23.15400 0.47500   1.000 23.39228  ?  184 ARG   A NH1  1 
ATOM   2525 N NH2  . ARG   A 1 180 ? 3.49800  25.34100 0.64900   1.000 24.96089  ?  184 ARG   A NH2  1 
ATOM   2526 H H    . ARG   A 1 180 ? 6.03700  19.03400 5.59700   1.000 17.76000  ?  184 ARG   A H    1 
ATOM   2527 H HA   . ARG   A 1 180 ? 7.41000  21.10500 4.81600   1.000 18.31000  ?  184 ARG   A HA   1 
ATOM   2528 H HB2  . ARG   A 1 180 ? 5.49400  20.48400 3.65400   1.000 19.06000  ?  184 ARG   A HB2  1 
ATOM   2529 H HB3  . ARG   A 1 180 ? 4.59600  20.82500 4.91900   1.000 19.06000  ?  184 ARG   A HB3  1 
ATOM   2530 H HG2  . ARG   A 1 180 ? 4.93900  23.02700 4.65900   1.000 19.41000  ?  184 ARG   A HG2  1 
ATOM   2531 H HG3  . ARG   A 1 180 ? 6.06300  22.77500 3.56400   1.000 19.41000  ?  184 ARG   A HG3  1 
ATOM   2532 H HD2  . ARG   A 1 180 ? 4.42800  21.90500 2.13100   1.000 21.05000  ?  184 ARG   A HD2  1 
ATOM   2533 H HD3  . ARG   A 1 180 ? 3.32100  22.25900 3.21500   1.000 21.05000  ?  184 ARG   A HD3  1 
ATOM   2534 H HE   . ARG   A 1 180 ? 4.41500  24.50300 2.73600   1.000 23.77000  ?  184 ARG   A HE   1 
ATOM   2535 H HH11 . ARG   A 1 180 ? 2.83400  22.35000 0.78100   1.000 28.12000  ?  184 ARG   A HH11 1 
ATOM   2536 H HH12 . ARG   A 1 180 ? 2.45500  23.33700 -0.26900  1.000 28.12000  ?  184 ARG   A HH12 1 
ATOM   2537 H HH21 . ARG   A 1 180 ? 3.91400  25.96400 1.07200   1.000 30.00000  ?  184 ARG   A HH21 1 
ATOM   2538 H HH22 . ARG   A 1 180 ? 3.10500  25.51500 -0.09600  1.000 30.00000  ?  184 ARG   A HH22 1 
ATOM   2539 N N    . ALA   A 1 181 ? 5.68500  21.64900 7.47500   1.000 15.35710  ?  185 ALA   A N    1 
ATOM   2540 C CA   . ALA   A 1 181 ? 5.56300  22.58800 8.58200   1.000 15.09391  ?  185 ALA   A CA   1 
ATOM   2541 C C    . ALA   A 1 181 ? 6.83000  22.63200 9.42200   1.000 14.59649  ?  185 ALA   A C    1 
ATOM   2542 O O    . ALA   A 1 181 ? 7.20100  23.69900 9.92500   1.000 15.21235  ?  185 ALA   A O    1 
ATOM   2543 C CB   . ALA   A 1 181 ? 4.35600  22.22900 9.44300   1.000 14.76230  ?  185 ALA   A CB   1 
ATOM   2544 H H    . ALA   A 1 181 ? 5.16200  20.96700 7.51500   1.000 18.48000  ?  185 ALA   A H    1 
ATOM   2545 H HA   . ALA   A 1 181 ? 5.41900  23.47600 8.21900   1.000 18.16000  ?  185 ALA   A HA   1 
ATOM   2546 H HB1  . ALA   A 1 181 ? 4.30000  22.85200 10.18400  1.000 17.76000  ?  185 ALA   A HB1  1 
ATOM   2547 H HB2  . ALA   A 1 181 ? 3.55300  22.28600 8.90200   1.000 17.76000  ?  185 ALA   A HB2  1 
ATOM   2548 H HB3  . ALA   A 1 181 ? 4.46500  21.32500 9.77800   1.000 17.76000  ?  185 ALA   A HB3  1 
ATOM   2549 N N    . VAL   A 1 182 ? 7.47100  21.48000 9.60900   1.000 14.99390  ?  186 VAL   A N    1 
ATOM   2550 C CA   . VAL   A 1 182 ? 8.76000  21.43900 10.29700  1.000 14.78335  ?  186 VAL   A CA   1 
ATOM   2551 C C    . VAL   A 1 182 ? 9.77100  22.33200 9.58700   1.000 14.55174  ?  186 VAL   A C    1 
ATOM   2552 O O    . VAL   A 1 182 ? 10.44300 23.15700 10.22100  1.000 15.19919  ?  186 VAL   A O    1 
ATOM   2553 C CB   . VAL   A 1 182 ? 9.24100  19.98500 10.43400  1.000 14.22013  ?  186 VAL   A CB   1 
ATOM   2554 C CG1  . VAL   A 1 182 ? 10.71900 19.97500 10.86400  1.000 14.14380  ?  186 VAL   A CG1  1 
ATOM   2555 C CG2  . VAL   A 1 182 ? 8.38100  19.22700 11.44800  1.000 14.21486  ?  186 VAL   A CG2  1 
ATOM   2556 H H    . VAL   A 1 182 ? 7.18400  20.71200 9.34900   1.000 18.04000  ?  186 VAL   A H    1 
ATOM   2557 H HA   . VAL   A 1 182 ? 8.65200  21.79400 11.19300  1.000 17.79000  ?  186 VAL   A HA   1 
ATOM   2558 H HB   . VAL   A 1 182 ? 9.15900  19.53400 9.57900   1.000 17.11000  ?  186 VAL   A HB   1 
ATOM   2559 H HG11 . VAL   A 1 182 ? 10.94300 19.09400 11.20300  1.000 17.02000  ?  186 VAL   A HG11 1 
ATOM   2560 H HG12 . VAL   A 1 182 ? 11.27300 20.18400 10.09500  1.000 17.02000  ?  186 VAL   A HG12 1 
ATOM   2561 H HG13 . VAL   A 1 182 ? 10.85100 20.64000 11.55700  1.000 17.02000  ?  186 VAL   A HG13 1 
ATOM   2562 H HG21 . VAL   A 1 182 ? 8.70800  18.31700 11.52200  1.000 17.11000  ?  186 VAL   A HG21 1 
ATOM   2563 H HG22 . VAL   A 1 182 ? 8.44100  19.67200 12.30800  1.000 17.11000  ?  186 VAL   A HG22 1 
ATOM   2564 H HG23 . VAL   A 1 182 ? 7.46000  19.22400 11.14100  1.000 17.11000  ?  186 VAL   A HG23 1 
ATOM   2565 N N    . THR   A 1 183 ? 9.88500  22.19400 8.26900   1.000 15.14655  ?  187 THR   A N    1 
ATOM   2566 C CA   . THR   A 1 183 ? 10.83200 23.00800 7.51600   1.000 15.30447  ?  187 THR   A CA   1 
ATOM   2567 C C    . THR   A 1 183 ? 10.47500 24.48400 7.59200   1.000 16.30722  ?  187 THR   A C    1 
ATOM   2568 O O    . THR   A 1 183 ? 11.34900 25.34400 7.76300   1.000 16.52040  ?  187 THR   A O    1 
ATOM   2569 C CB   . THR   A 1 183 ? 10.87500 22.53800 6.06000   1.000 15.92559  ?  187 THR   A CB   1 
ATOM   2570 O OG1  . THR   A 1 183 ? 11.41500 21.20900 6.01200   1.000 17.78634  ?  187 THR   A OG1  1 
ATOM   2571 C CG2  . THR   A 1 183 ? 11.75600 23.45700 5.21100   1.000 18.06006  ?  187 THR   A CG2  1 
ATOM   2572 H H    . THR   A 1 183 ? 9.42900  21.64200 7.79200   1.000 18.22000  ?  187 THR   A H    1 
ATOM   2573 H HA   . THR   A 1 183 ? 11.71600 22.89600 7.89900   1.000 18.41000  ?  187 THR   A HA   1 
ATOM   2574 H HB   . THR   A 1 183 ? 9.97700  22.55100 5.69400   1.000 19.16000  ?  187 THR   A HB   1 
ATOM   2575 H HG1  . THR   A 1 183 ? 10.87700 20.66800 6.36300   1.000 21.39000  ?  187 THR   A HG1  1 
ATOM   2576 H HG21 . THR   A 1 183 ? 11.82200 23.11000 4.30700   1.000 21.72000  ?  187 THR   A HG21 1 
ATOM   2577 H HG22 . THR   A 1 183 ? 11.37200 24.34700 5.17900   1.000 21.72000  ?  187 THR   A HG22 1 
ATOM   2578 H HG23 . THR   A 1 183 ? 12.64600 23.51000 5.59300   1.000 21.72000  ?  187 THR   A HG23 1 
ATOM   2579 N N    . GLU   A 1 184 ? 9.18800  24.80600 7.39500   1.000 16.18352  ?  188 GLU   A N    1 
ATOM   2580 C CA   . GLU   A 1 184 ? 8.77100  26.20100 7.42700   1.000 16.47566  ?  188 GLU   A CA   1 
ATOM   2581 C C    . GLU   A 1 184 ? 9.05300  26.84100 8.78300   1.000 15.55186  ?  188 GLU   A C    1 
ATOM   2582 O O    . GLU   A 1 184 ? 9.54900  27.97900 8.86000   1.000 16.56778  ?  188 GLU   A O    1 
ATOM   2583 C CB   . GLU   A 1 184 ? 7.28700  26.29300 7.06400   1.000 17.06257  ?  188 GLU   A CB   1 
ATOM   2584 C CG   . GLU   A 1 184 ? 7.06700  25.98600 5.58700   1.000 17.46788  ?  188 GLU   A CG   1 
ATOM   2585 C CD   . GLU   A 1 184 ? 5.61700  25.83800 5.19500   1.000 19.24178  ?  188 GLU   A CD   1 
ATOM   2586 O OE1  . GLU   A 1 184 ? 4.76300  25.55400 6.06700   1.000 19.29705  ?  188 GLU   A OE1  1 
ATOM   2587 O OE2  . GLU   A 1 184 ? 5.35200  25.98400 3.98700   1.000 20.30770  -1 188 GLU   A OE2  1 
ATOM   2588 H H    . GLU   A 1 184 ? 8.55600  24.24300 7.24400   1.000 19.47000  ?  188 GLU   A H    1 
ATOM   2589 H HA   . GLU   A 1 184 ? 9.27500  26.70200 6.76700   1.000 19.82000  ?  188 GLU   A HA   1 
ATOM   2590 H HB2  . GLU   A 1 184 ? 6.78600  25.65100 7.59000   1.000 20.52000  ?  188 GLU   A HB2  1 
ATOM   2591 H HB3  . GLU   A 1 184 ? 6.96700  27.19100 7.24200   1.000 20.52000  ?  188 GLU   A HB3  1 
ATOM   2592 H HG2  . GLU   A 1 184 ? 7.44100  26.70900 5.06000   1.000 21.01000  ?  188 GLU   A HG2  1 
ATOM   2593 H HG3  . GLU   A 1 184 ? 7.51500  25.15300 5.37300   1.000 21.01000  ?  188 GLU   A HG3  1 
ATOM   2594 N N    . SER   A 1 185 ? 8.75800  26.12700 9.86300   1.000 15.68872  ?  189 SER   A N    1 
ATOM   2595 C CA   . SER   A 1 185 ? 9.02400  26.68400 11.18000  1.000 15.22814  ?  189 SER   A CA   1 
ATOM   2596 C C    . SER   A 1 185 ? 10.51400 26.77100 11.46600  1.000 15.97297  ?  189 SER   A C    1 
ATOM   2597 O O    . SER   A 1 185 ? 10.97200 27.74300 12.07500  1.000 16.64410  ?  189 SER   A O    1 
ATOM   2598 C CB   . SER   A 1 185 ? 8.33600  25.83600 12.23000  1.000 14.89389  ?  189 SER   A CB   1 
ATOM   2599 O OG   . SER   A 1 185 ? 6.93000  26.05300 12.15400  1.000 15.40448  ?  189 SER   A OG   1 
ATOM   2600 H H    . SER   A 1 185 ? 8.41400  25.33900 9.86100   1.000 18.88000  ?  189 SER   A H    1 
ATOM   2601 H HA   . SER   A 1 185 ? 8.66500  27.58500 11.21800  1.000 18.32000  ?  189 SER   A HA   1 
ATOM   2602 H HB2  . SER   A 1 185 ? 8.52700  24.90000 12.06500  1.000 17.92000  ?  189 SER   A HB2  1 
ATOM   2603 H HB3  . SER   A 1 185 ? 8.65400  26.09000 13.11000  1.000 17.92000  ?  189 SER   A HB3  1 
ATOM   2604 H HG   . SER   A 1 185 ? 6.53100  25.53900 12.68500  1.000 18.53000  ?  189 SER   A HG   1 
ATOM   2605 N N    . LEU   A 1 186 ? 11.27900 25.75200 11.06500  1.000 15.38342  ?  190 LEU   A N    1 
ATOM   2606 C CA   . LEU   A 1 186 ? 12.72300 25.81600 11.23300  1.000 16.14404  ?  190 LEU   A CA   1 
ATOM   2607 C C    . LEU   A 1 186 ? 13.31200 27.01100 10.51500  1.000 16.32564  ?  190 LEU   A C    1 
ATOM   2608 O O    . LEU   A 1 186 ? 14.19800 27.68300 11.04500  1.000 16.77043  ?  190 LEU   A O    1 
ATOM   2609 C CB   . LEU   A 1 186 ? 13.34500 24.52700 10.75100  1.000 16.48356  ?  190 LEU   A CB   1 
ATOM   2610 C CG   . LEU   A 1 186 ? 14.83400 24.38900 11.03800  1.000 17.05731  ?  190 LEU   A CG   1 
ATOM   2611 C CD1  . LEU   A 1 186 ? 15.12500 24.30500 12.53200  1.000 17.82056  ?  190 LEU   A CD1  1 
ATOM   2612 C CD2  . LEU   A 1 186 ? 15.32300 23.14200 10.33500  1.000 17.73371  ?  190 LEU   A CD2  1 
ATOM   2613 H H    . LEU   A 1 186 ? 10.98900 25.02900 10.70100  1.000 18.51000  ?  190 LEU   A H    1 
ATOM   2614 H HA   . LEU   A 1 186 ? 12.93100 25.91500 12.17500  1.000 19.42000  ?  190 LEU   A HA   1 
ATOM   2615 H HB2  . LEU   A 1 186 ? 12.89400 23.78700 11.18600  1.000 19.83000  ?  190 LEU   A HB2  1 
ATOM   2616 H HB3  . LEU   A 1 186 ? 13.22700 24.47000 9.79000   1.000 19.83000  ?  190 LEU   A HB3  1 
ATOM   2617 H HG   . LEU   A 1 186 ? 15.30600 25.17200 10.71500  1.000 20.52000  ?  190 LEU   A HG   1 
ATOM   2618 H HD11 . LEU   A 1 186 ? 16.07000 24.12500 12.66000  1.000 21.43000  ?  190 LEU   A HD11 1 
ATOM   2619 H HD12 . LEU   A 1 186 ? 14.89000 25.15000 12.94800  1.000 21.43000  ?  190 LEU   A HD12 1 
ATOM   2620 H HD13 . LEU   A 1 186 ? 14.59700 23.58900 12.91800  1.000 21.43000  ?  190 LEU   A HD13 1 
ATOM   2621 H HD21 . LEU   A 1 186 ? 16.26700 23.02400 10.52200  1.000 21.33000  ?  190 LEU   A HD21 1 
ATOM   2622 H HD22 . LEU   A 1 186 ? 14.82200 22.37800 10.66300  1.000 21.33000  ?  190 LEU   A HD22 1 
ATOM   2623 H HD23 . LEU   A 1 186 ? 15.18400 23.24300 9.38000   1.000 21.33000  ?  190 LEU   A HD23 1 
ATOM   2624 N N    A GLN   A 1 187 ? 12.84300 27.28200 9.28600   0.270 16.42565  ?  191 GLN   A N    1 
ATOM   2625 N N    B GLN   A 1 187 ? 12.84000 27.29200 9.29400   0.230 16.57567  ?  191 GLN   A N    1 
ATOM   2626 N N    C GLN   A 1 187 ? 12.83900 27.29300 9.29000   0.500 16.06772  ?  191 GLN   A N    1 
ATOM   2627 C CA   A GLN   A 1 187 ? 13.30300 28.45500 8.55200   0.270 17.04678  ?  191 GLN   A CA   1 
ATOM   2628 C CA   B GLN   A 1 187 ? 13.32900 28.45900 8.57300   0.230 17.28365  ?  191 GLN   A CA   1 
ATOM   2629 C CA   C GLN   A 1 187 ? 13.32100 28.45800 8.55700   0.500 16.80991  ?  191 GLN   A CA   1 
ATOM   2630 C C    A GLN   A 1 187 ? 13.01900 29.72900 9.33600   0.270 17.63106  ?  191 GLN   A C    1 
ATOM   2631 C C    B GLN   A 1 187 ? 13.02300 29.73800 9.34100   0.230 17.76002  ?  191 GLN   A C    1 
ATOM   2632 C C    C GLN   A 1 187 ? 13.01500 29.74400 9.31700   0.500 17.56263  ?  191 GLN   A C    1 
ATOM   2633 O O    A GLN   A 1 187 ? 13.90100 30.57900 9.50500   0.270 17.66001  ?  191 GLN   A O    1 
ATOM   2634 O O    B GLN   A 1 187 ? 13.89100 30.60400 9.50100   0.230 17.80740  ?  191 GLN   A O    1 
ATOM   2635 O O    C GLN   A 1 187 ? 13.87600 30.62100 9.44800   0.500 17.85740  ?  191 GLN   A O    1 
ATOM   2636 C CB   A GLN   A 1 187 ? 12.62400 28.50400 7.17900   0.270 17.30207  ?  191 GLN   A CB   1 
ATOM   2637 C CB   B GLN   A 1 187 ? 12.71700 28.51400 7.17300   0.230 17.67844  ?  191 GLN   A CB   1 
ATOM   2638 C CB   C GLN   A 1 187 ? 12.69500 28.49000 7.15900   0.500 17.31523  ?  191 GLN   A CB   1 
ATOM   2639 C CG   A GLN   A 1 187 ? 12.98600 29.73200 6.34600   0.270 17.79950  ?  191 GLN   A CG   1 
ATOM   2640 C CG   B GLN   A 1 187 ? 13.00800 29.81900 6.45400   0.230 18.18639  ?  191 GLN   A CG   1 
ATOM   2641 C CG   C GLN   A 1 187 ? 13.18800 29.62700 6.27900   0.500 18.47327  ?  191 GLN   A CG   1 
ATOM   2642 C CD   A GLN   A 1 187 ? 12.18000 29.84800 5.05800   0.270 18.75225  ?  191 GLN   A CD   1 
ATOM   2643 C CD   B GLN   A 1 187 ? 12.68100 29.76700 4.97800   0.230 18.99175  ?  191 GLN   A CD   1 
ATOM   2644 C CD   C GLN   A 1 187 ? 12.50700 30.95500 6.56600   0.500 20.31033  ?  191 GLN   A CD   1 
ATOM   2645 O OE1  A GLN   A 1 187 ? 11.03400 29.40400 4.98100   0.270 19.64709  ?  191 GLN   A OE1  1 
ATOM   2646 O OE1  B GLN   A 1 187 ? 12.16900 28.76600 4.47800   0.230 19.82869  ?  191 GLN   A OE1  1 
ATOM   2647 O OE1  C GLN   A 1 187 ? 11.35400 30.99500 7.01200   0.500 20.34454  ?  191 GLN   A OE1  1 
ATOM   2648 N NE2  A GLN   A 1 187 ? 12.78400 30.45100 4.04000   0.270 19.48655  ?  191 GLN   A NE2  1 
ATOM   2649 N NE2  B GLN   A 1 187 ? 12.98700 30.84600 4.26700   0.230 18.96543  ?  191 GLN   A NE2  1 
ATOM   2650 N NE2  C GLN   A 1 187 ? 13.21400 32.05200 6.30900   0.500 21.60259  ?  191 GLN   A NE2  1 
ATOM   2651 H H    A GLN   A 1 187 ? 12.26500 26.80400 8.86600   0.270 19.76000  ?  191 GLN   A H    1 
ATOM   2652 H H    B GLN   A 1 187 ? 12.24800 26.83000 8.87400   0.230 19.94000  ?  191 GLN   A H    1 
ATOM   2653 H H    C GLN   A 1 187 ? 12.24800 26.82900 8.87300   0.500 19.33000  ?  191 GLN   A H    1 
ATOM   2654 H HA   A GLN   A 1 187 ? 14.26100 28.39000 8.41500   0.270 20.50000  ?  191 GLN   A HA   1 
ATOM   2655 H HA   B GLN   A 1 187 ? 14.29200 28.38400 8.47500   0.230 20.79000  ?  191 GLN   A HA   1 
ATOM   2656 H HA   C GLN   A 1 187 ? 14.28300 28.39100 8.45400   0.500 20.22000  ?  191 GLN   A HA   1 
ATOM   2657 H HB2  A GLN   A 1 187 ? 12.88700 27.71800 6.67500   0.270 20.81000  ?  191 GLN   A HB2  1 
ATOM   2658 H HB2  B GLN   A 1 187 ? 13.08200 27.79000 6.64100   0.230 21.26000  ?  191 GLN   A HB2  1 
ATOM   2659 H HB2  C GLN   A 1 187 ? 12.90400 27.65700 6.70700   0.500 20.83000  ?  191 GLN   A HB2  1 
ATOM   2660 H HB3  A GLN   A 1 187 ? 11.66200 28.50900 7.30800   0.270 20.81000  ?  191 GLN   A HB3  1 
ATOM   2661 H HB3  B GLN   A 1 187 ? 11.75500 28.41900 7.24600   0.230 21.26000  ?  191 GLN   A HB3  1 
ATOM   2662 H HB3  C GLN   A 1 187 ? 11.73400 28.58500 7.25200   0.500 20.83000  ?  191 GLN   A HB3  1 
ATOM   2663 H HG2  A GLN   A 1 187 ? 12.82000 30.52800 6.87400   0.270 21.41000  ?  191 GLN   A HG2  1 
ATOM   2664 H HG2  B GLN   A 1 187 ? 12.47600 30.52500 6.85300   0.230 21.87000  ?  191 GLN   A HG2  1 
ATOM   2665 H HG2  C GLN   A 1 187 ? 14.14000 29.74500 6.42300   0.500 22.22000  ?  191 GLN   A HG2  1 
ATOM   2666 H HG3  A GLN   A 1 187 ? 13.92400 29.68200 6.10600   0.270 21.41000  ?  191 GLN   A HG3  1 
ATOM   2667 H HG3  B GLN   A 1 187 ? 13.95200 30.02500 6.54300   0.230 21.87000  ?  191 GLN   A HG3  1 
ATOM   2668 H HG3  C GLN   A 1 187 ? 13.01800 29.40200 5.35100   0.500 22.22000  ?  191 GLN   A HG3  1 
ATOM   2669 H HE21 A GLN   A 1 187 ? 13.58500 30.75000 4.13100   0.270 23.44000  ?  191 GLN   A HE21 1 
ATOM   2670 H HE21 B GLN   A 1 187 ? 13.35200 31.52400 4.65100   0.230 22.81000  ?  191 GLN   A HE21 1 
ATOM   2671 H HE21 C GLN   A 1 187 ? 14.01200 31.98600 5.99700   0.500 25.98000  ?  191 GLN   A HE21 1 
ATOM   2672 H HE22 A GLN   A 1 187 ? 12.37300 30.54300 3.29000   0.270 23.44000  ?  191 GLN   A HE22 1 
ATOM   2673 H HE22 B GLN   A 1 187 ? 12.82200 30.86700 3.42300   0.230 22.81000  ?  191 GLN   A HE22 1 
ATOM   2674 H HE22 C GLN   A 1 187 ? 12.87200 32.82700 6.45500   0.500 25.98000  ?  191 GLN   A HE22 1 
ATOM   2675 N N    . LYS   A 1 188 ? 11.78700 29.87100 9.83200   1.000 18.23640  ?  192 LYS   A N    1 
ATOM   2676 C CA   . LYS   A 1 188 ? 11.40900 31.08200 10.55000  1.000 17.81529  ?  192 LYS   A CA   1 
ATOM   2677 C C    . LYS   A 1 188 ? 12.30400 31.31300 11.75300  1.000 18.39957  ?  192 LYS   A C    1 
ATOM   2678 O O    . LYS   A 1 188 ? 12.66100 32.45500 12.05800  1.000 18.87332  ?  192 LYS   A O    1 
ATOM   2679 C CB   . LYS   A 1 188 ? 9.95800  30.97800 11.01500  1.000 18.48906  ?  192 LYS   A CB   1 
ATOM   2680 C CG   . LYS   A 1 188 ? 8.94200  31.03500 9.89300   1.000 18.58644  ?  192 LYS   A CG   1 
ATOM   2681 C CD   . LYS   A 1 188 ? 7.57100  30.51400 10.36000  1.000 19.97871  ?  192 LYS   A CD   1 
ATOM   2682 C CE   . LYS   A 1 188 ? 6.51800  30.66300 9.27700   1.000 20.23664  ?  192 LYS   A CE   1 
ATOM   2683 N NZ   . LYS   A 1 188 ? 5.19900  30.18500 9.76600   1.000 20.30507  ?  192 LYS   A NZ   1 
ATOM   2684 H H    A LYS   A 1 188 ? 11.16000 29.28600 9.76600   0.270 21.94000  ?  192 LYS   A H    1 
ATOM   2685 H H    B LYS   A 1 188 ? 11.16200 29.28400 9.76300   0.230 21.94000  ?  192 LYS   A H    1 
ATOM   2686 H H    C LYS   A 1 188 ? 11.16600 29.27800 9.77900   0.500 21.94000  ?  192 LYS   A H    1 
ATOM   2687 H HA   . LYS   A 1 188 ? 11.49800 31.83600 9.94700   1.000 21.43000  ?  192 LYS   A HA   1 
ATOM   2688 H HB2  . LYS   A 1 188 ? 9.84000  30.13200 11.47600  1.000 22.24000  ?  192 LYS   A HB2  1 
ATOM   2689 H HB3  . LYS   A 1 188 ? 9.77100  31.71400 11.61900  1.000 22.24000  ?  192 LYS   A HB3  1 
ATOM   2690 H HG2  . LYS   A 1 188 ? 8.83600  31.95300 9.59900   1.000 22.35000  ?  192 LYS   A HG2  1 
ATOM   2691 H HG3  . LYS   A 1 188 ? 9.24400  30.48300 9.15500   1.000 22.35000  ?  192 LYS   A HG3  1 
ATOM   2692 H HD2  . LYS   A 1 188 ? 7.64500  29.57300 10.58500  1.000 24.03000  ?  192 LYS   A HD2  1 
ATOM   2693 H HD3  . LYS   A 1 188 ? 7.28300  31.01900 11.13600  1.000 24.03000  ?  192 LYS   A HD3  1 
ATOM   2694 H HE2  . LYS   A 1 188 ? 6.43600  31.59700 9.03000   1.000 24.33000  ?  192 LYS   A HE2  1 
ATOM   2695 H HE3  . LYS   A 1 188 ? 6.77100  30.13600 8.50300   1.000 24.33000  ?  192 LYS   A HE3  1 
ATOM   2696 H HZ1  . LYS   A 1 188 ? 4.58500  30.28300 9.13000   1.000 24.41000  ?  192 LYS   A HZ1  1 
ATOM   2697 H HZ2  . LYS   A 1 188 ? 5.25100  29.32400 9.98700   1.000 24.41000  ?  192 LYS   A HZ2  1 
ATOM   2698 H HZ3  . LYS   A 1 188 ? 4.95200  30.65300 10.48100  1.000 24.41000  ?  192 LYS   A HZ3  1 
ATOM   2699 N N    . LEU   A 1 189 ? 12.63700 30.24000 12.46700  1.000 17.49420  ?  193 LEU   A N    1 
ATOM   2700 C CA   . LEU   A 1 189 ? 13.35200 30.35600 13.72600  1.000 18.25482  ?  193 LEU   A CA   1 
ATOM   2701 C C    . LEU   A 1 189 ? 14.86300 30.51400 13.54200  1.000 18.64434  ?  193 LEU   A C    1 
ATOM   2702 O O    . LEU   A 1 189 ? 15.51500 31.17300 14.36500  1.000 20.55246  ?  193 LEU   A O    1 
ATOM   2703 C CB   . LEU   A 1 189 ? 13.07600 29.10700 14.55500  1.000 18.43642  ?  193 LEU   A CB   1 
ATOM   2704 C CG   . LEU   A 1 189 ? 11.62700 28.98100 15.04300  1.000 18.01269  ?  193 LEU   A CG   1 
ATOM   2705 C CD1  . LEU   A 1 189 ? 11.36700 27.58100 15.48300  1.000 18.26272  ?  193 LEU   A CD1  1 
ATOM   2706 C CD2  . LEU   A 1 189 ? 11.43800 29.96100 16.18400  1.000 18.76278  ?  193 LEU   A CD2  1 
ATOM   2707 H H    . LEU   A 1 189 ? 12.45900 29.43000 12.23900  1.000 21.04000  ?  193 LEU   A H    1 
ATOM   2708 H HA   . LEU   A 1 189 ? 13.03300 31.14300 14.19600  1.000 21.96000  ?  193 LEU   A HA   1 
ATOM   2709 H HB2  . LEU   A 1 189 ? 13.27400 28.32700 14.01300  1.000 22.17000  ?  193 LEU   A HB2  1 
ATOM   2710 H HB3  . LEU   A 1 189 ? 13.65000 29.12200 15.33700  1.000 22.17000  ?  193 LEU   A HB3  1 
ATOM   2711 H HG   . LEU   A 1 189 ? 10.99200 29.18500 14.33900  1.000 21.67000  ?  193 LEU   A HG   1 
ATOM   2712 H HD11 . LEU   A 1 189 ? 10.46100 27.51900 15.82300  1.000 21.96000  ?  193 LEU   A HD11 1 
ATOM   2713 H HD12 . LEU   A 1 189 ? 11.47700 26.98600 14.72400  1.000 21.96000  ?  193 LEU   A HD12 1 
ATOM   2714 H HD13 . LEU   A 1 189 ? 11.99900 27.34600 16.18000  1.000 21.96000  ?  193 LEU   A HD13 1 
ATOM   2715 H HD21 . LEU   A 1 189 ? 10.54000 29.86400 16.53800  1.000 22.56000  ?  193 LEU   A HD21 1 
ATOM   2716 H HD22 . LEU   A 1 189 ? 12.08900 29.76900 16.87700  1.000 22.56000  ?  193 LEU   A HD22 1 
ATOM   2717 H HD23 . LEU   A 1 189 ? 11.56700 30.86300 15.85000  1.000 22.56000  ?  193 LEU   A HD23 1 
ATOM   2718 N N    . THR   A 1 190 ? 15.44200 29.92100 12.49800  1.000 18.22061  ?  194 THR   A N    1 
ATOM   2719 C CA   . THR   A 1 190 ? 16.89100 29.98200 12.30600  1.000 18.02058  ?  194 THR   A CA   1 
ATOM   2720 C C    . THR   A 1 190 ? 17.33400 31.05500 11.32400  1.000 19.82869  ?  194 THR   A C    1 
ATOM   2721 O O    . THR   A 1 190 ? 18.47900 31.51400 11.41500  1.000 21.71839  ?  194 THR   A O    1 
ATOM   2722 C CB   . THR   A 1 190 ? 17.43400 28.65000 11.77400  1.000 18.19955  ?  194 THR   A CB   1 
ATOM   2723 O OG1  . THR   A 1 190 ? 16.81800 28.33100 10.51900  1.000 18.57854  ?  194 THR   A OG1  1 
ATOM   2724 C CG2  . THR   A 1 190 ? 17.24500 27.52700 12.76100  1.000 18.52591  ?  194 THR   A CG2  1 
ATOM   2725 H H    . THR   A 1 190 ? 15.02000 29.48100 11.89100  1.000 21.91000  ?  194 THR   A H    1 
ATOM   2726 H HA   . THR   A 1 190 ? 17.28300 30.16000 13.17500  1.000 21.68000  ?  194 THR   A HA   1 
ATOM   2727 H HB   . THR   A 1 190 ? 18.39000 28.73800 11.63800  1.000 21.89000  ?  194 THR   A HB   1 
ATOM   2728 H HG1  . THR   A 1 190 ? 15.98500 28.28000 10.61200  1.000 22.34000  ?  194 THR   A HG1  1 
ATOM   2729 H HG21 . THR   A 1 190 ? 17.58600 26.69800 12.39000  1.000 22.28000  ?  194 THR   A HG21 1 
ATOM   2730 H HG22 . THR   A 1 190 ? 17.72100 27.72400 13.58300  1.000 22.28000  ?  194 THR   A HG22 1 
ATOM   2731 H HG23 . THR   A 1 190 ? 16.30200 27.41800 12.96200  1.000 22.28000  ?  194 THR   A HG23 1 
ATOM   2732 N N    . LEU   A 1 191 ? 16.47700 31.45000 10.38200  1.000 19.96555  ?  195 LEU   A N    1 
ATOM   2733 C CA   . LEU   A 1 191 ? 16.87000 32.38700 9.34000   1.000 20.40508  ?  195 LEU   A CA   1 
ATOM   2734 C C    . LEU   A 1 191 ? 15.94200 33.58500 9.25100   1.000 21.40520  ?  195 LEU   A C    1 
ATOM   2735 O O    . LEU   A 1 191 ? 16.34300 34.65700 8.79000   1.000 23.08961  ?  195 LEU   A O    1 
ATOM   2736 C CB   . LEU   A 1 191 ? 16.88400 31.69600 7.97800   1.000 20.46298  ?  195 LEU   A CB   1 
ATOM   2737 C CG   . LEU   A 1 191 ? 17.83400 30.51100 7.86800   1.000 21.49995  ?  195 LEU   A CG   1 
ATOM   2738 C CD1  . LEU   A 1 191 ? 17.58500 29.78900 6.56100   1.000 21.64470  ?  195 LEU   A CD1  1 
ATOM   2739 C CD2  . LEU   A 1 191 ? 19.28400 30.98500 7.95300   1.000 22.41848  ?  195 LEU   A CD2  1 
ATOM   2740 H H    . LEU   A 1 191 ? 15.66000 31.18600 10.32800  1.000 24.01000  ?  195 LEU   A H    1 
ATOM   2741 H HA   . LEU   A 1 191 ? 17.75900 32.70400 9.56600   1.000 24.54000  ?  195 LEU   A HA   1 
ATOM   2742 H HB2  . LEU   A 1 191 ? 15.98900 31.37100 7.79000   1.000 24.61000  ?  195 LEU   A HB2  1 
ATOM   2743 H HB3  . LEU   A 1 191 ? 17.14800 32.34600 7.30700   1.000 24.61000  ?  195 LEU   A HB3  1 
ATOM   2744 H HG   . LEU   A 1 191 ? 17.68000 29.89400 8.60000   1.000 25.85000  ?  195 LEU   A HG   1 
ATOM   2745 H HD11 . LEU   A 1 191 ? 18.19100 29.03400 6.49800   1.000 26.03000  ?  195 LEU   A HD11 1 
ATOM   2746 H HD12 . LEU   A 1 191 ? 16.66700 29.47800 6.54300   1.000 26.03000  ?  195 LEU   A HD12 1 
ATOM   2747 H HD13 . LEU   A 1 191 ? 17.74200 30.40200 5.82600   1.000 26.03000  ?  195 LEU   A HD13 1 
ATOM   2748 H HD21 . LEU   A 1 191 ? 19.87200 30.22000 7.85500   1.000 26.95000  ?  195 LEU   A HD21 1 
ATOM   2749 H HD22 . LEU   A 1 191 ? 19.45000 31.62400 7.24200   1.000 26.95000  ?  195 LEU   A HD22 1 
ATOM   2750 H HD23 . LEU   A 1 191 ? 19.42800 31.40600 8.81500   1.000 26.95000  ?  195 LEU   A HD23 1 
ATOM   2751 N N    . GLY   A 1 192 ? 14.69400 33.40500 9.64300   1.000 21.50784  ?  196 GLY   A N    1 
ATOM   2752 C CA   . GLY   A 1 192 ? 13.70500 34.46500 9.60800   1.000 21.36046  ?  196 GLY   A CA   1 
ATOM   2753 C C    . GLY   A 1 192 ? 13.73000 35.27900 10.87700  1.000 21.86315  ?  196 GLY   A C    1 
ATOM   2754 O O    . GLY   A 1 192 ? 14.75200 35.37300 11.56400  1.000 23.31069  ?  196 GLY   A O    1 
ATOM   2755 H H    . GLY   A 1 192 ? 14.38800 32.65800 9.94100   1.000 25.86000  ?  196 GLY   A H    1 
ATOM   2756 H HA2  . GLY   A 1 192 ? 13.88600 35.05300 8.85800   1.000 25.68000  ?  196 GLY   A HA2  1 
ATOM   2757 H HA3  . GLY   A 1 192 ? 12.82100 34.08100 9.50300   1.000 25.68000  ?  196 GLY   A HA3  1 
ATOM   2758 N N    . SER   A 1 193 ? 12.58600 35.86000 11.21900  1.000 22.45796  ?  197 SER   A N    1 
ATOM   2759 C CA   . SER   A 1 193 ? 12.53200 36.81700 12.31700  1.000 24.68454  ?  197 SER   A CA   1 
ATOM   2760 C C    . SER   A 1 193 ? 11.70200 36.34000 13.50800  1.000 24.11605  ?  197 SER   A C    1 
ATOM   2761 O O    . SER   A 1 193 ? 11.30400 37.16200 14.34000  1.000 25.04511  ?  197 SER   A O    1 
ATOM   2762 C CB   . SER   A 1 193 ? 11.98500 38.14500 11.81000  1.000 28.39288  ?  197 SER   A CB   1 
ATOM   2763 O OG   . SER   A 1 193 ? 10.66100 37.94700 11.37300  1.000 30.66420  ?  197 SER   A OG   1 
ATOM   2764 H H    . SER   A 1 193 ? 11.83200 35.71600 10.83200  1.000 27.00000  ?  197 SER   A H    1 
ATOM   2765 H HA   . SER   A 1 193 ? 13.43700 36.94300 12.64100  1.000 29.67000  ?  197 SER   A HA   1 
ATOM   2766 H HB2  . SER   A 1 193 ? 11.99600 38.79700 12.52800  1.000 34.12000  ?  197 SER   A HB2  1 
ATOM   2767 H HB3  . SER   A 1 193 ? 12.52800 38.45800 11.06900  1.000 34.12000  ?  197 SER   A HB3  1 
ATOM   2768 H HG   . SER   A 1 193 ? 10.33400 38.67400 11.10700  1.000 36.85000  ?  197 SER   A HG   1 
ATOM   2769 N N    . ALA   A 1 194 ? 11.44200 35.03900 13.62600  1.000 22.79484  ?  198 ALA   A N    1 
ATOM   2770 C CA   . ALA   A 1 194 ? 10.62000 34.57100 14.73900  1.000 22.17371  ?  198 ALA   A CA   1 
ATOM   2771 C C    . ALA   A 1 194 ? 11.32600 34.74400 16.08000  1.000 23.09751  ?  198 ALA   A C    1 
ATOM   2772 O O    . ALA   A 1 194 ? 10.66200 34.95000 17.10200  1.000 24.96878  ?  198 ALA   A O    1 
ATOM   2773 C CB   . ALA   A 1 194 ? 10.20100 33.11400 14.52900  1.000 22.10791  ?  198 ALA   A CB   1 
ATOM   2774 H H    . ALA   A 1 194 ? 11.72200 34.42500 13.09200  1.000 27.40000  ?  198 ALA   A H    1 
ATOM   2775 H HA   . ALA   A 1 194 ? 9.80800  35.10300 14.76200  1.000 26.66000  ?  198 ALA   A HA   1 
ATOM   2776 H HB1  . ALA   A 1 194 ? 9.67400  32.82400 15.29000  1.000 26.58000  ?  198 ALA   A HB1  1 
ATOM   2777 H HB2  . ALA   A 1 194 ? 9.67300  33.05100 13.71800  1.000 26.58000  ?  198 ALA   A HB2  1 
ATOM   2778 H HB3  . ALA   A 1 194 ? 10.99700 32.56600 14.45000  1.000 26.58000  ?  198 ALA   A HB3  1 
ATOM   2779 N N    . LEU   A 1 195 ? 12.65200 34.66000 16.09900  1.000 22.25793  ?  199 LEU   A N    1 
ATOM   2780 C CA   . LEU   A 1 195 ? 13.45300 34.95600 17.27000  1.000 23.69758  ?  199 LEU   A CA   1 
ATOM   2781 C C    . LEU   A 1 195 ? 14.23500 36.23900 17.03000  1.000 25.23460  ?  199 LEU   A C    1 
ATOM   2782 O O    . LEU   A 1 195 ? 14.58500 36.56600 15.89300  1.000 26.33737  ?  199 LEU   A O    1 
ATOM   2783 C CB   . LEU   A 1 195 ? 14.44900 33.83000 17.54500  1.000 23.27648  ?  199 LEU   A CB   1 
ATOM   2784 C CG   . LEU   A 1 195 ? 13.85800 32.48900 17.96500  1.000 21.91842  ?  199 LEU   A CG   1 
ATOM   2785 C CD1  . LEU   A 1 195 ? 14.96400 31.43700 18.01600  1.000 21.75524  ?  199 LEU   A CD1  1 
ATOM   2786 C CD2  . LEU   A 1 195 ? 13.13400 32.57800 19.27900  1.000 22.58955  ?  199 LEU   A CD2  1 
ATOM   2787 H H    . LEU   A 1 195 ? 13.12300 34.42400 15.41900  1.000 26.76000  ?  199 LEU   A H    1 
ATOM   2788 H HA   . LEU   A 1 195 ? 12.87600 35.06400 18.04200  1.000 28.49000  ?  199 LEU   A HA   1 
ATOM   2789 H HB2  . LEU   A 1 195 ? 14.96000 33.67600 16.73500  1.000 27.98000  ?  199 LEU   A HB2  1 
ATOM   2790 H HB3  . LEU   A 1 195 ? 15.03900 34.11800 18.25900  1.000 27.98000  ?  199 LEU   A HB3  1 
ATOM   2791 H HG   . LEU   A 1 195 ? 13.19700 32.22000 17.30800  1.000 26.35000  ?  199 LEU   A HG   1 
ATOM   2792 H HD11 . LEU   A 1 195 ? 14.58300 30.59300 18.30400  1.000 26.15000  ?  199 LEU   A HD11 1 
ATOM   2793 H HD12 . LEU   A 1 195 ? 15.34900 31.34000 17.13100  1.000 26.15000  ?  199 LEU   A HD12 1 
ATOM   2794 H HD13 . LEU   A 1 195 ? 15.64500 31.72400 18.64300  1.000 26.15000  ?  199 LEU   A HD13 1 
ATOM   2795 H HD21 . LEU   A 1 195 ? 12.86000 31.68700 19.54900  1.000 27.16000  ?  199 LEU   A HD21 1 
ATOM   2796 H HD22 . LEU   A 1 195 ? 13.73000 32.95600 19.94400  1.000 27.16000  ?  199 LEU   A HD22 1 
ATOM   2797 H HD23 . LEU   A 1 195 ? 12.35400 33.14500 19.17200  1.000 27.16000  ?  199 LEU   A HD23 1 
ATOM   2798 N N    . ALA   A 1 196 ? 14.50300 36.96500 18.11200  1.000 25.71887  ?  200 ALA   A N    1 
ATOM   2799 C CA   . ALA   A 1 196 ? 15.41000 38.09700 18.03900  1.000 25.73466  ?  200 ALA   A CA   1 
ATOM   2800 C C    . ALA   A 1 196 ? 16.81300 37.60200 17.68600  1.000 25.50043  ?  200 ALA   A C    1 
ATOM   2801 O O    . ALA   A 1 196 ? 17.16500 36.44200 17.91100  1.000 24.85298  ?  200 ALA   A O    1 
ATOM   2802 C CB   . ALA   A 1 196 ? 15.42200 38.83900 19.37300  1.000 25.76888  ?  200 ALA   A CB   1 
ATOM   2803 H H    . ALA   A 1 196 ? 14.17300 36.82200 18.89300  1.000 30.91000  ?  200 ALA   A H    1 
ATOM   2804 H HA   . ALA   A 1 196 ? 15.12400 38.72200 17.35400  1.000 30.93000  ?  200 ALA   A HA   1 
ATOM   2805 H HB1  . ALA   A 1 196 ? 16.06200 39.56600 19.32400  1.000 30.97000  ?  200 ALA   A HB1  1 
ATOM   2806 H HB2  . ALA   A 1 196 ? 14.53500 39.19000 19.54700  1.000 30.97000  ?  200 ALA   A HB2  1 
ATOM   2807 H HB3  . ALA   A 1 196 ? 15.67700 38.22100 20.07600  1.000 30.97000  ?  200 ALA   A HB3  1 
ATOM   2808 N N    . ALA   A 1 197 ? 17.62300 38.50500 17.13600  1.000 26.02154  ?  201 ALA   A N    1 
ATOM   2809 C CA   . ALA   A 1 197 ? 18.88900 38.07600 16.54600  1.000 26.72952  ?  201 ALA   A CA   1 
ATOM   2810 C C    . ALA   A 1 197 ? 19.80500 37.32100 17.50300  1.000 26.49791  ?  201 ALA   A C    1 
ATOM   2811 O O    . ALA   A 1 197 ? 20.36200 36.28800 17.09000  1.000 25.93469  ?  201 ALA   A O    1 
ATOM   2812 C CB   . ALA   A 1 197 ? 19.60400 39.27200 15.91600  1.000 27.02166  ?  201 ALA   A CB   1 
ATOM   2813 H H    . ALA   A 1 197 ? 17.46800 39.34900 17.09100  1.000 31.28000  ?  201 ALA   A H    1 
ATOM   2814 H HA   . ALA   A 1 197 ? 18.66900 37.45200 15.83700  1.000 32.12000  ?  201 ALA   A HA   1 
ATOM   2815 H HB1  . ALA   A 1 197 ? 20.44800 38.97500 15.54300  1.000 32.48000  ?  201 ALA   A HB1  1 
ATOM   2816 H HB2  . ALA   A 1 197 ? 19.04400 39.64100 15.21400  1.000 32.48000  ?  201 ALA   A HB2  1 
ATOM   2817 H HB3  . ALA   A 1 197 ? 19.76200 39.94200 16.59900  1.000 32.48000  ?  201 ALA   A HB3  1 
ATOM   2818 N N    . PRO   A 1 198 ? 20.00200 37.74000 18.75500  1.000 27.36644  ?  202 PRO   A N    1 
ATOM   2819 C CA   . PRO   A 1 198 ? 20.89300 36.95600 19.63200  1.000 27.18221  ?  202 PRO   A CA   1 
ATOM   2820 C C    . PRO   A 1 198 ? 20.36700 35.55700 19.89100  1.000 25.63992  ?  202 PRO   A C    1 
ATOM   2821 O O    . PRO   A 1 198 ? 21.13200 34.57900 19.86600  1.000 24.95562  ?  202 PRO   A O    1 
ATOM   2822 C CB   . PRO   A 1 198 ? 20.97600 37.80900 20.91200  1.000 27.21379  ?  202 PRO   A CB   1 
ATOM   2823 C CG   . PRO   A 1 198 ? 20.52600 39.19200 20.50800  1.000 28.52974  ?  202 PRO   A CG   1 
ATOM   2824 C CD   . PRO   A 1 198 ? 19.50000 38.95700 19.42200  1.000 27.96651  ?  202 PRO   A CD   1 
ATOM   2825 H HA   . PRO   A 1 198 ? 21.78200 36.89900 19.24900  1.000 32.67000  ?  202 PRO   A HA   1 
ATOM   2826 H HB2  . PRO   A 1 198 ? 20.38900 37.44000 21.59100  1.000 32.70000  ?  202 PRO   A HB2  1 
ATOM   2827 H HB3  . PRO   A 1 198 ? 21.89000 37.82500 21.23700  1.000 32.70000  ?  202 PRO   A HB3  1 
ATOM   2828 H HG2  . PRO   A 1 198 ? 20.13000 39.64800 21.26700  1.000 34.28000  ?  202 PRO   A HG2  1 
ATOM   2829 H HG3  . PRO   A 1 198 ? 21.27900 39.70100 20.17000  1.000 34.28000  ?  202 PRO   A HG3  1 
ATOM   2830 H HD2  . PRO   A 1 198 ? 18.62100 38.80600 19.80200  1.000 33.61000  ?  202 PRO   A HD2  1 
ATOM   2831 H HD3  . PRO   A 1 198 ? 19.47100 39.70400 18.80500  1.000 33.61000  ?  202 PRO   A HD3  1 
ATOM   2832 N N    . GLN   A 1 199 ? 19.05500 35.43800 20.11700  1.000 24.29239  ?  203 GLN   A N    1 
ATOM   2833 C CA   . GLN   A 1 199 ? 18.45700 34.14000 20.38400  1.000 23.24226  ?  203 GLN   A CA   1 
ATOM   2834 C C    . GLN   A 1 199 ? 18.48900 33.26600 19.14000  1.000 21.62365  ?  203 GLN   A C    1 
ATOM   2835 O O    . GLN   A 1 199 ? 18.70700 32.05400 19.23100  1.000 21.13411  ?  203 GLN   A O    1 
ATOM   2836 C CB   . GLN   A 1 199 ? 17.02700 34.33300 20.89400  1.000 23.50808  ?  203 GLN   A CB   1 
ATOM   2837 C CG   . GLN   A 1 199 ? 16.94200 34.83400 22.33000  1.000 24.75560  ?  203 GLN   A CG   1 
ATOM   2838 C CD   . GLN   A 1 199 ? 17.38400 36.28300 22.50700  1.000 27.11378  ?  203 GLN   A CD   1 
ATOM   2839 O OE1  . GLN   A 1 199 ? 17.31700 37.08500 21.58100  1.000 27.04535  ?  203 GLN   A OE1  1 
ATOM   2840 N NE2  . GLN   A 1 199 ? 17.83400 36.62400 23.71400  1.000 29.51407  ?  203 GLN   A NE2  1 
ATOM   2841 H H    . GLN   A 1 199 ? 18.49700 36.09200 20.12000  1.000 29.20000  ?  203 GLN   A H    1 
ATOM   2842 H HA   . GLN   A 1 199 ? 18.95800 33.68400 21.07800  1.000 27.94000  ?  203 GLN   A HA   1 
ATOM   2843 H HB2  . GLN   A 1 199 ? 16.58100 34.98200 20.32800  1.000 28.26000  ?  203 GLN   A HB2  1 
ATOM   2844 H HB3  . GLN   A 1 199 ? 16.56500 33.48100 20.85100  1.000 28.26000  ?  203 GLN   A HB3  1 
ATOM   2845 H HG2  . GLN   A 1 199 ? 16.02200 34.76700 22.62900  1.000 29.76000  ?  203 GLN   A HG2  1 
ATOM   2846 H HG3  . GLN   A 1 199 ? 17.51300 34.28200 22.88700  1.000 29.76000  ?  203 GLN   A HG3  1 
ATOM   2847 H HE21 . GLN   A 1 199 ? 17.86500 36.03800 24.34300  1.000 35.47000  ?  203 GLN   A HE21 1 
ATOM   2848 H HE22 . GLN   A 1 199 ? 18.09500 37.42900 23.86400  1.000 35.47000  ?  203 GLN   A HE22 1 
ATOM   2849 N N    A ARG   A 1 200 ? 18.29800 33.86900 17.96500  0.680 21.78419  ?  204 ARG   A N    1 
ATOM   2850 N N    B ARG   A 1 200 ? 18.28500 33.86500 17.96500  0.320 21.29466  ?  204 ARG   A N    1 
ATOM   2851 C CA   A ARG   A 1 200 ? 18.38000 33.11500 16.71900  0.680 21.62365  ?  204 ARG   A CA   1 
ATOM   2852 C CA   B ARG   A 1 200 ? 18.37500 33.09700 16.72800  0.320 20.72880  ?  204 ARG   A CA   1 
ATOM   2853 C C    A ARG   A 1 200 ? 19.74900 32.46700 16.57400  0.680 20.31823  ?  204 ARG   A C    1 
ATOM   2854 C C    B ARG   A 1 200 ? 19.75100 32.45800 16.58900  0.320 20.45245  ?  204 ARG   A C    1 
ATOM   2855 O O    A ARG   A 1 200 ? 19.85900 31.26800 16.27800  0.680 19.07860  ?  204 ARG   A O    1 
ATOM   2856 O O    B ARG   A 1 200 ? 19.86800 31.26200 16.29000  0.320 19.89186  ?  204 ARG   A O    1 
ATOM   2857 C CB   A ARG   A 1 200 ? 18.11100 34.07200 15.56100  0.680 23.29227  ?  204 ARG   A CB   1 
ATOM   2858 C CB   B ARG   A 1 200 ? 18.07600 33.99900 15.53100  0.320 20.66300  ?  204 ARG   A CB   1 
ATOM   2859 C CG   A ARG   A 1 200 ? 18.14900 33.48600 14.16600  0.680 25.16091  ?  204 ARG   A CG   1 
ATOM   2860 C CG   B ARG   A 1 200 ? 18.29100 33.33200 14.17900  0.320 20.71564  ?  204 ARG   A CG   1 
ATOM   2861 C CD   A ARG   A 1 200 ? 17.99800 34.63300 13.15700  0.680 26.26368  ?  204 ARG   A CD   1 
ATOM   2862 C CD   B ARG   A 1 200 ? 17.89600 34.26600 13.03400  0.320 20.74459  ?  204 ARG   A CD   1 
ATOM   2863 N NE   A ARG   A 1 200 ? 16.97500 35.58100 13.59700  0.680 27.74280  ?  204 ARG   A NE   1 
ATOM   2864 N NE   B ARG   A 1 200 ? 18.61800 35.53300 13.09600  0.320 21.73945  ?  204 ARG   A NE   1 
ATOM   2865 C CZ   A ARG   A 1 200 ? 17.00400 36.88800 13.38000  0.680 28.64817  ?  204 ARG   A CZ   1 
ATOM   2866 C CZ   B ARG   A 1 200 ? 18.36000 36.59400 12.34300  0.320 22.98697  ?  204 ARG   A CZ   1 
ATOM   2867 N NH1  A ARG   A 1 200 ? 18.01100 37.46400 12.74200  0.680 29.43511  ?  204 ARG   A NH1  1 
ATOM   2868 N NH1  B ARG   A 1 200 ? 17.36800 36.59600 11.46700  0.320 23.78706  ?  204 ARG   A NH1  1 
ATOM   2869 N NH2  A ARG   A 1 200 ? 16.00500 37.64000 13.82600  0.680 28.14022  ?  204 ARG   A NH2  1 
ATOM   2870 N NH2  B ARG   A 1 200 ? 19.11500 37.68200 12.47700  0.320 23.56862  ?  204 ARG   A NH2  1 
ATOM   2871 H H    A ARG   A 1 200 ? 18.12100 34.70400 17.86500  0.680 26.19000  ?  204 ARG   A H    1 
ATOM   2872 H H    B ARG   A 1 200 ? 18.09800 34.69700 17.86000  0.320 25.60000  ?  204 ARG   A H    1 
ATOM   2873 H HA   A ARG   A 1 200 ? 17.71500 32.40900 16.70800  0.680 26.00000  ?  204 ARG   A HA   1 
ATOM   2874 H HA   B ARG   A 1 200 ? 17.71100 32.39000 16.74400  0.320 24.93000  ?  204 ARG   A HA   1 
ATOM   2875 H HB2  A ARG   A 1 200 ? 17.22600 34.45000 15.68400  0.680 28.00000  ?  204 ARG   A HB2  1 
ATOM   2876 H HB2  B ARG   A 1 200 ? 17.14900 34.27900 15.57700  0.320 24.85000  ?  204 ARG   A HB2  1 
ATOM   2877 H HB3  A ARG   A 1 200 ? 18.77900 34.77400 15.59100  0.680 28.00000  ?  204 ARG   A HB3  1 
ATOM   2878 H HB3  B ARG   A 1 200 ? 18.65900 34.77300 15.57200  0.320 24.85000  ?  204 ARG   A HB3  1 
ATOM   2879 H HG2  A ARG   A 1 200 ? 18.99600 33.03900 14.01500  0.680 30.24000  ?  204 ARG   A HG2  1 
ATOM   2880 H HG2  B ARG   A 1 200 ? 19.22700 33.10300 14.07800  0.320 24.91000  ?  204 ARG   A HG2  1 
ATOM   2881 H HG3  A ARG   A 1 200 ? 17.41800 32.86000 14.04700  0.680 30.24000  ?  204 ARG   A HG3  1 
ATOM   2882 H HG3  B ARG   A 1 200 ? 17.74500 32.53200 14.12400  0.320 24.91000  ?  204 ARG   A HG3  1 
ATOM   2883 H HD2  A ARG   A 1 200 ? 18.84200 35.10600 13.07500  0.680 31.57000  ?  204 ARG   A HD2  1 
ATOM   2884 H HD2  B ARG   A 1 200 ? 18.10200 33.83900 12.18700  0.320 24.94000  ?  204 ARG   A HD2  1 
ATOM   2885 H HD3  A ARG   A 1 200 ? 17.73500 34.27400 12.29500  0.680 31.57000  ?  204 ARG   A HD3  1 
ATOM   2886 H HD3  B ARG   A 1 200 ? 16.94600 34.45400 13.08700  0.320 24.94000  ?  204 ARG   A HD3  1 
ATOM   2887 H HE   A ARG   A 1 200 ? 16.30300 35.26600 14.03000  0.680 33.34000  ?  204 ARG   A HE   1 
ATOM   2888 H HE   B ARG   A 1 200 ? 19.26100 35.59600 13.66400  0.320 26.14000  ?  204 ARG   A HE   1 
ATOM   2889 H HH11 A ARG   A 1 200 ? 18.66800 36.98800 12.45700  0.680 35.37000  ?  204 ARG   A HH11 1 
ATOM   2890 H HH11 B ARG   A 1 200 ? 16.87400 35.89800 11.37600  0.320 28.60000  ?  204 ARG   A HH11 1 
ATOM   2891 H HH12 A ARG   A 1 200 ? 18.00900 38.31500 12.61300  0.680 35.37000  ?  204 ARG   A HH12 1 
ATOM   2892 H HH12 B ARG   A 1 200 ? 17.21800 37.29500 10.98900  0.320 28.60000  ?  204 ARG   A HH12 1 
ATOM   2893 H HH21 A ARG   A 1 200 ? 15.35000 37.27800 14.25000  0.680 33.82000  ?  204 ARG   A HH21 1 
ATOM   2894 H HH21 B ARG   A 1 200 ? 19.76000 37.69100 13.04600  0.320 28.33000  ?  204 ARG   A HH21 1 
ATOM   2895 H HH22 A ARG   A 1 200 ? 16.01300 38.48900 13.69200  0.680 33.82000  ?  204 ARG   A HH22 1 
ATOM   2896 H HH22 B ARG   A 1 200 ? 18.95800 38.37700 11.99500  0.320 28.33000  ?  204 ARG   A HH22 1 
ATOM   2897 N N    . GLN   A 1 201 ? 20.81100 33.23800 16.82400  1.000 21.12095  ?  205 GLN   A N    1 
ATOM   2898 C CA   . GLN   A 1 201 ? 22.15600 32.69100 16.69200  1.000 22.55534  ?  205 GLN   A CA   1 
ATOM   2899 C C    . GLN   A 1 201 ? 22.41600 31.62100 17.74500  1.000 21.34730  ?  205 GLN   A C    1 
ATOM   2900 O O    . GLN   A 1 201 ? 23.08000 30.61500 17.45800  1.000 20.76828  ?  205 GLN   A O    1 
ATOM   2901 C CB   . GLN   A 1 201 ? 23.21600 33.78900 16.75300  1.000 24.80297  ?  205 GLN   A CB   1 
ATOM   2902 C CG   . GLN   A 1 201 ? 24.63700 33.28100 16.39200  1.000 26.83743  ?  205 GLN   A CG   1 
ATOM   2903 C CD   . GLN   A 1 201 ? 24.73300 32.71500 14.97200  1.000 28.63501  ?  205 GLN   A CD   1 
ATOM   2904 O OE1  . GLN   A 1 201 ? 24.40500 33.38600 13.99400  1.000 30.23257  ?  205 GLN   A OE1  1 
ATOM   2905 N NE2  . GLN   A 1 201 ? 25.19300 31.48300 14.86100  1.000 28.99032  ?  205 GLN   A NE2  1 
ATOM   2906 H H    A GLN   A 1 201 ? 20.77700 34.06300 17.06500  0.680 25.39000  ?  205 GLN   A H    1 
ATOM   2907 H H    B GLN   A 1 201 ? 20.77600 34.06600 17.05400  0.320 25.39000  ?  205 GLN   A H    1 
ATOM   2908 H HA   . GLN   A 1 201 ? 22.23700 32.28400 15.81500  1.000 27.12000  ?  205 GLN   A HA   1 
ATOM   2909 H HB2  . GLN   A 1 201 ? 22.98000 34.49000 16.12600  1.000 29.81000  ?  205 GLN   A HB2  1 
ATOM   2910 H HB3  . GLN   A 1 201 ? 23.24700 34.14700 17.65400  1.000 29.81000  ?  205 GLN   A HB3  1 
ATOM   2911 H HG2  . GLN   A 1 201 ? 25.26300 34.01900 16.46100  1.000 32.26000  ?  205 GLN   A HG2  1 
ATOM   2912 H HG3  . GLN   A 1 201 ? 24.88600 32.57600 17.01100  1.000 32.26000  ?  205 GLN   A HG3  1 
ATOM   2913 H HE21 . GLN   A 1 201 ? 25.42000 31.04400 15.56500  1.000 34.84000  ?  205 GLN   A HE21 1 
ATOM   2914 H HE22 . GLN   A 1 201 ? 25.26600 31.11900 14.08500  1.000 34.84000  ?  205 GLN   A HE22 1 
ATOM   2915 N N    . GLN   A 1 202 ? 21.86400 31.77800 18.94900  1.000 22.19740  ?  206 GLN   A N    1 
ATOM   2916 C CA   . GLN   A 1 202 ? 22.03800 30.72400 19.94600  1.000 21.28676  ?  206 GLN   A CA   1 
ATOM   2917 C C    . GLN   A 1 202 ? 21.34300 29.43800 19.50500  1.000 19.43917  ?  206 GLN   A C    1 
ATOM   2918 O O    . GLN   A 1 202 ? 21.86400 28.33700 19.70300  1.000 19.10229  ?  206 GLN   A O    1 
ATOM   2919 C CB   . GLN   A 1 202 ? 21.51800 31.17700 21.31000  1.000 22.11055  ?  206 GLN   A CB   1 
ATOM   2920 C CG   . GLN   A 1 202 ? 21.59600 30.08500 22.37200  1.000 22.78694  ?  206 GLN   A CG   1 
ATOM   2921 C CD   . GLN   A 1 202 ? 23.01600 29.74400 22.76800  1.000 24.11605  ?  206 GLN   A CD   1 
ATOM   2922 O OE1  . GLN   A 1 202 ? 23.57400 30.36000 23.68300  1.000 25.49779  ?  206 GLN   A OE1  1 
ATOM   2923 N NE2  . GLN   A 1 202 ? 23.61600 28.75800 22.09000  1.000 23.83180  ?  206 GLN   A NE2  1 
ATOM   2924 H H    . GLN   A 1 202 ? 21.40400 32.45900 19.20400  1.000 26.69000  ?  206 GLN   A H    1 
ATOM   2925 H HA   . GLN   A 1 202 ? 22.98600 30.54400 20.04200  1.000 25.59000  ?  206 GLN   A HA   1 
ATOM   2926 H HB2  . GLN   A 1 202 ? 22.04900 31.92900 21.61500  1.000 26.58000  ?  206 GLN   A HB2  1 
ATOM   2927 H HB3  . GLN   A 1 202 ? 20.58900 31.44100 21.22100  1.000 26.58000  ?  206 GLN   A HB3  1 
ATOM   2928 H HG2  . GLN   A 1 202 ? 21.12800 30.38500 23.16700  1.000 27.39000  ?  206 GLN   A HG2  1 
ATOM   2929 H HG3  . GLN   A 1 202 ? 21.18100 29.27900 22.02600  1.000 27.39000  ?  206 GLN   A HG3  1 
ATOM   2930 H HE21 . GLN   A 1 202 ? 23.19500 28.34900 21.46100  1.000 28.65000  ?  206 GLN   A HE21 1 
ATOM   2931 H HE22 . GLN   A 1 202 ? 24.42300 28.53200 22.28300  1.000 28.65000  ?  206 GLN   A HE22 1 
ATOM   2932 N N    . PHE   A 1 203 ? 20.14100 29.55100 18.94100  1.000 18.72330  ?  207 PHE   A N    1 
ATOM   2933 C CA   . PHE   A 1 203 ? 19.44500 28.36900 18.44200  1.000 17.77318  ?  207 PHE   A CA   1 
ATOM   2934 C C    . PHE   A 1 203 ? 20.26000 27.67800 17.35300  1.000 17.97584  ?  207 PHE   A C    1 
ATOM   2935 O O    . PHE   A 1 203 ? 20.44300 26.45200 17.37500  1.000 17.13627  ?  207 PHE   A O    1 
ATOM   2936 C CB   . PHE   A 1 203 ? 18.04000 28.77600 17.95300  1.000 17.57316  ?  207 PHE   A CB   1 
ATOM   2937 C CG   . PHE   A 1 203 ? 17.17500 27.61800 17.51400  1.000 16.83097  ?  207 PHE   A CG   1 
ATOM   2938 C CD1  . PHE   A 1 203 ? 17.13500 26.44100 18.23600  1.000 17.71791  ?  207 PHE   A CD1  1 
ATOM   2939 C CD2  . PHE   A 1 203 ? 16.35900 27.73600 16.41000  1.000 17.55737  ?  207 PHE   A CD2  1 
ATOM   2940 C CE1  . PHE   A 1 203 ? 16.34000 25.38300 17.83100  1.000 17.74160  ?  207 PHE   A CE1  1 
ATOM   2941 C CE2  . PHE   A 1 203 ? 15.55200 26.68000 16.01400  1.000 17.48104  ?  207 PHE   A CE2  1 
ATOM   2942 C CZ   . PHE   A 1 203 ? 15.54200 25.51400 16.71300  1.000 17.92583  ?  207 PHE   A CZ   1 
ATOM   2943 H H    . PHE   A 1 203 ? 19.71300 30.29000 18.83700  1.000 22.52000  ?  207 PHE   A H    1 
ATOM   2944 H HA   . PHE   A 1 203 ? 19.32700 27.72400 19.15700  1.000 21.38000  ?  207 PHE   A HA   1 
ATOM   2945 H HB2  . PHE   A 1 203 ? 17.58000 29.22900 18.67600  1.000 21.14000  ?  207 PHE   A HB2  1 
ATOM   2946 H HB3  . PHE   A 1 203 ? 18.13700 29.37300 17.19500  1.000 21.14000  ?  207 PHE   A HB3  1 
ATOM   2947 H HD1  . PHE   A 1 203 ? 17.65000 26.35800 19.00500  1.000 21.31000  ?  207 PHE   A HD1  1 
ATOM   2948 H HD2  . PHE   A 1 203 ? 16.35000 28.53000 15.92600  1.000 21.12000  ?  207 PHE   A HD2  1 
ATOM   2949 H HE1  . PHE   A 1 203 ? 16.34400 24.58700 18.31100  1.000 21.34000  ?  207 PHE   A HE1  1 
ATOM   2950 H HE2  . PHE   A 1 203 ? 15.01300 26.77000 15.26200  1.000 21.02000  ?  207 PHE   A HE2  1 
ATOM   2951 H HZ   . PHE   A 1 203 ? 15.00000 24.80900 16.44000  1.000 21.56000  ?  207 PHE   A HZ   1 
ATOM   2952 N N    . VAL   A 1 204 ? 20.74900 28.45400 16.38400  1.000 18.14428  ?  208 VAL   A N    1 
ATOM   2953 C CA   . VAL   A 1 204 ? 21.61200 27.91500 15.33900  1.000 18.97070  ?  208 VAL   A CA   1 
ATOM   2954 C C    . VAL   A 1 204 ? 22.82200 27.21800 15.95100  1.000 18.88384  ?  208 VAL   A C    1 
ATOM   2955 O O    . VAL   A 1 204 ? 23.19700 26.11300 15.54400  1.000 19.50760  ?  208 VAL   A O    1 
ATOM   2956 C CB   . VAL   A 1 204 ? 22.03100 29.05000 14.39600  1.000 20.01556  ?  208 VAL   A CB   1 
ATOM   2957 C CG1  . VAL   A 1 204 ? 23.21700 28.64000 13.53500  1.000 20.34981  ?  208 VAL   A CG1  1 
ATOM   2958 C CG2  . VAL   A 1 204 ? 20.87400 29.46200 13.52600  1.000 20.42613  ?  208 VAL   A CG2  1 
ATOM   2959 H H    . VAL   A 1 204 ? 20.59500 29.29700 16.31100  1.000 21.82000  ?  208 VAL   A H    1 
ATOM   2960 H HA   . VAL   A 1 204 ? 21.12100 27.25000 14.83100  1.000 22.82000  ?  208 VAL   A HA   1 
ATOM   2961 H HB   . VAL   A 1 204 ? 22.30300 29.81000 14.93400  1.000 24.07000  ?  208 VAL   A HB   1 
ATOM   2962 H HG11 . VAL   A 1 204 ? 23.27700 29.23700 12.77400  1.000 24.47000  ?  208 VAL   A HG11 1 
ATOM   2963 H HG12 . VAL   A 1 204 ? 24.02700 28.69800 14.06600  1.000 24.47000  ?  208 VAL   A HG12 1 
ATOM   2964 H HG13 . VAL   A 1 204 ? 23.08600 27.72800 13.23100  1.000 24.47000  ?  208 VAL   A HG13 1 
ATOM   2965 H HG21 . VAL   A 1 204 ? 21.15500 30.19100 12.95100  1.000 24.56000  ?  208 VAL   A HG21 1 
ATOM   2966 H HG22 . VAL   A 1 204 ? 20.59800 28.70400 12.98700  1.000 24.56000  ?  208 VAL   A HG22 1 
ATOM   2967 H HG23 . VAL   A 1 204 ? 20.14000 29.75100 14.09100  1.000 24.56000  ?  208 VAL   A HG23 1 
ATOM   2968 N N    . ASP   A 1 205 ? 23.45700 27.85500 16.93300  1.000 19.13124  ?  209 ASP   A N    1 
ATOM   2969 C CA   . ASP   A 1 205 ? 24.65900 27.26900 17.51500  1.000 19.98397  ?  209 ASP   A CA   1 
ATOM   2970 C C    . ASP   A 1 205 ? 24.34700 25.95100 18.21500  1.000 19.98661  ?  209 ASP   A C    1 
ATOM   2971 O O    . ASP   A 1 205 ? 25.11400 24.98900 18.11800  1.000 19.68920  ?  209 ASP   A O    1 
ATOM   2972 C CB   . ASP   A 1 205 ? 25.30800 28.26100 18.48300  1.000 21.60522  ?  209 ASP   A CB   1 
ATOM   2973 C CG   . ASP   A 1 205 ? 26.02200 29.40200 17.76200  1.000 25.10827  ?  209 ASP   A CG   1 
ATOM   2974 O OD1  . ASP   A 1 205 ? 26.14400 29.34100 16.52200  1.000 27.16115  ?  209 ASP   A OD1  1 
ATOM   2975 O OD2  . ASP   A 1 205 ? 26.43700 30.36400 18.42600  1.000 28.13232  -1 209 ASP   A OD2  1 
ATOM   2976 H H    . ASP   A 1 205 ? 23.21800 28.60900 17.27200  1.000 23.01000  ?  209 ASP   A H    1 
ATOM   2977 H HA   . ASP   A 1 205 ? 25.29600 27.08400 16.80600  1.000 24.03000  ?  209 ASP   A HA   1 
ATOM   2978 H HB2  . ASP   A 1 205 ? 24.62100 28.64700 19.04900  1.000 25.97000  ?  209 ASP   A HB2  1 
ATOM   2979 H HB3  . ASP   A 1 205 ? 25.96100 27.79300 19.02600  1.000 25.97000  ?  209 ASP   A HB3  1 
ATOM   2980 N N    . TRP   A 1 206 ? 23.21000 25.87400 18.91600  1.000 18.65750  ?  210 TRP   A N    1 
ATOM   2981 C CA   . TRP   A 1 206 ? 22.84100 24.60200 19.52200  1.000 18.48906  ?  210 TRP   A CA   1 
ATOM   2982 C C    . TRP   A 1 206 ? 22.64700 23.52800 18.45900  1.000 17.92583  ?  210 TRP   A C    1 
ATOM   2983 O O    . TRP   A 1 206 ? 23.11600 22.40000 18.62300  1.000 18.31009  ?  210 TRP   A O    1 
ATOM   2984 C CB   . TRP   A 1 206 ? 21.59700 24.75600 20.40300  1.000 18.20218  ?  210 TRP   A CB   1 
ATOM   2985 C CG   . TRP   A 1 206 ? 21.86200 25.40600 21.72500  1.000 18.70487  ?  210 TRP   A CG   1 
ATOM   2986 C CD1  . TRP   A 1 206 ? 23.06300 25.47700 22.38800  1.000 19.66815  ?  210 TRP   A CD1  1 
ATOM   2987 C CD2  . TRP   A 1 206 ? 20.91500 26.08400 22.55200  1.000 18.54959  ?  210 TRP   A CD2  1 
ATOM   2988 N NE1  . TRP   A 1 206 ? 22.90000 26.12700 23.58900  1.000 19.81027  ?  210 TRP   A NE1  1 
ATOM   2989 C CE2  . TRP   A 1 206 ? 21.59100 26.51200 23.71100  1.000 19.96818  ?  210 TRP   A CE2  1 
ATOM   2990 C CE3  . TRP   A 1 206 ? 19.54600 26.34400 22.43900  1.000 18.61013  ?  210 TRP   A CE3  1 
ATOM   2991 C CZ2  . TRP   A 1 206 ? 20.95000 27.21500 24.73600  1.000 19.33390  ?  210 TRP   A CZ2  1 
ATOM   2992 C CZ3  . TRP   A 1 206 ? 18.91300 27.02800 23.45300  1.000 19.32337  ?  210 TRP   A CZ3  1 
ATOM   2993 C CH2  . TRP   A 1 206 ? 19.61400 27.46200 24.58400  1.000 19.44970  ?  210 TRP   A CH2  1 
ATOM   2994 H H    . TRP   A 1 206 ? 22.66000 26.52200 19.04900  1.000 22.44000  ?  210 TRP   A H    1 
ATOM   2995 H HA   . TRP   A 1 206 ? 23.55900 24.31400 20.10700  1.000 22.24000  ?  210 TRP   A HA   1 
ATOM   2996 H HB2  . TRP   A 1 206 ? 20.94800 25.30100 19.93100  1.000 21.89000  ?  210 TRP   A HB2  1 
ATOM   2997 H HB3  . TRP   A 1 206 ? 21.22700 23.87600 20.57500  1.000 21.89000  ?  210 TRP   A HB3  1 
ATOM   2998 H HD1  . TRP   A 1 206 ? 23.86800 25.13500 22.07200  1.000 23.65000  ?  210 TRP   A HD1  1 
ATOM   2999 H HE1  . TRP   A 1 206 ? 23.51900 26.26900 24.16900  1.000 23.82000  ?  210 TRP   A HE1  1 
ATOM   3000 H HE3  . TRP   A 1 206 ? 19.07100 26.06000 21.69200  1.000 22.38000  ?  210 TRP   A HE3  1 
ATOM   3001 H HZ2  . TRP   A 1 206 ? 21.41400 27.50100 25.48900  1.000 23.25000  ?  210 TRP   A HZ2  1 
ATOM   3002 H HZ3  . TRP   A 1 206 ? 18.00200 27.20500 23.38400  1.000 23.24000  ?  210 TRP   A HZ3  1 
ATOM   3003 H HH2  . TRP   A 1 206 ? 19.16100 27.93000 25.24700  1.000 23.39000  ?  210 TRP   A HH2  1 
ATOM   3004 N N    . LEU   A 1 207 ? 21.94100 23.85300 17.36900  1.000 17.39945  ?  211 LEU   A N    1 
ATOM   3005 C CA   . LEU   A 1 207 ? 21.73100 22.87100 16.31600  1.000 17.51789  ?  211 LEU   A CA   1 
ATOM   3006 C C    . LEU   A 1 207 ? 23.04000 22.46800 15.66000  1.000 17.40735  ?  211 LEU   A C    1 
ATOM   3007 O O    . LEU   A 1 207 ? 23.22900 21.30000 15.31700  1.000 17.84951  ?  211 LEU   A O    1 
ATOM   3008 C CB   . LEU   A 1 207 ? 20.79700 23.44600 15.26000  1.000 16.83623  ?  211 LEU   A CB   1 
ATOM   3009 C CG   . LEU   A 1 207 ? 19.34900 23.68300 15.70000  1.000 17.10205  ?  211 LEU   A CG   1 
ATOM   3010 C CD1  . LEU   A 1 207 ? 18.63800 24.59400 14.69000  1.000 17.85214  ?  211 LEU   A CD1  1 
ATOM   3011 C CD2  . LEU   A 1 207 ? 18.57500 22.37600 15.87300  1.000 17.00730  ?  211 LEU   A CD2  1 
ATOM   3012 H H    . LEU   A 1 207 ? 21.58300 24.62100 17.22200  1.000 20.93000  ?  211 LEU   A H    1 
ATOM   3013 H HA   . LEU   A 1 207 ? 21.32500 22.08200 16.70900  1.000 21.07000  ?  211 LEU   A HA   1 
ATOM   3014 H HB2  . LEU   A 1 207 ? 21.15400 24.30100 14.97400  1.000 20.25000  ?  211 LEU   A HB2  1 
ATOM   3015 H HB3  . LEU   A 1 207 ? 20.77100 22.83000 14.51100  1.000 20.25000  ?  211 LEU   A HB3  1 
ATOM   3016 H HG   . LEU   A 1 207 ? 19.36500 24.11800 16.56800  1.000 20.57000  ?  211 LEU   A HG   1 
ATOM   3017 H HD11 . LEU   A 1 207 ? 17.72000 24.72600 14.97600  1.000 21.47000  ?  211 LEU   A HD11 1 
ATOM   3018 H HD12 . LEU   A 1 207 ? 19.09900 25.44600 14.65400  1.000 21.47000  ?  211 LEU   A HD12 1 
ATOM   3019 H HD13 . LEU   A 1 207 ? 18.65500 24.17100 13.81700  1.000 21.47000  ?  211 LEU   A HD13 1 
ATOM   3020 H HD21 . LEU   A 1 207 ? 17.67700 22.57900 16.17800  1.000 20.46000  ?  211 LEU   A HD21 1 
ATOM   3021 H HD22 . LEU   A 1 207 ? 18.53800 21.91600 15.02000  1.000 20.46000  ?  211 LEU   A HD22 1 
ATOM   3022 H HD23 . LEU   A 1 207 ? 19.03000 21.82300 16.52700  1.000 20.46000  ?  211 LEU   A HD23 1 
ATOM   3023 N N    . LYS   A 1 208 ? 23.93700 23.42500 15.44700  1.000 17.94952  ?  212 LYS   A N    1 
ATOM   3024 C CA   . LYS   A 1 208 ? 25.22100 23.08300 14.83500  1.000 18.55486  ?  212 LYS   A CA   1 
ATOM   3025 C C    . LYS   A 1 208 ? 26.00500 22.10400 15.70100  1.000 19.59445  ?  212 LYS   A C    1 
ATOM   3026 O O    . LYS   A 1 208 ? 26.78100 21.28400 15.18200  1.000 20.32612  ?  212 LYS   A O    1 
ATOM   3027 C CB   . LYS   A 1 208 ? 26.03800 24.35000 14.58300  1.000 20.22348  ?  212 LYS   A CB   1 
ATOM   3028 C CG   . LYS   A 1 208 ? 25.58100 25.18600 13.41400  1.000 21.33940  ?  212 LYS   A CG   1 
ATOM   3029 C CD   . LYS   A 1 208 ? 26.46700 26.42000 13.34600  1.000 25.13196  ?  212 LYS   A CD   1 
ATOM   3030 C CE   . LYS   A 1 208 ? 26.43200 27.12500 12.03000  1.000 27.65858  ?  212 LYS   A CE   1 
ATOM   3031 N NZ   . LYS   A 1 208 ? 27.60600 28.05700 11.96000  1.000 28.87188  ?  212 LYS   A NZ   1 
ATOM   3032 H H    . LYS   A 1 208 ? 23.83300 24.25700 15.64000  1.000 21.59000  ?  212 LYS   A H    1 
ATOM   3033 H HA   . LYS   A 1 208 ? 25.05900 22.66100 13.97700  1.000 22.32000  ?  212 LYS   A HA   1 
ATOM   3034 H HB2  . LYS   A 1 208 ? 25.99000 24.90800 15.37500  1.000 24.32000  ?  212 LYS   A HB2  1 
ATOM   3035 H HB3  . LYS   A 1 208 ? 26.95800 24.09300 14.41300  1.000 24.32000  ?  212 LYS   A HB3  1 
ATOM   3036 H HG2  . LYS   A 1 208 ? 25.66800 24.68400 12.58900  1.000 25.66000  ?  212 LYS   A HG2  1 
ATOM   3037 H HG3  . LYS   A 1 208 ? 24.65900 25.46100 13.53900  1.000 25.66000  ?  212 LYS   A HG3  1 
ATOM   3038 H HD2  . LYS   A 1 208 ? 26.17600 27.04900 14.02400  1.000 30.21000  ?  212 LYS   A HD2  1 
ATOM   3039 H HD3  . LYS   A 1 208 ? 27.38500 26.15300 13.51200  1.000 30.21000  ?  212 LYS   A HD3  1 
ATOM   3040 H HE2  . LYS   A 1 208 ? 26.49400 26.48200 11.30700  1.000 33.24000  ?  212 LYS   A HE2  1 
ATOM   3041 H HE3  . LYS   A 1 208 ? 25.61300 27.63800 11.95000  1.000 33.24000  ?  212 LYS   A HE3  1 
ATOM   3042 H HZ1  . LYS   A 1 208 ? 27.61700 28.47300 11.17300  1.000 34.70000  ?  212 LYS   A HZ1  1 
ATOM   3043 H HZ2  . LYS   A 1 208 ? 27.55000 28.66600 12.60700  1.000 34.70000  ?  212 LYS   A HZ2  1 
ATOM   3044 H HZ3  . LYS   A 1 208 ? 28.36300 27.60100 12.05700  1.000 34.70000  ?  212 LYS   A HZ3  1 
ATOM   3045 N N    . GLY   A 1 209 ? 25.84200 22.19200 17.01100  1.000 19.23915  ?  213 GLY   A N    1 
ATOM   3046 C CA   . GLY   A 1 209 ? 26.56200 21.33300 17.92400  1.000 20.00240  ?  213 GLY   A CA   1 
ATOM   3047 C C    . GLY   A 1 209 ? 25.90000 20.00200 18.19300  1.000 18.89700  ?  213 GLY   A C    1 
ATOM   3048 O O    . GLY   A 1 209 ? 26.32300 19.26700 19.09100  1.000 20.67880  ?  213 GLY   A O    1 
ATOM   3049 H H    . GLY   A 1 209 ? 25.31200 22.74900 17.39700  1.000 23.14000  ?  213 GLY   A H    1 
ATOM   3050 H HA2  . GLY   A 1 209 ? 27.44300 21.15700 17.55700  1.000 24.05000  ?  213 GLY   A HA2  1 
ATOM   3051 H HA3  . GLY   A 1 209 ? 26.66000 21.79200 18.77300  1.000 24.05000  ?  213 GLY   A HA3  1 
ATOM   3052 N N    . ASN   A 1 210 ? 24.83700 19.66700 17.47200  1.000 18.27851  ?  214 ASN   A N    1 
ATOM   3053 C CA   . ASN   A 1 210 ? 24.20600 18.38400 17.70500  1.000 17.58895  ?  214 ASN   A CA   1 
ATOM   3054 C C    . ASN   A 1 210 ? 25.20400 17.25000 17.51300  1.000 18.16007  ?  214 ASN   A C    1 
ATOM   3055 O O    . ASN   A 1 210 ? 25.97100 17.23900 16.54400  1.000 18.96017  ?  214 ASN   A O    1 
ATOM   3056 C CB   . ASN   A 1 210 ? 23.03100 18.16900 16.75300  1.000 17.22575  ?  214 ASN   A CB   1 
ATOM   3057 C CG   . ASN   A 1 210 ? 22.32900 16.87300 17.02800  1.000 16.68884  ?  214 ASN   A CG   1 
ATOM   3058 O OD1  . ASN   A 1 210 ? 22.24100 16.44300 18.17500  1.000 17.50473  ?  214 ASN   A OD1  1 
ATOM   3059 N ND2  . ASN   A 1 210 ? 21.90000 16.20200 15.98300  1.000 17.48104  ?  214 ASN   A ND2  1 
ATOM   3060 H H    . ASN   A 1 210 ? 24.47600 20.15200 16.86100  1.000 21.99000  ?  214 ASN   A H    1 
ATOM   3061 H HA   . ASN   A 1 210 ? 23.87300 18.37200 18.61600  1.000 21.16000  ?  214 ASN   A HA   1 
ATOM   3062 H HB2  . ASN   A 1 210 ? 22.39200 18.89100 16.86400  1.000 20.72000  ?  214 ASN   A HB2  1 
ATOM   3063 H HB3  . ASN   A 1 210 ? 23.35800 18.15200 15.84000  1.000 20.72000  ?  214 ASN   A HB3  1 
ATOM   3064 H HD21 . ASN   A 1 210 ? 21.49100 15.45300 16.09200  1.000 21.03000  ?  214 ASN   A HD21 1 
ATOM   3065 H HD22 . ASN   A 1 210 ? 22.02700 16.51200 15.19100  1.000 21.03000  ?  214 ASN   A HD22 1 
ATOM   3066 N N    . THR   A 1 211 ? 25.12100 16.24400 18.38800  1.000 18.24429  ?  215 THR   A N    1 
ATOM   3067 C CA   . THR   A 1 211 ? 25.99600 15.08500 18.32500  1.000 18.70487  ?  215 THR   A CA   1 
ATOM   3068 C C    . THR   A 1 211 ? 25.32700 13.82500 17.78300  1.000 18.71540  ?  215 THR   A C    1 
ATOM   3069 O O    . THR   A 1 211 ? 26.02900 12.83300 17.55400  1.000 19.18651  ?  215 THR   A O    1 
ATOM   3070 C CB   . THR   A 1 211 ? 26.58300 14.75400 19.71500  1.000 19.98661  ?  215 THR   A CB   1 
ATOM   3071 O OG1  . THR   A 1 211 ? 25.55800 14.19300 20.55500  1.000 19.76290  ?  215 THR   A OG1  1 
ATOM   3072 C CG2  . THR   A 1 211 ? 27.20100 15.98400 20.38600  1.000 20.63142  ?  215 THR   A CG2  1 
ATOM   3073 H H    . THR   A 1 211 ? 24.55500 16.21400 19.03500  1.000 21.94000  ?  215 THR   A H    1 
ATOM   3074 H HA   . THR   A 1 211 ? 26.72600 15.31900 17.73100  1.000 22.50000  ?  215 THR   A HA   1 
ATOM   3075 H HB   . THR   A 1 211 ? 27.29700 14.10700 19.60400  1.000 24.03000  ?  215 THR   A HB   1 
ATOM   3076 H HG1  . THR   A 1 211 ? 24.92700 14.74100 20.64300  1.000 23.76000  ?  215 THR   A HG1  1 
ATOM   3077 H HG21 . THR   A 1 211 ? 27.62400 15.72900 21.22100  1.000 24.81000  ?  215 THR   A HG21 1 
ATOM   3078 H HG22 . THR   A 1 211 ? 27.86700 16.38100 19.80300  1.000 24.81000  ?  215 THR   A HG22 1 
ATOM   3079 H HG23 . THR   A 1 211 ? 26.51200 16.64200 20.57100  1.000 24.81000  ?  215 THR   A HG23 1 
ATOM   3080 N N    . THR   A 1 212 ? 24.00300 13.82000 17.57300  1.000 17.48368  ?  216 THR   A N    1 
ATOM   3081 C CA   . THR   A 1 212 ? 23.28200 12.58700 17.30000  1.000 17.60474  ?  216 THR   A CA   1 
ATOM   3082 C C    . THR   A 1 212 ? 22.96300 12.37500 15.81900  1.000 17.01520  ?  216 THR   A C    1 
ATOM   3083 O O    . THR   A 1 212 ? 22.31700 11.37400 15.48000  1.000 17.97321  ?  216 THR   A O    1 
ATOM   3084 C CB   . THR   A 1 212 ? 21.94900 12.57800 18.07600  1.000 18.12059  ?  216 THR   A CB   1 
ATOM   3085 O OG1  . THR   A 1 212 ? 21.10300 13.58800 17.52600  1.000 18.60749  ?  216 THR   A OG1  1 
ATOM   3086 C CG2  . THR   A 1 212 ? 22.13500 12.83500 19.55000  1.000 19.77869  ?  216 THR   A CG2  1 
ATOM   3087 H H    . THR   A 1 212 ? 23.50800 14.52300 17.58500  1.000 21.03000  ?  216 THR   A H    1 
ATOM   3088 H HA   . THR   A 1 212 ? 23.83900 11.85200 17.59900  1.000 21.17000  ?  216 THR   A HA   1 
ATOM   3089 H HB   . THR   A 1 212 ? 21.54400 11.70000 17.99600  1.000 21.80000  ?  216 THR   A HB   1 
ATOM   3090 H HG1  . THR   A 1 212 ? 20.38100 13.62200 17.95300  1.000 22.38000  ?  216 THR   A HG1  1 
ATOM   3091 H HG21 . THR   A 1 212 ? 21.30300 12.67500 20.02300  1.000 23.78000  ?  216 THR   A HG21 1 
ATOM   3092 H HG22 . THR   A 1 212 ? 22.81700 12.24500 19.90700  1.000 23.78000  ?  216 THR   A HG22 1 
ATOM   3093 H HG23 . THR   A 1 212 ? 22.40700 13.75500 19.69500  1.000 23.78000  ?  216 THR   A HG23 1 
ATOM   3094 N N    . GLY   A 1 213 ? 23.35200 13.29200 14.93500  1.000 17.04941  ?  217 GLY   A N    1 
ATOM   3095 C CA   . GLY   A 1 213 ? 22.89200 13.23700 13.56600  1.000 17.22049  ?  217 GLY   A CA   1 
ATOM   3096 C C    . GLY   A 1 213 ? 23.93600 12.93200 12.51800  1.000 17.22838  ?  217 GLY   A C    1 
ATOM   3097 O O    . GLY   A 1 213 ? 23.70500 13.19400 11.33800  1.000 17.13890  ?  217 GLY   A O    1 
ATOM   3098 H H    . GLY   A 1 213 ? 23.87900 13.94900 15.11000  1.000 20.51000  ?  217 GLY   A H    1 
ATOM   3099 H HA2  . GLY   A 1 213 ? 22.20900 12.55200 13.50100  1.000 20.71000  ?  217 GLY   A HA2  1 
ATOM   3100 H HA3  . GLY   A 1 213 ? 22.50000 14.09600 13.34100  1.000 20.71000  ?  217 GLY   A HA3  1 
ATOM   3101 N N    . ASN   A 1 214 ? 25.07400 12.35500 12.89300  1.000 18.04164  ?  218 ASN   A N    1 
ATOM   3102 C CA   . ASN   A 1 214 ? 26.14600 12.23000 11.91200  1.000 18.77857  ?  218 ASN   A CA   1 
ATOM   3103 C C    . ASN   A 1 214 ? 25.80700 11.25900 10.79300  1.000 19.19967  ?  218 ASN   A C    1 
ATOM   3104 O O    . ASN   A 1 214 ? 26.43500 11.32400 9.72500   1.000 20.34981  ?  218 ASN   A O    1 
ATOM   3105 C CB   . ASN   A 1 214 ? 27.44500 11.80000 12.59100  1.000 20.53404  ?  218 ASN   A CB   1 
ATOM   3106 C CG   . ASN   A 1 214 ? 27.97800 12.85600 13.52600  1.000 23.18436  ?  218 ASN   A CG   1 
ATOM   3107 O OD1  . ASN   A 1 214 ? 27.61700 14.02900 13.43600  1.000 23.05276  ?  218 ASN   A OD1  1 
ATOM   3108 N ND2  . ASN   A 1 214 ? 28.89800 12.45600 14.39800  1.000 26.81637  ?  218 ASN   A ND2  1 
ATOM   3109 H H    . ASN   A 1 214 ? 25.24400 12.04100 13.67600  1.000 21.70000  ?  218 ASN   A H    1 
ATOM   3110 H HA   . ASN   A 1 214 ? 26.29100 13.10200 11.51400  1.000 22.58000  ?  218 ASN   A HA   1 
ATOM   3111 H HB2  . ASN   A 1 214 ? 27.28300 10.99500 13.10600  1.000 24.69000  ?  218 ASN   A HB2  1 
ATOM   3112 H HB3  . ASN   A 1 214 ? 28.11700 11.63100 11.91200  1.000 24.69000  ?  218 ASN   A HB3  1 
ATOM   3113 H HD21 . ASN   A 1 214 ? 29.23600 13.01700 14.95500  1.000 32.23000  ?  218 ASN   A HD21 1 
ATOM   3114 H HD22 . ASN   A 1 214 ? 29.15600 11.63500 14.40400  1.000 32.23000  ?  218 ASN   A HD22 1 
ATOM   3115 N N    . HIS   A 1 215 ? 24.83400 10.36700 10.99600  1.000 18.04690  ?  219 HIS   A N    1 
ATOM   3116 C CA   . HIS   A 1 215 ? 24.49200 9.38500  9.98400   1.000 18.63118  ?  219 HIS   A CA   1 
ATOM   3117 C C    . HIS   A 1 215 ? 23.20700 9.72100  9.24900   1.000 17.76529  ?  219 HIS   A C    1 
ATOM   3118 O O    . HIS   A 1 215 ? 22.72300 8.90000  8.47900   1.000 18.38115  ?  219 HIS   A O    1 
ATOM   3119 C CB   . HIS   A 1 215 ? 24.40000 8.00100  10.60800  1.000 20.80249  ?  219 HIS   A CB   1 
ATOM   3120 C CG   . HIS   A 1 215 ? 25.64200 7.60600  11.33400  1.000 24.31607  ?  219 HIS   A CG   1 
ATOM   3121 N ND1  . HIS   A 1 215 ? 26.81200 7.30500  10.67400  1.000 25.65044  ?  219 HIS   A ND1  1 
ATOM   3122 C CD2  . HIS   A 1 215 ? 25.91800 7.50900  12.65400  1.000 26.35842  ?  219 HIS   A CD2  1 
ATOM   3123 C CE1  . HIS   A 1 215 ? 27.74900 7.01200  11.55500  1.000 26.72162  ?  219 HIS   A CE1  1 
ATOM   3124 N NE2  . HIS   A 1 215 ? 27.23500 7.13500  12.76400  1.000 27.17694  ?  219 HIS   A NE2  1 
ATOM   3125 H H    . HIS   A 1 215 ? 24.36200 10.31700 11.71400  1.000 21.71000  ?  219 HIS   A H    1 
ATOM   3126 H HA   . HIS   A 1 215 ? 25.20300 9.36300  9.32500   1.000 22.41000  ?  219 HIS   A HA   1 
ATOM   3127 H HB2  . HIS   A 1 215 ? 23.66600 7.99000  11.24200  1.000 25.01000  ?  219 HIS   A HB2  1 
ATOM   3128 H HB3  . HIS   A 1 215 ? 24.24300 7.34900  9.90700   1.000 25.01000  ?  219 HIS   A HB3  1 
ATOM   3129 H HD2  . HIS   A 1 215 ? 25.32700 7.66600  13.35500  1.000 31.68000  ?  219 HIS   A HD2  1 
ATOM   3130 H HE1  . HIS   A 1 215 ? 28.62200 6.76200  11.35800  1.000 32.11000  ?  219 HIS   A HE1  1 
ATOM   3131 H HE2  . HIS   A 1 215 ? 27.65600 7.00300  13.50200  1.000 32.66000  ?  219 HIS   A HE2  1 
ATOM   3132 N N    . ARG   A 1 216 ? 22.68600 10.92500 9.41100   1.000 16.98625  ?  220 ARG   A N    1 
ATOM   3133 C CA   . ARG   A 1 216 ? 21.40900 11.30000 8.79000   1.000 15.81242  ?  220 ARG   A CA   1 
ATOM   3134 C C    . ARG   A 1 216 ? 21.67100 12.43300 7.78200   1.000 16.12825  ?  220 ARG   A C    1 
ATOM   3135 O O    . ARG   A 1 216 ? 22.47400 12.26200 6.85600   1.000 17.23365  ?  220 ARG   A O    1 
ATOM   3136 C CB   . ARG   A 1 216 ? 20.37300 11.61400 9.89200   1.000 16.39933  ?  220 ARG   A CB   1 
ATOM   3137 C CG   . ARG   A 1 216 ? 20.09000 10.31000 10.68700  1.000 15.95191  ?  220 ARG   A CG   1 
ATOM   3138 C CD   . ARG   A 1 216 ? 19.03700 10.46500 11.74700  1.000 16.40197  ?  220 ARG   A CD   1 
ATOM   3139 N NE   . ARG   A 1 216 ? 18.96800 9.25500  12.53700  1.000 16.55725  ?  220 ARG   A NE   1 
ATOM   3140 C CZ   . ARG   A 1 216 ? 18.02700 8.99200  13.43100  1.000 16.12035  ?  220 ARG   A CZ   1 
ATOM   3141 N NH1  . ARG   A 1 216 ? 16.95800 9.76900  13.56300  1.000 16.38091  ?  220 ARG   A NH1  1 
ATOM   3142 N NH2  . ARG   A 1 216 ? 18.14400 7.90400  14.18500  1.000 16.92045  ?  220 ARG   A NH2  1 
ATOM   3143 H H    . ARG   A 1 216 ? 23.04800 11.55100 9.87500   1.000 20.43000  ?  220 ARG   A H    1 
ATOM   3144 H HA   . ARG   A 1 216 ? 21.00500 10.58100 8.28000   1.000 19.03000  ?  220 ARG   A HA   1 
ATOM   3145 H HB2  . ARG   A 1 216 ? 20.72500 12.28500 10.49700  1.000 19.73000  ?  220 ARG   A HB2  1 
ATOM   3146 H HB3  . ARG   A 1 216 ? 19.54700 11.92800 9.49200   1.000 19.73000  ?  220 ARG   A HB3  1 
ATOM   3147 H HG2  . ARG   A 1 216 ? 19.78800 9.62600  10.06900  1.000 19.19000  ?  220 ARG   A HG2  1 
ATOM   3148 H HG3  . ARG   A 1 216 ? 20.90800 10.02600 11.12400  1.000 19.19000  ?  220 ARG   A HG3  1 
ATOM   3149 H HD2  . ARG   A 1 216 ? 19.26200 11.20800 12.32900  1.000 19.73000  ?  220 ARG   A HD2  1 
ATOM   3150 H HD3  . ARG   A 1 216 ? 18.17300 10.61900 11.33200  1.000 19.73000  ?  220 ARG   A HD3  1 
ATOM   3151 H HE   . ARG   A 1 216 ? 19.58200 8.66400  12.41800  1.000 19.92000  ?  220 ARG   A HE   1 
ATOM   3152 H HH11 . ARG   A 1 216 ? 16.86600 10.46200 13.06100  1.000 19.70000  ?  220 ARG   A HH11 1 
ATOM   3153 H HH12 . ARG   A 1 216 ? 16.35900 9.58000  14.15000  1.000 19.70000  ?  220 ARG   A HH12 1 
ATOM   3154 H HH21 . ARG   A 1 216 ? 18.82300 7.38500  14.08800  1.000 20.36000  ?  220 ARG   A HH21 1 
ATOM   3155 H HH22 . ARG   A 1 216 ? 17.54100 7.72000  14.77000  1.000 20.36000  ?  220 ARG   A HH22 1 
ATOM   3156 N N    . ILE   A 1 217 ? 21.01100 13.58900 7.90200   1.000 16.14930  ?  221 ILE   A N    1 
ATOM   3157 C CA   . ILE   A 1 217 ? 21.18500 14.62800 6.89300   1.000 15.79926  ?  221 ILE   A CA   1 
ATOM   3158 C C    . ILE   A 1 217 ? 22.66200 14.99200 6.73400   1.000 16.73095  ?  221 ILE   A C    1 
ATOM   3159 O O    . ILE   A 1 217 ? 23.15000 15.17900 5.61200   1.000 17.04678  ?  221 ILE   A O    1 
ATOM   3160 C CB   . ILE   A 1 217 ? 20.31000 15.85000 7.20900   1.000 16.21247  ?  221 ILE   A CB   1 
ATOM   3161 C CG1  . ILE   A 1 217 ? 18.81600 15.51100 7.04700   1.000 16.03350  ?  221 ILE   A CG1  1 
ATOM   3162 C CG2  . ILE   A 1 217 ? 20.67800 17.00600 6.32000   1.000 16.67568  ?  221 ILE   A CG2  1 
ATOM   3163 C CD1  . ILE   A 1 217 ? 17.90300 16.56100 7.62300   1.000 16.30722  ?  221 ILE   A CD1  1 
ATOM   3164 H H    . ILE   A 1 217 ? 20.47200 13.78800 8.54200   1.000 19.43000  ?  221 ILE   A H    1 
ATOM   3165 H HA   . ILE   A 1 217 ? 20.88400 14.27400 6.04200   1.000 19.01000  ?  221 ILE   A HA   1 
ATOM   3166 H HB   . ILE   A 1 217 ? 20.47100 16.10000 8.13200   1.000 19.51000  ?  221 ILE   A HB   1 
ATOM   3167 H HG12 . ILE   A 1 217 ? 18.61400 15.42600 6.10200   1.000 19.29000  ?  221 ILE   A HG12 1 
ATOM   3168 H HG13 . ILE   A 1 217 ? 18.63300 14.67400 7.50200   1.000 19.29000  ?  221 ILE   A HG13 1 
ATOM   3169 H HG21 . ILE   A 1 217 ? 19.98000 17.67800 6.37200   1.000 20.06000  ?  221 ILE   A HG21 1 
ATOM   3170 H HG22 . ILE   A 1 217 ? 21.52100 17.38000 6.62100   1.000 20.06000  ?  221 ILE   A HG22 1 
ATOM   3171 H HG23 . ILE   A 1 217 ? 20.76300 16.68800 5.40800   1.000 20.06000  ?  221 ILE   A HG23 1 
ATOM   3172 H HD11 . ILE   A 1 217 ? 16.99800 16.21300 7.64800   1.000 19.62000  ?  221 ILE   A HD11 1 
ATOM   3173 H HD12 . ILE   A 1 217 ? 18.19800 16.77800 8.52200   1.000 19.62000  ?  221 ILE   A HD12 1 
ATOM   3174 H HD13 . ILE   A 1 217 ? 17.93800 17.35200 7.06400   1.000 19.62000  ?  221 ILE   A HD13 1 
ATOM   3175 N N    . ARG   A 1 218 ? 23.39100 15.07600 7.84900   1.000 16.41249  ?  222 ARG   A N    1 
ATOM   3176 C CA   . ARG   A 1 218 ? 24.80500 15.42700 7.79700   1.000 16.79938  ?  222 ARG   A CA   1 
ATOM   3177 C C    . ARG   A 1 218 ? 25.59200 14.51800 6.87100   1.000 17.56263  ?  222 ARG   A C    1 
ATOM   3178 O O    . ARG   A 1 218 ? 26.60100 14.94800 6.30600   1.000 17.74686  ?  222 ARG   A O    1 
ATOM   3179 C CB   . ARG   A 1 218 ? 25.40200 15.38800 9.20500   1.000 17.57053  ?  222 ARG   A CB   1 
ATOM   3180 C CG   . ARG   A 1 218 ? 25.09900 16.62300 10.01300  1.000 18.52327  ?  222 ARG   A CG   1 
ATOM   3181 C CD   . ARG   A 1 218 ? 25.50300 16.42200 11.44700  1.000 19.32863  ?  222 ARG   A CD   1 
ATOM   3182 N NE   . ARG   A 1 218 ? 24.97800 17.45900 12.32500  1.000 19.72079  ?  222 ARG   A NE   1 
ATOM   3183 C CZ   . ARG   A 1 218 ? 25.61700 18.56800 12.65700  1.000 21.10516  ?  222 ARG   A CZ   1 
ATOM   3184 N NH1  . ARG   A 1 218 ? 26.84300 18.81800 12.21900  1.000 22.41585  ?  222 ARG   A NH1  1 
ATOM   3185 N NH2  . ARG   A 1 218 ? 25.01200 19.45400 13.44200  1.000 21.24728  ?  222 ARG   A NH2  1 
ATOM   3186 H H    . ARG   A 1 218 ? 23.09000 14.93400 8.64200   1.000 19.74000  ?  222 ARG   A H    1 
ATOM   3187 H HA   . ARG   A 1 218 ? 24.88400 16.33100 7.45600   1.000 20.21000  ?  222 ARG   A HA   1 
ATOM   3188 H HB2  . ARG   A 1 218 ? 25.03800 14.62400 9.68000   1.000 21.13000  ?  222 ARG   A HB2  1 
ATOM   3189 H HB3  . ARG   A 1 218 ? 26.36600 15.30600 9.13500   1.000 21.13000  ?  222 ARG   A HB3  1 
ATOM   3190 H HG2  . ARG   A 1 218 ? 25.59400 17.37600 9.65500   1.000 22.28000  ?  222 ARG   A HG2  1 
ATOM   3191 H HG3  . ARG   A 1 218 ? 24.14700 16.80700 9.98300   1.000 22.28000  ?  222 ARG   A HG3  1 
ATOM   3192 H HD2  . ARG   A 1 218 ? 25.16400 15.56700 11.75500  1.000 23.24000  ?  222 ARG   A HD2  1 
ATOM   3193 H HD3  . ARG   A 1 218 ? 26.47100 16.43700 11.50800  1.000 23.24000  ?  222 ARG   A HD3  1 
ATOM   3194 H HE   . ARG   A 1 218 ? 24.19100 17.34100 12.65300  1.000 23.72000  ?  222 ARG   A HE   1 
ATOM   3195 H HH11 . ARG   A 1 218 ? 27.24000 18.25300 11.70700  1.000 26.95000  ?  222 ARG   A HH11 1 
ATOM   3196 H HH12 . ARG   A 1 218 ? 27.24100 19.54600 12.44700  1.000 26.95000  ?  222 ARG   A HH12 1 
ATOM   3197 H HH21 . ARG   A 1 218 ? 24.21500 19.30200 13.72700  1.000 25.55000  ?  222 ARG   A HH21 1 
ATOM   3198 H HH22 . ARG   A 1 218 ? 25.41700 20.17900 13.66500  1.000 25.55000  ?  222 ARG   A HH22 1 
ATOM   3199 N N    . ALA   A 1 219 ? 25.22000 13.24400 6.78500   1.000 17.54684  ?  223 ALA   A N    1 
ATOM   3200 C CA   . ALA   A 1 219 ? 25.96000 12.31500 5.94100   1.000 18.50485  ?  223 ALA   A CA   1 
ATOM   3201 C C    . ALA   A 1 219 ? 25.81300 12.64200 4.47100   1.000 20.23137  ?  223 ALA   A C    1 
ATOM   3202 O O    . ALA   A 1 219 ? 26.63200 12.17700 3.67100   1.000 22.28162  ?  223 ALA   A O    1 
ATOM   3203 C CB   . ALA   A 1 219 ? 25.53700 10.87500 6.21900   1.000 18.90490  ?  223 ALA   A CB   1 
ATOM   3204 H H    . ALA   A 1 219 ? 24.55200 12.89700 7.20000   1.000 21.10000  ?  223 ALA   A H    1 
ATOM   3205 H HA   . ALA   A 1 219 ? 26.90200 12.37700 6.16400   1.000 22.26000  ?  223 ALA   A HA   1 
ATOM   3206 H HB1  . ALA   A 1 219 ? 26.05000 10.27900 5.65000   1.000 22.74000  ?  223 ALA   A HB1  1 
ATOM   3207 H HB2  . ALA   A 1 219 ? 25.70700 10.67000 7.15200   1.000 22.74000  ?  223 ALA   A HB2  1 
ATOM   3208 H HB3  . ALA   A 1 219 ? 24.59100 10.78100 6.02700   1.000 22.74000  ?  223 ALA   A HB3  1 
ATOM   3209 N N    . ALA   A 1 220 ? 24.80000 13.42500 4.10500   1.000 19.43654  ?  224 ALA   A N    1 
ATOM   3210 C CA   . ALA   A 1 220 ? 24.57000 13.84100 2.73300   1.000 20.23664  ?  224 ALA   A CA   1 
ATOM   3211 C C    . ALA   A 1 220 ? 25.13900 15.21700 2.43800   1.000 20.25506  ?  224 ALA   A C    1 
ATOM   3212 O O    . ALA   A 1 220 ? 25.07900 15.65900 1.28800   1.000 23.36333  ?  224 ALA   A O    1 
ATOM   3213 C CB   . ALA   A 1 220 ? 23.06200 13.85300 2.44100   1.000 20.49983  ?  224 ALA   A CB   1 
ATOM   3214 H H    . ALA   A 1 220 ? 24.21700 13.73600 4.65400   1.000 23.38000  ?  224 ALA   A H    1 
ATOM   3215 H HA   . ALA   A 1 220 ? 24.99500 13.20200 2.13900   1.000 24.33000  ?  224 ALA   A HA   1 
ATOM   3216 H HB1  . ALA   A 1 220 ? 22.92000 14.12900 1.52200   1.000 24.65000  ?  224 ALA   A HB1  1 
ATOM   3217 H HB2  . ALA   A 1 220 ? 22.70700 12.96100 2.57700   1.000 24.65000  ?  224 ALA   A HB2  1 
ATOM   3218 H HB3  . ALA   A 1 220 ? 22.62900 14.47700 3.04500   1.000 24.65000  ?  224 ALA   A HB3  1 
ATOM   3219 N N    . VAL   A 1 221 ? 25.69900 15.89900 3.42700   1.000 20.25769  ?  225 VAL   A N    1 
ATOM   3220 C CA   . VAL   A 1 221 ? 26.14300 17.28800 3.29300   1.000 22.03422  ?  225 VAL   A CA   1 
ATOM   3221 C C    . VAL   A 1 221 ? 27.66700 17.31100 3.27300   1.000 22.59481  ?  225 VAL   A C    1 
ATOM   3222 O O    . VAL   A 1 221 ? 28.29300 16.76600 4.18400   1.000 22.83432  ?  225 VAL   A O    1 
ATOM   3223 C CB   . VAL   A 1 221 ? 25.61400 18.15500 4.45000   1.000 22.96854  ?  225 VAL   A CB   1 
ATOM   3224 C CG1  . VAL   A 1 221 ? 26.16800 19.55200 4.36300   1.000 24.11605  ?  225 VAL   A CG1  1 
ATOM   3225 C CG2  . VAL   A 1 221 ? 24.08000 18.19300 4.43500   1.000 22.65535  ?  225 VAL   A CG2  1 
ATOM   3226 H H    . VAL   A 1 221 ? 25.83800 15.57100 4.21000   1.000 24.36000  ?  225 VAL   A H    1 
ATOM   3227 H HA   . VAL   A 1 221 ? 25.82400 17.64700 2.45100   1.000 26.49000  ?  225 VAL   A HA   1 
ATOM   3228 H HB   . VAL   A 1 221 ? 25.90600 17.76300 5.28800   1.000 27.61000  ?  225 VAL   A HB   1 
ATOM   3229 H HG11 . VAL   A 1 221 ? 25.51400 20.17300 4.72000   1.000 28.99000  ?  225 VAL   A HG11 1 
ATOM   3230 H HG12 . VAL   A 1 221 ? 26.98700 19.60000 4.88100   1.000 28.99000  ?  225 VAL   A HG12 1 
ATOM   3231 H HG13 . VAL   A 1 221 ? 26.35100 19.76200 3.43400   1.000 28.99000  ?  225 VAL   A HG13 1 
ATOM   3232 H HG21 . VAL   A 1 221 ? 23.77000 18.71000 5.19400   1.000 27.23000  ?  225 VAL   A HG21 1 
ATOM   3233 H HG22 . VAL   A 1 221 ? 23.78300 18.60700 3.60900   1.000 27.23000  ?  225 VAL   A HG22 1 
ATOM   3234 H HG23 . VAL   A 1 221 ? 23.74100 17.28600 4.49100   1.000 27.23000  ?  225 VAL   A HG23 1 
ATOM   3235 N N    . PRO   A 1 222 ? 28.29900 17.97100 2.30700   1.000 21.95790  ?  226 PRO   A N    1 
ATOM   3236 C CA   . PRO   A 1 222 ? 29.77100 18.02800 2.30600   1.000 22.36321  ?  226 PRO   A CA   1 
ATOM   3237 C C    . PRO   A 1 222 ? 30.33300 18.59100 3.60300   1.000 21.93158  ?  226 PRO   A C    1 
ATOM   3238 O O    . PRO   A 1 222 ? 29.74900 19.48000 4.23300   1.000 21.26308  ?  226 PRO   A O    1 
ATOM   3239 C CB   . PRO   A 1 222 ? 30.08600 18.95400 1.13000   1.000 23.32122  ?  226 PRO   A CB   1 
ATOM   3240 C CG   . PRO   A 1 222 ? 28.93700 18.77600 0.21800   1.000 23.29490  ?  226 PRO   A CG   1 
ATOM   3241 C CD   . PRO   A 1 222 ? 27.71900 18.60500 1.11100   1.000 22.67114  ?  226 PRO   A CD   1 
ATOM   3242 H HA   . PRO   A 1 222 ? 30.13700 17.14300 2.15300   1.000 26.88000  ?  226 PRO   A HA   1 
ATOM   3243 H HB2  . PRO   A 1 222 ? 30.15200 19.87200 1.43600   1.000 28.03000  ?  226 PRO   A HB2  1 
ATOM   3244 H HB3  . PRO   A 1 222 ? 30.91600 18.68500 0.70600   1.000 28.03000  ?  226 PRO   A HB3  1 
ATOM   3245 H HG2  . PRO   A 1 222 ? 28.84200 19.56000 -0.34600  1.000 28.00000  ?  226 PRO   A HG2  1 
ATOM   3246 H HG3  . PRO   A 1 222 ? 29.07400 17.98700 -0.33100  1.000 28.00000  ?  226 PRO   A HG3  1 
ATOM   3247 H HD2  . PRO   A 1 222 ? 27.32100 19.46200 1.32700   1.000 27.25000  ?  226 PRO   A HD2  1 
ATOM   3248 H HD3  . PRO   A 1 222 ? 27.05800 18.02800 0.69500   1.000 27.25000  ?  226 PRO   A HD3  1 
ATOM   3249 N N    . ALA   A 1 223 ? 31.50600 18.06500 3.99000   1.000 22.56323  ?  227 ALA   A N    1 
ATOM   3250 C CA   . ALA   A 1 223 ? 32.10100 18.42100 5.26900   1.000 24.22133  ?  227 ALA   A CA   1 
ATOM   3251 C C    . ALA   A 1 223 ? 32.45400 19.89700 5.37200   1.000 23.47124  ?  227 ALA   A C    1 
ATOM   3252 O O    . ALA   A 1 223 ? 32.52500 20.41700 6.48400   1.000 25.06090  ?  227 ALA   A O    1 
ATOM   3253 C CB   . ALA   A 1 223 ? 33.34400 17.56600 5.52300   1.000 26.51371  ?  227 ALA   A CB   1 
ATOM   3254 H H    . ALA   A 1 223 ? 31.96800 17.50600 3.52800   1.000 27.12000  ?  227 ALA   A H    1 
ATOM   3255 H HA   . ALA   A 1 223 ? 31.45300 18.23200 5.96600   1.000 29.11000  ?  227 ALA   A HA   1 
ATOM   3256 H HB1  . ALA   A 1 223 ? 33.73000 17.81600 6.37700   1.000 31.86000  ?  227 ALA   A HB1  1 
ATOM   3257 H HB2  . ALA   A 1 223 ? 33.08700 16.63100 5.53700   1.000 31.86000  ?  227 ALA   A HB2  1 
ATOM   3258 H HB3  . ALA   A 1 223 ? 33.98500 17.72300 4.81100   1.000 31.86000  ?  227 ALA   A HB3  1 
ATOM   3259 N N    . ASP   A 1 224 ? 32.69100 20.58700 4.26100   1.000 21.34993  ?  228 ASP   A N    1 
ATOM   3260 C CA   . ASP   A 1 224 ? 33.05400 21.99600 4.31900   1.000 20.64984  ?  228 ASP   A CA   1 
ATOM   3261 C C    . ASP   A 1 224 ? 31.84400 22.93200 4.32900   1.000 20.08662  ?  228 ASP   A C    1 
ATOM   3262 O O    . ASP   A 1 224 ? 32.02600 24.15200 4.24200   1.000 22.41058  ?  228 ASP   A O    1 
ATOM   3263 C CB   . ASP   A 1 224 ? 34.02500 22.36300 3.18400   1.000 19.24704  ?  228 ASP   A CB   1 
ATOM   3264 C CG   . ASP   A 1 224 ? 33.36600 22.31300 1.82200   1.000 20.17610  ?  228 ASP   A CG   1 
ATOM   3265 O OD1  . ASP   A 1 224 ? 32.62400 21.34200 1.56900   1.000 19.27600  ?  228 ASP   A OD1  1 
ATOM   3266 O OD2  . ASP   A 1 224 ? 33.56600 23.24200 1.00900   1.000 22.06317  -1 228 ASP   A OD2  1 
ATOM   3267 H H    . ASP   A 1 224 ? 32.64700 20.26200 3.46600   1.000 25.67000  ?  228 ASP   A H    1 
ATOM   3268 H HA   . ASP   A 1 224 ? 33.53300 22.14700 5.14900   1.000 24.83000  ?  228 ASP   A HA   1 
ATOM   3269 H HB2  . ASP   A 1 224 ? 34.35400 23.26400 3.32700   1.000 23.15000  ?  228 ASP   A HB2  1 
ATOM   3270 H HB3  . ASP   A 1 224 ? 34.76400 21.73500 3.18400   1.000 23.15000  ?  228 ASP   A HB3  1 
ATOM   3271 N N    . TRP   A 1 225 ? 30.61700 22.40300 4.41000   1.000 19.50760  ?  229 TRP   A N    1 
ATOM   3272 C CA   . TRP   A 1 225 ? 29.42900 23.22500 4.61000   1.000 19.54708  ?  229 TRP   A CA   1 
ATOM   3273 C C    . TRP   A 1 225 ? 29.00600 23.17500 6.07800   1.000 21.09990  ?  229 TRP   A C    1 
ATOM   3274 O O    . TRP   A 1 225 ? 29.12400 22.14400 6.73900   1.000 24.40293  ?  229 TRP   A O    1 
ATOM   3275 C CB   . TRP   A 1 225 ? 28.24300 22.75800 3.76200   1.000 19.18914  ?  229 TRP   A CB   1 
ATOM   3276 C CG   . TRP   A 1 225 ? 28.47100 22.72300 2.29100   1.000 18.72330  ?  229 TRP   A CG   1 
ATOM   3277 C CD1  . TRP   A 1 225 ? 29.60100 23.07100 1.61000   1.000 18.57591  ?  229 TRP   A CD1  1 
ATOM   3278 C CD2  . TRP   A 1 225 ? 27.52200 22.30600 1.30700   1.000 20.19716  ?  229 TRP   A CD2  1 
ATOM   3279 N NE1  . TRP   A 1 225 ? 29.41500 22.87400 0.26400   1.000 20.54457  ?  229 TRP   A NE1  1 
ATOM   3280 C CE2  . TRP   A 1 225 ? 28.14200 22.40500 0.05600   1.000 21.08937  ?  229 TRP   A CE2  1 
ATOM   3281 C CE3  . TRP   A 1 225 ? 26.19900 21.84800 1.36900   1.000 21.22360  ?  229 TRP   A CE3  1 
ATOM   3282 C CZ2  . TRP   A 1 225 ? 27.49400 22.06100 -1.12000  1.000 21.95790  ?  229 TRP   A CZ2  1 
ATOM   3283 C CZ3  . TRP   A 1 225 ? 25.56700 21.50100 0.20200   1.000 23.02908  ?  229 TRP   A CZ3  1 
ATOM   3284 C CH2  . TRP   A 1 225 ? 26.20600 21.61300 -1.02400  1.000 23.68442  ?  229 TRP   A CH2  1 
ATOM   3285 H H    . TRP   A 1 225 ? 30.45100 21.56100 4.35000   1.000 23.46000  ?  229 TRP   A H    1 
ATOM   3286 H HA   . TRP   A 1 225 ? 29.64700 24.13400 4.35000   1.000 23.51000  ?  229 TRP   A HA   1 
ATOM   3287 H HB2  . TRP   A 1 225 ? 28.00900 21.85800 4.03800   1.000 23.08000  ?  229 TRP   A HB2  1 
ATOM   3288 H HB3  . TRP   A 1 225 ? 27.49800 23.35800 3.92400   1.000 23.08000  ?  229 TRP   A HB3  1 
ATOM   3289 H HD1  . TRP   A 1 225 ? 30.38100 23.39400 1.99900   1.000 22.34000  ?  229 TRP   A HD1  1 
ATOM   3290 H HE1  . TRP   A 1 225 ? 30.00000 23.02100 -0.34800  1.000 24.70000  ?  229 TRP   A HE1  1 
ATOM   3291 H HE3  . TRP   A 1 225 ? 25.75800 21.78100 2.18500   1.000 25.52000  ?  229 TRP   A HE3  1 
ATOM   3292 H HZ2  . TRP   A 1 225 ? 27.91900 22.13300 -1.94300  1.000 26.40000  ?  229 TRP   A HZ2  1 
ATOM   3293 H HZ3  . TRP   A 1 225 ? 24.69400 21.18300 0.23300   1.000 27.68000  ?  229 TRP   A HZ3  1 
ATOM   3294 H HH2  . TRP   A 1 225 ? 25.74800 21.37900 -1.79900  1.000 28.47000  ?  229 TRP   A HH2  1 
ATOM   3295 N N    . ALA   A 1 226 ? 28.47500 24.28300 6.57800   1.000 19.57866  ?  230 ALA   A N    1 
ATOM   3296 C CA   . ALA   A 1 226 ? 27.93500 24.31300 7.93100   1.000 19.48128  ?  230 ALA   A CA   1 
ATOM   3297 C C    . ALA   A 1 226 ? 26.54500 23.68300 7.96200   1.000 18.68382  ?  230 ALA   A C    1 
ATOM   3298 O O    . ALA   A 1 226 ? 25.76900 23.79600 7.00800   1.000 18.20218  ?  230 ALA   A O    1 
ATOM   3299 C CB   . ALA   A 1 226 ? 27.86200 25.75200 8.43000   1.000 20.22874  ?  230 ALA   A CB   1 
ATOM   3300 H H    . ALA   A 1 226 ? 28.41600 25.03000 6.15500   1.000 23.54000  ?  230 ALA   A H    1 
ATOM   3301 H HA   . ALA   A 1 226 ? 28.51000 23.80900 8.52800   1.000 23.43000  ?  230 ALA   A HA   1 
ATOM   3302 H HB1  . ALA   A 1 226 ? 27.50400 25.75600 9.33200   1.000 24.32000  ?  230 ALA   A HB1  1 
ATOM   3303 H HB2  . ALA   A 1 226 ? 28.75400 26.13300 8.42700   1.000 24.32000  ?  230 ALA   A HB2  1 
ATOM   3304 H HB3  . ALA   A 1 226 ? 27.28300 26.26100 7.84200   1.000 24.32000  ?  230 ALA   A HB3  1 
ATOM   3305 N N    A VAL   A 1 227 ? 26.22300 23.03100 9.07200   0.620 17.84161  ?  231 VAL   A N    1 
ATOM   3306 N N    B VAL   A 1 227 ? 26.25400 23.00300 9.07100   0.380 18.09164  ?  231 VAL   A N    1 
ATOM   3307 C CA   A VAL   A 1 227 ? 24.92300 22.37500 9.18900   0.620 18.41010  ?  231 VAL   A CA   1 
ATOM   3308 C CA   B VAL   A 1 227 ? 24.97700 22.32400 9.24500   0.380 18.28903  ?  231 VAL   A CA   1 
ATOM   3309 C C    A VAL   A 1 227 ? 24.53400 22.25600 10.65500  0.620 16.97572  ?  231 VAL   A C    1 
ATOM   3310 C C    B VAL   A 1 227 ? 24.55900 22.43800 10.70300  0.380 17.53368  ?  231 VAL   A C    1 
ATOM   3311 O O    A VAL   A 1 227 ? 25.35700 21.91800 11.51200  0.620 16.93361  ?  231 VAL   A O    1 
ATOM   3312 O O    B VAL   A 1 227 ? 25.39200 22.40900 11.60400  0.380 18.00479  ?  231 VAL   A O    1 
ATOM   3313 C CB   A VAL   A 1 227 ? 24.93800 20.98900 8.51100   0.620 20.12873  ?  231 VAL   A CB   1 
ATOM   3314 C CB   B VAL   A 1 227 ? 25.06500 20.82600 8.85100   0.380 19.12861  ?  231 VAL   A CB   1 
ATOM   3315 C CG1  A VAL   A 1 227 ? 26.16300 20.20600 8.98100   0.620 21.19991  ?  231 VAL   A CG1  1 
ATOM   3316 C CG1  B VAL   A 1 227 ? 23.77300 20.10500 9.24900   0.380 20.51035  ?  231 VAL   A CG1  1 
ATOM   3317 C CG2  A VAL   A 1 227 ? 23.62900 20.23700 8.80400   0.620 20.49983  ?  231 VAL   A CG2  1 
ATOM   3318 C CG2  B VAL   A 1 227 ? 25.33500 20.67400 7.38400   0.380 18.77067  ?  231 VAL   A CG2  1 
ATOM   3319 H H    A VAL   A 1 227 ? 26.73100 22.95500 9.76200   0.620 21.46000  ?  231 VAL   A H    1 
ATOM   3320 H H    B VAL   A 1 227 ? 26.78700 22.92100 9.74100   0.380 21.76000  ?  231 VAL   A H    1 
ATOM   3321 H HA   A VAL   A 1 227 ? 24.26000 22.93700 8.75800   0.620 22.14000  ?  231 VAL   A HA   1 
ATOM   3322 H HA   B VAL   A 1 227 ? 24.31800 22.76600 8.68700   0.380 22.00000  ?  231 VAL   A HA   1 
ATOM   3323 H HB   A VAL   A 1 227 ? 24.99800 21.08800 7.54800   0.620 24.20000  ?  231 VAL   A HB   1 
ATOM   3324 H HB   B VAL   A 1 227 ? 25.80500 20.41600 9.32600   0.380 23.00000  ?  231 VAL   A HB   1 
ATOM   3325 H HG11 A VAL   A 1 227 ? 26.12500 19.31000 8.61300   0.620 25.49000  ?  231 VAL   A HG11 1 
ATOM   3326 H HG11 B VAL   A 1 227 ? 23.70800 19.27600 8.75000   0.380 24.66000  ?  231 VAL   A HG11 1 
ATOM   3327 H HG12 A VAL   A 1 227 ? 26.96400 20.65800 8.67200   0.620 25.49000  ?  231 VAL   A HG12 1 
ATOM   3328 H HG12 B VAL   A 1 227 ? 23.79700 19.91700 10.20100  0.380 24.66000  ?  231 VAL   A HG12 1 
ATOM   3329 H HG13 A VAL   A 1 227 ? 26.15900 20.16600 9.95100   0.620 25.49000  ?  231 VAL   A HG13 1 
ATOM   3330 H HG13 B VAL   A 1 227 ? 23.01600 20.67500 9.04400   0.380 24.66000  ?  231 VAL   A HG13 1 
ATOM   3331 H HG21 A VAL   A 1 227 ? 23.58500 19.44900 8.24100   0.620 24.65000  ?  231 VAL   A HG21 1 
ATOM   3332 H HG21 B VAL   A 1 227 ? 25.30500 19.73200 7.15400   0.380 22.58000  ?  231 VAL   A HG21 1 
ATOM   3333 H HG22 A VAL   A 1 227 ? 23.61600 19.97800 9.73800   0.620 24.65000  ?  231 VAL   A HG22 1 
ATOM   3334 H HG22 B VAL   A 1 227 ? 24.65700 21.15700 6.88700   0.380 22.58000  ?  231 VAL   A HG22 1 
ATOM   3335 H HG23 A VAL   A 1 227 ? 22.87900 20.82300 8.61200   0.620 24.65000  ?  231 VAL   A HG23 1 
ATOM   3336 H HG23 B VAL   A 1 227 ? 26.21200 21.03500 7.18500   0.380 22.58000  ?  231 VAL   A HG23 1 
ATOM   3337 N N    . GLY   A 1 228 ? 23.26200 22.53200 10.92100  1.000 16.50987  ?  232 GLY   A N    1 
ATOM   3338 C CA   . GLY   A 1 228 ? 22.69900 22.27400 12.23700  1.000 17.23628  ?  232 GLY   A CA   1 
ATOM   3339 C C    . GLY   A 1 228 ? 21.45800 21.42600 12.06600  1.000 16.81254  ?  232 GLY   A C    1 
ATOM   3340 O O    . GLY   A 1 228 ? 20.75700 21.52200 11.06300  1.000 17.94162  ?  232 GLY   A O    1 
ATOM   3341 H H    A GLY   A 1 228 ? 22.70700 22.86800 10.35600  0.620 19.86000  ?  232 GLY   A H    1 
ATOM   3342 H H    B GLY   A 1 228 ? 22.68200 22.74400 10.32200  0.380 19.86000  ?  232 GLY   A H    1 
ATOM   3343 H HA2  . GLY   A 1 228 ? 23.34000 21.80000 12.79000  1.000 20.73000  ?  232 GLY   A HA2  1 
ATOM   3344 H HA3  . GLY   A 1 228 ? 22.46300 23.10800 12.67200  1.000 20.73000  ?  232 GLY   A HA3  1 
ATOM   3345 N N    . ASP   A 1 229 ? 21.26900 20.51200 13.01600  1.000 15.89664  ?  233 ASP   A N    1 
ATOM   3346 C CA   . ASP   A 1 229 ? 20.16100 19.57900 12.87300  1.000 15.08602  ?  233 ASP   A CA   1 
ATOM   3347 C C    . ASP   A 1 229 ? 19.61500 19.10500 14.20700  1.000 15.06760  ?  233 ASP   A C    1 
ATOM   3348 O O    . ASP   A 1 229 ? 20.25100 19.24600 15.24800  1.000 15.83348  ?  233 ASP   A O    1 
ATOM   3349 C CB   . ASP   A 1 229 ? 20.54800 18.34300 12.03600  1.000 15.62029  ?  233 ASP   A CB   1 
ATOM   3350 C CG   . ASP   A 1 229 ? 21.22600 17.24600 12.86000  1.000 15.92033  ?  233 ASP   A CG   1 
ATOM   3351 O OD1  . ASP   A 1 229 ? 22.35200 17.48600 13.37000  1.000 16.11246  ?  233 ASP   A OD1  1 
ATOM   3352 O OD2  . ASP   A 1 229 ? 20.64400 16.14600 13.03700  1.000 15.98350  -1 233 ASP   A OD2  1 
ATOM   3353 H H    . ASP   A 1 229 ? 21.75000 20.41800 13.72300  1.000 19.12000  ?  233 ASP   A H    1 
ATOM   3354 H HA   . ASP   A 1 229 ? 19.45400 20.07900 12.43600  1.000 18.15000  ?  233 ASP   A HA   1 
ATOM   3355 H HB2  . ASP   A 1 229 ? 19.74500 17.96700 11.64200  1.000 18.79000  ?  233 ASP   A HB2  1 
ATOM   3356 H HB3  . ASP   A 1 229 ? 21.16400 18.61600 11.33900  1.000 18.79000  ?  233 ASP   A HB3  1 
ATOM   3357 N N    . LYS   A 1 230 ? 18.41200 18.51500 14.14900  1.000 15.16761  ?  234 LYS   A N    1 
ATOM   3358 C CA   . LYS   A 1 230 ? 17.87300 17.76700 15.27900  1.000 15.46501  ?  234 LYS   A CA   1 
ATOM   3359 C C    . LYS   A 1 230 ? 17.22700 16.48700 14.77400  1.000 14.45963  ?  234 LYS   A C    1 
ATOM   3360 O O    . LYS   A 1 230 ? 16.38000 16.53400 13.87100  1.000 14.33593  ?  234 LYS   A O    1 
ATOM   3361 C CB   . LYS   A 1 230 ? 16.82200 18.56200 16.06400  1.000 15.66504  ?  234 LYS   A CB   1 
ATOM   3362 C CG   . LYS   A 1 230 ? 16.23700 17.77100 17.22700  1.000 15.50712  ?  234 LYS   A CG   1 
ATOM   3363 C CD   . LYS   A 1 230 ? 17.19100 17.73500 18.45100  1.000 16.96782  ?  234 LYS   A CD   1 
ATOM   3364 C CE   . LYS   A 1 230 ? 16.79900 16.67600 19.44500  1.000 16.27564  ?  234 LYS   A CE   1 
ATOM   3365 N NZ   . LYS   A 1 230 ? 17.22300 15.30500 19.05000  1.000 16.45460  ?  234 LYS   A NZ   1 
ATOM   3366 H H    . LYS   A 1 230 ? 17.89400 18.53800 13.46300  1.000 18.25000  ?  234 LYS   A H    1 
ATOM   3367 H HA   . LYS   A 1 230 ? 18.61000 17.55300 15.87200  1.000 18.61000  ?  234 LYS   A HA   1 
ATOM   3368 H HB2  . LYS   A 1 230 ? 17.23500 19.36300 16.42300  1.000 18.85000  ?  234 LYS   A HB2  1 
ATOM   3369 H HB3  . LYS   A 1 230 ? 16.09600 18.80200 15.46700  1.000 18.85000  ?  234 LYS   A HB3  1 
ATOM   3370 H HG2  . LYS   A 1 230 ? 15.40400 18.18300 17.50500  1.000 18.66000  ?  234 LYS   A HG2  1 
ATOM   3371 H HG3  . LYS   A 1 230 ? 16.07700 16.85800 16.94200  1.000 18.66000  ?  234 LYS   A HG3  1 
ATOM   3372 H HD2  . LYS   A 1 230 ? 18.09300 17.54500 18.14700  1.000 20.41000  ?  234 LYS   A HD2  1 
ATOM   3373 H HD3  . LYS   A 1 230 ? 17.16600 18.59500 18.89900  1.000 20.41000  ?  234 LYS   A HD3  1 
ATOM   3374 H HE2  . LYS   A 1 230 ? 17.21300 16.88000 20.29900  1.000 19.58000  ?  234 LYS   A HE2  1 
ATOM   3375 H HE3  . LYS   A 1 230 ? 15.83400 16.67300 19.53600  1.000 19.58000  ?  234 LYS   A HE3  1 
ATOM   3376 H HZ1  . LYS   A 1 230 ? 18.11100 15.25900 19.01400  1.000 19.80000  ?  234 LYS   A HZ1  1 
ATOM   3377 H HZ2  . LYS   A 1 230 ? 16.92700 14.71200 19.64400  1.000 19.80000  ?  234 LYS   A HZ2  1 
ATOM   3378 H HZ3  . LYS   A 1 230 ? 16.89100 15.10200 18.25000  1.000 19.80000  ?  234 LYS   A HZ3  1 
ATOM   3379 N N    . THR   A 1 231 ? 17.56400 15.37000 15.40800  1.000 14.92021  ?  235 THR   A N    1 
ATOM   3380 C CA   . THR   A 1 231 ? 17.06500 14.04600 15.07200  1.000 14.29382  ?  235 THR   A CA   1 
ATOM   3381 C C    . THR   A 1 231 ? 15.91300 13.60700 15.97800  1.000 14.53595  ?  235 THR   A C    1 
ATOM   3382 O O    . THR   A 1 231 ? 15.65400 14.17400 17.04200  1.000 14.79388  ?  235 THR   A O    1 
ATOM   3383 C CB   . THR   A 1 231 ? 18.19400 13.02100 15.21400  1.000 16.39407  ?  235 THR   A CB   1 
ATOM   3384 O OG1  . THR   A 1 231 ? 18.68000 13.02500 16.57300  1.000 17.08100  ?  235 THR   A OG1  1 
ATOM   3385 C CG2  . THR   A 1 231 ? 19.33200 13.34000 14.28300  1.000 16.93361  ?  235 THR   A CG2  1 
ATOM   3386 H H    . THR   A 1 231 ? 18.11100 15.35400 16.07200  1.000 17.95000  ?  235 THR   A H    1 
ATOM   3387 H HA   . THR   A 1 231 ? 16.73500 14.08100 14.16000  1.000 17.21000  ?  235 THR   A HA   1 
ATOM   3388 H HB   . THR   A 1 231 ? 17.85500 12.14100 14.98800  1.000 19.72000  ?  235 THR   A HB   1 
ATOM   3389 H HG1  . THR   A 1 231 ? 18.13900 12.62100 17.07300  1.000 20.55000  ?  235 THR   A HG1  1 
ATOM   3390 H HG21 . THR   A 1 231 ? 20.00400 12.64100 14.32900  1.000 20.37000  ?  235 THR   A HG21 1 
ATOM   3391 H HG22 . THR   A 1 231 ? 19.00700 13.40600 13.37200  1.000 20.37000  ?  235 THR   A HG22 1 
ATOM   3392 H HG23 . THR   A 1 231 ? 19.73900 14.18400 14.53400  1.000 20.37000  ?  235 THR   A HG23 1 
ATOM   3393 N N    . GLY   A 1 232 ? 15.24200 12.55200 15.53800  1.000 14.48858  ?  236 GLY   A N    1 
ATOM   3394 C CA   . GLY   A 1 232 ? 14.24500 11.85600 16.32800  1.000 15.33605  ?  236 GLY   A CA   1 
ATOM   3395 C C    . GLY   A 1 232 ? 14.21400 10.38200 15.99500  1.000 13.70164  ?  236 GLY   A C    1 
ATOM   3396 O O    . GLY   A 1 232 ? 14.38600 10.00700 14.83400  1.000 14.37541  ?  236 GLY   A O    1 
ATOM   3397 H H    . GLY   A 1 232 ? 15.35000 12.20900 14.75700  1.000 17.44000  ?  236 GLY   A H    1 
ATOM   3398 H HA2  . GLY   A 1 232 ? 14.44900 11.95700 17.27100  1.000 18.45000  ?  236 GLY   A HA2  1 
ATOM   3399 H HA3  . GLY   A 1 232 ? 13.36900 12.23300 16.15300  1.000 18.45000  ?  236 GLY   A HA3  1 
ATOM   3400 N N    . THR   A 1 233 ? 13.99000 9.52600  17.00500  1.000 14.20960  ?  237 THR   A N    1 
ATOM   3401 C CA   . THR   A 1 233 ? 14.00800 8.07100  16.81400  1.000 14.39909  ?  237 THR   A CA   1 
ATOM   3402 C C    . THR   A 1 233 ? 12.99600 7.46900  17.79200  1.000 15.24656  ?  237 THR   A C    1 
ATOM   3403 O O    . THR   A 1 233 ? 13.34100 7.16500  18.92800  1.000 15.90191  ?  237 THR   A O    1 
ATOM   3404 C CB   . THR   A 1 233 ? 15.40000 7.48700  17.05600  1.000 15.85190  ?  237 THR   A CB   1 
ATOM   3405 O OG1  . THR   A 1 233 ? 16.38600 8.24900  16.34900  1.000 16.29143  ?  237 THR   A OG1  1 
ATOM   3406 C CG2  . THR   A 1 233 ? 15.45200 6.06000  16.58400  1.000 17.33366  ?  237 THR   A CG2  1 
ATOM   3407 H H    . THR   A 1 233 ? 13.82500 9.76700  17.81400  1.000 17.10000  ?  237 THR   A H    1 
ATOM   3408 H HA   . THR   A 1 233 ? 13.73500 7.87200  15.90500  1.000 17.33000  ?  237 THR   A HA   1 
ATOM   3409 H HB   . THR   A 1 233 ? 15.59700 7.51500  18.00500  1.000 19.07000  ?  237 THR   A HB   1 
ATOM   3410 H HG1  . THR   A 1 233 ? 16.44700 9.01800  16.68100  1.000 19.60000  ?  237 THR   A HG1  1 
ATOM   3411 H HG21 . THR   A 1 233 ? 16.34600 5.70300  16.70600  1.000 20.85000  ?  237 THR   A HG21 1 
ATOM   3412 H HG22 . THR   A 1 233 ? 14.82600 5.52000  17.09000  1.000 20.85000  ?  237 THR   A HG22 1 
ATOM   3413 H HG23 . THR   A 1 233 ? 15.22100 6.01300  15.64300  1.000 20.85000  ?  237 THR   A HG23 1 
ATOM   3414 N N    . CYS   A 1 234 ? 11.76200 7.24400  17.32200  1.000 15.46764  ?  238 CYS   A N    1 
ATOM   3415 C CA   . CYS   A 1 234 ? 10.71200 6.81700  18.24800  1.000 15.89927  ?  238 CYS   A CA   1 
ATOM   3416 C C    . CYS   A 1 234 ? 10.96700 5.42600  18.80500  1.000 17.00730  ?  238 CYS   A C    1 
ATOM   3417 O O    . CYS   A 1 234 ? 10.56400 5.13200  19.93800  1.000 19.92871  ?  238 CYS   A O    1 
ATOM   3418 C CB   . CYS   A 1 234 ? 9.31600  6.85100  17.59500  1.000 15.86243  ?  238 CYS   A CB   1 
ATOM   3419 S SG   . CYS   A 1 234 ? 8.48900  8.45000  17.66900  1.000 15.18603  ?  238 CYS   A SG   1 
ATOM   3420 H H    . CYS   A 1 234 ? 11.51700 7.32800  16.50200  1.000 18.61000  ?  238 CYS   A H    1 
ATOM   3421 H HA   . CYS   A 1 234 ? 10.71100 7.45600  18.97700  1.000 19.13000  ?  238 CYS   A HA   1 
ATOM   3422 H HB2  . CYS   A 1 234 ? 9.40700  6.61300  16.65900  1.000 19.09000  ?  238 CYS   A HB2  1 
ATOM   3423 H HB3  . CYS   A 1 234 ? 8.74800  6.20700  18.04700  1.000 19.09000  ?  238 CYS   A HB3  1 
ATOM   3424 N N    . GLY   A 1 235 ? 11.61300 4.54900  18.02800  1.000 18.33115  ?  239 GLY   A N    1 
ATOM   3425 C CA   . GLY   A 1 235 ? 11.93900 3.21500  18.49500  1.000 19.05492  ?  239 GLY   A CA   1 
ATOM   3426 C C    . GLY   A 1 235 ? 10.93400 2.15900  18.11600  1.000 19.26810  ?  239 GLY   A C    1 
ATOM   3427 O O    . GLY   A 1 235 ? 11.12700 0.98600  18.45200  1.000 20.14189  ?  239 GLY   A O    1 
ATOM   3428 H H    . GLY   A 1 235 ? 11.87100 4.71100  17.22300  1.000 22.05000  ?  239 GLY   A H    1 
ATOM   3429 H HA2  . GLY   A 1 235 ? 12.79800 2.95600  18.12600  1.000 22.92000  ?  239 GLY   A HA2  1 
ATOM   3430 H HA3  . GLY   A 1 235 ? 12.00400 3.23100  19.46300  1.000 22.92000  ?  239 GLY   A HA3  1 
ATOM   3431 N N    . VAL   A 1 236 ? 9.86300  2.54200  17.42100  1.000 16.81517  ?  240 VAL   A N    1 
ATOM   3432 C CA   . VAL   A 1 236 ? 8.82800  1.62600  16.96600  1.000 16.88624  ?  240 VAL   A CA   1 
ATOM   3433 C C    . VAL   A 1 236 ? 8.33600  2.12400  15.61800  1.000 15.79137  ?  240 VAL   A C    1 
ATOM   3434 O O    . VAL   A 1 236 ? 8.53700  3.28100  15.25400  1.000 15.99929  ?  240 VAL   A O    1 
ATOM   3435 C CB   . VAL   A 1 236 ? 7.64600  1.57100  17.96100  1.000 17.87320  ?  240 VAL   A CB   1 
ATOM   3436 C CG1  . VAL   A 1 236 ? 8.01900  0.74700  19.18800  1.000 19.03123  ?  240 VAL   A CG1  1 
ATOM   3437 C CG2  . VAL   A 1 236 ? 7.20700  2.99200  18.35600  1.000 18.61802  ?  240 VAL   A CG2  1 
ATOM   3438 H H    . VAL   A 1 236 ? 9.71200  3.35800  17.19500  1.000 20.23000  ?  240 VAL   A H    1 
ATOM   3439 H HA   . VAL   A 1 236 ? 9.19700  0.73500  16.86500  1.000 20.31000  ?  240 VAL   A HA   1 
ATOM   3440 H HB   . VAL   A 1 236 ? 6.89100  1.13800  17.53300  1.000 21.50000  ?  240 VAL   A HB   1 
ATOM   3441 H HG11 . VAL   A 1 236 ? 7.27900  0.76100  19.81500  1.000 22.89000  ?  240 VAL   A HG11 1 
ATOM   3442 H HG12 . VAL   A 1 236 ? 8.20200  -0.16500 18.91300  1.000 22.89000  ?  240 VAL   A HG12 1 
ATOM   3443 H HG13 . VAL   A 1 236 ? 8.80900  1.13300  19.60000  1.000 22.89000  ?  240 VAL   A HG13 1 
ATOM   3444 H HG21 . VAL   A 1 236 ? 6.41700  2.93400  18.91600  1.000 22.39000  ?  240 VAL   A HG21 1 
ATOM   3445 H HG22 . VAL   A 1 236 ? 7.92800  3.42100  18.84400  1.000 22.39000  ?  240 VAL   A HG22 1 
ATOM   3446 H HG23 . VAL   A 1 236 ? 7.00700  3.49600  17.55200  1.000 22.39000  ?  240 VAL   A HG23 1 
ATOM   3447 N N    . TYR   A 1 237 ? 7.67000  1.23600  14.88100  1.000 15.58345  ?  241 TYR   A N    1 
ATOM   3448 C CA   . TYR   A 1 237 ? 6.98900  1.61200  13.63400  1.000 15.29920  ?  241 TYR   A CA   1 
ATOM   3449 C C    . TYR   A 1 237 ? 7.93500  2.27600  12.64000  1.000 15.78347  ?  241 TYR   A C    1 
ATOM   3450 O O    . TYR   A 1 237 ? 7.56500  3.19400  11.91700  1.000 15.80189  ?  241 TYR   A O    1 
ATOM   3451 C CB   . TYR   A 1 237 ? 5.75000  2.49400  13.89300  1.000 14.97022  ?  241 TYR   A CB   1 
ATOM   3452 C CG   . TYR   A 1 237 ? 4.62500  1.73200  14.57400  1.000 14.81230  ?  241 TYR   A CG   1 
ATOM   3453 C CD1  . TYR   A 1 237 ? 3.83500  0.86000  13.84800  1.000 14.42015  ?  241 TYR   A CD1  1 
ATOM   3454 C CD2  . TYR   A 1 237 ? 4.37300  1.87000  15.92800  1.000 15.41764  ?  241 TYR   A CD2  1 
ATOM   3455 C CE1  . TYR   A 1 237 ? 2.83200  0.12700  14.44200  1.000 14.99127  ?  241 TYR   A CE1  1 
ATOM   3456 C CE2  . TYR   A 1 237 ? 3.34700  1.13100  16.54700  1.000 15.74399  ?  241 TYR   A CE2  1 
ATOM   3457 C CZ   . TYR   A 1 237 ? 2.59000  0.27600  15.78500  1.000 16.58883  ?  241 TYR   A CZ   1 
ATOM   3458 O OH   . TYR   A 1 237 ? 1.58700  -0.46200 16.37000  1.000 18.23377  ?  241 TYR   A OH   1 
ATOM   3459 H H    . TYR   A 1 237 ? 7.59500  0.40300  15.08000  1.000 18.75000  ?  241 TYR   A H    1 
ATOM   3460 H HA   . TYR   A 1 237 ? 6.68000  0.78900  13.22400  1.000 18.41000  ?  241 TYR   A HA   1 
ATOM   3461 H HB2  . TYR   A 1 237 ? 6.00200  3.23400  14.46600  1.000 18.01000  ?  241 TYR   A HB2  1 
ATOM   3462 H HB3  . TYR   A 1 237 ? 5.41700  2.82900  13.04500  1.000 18.01000  ?  241 TYR   A HB3  1 
ATOM   3463 H HD1  . TYR   A 1 237 ? 3.98400  0.76600  12.93400  1.000 17.35000  ?  241 TYR   A HD1  1 
ATOM   3464 H HD2  . TYR   A 1 237 ? 4.88600  2.45700  16.43500  1.000 18.55000  ?  241 TYR   A HD2  1 
ATOM   3465 H HE1  . TYR   A 1 237 ? 2.32200  -0.46400 13.93700  1.000 18.04000  ?  241 TYR   A HE1  1 
ATOM   3466 H HE2  . TYR   A 1 237 ? 3.18400  1.22100  17.45800  1.000 18.94000  ?  241 TYR   A HE2  1 
ATOM   3467 H HH   . TYR   A 1 237 ? 1.60300  -0.35900 17.20300  1.000 21.93000  ?  241 TYR   A HH   1 
ATOM   3468 N N    . GLY   A 1 238 ? 9.17800  1.81000  12.61900  1.000 16.12562  ?  242 GLY   A N    1 
ATOM   3469 C CA   . GLY   A 1 238 ? 10.16000 2.32100  11.68100  1.000 17.58895  ?  242 GLY   A CA   1 
ATOM   3470 C C    . GLY   A 1 238 ? 10.23700 3.83600  11.65200  1.000 15.79137  ?  242 GLY   A C    1 
ATOM   3471 O O    . GLY   A 1 238 ? 10.53500 4.42800  10.59900  1.000 17.31787  ?  242 GLY   A O    1 
ATOM   3472 H H    . GLY   A 1 238 ? 9.47500  1.19500  13.14100  1.000 19.40000  ?  242 GLY   A H    1 
ATOM   3473 H HA2  . GLY   A 1 238 ? 11.03600 1.98000  11.92200  1.000 21.16000  ?  242 GLY   A HA2  1 
ATOM   3474 H HA3  . GLY   A 1 238 ? 9.93600  2.01400  10.78900  1.000 21.16000  ?  242 GLY   A HA3  1 
ATOM   3475 N N    . THR   A 1 239 ? 9.99000  4.49200  12.79900  1.000 14.57806  ?  243 THR   A N    1 
ATOM   3476 C CA   . THR   A 1 239 ? 9.72800  5.93000  12.82900  1.000 14.94127  ?  243 THR   A CA   1 
ATOM   3477 C C    . THR   A 1 239 ? 10.96500 6.67000  13.32900  1.000 14.89126  ?  243 THR   A C    1 
ATOM   3478 O O    . THR   A 1 239 ? 11.33600 6.56500  14.50200  1.000 15.59924  ?  243 THR   A O    1 
ATOM   3479 C CB   . THR   A 1 239 ? 8.49700  6.23100  13.68800  1.000 14.61228  ?  243 THR   A CB   1 
ATOM   3480 O OG1  . THR   A 1 239 ? 7.32500  5.66300  13.08000  1.000 14.75177  ?  243 THR   A OG1  1 
ATOM   3481 C CG2  . THR   A 1 239 ? 8.27400  7.69200  13.83400  1.000 15.25972  ?  243 THR   A CG2  1 
ATOM   3482 H H    . THR   A 1 239 ? 9.97100  4.11700  13.57300  1.000 17.55000  ?  243 THR   A H    1 
ATOM   3483 H HA   . THR   A 1 239 ? 9.55900  6.24000  11.92500  1.000 17.98000  ?  243 THR   A HA   1 
ATOM   3484 H HB   . THR   A 1 239 ? 8.64500  5.85000  14.56800  1.000 17.59000  ?  243 THR   A HB   1 
ATOM   3485 H HG1  . THR   A 1 239 ? 7.37000  4.82500  13.09600  1.000 17.75000  ?  243 THR   A HG1  1 
ATOM   3486 H HG21 . THR   A 1 239 ? 7.44500  7.85500  14.31000  1.000 18.36000  ?  243 THR   A HG21 1 
ATOM   3487 H HG22 . THR   A 1 239 ? 9.00500  8.09200  14.33100  1.000 18.36000  ?  243 THR   A HG22 1 
ATOM   3488 H HG23 . THR   A 1 239 ? 8.22200  8.10900  12.96000  1.000 18.36000  ?  243 THR   A HG23 1 
ATOM   3489 N N    . ALA   A 1 240 ? 11.54100 7.48400  12.45200  1.000 14.52543  ?  244 ALA   A N    1 
ATOM   3490 C CA   . ALA   A 1 240 ? 12.73000 8.26000  12.76900  1.000 14.73335  ?  244 ALA   A CA   1 
ATOM   3491 C C    . ALA   A 1 240 ? 12.80900 9.42800  11.80200  1.000 14.64123  ?  244 ALA   A C    1 
ATOM   3492 O O    . ALA   A 1 240 ? 12.16600 9.42800  10.73900  1.000 14.41752  ?  244 ALA   A O    1 
ATOM   3493 C CB   . ALA   A 1 240 ? 14.01000 7.41600  12.73700  1.000 15.39658  ?  244 ALA   A CB   1 
ATOM   3494 H H    . ALA   A 1 240 ? 11.25500 7.60700  11.65000  1.000 17.48000  ?  244 ALA   A H    1 
ATOM   3495 H HA   . ALA   A 1 240 ? 12.65100 8.61200  13.66900  1.000 17.73000  ?  244 ALA   A HA   1 
ATOM   3496 H HB1  . ALA   A 1 240 ? 14.76800 7.98400  12.94700  1.000 18.52000  ?  244 ALA   A HB1  1 
ATOM   3497 H HB2  . ALA   A 1 240 ? 13.93600 6.70600  13.39500  1.000 18.52000  ?  244 ALA   A HB2  1 
ATOM   3498 H HB3  . ALA   A 1 240 ? 14.11600 7.03600  11.85100  1.000 18.52000  ?  244 ALA   A HB3  1 
ATOM   3499 N N    . ASN   A 1 241 ? 13.62800 10.42200 12.15400  1.000 14.25960  ?  245 ASN   A N    1 
ATOM   3500 C CA   . ASN   A 1 241 ? 13.59200 11.65400 11.38300  1.000 13.86745  ?  245 ASN   A CA   1 
ATOM   3501 C C    . ASN   A 1 241 ? 14.82200 12.50600 11.66400  1.000 14.82809  ?  245 ASN   A C    1 
ATOM   3502 O O    . ASN   A 1 241 ? 15.63900 12.20800 12.54300  1.000 14.80967  ?  245 ASN   A O    1 
ATOM   3503 C CB   . ASN   A 1 241 ? 12.29700 12.41600 11.68000  1.000 13.74375  ?  245 ASN   A CB   1 
ATOM   3504 C CG   . ASN   A 1 241 ? 12.10700 12.64000 13.17400  1.000 14.05695  ?  245 ASN   A CG   1 
ATOM   3505 O OD1  . ASN   A 1 241 ? 12.90000 13.31300 13.81900  1.000 15.05444  ?  245 ASN   A OD1  1 
ATOM   3506 N ND2  . ASN   A 1 241 ? 11.06600 12.06100 13.73800  1.000 14.39120  ?  245 ASN   A ND2  1 
ATOM   3507 H H    . ASN   A 1 241 ? 14.18700 10.40300 12.80700  1.000 17.16000  ?  245 ASN   A H    1 
ATOM   3508 H HA   . ASN   A 1 241 ? 13.63500 11.43500 10.43900  1.000 16.69000  ?  245 ASN   A HA   1 
ATOM   3509 H HB2  . ASN   A 1 241 ? 12.32700 13.28100 11.24400  1.000 16.54000  ?  245 ASN   A HB2  1 
ATOM   3510 H HB3  . ASN   A 1 241 ? 11.54200 11.90400 11.35100  1.000 16.54000  ?  245 ASN   A HB3  1 
ATOM   3511 H HD21 . ASN   A 1 241 ? 10.92200 12.16200 14.58000  1.000 17.32000  ?  245 ASN   A HD21 1 
ATOM   3512 H HD22 . ASN   A 1 241 ? 10.53200 11.58200 13.26400  1.000 17.32000  ?  245 ASN   A HD22 1 
ATOM   3513 N N    . ASP   A 1 242 ? 14.90700 13.59700 10.91500  1.000 15.16234  ?  246 ASP   A N    1 
ATOM   3514 C CA   . ASP   A 1 242 ? 15.95600 14.60200 11.06100  1.000 14.33330  ?  246 ASP   A CA   1 
ATOM   3515 C C    . ASP   A 1 242 ? 15.47900 15.84600 10.31900  1.000 14.90179  ?  246 ASP   A C    1 
ATOM   3516 O O    . ASP   A 1 242 ? 14.86100 15.73700 9.25600   1.000 15.27025  ?  246 ASP   A O    1 
ATOM   3517 C CB   . ASP   A 1 242 ? 17.28400 14.08400 10.46400  1.000 14.67281  ?  246 ASP   A CB   1 
ATOM   3518 C CG   . ASP   A 1 242 ? 18.52100 14.86100 10.90700  1.000 14.73335  ?  246 ASP   A CG   1 
ATOM   3519 O OD1  . ASP   A 1 242 ? 18.47300 15.57600 11.93100  1.000 14.95706  ?  246 ASP   A OD1  1 
ATOM   3520 O OD2  . ASP   A 1 242 ? 19.56400 14.73500 10.20500  1.000 15.36237  -1 246 ASP   A OD2  1 
ATOM   3521 H H    . ASP   A 1 242 ? 14.34900 13.78700 10.28900  1.000 18.25000  ?  246 ASP   A H    1 
ATOM   3522 H HA   . ASP   A 1 242 ? 16.11100 14.82600 11.99200  1.000 17.25000  ?  246 ASP   A HA   1 
ATOM   3523 H HB2  . ASP   A 1 242 ? 17.40600 13.16000 10.73400  1.000 17.66000  ?  246 ASP   A HB2  1 
ATOM   3524 H HB3  . ASP   A 1 242 ? 17.23300 14.14200 9.49700   1.000 17.66000  ?  246 ASP   A HB3  1 
ATOM   3525 N N    . TYR   A 1 243 ? 15.77900 17.01800 10.86600  1.000 14.71229  ?  247 TYR   A N    1 
ATOM   3526 C CA   . TYR   A 1 243 ? 15.61700 18.26400 10.13600  1.000 14.82283  ?  247 TYR   A CA   1 
ATOM   3527 C C    . TYR   A 1 243 ? 16.88100 19.08700 10.31000  1.000 14.71755  ?  247 TYR   A C    1 
ATOM   3528 O O    . TYR   A 1 243 ? 17.60600 18.93700 11.30400  1.000 14.99917  ?  247 TYR   A O    1 
ATOM   3529 C CB   . TYR   A 1 243 ? 14.36300 19.05000 10.54700  1.000 15.37553  ?  247 TYR   A CB   1 
ATOM   3530 C CG   . TYR   A 1 243 ? 14.21500 19.39700 12.01400  1.000 14.51490  ?  247 TYR   A CG   1 
ATOM   3531 C CD1  . TYR   A 1 243 ? 15.00600 20.36700 12.62100  1.000 14.67018  ?  247 TYR   A CD1  1 
ATOM   3532 C CD2  . TYR   A 1 243 ? 13.23000 18.80400 12.77700  1.000 15.17024  ?  247 TYR   A CD2  1 
ATOM   3533 C CE1  . TYR   A 1 243 ? 14.83000 20.72200 13.93900  1.000 15.60977  ?  247 TYR   A CE1  1 
ATOM   3534 C CE2  . TYR   A 1 243 ? 13.06200 19.14300 14.09100  1.000 14.57280  ?  247 TYR   A CE2  1 
ATOM   3535 C CZ   . TYR   A 1 243 ? 13.83700 20.10600 14.66400  1.000 15.00969  ?  247 TYR   A CZ   1 
ATOM   3536 O OH   . TYR   A 1 243 ? 13.66500 20.45100 15.97300  1.000 15.61766  ?  247 TYR   A OH   1 
ATOM   3537 H H    . TYR   A 1 243 ? 16.08000 17.11600 11.66500  1.000 17.70000  ?  247 TYR   A H    1 
ATOM   3538 H HA   . TYR   A 1 243 ? 15.50000 18.08100 9.19100   1.000 17.84000  ?  247 TYR   A HA   1 
ATOM   3539 H HB2  . TYR   A 1 243 ? 14.36100 19.88800 10.05800  1.000 18.50000  ?  247 TYR   A HB2  1 
ATOM   3540 H HB3  . TYR   A 1 243 ? 13.58600 18.52200 10.30300  1.000 18.50000  ?  247 TYR   A HB3  1 
ATOM   3541 H HD1  . TYR   A 1 243 ? 15.67000 20.78700 12.12300  1.000 17.65000  ?  247 TYR   A HD1  1 
ATOM   3542 H HD2  . TYR   A 1 243 ? 12.67400 18.16500 12.39300  1.000 18.25000  ?  247 TYR   A HD2  1 
ATOM   3543 H HE1  . TYR   A 1 243 ? 15.37200 21.36700 14.33300  1.000 18.78000  ?  247 TYR   A HE1  1 
ATOM   3544 H HE2  . TYR   A 1 243 ? 12.41200 18.71300 14.59900  1.000 17.54000  ?  247 TYR   A HE2  1 
ATOM   3545 H HH   . TYR   A 1 243 ? 13.11600 19.93000 16.33800  1.000 18.79000  ?  247 TYR   A HH   1 
ATOM   3546 N N    . ALA   A 1 244 ? 17.15000 19.93700 9.32900   1.000 15.03601  ?  248 ALA   A N    1 
ATOM   3547 C CA   . ALA   A 1 244 ? 18.42400 20.63800 9.30500   1.000 14.61491  ?  248 ALA   A CA   1 
ATOM   3548 C C    . ALA   A 1 244 ? 18.32700 21.95200 8.55900   1.000 15.81769  ?  248 ALA   A C    1 
ATOM   3549 O O    . ALA   A 1 244 ? 17.50600 22.11500 7.64900   1.000 16.41249  ?  248 ALA   A O    1 
ATOM   3550 C CB   . ALA   A 1 244 ? 19.52900 19.78200 8.65600   1.000 15.85190  ?  248 ALA   A CB   1 
ATOM   3551 H H    . ALA   A 1 244 ? 16.62000 20.12200 8.67700   1.000 18.09000  ?  248 ALA   A H    1 
ATOM   3552 H HA   . ALA   A 1 244 ? 18.65400 20.84300 10.22400  1.000 17.59000  ?  248 ALA   A HA   1 
ATOM   3553 H HB1  . ALA   A 1 244 ? 20.36100 20.28000 8.66600   1.000 19.07000  ?  248 ALA   A HB1  1 
ATOM   3554 H HB2  . ALA   A 1 244 ? 19.62900 18.96000 9.16200   1.000 19.07000  ?  248 ALA   A HB2  1 
ATOM   3555 H HB3  . ALA   A 1 244 ? 19.27600 19.57900 7.74200   1.000 19.07000  ?  248 ALA   A HB3  1 
ATOM   3556 N N    . VAL   A 1 245 ? 19.20700 22.87800 8.94500   1.000 16.13088  ?  249 VAL   A N    1 
ATOM   3557 C CA   . VAL   A 1 245 ? 19.56800 24.02800 8.12900   1.000 16.49145  ?  249 VAL   A CA   1 
ATOM   3558 C C    . VAL   A 1 245 ? 20.99300 23.79200 7.66400   1.000 16.65200  ?  249 VAL   A C    1 
ATOM   3559 O O    . VAL   A 1 245 ? 21.85100 23.40000 8.46300   1.000 17.13363  ?  249 VAL   A O    1 
ATOM   3560 C CB   . VAL   A 1 245 ? 19.45400 25.34500 8.90900   1.000 19.38653  ?  249 VAL   A CB   1 
ATOM   3561 C CG1  . VAL   A 1 245 ? 19.73800 26.52300 8.00900   1.000 20.43666  ?  249 VAL   A CG1  1 
ATOM   3562 C CG2  . VAL   A 1 245 ? 18.10700 25.46600 9.52400   1.000 21.71839  ?  249 VAL   A CG2  1 
ATOM   3563 H H    . VAL   A 1 245 ? 19.61800 22.85700 9.70000   1.000 19.41000  ?  249 VAL   A H    1 
ATOM   3564 H HA   . VAL   A 1 245 ? 18.97800 24.09500 7.36200   1.000 19.84000  ?  249 VAL   A HA   1 
ATOM   3565 H HB   . VAL   A 1 245 ? 20.11300 25.34600 9.62100   1.000 23.31000  ?  249 VAL   A HB   1 
ATOM   3566 H HG11 . VAL   A 1 245 ? 19.60600 27.34300 8.51100   1.000 24.58000  ?  249 VAL   A HG11 1 
ATOM   3567 H HG12 . VAL   A 1 245 ? 20.65500 26.46900 7.69800   1.000 24.58000  ?  249 VAL   A HG12 1 
ATOM   3568 H HG13 . VAL   A 1 245 ? 19.13000 26.49700 7.25300   1.000 24.58000  ?  249 VAL   A HG13 1 
ATOM   3569 H HG21 . VAL   A 1 245 ? 18.03500 26.33100 9.95800   1.000 26.11000  ?  249 VAL   A HG21 1 
ATOM   3570 H HG22 . VAL   A 1 245 ? 17.43400 25.38800 8.83000   1.000 26.11000  ?  249 VAL   A HG22 1 
ATOM   3571 H HG23 . VAL   A 1 245 ? 17.99200 24.75800 10.17700  1.000 26.11000  ?  249 VAL   A HG23 1 
ATOM   3572 N N    . VAL   A 1 246 ? 21.22700 23.99400 6.37400   1.000 17.83635  ?  250 VAL   A N    1 
ATOM   3573 C CA   . VAL   A 1 246 ? 22.49000 23.70900 5.70600   1.000 17.54421  ?  250 VAL   A CA   1 
ATOM   3574 C C    . VAL   A 1 246 ? 22.92900 24.99900 5.04200   1.000 18.16270  ?  250 VAL   A C    1 
ATOM   3575 O O    . VAL   A 1 246 ? 22.13400 25.64600 4.34900   1.000 19.16809  ?  250 VAL   A O    1 
ATOM   3576 C CB   . VAL   A 1 246 ? 22.29900 22.60700 4.64800   1.000 18.55486  ?  250 VAL   A CB   1 
ATOM   3577 C CG1  . VAL   A 1 246 ? 23.59400 22.41300 3.86000   1.000 19.67604  ?  250 VAL   A CG1  1 
ATOM   3578 C CG2  . VAL   A 1 246 ? 21.85600 21.31000 5.28200   1.000 19.92081  ?  250 VAL   A CG2  1 
ATOM   3579 H H    . VAL   A 1 246 ? 20.63700 24.31400 5.83500   1.000 21.45000  ?  250 VAL   A H    1 
ATOM   3580 H HA   . VAL   A 1 246 ? 23.16400 23.42400 6.34300   1.000 21.10000  ?  250 VAL   A HA   1 
ATOM   3581 H HB   . VAL   A 1 246 ? 21.60100 22.87900 4.03300   1.000 22.32000  ?  250 VAL   A HB   1 
ATOM   3582 H HG11 . VAL   A 1 246 ? 23.53000 21.59500 3.34400   1.000 23.66000  ?  250 VAL   A HG11 1 
ATOM   3583 H HG12 . VAL   A 1 246 ? 23.71800 23.17000 3.26600   1.000 23.66000  ?  250 VAL   A HG12 1 
ATOM   3584 H HG13 . VAL   A 1 246 ? 24.33600 22.35500 4.48200   1.000 23.66000  ?  250 VAL   A HG13 1 
ATOM   3585 H HG21 . VAL   A 1 246 ? 21.78900 20.62900 4.59400   1.000 23.95000  ?  250 VAL   A HG21 1 
ATOM   3586 H HG22 . VAL   A 1 246 ? 22.50900 21.04400 5.94800   1.000 23.95000  ?  250 VAL   A HG22 1 
ATOM   3587 H HG23 . VAL   A 1 246 ? 20.99100 21.44300 5.70100   1.000 23.95000  ?  250 VAL   A HG23 1 
ATOM   3588 N N    . TRP   A 1 247 ? 24.19800 25.36500 5.23100   1.000 17.79424  ?  251 TRP   A N    1 
ATOM   3589 C CA   . TRP   A 1 247 ? 24.76600 26.56000 4.62100   1.000 19.70236  ?  251 TRP   A CA   1 
ATOM   3590 C C    . TRP   A 1 247 ? 25.82200 26.12600 3.61100   1.000 20.66564  ?  251 TRP   A C    1 
ATOM   3591 O O    . TRP   A 1 247 ? 27.01000 25.99400 3.96000   1.000 21.27887  ?  251 TRP   A O    1 
ATOM   3592 C CB   . TRP   A 1 247 ? 25.38900 27.48300 5.67000   1.000 21.42889  ?  251 TRP   A CB   1 
ATOM   3593 C CG   . TRP   A 1 247 ? 24.41900 28.21300 6.55000   1.000 21.85262  ?  251 TRP   A CG   1 
ATOM   3594 C CD1  . TRP   A 1 247 ? 23.94000 29.47700 6.37000   1.000 22.33952  ?  251 TRP   A CD1  1 
ATOM   3595 C CD2  . TRP   A 1 247 ? 23.85000 27.74300 7.78100   1.000 20.80513  ?  251 TRP   A CD2  1 
ATOM   3596 N NE1  . TRP   A 1 247 ? 23.08800 29.81100 7.39600   1.000 22.86853  ?  251 TRP   A NE1  1 
ATOM   3597 C CE2  . TRP   A 1 247 ? 23.03400 28.77300 8.28300   1.000 21.39467  ?  251 TRP   A CE2  1 
ATOM   3598 C CE3  . TRP   A 1 247 ? 23.95600 26.55800 8.50500   1.000 20.69459  ?  251 TRP   A CE3  1 
ATOM   3599 C CZ2  . TRP   A 1 247 ? 22.31600 28.64300 9.46300   1.000 21.23939  ?  251 TRP   A CZ2  1 
ATOM   3600 C CZ3  . TRP   A 1 247 ? 23.24800 26.43800 9.68800   1.000 21.15254  ?  251 TRP   A CZ3  1 
ATOM   3601 C CH2  . TRP   A 1 247 ? 22.43400 27.47700 10.15000  1.000 21.11306  ?  251 TRP   A CH2  1 
ATOM   3602 H H    . TRP   A 1 247 ? 24.75500 24.92600 5.71700   1.000 21.41000  ?  251 TRP   A H    1 
ATOM   3603 H HA   . TRP   A 1 247 ? 24.06100 27.04900 4.16900   1.000 23.70000  ?  251 TRP   A HA   1 
ATOM   3604 H HB2  . TRP   A 1 247 ? 25.95600 26.94900 6.24800   1.000 25.76000  ?  251 TRP   A HB2  1 
ATOM   3605 H HB3  . TRP   A 1 247 ? 25.92000 28.15200 5.21000   1.000 25.76000  ?  251 TRP   A HB3  1 
ATOM   3606 H HD1  . TRP   A 1 247 ? 24.15700 30.03200 5.65600   1.000 26.86000  ?  251 TRP   A HD1  1 
ATOM   3607 H HE1  . TRP   A 1 247 ? 22.65900 30.55300 7.46800   1.000 27.49000  ?  251 TRP   A HE1  1 
ATOM   3608 H HE3  . TRP   A 1 247 ? 24.49200 25.86200 8.20000   1.000 24.88000  ?  251 TRP   A HE3  1 
ATOM   3609 H HZ2  . TRP   A 1 247 ? 21.77200 29.33100 9.77300   1.000 25.54000  ?  251 TRP   A HZ2  1 
ATOM   3610 H HZ3  . TRP   A 1 247 ? 23.31400 25.65300 10.18300  1.000 25.43000  ?  251 TRP   A HZ3  1 
ATOM   3611 H HH2  . TRP   A 1 247 ? 21.96400 27.36700 10.94500  1.000 25.38000  ?  251 TRP   A HH2  1 
ATOM   3612 N N    . PRO   A 1 248 ? 25.45900 25.90700 2.34900   1.000 20.96304  ?  252 PRO   A N    1 
ATOM   3613 C CA   . PRO   A 1 248 ? 26.49400 25.64200 1.34000   1.000 21.47626  ?  252 PRO   A CA   1 
ATOM   3614 C C    . PRO   A 1 248 ? 27.33600 26.89700 1.22600   1.000 22.98170  ?  252 PRO   A C    1 
ATOM   3615 O O    . PRO   A 1 248 ? 26.87500 28.00300 1.50000   1.000 26.64793  ?  252 PRO   A O    1 
ATOM   3616 C CB   . PRO   A 1 248 ? 25.69700 25.38400 0.05500   1.000 21.88947  ?  252 PRO   A CB   1 
ATOM   3617 C CG   . PRO   A 1 248 ? 24.24800 25.24100 0.51200   1.000 20.56562  ?  252 PRO   A CG   1 
ATOM   3618 C CD   . PRO   A 1 248 ? 24.10900 26.04300 1.75600   1.000 20.77354  ?  252 PRO   A CD   1 
ATOM   3619 H HA   . PRO   A 1 248 ? 27.02600 24.85400 1.53100   1.000 25.82000  ?  252 PRO   A HA   1 
ATOM   3620 H HB2  . PRO   A 1 248 ? 25.79700 26.13400 -0.55200  1.000 26.32000  ?  252 PRO   A HB2  1 
ATOM   3621 H HB3  . PRO   A 1 248 ? 26.01000 24.57000 -0.37000  1.000 26.32000  ?  252 PRO   A HB3  1 
ATOM   3622 H HG2  . PRO   A 1 248 ? 23.65600 25.57800 -0.17900  1.000 24.73000  ?  252 PRO   A HG2  1 
ATOM   3623 H HG3  . PRO   A 1 248 ? 24.05500 24.30600 0.68600   1.000 24.73000  ?  252 PRO   A HG3  1 
ATOM   3624 H HD2  . PRO   A 1 248 ? 23.90500 26.97000 1.55600   1.000 24.98000  ?  252 PRO   A HD2  1 
ATOM   3625 H HD3  . PRO   A 1 248 ? 23.42900 25.67200 2.34000   1.000 24.98000  ?  252 PRO   A HD3  1 
ATOM   3626 N N    . THR   A 1 249 ? 28.59200 26.73300 0.85800   1.000 20.21295  ?  254 THR   A N    1 
ATOM   3627 C CA   . THR   A 1 249 ? 29.40500 27.91100 0.62000   1.000 20.31559  ?  254 THR   A CA   1 
ATOM   3628 C C    . THR   A 1 249 ? 28.95500 28.53800 -0.70100  1.000 24.04762  ?  254 THR   A C    1 
ATOM   3629 O O    . THR   A 1 249 ? 28.57000 27.84200 -1.65100  1.000 25.38989  ?  254 THR   A O    1 
ATOM   3630 C CB   . THR   A 1 249 ? 30.88900 27.53600 0.59600   1.000 18.71540  ?  254 THR   A CB   1 
ATOM   3631 O OG1  . THR   A 1 249 ? 31.17500 26.76200 -0.56200  1.000 18.18902  ?  254 THR   A OG1  1 
ATOM   3632 C CG2  . THR   A 1 249 ? 31.29100 26.74600 1.83400   1.000 19.04702  ?  254 THR   A CG2  1 
ATOM   3633 H H    . THR   A 1 249 ? 28.98600 25.97700 0.74300   1.000 24.30000  ?  254 THR   A H    1 
ATOM   3634 H HA   . THR   A 1 249 ? 29.30300 28.56500 1.32900   1.000 24.43000  ?  254 THR   A HA   1 
ATOM   3635 H HB   . THR   A 1 249 ? 31.41000 28.35400 0.58100   1.000 22.51000  ?  254 THR   A HB   1 
ATOM   3636 H HG1  . THR   A 1 249 ? 30.78700 26.01800 -0.51300  1.000 21.88000  ?  254 THR   A HG1  1 
ATOM   3637 H HG21 . THR   A 1 249 ? 32.19900 26.97000 2.09000   1.000 22.91000  ?  254 THR   A HG21 1 
ATOM   3638 H HG22 . THR   A 1 249 ? 30.69500 26.95700 2.57000   1.000 22.91000  ?  254 THR   A HG22 1 
ATOM   3639 H HG23 . THR   A 1 249 ? 31.24200 25.79500 1.65100   1.000 22.91000  ?  254 THR   A HG23 1 
ATOM   3640 N N    . GLY   A 1 250 ? 28.92700 29.85400 -0.74800  1.000 26.65320  ?  255 GLY   A N    1 
ATOM   3641 C CA   . GLY   A 1 250 ? 28.60600 30.44900 -2.04000  1.000 26.05312  ?  255 GLY   A CA   1 
ATOM   3642 C C    . GLY   A 1 250 ? 27.16400 30.42700 -2.54100  1.000 25.51359  ?  255 GLY   A C    1 
ATOM   3643 O O    . GLY   A 1 250 ? 26.93300 30.87500 -3.66100  1.000 26.45580  ?  255 GLY   A O    1 
ATOM   3644 H H    . GLY   A 1 250 ? 29.07800 30.39200 -0.09500  1.000 32.03000  ?  255 GLY   A H    1 
ATOM   3645 H HA2  . GLY   A 1 250 ? 28.87200 31.38200 -2.00600  1.000 31.31000  ?  255 GLY   A HA2  1 
ATOM   3646 H HA3  . GLY   A 1 250 ? 29.13800 29.99400 -2.71200  1.000 31.31000  ?  255 GLY   A HA3  1 
ATOM   3647 N N    . ARG   A 1 251 ? 26.18900 29.92300 -1.79000  1.000 24.16606  ?  256 ARG   A N    1 
ATOM   3648 C CA   . ARG   A 1 251 ? 24.78900 30.07600 -2.17300  1.000 24.18448  ?  256 ARG   A CA   1 
ATOM   3649 C C    . ARG   A 1 251 ? 23.96400 30.14600 -0.89700  1.000 21.93421  ?  256 ARG   A C    1 
ATOM   3650 O O    . ARG   A 1 251 ? 24.46200 29.92300 0.20900   1.000 22.45269  ?  256 ARG   A O    1 
ATOM   3651 C CB   . ARG   A 1 251 ? 24.31700 28.94200 -3.08300  1.000 25.00300  ?  256 ARG   A CB   1 
ATOM   3652 C CG   . ARG   A 1 251 ? 24.43300 27.56100 -2.47800  1.000 25.97943  ?  256 ARG   A CG   1 
ATOM   3653 C CD   . ARG   A 1 251 ? 23.99500 26.48600 -3.45900  1.000 27.06114  ?  256 ARG   A CD   1 
ATOM   3654 N NE   . ARG   A 1 251 ? 22.62000 26.66500 -3.91500  1.000 28.75871  ?  256 ARG   A NE   1 
ATOM   3655 C CZ   . ARG   A 1 251 ? 22.13000 26.12600 -5.02400  1.000 31.72222  ?  256 ARG   A CZ   1 
ATOM   3656 N NH1  . ARG   A 1 251 ? 22.87200 25.35800 -5.80900  1.000 33.33821  ?  256 ARG   A NH1  1 
ATOM   3657 N NH2  . ARG   A 1 251 ? 20.86700 26.36900 -5.36400  1.000 33.53560  ?  256 ARG   A NH2  1 
ATOM   3658 H H    . ARG   A 1 251 ? 26.31200 29.49000 -1.05700  1.000 29.05000  ?  256 ARG   A H    1 
ATOM   3659 H HA   . ARG   A 1 251 ? 24.67500 30.90400 -2.66600  1.000 29.07000  ?  256 ARG   A HA   1 
ATOM   3660 H HB2  . ARG   A 1 251 ? 23.38300 29.08900 -3.30000  1.000 30.05000  ?  256 ARG   A HB2  1 
ATOM   3661 H HB3  . ARG   A 1 251 ? 24.85100 28.95200 -3.89200  1.000 30.05000  ?  256 ARG   A HB3  1 
ATOM   3662 H HG2  . ARG   A 1 251 ? 25.35600 27.39400 -2.23300  1.000 31.22000  ?  256 ARG   A HG2  1 
ATOM   3663 H HG3  . ARG   A 1 251 ? 23.86600 27.50600 -1.69200  1.000 31.22000  ?  256 ARG   A HG3  1 
ATOM   3664 H HD2  . ARG   A 1 251 ? 24.57500 26.51200 -4.23700  1.000 32.52000  ?  256 ARG   A HD2  1 
ATOM   3665 H HD3  . ARG   A 1 251 ? 24.05700 25.61900 -3.02800  1.000 32.52000  ?  256 ARG   A HD3  1 
ATOM   3666 H HE   . ARG   A 1 251 ? 22.09500 27.15000 -3.43600  1.000 34.56000  ?  256 ARG   A HE   1 
ATOM   3667 H HH11 . ARG   A 1 251 ? 23.69200 25.20000 -5.60400  1.000 40.05000  ?  256 ARG   A HH11 1 
ATOM   3668 H HH12 . ARG   A 1 251 ? 22.53300 25.01900 -6.52300  1.000 40.05000  ?  256 ARG   A HH12 1 
ATOM   3669 H HH21 . ARG   A 1 251 ? 20.37800 26.87100 -4.86700  1.000 40.29000  ?  256 ARG   A HH21 1 
ATOM   3670 H HH22 . ARG   A 1 251 ? 20.54100 26.02400 -6.08000  1.000 40.29000  ?  256 ARG   A HH22 1 
ATOM   3671 N N    . ALA   A 1 252 ? 22.67900 30.46100 -1.06000  1.000 21.62628  ?  257 ALA   A N    1 
ATOM   3672 C CA   . ALA   A 1 252 ? 21.80800 30.67500 0.08600   1.000 20.58668  ?  257 ALA   A CA   1 
ATOM   3673 C C    . ALA   A 1 252 ? 21.56900 29.37400 0.85200   1.000 19.50760  ?  257 ALA   A C    1 
ATOM   3674 O O    . ALA   A 1 252 ? 21.65700 28.27800 0.29800   1.000 19.47339  ?  257 ALA   A O    1 
ATOM   3675 C CB   . ALA   A 1 252 ? 20.46300 31.22100 -0.39100  1.000 21.15780  ?  257 ALA   A CB   1 
ATOM   3676 H H    . ALA   A 1 252 ? 22.29200 30.55700 -1.82200  1.000 26.00000  ?  257 ALA   A H    1 
ATOM   3677 H HA   . ALA   A 1 252 ? 22.22700 31.30800 0.69000   1.000 24.75000  ?  257 ALA   A HA   1 
ATOM   3678 H HB1  . ALA   A 1 252 ? 19.88900 31.36300 0.37800   1.000 25.44000  ?  257 ALA   A HB1  1 
ATOM   3679 H HB2  . ALA   A 1 252 ? 20.60900 32.06000 -0.85500  1.000 25.44000  ?  257 ALA   A HB2  1 
ATOM   3680 H HB3  . ALA   A 1 252 ? 20.05600 30.57700 -0.99200  1.000 25.44000  ?  257 ALA   A HB3  1 
ATOM   3681 N N    . PRO   A 1 253 ? 21.23100 29.46700 2.13000   1.000 18.81541  ?  258 PRO   A N    1 
ATOM   3682 C CA   . PRO   A 1 253 ? 21.00400 28.24600 2.90400   1.000 18.81015  ?  258 PRO   A CA   1 
ATOM   3683 C C    . PRO   A 1 253 ? 19.79500 27.44900 2.42600   1.000 17.82582  ?  258 PRO   A C    1 
ATOM   3684 O O    . PRO   A 1 253 ? 18.86800 27.96100 1.78900   1.000 18.40221  ?  258 PRO   A O    1 
ATOM   3685 C CB   . PRO   A 1 253 ? 20.81200 28.74000 4.34000   1.000 20.83145  ?  258 PRO   A CB   1 
ATOM   3686 C CG   . PRO   A 1 253 ? 20.67500 30.16300 4.27300   1.000 22.12634  ?  258 PRO   A CG   1 
ATOM   3687 C CD   . PRO   A 1 253 ? 21.20100 30.67300 2.97300   1.000 20.16558  ?  258 PRO   A CD   1 
ATOM   3688 H HA   . PRO   A 1 253 ? 21.79200 27.68200 2.85400   1.000 22.62000  ?  258 PRO   A HA   1 
ATOM   3689 H HB2  . PRO   A 1 253 ? 20.01300 28.33800 4.71600   1.000 25.05000  ?  258 PRO   A HB2  1 
ATOM   3690 H HB3  . PRO   A 1 253 ? 21.58700 28.49700 4.87100   1.000 25.05000  ?  258 PRO   A HB3  1 
ATOM   3691 H HG2  . PRO   A 1 253 ? 19.73500 30.38600 4.35600   1.000 26.60000  ?  258 PRO   A HG2  1 
ATOM   3692 H HG3  . PRO   A 1 253 ? 21.17600 30.55600 5.00600   1.000 26.60000  ?  258 PRO   A HG3  1 
ATOM   3693 H HD2  . PRO   A 1 253 ? 20.60800 31.34300 2.59900   1.000 24.25000  ?  258 PRO   A HD2  1 
ATOM   3694 H HD3  . PRO   A 1 253 ? 22.09200 31.04200 3.08100   1.000 24.25000  ?  258 PRO   A HD3  1 
ATOM   3695 N N    A ILE   A 1 254 ? 19.84900 26.15600 2.73800   0.530 17.24154  ?  259 ILE   A N    1 
ATOM   3696 N N    B ILE   A 1 254 ? 19.83600 26.15900 2.74600   0.470 17.25207  ?  259 ILE   A N    1 
ATOM   3697 C CA   A ILE   A 1 254 ? 18.78700 25.19700 2.46400   0.530 17.54421  ?  259 ILE   A CA   1 
ATOM   3698 C CA   B ILE   A 1 254 ? 18.77000 25.21200 2.45200   0.470 17.33103  ?  259 ILE   A CA   1 
ATOM   3699 C C    A ILE   A 1 254 ? 18.22700 24.75300 3.80200   0.530 17.01257  ?  259 ILE   A C    1 
ATOM   3700 C C    B ILE   A 1 254 ? 18.22900 24.69900 3.77300   0.470 16.78096  ?  259 ILE   A C    1 
ATOM   3701 O O    A ILE   A 1 254 ? 18.97700 24.51700 4.75400   0.530 17.14416  ?  259 ILE   A O    1 
ATOM   3702 O O    B ILE   A 1 254 ? 18.99300 24.35900 4.68200   0.470 16.74674  ?  259 ILE   A O    1 
ATOM   3703 C CB   A ILE   A 1 254 ? 19.35300 23.97400 1.71300   0.530 18.62592  ?  259 ILE   A CB   1 
ATOM   3704 C CB   B ILE   A 1 254 ? 19.30200 24.03300 1.61000   0.470 18.17323  ?  259 ILE   A CB   1 
ATOM   3705 C CG1  A ILE   A 1 254 ? 20.18400 24.41500 0.50600   0.530 19.68131  ?  259 ILE   A CG1  1 
ATOM   3706 C CG1  B ILE   A 1 254 ? 19.75800 24.52700 0.23700   0.470 19.11808  ?  259 ILE   A CG1  1 
ATOM   3707 C CG2  A ILE   A 1 254 ? 18.24700 23.02000 1.29200   0.530 19.18125  ?  259 ILE   A CG2  1 
ATOM   3708 C CG2  B ILE   A 1 254 ? 18.25400 22.92900 1.49000   0.470 18.51801  ?  259 ILE   A CG2  1 
ATOM   3709 C CD1  A ILE   A 1 254 ? 19.42700 25.22100 -0.49900  0.530 20.27875  ?  259 ILE   A CD1  1 
ATOM   3710 C CD1  B ILE   A 1 254 ? 20.66800 23.56700 -0.44900  0.470 20.03661  ?  259 ILE   A CD1  1 
ATOM   3711 H H    A ILE   A 1 254 ? 20.52600 25.79600 3.12800   0.530 20.74000  ?  259 ILE   A H    1 
ATOM   3712 H H    B ILE   A 1 254 ? 20.50100 25.79500 3.15300   0.470 20.75000  ?  259 ILE   A H    1 
ATOM   3713 H HA   A ILE   A 1 254 ? 18.08800 25.61000 1.93300   0.530 21.11000  ?  259 ILE   A HA   1 
ATOM   3714 H HA   B ILE   A 1 254 ? 18.05700 25.65400 1.96400   0.470 20.85000  ?  259 ILE   A HA   1 
ATOM   3715 H HB   A ILE   A 1 254 ? 19.93500 23.49800 2.32600   0.530 22.40000  ?  259 ILE   A HB   1 
ATOM   3716 H HB   B ILE   A 1 254 ? 20.07100 23.65400 2.06400   0.470 21.86000  ?  259 ILE   A HB   1 
ATOM   3717 H HG12 A ILE   A 1 254 ? 20.92400 24.95800 0.82100   0.530 23.67000  ?  259 ILE   A HG12 1 
ATOM   3718 H HG12 B ILE   A 1 254 ? 18.97900 24.65700 -0.32700  0.470 22.99000  ?  259 ILE   A HG12 1 
ATOM   3719 H HG13 A ILE   A 1 254 ? 20.52100 23.62500 0.05600   0.530 23.67000  ?  259 ILE   A HG13 1 
ATOM   3720 H HG13 B ILE   A 1 254 ? 20.23300 25.36600 0.34500   0.470 22.99000  ?  259 ILE   A HG13 1 
ATOM   3721 H HG21 A ILE   A 1 254 ? 18.61900 22.34500 0.70200   0.530 23.07000  ?  259 ILE   A HG21 1 
ATOM   3722 H HG21 B ILE   A 1 254 ? 18.51100 22.32600 0.77400   0.470 22.27000  ?  259 ILE   A HG21 1 
ATOM   3723 H HG22 A ILE   A 1 254 ? 17.87500 22.59800 2.08200   0.530 23.07000  ?  259 ILE   A HG22 1 
ATOM   3724 H HG22 B ILE   A 1 254 ? 18.20700 22.44500 2.32900   0.470 22.27000  ?  259 ILE   A HG22 1 
ATOM   3725 H HG23 A ILE   A 1 254 ? 17.55800 23.52000 0.82800   0.530 23.07000  ?  259 ILE   A HG23 1 
ATOM   3726 H HG23 B ILE   A 1 254 ? 17.39400 23.33000 1.29100   0.470 22.27000  ?  259 ILE   A HG23 1 
ATOM   3727 H HD11 A ILE   A 1 254 ? 19.99300 25.37600 -1.27100  0.530 24.38000  ?  259 ILE   A HD11 1 
ATOM   3728 H HD11 B ILE   A 1 254 ? 21.10600 24.01900 -1.18700  0.470 24.09000  ?  259 ILE   A HD11 1 
ATOM   3729 H HD12 A ILE   A 1 254 ? 18.63300 24.73000 -0.76400  0.530 24.38000  ?  259 ILE   A HD12 1 
ATOM   3730 H HD12 B ILE   A 1 254 ? 21.33000 23.25200 0.18600   0.470 24.09000  ?  259 ILE   A HD12 1 
ATOM   3731 H HD13 A ILE   A 1 254 ? 19.17300 26.06700 -0.09900  0.530 24.38000  ?  259 ILE   A HD13 1 
ATOM   3732 H HD13 B ILE   A 1 254 ? 20.14600 22.82000 -0.78100  0.470 24.09000  ?  259 ILE   A HD13 1 
ATOM   3733 N N    . VAL   A 1 255 ? 16.90800 24.62900 3.87900   1.000 16.61252  ?  260 VAL   A N    1 
ATOM   3734 C CA   . VAL   A 1 255 ? 16.24800 24.08400 5.05700   1.000 16.92835  ?  260 VAL   A CA   1 
ATOM   3735 C C    . VAL   A 1 255 ? 15.50900 22.82900 4.62100   1.000 16.43881  ?  260 VAL   A C    1 
ATOM   3736 O O    . VAL   A 1 255 ? 14.83100 22.83500 3.58500   1.000 17.29944  ?  260 VAL   A O    1 
ATOM   3737 C CB   . VAL   A 1 255 ? 15.28400 25.09500 5.70200   1.000 17.68633  ?  260 VAL   A CB   1 
ATOM   3738 C CG1  . VAL   A 1 255 ? 14.75800 24.57300 7.02000   1.000 19.61814  ?  260 VAL   A CG1  1 
ATOM   3739 C CG2  . VAL   A 1 255 ? 15.97600 26.44400 5.91100   1.000 19.20230  ?  260 VAL   A CG2  1 
ATOM   3740 H H    A VAL   A 1 255 ? 16.36600 24.85700 3.25100   0.530 19.98000  ?  260 VAL   A H    1 
ATOM   3741 H H    B VAL   A 1 255 ? 16.36300 24.89600 3.26900   0.470 19.98000  ?  260 VAL   A H    1 
ATOM   3742 H HA   . VAL   A 1 255 ? 16.91200 23.84700 5.72400   1.000 20.36000  ?  260 VAL   A HA   1 
ATOM   3743 H HB   . VAL   A 1 255 ? 14.53200 25.22300 5.10300   1.000 21.27000  ?  260 VAL   A HB   1 
ATOM   3744 H HG11 . VAL   A 1 255 ? 14.03600 25.14700 7.32100   1.000 23.59000  ?  260 VAL   A HG11 1 
ATOM   3745 H HG12 . VAL   A 1 255 ? 14.43000 23.66900 6.89300   1.000 23.59000  ?  260 VAL   A HG12 1 
ATOM   3746 H HG13 . VAL   A 1 255 ? 15.47700 24.57700 7.67100   1.000 23.59000  ?  260 VAL   A HG13 1 
ATOM   3747 H HG21 . VAL   A 1 255 ? 15.37600 27.03600 6.39100   1.000 23.09000  ?  260 VAL   A HG21 1 
ATOM   3748 H HG22 . VAL   A 1 255 ? 16.78700 26.30700 6.42600   1.000 23.09000  ?  260 VAL   A HG22 1 
ATOM   3749 H HG23 . VAL   A 1 255 ? 16.19500 26.82400 5.04600   1.000 23.09000  ?  260 VAL   A HG23 1 
ATOM   3750 N N    . LEU   A 1 256 ? 15.65200 21.74700 5.37900   1.000 16.47040  ?  261 LEU   A N    1 
ATOM   3751 C CA   . LEU   A 1 256 ? 14.97700 20.52000 4.96900   1.000 16.20984  ?  261 LEU   A CA   1 
ATOM   3752 C C    . LEU   A 1 256 ? 14.60400 19.64400 6.15500   1.000 16.24142  ?  261 LEU   A C    1 
ATOM   3753 O O    . LEU   A 1 256 ? 15.18100 19.73000 7.24400   1.000 16.47303  ?  261 LEU   A O    1 
ATOM   3754 C CB   . LEU   A 1 256 ? 15.76100 19.72600 3.91600   1.000 16.62831  ?  261 LEU   A CB   1 
ATOM   3755 C CG   . LEU   A 1 256 ? 16.98800 18.99100 4.40300   1.000 17.08889  ?  261 LEU   A CG   1 
ATOM   3756 C CD1  . LEU   A 1 256 ? 17.43200 17.95500 3.39400   1.000 19.22862  ?  261 LEU   A CD1  1 
ATOM   3757 C CD2  . LEU   A 1 256 ? 18.15200 19.94400 4.65700   1.000 17.94689  ?  261 LEU   A CD2  1 
ATOM   3758 H H    . LEU   A 1 256 ? 16.11400 21.70000 6.10300   1.000 19.81000  ?  261 LEU   A H    1 
ATOM   3759 H HA   . LEU   A 1 256 ? 14.13600 20.79400 4.56900   1.000 19.50000  ?  261 LEU   A HA   1 
ATOM   3760 H HB2  . LEU   A 1 256 ? 15.16500 19.06400 3.53400   1.000 20.00000  ?  261 LEU   A HB2  1 
ATOM   3761 H HB3  . LEU   A 1 256 ? 16.05300 20.34500 3.22900   1.000 20.00000  ?  261 LEU   A HB3  1 
ATOM   3762 H HG   . LEU   A 1 256 ? 16.75000 18.55600 5.23600   1.000 20.55000  ?  261 LEU   A HG   1 
ATOM   3763 H HD11 . LEU   A 1 256 ? 18.22300 17.50600 3.73000   1.000 23.12000  ?  261 LEU   A HD11 1 
ATOM   3764 H HD12 . LEU   A 1 256 ? 16.71600 17.31300 3.26500   1.000 23.12000  ?  261 LEU   A HD12 1 
ATOM   3765 H HD13 . LEU   A 1 256 ? 17.63400 18.39800 2.55500   1.000 23.12000  ?  261 LEU   A HD13 1 
ATOM   3766 H HD21 . LEU   A 1 256 ? 18.93000 19.42800 4.92400   1.000 21.58000  ?  261 LEU   A HD21 1 
ATOM   3767 H HD22 . LEU   A 1 256 ? 18.34400 20.43400 3.84200   1.000 21.58000  ?  261 LEU   A HD22 1 
ATOM   3768 H HD23 . LEU   A 1 256 ? 17.90600 20.56100 5.36400   1.000 21.58000  ?  261 LEU   A HD23 1 
ATOM   3769 N N    . ALA   A 1 257 ? 13.61600 18.77900 5.91000   1.000 15.32289  ?  262 ALA   A N    1 
ATOM   3770 C CA   . ALA   A 1 257 ? 13.10500 17.83900 6.89200   1.000 15.14392  ?  262 ALA   A CA   1 
ATOM   3771 C C    . ALA   A 1 257 ? 12.86100 16.50400 6.20400   1.000 14.99917  ?  262 ALA   A C    1 
ATOM   3772 O O    . ALA   A 1 257 ? 12.32200 16.45900 5.09000   1.000 15.14655  ?  262 ALA   A O    1 
ATOM   3773 C CB   . ALA   A 1 257 ? 11.80500 18.36500 7.52000   1.000 16.42565  ?  262 ALA   A CB   1 
ATOM   3774 H H    . ALA   A 1 257 ? 13.21500 18.72000 5.15200   1.000 18.43000  ?  262 ALA   A H    1 
ATOM   3775 H HA   . ALA   A 1 257 ? 13.75000 17.70000 7.60300   1.000 18.22000  ?  262 ALA   A HA   1 
ATOM   3776 H HB1  . ALA   A 1 257 ? 11.47700 17.71500 8.16100   1.000 19.76000  ?  262 ALA   A HB1  1 
ATOM   3777 H HB2  . ALA   A 1 257 ? 11.98800 19.20600 7.96700   1.000 19.76000  ?  262 ALA   A HB2  1 
ATOM   3778 H HB3  . ALA   A 1 257 ? 11.14700 18.50000 6.81900   1.000 19.76000  ?  262 ALA   A HB3  1 
ATOM   3779 N N    . VAL   A 1 258 ? 13.29400 15.42900 6.85600   1.000 14.65176  ?  263 VAL   A N    1 
ATOM   3780 C CA   . VAL   A 1 258 ? 13.11300 14.06200 6.38700   1.000 14.81493  ?  263 VAL   A CA   1 
ATOM   3781 C C    . VAL   A 1 258 ? 12.52800 13.24200 7.53400   1.000 14.15959  ?  263 VAL   A C    1 
ATOM   3782 O O    . VAL   A 1 258 ? 13.17800 13.08500 8.57500   1.000 14.72808  ?  263 VAL   A O    1 
ATOM   3783 C CB   . VAL   A 1 258 ? 14.43700 13.43200 5.91200   1.000 15.88085  ?  263 VAL   A CB   1 
ATOM   3784 C CG1  . VAL   A 1 258 ? 14.18800 12.00500 5.50800   1.000 16.62568  ?  263 VAL   A CG1  1 
ATOM   3785 C CG2  . VAL   A 1 258 ? 15.07200 14.23800 4.77400   1.000 16.79149  ?  263 VAL   A CG2  1 
ATOM   3786 H H    . VAL   A 1 258 ? 13.71400 15.46900 7.60500   1.000 17.63000  ?  263 VAL   A H    1 
ATOM   3787 H HA   . VAL   A 1 258 ? 12.48300 14.06100 5.64900   1.000 17.83000  ?  263 VAL   A HA   1 
ATOM   3788 H HB   . VAL   A 1 258 ? 15.07800 13.44400 6.64000   1.000 19.11000  ?  263 VAL   A HB   1 
ATOM   3789 H HG11 . VAL   A 1 258 ? 14.97400 11.66400 5.05200   1.000 20.00000  ?  263 VAL   A HG11 1 
ATOM   3790 H HG12 . VAL   A 1 258 ? 14.01200 11.47700 6.30200   1.000 20.00000  ?  263 VAL   A HG12 1 
ATOM   3791 H HG13 . VAL   A 1 258 ? 13.42200 11.97400 4.91400   1.000 20.00000  ?  263 VAL   A HG13 1 
ATOM   3792 H HG21 . VAL   A 1 258 ? 15.91800 13.83000 4.53200   1.000 20.20000  ?  263 VAL   A HG21 1 
ATOM   3793 H HG22 . VAL   A 1 258 ? 14.47200 14.23400 4.01100   1.000 20.20000  ?  263 VAL   A HG22 1 
ATOM   3794 H HG23 . VAL   A 1 258 ? 15.21700 15.14800 5.07500   1.000 20.20000  ?  263 VAL   A HG23 1 
ATOM   3795 N N    . TYR   A 1 259 ? 11.30800 12.71700 7.34300   1.000 14.19644  ?  264 TYR   A N    1 
ATOM   3796 C CA   . TYR   A 1 259 ? 10.60400 11.93800 8.34900   1.000 14.04116  ?  264 TYR   A CA   1 
ATOM   3797 C C    . TYR   A 1 259 ? 10.26600 10.57400 7.76500   1.000 13.75165  ?  264 TYR   A C    1 
ATOM   3798 O O    . TYR   A 1 259 ? 9.94100  10.46600 6.57600   1.000 14.37804  ?  264 TYR   A O    1 
ATOM   3799 C CB   . TYR   A 1 259 ? 9.29400  12.67800 8.79400   1.000 13.89114  ?  264 TYR   A CB   1 
ATOM   3800 C CG   . TYR   A 1 259 ? 9.59400  13.75800 9.79800   1.000 14.13854  ?  264 TYR   A CG   1 
ATOM   3801 C CD1  . TYR   A 1 259 ? 10.28500 14.90100 9.42800   1.000 13.16474  ?  264 TYR   A CD1  1 
ATOM   3802 C CD2  . TYR   A 1 259 ? 9.23500  13.61500 11.13900  1.000 13.16474  ?  264 TYR   A CD2  1 
ATOM   3803 C CE1  . TYR   A 1 259 ? 10.62900 15.86600 10.37300  1.000 13.18316  ?  264 TYR   A CE1  1 
ATOM   3804 C CE2  . TYR   A 1 259 ? 9.56800  14.56400 12.07500  1.000 13.11736  ?  264 TYR   A CE2  1 
ATOM   3805 C CZ   . TYR   A 1 259 ? 10.28500 15.69500 11.69900  1.000 13.41477  ?  264 TYR   A CZ   1 
ATOM   3806 O OH   . TYR   A 1 259 ? 10.68000 16.67900 12.60600  1.000 13.66216  ?  264 TYR   A OH   1 
ATOM   3807 H H    . TYR   A 1 259 ? 10.86100 12.80700 6.61300   1.000 17.08000  ?  264 TYR   A H    1 
ATOM   3808 H HA   . TYR   A 1 259 ? 11.15700 11.80500 9.13500   1.000 16.90000  ?  264 TYR   A HA   1 
ATOM   3809 H HB2  . TYR   A 1 259 ? 8.87600  13.08700 8.02000   1.000 16.72000  ?  264 TYR   A HB2  1 
ATOM   3810 H HB3  . TYR   A 1 259 ? 8.68600  12.04100 9.20100   1.000 16.72000  ?  264 TYR   A HB3  1 
ATOM   3811 H HD1  . TYR   A 1 259 ? 10.52300 15.02500 8.53800   1.000 15.85000  ?  264 TYR   A HD1  1 
ATOM   3812 H HD2  . TYR   A 1 259 ? 8.76000  12.86100 11.40400  1.000 15.85000  ?  264 TYR   A HD2  1 
ATOM   3813 H HE1  . TYR   A 1 259 ? 11.09100 16.62900 10.10900  1.000 15.87000  ?  264 TYR   A HE1  1 
ATOM   3814 H HE2  . TYR   A 1 259 ? 9.31300  14.44900 12.96200  1.000 15.79000  ?  264 TYR   A HE2  1 
ATOM   3815 H HH   . TYR   A 1 259 ? 10.53300 16.42000 13.39200  1.000 16.44000  ?  264 TYR   A HH   1 
ATOM   3816 N N    . THR   A 1 260 ? 10.29800 9.54000  8.60300   1.000 14.15959  ?  265 THR   A N    1 
ATOM   3817 C CA   . THR   A 1 260 ? 9.93500  8.20300  8.16800   1.000 14.61754  ?  265 THR   A CA   1 
ATOM   3818 C C    . THR   A 1 260 ? 8.98200  7.54600  9.15900   1.000 14.79914  ?  265 THR   A C    1 
ATOM   3819 O O    . THR   A 1 260 ? 8.92000  7.89300  10.33800  1.000 15.25709  ?  265 THR   A O    1 
ATOM   3820 C CB   . THR   A 1 260 ? 11.14400 7.26500  7.94300   1.000 15.63872  ?  265 THR   A CB   1 
ATOM   3821 O OG1  . THR   A 1 260 ? 11.63800 6.77000  9.19600   1.000 16.01771  ?  265 THR   A OG1  1 
ATOM   3822 C CG2  . THR   A 1 260 ? 12.29900 7.94200  7.21000   1.000 16.08351  ?  265 THR   A CG2  1 
ATOM   3823 H H    . THR   A 1 260 ? 10.52800 9.59200  9.43000   1.000 17.04000  ?  265 THR   A H    1 
ATOM   3824 H HA   . THR   A 1 260 ? 9.48000  8.31000  7.31800   1.000 17.59000  ?  265 THR   A HA   1 
ATOM   3825 H HB   . THR   A 1 260 ? 10.82900 6.53400  7.38900   1.000 18.82000  ?  265 THR   A HB   1 
ATOM   3826 H HG1  . THR   A 1 260 ? 11.16400 6.12900  9.45800   1.000 19.27000  ?  265 THR   A HG1  1 
ATOM   3827 H HG21 . THR   A 1 260 ? 12.98800 7.29100  7.00400   1.000 19.35000  ?  265 THR   A HG21 1 
ATOM   3828 H HG22 . THR   A 1 260 ? 11.98100 8.33600  6.38200   1.000 19.35000  ?  265 THR   A HG22 1 
ATOM   3829 H HG23 . THR   A 1 260 ? 12.68100 8.64000  7.76500   1.000 19.35000  ?  265 THR   A HG23 1 
ATOM   3830 N N    . ARG   A 1 261 ? 8.22700  6.59100  8.64300   1.000 15.22814  ?  266 ARG   A N    1 
ATOM   3831 C CA   . ARG   A 1 261 ? 7.40600  5.70300  9.45300   1.000 15.61240  ?  266 ARG   A CA   1 
ATOM   3832 C C    . ARG   A 1 261 ? 7.17200  4.44400  8.61500   1.000 15.38342  ?  266 ARG   A C    1 
ATOM   3833 O O    . ARG   A 1 261 ? 7.46700  4.40600  7.41000   1.000 15.80716  ?  266 ARG   A O    1 
ATOM   3834 C CB   . ARG   A 1 261 ? 6.07900  6.37400  9.89600   1.000 17.06784  ?  266 ARG   A CB   1 
ATOM   3835 C CG   . ARG   A 1 261 ? 5.10300  6.65300  8.77000   1.000 18.17850  ?  266 ARG   A CG   1 
ATOM   3836 C CD   . ARG   A 1 261 ? 3.79200  7.38000  9.18800   1.000 21.26571  ?  266 ARG   A CD   1 
ATOM   3837 N NE   . ARG   A 1 261 ? 2.74000  7.20400  8.17800   1.000 25.73993  ?  266 ARG   A NE   1 
ATOM   3838 C CZ   . ARG   A 1 261 ? 2.25500  8.10000  7.31300   1.000 28.42972  ?  266 ARG   A CZ   1 
ATOM   3839 N NH1  . ARG   A 1 261 ? 2.75300  9.32700  7.18400   1.000 24.66348  ?  266 ARG   A NH1  1 
ATOM   3840 N NH2  . ARG   A 1 261 ? 1.20000  7.76700  6.57600   1.000 32.97237  ?  266 ARG   A NH2  1 
ATOM   3841 H H    . ARG   A 1 261 ? 8.17000  6.43100  7.80100   1.000 18.32000  ?  266 ARG   A H    1 
ATOM   3842 H HA   . ARG   A 1 261 ? 7.87000  5.45800  10.26900  1.000 18.78000  ?  266 ARG   A HA   1 
ATOM   3843 H HB2  . ARG   A 1 261 ? 5.63400  5.79000  10.52900  1.000 20.53000  ?  266 ARG   A HB2  1 
ATOM   3844 H HB3  . ARG   A 1 261 ? 6.28900  7.22300  10.31700  1.000 20.53000  ?  266 ARG   A HB3  1 
ATOM   3845 H HG2  . ARG   A 1 261 ? 5.54500  7.21300  8.11200   1.000 21.87000  ?  266 ARG   A HG2  1 
ATOM   3846 H HG3  . ARG   A 1 261 ? 4.84800  5.80800  8.36900   1.000 21.87000  ?  266 ARG   A HG3  1 
ATOM   3847 H HD2  . ARG   A 1 261 ? 3.47500  7.01400  10.02800  1.000 25.57000  ?  266 ARG   A HD2  1 
ATOM   3848 H HD3  . ARG   A 1 261 ? 3.96700  8.32900  9.28500   1.000 25.57000  ?  266 ARG   A HD3  1 
ATOM   3849 H HE   . ARG   A 1 261 ? 2.38900  6.42000  8.13900   1.000 30.93000  ?  266 ARG   A HE   1 
ATOM   3850 H HH11 . ARG   A 1 261 ? 3.41800  9.57500  7.67100   1.000 29.65000  ?  266 ARG   A HH11 1 
ATOM   3851 H HH12 . ARG   A 1 261 ? 2.41100  9.87300  6.61500   1.000 29.65000  ?  266 ARG   A HH12 1 
ATOM   3852 H HH21 . ARG   A 1 261 ? 0.84400  6.98800  6.66100   1.000 39.62000  ?  266 ARG   A HH21 1 
ATOM   3853 H HH22 . ARG   A 1 261 ? 0.87300  8.32900  6.01300   1.000 39.62000  ?  266 ARG   A HH22 1 
ATOM   3854 N N    . ALA   A 1 262 ? 6.65300  3.40600  9.26000   1.000 15.54660  ?  267 ALA   A N    1 
ATOM   3855 C CA   . ALA   A 1 262 ? 6.46300  2.11000  8.63000   1.000 15.70978  ?  267 ALA   A CA   1 
ATOM   3856 C C    . ALA   A 1 262 ? 5.28000  1.43200  9.29800   1.000 15.90717  ?  267 ALA   A C    1 
ATOM   3857 O O    . ALA   A 1 262 ? 4.91200  1.78600  10.42300  1.000 15.53344  ?  267 ALA   A O    1 
ATOM   3858 C CB   . ALA   A 1 262 ? 7.72000  1.23700  8.73600   1.000 17.10731  ?  267 ALA   A CB   1 
ATOM   3859 H H    . ALA   A 1 262 ? 6.39700  3.43100  10.08000  1.000 18.71000  ?  267 ALA   A H    1 
ATOM   3860 H HA   . ALA   A 1 262 ? 6.26100  2.22800  7.68900   1.000 18.90000  ?  267 ALA   A HA   1 
ATOM   3861 H HB1  . ALA   A 1 262 ? 7.54900  0.38400  8.30700   1.000 20.58000  ?  267 ALA   A HB1  1 
ATOM   3862 H HB2  . ALA   A 1 262 ? 8.45600  1.68800  8.29200   1.000 20.58000  ?  267 ALA   A HB2  1 
ATOM   3863 H HB3  . ALA   A 1 262 ? 7.93200  1.10000  9.67200   1.000 20.58000  ?  267 ALA   A HB3  1 
ATOM   3864 N N    . PRO   A 1 263 ? 4.65300  0.46100  8.63700   1.000 16.04929  ?  268 PRO   A N    1 
ATOM   3865 C CA   . PRO   A 1 263 ? 3.34000  -0.00700 9.10700   1.000 15.54134  ?  268 PRO   A CA   1 
ATOM   3866 C C    . PRO   A 1 263 ? 3.36900  -0.86800 10.35500  1.000 15.02022  ?  268 PRO   A C    1 
ATOM   3867 O O    . PRO   A 1 263 ? 2.36800  -0.89300 11.08300  1.000 15.70978  ?  268 PRO   A O    1 
ATOM   3868 C CB   . PRO   A 1 263 ? 2.78400  -0.78200 7.90400   1.000 16.67832  ?  268 PRO   A CB   1 
ATOM   3869 C CG   . PRO   A 1 263 ? 3.96700  -1.09600 7.04800   1.000 19.00228  ?  268 PRO   A CG   1 
ATOM   3870 C CD   . PRO   A 1 263 ? 4.94300  -0.00100 7.27500   1.000 16.62305  ?  268 PRO   A CD   1 
ATOM   3871 H HA   . PRO   A 1 263 ? 2.78500  0.76800  9.28600   1.000 18.70000  ?  268 PRO   A HA   1 
ATOM   3872 H HB2  . PRO   A 1 263 ? 2.35300  -1.59600 8.20900   1.000 20.06000  ?  268 PRO   A HB2  1 
ATOM   3873 H HB3  . PRO   A 1 263 ? 2.14700  -0.23000 7.42300   1.000 20.06000  ?  268 PRO   A HB3  1 
ATOM   3874 H HG2  . PRO   A 1 263 ? 4.34300  -1.95000 7.31300   1.000 22.85000  ?  268 PRO   A HG2  1 
ATOM   3875 H HG3  . PRO   A 1 263 ? 3.69700  -1.12700 6.11700   1.000 22.85000  ?  268 PRO   A HG3  1 
ATOM   3876 H HD2  . PRO   A 1 263 ? 5.85200  -0.33500 7.21300   1.000 20.00000  ?  268 PRO   A HD2  1 
ATOM   3877 H HD3  . PRO   A 1 263 ? 4.80800  0.71500  6.63500   1.000 20.00000  ?  268 PRO   A HD3  1 
ATOM   3878 N N    . ASN   A 1 264 ? 4.44700  -1.60100 10.61600  1.000 14.78072  ?  269 ASN   A N    1 
ATOM   3879 C CA   . ASN   A 1 264 ? 4.46600  -2.59600 11.67100  1.000 15.90980  ?  269 ASN   A CA   1 
ATOM   3880 C C    . ASN   A 1 264 ? 5.23500  -2.10000 12.87300  1.000 15.59397  ?  269 ASN   A C    1 
ATOM   3881 O O    . ASN   A 1 264 ? 6.26700  -1.44500 12.72700  1.000 15.64398  ?  269 ASN   A O    1 
ATOM   3882 C CB   . ASN   A 1 264 ? 5.11100  -3.88100 11.18600  1.000 17.83372  ?  269 ASN   A CB   1 
ATOM   3883 C CG   . ASN   A 1 264 ? 4.42300  -4.43000 9.98500   1.000 21.03936  ?  269 ASN   A CG   1 
ATOM   3884 O OD1  . ASN   A 1 264 ? 3.20200  -4.63400 9.99000   1.000 21.84736  ?  269 ASN   A OD1  1 
ATOM   3885 N ND2  . ASN   A 1 264 ? 5.18100  -4.60400 8.91500   1.000 23.44755  ?  269 ASN   A ND2  1 
ATOM   3886 H H    . ASN   A 1 264 ? 5.19000  -1.53500 10.18700  1.000 17.79000  ?  269 ASN   A H    1 
ATOM   3887 H HA   . ASN   A 1 264 ? 3.55100  -2.77200 11.94100  1.000 19.15000  ?  269 ASN   A HA   1 
ATOM   3888 H HB2  . ASN   A 1 264 ? 6.03600  -3.70600 10.95200  1.000 21.45000  ?  269 ASN   A HB2  1 
ATOM   3889 H HB3  . ASN   A 1 264 ? 5.06800  -4.54700 11.89000  1.000 21.45000  ?  269 ASN   A HB3  1 
ATOM   3890 H HD21 . ASN   A 1 264 ? 4.83800  -4.91800 8.19200   1.000 28.18000  ?  269 ASN   A HD21 1 
ATOM   3891 H HD22 . ASN   A 1 264 ? 6.01700  -4.40300 8.94300   1.000 28.18000  ?  269 ASN   A HD22 1 
ATOM   3892 N N    . LYS   A 1 265 ? 4.77900  -2.48700 14.06900  1.000 15.18866  ?  270 LYS   A N    1 
ATOM   3893 C CA   . LYS   A 1 265 ? 5.40300  -1.96000 15.28200  1.000 16.18089  ?  270 LYS   A CA   1 
ATOM   3894 C C    . LYS   A 1 265 ? 6.88900  -2.30400 15.33000  1.000 17.08363  ?  270 LYS   A C    1 
ATOM   3895 O O    . LYS   A 1 265 ? 7.70800  -1.48400 15.75400  1.000 17.59158  ?  270 LYS   A O    1 
ATOM   3896 C CB   . LYS   A 1 265 ? 4.67900  -2.46600 16.53500  1.000 16.35722  ?  270 LYS   A CB   1 
ATOM   3897 C CG   . LYS   A 1 265 ? 5.17500  -1.79100 17.80100  1.000 18.12586  ?  270 LYS   A CG   1 
ATOM   3898 C CD   . LYS   A 1 265 ? 4.36500  -2.17600 19.01300  1.000 20.24980  ?  270 LYS   A CD   1 
ATOM   3899 C CE   . LYS   A 1 265 ? 4.90900  -1.56100 20.30400  1.000 22.73167  ?  270 LYS   A CE   1 
ATOM   3900 N NZ   . LYS   A 1 265 ? 4.01700  -1.90700 21.45200  1.000 26.11629  ?  270 LYS   A NZ   1 
ATOM   3901 H H    . LYS   A 1 265 ? 4.13100  -3.03700 14.20000  1.000 18.28000  ?  270 LYS   A H    1 
ATOM   3902 H HA   . LYS   A 1 265 ? 5.31800  -0.99400 15.27500  1.000 19.46000  ?  270 LYS   A HA   1 
ATOM   3903 H HB2  . LYS   A 1 265 ? 3.73000  -2.28500 16.44900  1.000 19.68000  ?  270 LYS   A HB2  1 
ATOM   3904 H HB3  . LYS   A 1 265 ? 4.82800  -3.42100 16.62400  1.000 19.68000  ?  270 LYS   A HB3  1 
ATOM   3905 H HG2  . LYS   A 1 265 ? 6.09600  -2.05000 17.96000  1.000 21.80000  ?  270 LYS   A HG2  1 
ATOM   3906 H HG3  . LYS   A 1 265 ? 5.11500  -0.82900 17.69200  1.000 21.80000  ?  270 LYS   A HG3  1 
ATOM   3907 H HD2  . LYS   A 1 265 ? 3.45300  -1.86800 18.89600  1.000 24.35000  ?  270 LYS   A HD2  1 
ATOM   3908 H HD3  . LYS   A 1 265 ? 4.38000  -3.14100 19.11100  1.000 24.35000  ?  270 LYS   A HD3  1 
ATOM   3909 H HE2  . LYS   A 1 265 ? 5.79600  -1.91000 20.48300  1.000 27.33000  ?  270 LYS   A HE2  1 
ATOM   3910 H HE3  . LYS   A 1 265 ? 4.94400  -0.59600 20.21600  1.000 27.33000  ?  270 LYS   A HE3  1 
ATOM   3911 H HZ1  . LYS   A 1 265 ? 4.37400  -1.61500 22.21300  1.000 31.39000  ?  270 LYS   A HZ1  1 
ATOM   3912 H HZ2  . LYS   A 1 265 ? 3.22000  -1.52700 21.34300  1.000 31.39000  ?  270 LYS   A HZ2  1 
ATOM   3913 H HZ3  . LYS   A 1 265 ? 3.91200  -2.78900 21.50100  1.000 31.39000  ?  270 LYS   A HZ3  1 
ATOM   3914 N N    . ASP   A 1 266 ? 7.25500  -3.49500 14.88200  1.000 17.83372  ?  271 ASP   A N    1 
ATOM   3915 C CA   . ASP   A 1 266 ? 8.64300  -3.92200 14.95900  1.000 19.61814  ?  271 ASP   A CA   1 
ATOM   3916 C C    . ASP   A 1 266 ? 9.44300  -3.62200 13.69100  1.000 18.09691  ?  271 ASP   A C    1 
ATOM   3917 O O    . ASP   A 1 266 ? 10.59600 -4.06100 13.57800  1.000 19.44970  ?  271 ASP   A O    1 
ATOM   3918 C CB   . ASP   A 1 266 ? 8.74200  -5.38700 15.38600  1.000 23.74232  ?  271 ASP   A CB   1 
ATOM   3919 C CG   . ASP   A 1 266 ? 8.41900  -6.34300 14.29000  1.000 28.87188  ?  271 ASP   A CG   1 
ATOM   3920 O OD1  . ASP   A 1 266 ? 7.74000  -5.94600 13.32900  1.000 31.34850  ?  271 ASP   A OD1  1 
ATOM   3921 O OD2  . ASP   A 1 266 ? 8.85100  -7.51500 14.39800  1.000 32.90921  -1 271 ASP   A OD2  1 
ATOM   3922 H H    . ASP   A 1 266 ? 6.72100  -4.07100 14.53200  1.000 21.45000  ?  271 ASP   A H    1 
ATOM   3923 H HA   . ASP   A 1 266 ? 9.08000  -3.41900 15.66500  1.000 23.59000  ?  271 ASP   A HA   1 
ATOM   3924 H HB2  . ASP   A 1 266 ? 9.64800  -5.56800 15.68100  1.000 28.54000  ?  271 ASP   A HB2  1 
ATOM   3925 H HB3  . ASP   A 1 266 ? 8.11800  -5.54500 16.11200  1.000 28.54000  ?  271 ASP   A HB3  1 
ATOM   3926 N N    . ASP   A 1 267 ? 8.89600  -2.85400 12.75200  1.000 18.08112  ?  272 ASP   A N    1 
ATOM   3927 C CA   . ASP   A 1 267 ? 9.70600  -2.41900 11.61700  1.000 17.84161  ?  272 ASP   A CA   1 
ATOM   3928 C C    . ASP   A 1 267 ? 10.83500 -1.52700 12.11300  1.000 19.27073  ?  272 ASP   A C    1 
ATOM   3929 O O    . ASP   A 1 267 ? 10.63500 -0.66000 12.96800  1.000 20.35507  ?  272 ASP   A O    1 
ATOM   3930 C CB   . ASP   A 1 267 ? 8.85800  -1.63300 10.61700  1.000 18.64171  ?  272 ASP   A CB   1 
ATOM   3931 C CG   . ASP   A 1 267 ? 8.00200  -2.52600 9.73300   1.000 19.24441  ?  272 ASP   A CG   1 
ATOM   3932 O OD1  . ASP   A 1 267 ? 8.27800  -3.73100 9.62800   1.000 21.29466  ?  272 ASP   A OD1  1 
ATOM   3933 O OD2  . ASP   A 1 267 ? 7.02800  -2.00900 9.15200   1.000 17.97584  -1 272 ASP   A OD2  1 
ATOM   3934 H H    . ASP   A 1 267 ? 8.08100  -2.57900 12.74800  1.000 21.75000  ?  272 ASP   A H    1 
ATOM   3935 H HA   . ASP   A 1 267 ? 10.07000 -3.19700 11.16600  1.000 21.46000  ?  272 ASP   A HA   1 
ATOM   3936 H HB2  . ASP   A 1 267 ? 8.26600  -1.03900 11.10400  1.000 22.42000  ?  272 ASP   A HB2  1 
ATOM   3937 H HB3  . ASP   A 1 267 ? 9.44500  -1.11800 10.04200  1.000 22.42000  ?  272 ASP   A HB3  1 
ATOM   3938 N N    . LYS   A 1 268 ? 12.02800 -1.71500 11.55800  1.000 21.37362  ?  273 LYS   A N    1 
ATOM   3939 C CA   . LYS   A 1 268 ? 13.18100 -0.95600 12.02500  1.000 22.57902  ?  273 LYS   A CA   1 
ATOM   3940 C C    . LYS   A 1 268 ? 13.31400 0.36100  11.27200  1.000 20.37613  ?  273 LYS   A C    1 
ATOM   3941 O O    . LYS   A 1 268 ? 12.96800 0.45900  10.09100  1.000 20.28927  ?  273 LYS   A O    1 
ATOM   3942 C CB   . LYS   A 1 268 ? 14.45300 -1.78100 11.85900  1.000 26.40843  ?  273 LYS   A CB   1 
ATOM   3943 C CG   . LYS   A 1 268 ? 14.48000 -3.03800 12.72300  1.000 30.65104  ?  273 LYS   A CG   1 
ATOM   3944 C CD   . LYS   A 1 268 ? 15.84800 -3.48900 13.08300  1.000 34.68047  ?  273 LYS   A CD   1 
ATOM   3945 C CE   . LYS   A 1 268 ? 15.81700 -4.61000 14.12700  1.000 37.62820  ?  273 LYS   A CE   1 
ATOM   3946 N NZ   . LYS   A 1 268 ? 14.90900 -5.71400 13.69800  1.000 39.49684  ?  273 LYS   A NZ   1 
ATOM   3947 H H    . LYS   A 1 268 ? 12.19200 -2.26800 10.92000  1.000 25.70000  ?  273 LYS   A H    1 
ATOM   3948 H HA   . LYS   A 1 268 ? 13.06200 -0.74400 12.96400  1.000 27.15000  ?  273 LYS   A HA   1 
ATOM   3949 H HB2  . LYS   A 1 268 ? 14.52900 -2.05500 10.93200  1.000 31.74000  ?  273 LYS   A HB2  1 
ATOM   3950 H HB3  . LYS   A 1 268 ? 15.21500 -1.23300 12.10600  1.000 31.74000  ?  273 LYS   A HB3  1 
ATOM   3951 H HG2  . LYS   A 1 268 ? 14.00200 -2.86100 13.54800  1.000 36.83000  ?  273 LYS   A HG2  1 
ATOM   3952 H HG3  . LYS   A 1 268 ? 14.05000 -3.76000 12.23800  1.000 36.83000  ?  273 LYS   A HG3  1 
ATOM   3953 H HD2  . LYS   A 1 268 ? 16.29500 -3.82400 12.29000  1.000 41.67000  ?  273 LYS   A HD2  1 
ATOM   3954 H HD3  . LYS   A 1 268 ? 16.34500 -2.74200 13.45300  1.000 41.67000  ?  273 LYS   A HD3  1 
ATOM   3955 H HE2  . LYS   A 1 268 ? 16.71000 -4.97300 14.23900  1.000 45.20000  ?  273 LYS   A HE2  1 
ATOM   3956 H HE3  . LYS   A 1 268 ? 15.49400 -4.25700 14.97100  1.000 45.20000  ?  273 LYS   A HE3  1 
ATOM   3957 H HZ1  . LYS   A 1 268 ? 15.13700 -5.99700 12.88600  1.000 47.45000  ?  273 LYS   A HZ1  1 
ATOM   3958 H HZ2  . LYS   A 1 268 ? 14.96800 -6.39500 14.26800  1.000 47.45000  ?  273 LYS   A HZ2  1 
ATOM   3959 H HZ3  . LYS   A 1 268 ? 14.06800 -5.42600 13.67800  1.000 47.45000  ?  273 LYS   A HZ3  1 
ATOM   3960 N N    . HIS   A 1 269 ? 13.76200 1.39200  11.98300  1.000 19.18651  ?  274 HIS   A N    1 
ATOM   3961 C CA   . HIS   A 1 269 ? 14.12600 2.63200  11.31900  1.000 18.56012  ?  274 HIS   A CA   1 
ATOM   3962 C C    . HIS   A 1 269 ? 15.46000 2.43900  10.60400  1.000 18.44695  ?  274 HIS   A C    1 
ATOM   3963 O O    . HIS   A 1 269 ? 16.18100 1.45100  10.81700  1.000 19.52076  ?  274 HIS   A O    1 
ATOM   3964 C CB   . HIS   A 1 269 ? 14.17400 3.80100  12.30700  1.000 18.84173  ?  274 HIS   A CB   1 
ATOM   3965 C CG   . HIS   A 1 269 ? 15.42600 3.85000  13.13800  1.000 19.42338  ?  274 HIS   A CG   1 
ATOM   3966 N ND1  . HIS   A 1 269 ? 15.63300 3.02600  14.22500  1.000 21.59469  ?  274 HIS   A ND1  1 
ATOM   3967 C CD2  . HIS   A 1 269 ? 16.52600 4.63800  13.05000  1.000 20.38139  ?  274 HIS   A CD2  1 
ATOM   3968 C CE1  . HIS   A 1 269 ? 16.82400 3.27900  14.74700  1.000 22.36321  ?  274 HIS   A CE1  1 
ATOM   3969 N NE2  . HIS   A 1 269 ? 17.38000 4.25900  14.05800  1.000 21.03936  ?  274 HIS   A NE2  1 
ATOM   3970 H H    A HIS   A 1 269 ? 13.86300 1.39600  12.83700  0.640 23.07000  ?  274 HIS   A H    1 
ATOM   3971 H H    B HIS   A 1 269 ? 13.86300 1.39600  12.83700  0.360 23.07000  ?  274 HIS   A H    1 
ATOM   3972 H HA   . HIS   A 1 269 ? 13.45400 2.86800  10.66000  1.000 22.32000  ?  274 HIS   A HA   1 
ATOM   3973 H HB2  . HIS   A 1 269 ? 14.11800 4.63100  11.80900  1.000 22.66000  ?  274 HIS   A HB2  1 
ATOM   3974 H HB3  . HIS   A 1 269 ? 13.42100 3.72700  12.91300  1.000 22.66000  ?  274 HIS   A HB3  1 
ATOM   3975 H HD2  . HIS   A 1 269 ? 16.67400 5.31000  12.42500  1.000 24.51000  ?  274 HIS   A HD2  1 
ATOM   3976 H HE1  . HIS   A 1 269 ? 17.20300 2.84200  15.47500  1.000 26.89000  ?  274 HIS   A HE1  1 
ATOM   3977 H HE2  . HIS   A 1 269 ? 18.15200 4.60500  14.21500  1.000 25.30000  ?  274 HIS   A HE2  1 
ATOM   3978 N N    . SER   A 1 270 ? 15.76600 3.37900  9.71700   1.000 18.24692  ?  275 SER   A N    1 
ATOM   3979 C CA   . SER   A 1 270 ? 17.01800 3.35600  8.96400   1.000 17.94689  ?  275 SER   A CA   1 
ATOM   3980 C C    . SER   A 1 270 ? 17.62000 4.75300  8.91700   1.000 17.73634  ?  275 SER   A C    1 
ATOM   3981 O O    . SER   A 1 270 ? 17.01700 5.68000  8.36900   1.000 18.05480  ?  275 SER   A O    1 
ATOM   3982 C CB   . SER   A 1 270 ? 16.78900 2.85300  7.54000   1.000 18.92859  ?  275 SER   A CB   1 
ATOM   3983 O OG   . SER   A 1 270 ? 17.99500 3.03800  6.80900   1.000 20.20769  ?  275 SER   A OG   1 
ATOM   3984 H H    . SER   A 1 270 ? 15.25900 4.04800  9.53000   1.000 21.95000  ?  275 SER   A H    1 
ATOM   3985 H HA   . SER   A 1 270 ? 17.64100 2.77200  9.42400   1.000 21.59000  ?  275 SER   A HA   1 
ATOM   3986 H HB2  . SER   A 1 270 ? 16.56000 1.91100  7.55900   1.000 22.76000  ?  275 SER   A HB2  1 
ATOM   3987 H HB3  . SER   A 1 270 ? 16.07400 3.36000  7.12500   1.000 22.76000  ?  275 SER   A HB3  1 
ATOM   3988 H HG   . SER   A 1 270 ? 18.03000 2.49400  6.17000   1.000 24.30000  ?  275 SER   A HG   1 
ATOM   3989 N N    . GLU   A 1 271 ? 18.84700 4.89500  9.43900   1.000 17.37577  ?  276 GLU   A N    1 
ATOM   3990 C CA   . GLU   A 1 271 ? 19.56400 6.14700  9.25700   1.000 17.37577  ?  276 GLU   A CA   1 
ATOM   3991 C C    . GLU   A 1 271 ? 19.95100 6.32700  7.80000   1.000 17.35208  ?  276 GLU   A C    1 
ATOM   3992 O O    . GLU   A 1 271 ? 19.87100 7.43800  7.26600   1.000 17.67054  ?  276 GLU   A O    1 
ATOM   3993 C CB   . GLU   A 1 271 ? 20.79100 6.20300  10.15900  1.000 18.71014  ?  276 GLU   A CB   1 
ATOM   3994 C CG   . GLU   A 1 271 ? 20.42000 6.07900  11.62800  1.000 19.41022  ?  276 GLU   A CG   1 
ATOM   3995 C CD   . GLU   A 1 271 ? 21.47600 6.65100  12.53300  1.000 18.53906  ?  276 GLU   A CD   1 
ATOM   3996 O OE1  . GLU   A 1 271 ? 22.50000 5.97600  12.74800  1.000 20.06556  ?  276 GLU   A OE1  1 
ATOM   3997 O OE2  . GLU   A 1 271 ? 21.31200 7.78700  12.99000  1.000 18.62065  -1 276 GLU   A OE2  1 
ATOM   3998 H H    . GLU   A 1 271 ? 19.26800 4.29400  9.88800   1.000 20.90000  ?  276 GLU   A H    1 
ATOM   3999 H HA   . GLU   A 1 271 ? 18.98900 6.88300  9.51800   1.000 20.90000  ?  276 GLU   A HA   1 
ATOM   4000 H HB2  . GLU   A 1 271 ? 21.38700 5.47200  9.93200   1.000 22.50000  ?  276 GLU   A HB2  1 
ATOM   4001 H HB3  . GLU   A 1 271 ? 21.24300 7.05100  10.03000  1.000 22.50000  ?  276 GLU   A HB3  1 
ATOM   4002 H HG2  . GLU   A 1 271 ? 19.59200 6.55800  11.78900  1.000 23.34000  ?  276 GLU   A HG2  1 
ATOM   4003 H HG3  . GLU   A 1 271 ? 20.30800 5.14100  11.85000  1.000 23.34000  ?  276 GLU   A HG3  1 
ATOM   4004 N N    . ALA   A 1 272 ? 20.37000 5.24000  7.14000   1.000 18.46800  ?  277 ALA   A N    1 
ATOM   4005 C CA   . ALA   A 1 272 ? 20.83500 5.33500  5.75800   1.000 18.86279  ?  277 ALA   A CA   1 
ATOM   4006 C C    . ALA   A 1 272 ? 19.73000 5.83100  4.83400   1.000 18.59697  ?  277 ALA   A C    1 
ATOM   4007 O O    . ALA   A 1 272 ? 19.99400 6.56100  3.87200   1.000 18.00216  ?  277 ALA   A O    1 
ATOM   4008 C CB   . ALA   A 1 272 ? 21.33000 3.96800  5.29700   1.000 20.81829  ?  277 ALA   A CB   1 
ATOM   4009 H H    . ALA   A 1 272 ? 20.39400 4.44600  7.46900   1.000 22.21000  ?  277 ALA   A H    1 
ATOM   4010 H HA   . ALA   A 1 272 ? 21.57000 5.96700  5.71300   1.000 22.68000  ?  277 ALA   A HA   1 
ATOM   4011 H HB1  . ALA   A 1 272 ? 21.64400 4.03800  4.38200   1.000 25.03000  ?  277 ALA   A HB1  1 
ATOM   4012 H HB2  . ALA   A 1 272 ? 22.05600 3.68400  5.87500   1.000 25.03000  ?  277 ALA   A HB2  1 
ATOM   4013 H HB3  . ALA   A 1 272 ? 20.59900 3.33400  5.34800   1.000 25.03000  ?  277 ALA   A HB3  1 
ATOM   4014 N N    . VAL   A 1 273 ? 18.48300 5.43400  5.10000   1.000 18.63118  ?  278 VAL   A N    1 
ATOM   4015 C CA   . VAL   A 1 273 ? 17.38200 5.91100  4.27100   1.000 19.24441  ?  278 VAL   A CA   1 
ATOM   4016 C C    . VAL   A 1 273 ? 17.18300 7.41100  4.43700   1.000 18.19165  ?  278 VAL   A C    1 
ATOM   4017 O O    . VAL   A 1 273 ? 16.86400 8.11300  3.47200   1.000 18.21534  ?  278 VAL   A O    1 
ATOM   4018 C CB   . VAL   A 1 273 ? 16.10300 5.12400  4.59400   1.000 22.12634  ?  278 VAL   A CB   1 
ATOM   4019 C CG1  . VAL   A 1 273 ? 14.89700 5.72500  3.91400   1.000 24.53452  ?  278 VAL   A CG1  1 
ATOM   4020 C CG2  . VAL   A 1 273 ? 16.25200 3.68000  4.19400   1.000 23.77390  ?  278 VAL   A CG2  1 
ATOM   4021 H H    . VAL   A 1 273 ? 18.25700 4.90300  5.73800   1.000 22.40000  ?  278 VAL   A H    1 
ATOM   4022 H HA   . VAL   A 1 273 ? 17.60700 5.75200  3.34100   1.000 23.14000  ?  278 VAL   A HA   1 
ATOM   4023 H HB   . VAL   A 1 273 ? 15.96100 5.17000  5.55300   1.000 26.60000  ?  278 VAL   A HB   1 
ATOM   4024 H HG11 . VAL   A 1 273 ? 14.16400 5.09100  3.95300   1.000 29.49000  ?  278 VAL   A HG11 1 
ATOM   4025 H HG12 . VAL   A 1 273 ? 14.65100 6.54300  4.37200   1.000 29.49000  ?  278 VAL   A HG12 1 
ATOM   4026 H HG13 . VAL   A 1 273 ? 15.11900 5.91700  2.98900   1.000 29.49000  ?  278 VAL   A HG13 1 
ATOM   4027 H HG21 . VAL   A 1 273 ? 15.52900 3.16700  4.58900   1.000 28.58000  ?  278 VAL   A HG21 1 
ATOM   4028 H HG22 . VAL   A 1 273 ? 16.21300 3.61400  3.22700   1.000 28.58000  ?  278 VAL   A HG22 1 
ATOM   4029 H HG23 . VAL   A 1 273 ? 17.10600 3.34900  4.51400   1.000 28.58000  ?  278 VAL   A HG23 1 
ATOM   4030 N N    . ILE   A 1 274 ? 17.35100 7.92700  5.65400   1.000 16.89676  ?  279 ILE   A N    1 
ATOM   4031 C CA   . ILE   A 1 274 ? 17.22100 9.36300  5.87700   1.000 17.12311  ?  279 ILE   A CA   1 
ATOM   4032 C C    . ILE   A 1 274 ? 18.32100 10.11500 5.13100   1.000 16.80991  ?  279 ILE   A C    1 
ATOM   4033 O O    . ILE   A 1 274 ? 18.06900 11.13400 4.47100   1.000 16.78359  ?  279 ILE   A O    1 
ATOM   4034 C CB   . ILE   A 1 274 ? 17.23400 9.66900  7.38900   1.000 17.15206  ?  279 ILE   A CB   1 
ATOM   4035 C CG1  . ILE   A 1 274 ? 15.96700 9.09500  8.03800   1.000 16.66516  ?  279 ILE   A CG1  1 
ATOM   4036 C CG2  . ILE   A 1 274 ? 17.32500 11.15800 7.64200   1.000 17.30997  ?  279 ILE   A CG2  1 
ATOM   4037 C CD1  . ILE   A 1 274 ? 15.94000 9.16700  9.53900   1.000 17.14416  ?  279 ILE   A CD1  1 
ATOM   4038 H H    . ILE   A 1 274 ? 17.53700 7.47200  6.35900   1.000 20.33000  ?  279 ILE   A H    1 
ATOM   4039 H HA   . ILE   A 1 274 ? 16.37000 9.66100  5.52200   1.000 20.60000  ?  279 ILE   A HA   1 
ATOM   4040 H HB   . ILE   A 1 274 ? 18.01700 9.25100  7.78100   1.000 20.63000  ?  279 ILE   A HB   1 
ATOM   4041 H HG12 . ILE   A 1 274 ? 15.20100 9.59100  7.70900   1.000 20.05000  ?  279 ILE   A HG12 1 
ATOM   4042 H HG13 . ILE   A 1 274 ? 15.89000 8.16100  7.79000   1.000 20.05000  ?  279 ILE   A HG13 1 
ATOM   4043 H HG21 . ILE   A 1 274 ? 17.07600 11.33800 8.56100   1.000 20.82000  ?  279 ILE   A HG21 1 
ATOM   4044 H HG22 . ILE   A 1 274 ? 18.23600 11.45100 7.48300   1.000 20.82000  ?  279 ILE   A HG22 1 
ATOM   4045 H HG23 . ILE   A 1 274 ? 16.72000 11.61800 7.03900   1.000 20.82000  ?  279 ILE   A HG23 1 
ATOM   4046 H HD11 . ILE   A 1 274 ? 15.16500 8.68400  9.86500   1.000 20.62000  ?  279 ILE   A HD11 1 
ATOM   4047 H HD12 . ILE   A 1 274 ? 16.75100 8.76600  9.88900   1.000 20.62000  ?  279 ILE   A HD12 1 
ATOM   4048 H HD13 . ILE   A 1 274 ? 15.88800 10.09700 9.81000   1.000 20.62000  ?  279 ILE   A HD13 1 
ATOM   4049 N N    . ALA   A 1 275 ? 19.56600 9.62000  5.22100   1.000 17.13890  ?  280 ALA   A N    1 
ATOM   4050 C CA   . ALA   A 1 275 ? 20.65700 10.23800 4.47500   1.000 16.57830  ?  280 ALA   A CA   1 
ATOM   4051 C C    . ALA   A 1 275 ? 20.39200 10.18500 2.98200   1.000 16.82307  ?  280 ALA   A C    1 
ATOM   4052 O O    . ALA   A 1 275 ? 20.63500 11.16400 2.26800   1.000 17.37050  ?  280 ALA   A O    1 
ATOM   4053 C CB   . ALA   A 1 275 ? 21.98200 9.54400  4.81500   1.000 17.48104  ?  280 ALA   A CB   1 
ATOM   4054 H H    . ALA   A 1 275 ? 19.79400 8.94200  5.69700   1.000 20.62000  ?  280 ALA   A H    1 
ATOM   4055 H HA   . ALA   A 1 275 ? 20.73200 11.16900 4.73600   1.000 19.94000  ?  280 ALA   A HA   1 
ATOM   4056 H HB1  . ALA   A 1 275 ? 22.69900 9.97400  4.32200   1.000 21.02000  ?  280 ALA   A HB1  1 
ATOM   4057 H HB2  . ALA   A 1 275 ? 22.14400 9.62100  5.76800   1.000 21.02000  ?  280 ALA   A HB2  1 
ATOM   4058 H HB3  . ALA   A 1 275 ? 21.92200 8.60900  4.56400   1.000 21.02000  ?  280 ALA   A HB3  1 
ATOM   4059 N N    . ALA   A 1 276 ? 19.91200 9.04300  2.48900   1.000 17.16258  ?  281 ALA   A N    1 
ATOM   4060 C CA   . ALA   A 1 276 ? 19.65300 8.91500  1.05700   1.000 17.77582  ?  281 ALA   A CA   1 
ATOM   4061 C C    . ALA   A 1 276 ? 18.55200 9.87200  0.60000   1.000 17.14153  ?  281 ALA   A C    1 
ATOM   4062 O O    . ALA   A 1 276 ? 18.63200 10.45900 -0.48700  1.000 18.12059  ?  281 ALA   A O    1 
ATOM   4063 C CB   . ALA   A 1 276 ? 19.28100 7.47500  0.71300   1.000 18.48380  ?  281 ALA   A CB   1 
ATOM   4064 H H    . ALA   A 1 276 ? 19.73200 8.34100  2.95300   1.000 20.65000  ?  281 ALA   A H    1 
ATOM   4065 H HA   . ALA   A 1 276 ? 20.46600 9.14000  0.57800   1.000 21.38000  ?  281 ALA   A HA   1 
ATOM   4066 H HB1  . ALA   A 1 276 ? 19.10800 7.41200  -0.23900  1.000 22.23000  ?  281 ALA   A HB1  1 
ATOM   4067 H HB2  . ALA   A 1 276 ? 20.01800 6.89200  0.95500   1.000 22.23000  ?  281 ALA   A HB2  1 
ATOM   4068 H HB3  . ALA   A 1 276 ? 18.48600 7.22600  1.21100   1.000 22.23000  ?  281 ALA   A HB3  1 
ATOM   4069 N N    . ALA   A 1 277 ? 17.51100 10.03900 1.42400   1.000 17.18890  ?  282 ALA   A N    1 
ATOM   4070 C CA   . ALA   A 1 277 ? 16.44000 10.96700 1.08100   1.000 17.49157  ?  282 ALA   A CA   1 
ATOM   4071 C C    . ALA   A 1 277 ? 16.94700 12.40100 1.07400   1.000 17.31260  ?  282 ALA   A C    1 
ATOM   4072 O O    . ALA   A 1 277 ? 16.57500 13.18700 0.20400   1.000 17.27049  ?  282 ALA   A O    1 
ATOM   4073 C CB   . ALA   A 1 277 ? 15.28500 10.79200 2.06300   1.000 17.82845  ?  282 ALA   A CB   1 
ATOM   4074 H H    . ALA   A 1 277 ? 17.40700 9.63300  2.17500   1.000 20.68000  ?  282 ALA   A H    1 
ATOM   4075 H HA   . ALA   A 1 277 ? 16.10700 10.77000 0.19100   1.000 21.04000  ?  282 ALA   A HA   1 
ATOM   4076 H HB1  . ALA   A 1 277 ? 14.58600 11.42900 1.84700   1.000 21.45000  ?  282 ALA   A HB1  1 
ATOM   4077 H HB2  . ALA   A 1 277 ? 14.94200 9.88700  1.98900   1.000 21.45000  ?  282 ALA   A HB2  1 
ATOM   4078 H HB3  . ALA   A 1 277 ? 15.60900 10.95000 2.96400   1.000 21.45000  ?  282 ALA   A HB3  1 
ATOM   4079 N N    . ALA   A 1 278 ? 17.83100 12.75100 2.01600   1.000 16.55988  ?  283 ALA   A N    1 
ATOM   4080 C CA   . ALA   A 1 278 ? 18.42500 14.07600 2.01100   1.000 17.55210  ?  283 ALA   A CA   1 
ATOM   4081 C C    . ALA   A 1 278 ? 19.24600 14.30300 0.74500   1.000 17.74686  ?  283 ALA   A C    1 
ATOM   4082 O O    . ALA   A 1 278 ? 19.22200 15.39500 0.16300   1.000 18.08375  ?  283 ALA   A O    1 
ATOM   4083 C CB   . ALA   A 1 278 ? 19.31900 14.22900 3.24300   1.000 18.47590  ?  283 ALA   A CB   1 
ATOM   4084 H H    . ALA   A 1 278 ? 18.09500 12.24200 2.65600   1.000 19.92000  ?  283 ALA   A H    1 
ATOM   4085 H HA   . ALA   A 1 278 ? 17.72100 14.74300 2.04400   1.000 21.11000  ?  283 ALA   A HA   1 
ATOM   4086 H HB1  . ALA   A 1 278 ? 19.72200 15.11200 3.23400   1.000 22.22000  ?  283 ALA   A HB1  1 
ATOM   4087 H HB2  . ALA   A 1 278 ? 18.77900 14.12000 4.04100   1.000 22.22000  ?  283 ALA   A HB2  1 
ATOM   4088 H HB3  . ALA   A 1 278 ? 20.01100 13.55000 3.21800   1.000 22.22000  ?  283 ALA   A HB3  1 
ATOM   4089 N N    A ARG   A 1 279 ? 19.98400 13.28300 0.30500   0.430 17.98110  ?  284 ARG   A N    1 
ATOM   4090 N N    B ARG   A 1 279 ? 20.00000 13.29000 0.31600   0.570 17.86267  ?  284 ARG   A N    1 
ATOM   4091 C CA   A ARG   A 1 279 ? 20.78200 13.41600 -0.91100  0.430 18.87068  ?  284 ARG   A CA   1 
ATOM   4092 C CA   B ARG   A 1 279 ? 20.77600 13.42900 -0.91200  0.570 18.97596  ?  284 ARG   A CA   1 
ATOM   4093 C C    A ARG   A 1 279 ? 19.89300 13.65500 -2.12400  0.430 18.73383  ?  284 ARG   A C    1 
ATOM   4094 C C    B ARG   A 1 279 ? 19.86400 13.70100 -2.09800  0.570 18.91016  ?  284 ARG   A C    1 
ATOM   4095 O O    A ARG   A 1 279 ? 20.22000 14.47400 -2.99100  0.430 19.31547  ?  284 ARG   A O    1 
ATOM   4096 O O    B ARG   A 1 279 ? 20.14000 14.59300 -2.90900  0.570 19.81817  ?  284 ARG   A O    1 
ATOM   4097 C CB   A ARG   A 1 279 ? 21.63000 12.15900 -1.09600  0.430 19.85238  ?  284 ARG   A CB   1 
ATOM   4098 C CB   B ARG   A 1 279 ? 21.61300 12.17400 -1.15600  0.570 20.13926  ?  284 ARG   A CB   1 
ATOM   4099 C CG   A ARG   A 1 279 ? 22.41600 12.09900 -2.40100  0.430 20.74722  ?  284 ARG   A CG   1 
ATOM   4100 C CG   B ARG   A 1 279 ? 22.82800 12.06600 -0.25800  0.570 21.07095  ?  284 ARG   A CG   1 
ATOM   4101 C CD   A ARG   A 1 279 ? 23.20600 10.79000 -2.50500  0.430 23.12646  ?  284 ARG   A CD   1 
ATOM   4102 C CD   B ARG   A 1 279 ? 23.82800 11.00800 -0.73600  0.570 21.88947  ?  284 ARG   A CD   1 
ATOM   4103 N NE   A ARG   A 1 279 ? 23.66500 10.48700 -3.85700  0.430 25.76098  ?  284 ARG   A NE   1 
ATOM   4104 N NE   B ARG   A 1 279 ? 24.67100 10.63800 0.38900   0.570 23.17120  ?  284 ARG   A NE   1 
ATOM   4105 C CZ   A ARG   A 1 279 ? 24.93400 10.36400 -4.21800  0.430 28.41656  ?  284 ARG   A CZ   1 
ATOM   4106 C CZ   B ARG   A 1 279 ? 24.36500 9.70300  1.27500   0.570 22.99486  ?  284 ARG   A CZ   1 
ATOM   4107 N NH1  A ARG   A 1 279 ? 25.92600 10.54800 -3.35800  0.430 29.74567  ?  284 ARG   A NH1  1 
ATOM   4108 N NH1  B ARG   A 1 279 ? 23.34500 8.88100  1.08700   0.570 21.81841  ?  284 ARG   A NH1  1 
ATOM   4109 N NH2  A ARG   A 1 279 ? 25.21800 10.03600 -5.47300  0.430 29.60881  ?  284 ARG   A NH2  1 
ATOM   4110 N NH2  B ARG   A 1 279 ? 25.10500 9.58700  2.37600   0.570 24.31344  ?  284 ARG   A NH2  1 
ATOM   4111 H H    A ARG   A 1 279 ? 20.03900 12.51400 0.68700   0.430 21.62000  ?  284 ARG   A H    1 
ATOM   4112 H H    B ARG   A 1 279 ? 20.07700 12.52800 0.70800   0.570 21.49000  ?  284 ARG   A H    1 
ATOM   4113 H HA   A ARG   A 1 279 ? 21.37800 14.17700 -0.82800  0.430 22.69000  ?  284 ARG   A HA   1 
ATOM   4114 H HA   B ARG   A 1 279 ? 21.38700 14.17700 -0.81600  0.570 22.82000  ?  284 ARG   A HA   1 
ATOM   4115 H HB2  A ARG   A 1 279 ? 22.26900 12.11000 -0.36800  0.430 23.87000  ?  284 ARG   A HB2  1 
ATOM   4116 H HB2  B ARG   A 1 279 ? 21.05800 11.39500 -0.99900  0.570 24.22000  ?  284 ARG   A HB2  1 
ATOM   4117 H HB3  A ARG   A 1 279 ? 21.04200 11.38700 -1.07500  0.430 23.87000  ?  284 ARG   A HB3  1 
ATOM   4118 H HB3  B ARG   A 1 279 ? 21.92400 12.18100 -2.07500  0.570 24.22000  ?  284 ARG   A HB3  1 
ATOM   4119 H HG2  A ARG   A 1 279 ? 21.80300 12.14800 -3.15100  0.430 24.95000  ?  284 ARG   A HG2  1 
ATOM   4120 H HG2  B ARG   A 1 279 ? 23.28400 12.92200 -0.23900  0.570 25.34000  ?  284 ARG   A HG2  1 
ATOM   4121 H HG3  A ARG   A 1 279 ? 23.04200 12.84000 -2.43600  0.430 24.95000  ?  284 ARG   A HG3  1 
ATOM   4122 H HG3  B ARG   A 1 279 ? 22.53900 11.82300 0.63600   0.570 25.34000  ?  284 ARG   A HG3  1 
ATOM   4123 H HD2  A ARG   A 1 279 ? 23.98900 10.85100 -1.93400  0.430 27.80000  ?  284 ARG   A HD2  1 
ATOM   4124 H HD2  B ARG   A 1 279 ? 23.35600 10.22200 -1.05200  0.570 26.32000  ?  284 ARG   A HD2  1 
ATOM   4125 H HD3  A ARG   A 1 279 ? 22.63900 10.05900 -2.21400  0.430 27.80000  ?  284 ARG   A HD3  1 
ATOM   4126 H HD3  B ARG   A 1 279 ? 24.38300 11.37000 -1.44400  0.570 26.32000  ?  284 ARG   A HD3  1 
ATOM   4127 H HE   A ARG   A 1 279 ? 23.06600 10.38000 -4.46500  0.430 30.96000  ?  284 ARG   A HE   1 
ATOM   4128 H HE   B ARG   A 1 279 ? 25.41800 11.05400 0.48500   0.570 27.86000  ?  284 ARG   A HE   1 
ATOM   4129 H HH11 A ARG   A 1 279 ? 25.75400 10.75300 -2.54100  0.430 35.74000  ?  284 ARG   A HH11 1 
ATOM   4130 H HH11 B ARG   A 1 279 ? 22.86400 8.94800  0.37600   0.570 26.23000  ?  284 ARG   A HH11 1 
ATOM   4131 H HH12 A ARG   A 1 279 ? 26.74200 10.46200 -3.61700  0.430 35.74000  ?  284 ARG   A HH12 1 
ATOM   4132 H HH12 B ARG   A 1 279 ? 23.16200 8.28000  1.67400   0.570 26.23000  ?  284 ARG   A HH12 1 
ATOM   4133 H HH21 A ARG   A 1 279 ? 24.58300 9.90700  -6.03800  0.430 35.58000  ?  284 ARG   A HH21 1 
ATOM   4134 H HH21 B ARG   A 1 279 ? 25.77100 10.11500 2.50400   0.570 29.23000  ?  284 ARG   A HH21 1 
ATOM   4135 H HH22 A ARG   A 1 279 ? 26.03800 9.95300  -5.72100  0.430 35.58000  ?  284 ARG   A HH22 1 
ATOM   4136 H HH22 B ARG   A 1 279 ? 24.91600 8.98300  2.95900   0.570 29.23000  ?  284 ARG   A HH22 1 
ATOM   4137 N N    . LEU   A 1 280 ? 18.75200 12.96100 -2.19400  1.000 18.23903  ?  285 LEU   A N    1 
ATOM   4138 C CA   . LEU   A 1 280 ? 17.82400 13.17500 -3.29500  1.000 18.93122  ?  285 LEU   A CA   1 
ATOM   4139 C C    . LEU   A 1 280 ? 17.23100 14.57200 -3.24300  1.000 18.62855  ?  285 LEU   A C    1 
ATOM   4140 O O    . LEU   A 1 280 ? 17.03200 15.20600 -4.28600  1.000 18.99701  ?  285 LEU   A O    1 
ATOM   4141 C CB   . LEU   A 1 280 ? 16.70200 12.13500 -3.25900  1.000 19.58130  ?  285 LEU   A CB   1 
ATOM   4142 C CG   . LEU   A 1 280 ? 17.07000 10.69800 -3.59100  1.000 20.73670  ?  285 LEU   A CG   1 
ATOM   4143 C CD1  . LEU   A 1 280 ? 15.81200 9.84100  -3.58700  1.000 20.91303  ?  285 LEU   A CD1  1 
ATOM   4144 C CD2  . LEU   A 1 280 ? 17.75100 10.58900 -4.94000  1.000 21.61049  ?  285 LEU   A CD2  1 
ATOM   4145 H H    A LEU   A 1 280 ? 18.49900 12.37100 -1.62200  0.430 21.94000  ?  285 LEU   A H    1 
ATOM   4146 H H    B LEU   A 1 280 ? 18.52100 12.34300 -1.64200  0.570 21.94000  ?  285 LEU   A H    1 
ATOM   4147 H HA   . LEU   A 1 280 ? 18.30800 13.06900 -4.12900  1.000 22.76000  ?  285 LEU   A HA   1 
ATOM   4148 H HB2  . LEU   A 1 280 ? 16.33000 12.13100 -2.36300  1.000 23.54000  ?  285 LEU   A HB2  1 
ATOM   4149 H HB3  . LEU   A 1 280 ? 16.02400 12.40700 -3.89700  1.000 23.54000  ?  285 LEU   A HB3  1 
ATOM   4150 H HG   . LEU   A 1 280 ? 17.69400 10.37700 -2.92100  1.000 24.93000  ?  285 LEU   A HG   1 
ATOM   4151 H HD11 . LEU   A 1 280 ? 16.05300 8.92600  -3.80200  1.000 25.15000  ?  285 LEU   A HD11 1 
ATOM   4152 H HD12 . LEU   A 1 280 ? 15.40800 9.87800  -2.70600  1.000 25.15000  ?  285 LEU   A HD12 1 
ATOM   4153 H HD13 . LEU   A 1 280 ? 15.19300 10.18500 -4.25000  1.000 25.15000  ?  285 LEU   A HD13 1 
ATOM   4154 H HD21 . LEU   A 1 280 ? 17.82000 9.65200  -5.18400  1.000 25.98000  ?  285 LEU   A HD21 1 
ATOM   4155 H HD22 . LEU   A 1 280 ? 17.22200 11.06400 -5.60000  1.000 25.98000  ?  285 LEU   A HD22 1 
ATOM   4156 H HD23 . LEU   A 1 280 ? 18.63600 10.98100 -4.88000  1.000 25.98000  ?  285 LEU   A HD23 1 
ATOM   4157 N N    . ALA   A 1 281 ? 16.92900 15.06300 -2.03800  1.000 19.04176  ?  286 ALA   A N    1 
ATOM   4158 C CA   . ALA   A 1 281 ? 16.38000 16.40800 -1.90900  1.000 19.53129  ?  286 ALA   A CA   1 
ATOM   4159 C C    . ALA   A 1 281 ? 17.36900 17.45400 -2.41100  1.000 19.60498  ?  286 ALA   A C    1 
ATOM   4160 O O    . ALA   A 1 281 ? 16.99700 18.39200 -3.12500  1.000 19.88396  ?  286 ALA   A O    1 
ATOM   4161 C CB   . ALA   A 1 281 ? 15.99900 16.68900 -0.44900  1.000 19.93660  ?  286 ALA   A CB   1 
ATOM   4162 H H    . ALA   A 1 281 ? 17.03300 14.64400 -1.29400  1.000 22.90000  ?  286 ALA   A H    1 
ATOM   4163 H HA   . ALA   A 1 281 ? 15.57500 16.46400 -2.44700  1.000 23.49000  ?  286 ALA   A HA   1 
ATOM   4164 H HB1  . ALA   A 1 281 ? 15.62700 17.58300 -0.38700  1.000 23.98000  ?  286 ALA   A HB1  1 
ATOM   4165 H HB2  . ALA   A 1 281 ? 15.34100 16.03600 -0.16300  1.000 23.98000  ?  286 ALA   A HB2  1 
ATOM   4166 H HB3  . ALA   A 1 281 ? 16.79400 16.62200 0.10300   1.000 23.98000  ?  286 ALA   A HB3  1 
ATOM   4167 N N    . LEU   A 1 282 ? 18.64000 17.33200 -2.01000  1.000 19.66552  ?  287 LEU   A N    1 
ATOM   4168 C CA   . LEU   A 1 282 ? 19.64700 18.28500 -2.46800  1.000 20.77881  ?  287 LEU   A CA   1 
ATOM   4169 C C    . LEU   A 1 282 ? 19.82400 18.19000 -3.98000  1.000 20.93672  ?  287 LEU   A C    1 
ATOM   4170 O O    . LEU   A 1 282 ? 19.92400 19.21100 -4.66900  1.000 22.51849  ?  287 LEU   A O    1 
ATOM   4171 C CB   . LEU   A 1 282 ? 20.98000 18.04600 -1.73800  1.000 23.13172  ?  287 LEU   A CB   1 
ATOM   4172 C CG   . LEU   A 1 282 ? 20.95400 18.30700 -0.23300  1.000 24.96089  ?  287 LEU   A CG   1 
ATOM   4173 C CD1  . LEU   A 1 282 ? 22.23700 17.84000 0.45600   1.000 26.56634  ?  287 LEU   A CD1  1 
ATOM   4174 C CD2  . LEU   A 1 282 ? 20.74100 19.78400 0.01800   1.000 25.61886  ?  287 LEU   A CD2  1 
ATOM   4175 H H    . LEU   A 1 282 ? 18.93600 16.71900 -1.48400  1.000 23.65000  ?  287 LEU   A H    1 
ATOM   4176 H HA   . LEU   A 1 282 ? 19.35800 19.18500 -2.25100  1.000 24.98000  ?  287 LEU   A HA   1 
ATOM   4177 H HB2  . LEU   A 1 282 ? 21.23800 17.12000 -1.86800  1.000 27.81000  ?  287 LEU   A HB2  1 
ATOM   4178 H HB3  . LEU   A 1 282 ? 21.64900 18.63400 -2.12300  1.000 27.81000  ?  287 LEU   A HB3  1 
ATOM   4179 H HG   . LEU   A 1 282 ? 20.22400 17.79900 0.15400   1.000 30.00000  ?  287 LEU   A HG   1 
ATOM   4180 H HD11 . LEU   A 1 282 ? 22.16900 18.02100 1.40600   1.000 31.93000  ?  287 LEU   A HD11 1 
ATOM   4181 H HD12 . LEU   A 1 282 ? 22.34600 16.88700 0.30800   1.000 31.93000  ?  287 LEU   A HD12 1 
ATOM   4182 H HD13 . LEU   A 1 282 ? 22.99000 18.32100 0.08000   1.000 31.93000  ?  287 LEU   A HD13 1 
ATOM   4183 H HD21 . LEU   A 1 282 ? 20.82600 19.95800 0.96800   1.000 30.79000  ?  287 LEU   A HD21 1 
ATOM   4184 H HD22 . LEU   A 1 282 ? 21.41100 20.28700 -0.47200  1.000 30.79000  ?  287 LEU   A HD22 1 
ATOM   4185 H HD23 . LEU   A 1 282 ? 19.85400 20.03100 -0.28600  1.000 30.79000  ?  287 LEU   A HD23 1 
ATOM   4186 N N    . GLU   A 1 283 ? 19.84200 16.97100 -4.51500  1.000 21.03673  ?  288 GLU   A N    1 
ATOM   4187 C CA   . GLU   A 1 283 ? 19.91700 16.80400 -5.96100  1.000 22.11581  ?  288 GLU   A CA   1 
ATOM   4188 C C    . GLU   A 1 283 ? 18.72800 17.46900 -6.64000  1.000 21.71839  ?  288 GLU   A C    1 
ATOM   4189 O O    . GLU   A 1 283 ? 18.87900 18.14400 -7.66200  1.000 21.96053  ?  288 GLU   A O    1 
ATOM   4190 C CB   . GLU   A 1 283 ? 19.99100 15.31600 -6.30700  1.000 23.32911  ?  288 GLU   A CB   1 
ATOM   4191 C CG   . GLU   A 1 283 ? 21.33800 14.72200 -5.90800  1.000 27.40065  ?  288 GLU   A CG   1 
ATOM   4192 C CD   . GLU   A 1 283 ? 21.43600 13.22200 -6.06400  1.000 32.26966  ?  288 GLU   A CD   1 
ATOM   4193 O OE1  . GLU   A 1 283 ? 20.41300 12.56200 -6.30800  1.000 34.63047  ?  288 GLU   A OE1  1 
ATOM   4194 O OE2  . GLU   A 1 283 ? 22.56200 12.70000 -5.93800  1.000 34.95945  -1 288 GLU   A OE2  1 
ATOM   4195 H H    . GLU   A 1 283 ? 19.81300 16.23600 -4.06900  1.000 25.30000  ?  288 GLU   A H    1 
ATOM   4196 H HA   . GLU   A 1 283 ? 20.72400 17.22300 -6.29700  1.000 26.59000  ?  288 GLU   A HA   1 
ATOM   4197 H HB2  . GLU   A 1 283 ? 19.29300 14.84000 -5.83000  1.000 28.04000  ?  288 GLU   A HB2  1 
ATOM   4198 H HB3  . GLU   A 1 283 ? 19.87600 15.20200 -7.26300  1.000 28.04000  ?  288 GLU   A HB3  1 
ATOM   4199 H HG2  . GLU   A 1 283 ? 22.02600 15.11800 -6.46400  1.000 32.93000  ?  288 GLU   A HG2  1 
ATOM   4200 H HG3  . GLU   A 1 283 ? 21.50300 14.93000 -4.97600  1.000 32.93000  ?  288 GLU   A HG3  1 
ATOM   4201 N N    . GLY   A 1 284 ? 17.54100 17.32600 -6.05600  1.000 20.44456  ?  289 GLY   A N    1 
ATOM   4202 C CA   . GLY   A 1 284 ? 16.35500 17.93100 -6.63500  1.000 20.80513  ?  289 GLY   A CA   1 
ATOM   4203 C C    . GLY   A 1 284 ? 16.39400 19.44200 -6.65200  1.000 21.96579  ?  289 GLY   A C    1 
ATOM   4204 O O    . GLY   A 1 284 ? 15.73000 20.07800 -7.47400  1.000 23.43176  ?  289 GLY   A O    1 
ATOM   4205 H H    . GLY   A 1 284 ? 17.40000 16.88700 -5.33000  1.000 24.58000  ?  289 GLY   A H    1 
ATOM   4206 H HA2  . GLY   A 1 284 ? 16.25600 17.62200 -7.54900  1.000 25.02000  ?  289 GLY   A HA2  1 
ATOM   4207 H HA3  . GLY   A 1 284 ? 15.57800 17.65600 -6.12400  1.000 25.02000  ?  289 GLY   A HA3  1 
ATOM   4208 N N    . LEU   A 1 285 ? 17.14600 20.03800 -5.74300  1.000 22.05001  ?  290 LEU   A N    1 
ATOM   4209 C CA   . LEU   A 1 285 ? 17.31500 21.48400 -5.71800  1.000 22.59745  ?  290 LEU   A CA   1 
ATOM   4210 C C    . LEU   A 1 285 ? 18.47100 21.96200 -6.58500  1.000 23.98972  ?  290 LEU   A C    1 
ATOM   4211 O O    . LEU   A 1 285 ? 18.70400 23.17400 -6.67300  1.000 24.57137  ?  290 LEU   A O    1 
ATOM   4212 C CB   . LEU   A 1 285 ? 17.53500 21.95500 -4.28000  1.000 21.39467  ?  290 LEU   A CB   1 
ATOM   4213 C CG   . LEU   A 1 285 ? 16.31700 21.82600 -3.36300  1.000 20.92619  ?  290 LEU   A CG   1 
ATOM   4214 C CD1  . LEU   A 1 285 ? 16.69500 22.24700 -1.96200  1.000 20.92619  ?  290 LEU   A CD1  1 
ATOM   4215 C CD2  . LEU   A 1 285 ? 15.13900 22.66500 -3.88400  1.000 21.57364  ?  290 LEU   A CD2  1 
ATOM   4216 H H    . LEU   A 1 285 ? 17.57500 19.62400 -5.12300  1.000 26.51000  ?  290 LEU   A H    1 
ATOM   4217 H HA   . LEU   A 1 285 ? 16.50300 21.89500 -6.05300  1.000 27.17000  ?  290 LEU   A HA   1 
ATOM   4218 H HB2  . LEU   A 1 285 ? 18.24900 21.42700 -3.89100  1.000 25.72000  ?  290 LEU   A HB2  1 
ATOM   4219 H HB3  . LEU   A 1 285 ? 17.78700 22.89100 -4.29900  1.000 25.72000  ?  290 LEU   A HB3  1 
ATOM   4220 H HG   . LEU   A 1 285 ? 16.02400 20.90100 -3.34600  1.000 25.16000  ?  290 LEU   A HG   1 
ATOM   4221 H HD11 . LEU   A 1 285 ? 15.92200 22.15400 -1.38500  1.000 25.16000  ?  290 LEU   A HD11 1 
ATOM   4222 H HD12 . LEU   A 1 285 ? 17.41500 21.68000 -1.64500  1.000 25.16000  ?  290 LEU   A HD12 1 
ATOM   4223 H HD13 . LEU   A 1 285 ? 16.98600 23.17300 -1.97900  1.000 25.16000  ?  290 LEU   A HD13 1 
ATOM   4224 H HD21 . LEU   A 1 285 ? 14.46300 22.72500 -3.19100  1.000 25.94000  ?  290 LEU   A HD21 1 
ATOM   4225 H HD22 . LEU   A 1 285 ? 15.45900 23.55300 -4.11000  1.000 25.94000  ?  290 LEU   A HD22 1 
ATOM   4226 H HD23 . LEU   A 1 285 ? 14.76900 22.23600 -4.67100  1.000 25.94000  ?  290 LEU   A HD23 1 
ATOM   4227 N N    . GLY   A 1 286 ? 19.18300 21.05000 -7.23900  1.000 24.98721  ?  291 GLY   A N    1 
ATOM   4228 C CA   . GLY   A 1 286 ? 20.31400 21.44900 -8.04500  1.000 26.12682  ?  291 GLY   A CA   1 
ATOM   4229 C C    . GLY   A 1 286 ? 21.49700 21.90600 -7.24300  1.000 27.99546  ?  291 GLY   A C    1 
ATOM   4230 O O    . GLY   A 1 286 ? 22.36000 22.60900 -7.76900  1.000 29.49038  ?  291 GLY   A O    1 
ATOM   4231 H H    . GLY   A 1 286 ? 19.02900 20.20300 -7.22800  1.000 30.03000  ?  291 GLY   A H    1 
ATOM   4232 H HA2  . GLY   A 1 286 ? 20.59400 20.69800 -8.59000  1.000 31.40000  ?  291 GLY   A HA2  1 
ATOM   4233 H HA3  . GLY   A 1 286 ? 20.04500 22.17800 -8.62500  1.000 31.40000  ?  291 GLY   A HA3  1 
ATOM   4234 N N    . VAL   A 1 287 ? 21.55600 21.52300 -5.97300  1.000 29.05085  ?  292 VAL   A N    1 
ATOM   4235 C CA   . VAL   A 1 287 ? 22.66900 21.89200 -5.10700  1.000 31.61695  ?  292 VAL   A CA   1 
ATOM   4236 C C    . VAL   A 1 287 ? 23.76500 20.85800 -5.33300  1.000 32.32756  ?  292 VAL   A C    1 
ATOM   4237 O O    . VAL   A 1 287 ? 23.57200 19.67300 -5.05400  1.000 32.93026  ?  292 VAL   A O    1 
ATOM   4238 C CB   . VAL   A 1 287 ? 22.22400 21.94000 -3.64100  1.000 32.44073  ?  292 VAL   A CB   1 
ATOM   4239 C CG1  . VAL   A 1 287 ? 23.37400 22.28700 -2.72500  1.000 33.22504  ?  292 VAL   A CG1  1 
ATOM   4240 C CG2  . VAL   A 1 287 ? 21.10500 22.96800 -3.49500  1.000 32.90395  ?  292 VAL   A CG2  1 
ATOM   4241 H H    . VAL   A 1 287 ? 20.95700 21.04400 -5.58500  1.000 34.91000  ?  292 VAL   A H    1 
ATOM   4242 H HA   . VAL   A 1 287 ? 23.01500 22.76600 -5.34500  1.000 37.99000  ?  292 VAL   A HA   1 
ATOM   4243 H HB   . VAL   A 1 287 ? 21.90100 21.06400 -3.37900  1.000 38.98000  ?  292 VAL   A HB   1 
ATOM   4244 H HG11 . VAL   A 1 287 ? 23.02200 22.53500 -1.85600  1.000 39.92000  ?  292 VAL   A HG11 1 
ATOM   4245 H HG12 . VAL   A 1 287 ? 23.95500 21.51500 -2.64000  1.000 39.92000  ?  292 VAL   A HG12 1 
ATOM   4246 H HG13 . VAL   A 1 287 ? 23.86800 23.03100 -3.10600  1.000 39.92000  ?  292 VAL   A HG13 1 
ATOM   4247 H HG21 . VAL   A 1 287 ? 20.47400 22.65500 -2.82800  1.000 39.53000  ?  292 VAL   A HG21 1 
ATOM   4248 H HG22 . VAL   A 1 287 ? 21.48800 23.81400 -3.21700  1.000 39.53000  ?  292 VAL   A HG22 1 
ATOM   4249 H HG23 . VAL   A 1 287 ? 20.65800 23.07200 -4.35000  1.000 39.53000  ?  292 VAL   A HG23 1 
ATOM   4250 N N    . ASN   A 1 288 ? 24.89900 21.29200 -5.89300  1.000 33.39874  ?  293 ASN   A N    1 
ATOM   4251 C CA   . ASN   A 1 288 ? 26.01700 20.38200 -6.10900  1.000 33.05660  ?  293 ASN   A CA   1 
ATOM   4252 C C    . ASN   A 1 288 ? 26.64200 20.05900 -4.76200  1.000 33.19609  ?  293 ASN   A C    1 
ATOM   4253 O O    . ASN   A 1 288 ? 27.05900 20.96300 -4.03300  1.000 34.40676  ?  293 ASN   A O    1 
ATOM   4254 C CB   . ASN   A 1 288 ? 27.06300 21.02000 -7.01200  1.000 32.41968  ?  293 ASN   A CB   1 
ATOM   4255 C CG   . ASN   A 1 288 ? 28.19300 20.07000 -7.33900  1.000 32.22492  ?  293 ASN   A CG   1 
ATOM   4256 O OD1  . ASN   A 1 288 ? 27.97900 19.01900 -7.96400  1.000 35.53321  ?  293 ASN   A OD1  1 
ATOM   4257 N ND2  . ASN   A 1 288 ? 29.40200 20.41900 -6.91900  1.000 27.69279  ?  293 ASN   A ND2  1 
ATOM   4258 H H    . ASN   A 1 288 ? 25.04000 22.09900 -6.15200  1.000 40.13000  ?  293 ASN   A H    1 
ATOM   4259 H HA   . ASN   A 1 288 ? 25.69900 19.57200 -6.53700  1.000 39.72000  ?  293 ASN   A HA   1 
ATOM   4260 H HB2  . ASN   A 1 288 ? 26.64300 21.28900 -7.84400  1.000 38.95000  ?  293 ASN   A HB2  1 
ATOM   4261 H HB3  . ASN   A 1 288 ? 27.43900 21.79500 -6.56500  1.000 38.95000  ?  293 ASN   A HB3  1 
ATOM   4262 H HD21 . ASN   A 1 288 ? 30.07700 19.91000 -7.08000  1.000 33.28000  ?  293 ASN   A HD21 1 
ATOM   4263 H HD22 . ASN   A 1 288 ? 29.51100 21.15300 -6.48500  1.000 33.28000  ?  293 ASN   A HD22 1 
ATOM   4264 N N    . GLY   A 1 289 ? 26.66000 18.78500 -4.40800  0.770 33.18556  ?  294 GLY   A N    1 
ATOM   4265 C CA   . GLY   A 1 289 ? 27.15500 18.38100 -3.10800  0.730 34.16462  ?  294 GLY   A CA   1 
ATOM   4266 C C    . GLY   A 1 289 ? 28.06600 17.18100 -3.17500  0.830 35.29107  ?  294 GLY   A C    1 
ATOM   4267 O O    . GLY   A 1 289 ? 29.05800 17.19900 -3.89800  1.000 36.09380  ?  294 GLY   A O    1 
ATOM   4268 H H    . GLY   A 1 289 ? 26.39100 18.13600 -4.90400  0.880 39.87000  ?  294 GLY   A H    1 
ATOM   4269 H HA2  . GLY   A 1 289 ? 27.65000 19.11600 -2.71300  0.770 41.05000  ?  294 GLY   A HA2  1 
ATOM   4270 H HA3  . GLY   A 1 289 ? 26.40400 18.16000 -2.53500  0.770 41.05000  ?  294 GLY   A HA3  1 
HETATM 4271 C C1   A GOL   B 2 .   ? 26.09200 30.36400 9.51600   0.550 34.85681  ?  501 GOL   A C1   1 
HETATM 4272 C C1   B GOL   B 2 .   ? 25.97900 30.13500 9.51800   0.450 36.58860  ?  501 GOL   A C1   1 
HETATM 4273 O O1   A GOL   B 2 .   ? 26.43700 28.99700 9.36400   0.550 35.20422  ?  501 GOL   A O1   1 
HETATM 4274 O O1   B GOL   B 2 .   ? 26.32000 28.77700 9.28800   0.450 37.33079  ?  501 GOL   A O1   1 
HETATM 4275 C C2   A GOL   B 2 .   ? 25.26600 30.46600 10.87900  0.550 34.06198  ?  501 GOL   A C2   1 
HETATM 4276 C C2   B GOL   B 2 .   ? 25.25700 30.20400 10.92800  0.450 35.57795  ?  501 GOL   A C2   1 
HETATM 4277 O O2   A GOL   B 2 .   ? 26.07500 30.57800 11.94700  0.550 33.86195  ?  501 GOL   A O2   1 
HETATM 4278 O O2   B GOL   B 2 .   ? 26.08500 30.53200 11.92600  0.450 34.59362  ?  501 GOL   A O2   1 
HETATM 4279 C C3   A GOL   B 2 .   ? 24.35900 31.73700 10.68900  0.550 33.12766  ?  501 GOL   A C3   1 
HETATM 4280 C C3   B GOL   B 2 .   ? 24.08400 31.24200 10.76300  0.450 35.45162  ?  501 GOL   A C3   1 
HETATM 4281 O O3   A GOL   B 2 .   ? 23.37500 31.69100 11.75700  0.550 32.39073  ?  501 GOL   A O3   1 
HETATM 4282 O O3   B GOL   B 2 .   ? 24.58700 32.51700 11.14200  0.450 35.33845  ?  501 GOL   A O3   1 
HETATM 4283 H H31  A GOL   B 2 .   ? 23.96900 31.72000 9.80200   0.550 39.80000  ?  501 GOL   A H31  1 
HETATM 4284 H H31  B GOL   B 2 .   ? 23.33200 30.95100 11.30200  0.450 42.59000  ?  501 GOL   A H31  1 
HETATM 4285 H H32  A GOL   B 2 .   ? 24.91600 32.53100 10.70900  0.550 39.80000  ?  501 GOL   A H32  1 
HETATM 4286 H H32  B GOL   B 2 .   ? 23.76800 31.21200 9.84600   0.450 42.59000  ?  501 GOL   A H32  1 
HETATM 4287 H HO3  A GOL   B 2 .   ? 23.73000 31.34600 12.45100  0.550 38.92000  ?  501 GOL   A HO3  1 
HETATM 4288 H HO3  B GOL   B 2 .   ? 24.84400 32.46700 11.96300  0.450 42.45000  ?  501 GOL   A HO3  1 
HETATM 4289 O OAC  A NXL   C 3 .   ? 13.56300 10.41100 19.72900  0.610 15.60187  ?  502 NXL   A OAC  1 
HETATM 4290 C CAN  A NXL   C 3 .   ? 14.18500 10.72100 20.71700  0.610 15.22814  ?  502 NXL   A CAN  1 
HETATM 4291 N N    A NXL   C 3 .   ? 14.68900 9.86700  21.61000  0.610 15.66240  ?  502 NXL   A N    1 
HETATM 4292 C CAJ  A NXL   C 3 .   ? 15.75300 10.28500 22.52800  0.610 18.11533  ?  502 NXL   A CAJ  1 
HETATM 4293 C CA   A NXL   C 3 .   ? 14.25000 8.46400  21.62100  0.610 17.24417  ?  502 NXL   A CA   1 
HETATM 4294 C C    A NXL   C 3 .   ? 13.23200 8.19200  22.73100  0.610 17.99953  ?  502 NXL   A C    1 
HETATM 4295 O O    A NXL   C 3 .   ? 12.94200 9.09000  23.53100  0.610 16.39933  ?  502 NXL   A O    1 
HETATM 4296 N NAA  A NXL   C 3 .   ? 12.69700 6.97400  22.76400  0.610 21.83683  ?  502 NXL   A NAA  1 
HETATM 4297 C CB   A NXL   C 3 .   ? 15.44500 7.51100  21.65200  0.610 19.91291  ?  502 NXL   A CB   1 
HETATM 4298 C CAH  A NXL   C 3 .   ? 16.54500 7.92200  22.62400  0.610 22.34215  ?  502 NXL   A CAH  1 
HETATM 4299 C CAO  A NXL   C 3 .   ? 16.96600 9.37200  22.43100  0.610 21.60259  ?  502 NXL   A CAO  1 
HETATM 4300 N NAK  A NXL   C 3 .   ? 17.68400 9.58900  21.13700  0.610 23.92129  ?  502 NXL   A NAK  1 
HETATM 4301 O OAL  A NXL   C 3 .   ? 17.20500 10.66900 20.47100  0.610 26.00575  ?  502 NXL   A OAL  1 
HETATM 4302 S SAR  A NXL   C 3 .   ? 17.64400 10.71700 18.89600  0.610 25.91627  ?  502 NXL   A SAR  1 
HETATM 4303 O OAD  A NXL   C 3 .   ? 16.52700 11.50600 18.24200  0.610 29.43511  ?  502 NXL   A OAD  1 
HETATM 4304 O OAE  A NXL   C 3 .   ? 18.83300 11.49800 18.87300  0.610 28.55342  ?  502 NXL   A OAE  1 
HETATM 4305 O OAG  A NXL   C 3 .   ? 17.55700 9.41400  18.42200  0.610 26.45844  ?  502 NXL   A OAG  1 
HETATM 4306 H H2   A NXL   C 3 .   ? 16.03100 11.31600 22.31300  0.610 21.79000  ?  502 NXL   A H2   1 
HETATM 4307 H H3   A NXL   C 3 .   ? 15.36600 10.30200 23.54600  0.610 21.79000  ?  502 NXL   A H3   1 
HETATM 4308 H H4   A NXL   C 3 .   ? 13.77800 8.27800  20.65800  0.610 20.74000  ?  502 NXL   A H4   1 
HETATM 4309 H H5   A NXL   C 3 .   ? 12.93000 6.23900  22.10400  0.610 26.25000  ?  502 NXL   A H5   1 
HETATM 4310 H H6   A NXL   C 3 .   ? 12.01200 6.68000  23.45300  0.610 26.25000  ?  502 NXL   A H6   1 
HETATM 4311 H H7   A NXL   C 3 .   ? 15.10700 6.50700  21.90200  0.610 23.95000  ?  502 NXL   A H7   1 
HETATM 4312 H H8   A NXL   C 3 .   ? 15.86800 7.42200  20.65300  0.610 23.95000  ?  502 NXL   A H8   1 
HETATM 4313 H H9   A NXL   C 3 .   ? 16.20200 7.75000  23.64300  0.610 26.86000  ?  502 NXL   A H9   1 
HETATM 4314 H H10  A NXL   C 3 .   ? 17.39500 7.25200  22.50200  0.610 26.86000  ?  502 NXL   A H10  1 
HETATM 4315 H H11  A NXL   C 3 .   ? 17.63200 9.65700  23.24400  0.610 25.97000  ?  502 NXL   A H11  1 
HETATM 4316 H H12  A NXL   C 3 .   ? 18.65500 9.83600  21.30500  0.610 28.76000  ?  502 NXL   A H12  1 
HETATM 4317 H H13  A NXL   C 3 .   ? 15.54200 11.37600 18.26400  0.610 35.37000  ?  502 NXL   A H13  1 
HETATM 4318 C C5   B A1H3M D 4 .   ? 16.46200 7.92800  22.69400  0.480 24.75297  ?  503 A1H3M A C5   1 
HETATM 4319 C C6   B A1H3M D 4 .   ? 13.24400 8.25600  22.71500  0.480 23.64757  ?  503 A1H3M A C6   1 
HETATM 4320 N N1   B A1H3M D 4 .   ? 17.98300 9.87900  22.38700  0.480 23.31859  ?  503 A1H3M A N1   1 
HETATM 4321 C C2   B A1H3M D 4 .   ? 16.82800 9.37100  22.52800  0.480 23.62125  ?  503 A1H3M A C2   1 
HETATM 4322 C C4   B A1H3M D 4 .   ? 15.44300 7.48900  21.64900  0.480 23.74758  ?  503 A1H3M A C4   1 
HETATM 4323 N N    B A1H3M D 4 .   ? 14.70800 9.86000  21.57300  0.480 20.16294  ?  503 A1H3M A N    1 
HETATM 4324 C C    B A1H3M D 4 .   ? 14.17500 10.72300 20.71800  0.480 17.60737  ?  503 A1H3M A C    1 
HETATM 4325 O O    B A1H3M D 4 .   ? 13.57100 10.46700 19.67500  0.480 17.80477  ?  503 A1H3M A O    1 
HETATM 4326 C C1   B A1H3M D 4 .   ? 15.65600 10.29900 22.60100  0.480 21.78156  ?  503 A1H3M A C1   1 
HETATM 4327 C C3   B A1H3M D 4 .   ? 14.25200 8.46600  21.59100  0.480 22.27109  ?  503 A1H3M A C3   1 
HETATM 4328 N N2   B A1H3M D 4 .   ? 12.65400 7.08100  22.74700  0.480 25.90837  ?  503 A1H3M A N2   1 
HETATM 4329 O O1   B A1H3M D 4 .   ? 13.01000 9.15700  23.52600  0.480 23.08961  ?  503 A1H3M A O1   1 
HETATM 4330 H H7   B A1H3M D 4 .   ? 17.36400 7.32000  22.63600  0.480 29.75000  ?  503 A1H3M A H7   1 
HETATM 4331 H H8   B A1H3M D 4 .   ? 16.07900 7.76800  23.70100  0.480 29.75000  ?  503 A1H3M A H8   1 
HETATM 4332 H H4   B A1H3M D 4 .   ? 18.76000 9.22700  22.38200  0.480 28.03000  ?  503 A1H3M A H4   1 
HETATM 4333 H H6   B A1H3M D 4 .   ? 15.93400 7.40500  20.68100  0.480 28.55000  ?  503 A1H3M A H6   1 
HETATM 4334 H H5   B A1H3M D 4 .   ? 15.11400 6.47500  21.87200  0.480 28.55000  ?  503 A1H3M A H5   1 
HETATM 4335 H H3   B A1H3M D 4 .   ? 15.22100 10.28200 23.59900  0.480 26.19000  ?  503 A1H3M A H3   1 
HETATM 4336 H H2   B A1H3M D 4 .   ? 15.97900 11.32900 22.45100  0.480 26.19000  ?  503 A1H3M A H2   1 
HETATM 4337 H H1   B A1H3M D 4 .   ? 13.79300 8.27900  20.62100  0.480 26.77000  ?  503 A1H3M A H1   1 
HETATM 4338 H H9   B A1H3M D 4 .   ? 12.87200 6.37300  22.05400  0.480 31.14000  ?  503 A1H3M A H9   1 
HETATM 4339 H H10  B A1H3M D 4 .   ? 11.97000 6.86500  23.46500  0.480 31.14000  ?  503 A1H3M A H10  1 
HETATM 4340 S S    . SO4   E 5 .   ? 21.05600 2.04000  9.58400   1.000 29.21666  ?  504 SO4   A S    1 
HETATM 4341 O O1   . SO4   E 5 .   ? 20.51600 0.81400  9.01600   1.000 32.89868  -1 504 SO4   A O1   1 
HETATM 4342 O O2   . SO4   E 5 .   ? 21.33800 2.97000  8.51000   1.000 28.20865  ?  504 SO4   A O2   1 
HETATM 4343 O O3   . SO4   E 5 .   ? 22.28700 1.75600  10.33100  1.000 31.39587  ?  504 SO4   A O3   1 
HETATM 4344 O O4   . SO4   E 5 .   ? 20.07300 2.58900  10.53500  1.000 25.97417  ?  504 SO4   A O4   1 
HETATM 4345 S S    B SO4   F 5 .   ? 17.63000 10.73400 18.91900  0.420 14.17802  ?  505 SO4   A S    1 
HETATM 4346 O O1   B SO4   F 5 .   ? 17.49700 10.25900 17.55300  0.420 17.41261  ?  505 SO4   A O1   1 
HETATM 4347 O O2   B SO4   F 5 .   ? 18.98100 11.23600 19.18000  0.420 16.37302  ?  505 SO4   A O2   1 
HETATM 4348 O O3   B SO4   F 5 .   ? 16.62000 11.70100 19.27800  0.420 17.89425  ?  505 SO4   A O3   1 
HETATM 4349 O O4   B SO4   F 5 .   ? 17.50200 9.59100  19.79900  0.420 17.81003  ?  505 SO4   A O4   1 
HETATM 4350 O O    . HOH   G 6 .   ? 24.55100 18.02800 -6.16500  1.000 51.62461  ?  601 HOH   A O    1 
HETATM 4351 O O    . HOH   G 6 .   ? 6.39900  -7.16100 12.02900  1.000 39.22576  ?  602 HOH   A O    1 
HETATM 4352 O O    . HOH   G 6 .   ? 23.25600 17.40100 -5.12500  1.000 41.76817  ?  603 HOH   A O    1 
HETATM 4353 O O    . HOH   G 6 .   ? 10.94900 33.17700 7.61100   1.000 40.38116  ?  604 HOH   A O    1 
HETATM 4354 O O    . HOH   G 6 .   ? 19.49900 0.97400  6.93000   1.000 46.39504  ?  605 HOH   A O    1 
HETATM 4355 O O    . HOH   G 6 .   ? 6.61600  24.30400 -1.89000  1.000 41.13388  ?  606 HOH   A O    1 
HETATM 4356 O O    C HOH   G 6 .   ? 27.09200 29.29200 9.95900   0.500 29.79831  ?  607 HOH   A O    1 
HETATM 4357 O O    . HOH   G 6 .   ? 11.00700 -0.30100 15.33000  1.000 46.90036  ?  608 HOH   A O    1 
HETATM 4358 O O    . HOH   G 6 .   ? 8.70700  -5.94700 11.10700  1.000 43.91053  ?  609 HOH   A O    1 
HETATM 4359 O O    . HOH   G 6 .   ? 27.90500 9.42700  35.41900  1.000 49.52436  ?  610 HOH   A O    1 
HETATM 4360 O O    . HOH   G 6 .   ? 9.06600  29.44700 6.49100   1.000 26.46107  ?  611 HOH   A O    1 
HETATM 4361 O O    . HOH   G 6 .   ? 16.78600 1.90700  -1.89800  1.000 43.72366  ?  612 HOH   A O    1 
HETATM 4362 O O    . HOH   G 6 .   ? 24.93800 15.45000 -1.20900  1.000 48.64794  ?  613 HOH   A O    1 
HETATM 4363 O O    . HOH   G 6 .   ? 6.16800  26.54300 -6.02500  1.000 41.91029  ?  614 HOH   A O    1 
HETATM 4364 O O    . HOH   G 6 .   ? 12.98800 32.34700 -7.65000  1.000 51.00612  ?  615 HOH   A O    1 
HETATM 4365 O O    . HOH   G 6 .   ? 6.71500  -8.78200 14.92800  1.000 37.12287  ?  616 HOH   A O    1 
HETATM 4366 O O    . HOH   G 6 .   ? 11.76200 11.27600 22.25400  1.000 17.04415  ?  617 HOH   A O    1 
HETATM 4367 O O    . HOH   G 6 .   ? 21.38000 9.83700  -4.80200  1.000 39.32050  ?  618 HOH   A O    1 
HETATM 4368 O O    . HOH   G 6 .   ? 1.97700  7.31600  4.16600   1.000 24.06604  ?  619 HOH   A O    1 
HETATM 4369 O O    . HOH   G 6 .   ? 6.03900  21.79600 12.71500  1.000 16.61778  ?  620 HOH   A O    1 
HETATM 4370 O O    . HOH   G 6 .   ? 28.18400 29.19800 7.46400   1.000 36.48332  ?  621 HOH   A O    1 
HETATM 4371 O O    . HOH   G 6 .   ? 9.66200  -1.21200 -5.18500  1.000 47.72151  ?  622 HOH   A O    1 
HETATM 4372 O O    . HOH   G 6 .   ? 21.87300 33.68700 13.46300  1.000 37.16498  ?  623 HOH   A O    1 
HETATM 4373 O O    . HOH   G 6 .   ? 27.68400 26.04600 -3.32300  1.000 36.60439  ?  624 HOH   A O    1 
HETATM 4374 O O    . HOH   G 6 .   ? 24.81200 29.40000 2.74700   1.000 27.86650  ?  625 HOH   A O    1 
HETATM 4375 O O    . HOH   G 6 .   ? 6.36000  10.65900 31.50800  1.000 54.19334  ?  626 HOH   A O    1 
HETATM 4376 O O    . HOH   G 6 .   ? 28.90500 27.24000 5.27600   1.000 29.89832  ?  627 HOH   A O    1 
HETATM 4377 O O    A HOH   G 6 .   ? 13.87400 1.30500  15.15200  1.000 46.80824  ?  628 HOH   A O    1 
HETATM 4378 O O    . HOH   G 6 .   ? 1.43500  -1.37700 21.62400  1.000 47.54254  ?  629 HOH   A O    1 
HETATM 4379 O O    . HOH   G 6 .   ? 7.04600  26.52200 2.02500   1.000 33.14608  ?  630 HOH   A O    1 
HETATM 4380 O O    . HOH   G 6 .   ? 16.77900 27.14300 -7.22300  1.000 44.02107  ?  631 HOH   A O    1 
HETATM 4381 O O    . HOH   G 6 .   ? 1.82800  9.67500  17.52800  1.000 17.12574  ?  632 HOH   A O    1 
HETATM 4382 O O    . HOH   G 6 .   ? 16.49700 38.76900 27.33800  1.000 41.30232  ?  633 HOH   A O    1 
HETATM 4383 O O    . HOH   G 6 .   ? 23.73400 3.94400  11.55800  1.000 47.07407  ?  634 HOH   A O    1 
HETATM 4384 O O    . HOH   G 6 .   ? 19.59200 15.80400 17.95000  1.000 40.07059  ?  635 HOH   A O    1 
HETATM 4385 O O    . HOH   G 6 .   ? -0.64400 9.62500  6.09300   1.000 34.78575  ?  636 HOH   A O    1 
HETATM 4386 O O    . HOH   G 6 .   ? 4.14400  20.46200 -1.70000  1.000 23.86076  ?  637 HOH   A O    1 
HETATM 4387 O O    . HOH   G 6 .   ? -3.50600 16.78600 9.65300   1.000 57.39109  ?  638 HOH   A O    1 
HETATM 4388 O O    . HOH   G 6 .   ? 22.95300 9.88900  13.12100  1.000 20.79986  ?  639 HOH   A O    1 
HETATM 4389 O O    . HOH   G 6 .   ? 20.90700 28.05500 -2.25500  1.000 29.50354  ?  640 HOH   A O    1 
HETATM 4390 O O    . HOH   G 6 .   ? 2.28400  24.93500 5.28500   1.000 27.56646  ?  641 HOH   A O    1 
HETATM 4391 O O    . HOH   G 6 .   ? 18.93100 15.93300 43.12200  1.000 36.71230  ?  642 HOH   A O    1 
HETATM 4392 O O    . HOH   G 6 .   ? 1.12900  -4.25900 8.34200   1.000 29.14034  ?  643 HOH   A O    1 
HETATM 4393 O O    . HOH   G 6 .   ? 7.75100  -1.68400 0.34800   1.000 46.37398  ?  644 HOH   A O    1 
HETATM 4394 O O    . HOH   G 6 .   ? 23.20900 30.70100 37.59200  1.000 29.23772  ?  645 HOH   A O    1 
HETATM 4395 O O    . HOH   G 6 .   ? 11.57700 0.23300  20.98100  1.000 36.83336  ?  646 HOH   A O    1 
HETATM 4396 O O    . HOH   G 6 .   ? 22.55300 23.96200 40.04300  1.000 27.54804  ?  647 HOH   A O    1 
HETATM 4397 O O    . HOH   G 6 .   ? 1.39600  8.55200  14.93600  1.000 15.48870  ?  648 HOH   A O    1 
HETATM 4398 O O    . HOH   G 6 .   ? 20.71400 32.96500 11.13800  1.000 32.31703  ?  649 HOH   A O    1 
HETATM 4399 O O    . HOH   G 6 .   ? 1.40200  20.78200 6.94700   1.000 26.59529  ?  650 HOH   A O    1 
HETATM 4400 O O    . HOH   G 6 .   ? 5.49500  4.31300  -2.66700  1.000 27.29538  ?  651 HOH   A O    1 
HETATM 4401 O O    . HOH   G 6 .   ? 18.61800 14.70900 -10.20700 1.000 40.81805  ?  652 HOH   A O    1 
HETATM 4402 O O    . HOH   G 6 .   ? -2.57700 23.29700 9.26800   1.000 47.99260  ?  653 HOH   A O    1 
HETATM 4403 O O    . HOH   G 6 .   ? 7.28400  -2.72800 6.49400   1.000 29.86674  ?  654 HOH   A O    1 
HETATM 4404 O O    . HOH   G 6 .   ? 19.76000 5.26300  14.83400  1.000 22.66588  ?  655 HOH   A O    1 
HETATM 4405 O O    . HOH   G 6 .   ? 4.29400  9.30400  18.60300  1.000 21.96842  ?  656 HOH   A O    1 
HETATM 4406 O O    . HOH   G 6 .   ? 28.09000 32.19300 17.32500  1.000 37.92823  ?  657 HOH   A O    1 
HETATM 4407 O O    . HOH   G 6 .   ? 3.82500  26.09300 8.54100   1.000 21.93158  ?  658 HOH   A O    1 
HETATM 4408 O O    . HOH   G 6 .   ? 28.50700 12.79900 8.81600   1.000 32.49337  ?  659 HOH   A O    1 
HETATM 4409 O O    . HOH   G 6 .   ? 22.88800 9.94800  38.19400  1.000 28.01652  ?  660 HOH   A O    1 
HETATM 4410 O O    . HOH   G 6 .   ? 3.95300  -4.57900 21.84400  1.000 24.93457  ?  661 HOH   A O    1 
HETATM 4411 O O    . HOH   G 6 .   ? 1.00100  7.55100  18.97800  1.000 15.48870  ?  662 HOH   A O    1 
HETATM 4412 O O    . HOH   G 6 .   ? 11.96600 15.51500 41.83500  1.000 35.87799  ?  663 HOH   A O    1 
HETATM 4413 O O    . HOH   G 6 .   ? 27.82400 25.05800 18.03900  1.000 37.95455  ?  664 HOH   A O    1 
HETATM 4414 O O    . HOH   G 6 .   ? 19.60200 1.76300  13.07600  1.000 49.39013  ?  665 HOH   A O    1 
HETATM 4415 O O    . HOH   G 6 .   ? 18.81900 35.11900 7.77500   1.000 39.24944  ?  666 HOH   A O    1 
HETATM 4416 O O    . HOH   G 6 .   ? 9.09300  11.46600 -7.40500  1.000 50.91663  ?  667 HOH   A O    1 
HETATM 4417 O O    . HOH   G 6 .   ? 20.01100 15.30700 19.50100  1.000 24.10552  ?  668 HOH   A O    1 
HETATM 4418 O O    . HOH   G 6 .   ? 3.36300  2.13300  20.15900  1.000 25.96627  ?  669 HOH   A O    1 
HETATM 4419 O O    . HOH   G 6 .   ? 28.53300 19.47200 20.66100  1.000 35.85167  ?  670 HOH   A O    1 
HETATM 4420 O O    . HOH   G 6 .   ? 4.44000  5.69500  13.01900  1.000 16.26774  ?  671 HOH   A O    1 
HETATM 4421 O O    . HOH   G 6 .   ? 29.09900 19.44200 7.07400   1.000 35.47794  ?  672 HOH   A O    1 
HETATM 4422 O O    . HOH   G 6 .   ? 18.50500 34.69900 25.52400  1.000 31.13268  ?  673 HOH   A O    1 
HETATM 4423 O O    . HOH   G 6 .   ? 22.20900 15.34900 10.45000  1.000 16.93624  ?  674 HOH   A O    1 
HETATM 4424 O O    . HOH   G 6 .   ? -0.26500 30.33400 9.60500   1.000 44.08686  ?  675 HOH   A O    1 
HETATM 4425 O O    . HOH   G 6 .   ? 17.13500 25.32100 -6.06500  1.000 32.73814  ?  676 HOH   A O    1 
HETATM 4426 O O    . HOH   G 6 .   ? 22.65500 32.57700 24.98000  1.000 40.96281  ?  677 HOH   A O    1 
HETATM 4427 O O    . HOH   G 6 .   ? 31.34500 26.42000 5.61500   1.000 29.47459  ?  678 HOH   A O    1 
HETATM 4428 O O    . HOH   G 6 .   ? 17.71800 0.51500  12.88000  1.000 44.80537  ?  679 HOH   A O    1 
HETATM 4429 O O    . HOH   G 6 .   ? -2.45900 14.40000 26.16500  1.000 41.20231  ?  680 HOH   A O    1 
HETATM 4430 O O    . HOH   G 6 .   ? 21.21700 36.06700 14.49600  1.000 38.62042  ?  681 HOH   A O    1 
HETATM 4431 O O    . HOH   G 6 .   ? 12.55200 4.27700  15.40600  1.000 21.95790  ?  682 HOH   A O    1 
HETATM 4432 O O    . HOH   G 6 .   ? 23.83200 6.79500  7.10600   1.000 22.75273  ?  683 HOH   A O    1 
HETATM 4433 O O    . HOH   G 6 .   ? 1.42800  0.10600  19.05300  1.000 28.02968  ?  684 HOH   A O    1 
HETATM 4434 O O    . HOH   G 6 .   ? 28.30200 21.31000 12.89300  1.000 30.21152  ?  685 HOH   A O    1 
HETATM 4435 O O    . HOH   G 6 .   ? 25.63700 22.78800 41.72700  1.000 20.42350  ?  686 HOH   A O    1 
HETATM 4436 O O    . HOH   G 6 .   ? -1.21800 17.73900 26.90300  1.000 52.33259  ?  687 HOH   A O    1 
HETATM 4437 O O    . HOH   G 6 .   ? 28.02700 29.42600 14.51500  1.000 37.75979  ?  688 HOH   A O    1 
HETATM 4438 O O    . HOH   G 6 .   ? 11.05600 -2.09700 -3.17600  1.000 42.85251  ?  689 HOH   A O    1 
HETATM 4439 O O    . HOH   G 6 .   ? 11.87100 -5.99400 12.07600  1.000 46.06605  ?  690 HOH   A O    1 
HETATM 4440 O O    . HOH   G 6 .   ? 6.22300  12.03600 18.58500  1.000 16.63621  ?  691 HOH   A O    1 
HETATM 4441 O O    . HOH   G 6 .   ? 24.16700 28.42100 31.49200  1.000 28.49026  ?  692 HOH   A O    1 
HETATM 4442 O O    . HOH   G 6 .   ? 17.23300 39.78000 22.18200  1.000 41.91029  ?  693 HOH   A O    1 
HETATM 4443 O O    . HOH   G 6 .   ? 22.47800 6.35600  2.66700   1.000 25.70308  ?  694 HOH   A O    1 
HETATM 4444 O O    . HOH   G 6 .   ? 24.28500 20.97800 28.30900  1.000 30.16941  ?  695 HOH   A O    1 
HETATM 4445 O O    . HOH   G 6 .   ? 12.07300 22.50900 -7.49600  1.000 26.69531  ?  696 HOH   A O    1 
HETATM 4446 O O    . HOH   G 6 .   ? 28.24900 18.58600 15.72100  1.000 37.53608  ?  697 HOH   A O    1 
HETATM 4447 O O    . HOH   G 6 .   ? 0.00000  0.00000  9.94700   0.460 14.78072  ?  698 HOH   A O    1 
HETATM 4448 O O    . HOH   G 6 .   ? 25.75200 11.12300 15.38700  1.000 21.08148  ?  699 HOH   A O    1 
HETATM 4449 O O    . HOH   G 6 .   ? 4.26500  8.15500  -4.40300  1.000 50.37446  ?  700 HOH   A O    1 
HETATM 4450 O O    . HOH   G 6 .   ? 3.42000  27.64100 2.87900   1.000 49.51120  ?  701 HOH   A O    1 
HETATM 4451 O O    . HOH   G 6 .   ? 5.54900  27.45000 10.19100  1.000 18.82857  ?  702 HOH   A O    1 
HETATM 4452 O O    . HOH   G 6 .   ? 23.46200 6.70600  15.25100  1.000 47.03195  ?  703 HOH   A O    1 
HETATM 4453 O O    . HOH   G 6 .   ? 28.88100 10.68200 4.32700   1.000 39.17575  ?  704 HOH   A O    1 
HETATM 4454 O O    . HOH   G 6 .   ? 7.89300  35.16700 16.99800  1.000 32.84078  ?  705 HOH   A O    1 
HETATM 4455 O O    . HOH   G 6 .   ? 3.42500  4.06700  10.98100  1.000 17.64159  ?  706 HOH   A O    1 
HETATM 4456 O O    . HOH   G 6 .   ? 3.40100  30.54300 7.67300   1.000 50.02968  ?  707 HOH   A O    1 
HETATM 4457 O O    . HOH   G 6 .   ? 25.44200 15.21900 14.69900  1.000 20.70775  ?  708 HOH   A O    1 
HETATM 4458 O O    . HOH   G 6 .   ? -1.49100 7.48000  5.92700   1.000 47.36094  ?  709 HOH   A O    1 
HETATM 4459 O O    . HOH   G 6 .   ? 11.69000 22.96700 35.11300  1.000 44.60272  ?  710 HOH   A O    1 
HETATM 4460 O O    . HOH   G 6 .   ? 19.05800 33.47300 36.77900  1.000 36.65966  ?  711 HOH   A O    1 
HETATM 4461 O O    . HOH   G 6 .   ? 8.59300  26.25300 -4.38700  1.000 31.24322  ?  712 HOH   A O    1 
HETATM 4462 O O    . HOH   G 6 .   ? 19.61400 18.21900 40.01600  1.000 24.18185  ?  713 HOH   A O    1 
HETATM 4463 O O    . HOH   G 6 .   ? 6.21500  34.27600 18.79700  1.000 31.54852  ?  714 HOH   A O    1 
HETATM 4464 O O    . HOH   G 6 .   ? 6.13500  14.44500 -4.91100  1.000 27.41908  ?  715 HOH   A O    1 
HETATM 4465 O O    . HOH   G 6 .   ? 18.54200 6.85600  18.97000  1.000 43.87368  ?  716 HOH   A O    1 
HETATM 4466 O O    . HOH   G 6 .   ? -1.11400 29.75000 14.07500  1.000 26.90849  ?  717 HOH   A O    1 
HETATM 4467 O O    . HOH   G 6 .   ? 24.80800 26.61100 25.58000  1.000 40.98386  ?  718 HOH   A O    1 
HETATM 4468 O O    B HOH   G 6 .   ? 19.56500 10.72100 24.61700  0.630 28.23760  ?  719 HOH   A O    1 
HETATM 4469 O O    . HOH   G 6 .   ? 9.09900  32.57100 6.48900   1.000 43.40784  ?  720 HOH   A O    1 
HETATM 4470 O O    . HOH   G 6 .   ? 24.51700 30.30100 33.78500  1.000 30.77474  ?  721 HOH   A O    1 
HETATM 4471 O O    . HOH   G 6 .   ? 9.06200  3.97600  22.00100  1.000 31.98805  ?  722 HOH   A O    1 
HETATM 4472 O O    . HOH   G 6 .   ? 8.51600  16.59000 -10.84800 1.000 42.88935  ?  723 HOH   A O    1 
HETATM 4473 O O    . HOH   G 6 .   ? 4.99900  20.89300 -9.06700  1.000 44.19214  ?  724 HOH   A O    1 
HETATM 4474 O O    . HOH   G 6 .   ? 6.32600  1.47800  1.00700   1.000 35.41214  ?  725 HOH   A O    1 
HETATM 4475 O O    . HOH   G 6 .   ? 25.21400 31.95100 20.39500  1.000 39.43368  ?  726 HOH   A O    1 
HETATM 4476 O O    . HOH   G 6 .   ? 28.63700 11.97800 18.17100  1.000 45.13173  ?  727 HOH   A O    1 
HETATM 4477 O O    . HOH   G 6 .   ? 3.63800  29.26500 24.93300  1.000 29.71409  ?  728 HOH   A O    1 
HETATM 4478 O O    . HOH   G 6 .   ? 14.27100 5.80400  9.48500   1.000 18.81015  ?  729 HOH   A O    1 
HETATM 4479 O O    . HOH   G 6 .   ? 20.13300 25.38000 -7.90100  1.000 35.59374  ?  730 HOH   A O    1 
HETATM 4480 O O    . HOH   G 6 .   ? 25.57400 11.44200 21.17600  1.000 43.57101  ?  731 HOH   A O    1 
HETATM 4481 O O    . HOH   G 6 .   ? 23.78100 4.38000  8.37600   1.000 33.21451  ?  732 HOH   A O    1 
HETATM 4482 O O    . HOH   G 6 .   ? 23.92300 34.53900 20.30200  1.000 37.50186  ?  733 HOH   A O    1 
HETATM 4483 O O    . HOH   G 6 .   ? 16.18800 12.31700 -11.36500 1.000 30.33258  ?  734 HOH   A O    1 
HETATM 4484 O O    . HOH   G 6 .   ? -0.32800 30.95000 20.53000  1.000 25.41094  ?  735 HOH   A O    1 
HETATM 4485 O O    . HOH   G 6 .   ? 3.97300  23.72500 34.00500  1.000 48.37422  ?  736 HOH   A O    1 
HETATM 4486 O O    . HOH   G 6 .   ? 2.58600  6.20300  24.87600  1.000 25.29251  ?  737 HOH   A O    1 
HETATM 4487 O O    . HOH   G 6 .   ? 31.71800 24.03000 -1.05400  1.000 18.04164  ?  738 HOH   A O    1 
HETATM 4488 O O    . HOH   G 6 .   ? 28.87700 18.79200 23.29000  1.000 52.11151  ?  739 HOH   A O    1 
HETATM 4489 O O    . HOH   G 6 .   ? 14.12600 -1.42800 5.87200   1.000 41.62868  ?  740 HOH   A O    1 
HETATM 4490 O O    . HOH   G 6 .   ? 19.83200 10.00500 15.96600  1.000 24.29765  ?  741 HOH   A O    1 
HETATM 4491 O O    . HOH   G 6 .   ? 12.75900 20.27300 38.93200  1.000 57.79114  ?  742 HOH   A O    1 
HETATM 4492 O O    . HOH   G 6 .   ? 15.77100 37.62000 9.36000   1.000 43.67103  ?  743 HOH   A O    1 
HETATM 4493 O O    . HOH   G 6 .   ? 12.99300 19.40100 -7.81700  1.000 27.09272  ?  744 HOH   A O    1 
HETATM 4494 O O    . HOH   G 6 .   ? 18.24100 32.83700 3.55600   1.000 43.56049  ?  745 HOH   A O    1 
HETATM 4495 O O    . HOH   G 6 .   ? 0.39900  7.47700  10.76300  1.000 21.98948  ?  746 HOH   A O    1 
HETATM 4496 O O    . HOH   G 6 .   ? 9.03000  36.48400 23.52700  1.000 51.71673  ?  747 HOH   A O    1 
HETATM 4497 O O    . HOH   G 6 .   ? 22.28400 32.55100 7.30300   1.000 41.62341  ?  748 HOH   A O    1 
HETATM 4498 O O    . HOH   G 6 .   ? -5.03400 5.66700  14.76000  1.000 20.30243  ?  749 HOH   A O    1 
HETATM 4499 O O    . HOH   G 6 .   ? 4.18600  3.29900  5.85600   1.000 24.81350  ?  750 HOH   A O    1 
HETATM 4500 O O    . HOH   G 6 .   ? 26.65600 7.47900  7.82000   1.000 32.36967  ?  751 HOH   A O    1 
HETATM 4501 O O    . HOH   G 6 .   ? 11.53400 16.34700 -6.47400  1.000 26.63740  ?  752 HOH   A O    1 
HETATM 4502 O O    . HOH   G 6 .   ? 19.95200 34.38500 31.96900  1.000 35.44899  ?  753 HOH   A O    1 
HETATM 4503 O O    . HOH   G 6 .   ? 15.64900 2.42400  0.78400   1.000 34.89103  ?  754 HOH   A O    1 
HETATM 4504 O O    . HOH   G 6 .   ? 12.70000 19.27700 40.48800  1.000 39.33103  ?  755 HOH   A O    1 
HETATM 4505 O O    . HOH   G 6 .   ? 12.34000 -3.80300 9.61500   1.000 34.62257  ?  756 HOH   A O    1 
HETATM 4506 O O    . HOH   G 6 .   ? -2.01400 5.56300  23.49500  1.000 27.40065  ?  757 HOH   A O    1 
HETATM 4507 O O    . HOH   G 6 .   ? 14.94100 -0.36700 8.17600   1.000 44.51850  ?  758 HOH   A O    1 
HETATM 4508 O O    . HOH   G 6 .   ? 11.11000 13.56200 33.50900  1.000 29.16402  ?  759 HOH   A O    1 
HETATM 4509 O O    . HOH   G 6 .   ? 20.17000 7.78500  30.51300  1.000 35.85693  ?  760 HOH   A O    1 
HETATM 4510 O O    . HOH   G 6 .   ? 14.56700 33.87500 14.09200  1.000 21.67365  ?  761 HOH   A O    1 
HETATM 4511 O O    . HOH   G 6 .   ? 11.16300 -0.35300 8.00100   1.000 31.25638  ?  762 HOH   A O    1 
HETATM 4512 O O    . HOH   G 6 .   ? 0.22900  21.39500 28.46400  1.000 31.99594  ?  763 HOH   A O    1 
HETATM 4513 O O    . HOH   G 6 .   ? -0.01500 17.44900 30.16900  1.000 53.89330  ?  764 HOH   A O    1 
HETATM 4514 O O    . HOH   G 6 .   ? 20.01900 8.94800  -2.53100  1.000 24.78981  ?  765 HOH   A O    1 
HETATM 4515 O O    . HOH   G 6 .   ? 28.44600 22.86400 10.96200  1.000 32.83288  ?  766 HOH   A O    1 
HETATM 4516 O O    . HOH   G 6 .   ? 15.76400 5.87900  -4.97100  1.000 28.35077  ?  767 HOH   A O    1 
HETATM 4517 O O    . HOH   G 6 .   ? 18.13200 7.87600  32.80600  1.000 38.39934  ?  768 HOH   A O    1 
HETATM 4518 O O    . HOH   G 6 .   ? -1.27800 12.44700 7.46200   1.000 32.24860  ?  769 HOH   A O    1 
HETATM 4519 O O    . HOH   G 6 .   ? 1.47000  24.91800 9.46900   1.000 20.65511  ?  770 HOH   A O    1 
HETATM 4520 O O    . HOH   G 6 .   ? 0.02900  9.90900  9.66700   1.000 31.88540  ?  771 HOH   A O    1 
HETATM 4521 O O    . HOH   G 6 .   ? 7.79700  30.59800 24.37200  1.000 30.09045  ?  772 HOH   A O    1 
HETATM 4522 O O    . HOH   G 6 .   ? 18.18200 19.61800 -10.06800 1.000 42.01820  ?  773 HOH   A O    1 
HETATM 4523 O O    . HOH   G 6 .   ? 26.73400 18.33300 44.90700  1.000 38.92046  ?  774 HOH   A O    1 
HETATM 4524 O O    . HOH   G 6 .   ? 35.10500 21.17700 7.58700   1.000 35.32529  ?  775 HOH   A O    1 
HETATM 4525 O O    . HOH   G 6 .   ? 12.54300 39.31400 15.85300  1.000 54.35652  ?  776 HOH   A O    1 
HETATM 4526 O O    . HOH   G 6 .   ? 15.50500 32.77800 4.66900   1.000 37.00444  ?  777 HOH   A O    1 
HETATM 4527 O O    . HOH   G 6 .   ? 25.55100 24.20700 -5.82300  1.000 41.98398  ?  778 HOH   A O    1 
HETATM 4528 O O    . HOH   G 6 .   ? 26.34100 27.72600 22.20700  1.000 37.47291  ?  779 HOH   A O    1 
HETATM 4529 O O    . HOH   G 6 .   ? 9.08500  9.05100  -6.55500  1.000 25.38462  ?  780 HOH   A O    1 
HETATM 4530 O O    . HOH   G 6 .   ? 19.85100 18.16000 44.17600  1.000 52.64315  ?  781 HOH   A O    1 
HETATM 4531 O O    . HOH   G 6 .   ? -5.57500 11.22900 15.31100  1.000 21.95790  ?  782 HOH   A O    1 
HETATM 4532 O O    . HOH   G 6 .   ? 16.67100 41.14500 16.32100  1.000 47.92680  ?  783 HOH   A O    1 
HETATM 4533 O O    . HOH   G 6 .   ? 29.95900 26.39700 11.43700  1.000 49.06378  ?  784 HOH   A O    1 
HETATM 4534 O O    . HOH   G 6 .   ? 28.43700 17.37500 10.22900  1.000 29.97201  ?  785 HOH   A O    1 
HETATM 4535 O O    . HOH   G 6 .   ? 10.88800 6.24500  -7.51900  1.000 32.38809  ?  786 HOH   A O    1 
HETATM 4536 O O    . HOH   G 6 .   ? 27.53500 23.84100 -4.45000  1.000 41.12862  ?  787 HOH   A O    1 
HETATM 4537 O O    . HOH   G 6 .   ? 9.08900  10.45200 11.89300  1.000 14.87284  ?  788 HOH   A O    1 
HETATM 4538 O O    . HOH   G 6 .   ? 2.16700  29.08400 -6.78700  1.000 47.56360  ?  789 HOH   A O    1 
HETATM 4539 O O    . HOH   G 6 .   ? 7.61200  7.67500  30.42200  1.000 29.02190  ?  790 HOH   A O    1 
HETATM 4540 O O    . HOH   G 6 .   ? 13.25500 11.29800 43.13800  1.000 43.20255  ?  791 HOH   A O    1 
HETATM 4541 O O    . HOH   G 6 .   ? 10.31000 35.04300 9.50100   1.000 35.06999  ?  792 HOH   A O    1 
HETATM 4542 O O    . HOH   G 6 .   ? 17.56300 34.50300 29.73000  1.000 30.46681  ?  793 HOH   A O    1 
HETATM 4543 O O    . HOH   G 6 .   ? 4.79600  29.08000 27.21000  1.000 52.01413  ?  794 HOH   A O    1 
HETATM 4544 O O    . HOH   G 6 .   ? -3.12400 11.88100 25.30400  1.000 29.54828  ?  795 HOH   A O    1 
HETATM 4545 O O    . HOH   G 6 .   ? 2.55400  4.23400  8.40000   1.000 42.75513  ?  796 HOH   A O    1 
HETATM 4546 O O    . HOH   G 6 .   ? 10.30100 14.10500 -6.89800  1.000 37.85980  ?  797 HOH   A O    1 
HETATM 4547 O O    . HOH   G 6 .   ? 27.77300 17.40400 7.54700   1.000 31.03530  ?  798 HOH   A O    1 
HETATM 4548 O O    . HOH   G 6 .   ? 2.62200  11.95800 28.72900  1.000 28.79819  ?  799 HOH   A O    1 
HETATM 4549 O O    . HOH   G 6 .   ? 6.94200  33.63000 12.29200  1.000 48.76374  ?  800 HOH   A O    1 
HETATM 4550 O O    . HOH   G 6 .   ? 28.65900 24.94200 -2.39800  1.000 42.02083  ?  801 HOH   A O    1 
HETATM 4551 O O    . HOH   G 6 .   ? 25.16500 13.42100 39.49800  1.000 24.02393  ?  802 HOH   A O    1 
HETATM 4552 O O    . HOH   G 6 .   ? 19.76700 7.72100  34.54400  1.000 41.96556  ?  803 HOH   A O    1 
HETATM 4553 O O    . HOH   G 6 .   ? 13.70600 4.84100  20.79400  1.000 47.19513  ?  804 HOH   A O    1 
HETATM 4554 O O    . HOH   G 6 .   ? 29.02800 32.94400 -4.32500  1.000 42.56300  ?  805 HOH   A O    1 
HETATM 4555 O O    . HOH   G 6 .   ? 0.10000  7.66500  25.93500  1.000 24.06868  ?  806 HOH   A O    1 
HETATM 4556 O O    . HOH   G 6 .   ? 27.07300 12.49600 0.68400   1.000 53.16164  ?  807 HOH   A O    1 
HETATM 4557 O O    . HOH   G 6 .   ? 12.35100 30.43900 1.03400   1.000 52.50103  ?  808 HOH   A O    1 
HETATM 4558 O O    . HOH   G 6 .   ? 12.59300 16.81700 39.62800  1.000 36.73862  ?  809 HOH   A O    1 
HETATM 4559 O O    . HOH   G 6 .   ? 19.33400 29.87500 -4.78700  1.000 41.34180  ?  810 HOH   A O    1 
HETATM 4560 O O    . HOH   G 6 .   ? 16.29800 3.33400  -3.83300  1.000 43.26835  ?  811 HOH   A O    1 
HETATM 4561 O O    . HOH   G 6 .   ? 12.58400 29.04900 36.00900  1.000 46.87667  ?  812 HOH   A O    1 
HETATM 4562 O O    . HOH   G 6 .   ? 4.47400  -4.80600 5.94600   1.000 44.23162  ?  813 HOH   A O    1 
HETATM 4563 O O    . HOH   G 6 .   ? 23.09500 15.50700 -3.17400  1.000 33.37505  ?  814 HOH   A O    1 
HETATM 4564 O O    . HOH   G 6 .   ? 29.31200 16.53600 13.89800  1.000 55.86196  ?  815 HOH   A O    1 
HETATM 4565 O O    . HOH   G 6 .   ? 21.48400 30.92900 -3.85400  1.000 32.99080  ?  816 HOH   A O    1 
HETATM 4566 O O    . HOH   G 6 .   ? 25.59700 23.84600 45.21800  1.000 53.43535  ?  817 HOH   A O    1 
HETATM 4567 O O    . HOH   G 6 .   ? 22.21000 7.62700  -1.49000  1.000 31.49851  ?  818 HOH   A O    1 
HETATM 4568 O O    . HOH   G 6 .   ? 14.26300 -4.29100 1.00400   1.000 53.95121  ?  819 HOH   A O    1 
HETATM 4569 O O    . HOH   G 6 .   ? 2.98600  23.94400 -2.83100  1.000 35.21475  ?  820 HOH   A O    1 
HETATM 4570 O O    . HOH   G 6 .   ? 25.77500 20.24900 45.23700  1.000 47.79784  ?  821 HOH   A O    1 
HETATM 4571 O O    . HOH   G 6 .   ? 3.29000  32.58100 9.37600   1.000 44.16056  ?  822 HOH   A O    1 
HETATM 4572 O O    . HOH   G 6 .   ? 34.35700 25.66500 2.88900   1.000 25.66887  ?  823 HOH   A O    1 
HETATM 4573 O O    . HOH   G 6 .   ? 4.66800  32.75900 22.03500  1.000 44.48165  ?  824 HOH   A O    1 
HETATM 4574 O O    . HOH   G 6 .   ? 14.04600 33.17700 2.19200   1.000 43.11306  ?  825 HOH   A O    1 
HETATM 4575 O O    . HOH   G 6 .   ? -1.10000 10.88900 12.11300  1.000 33.43296  ?  826 HOH   A O    1 
HETATM 4576 O O    . HOH   G 6 .   ? 3.97700  3.94000  1.68100   1.000 53.27218  ?  827 HOH   A O    1 
HETATM 4577 O O    . HOH   G 6 .   ? 10.28800 5.60500  24.19100  1.000 26.70320  ?  828 HOH   A O    1 
HETATM 4578 O O    . HOH   G 6 .   ? 26.23000 10.24400 37.33600  1.000 32.92763  ?  829 HOH   A O    1 
HETATM 4579 O O    . HOH   G 6 .   ? 22.80000 34.97300 36.57900  1.000 34.55941  ?  830 HOH   A O    1 
HETATM 4580 O O    . HOH   G 6 .   ? -6.92300 14.54700 18.11700  1.000 24.47136  ?  831 HOH   A O    1 
HETATM 4581 O O    . HOH   G 6 .   ? 12.92000 40.05800 32.73800  1.000 58.85706  ?  832 HOH   A O    1 
HETATM 4582 O O    . HOH   G 6 .   ? 14.91700 23.06400 -7.96000  1.000 40.74436  ?  833 HOH   A O    1 
HETATM 4583 O O    . HOH   G 6 .   ? -3.09400 7.54100  26.05900  1.000 51.30615  ?  834 HOH   A O    1 
HETATM 4584 O O    . HOH   G 6 .   ? 27.95400 23.63500 21.06000  1.000 53.14058  ?  835 HOH   A O    1 
HETATM 4585 O O    . HOH   G 6 .   ? 14.72600 23.59000 41.06100  1.000 50.20865  ?  836 HOH   A O    1 
HETATM 4586 O O    . HOH   G 6 .   ? 11.66400 1.58900  14.95100  1.000 27.49277  ?  837 HOH   A O    1 
HETATM 4587 O O    . HOH   G 6 .   ? 17.22800 21.67700 -9.78000  1.000 43.59733  ?  838 HOH   A O    1 
HETATM 4588 O O    . HOH   G 6 .   ? 20.02400 35.45300 10.12600  1.000 56.33044  ?  839 HOH   A O    1 
HETATM 4589 O O    . HOH   G 6 .   ? -3.61700 11.53000 11.57100  1.000 46.63191  ?  840 HOH   A O    1 
HETATM 4590 O O    . HOH   G 6 .   ? 4.57900  28.85900 31.47500  1.000 45.55546  ?  841 HOH   A O    1 
HETATM 4591 O O    . HOH   G 6 .   ? 26.62300 24.93500 21.98600  1.000 44.56324  ?  842 HOH   A O    1 
HETATM 4592 O O    . HOH   G 6 .   ? 6.43600  -0.26000 22.84700  1.000 51.12981  ?  843 HOH   A O    1 
HETATM 4593 O O    . HOH   G 6 .   ? 18.75000 10.35400 -8.36600  1.000 43.86579  ?  844 HOH   A O    1 
HETATM 4594 O O    . HOH   G 6 .   ? 28.15600 14.03700 -4.01300  1.000 53.13532  ?  845 HOH   A O    1 
HETATM 4595 O O    . HOH   G 6 .   ? -0.49400 19.70900 27.87200  1.000 46.26607  ?  846 HOH   A O    1 
HETATM 4596 O O    . HOH   G 6 .   ? 21.46300 3.51400  14.69200  1.000 47.44253  ?  847 HOH   A O    1 
HETATM 4597 O O    . HOH   G 6 .   ? 28.81800 13.83200 1.82100   1.000 47.08986  ?  848 HOH   A O    1 
HETATM 4598 O O    . HOH   G 6 .   ? 27.97900 8.78900  15.57200  1.000 57.21475  ?  849 HOH   A O    1 
HETATM 4599 O O    . HOH   G 6 .   ? 2.21600  28.43300 7.42300   1.000 47.14776  ?  850 HOH   A O    1 
HETATM 4600 O O    A HOH   G 6 .   ? 25.42700 12.25700 -0.51400  0.550 41.92871  ?  851 HOH   A O    1 
HETATM 4601 O O    . HOH   G 6 .   ? 24.42700 25.96700 27.52400  1.000 42.02872  ?  852 HOH   A O    1 
HETATM 4602 O O    . HOH   G 6 .   ? 29.45200 14.89500 10.74300  1.000 52.05361  ?  853 HOH   A O    1 
HETATM 4603 O O    . HOH   G 6 .   ? 6.24300  5.01700  24.18800  1.000 52.90634  ?  854 HOH   A O    1 
HETATM 4604 O O    . HOH   G 6 .   ? 22.03600 32.80700 -3.41700  1.000 56.86734  ?  855 HOH   A O    1 
HETATM 4605 O O    . HOH   G 6 .   ? 10.72400 -2.80700 7.47200   1.000 43.27361  ?  856 HOH   A O    1 
HETATM 4606 O O    . HOH   G 6 .   ? 29.58100 9.14500  14.68000  1.000 52.57472  ?  857 HOH   A O    1 
HETATM 4607 O O    . HOH   G 6 .   ? 16.41100 4.85500  -7.54400  1.000 55.40401  ?  858 HOH   A O    1 
HETATM 4608 O O    . HOH   G 6 .   ? 0.15900  25.19100 7.16600   1.000 33.75405  ?  859 HOH   A O    1 
HETATM 4609 O O    . HOH   G 6 .   ? 20.24200 7.11700  16.78900  1.000 57.70166  ?  860 HOH   A O    1 
HETATM 4610 O O    . HOH   G 6 .   ? 24.83700 19.65500 25.89900  1.000 37.77821  ?  861 HOH   A O    1 
HETATM 4611 O O    B HOH   G 6 .   ? 20.38700 7.56700  21.45700  0.710 39.67844  ?  862 HOH   A O    1 
HETATM 4612 O O    . HOH   G 6 .   ? 13.21500 3.54900  22.66600  1.000 48.71637  ?  863 HOH   A O    1 
HETATM 4613 O O    . HOH   G 6 .   ? 2.96900  29.49100 -8.42400  1.000 50.61133  ?  864 HOH   A O    1 
HETATM 4614 O O    A HOH   G 6 .   ? 15.05100 -0.07100 15.73500  1.000 48.00312  ?  865 HOH   A O    1 
HETATM 4615 O O    . HOH   G 6 .   ? 24.64800 8.92500  16.42400  1.000 52.22205  ?  866 HOH   A O    1 
HETATM 4616 O O    . HOH   G 6 .   ? 24.51200 6.76700  4.40900   1.000 30.68526  ?  867 HOH   A O    1 
HETATM 4617 O O    . HOH   G 6 .   ? 12.21500 9.73700  -10.48200 1.000 48.10050  ?  868 HOH   A O    1 
HETATM 4618 O O    . HOH   G 6 .   ? 20.51500 36.95900 34.42100  1.000 56.00672  ?  869 HOH   A O    1 
HETATM 4619 O O    . HOH   G 6 .   ? -1.60000 23.23100 7.01300   1.000 49.22695  ?  870 HOH   A O    1 
HETATM 4620 O O    . HOH   G 6 .   ? 3.49300  31.13400 23.15100  1.000 39.05468  ?  871 HOH   A O    1 
HETATM 4621 O O    . HOH   G 6 .   ? 17.76500 32.82700 38.94400  1.000 51.25088  ?  872 HOH   A O    1 
HETATM 4622 O O    . HOH   G 6 .   ? 6.78500  3.90600  22.50200  1.000 50.62449  ?  873 HOH   A O    1 
HETATM 4623 O O    . HOH   G 6 .   ? 25.97500 21.03100 30.33100  1.000 47.82942  ?  874 HOH   A O    1 
HETATM 4624 O O    . HOH   G 6 .   ? -5.01200 14.45800 11.78900  1.000 39.33630  ?  875 HOH   A O    1 
HETATM 4625 O O    . HOH   G 6 .   ? -0.79400 32.57200 18.39400  1.000 43.36836  ?  876 HOH   A O    1 
HETATM 4626 O O    . HOH   G 6 .   ? 27.52400 27.62900 -5.27000  1.000 43.77893  ?  877 HOH   A O    1 
HETATM 4627 O O    . HOH   G 6 .   ? 0.57200  4.58900  23.69800  1.000 28.84820  ?  878 HOH   A O    1 
HETATM 4628 O O    . HOH   G 6 .   ? 8.45100  34.38900 11.46400  1.000 51.15350  ?  879 HOH   A O    1 
HETATM 4629 O O    . HOH   G 6 .   ? 17.46900 10.30000 -10.44400 1.000 39.64949  ?  880 HOH   A O    1 
HETATM 4630 O O    . HOH   G 6 .   ? -5.67600 12.16900 17.81000  1.000 32.35651  ?  881 HOH   A O    1 
HETATM 4631 O O    . HOH   G 6 .   ? 20.45800 33.81300 23.81000  1.000 33.21451  ?  882 HOH   A O    1 
HETATM 4632 O O    . HOH   G 6 .   ? 2.55500  7.69700  12.45500  1.000 18.89437  ?  883 HOH   A O    1 
HETATM 4633 O O    . HOH   G 6 .   ? -2.09100 19.23600 25.44200  1.000 42.73670  ?  884 HOH   A O    1 
HETATM 4634 O O    . HOH   G 6 .   ? 17.33600 35.08200 40.25700  1.000 44.33163  ?  885 HOH   A O    1 
HETATM 4635 O O    . HOH   G 6 .   ? 21.85200 34.40000 29.42300  1.000 46.39240  ?  886 HOH   A O    1 
HETATM 4636 O O    . HOH   G 6 .   ? 20.28400 5.14600  16.53300  1.000 51.60092  ?  887 HOH   A O    1 
HETATM 4637 O O    . HOH   G 6 .   ? 19.51500 35.43600 28.06700  1.000 37.95192  ?  888 HOH   A O    1 
HETATM 4638 O O    . HOH   G 6 .   ? 0.00000  0.00000  19.93600  0.50  27.83228  ?  889 HOH   A O    1 
HETATM 4639 O O    . HOH   G 6 .   ? 24.84700 29.28600 36.35400  1.000 28.77187  ?  890 HOH   A O    1 
HETATM 4640 O O    . HOH   G 6 .   ? 5.65100  -8.39300 9.96400   1.000 44.98960  ?  891 HOH   A O    1 
HETATM 4641 O O    . HOH   G 6 .   ? -4.30000 5.95400  24.70600  1.000 58.67282  ?  892 HOH   A O    1 
HETATM 4642 O O    . HOH   G 6 .   ? 31.11300 32.84200 0.66800   1.000 66.86591  ?  893 HOH   A O    1 
HETATM 4643 O O    . HOH   G 6 .   ? 33.54100 27.81600 4.47600   1.000 39.18628  ?  894 HOH   A O    1 
HETATM 4644 O O    . HOH   G 6 .   ? 5.31900  1.79900  22.12000  1.000 37.20709  ?  895 HOH   A O    1 
HETATM 4645 O O    . HOH   G 6 .   ? 28.37900 14.18500 -0.40000  1.000 55.15135  ?  896 HOH   A O    1 
HETATM 4646 O O    . HOH   G 6 .   ? 1.38900  22.45100 4.94100   1.000 29.25088  ?  897 HOH   A O    1 
HETATM 4647 O O    . HOH   G 6 .   ? 3.93400  5.67900  -4.62200  1.000 51.53776  ?  898 HOH   A O    1 
HETATM 4648 O O    . HOH   G 6 .   ? -2.07700 10.58900 27.44000  1.000 52.96425  ?  899 HOH   A O    1 
HETATM 4649 O O    . HOH   G 6 .   ? 24.53400 10.80400 40.38000  1.000 23.92655  ?  900 HOH   A O    1 
HETATM 4650 O O    . HOH   G 6 .   ? 10.81600 2.07900  22.59100  1.000 50.33761  ?  901 HOH   A O    1 
HETATM 4651 O O    . HOH   G 6 .   ? 25.32800 28.44000 -6.77600  1.000 41.75237  ?  902 HOH   A O    1 
HETATM 4652 O O    . HOH   G 6 .   ? 18.70100 13.51200 44.00300  1.000 48.15314  ?  903 HOH   A O    1 
HETATM 4653 O O    . HOH   G 6 .   ? 10.63800 16.20600 35.00800  1.000 36.56754  ?  904 HOH   A O    1 
HETATM 4654 O O    . HOH   G 6 .   ? 6.41800  29.67900 5.44100   1.000 40.72857  ?  905 HOH   A O    1 
HETATM 4655 O O    . HOH   G 6 .   ? 4.50100  2.60200  -0.61100  1.000 45.89234  ?  906 HOH   A O    1 
HETATM 4656 O O    . HOH   G 6 .   ? 9.06400  16.34600 -13.37400 1.000 46.58190  ?  907 HOH   A O    1 
HETATM 4657 O O    . HOH   G 6 .   ? 29.56100 11.94200 6.57500   1.000 44.20530  ?  908 HOH   A O    1 
HETATM 4658 O O    . HOH   G 6 .   ? 0.65000  32.20700 22.87300  1.000 48.81112  ?  909 HOH   A O    1 
HETATM 4659 O O    . HOH   G 6 .   ? 14.89200 40.62500 22.64300  1.000 56.56204  ?  910 HOH   A O    1 
HETATM 4660 O O    . HOH   G 6 .   ? 23.76800 9.56700  18.94500  1.000 49.62174  ?  911 HOH   A O    1 
HETATM 4661 O O    . HOH   G 6 .   ? 19.23200 37.46700 38.26500  1.000 42.31034  ?  912 HOH   A O    1 
HETATM 4662 O O    . HOH   G 6 .   ? -1.61300 31.12600 11.74900  1.000 34.63836  ?  913 HOH   A O    1 
HETATM 4663 O O    . HOH   G 6 .   ? -2.40300 5.52000  25.33500  1.000 47.71888  ?  914 HOH   A O    1 
HETATM 4664 O O    . HOH   G 6 .   ? 18.95800 34.58800 1.40200   1.000 55.34611  ?  915 HOH   A O    1 
HETATM 4665 O O    . HOH   G 6 .   ? 22.54600 4.26200  1.45500   1.000 47.88732  ?  916 HOH   A O    1 
HETATM 4666 O O    . HOH   G 6 .   ? 6.90100  35.28000 14.26800  1.000 39.18365  ?  917 HOH   A O    1 
HETATM 4667 O O    . HOH   G 6 .   ? -0.90500 6.81100  -1.61100  1.000 65.84474  ?  918 HOH   A O    1 
HETATM 4668 O O    . HOH   G 6 .   ? 27.29600 31.53200 6.07800   1.000 50.85083  ?  919 HOH   A O    1 
HETATM 4669 O O    . HOH   G 6 .   ? -1.00800 26.90100 28.00100  1.000 49.66122  ?  920 HOH   A O    1 
HETATM 4670 O O    . HOH   G 6 .   ? 2.83300  1.62700  4.28400   1.000 48.58477  ?  921 HOH   A O    1 
HETATM 4671 O O    . HOH   G 6 .   ? 6.39200  8.72600  -7.12500  1.000 40.89964  ?  922 HOH   A O    1 
HETATM 4672 O O    . HOH   G 6 .   ? 18.82200 35.32200 -1.00200  1.000 46.93984  ?  923 HOH   A O    1 
HETATM 4673 O O    . HOH   G 6 .   ? 7.87300  15.07300 -9.05800  1.000 52.34049  ?  924 HOH   A O    1 
HETATM 4674 O O    . HOH   G 6 .   ? 2.30400  -4.14400 5.68800   1.000 46.16343  ?  925 HOH   A O    1 
HETATM 4675 O O    . HOH   G 6 .   ? 3.78100  35.27700 21.91200  1.000 55.49086  ?  926 HOH   A O    1 
HETATM 4676 O O    . HOH   G 6 .   ? 26.34400 33.31000 36.18000  1.000 25.37673  ?  927 HOH   A O    1 
HETATM 4677 O O    . HOH   G 6 .   ? 7.04600  33.09500 23.35700  1.000 41.41549  ?  928 HOH   A O    1 
HETATM 4678 O O    . HOH   G 6 .   ? -2.99000 7.37800  8.12400   1.000 49.53489  ?  929 HOH   A O    1 
HETATM 4679 O O    . HOH   G 6 .   ? 35.12000 16.09300 2.17700   1.000 38.93888  ?  930 HOH   A O    1 
HETATM 4680 O O    . HOH   G 6 .   ? 0.52200  2.20400  8.24300   1.000 21.11043  ?  931 HOH   A O    1 
HETATM 4681 O O    . HOH   G 6 .   ? -3.42600 29.96400 15.69200  1.000 32.61707  ?  932 HOH   A O    1 
HETATM 4682 O O    . HOH   G 6 .   ? 10.10500 6.83200  31.74700  1.000 42.28402  ?  933 HOH   A O    1 
HETATM 4683 O O    B HOH   G 6 .   ? 21.74600 8.71600  24.64500  0.640 40.30483  ?  934 HOH   A O    1 
HETATM 4684 O O    . HOH   G 6 .   ? 31.99500 13.92000 2.18300   1.000 41.57604  ?  935 HOH   A O    1 
HETATM 4685 O O    . HOH   G 6 .   ? -3.80300 9.29200  8.74000   1.000 48.30316  ?  936 HOH   A O    1 
HETATM 4686 O O    . HOH   G 6 .   ? 19.43100 8.10700  -7.12000  1.000 45.85550  ?  937 HOH   A O    1 
HETATM 4687 O O    . HOH   G 6 .   ? 20.44100 36.01100 37.02300  1.000 38.38355  ?  938 HOH   A O    1 
HETATM 4688 O O    . HOH   G 6 .   ? -2.78800 20.41400 28.18400  1.000 58.88864  ?  939 HOH   A O    1 
HETATM 4689 O O    . HOH   G 6 .   ? -6.80500 13.23200 13.83300  1.000 29.97465  ?  940 HOH   A O    1 
HETATM 4690 O O    . HOH   G 6 .   ? 0.44500  9.81800  28.06100  1.000 34.74890  ?  941 HOH   A O    1 
HETATM 4691 O O    . HOH   G 6 .   ? 25.78100 23.86800 27.62200  1.000 38.48356  ?  942 HOH   A O    1 
HETATM 4692 O O    . HOH   G 6 .   ? 11.41300 21.68600 37.65100  1.000 49.18748  ?  943 HOH   A O    1 
HETATM 4693 O O    . HOH   G 6 .   ? 10.61100 16.60800 37.61200  1.000 48.78216  ?  944 HOH   A O    1 
HETATM 4694 O O    . HOH   G 6 .   ? 7.76300  34.92800 21.02600  1.000 53.58011  ?  945 HOH   A O    1 
HETATM 4695 O O    . HOH   G 6 .   ? 18.34100 6.91000  -3.70700  1.000 49.59279  ?  946 HOH   A O    1 
HETATM 4696 O O    . HOH   G 6 .   ? 1.02900  2.26300  22.46700  1.000 36.32278  ?  947 HOH   A O    1 
HETATM 4697 O O    . HOH   G 6 .   ? 8.98300  -0.77700 22.42100  1.000 46.62664  ?  948 HOH   A O    1 
HETATM 4698 O O    . HOH   G 6 .   ? 24.51000 33.11600 38.10500  1.000 32.07753  ?  949 HOH   A O    1 
HETATM 4699 O O    . HOH   G 6 .   ? 20.88000 8.20600  39.04100  1.000 42.57089  ?  950 HOH   A O    1 
HETATM 4700 O O    . HOH   G 6 .   ? 7.43900  33.93900 7.35700   1.000 49.63490  ?  951 HOH   A O    1 
HETATM 4701 O O    . HOH   G 6 .   ? 10.67300 4.22200  31.84500  1.000 48.19262  ?  952 HOH   A O    1 
HETATM 4702 O O    . HOH   G 6 .   ? 20.15600 33.77600 5.68200   1.000 43.02095  ?  953 HOH   A O    1 
HETATM 4703 O O    . HOH   G 6 .   ? 12.66600 4.60800  -9.61800  1.000 44.43427  ?  954 HOH   A O    1 
HETATM 4704 O O    . HOH   G 6 .   ? 16.61200 23.97800 45.74300  1.000 49.32433  ?  955 HOH   A O    1 
HETATM 4705 O O    . HOH   G 6 .   ? -6.36600 13.44500 12.13300  1.000 47.85047  ?  956 HOH   A O    1 
HETATM 4706 O O    . HOH   G 6 .   ? 0.25000  1.29900  5.64200   1.000 37.98350  ?  957 HOH   A O    1 
HETATM 4707 O O    . HOH   G 6 .   ? 23.48100 10.17800 42.71600  1.000 35.41740  ?  958 HOH   A O    1 
HETATM 4708 O O    . HOH   G 6 .   ? -4.53400 30.47800 11.43000  1.000 49.27170  ?  959 HOH   A O    1 
HETATM 4709 O O    . HOH   G 6 .   ? -0.18900 3.58100  26.29700  1.000 51.15613  ?  960 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   . HIS   A 20  ? 1.25580 1.29940 1.23210 0.00130  -0.00090 0.01810  23  HIS   A N   
2    C CA  . HIS   A 20  ? 1.18570 1.18570 1.18570 0.00110  -0.02830 0.02620  23  HIS   A CA  
3    C C   . HIS   A 20  ? 0.86600 1.02170 0.89690 -0.00740 -0.06200 0.01970  23  HIS   A C   
4    O O   . HIS   A 20  ? 0.78550 1.08580 0.81670 -0.01060 -0.06330 0.02940  23  HIS   A O   
5    C CB  . HIS   A 20  ? 1.27370 1.29770 1.24300 0.00350  -0.01050 0.01580  23  HIS   A CB  
6    C CG  . HIS   A 20  ? 1.16210 1.29860 1.13360 0.00060  -0.00690 0.01100  23  HIS   A CG  
7    N ND1 . HIS   A 20  ? 1.23790 1.23790 1.23790 -0.00020 0.00260  0.01100  23  HIS   A ND1 
8    C CD2 . HIS   A 20  ? 1.08520 1.42960 1.01350 -0.00400 -0.01500 0.01680  23  HIS   A CD2 
9    C CE1 . HIS   A 20  ? 1.06780 1.20760 1.05300 -0.00430 0.00070  0.01770  23  HIS   A CE1 
10   N NE2 . HIS   A 20  ? 1.06640 1.15380 1.05880 -0.00460 -0.00900 0.01660  23  HIS   A NE2 
11   N N   . MET   A 21  ? 0.72720 0.99880 0.74500 -0.00330 -0.06800 0.04680  24  MET   A N   
12   C CA  . MET   A 21  ? 0.67610 0.95000 0.70630 -0.00410 -0.08870 0.05240  24  MET   A CA  
13   C C   . MET   A 21  ? 0.44040 0.71320 0.52760 -0.01230 -0.11820 0.05170  24  MET   A C   
14   O O   . MET   A 21  ? 0.40420 0.65210 0.48480 -0.02770 -0.15920 0.04410  24  MET   A O   
15   C CB  . MET   A 21  ? 0.93240 1.09920 0.94550 0.00010  -0.06330 0.04420  24  MET   A CB  
16   C CG  . MET   A 21  ? 1.19470 1.31820 1.18810 0.00490  -0.03900 0.04340  24  MET   A CG  
17   S SD  . MET   A 21  ? 1.45740 1.45740 1.45740 0.00620  -0.01580 0.01570  24  MET   A SD  
18   C CE  . MET   A 21  ? 1.54450 1.59180 1.51600 0.00460  -0.00690 0.00280  24  MET   A CE  
21   N N   . LEU   A 22  ? 0.24850 0.51660 0.38360 -0.00020 -0.08200 0.04580  25  LEU   A N   
22   C CA  . LEU   A 22  ? 0.22160 0.47970 0.35580 -0.00610 -0.06180 0.06080  25  LEU   A CA  
23   C C   . LEU   A 22  ? 0.18690 0.45890 0.32210 -0.01110 -0.05070 0.04310  25  LEU   A C   
24   O O   . LEU   A 22  ? 0.18560 0.44730 0.28960 -0.02170 -0.04720 0.04750  25  LEU   A O   
25   C CB  . LEU   A 22  ? 0.25250 0.46770 0.36580 -0.00180 -0.05340 0.08770  25  LEU   A CB  
26   C CG  . LEU   A 22  ? 0.28750 0.46180 0.38440 -0.01220 -0.01170 0.09410  25  LEU   A CG  
27   C CD1 . LEU   A 22  ? 0.32590 0.46560 0.40720 -0.00440 -0.00800 0.09140  25  LEU   A CD1 
28   C CD2 . LEU   A 22  ? 0.32270 0.46230 0.41600 -0.02180 0.02030  0.08700  25  LEU   A CD2 
40   N N   . THR   A 23  ? 0.18760 0.45270 0.32150 -0.02220 -0.04290 0.02260  26  THR   A N   
41   C CA  . THR   A 23  ? 0.17710 0.45020 0.29250 -0.00680 -0.03120 0.00590  26  THR   A CA  
42   C C   . THR   A 23  ? 0.18330 0.44560 0.24990 -0.01600 -0.00550 0.01800  26  THR   A C   
43   O O   . THR   A 23  ? 0.20050 0.44630 0.23780 -0.01270 -0.01820 0.04940  26  THR   A O   
44   C CB  . THR   A 23  ? 0.19880 0.44940 0.30150 0.00930  -0.01210 -0.00980 26  THR   A CB  
45   O OG1 . THR   A 23  ? 0.22140 0.45400 0.34310 0.03390  -0.02560 -0.02980 26  THR   A OG1 
46   C CG2 . THR   A 23  ? 0.20820 0.45470 0.27700 0.00270  0.00550  -0.00320 26  THR   A CG2 
54   N N   . ASN   A 24  ? 0.17360 0.43970 0.23020 -0.00360 0.01200  0.03150  27  ASN   A N   
55   C CA  . ASN   A 24  ? 0.20240 0.44220 0.20430 -0.00740 0.01870  0.04700  27  ASN   A CA  
56   C C   . ASN   A 24  ? 0.22930 0.45520 0.21140 -0.00980 -0.00170 0.04560  27  ASN   A C   
57   O O   . ASN   A 24  ? 0.23790 0.46510 0.21470 -0.01220 0.00830  0.01040  27  ASN   A O   
58   C CB  . ASN   A 24  ? 0.21040 0.44840 0.21960 -0.01550 0.01750  0.04020  27  ASN   A CB  
59   C CG  . ASN   A 24  ? 0.18620 0.44150 0.19980 -0.02060 0.00550  0.03520  27  ASN   A CG  
60   O OD1 . ASN   A 24  ? 0.18290 0.43380 0.19710 -0.02480 -0.00150 0.03570  27  ASN   A OD1 
61   N ND2 . ASN   A 24  ? 0.17790 0.44570 0.20710 -0.03020 0.00190  0.04170  27  ASN   A ND2 
68   N N   . LEU   A 25  ? 0.24910 0.45560 0.22580 -0.01380 0.02780  0.06670  28  LEU   A N   
69   C CA  . LEU   A 25  ? 0.28880 0.46090 0.24170 -0.01540 0.02160  0.05190  28  LEU   A CA  
70   C C   . LEU   A 25  ? 0.29540 0.46830 0.23290 -0.02580 0.04020  0.04130  28  LEU   A C   
71   O O   . LEU   A 25  ? 0.33330 0.48330 0.23280 -0.02170 0.02050  0.05070  28  LEU   A O   
72   C CB  . LEU   A 25  ? 0.31860 0.46980 0.29610 -0.01500 0.03710  0.05920  28  LEU   A CB  
73   C CG  . LEU   A 25  ? 0.34850 0.47800 0.34650 -0.01820 0.02420  0.06200  28  LEU   A CG  
74   C CD1 . LEU   A 25  ? 0.36390 0.47880 0.37160 -0.02480 0.03500  0.06250  28  LEU   A CD1 
75   C CD2 . LEU   A 25  ? 0.35020 0.48210 0.36910 -0.00910 0.00780  0.06840  28  LEU   A CD2 
87   N N   . VAL   A 26  ? 0.27740 0.45800 0.21670 -0.02470 0.02860  0.02280  29  VAL   A N   
88   C CA  . VAL   A 26  ? 0.27970 0.45260 0.21790 -0.03620 0.05630  0.02460  29  VAL   A CA  
89   C C   . VAL   A 26  ? 0.28840 0.45430 0.22780 -0.05820 0.02820  0.02760  29  VAL   A C   
90   O O   . VAL   A 26  ? 0.30900 0.46230 0.24280 -0.07890 0.02950  0.03930  29  VAL   A O   
91   C CB  . VAL   A 26  ? 0.28940 0.45570 0.24260 -0.00760 0.10190  0.02100  29  VAL   A CB  
92   C CG1 . VAL   A 26  ? 0.30230 0.45790 0.25430 -0.00560 0.09570  -0.00190 29  VAL   A CG1 
93   C CG2 . VAL   A 26  ? 0.29070 0.45520 0.29650 -0.00180 0.09220  0.02930  29  VAL   A CG2 
103  N N   . ALA   A 27  ? 0.28080 0.44940 0.23950 -0.04460 0.00620  0.04030  30  ALA   A N   
104  C CA  . ALA   A 27  ? 0.26390 0.44150 0.24940 -0.04050 -0.00750 0.02490  30  ALA   A CA  
105  C C   . ALA   A 27  ? 0.21160 0.42570 0.23140 -0.02260 0.01080  0.01830  30  ALA   A C   
106  O O   . ALA   A 27  ? 0.22380 0.43270 0.23570 -0.00650 0.01580  0.02610  30  ALA   A O   
107  C CB  . ALA   A 27  ? 0.29020 0.44500 0.23760 -0.04830 -0.03370 0.02810  30  ALA   A CB  
113  N N   . GLU   A 28  ? 0.20540 0.40810 0.23850 -0.02520 -0.00690 0.00070  31  GLU   A N   
114  C CA  . GLU   A 28  ? 0.20820 0.40120 0.24000 -0.02150 0.00200  -0.00710 31  GLU   A CA  
115  C C   . GLU   A 28  ? 0.20430 0.39660 0.23840 -0.01920 0.01010  -0.00940 31  GLU   A C   
116  O O   . GLU   A 28  ? 0.19760 0.40190 0.26200 -0.01910 0.00910  0.00030  31  GLU   A O   
117  C CB  . GLU   A 28  ? 0.22700 0.40440 0.22690 -0.02960 0.00620  -0.00960 31  GLU   A CB  
118  C CG  . GLU   A 28  ? 0.21150 0.40980 0.24380 -0.03830 -0.00370 -0.00310 31  GLU   A CG  
119  C CD  . GLU   A 28  ? 0.24760 0.41410 0.29020 -0.03980 0.00390  -0.00100 31  GLU   A CD  
120  O OE1 . GLU   A 28  ? 0.24580 0.42350 0.32580 -0.03500 0.00220  0.00810  31  GLU   A OE1 
121  O OE2 . GLU   A 28  ? 0.26220 0.41100 0.29450 -0.03880 0.02310  0.00640  31  GLU   A OE2 
128  N N   . PRO   A 29  ? 0.21530 0.39160 0.24260 -0.01460 0.03130  -0.03200 32  PRO   A N   
129  C CA  . PRO   A 29  ? 0.23050 0.37210 0.24190 -0.01920 0.01880  -0.02340 32  PRO   A CA  
130  C C   . PRO   A 29  ? 0.21660 0.35890 0.24190 -0.02260 0.00330  -0.01720 32  PRO   A C   
131  O O   . PRO   A 29  ? 0.22160 0.34280 0.25270 -0.01700 0.02290  -0.03420 32  PRO   A O   
132  C CB  . PRO   A 29  ? 0.23640 0.37660 0.25210 -0.01360 0.02100  -0.02450 32  PRO   A CB  
133  C CG  . PRO   A 29  ? 0.23270 0.37680 0.25020 -0.01440 0.01920  -0.03040 32  PRO   A CG  
134  C CD  . PRO   A 29  ? 0.21880 0.38550 0.24680 -0.00660 0.03460  -0.03230 32  PRO   A CD  
142  N N   . PHE   A 30  ? 0.19100 0.35820 0.22310 -0.01900 0.01350  -0.01400 33  PHE   A N   
143  C CA  . PHE   A 30  ? 0.19270 0.35550 0.23090 -0.01370 0.00430  0.00170  33  PHE   A CA  
144  C C   . PHE   A 30  ? 0.18730 0.36730 0.23780 -0.00690 -0.00720 0.01030  33  PHE   A C   
145  O O   . PHE   A 30  ? 0.17140 0.36820 0.26680 -0.01270 -0.01210 0.01760  33  PHE   A O   
146  C CB  . PHE   A 30  ? 0.17910 0.33760 0.24450 0.00490  0.00740  -0.00390 33  PHE   A CB  
147  C CG  . PHE   A 30  ? 0.16380 0.32070 0.22100 0.00260  -0.00290 -0.00890 33  PHE   A CG  
148  C CD1 . PHE   A 30  ? 0.17350 0.32000 0.25890 0.01640  0.00620  -0.02320 33  PHE   A CD1 
149  C CD2 . PHE   A 30  ? 0.16920 0.30840 0.21280 -0.00990 -0.02600 -0.01480 33  PHE   A CD2 
150  C CE1 . PHE   A 30  ? 0.15870 0.31300 0.25430 0.01010  0.01890  -0.02340 33  PHE   A CE1 
151  C CE2 . PHE   A 30  ? 0.18650 0.30650 0.23460 -0.01440 0.01330  -0.02120 33  PHE   A CE2 
152  C CZ  . PHE   A 30  ? 0.16660 0.31140 0.25670 0.00450  0.02450  -0.02120 33  PHE   A CZ  
162  N N   . ALA   A 31  ? 0.20910 0.38250 0.24680 -0.01720 -0.00890 0.00600  34  ALA   A N   
163  C CA  . ALA   A 31  ? 0.20660 0.38500 0.24010 -0.03440 -0.02950 -0.00260 34  ALA   A CA  
164  C C   . ALA   A 31  ? 0.23420 0.37510 0.24440 -0.03420 -0.00520 -0.02870 34  ALA   A C   
165  O O   . ALA   A 31  ? 0.24160 0.34840 0.26320 -0.04160 0.00450  -0.01610 34  ALA   A O   
166  C CB  . ALA   A 31  ? 0.22610 0.39620 0.25010 -0.04020 -0.03490 -0.00380 34  ALA   A CB  
172  N N   . LYS   A 32  ? 0.24200 0.38290 0.24900 -0.01310 0.00580  -0.04240 35  LYS   A N   
173  C CA  . LYS   A 32  ? 0.26840 0.38770 0.25900 -0.00330 0.01990  -0.03850 35  LYS   A CA  
174  C C   . LYS   A 32  ? 0.23270 0.36630 0.26090 0.00360  0.01070  -0.03950 35  LYS   A C   
175  O O   . LYS   A 32  ? 0.23460 0.36090 0.26350 -0.00210 0.01620  -0.03660 35  LYS   A O   
176  C CB  . LYS   A 32  ? 0.32270 0.42090 0.29530 0.00140  0.03780  -0.04160 35  LYS   A CB  
177  C CG  . LYS   A 32  ? 0.37080 0.45850 0.37480 0.01660  0.05090  -0.04240 35  LYS   A CG  
178  C CD  . LYS   A 32  ? 0.41660 0.48750 0.47700 0.02250  0.04050  -0.04470 35  LYS   A CD  
179  C CE  . LYS   A 32  ? 0.44470 0.50770 0.53640 0.02770  0.04000  -0.04960 35  LYS   A CE  
180  N NZ  . LYS   A 32  ? 0.46520 0.51690 0.57160 0.02850  0.04340  -0.05720 35  LYS   A NZ  
194  N N   . LEU   A 33  ? 0.20120 0.35540 0.25680 0.01080  0.02910  -0.03180 36  LEU   A N   
195  C CA  . LEU   A 33  ? 0.16880 0.34590 0.25610 0.01090  0.02250  -0.03430 36  LEU   A CA  
196  C C   . LEU   A 33  ? 0.14910 0.33610 0.25400 0.00890  0.00900  -0.01450 36  LEU   A C   
197  O O   . LEU   A 33  ? 0.14890 0.32820 0.24790 0.02070  0.02030  0.00140  36  LEU   A O   
198  C CB  . LEU   A 33  ? 0.16660 0.34560 0.28580 0.01510  0.02190  -0.02410 36  LEU   A CB  
199  C CG  . LEU   A 33  ? 0.17890 0.34480 0.30040 -0.00180 -0.00310 -0.02960 36  LEU   A CG  
200  C CD1 . LEU   A 33  ? 0.21000 0.35700 0.35720 0.00350  -0.01350 -0.03640 36  LEU   A CD1 
201  C CD2 . LEU   A 33  ? 0.18620 0.34220 0.30920 -0.01820 0.01170  -0.02560 36  LEU   A CD2 
213  N N   . GLU   A 34  ? 0.15240 0.34350 0.26870 0.00650  -0.01070 -0.02170 37  GLU   A N   
214  C CA  . GLU   A 34  ? 0.14640 0.34310 0.30550 0.00970  0.01520  -0.00480 37  GLU   A CA  
215  C C   . GLU   A 34  ? 0.17450 0.34370 0.31240 -0.00320 0.01530  -0.00200 37  GLU   A C   
216  O O   . GLU   A 34  ? 0.18920 0.34040 0.32780 -0.01050 -0.00460 0.02470  37  GLU   A O   
217  C CB  . GLU   A 34  ? 0.17130 0.34700 0.30420 0.01900  0.01990  -0.00990 37  GLU   A CB  
218  C CG  . GLU   A 34  ? 0.19880 0.33520 0.26910 0.01340  -0.00850 -0.00030 37  GLU   A CG  
219  C CD  . GLU   A 34  ? 0.15370 0.32380 0.22620 -0.00200 0.00540  -0.01450 37  GLU   A CD  
220  O OE1 . GLU   A 34  ? 0.13430 0.30250 0.21230 -0.00800 -0.00510 -0.00280 37  GLU   A OE1 
221  O OE2 . GLU   A 34  ? 0.17770 0.33540 0.22230 -0.00030 -0.00890 -0.03550 37  GLU   A OE2 
228  N N   . GLN   A 35  ? 0.20670 0.34670 0.32910 -0.01070 -0.00160 -0.00280 38  GLN   A N   
229  C CA  . GLN   A 35  ? 0.29510 0.35040 0.31190 0.00530  -0.01990 -0.02970 38  GLN   A CA  
230  C C   . GLN   A 35  ? 0.31480 0.33940 0.30820 0.00420  -0.00700 -0.04560 38  GLN   A C   
231  O O   . GLN   A 35  ? 0.33310 0.33510 0.30890 -0.01230 -0.01720 -0.03760 38  GLN   A O   
232  C CB  . GLN   A 35  ? 0.33160 0.36090 0.33440 0.01030  -0.02280 -0.03030 38  GLN   A CB  
233  C CG  . GLN   A 35  ? 0.37480 0.38280 0.34450 0.02170  -0.02450 -0.02850 38  GLN   A CG  
234  C CD  . GLN   A 35  ? 0.40290 0.39460 0.34840 0.03610  -0.02680 -0.02790 38  GLN   A CD  
235  O OE1 . GLN   A 35  ? 0.41670 0.40300 0.38280 0.05840  -0.02170 -0.03190 38  GLN   A OE1 
236  N NE2 . GLN   A 35  ? 0.39770 0.39370 0.31650 0.03580  -0.02340 -0.02110 38  GLN   A NE2 
245  N N   . ASP   A 36  ? 0.30670 0.34750 0.29890 0.01730  0.02840  -0.04700 39  ASP   A N   
246  C CA  . ASP   A 36  ? 0.31110 0.35920 0.30560 0.04370  0.05990  -0.05330 39  ASP   A CA  
247  C C   . ASP   A 36  ? 0.27580 0.33930 0.27940 0.04290  0.04050  -0.03950 39  ASP   A C   
248  O O   . ASP   A 36  ? 0.30550 0.34320 0.32020 0.05060  0.05150  -0.03280 39  ASP   A O   
249  C CB  . ASP   A 36  ? 0.35750 0.39700 0.32710 0.05830  0.09650  -0.05440 39  ASP   A CB  
250  C CG  . ASP   A 36  ? 0.40920 0.43710 0.37070 0.05570  0.09290  -0.04870 39  ASP   A CG  
251  O OD1 . ASP   A 36  ? 0.44520 0.45200 0.38490 0.06580  0.07260  -0.05740 39  ASP   A OD1 
252  O OD2 . ASP   A 36  ? 0.39830 0.45900 0.38480 0.07740  0.13570  -0.03930 39  ASP   A OD2 
257  N N   . PHE   A 37  ? 0.21640 0.33050 0.26310 0.03070  0.02310  -0.03600 40  PHE   A N   
258  C CA  . PHE   A 37  ? 0.19740 0.31100 0.24470 0.00240  0.01010  -0.02150 40  PHE   A CA  
259  C C   . PHE   A 37  ? 0.21320 0.30380 0.24260 0.01110  0.01600  -0.02080 40  PHE   A C   
260  O O   . PHE   A 37  ? 0.23900 0.30780 0.24920 0.01090  0.01310  -0.02670 40  PHE   A O   
261  C CB  . PHE   A 37  ? 0.17230 0.30520 0.25970 0.00760  0.00360  -0.02660 40  PHE   A CB  
262  C CG  . PHE   A 37  ? 0.14740 0.30370 0.25600 -0.00150 0.02170  -0.01730 40  PHE   A CG  
263  C CD1 . PHE   A 37  ? 0.16770 0.31120 0.27350 0.01220  0.01360  -0.02690 40  PHE   A CD1 
264  C CD2 . PHE   A 37  ? 0.15750 0.29400 0.26180 -0.02310 0.02460  -0.01600 40  PHE   A CD2 
265  C CE1 . PHE   A 37  ? 0.16110 0.31190 0.27030 -0.00140 0.01670  -0.01440 40  PHE   A CE1 
266  C CE2 . PHE   A 37  ? 0.14840 0.29790 0.27510 -0.02310 0.04160  -0.03350 40  PHE   A CE2 
267  C CZ  . PHE   A 37  ? 0.15810 0.30460 0.25180 -0.01410 0.03290  -0.03280 40  PHE   A CZ  
277  N N   . GLY   A 38  ? 0.20580 0.28860 0.27010 0.01690  0.00810  -0.00100 41  GLY   A N   
278  C CA  . GLY   A 38  ? 0.22120 0.27310 0.26940 0.00150  0.02190  0.00520  41  GLY   A CA  
279  C C   . GLY   A 38  ? 0.20970 0.26000 0.26090 -0.01270 0.03970  0.00170  41  GLY   A C   
280  O O   . GLY   A 38  ? 0.23520 0.26890 0.27990 0.00140  0.05340  -0.01020 41  GLY   A O   
284  N N   . GLY   A 39  ? 0.17980 0.25910 0.22660 -0.00680 0.03570  -0.00620 42  GLY   A N   
285  C CA  . GLY   A 39  ? 0.18490 0.26270 0.22610 -0.01150 0.02880  -0.02930 42  GLY   A CA  
286  C C   . GLY   A 39  ? 0.18120 0.28390 0.20860 -0.00890 0.04490  -0.01600 42  GLY   A C   
287  O O   . GLY   A 39  ? 0.27090 0.30580 0.24220 0.01870  0.04180  -0.03090 42  GLY   A O   
291  N N   . SER   A 40  ? 0.13250 0.27710 0.19620 -0.00680 0.00350  -0.00030 43  SER   A N   
292  C CA  . SER   A 40  ? 0.12240 0.27430 0.21750 -0.01830 0.00620  -0.00560 43  SER   A CA  
293  C C   . SER   A 40  ? 0.12180 0.27060 0.20520 -0.01410 0.00230  0.00940  43  SER   A C   
294  O O   . SER   A 40  ? 0.14590 0.26650 0.20620 -0.01470 -0.00030 -0.00490 43  SER   A O   
295  C CB  . SER   A 40  ? 0.10430 0.29100 0.25060 -0.01680 0.02440  -0.02330 43  SER   A CB  
296  O OG  . SER   A 40  ? 0.14720 0.30550 0.25270 -0.02420 0.01490  -0.02780 43  SER   A OG  
302  N N   . ILE   A 41  ? 0.12450 0.29070 0.19160 -0.02480 -0.00100 -0.01350 44  ILE   A N   
303  C CA  . ILE   A 41  ? 0.12120 0.30770 0.19510 -0.00940 -0.00080 0.00440  44  ILE   A CA  
304  C C   . ILE   A 41  ? 0.11480 0.30050 0.19060 0.00760  0.00060  0.01500  44  ILE   A C   
305  O O   . ILE   A 41  ? 0.16110 0.29400 0.19160 -0.00050 -0.01730 0.02000  44  ILE   A O   
306  C CB  . ILE   A 41  ? 0.11700 0.33520 0.24930 -0.00200 0.02020  -0.00400 44  ILE   A CB  
307  C CG1 . ILE   A 41  ? 0.12120 0.35220 0.27580 -0.01060 0.02340  -0.00830 44  ILE   A CG1 
308  C CG2 . ILE   A 41  ? 0.13940 0.35970 0.26950 0.00000  0.03450  -0.01460 44  ILE   A CG2 
309  C CD1 . ILE   A 41  ? 0.15870 0.36550 0.33160 -0.01020 0.02000  -0.00630 44  ILE   A CD1 
321  N N   . GLY   A 42  ? 0.12260 0.28970 0.16430 -0.01630 0.00970  0.01950  45  GLY   A N   
322  C CA  . GLY   A 42  ? 0.10630 0.27320 0.17480 -0.02380 0.00640  0.02230  45  GLY   A CA  
323  C C   . GLY   A 42  ? 0.09490 0.27170 0.18940 -0.00750 -0.00300 0.02830  45  GLY   A C   
324  O O   . GLY   A 42  ? 0.10400 0.26110 0.19200 -0.01100 -0.00600 0.02580  45  GLY   A O   
328  N N   . VAL   A 43  ? 0.09800 0.27670 0.19020 -0.02000 -0.00660 0.03390  46  VAL   A N   
329  C CA  . VAL   A 43  ? 0.12630 0.29120 0.18210 -0.02300 0.00040  0.04030  46  VAL   A CA  
330  C C   . VAL   A 43  ? 0.12380 0.29830 0.18770 -0.01670 -0.00220 0.04120  46  VAL   A C   
331  O O   . VAL   A 43  ? 0.12400 0.29710 0.18990 -0.01080 -0.01320 0.03600  46  VAL   A O   
332  C CB  . VAL   A 43  ? 0.14090 0.29630 0.19660 -0.00130 0.00220  0.04770  46  VAL   A CB  
333  C CG1 . VAL   A 43  ? 0.14720 0.30010 0.23420 -0.00700 0.03400  0.04220  46  VAL   A CG1 
334  C CG2 . VAL   A 43  ? 0.17880 0.29760 0.21700 0.00650  0.02130  0.04590  46  VAL   A CG2 
344  N N   . TYR   A 44  ? 0.11320 0.31300 0.18270 -0.01830 -0.01750 0.04450  47  TYR   A N   
345  C CA  . TYR   A 44  ? 0.11570 0.32020 0.18800 -0.02530 0.00080  0.03800  47  TYR   A CA  
346  C C   . TYR   A 44  ? 0.13260 0.32360 0.21430 -0.02930 -0.01160 0.04760  47  TYR   A C   
347  O O   . TYR   A 44  ? 0.16290 0.33610 0.22260 -0.06160 -0.04470 0.06600  47  TYR   A O   
348  C CB  . TYR   A 44  ? 0.12800 0.33650 0.17440 -0.01490 0.01240  0.03520  47  TYR   A CB  
349  C CG  . TYR   A 44  ? 0.13620 0.34580 0.18470 -0.00710 0.00990  0.03330  47  TYR   A CG  
350  C CD1 . TYR   A 44  ? 0.13290 0.34750 0.17800 0.00620  0.00080  0.03460  47  TYR   A CD1 
351  C CD2 . TYR   A 44  ? 0.15840 0.35020 0.20030 -0.00190 0.01230  0.03180  47  TYR   A CD2 
352  C CE1 . TYR   A 44  ? 0.14460 0.36280 0.19640 0.01360  0.00130  0.05190  47  TYR   A CE1 
353  C CE2 . TYR   A 44  ? 0.17290 0.35470 0.21940 0.00780  0.01760  0.04950  47  TYR   A CE2 
354  C CZ  . TYR   A 44  ? 0.18500 0.35960 0.21160 0.04610  0.01200  0.07290  47  TYR   A CZ  
355  O OH  . TYR   A 44  ? 0.23430 0.37780 0.27100 0.06480  0.03400  0.07360  47  TYR   A OH  
365  N N   . ALA   A 45  ? 0.11170 0.30950 0.20130 -0.01990 0.00200  0.02910  48  ALA   A N   
366  C CA  . ALA   A 45  ? 0.11990 0.30940 0.19330 -0.01320 -0.00330 0.03270  48  ALA   A CA  
367  C C   . ALA   A 45  ? 0.12600 0.30720 0.22950 -0.01760 0.00140  0.05670  48  ALA   A C   
368  O O   . ALA   A 45  ? 0.15310 0.30840 0.22690 -0.03510 -0.00600 0.05640  48  ALA   A O   
369  C CB  . ALA   A 45  ? 0.13150 0.31760 0.19390 -0.01750 0.01100  0.03500  48  ALA   A CB  
375  N N   A MET   A 46  ? 0.14110 0.30560 0.25460 -0.01870 -0.01270 0.05920  49  MET   A N   
376  N N   B MET   A 46  ? 0.12560 0.30780 0.24790 -0.01550 -0.01750 0.07620  49  MET   A N   
377  N N   C MET   A 46  ? 0.13150 0.31330 0.27430 -0.02540 0.00030  0.05770  49  MET   A N   
378  C CA  A MET   A 46  ? 0.15640 0.30500 0.27960 -0.02180 -0.02230 0.05620  49  MET   A CA  
379  C CA  B MET   A 46  ? 0.14160 0.31510 0.27470 -0.02190 -0.03180 0.06970  49  MET   A CA  
380  C CA  C MET   A 46  ? 0.13220 0.32310 0.32050 -0.04030 0.01080  0.03590  49  MET   A CA  
381  C C   A MET   A 46  ? 0.14590 0.30790 0.27620 -0.02740 -0.02560 0.05090  49  MET   A C   
382  C C   B MET   A 46  ? 0.13390 0.31390 0.26560 -0.02500 -0.03100 0.05860  49  MET   A C   
383  C C   C MET   A 46  ? 0.12050 0.31550 0.29270 -0.03380 -0.00210 0.04070  49  MET   A C   
384  O O   A MET   A 46  ? 0.14430 0.30570 0.27670 -0.02930 -0.02700 0.04730  49  MET   A O   
385  O O   B MET   A 46  ? 0.13020 0.31480 0.25160 -0.03560 -0.03900 0.04980  49  MET   A O   
386  O O   C MET   A 46  ? 0.10360 0.31170 0.28630 -0.04550 0.00700  0.03350  49  MET   A O   
387  C CB  A MET   A 46  ? 0.17990 0.30430 0.31030 -0.01570 -0.02200 0.06010  49  MET   A CB  
388  C CB  B MET   A 46  ? 0.16070 0.33100 0.32070 -0.01470 -0.02350 0.07620  49  MET   A CB  
389  C CB  C MET   A 46  ? 0.14080 0.34880 0.39810 -0.04880 0.06690  0.01760  49  MET   A CB  
390  C CG  A MET   A 46  ? 0.19950 0.30570 0.33530 -0.00780 -0.03160 0.06420  49  MET   A CG  
391  C CG  B MET   A 46  ? 0.18620 0.35080 0.34630 0.00460  -0.06230 0.08100  49  MET   A CG  
392  C CG  C MET   A 46  ? 0.18530 0.37960 0.46370 -0.04780 0.06300  -0.01110 49  MET   A CG  
393  S SD  A MET   A 46  ? 0.21070 0.30800 0.35450 0.00620  -0.03710 0.06750  49  MET   A SD  
394  S SD  B MET   A 46  ? 0.21650 0.36960 0.36440 0.00990  -0.07570 0.07060  49  MET   A SD  
395  S SD  C MET   A 46  ? 0.22030 0.40490 0.50900 -0.04590 0.07540  -0.04830 49  MET   A SD  
396  C CE  A MET   A 46  ? 0.20810 0.30630 0.35170 0.00590  -0.03420 0.06410  49  MET   A CE  
397  C CE  B MET   A 46  ? 0.21150 0.37400 0.35890 0.00920  -0.06110 0.05540  49  MET   A CE  
398  C CE  C MET   A 46  ? 0.20620 0.40370 0.48940 -0.04410 0.08660  -0.05960 49  MET   A CE  
426  N N   . ASP   A 47  ? 0.13750 0.31400 0.27350 -0.03550 -0.02750 0.04870  50  ASP   A N   
427  C CA  . ASP   A 47  ? 0.14530 0.33620 0.25520 -0.02830 -0.01380 0.04200  50  ASP   A CA  
428  C C   . ASP   A 47  ? 0.14410 0.34510 0.27060 -0.02260 0.00690  0.04220  50  ASP   A C   
429  O O   . ASP   A 47  ? 0.17640 0.34760 0.28070 -0.02760 -0.00990 0.05810  50  ASP   A O   
430  C CB  . ASP   A 47  ? 0.18400 0.35630 0.26070 -0.03300 0.01310  0.05170  50  ASP   A CB  
431  C CG  . ASP   A 47  ? 0.20830 0.37610 0.27410 -0.02080 0.03480  0.05310  50  ASP   A CG  
432  O OD1 . ASP   A 47  ? 0.19690 0.38930 0.30720 -0.03120 0.04770  0.05660  50  ASP   A OD1 
433  O OD2 . ASP   A 47  ? 0.24270 0.39210 0.30400 -0.01540 0.06160  0.04100  50  ASP   A OD2 
440  N N   . THR   A 48  ? 0.13530 0.34660 0.27210 -0.01360 0.01190  0.01770  51  THR   A N   
441  C CA  . THR   A 48  ? 0.13880 0.34710 0.30040 -0.01390 0.00970  0.02510  51  THR   A CA  
442  C C   . THR   A 48  ? 0.17560 0.34250 0.32160 -0.00480 -0.01550 0.03880  51  THR   A C   
443  O O   . THR   A 48  ? 0.23170 0.34570 0.34030 0.01000  -0.01620 0.03820  51  THR   A O   
444  C CB  . THR   A 48  ? 0.13180 0.36070 0.31270 -0.01340 0.02210  0.02320  51  THR   A CB  
445  O OG1 . THR   A 48  ? 0.13210 0.36030 0.29840 -0.02580 0.00770  0.02490  51  THR   A OG1 
446  C CG2 . THR   A 48  ? 0.12870 0.36640 0.31950 -0.02840 0.02090  0.01910  51  THR   A CG2 
454  N N   . GLY   A 49  ? 0.17440 0.33740 0.33810 -0.02050 -0.00910 0.08560  52  GLY   A N   
455  C CA  . GLY   A 49  ? 0.21860 0.34970 0.36390 -0.02900 -0.03530 0.10360  52  GLY   A CA  
456  C C   . GLY   A 49  ? 0.26180 0.36140 0.39110 -0.03780 -0.06390 0.11930  52  GLY   A C   
457  O O   . GLY   A 49  ? 0.30960 0.37790 0.43430 -0.04000 -0.09390 0.11650  52  GLY   A O   
461  N N   . SER   A 50  ? 0.24850 0.37110 0.38150 -0.04950 -0.08050 0.12910  53  SER   A N   
462  C CA  . SER   A 50  ? 0.26360 0.38180 0.39360 -0.04440 -0.06960 0.12170  53  SER   A CA  
463  C C   . SER   A 50  ? 0.26910 0.38250 0.40240 -0.02680 -0.08840 0.12130  53  SER   A C   
464  O O   . SER   A 50  ? 0.29320 0.38130 0.40820 -0.01220 -0.11020 0.13510  53  SER   A O   
465  C CB  . SER   A 50  ? 0.27430 0.38560 0.39400 -0.05660 -0.03860 0.11080  53  SER   A CB  
466  O OG  . SER   A 50  ? 0.25310 0.39410 0.38770 -0.05960 -0.02650 0.09890  53  SER   A OG  
472  N N   . GLY   A 51  ? 0.26180 0.37610 0.40960 -0.01730 -0.07720 0.10610  54  GLY   A N   
473  C CA  . GLY   A 51  ? 0.25880 0.36990 0.41030 -0.01450 -0.04580 0.09610  54  GLY   A CA  
474  C C   . GLY   A 51  ? 0.23410 0.36990 0.38820 -0.01160 -0.03350 0.09720  54  GLY   A C   
475  O O   . GLY   A 51  ? 0.23300 0.37060 0.42110 -0.00530 -0.02310 0.07820  54  GLY   A O   
479  N N   . ALA   A 52  ? 0.21450 0.37030 0.32470 -0.02370 -0.03670 0.10720  55  ALA   A N   
480  C CA  . ALA   A 52  ? 0.20710 0.37150 0.29390 -0.03110 -0.04620 0.10140  55  ALA   A CA  
481  C C   . ALA   A 52  ? 0.17060 0.37030 0.26190 -0.03440 -0.01970 0.08120  55  ALA   A C   
482  O O   . ALA   A 52  ? 0.16440 0.35990 0.27060 -0.04800 -0.01210 0.07660  55  ALA   A O   
483  C CB  . ALA   A 52  ? 0.21630 0.38240 0.29140 -0.04790 -0.05050 0.09970  55  ALA   A CB  
489  N N   . THR   A 53  ? 0.15170 0.37880 0.24580 -0.02480 -0.01280 0.06020  56  THR   A N   
490  C CA  . THR   A 53  ? 0.12610 0.37970 0.24400 -0.01940 0.00430  0.04480  56  THR   A CA  
491  C C   . THR   A 53  ? 0.13520 0.36170 0.21170 -0.02500 0.00220  0.04720  56  THR   A C   
492  O O   . THR   A 53  ? 0.16390 0.34730 0.20530 -0.02630 -0.00130 0.04100  56  THR   A O   
493  C CB  . THR   A 53  ? 0.15010 0.41470 0.30200 -0.00190 -0.01120 0.00520  56  THR   A CB  
494  O OG1 . THR   A 53  ? 0.16190 0.43850 0.29360 -0.00210 -0.01480 -0.01700 56  THR   A OG1 
495  C CG2 . THR   A 53  ? 0.13780 0.42440 0.33820 -0.00890 -0.00240 -0.00110 56  THR   A CG2 
503  N N   . VAL   A 54  ? 0.14130 0.35540 0.22940 -0.03290 0.00320  0.04010  57  VAL   A N   
504  C CA  . VAL   A 54  ? 0.13810 0.33630 0.20670 -0.04130 0.00950  0.03210  57  VAL   A CA  
505  C C   . VAL   A 54  ? 0.16030 0.33610 0.19860 -0.04010 -0.00510 0.02870  57  VAL   A C   
506  O O   . VAL   A 54  ? 0.17230 0.32950 0.19850 -0.04450 0.01440  0.01720  57  VAL   A O   
507  C CB  . VAL   A 54  ? 0.15470 0.34280 0.21990 -0.04150 0.01500  0.02850  57  VAL   A CB  
508  C CG1 . VAL   A 54  ? 0.16810 0.34350 0.23460 -0.03600 -0.00260 0.04160  57  VAL   A CG1 
509  C CG2 . VAL   A 54  ? 0.17290 0.34530 0.24150 -0.02950 0.03140  0.01180  57  VAL   A CG2 
519  N N   A SER   A 55  ? 0.15960 0.34360 0.18070 -0.03090 -0.00360 0.02080  59  SER   A N   
520  N N   B SER   A 55  ? 0.15920 0.33920 0.18580 -0.03450 -0.00060 0.02150  59  SER   A N   
521  C CA  A SER   A 55  ? 0.12710 0.33470 0.18820 -0.02050 -0.00670 0.03080  59  SER   A CA  
522  C CA  B SER   A 55  ? 0.15520 0.33550 0.18210 -0.02680 -0.00120 0.01910  59  SER   A CA  
523  C C   A SER   A 55  ? 0.11840 0.32660 0.17180 -0.01510 0.02400  0.02210  59  SER   A C   
524  C C   B SER   A 55  ? 0.14180 0.33140 0.17720 -0.01320 0.01070  0.01570  59  SER   A C   
525  O O   A SER   A 55  ? 0.17330 0.32320 0.16150 -0.03120 0.01210  0.03650  59  SER   A O   
526  O O   B SER   A 55  ? 0.16190 0.32960 0.17950 -0.01820 0.00780  0.01860  59  SER   A O   
527  C CB  A SER   A 55  ? 0.12960 0.33290 0.21050 -0.01140 -0.02350 0.03720  59  SER   A CB  
528  C CB  B SER   A 55  ? 0.17320 0.33640 0.18210 -0.03030 -0.00980 0.01600  59  SER   A CB  
529  O OG  A SER   A 55  ? 0.10140 0.33720 0.24770 -0.00730 -0.02160 0.05100  59  SER   A OG  
530  O OG  B SER   A 55  ? 0.17310 0.34010 0.18450 -0.03360 -0.01770 0.00970  59  SER   A OG  
541  N N   . TYR   A 56  ? 0.12460 0.33290 0.17130 0.00420  0.01270  0.01460  60  TYR   A N   
542  C CA  . TYR   A 56  ? 0.11310 0.32410 0.16520 -0.00410 0.00370  -0.00180 60  TYR   A CA  
543  C C   . TYR   A 56  ? 0.11290 0.31720 0.18360 -0.00290 -0.00790 0.00970  60  TYR   A C   
544  O O   . TYR   A 56  ? 0.10530 0.32590 0.18930 0.00210  -0.01190 0.01930  60  TYR   A O   
545  C CB  . TYR   A 56  ? 0.12120 0.32910 0.19130 0.01210  0.02600  0.00210  60  TYR   A CB  
546  C CG  . TYR   A 56  ? 0.13660 0.32050 0.20110 0.01510  0.01200  0.00430  60  TYR   A CG  
547  C CD1 . TYR   A 56  ? 0.17610 0.33270 0.22390 0.01190  0.01500  0.00420  60  TYR   A CD1 
548  C CD2 . TYR   A 56  ? 0.13470 0.30470 0.21060 0.01960  -0.00340 0.01760  60  TYR   A CD2 
549  C CE1 . TYR   A 56  ? 0.19650 0.32910 0.20730 0.00930  0.01510  0.00490  60  TYR   A CE1 
550  C CE2 . TYR   A 56  ? 0.14920 0.30720 0.20730 0.01390  0.00340  -0.01270 60  TYR   A CE2 
551  C CZ  . TYR   A 56  ? 0.19440 0.31930 0.20310 -0.00720 -0.00340 -0.01720 60  TYR   A CZ  
552  O OH  . TYR   A 56  ? 0.23910 0.34520 0.23390 -0.01780 -0.04190 -0.04540 60  TYR   A OH  
563  N N   . ARG   A 57  ? 0.10300 0.30050 0.18480 -0.01140 -0.00350 0.01430  61  ARG   A N   
564  C CA  . ARG   A 57  ? 0.09540 0.28660 0.19000 -0.00690 -0.01460 0.01460  61  ARG   A CA  
565  C C   . ARG   A 57  ? 0.10600 0.28190 0.19300 0.00890  -0.02830 0.03170  61  ARG   A C   
566  O O   . ARG   A 57  ? 0.10080 0.27670 0.20730 0.01290  -0.01610 0.02180  61  ARG   A O   
567  C CB  . ARG   A 57  ? 0.10000 0.30600 0.18970 -0.00110 -0.01380 0.00200  61  ARG   A CB  
568  C CG  . ARG   A 57  ? 0.10180 0.31360 0.21390 0.01660  -0.01190 0.00160  61  ARG   A CG  
569  C CD  . ARG   A 57  ? 0.10980 0.30890 0.21970 0.02220  -0.00440 0.00070  61  ARG   A CD  
570  N NE  . ARG   A 57  ? 0.11430 0.31080 0.22970 0.00980  -0.01010 -0.01780 61  ARG   A NE  
571  C CZ  . ARG   A 57  ? 0.13730 0.30720 0.27880 0.00080  -0.00620 -0.03820 61  ARG   A CZ  
572  N NH1 . ARG   A 57  ? 0.13250 0.31200 0.29120 0.00260  -0.01100 -0.01850 61  ARG   A NH1 
573  N NH2 . ARG   A 57  ? 0.16390 0.31540 0.29800 -0.00640 -0.01030 -0.06210 61  ARG   A NH2 
587  N N   . ALA   A 58  ? 0.11290 0.28700 0.18630 0.00240  -0.00900 0.02050  62  ALA   A N   
588  C CA  . ALA   A 58  ? 0.12560 0.28130 0.20020 -0.00740 0.00780  0.01820  62  ALA   A CA  
589  C C   . ALA   A 58  ? 0.13710 0.28770 0.20300 0.00180  -0.00180 0.01070  62  ALA   A C   
590  O O   . ALA   A 58  ? 0.11200 0.27520 0.19610 -0.01650 0.00290  -0.00770 62  ALA   A O   
591  C CB  . ALA   A 58  ? 0.13820 0.28380 0.21250 -0.02420 0.02440  0.02890  62  ALA   A CB  
597  N N   . GLU   A 59  ? 0.10960 0.28740 0.17720 0.02630  -0.00270 0.00540  63  GLU   A N   
598  C CA  . GLU   A 59  ? 0.12090 0.28760 0.18970 0.02580  -0.00670 -0.00430 63  GLU   A CA  
599  C C   . GLU   A 59  ? 0.11980 0.29090 0.20280 0.00930  -0.00700 -0.00550 63  GLU   A C   
600  O O   . GLU   A 59  ? 0.13180 0.30260 0.27070 0.00380  0.03840  0.00550  63  GLU   A O   
601  C CB  . GLU   A 59  ? 0.14480 0.28570 0.19870 0.02820  -0.01410 0.00520  63  GLU   A CB  
602  C CG  . GLU   A 59  ? 0.16630 0.28670 0.20540 0.02310  -0.04620 0.01530  63  GLU   A CG  
603  C CD  . GLU   A 59  ? 0.17290 0.29740 0.22680 0.00940  -0.04150 0.03710  63  GLU   A CD  
604  O OE1 . GLU   A 59  ? 0.14460 0.31300 0.22720 0.02470  -0.02590 0.03260  63  GLU   A OE1 
605  O OE2 . GLU   A 59  ? 0.16630 0.30070 0.23720 -0.00100 -0.04390 0.03760  63  GLU   A OE2 
612  N N   . GLU   A 60  ? 0.10740 0.29830 0.17190 0.00040  -0.00980 -0.01490 64  GLU   A N   
613  C CA  . GLU   A 60  ? 0.12440 0.29120 0.16150 -0.00410 -0.01040 -0.02210 64  GLU   A CA  
614  C C   . GLU   A 60  ? 0.11950 0.28580 0.18220 0.00590  -0.01360 -0.00070 64  GLU   A C   
615  O O   . GLU   A 60  ? 0.11190 0.29010 0.20440 -0.00290 -0.00000 0.00770  64  GLU   A O   
616  C CB  . GLU   A 60  ? 0.12380 0.30200 0.19870 0.01620  -0.01200 -0.02520 64  GLU   A CB  
617  C CG  . GLU   A 60  ? 0.14020 0.30230 0.20970 0.01240  -0.02600 -0.00550 64  GLU   A CG  
618  C CD  . GLU   A 60  ? 0.13570 0.30450 0.21090 0.01520  -0.01430 0.00650  64  GLU   A CD  
619  O OE1 . GLU   A 60  ? 0.24470 0.30670 0.20830 0.02090  0.00460  -0.01170 64  GLU   A OE1 
620  O OE2 . GLU   A 60  ? 0.13170 0.32060 0.20840 0.00670  -0.01390 0.00930  64  GLU   A OE2 
627  N N   . ARG   A 61  ? 0.10130 0.29710 0.17960 -0.00410 -0.00020 0.00530  65  ARG   A N   
628  C CA  . ARG   A 61  ? 0.10690 0.27860 0.17300 0.00410  0.01220  -0.00710 65  ARG   A CA  
629  C C   . ARG   A 61  ? 0.12380 0.25550 0.18390 -0.01400 0.00790  -0.02150 65  ARG   A C   
630  O O   . ARG   A 61  ? 0.09920 0.25250 0.19180 -0.01450 -0.00220 -0.02710 65  ARG   A O   
631  C CB  . ARG   A 61  ? 0.13570 0.28670 0.19060 0.00400  0.01420  -0.01180 65  ARG   A CB  
632  C CG  . ARG   A 61  ? 0.14410 0.29010 0.19280 0.01400  0.00450  -0.01310 65  ARG   A CG  
633  C CD  . ARG   A 61  ? 0.13600 0.29930 0.21640 0.03380  0.01510  -0.01140 65  ARG   A CD  
634  N NE  . ARG   A 61  ? 0.11140 0.31330 0.24010 0.01010  0.00920  -0.02160 65  ARG   A NE  
635  C CZ  . ARG   A 61  ? 0.11470 0.30920 0.22250 0.00570  0.02000  -0.01770 65  ARG   A CZ  
636  N NH1 . ARG   A 61  ? 0.09270 0.30880 0.21530 -0.00590 -0.00010 -0.00290 65  ARG   A NH1 
637  N NH2 . ARG   A 61  ? 0.13750 0.31320 0.23430 0.00910  0.00720  0.01100  65  ARG   A NH2 
651  N N   . PHE   A 62  ? 0.10710 0.23980 0.17530 -0.00490 0.00070  -0.00330 66  PHE   A N   
652  C CA  . PHE   A 62  ? 0.09450 0.23930 0.19700 0.00370  0.00660  -0.01030 66  PHE   A CA  
653  C C   . PHE   A 62  ? 0.10110 0.22630 0.19640 0.00150  0.00870  -0.00940 66  PHE   A C   
654  O O   . PHE   A 62  ? 0.10500 0.22610 0.20160 0.00110  0.00450  -0.00150 66  PHE   A O   
655  C CB  . PHE   A 62  ? 0.08630 0.24300 0.20150 0.00770  0.01540  -0.00440 66  PHE   A CB  
656  C CG  . PHE   A 62  ? 0.09440 0.25080 0.19990 -0.01130 0.01950  -0.00050 66  PHE   A CG  
657  C CD1 . PHE   A 62  ? 0.09580 0.26020 0.20010 -0.01850 0.00380  -0.01550 66  PHE   A CD1 
658  C CD2 . PHE   A 62  ? 0.11530 0.24940 0.18060 -0.01330 -0.00090 -0.00460 66  PHE   A CD2 
659  C CE1 . PHE   A 62  ? 0.10430 0.27280 0.20340 -0.02900 -0.00590 -0.00730 66  PHE   A CE1 
660  C CE2 . PHE   A 62  ? 0.10160 0.26290 0.20440 -0.00540 -0.00240 -0.00460 66  PHE   A CE2 
661  C CZ  . PHE   A 62  ? 0.11100 0.26190 0.19890 -0.01280 -0.01690 -0.00080 66  PHE   A CZ  
671  N N   . PRO   A 63  ? 0.10460 0.22500 0.19800 -0.01270 0.00700  -0.01580 67  PRO   A N   
672  C CA  . PRO   A 63  ? 0.11320 0.23200 0.18960 -0.01490 -0.00950 -0.00300 67  PRO   A CA  
673  C C   . PRO   A 63  ? 0.10990 0.24400 0.19120 0.00550  0.00330  -0.00950 67  PRO   A C   
674  O O   . PRO   A 63  ? 0.10470 0.25720 0.17660 -0.00770 0.00650  -0.01600 67  PRO   A O   
675  C CB  . PRO   A 63  ? 0.11590 0.23170 0.18870 -0.01620 -0.00690 0.01120  67  PRO   A CB  
676  C CG  . PRO   A 63  ? 0.11760 0.23380 0.20430 0.00070  0.00580  -0.00280 67  PRO   A CG  
677  C CD  . PRO   A 63  ? 0.11620 0.21060 0.20640 -0.00160 -0.00150 -0.00550 67  PRO   A CD  
685  N N   . LEU   A 64  ? 0.11180 0.23620 0.18360 -0.01940 0.00690  -0.01070 68  LEU   A N   
686  C CA  . LEU   A 64  ? 0.11720 0.23960 0.18160 -0.02470 0.00900  -0.01680 68  LEU   A CA  
687  C C   . LEU   A 64  ? 0.10440 0.24050 0.17960 -0.00970 0.00600  -0.00090 68  LEU   A C   
688  O O   . LEU   A 64  ? 0.09490 0.24980 0.18690 -0.00700 0.01020  -0.00150 68  LEU   A O   
689  C CB  . LEU   A 64  ? 0.10350 0.25540 0.19050 -0.01430 -0.00360 0.00150  68  LEU   A CB  
690  C CG  . LEU   A 64  ? 0.12210 0.25700 0.21880 -0.00270 -0.00810 0.00520  68  LEU   A CG  
691  C CD1 . LEU   A 64  ? 0.14850 0.25120 0.22600 -0.00280 -0.01500 -0.01610 68  LEU   A CD1 
692  C CD2 . LEU   A 64  ? 0.14500 0.26420 0.24320 0.00650  -0.03000 0.01580  68  LEU   A CD2 
704  N N   . CYS   A 65  ? 0.10250 0.24570 0.18680 0.00010  -0.00420 0.00910  69  CYS   A N   
705  C CA  . CYS   A 65  ? 0.10160 0.23910 0.19700 0.00730  -0.00080 0.00800  69  CYS   A CA  
706  C C   . CYS   A 65  ? 0.10790 0.22560 0.19690 0.01070  0.01330  -0.01270 69  CYS   A C   
707  O O   . CYS   A 65  ? 0.12400 0.24900 0.19130 0.02190  0.00280  0.01220  69  CYS   A O   
708  C CB  . CYS   A 65  ? 0.11160 0.23560 0.23560 0.00550  -0.01140 0.01520  69  CYS   A CB  
709  S SG  . CYS   A 65  ? 0.12570 0.25290 0.20650 -0.00570 -0.00850 -0.00830 69  CYS   A SG  
714  N N   . SER   A 66  ? 0.09930 0.23950 0.18900 -0.00980 0.00180  -0.00720 70  SER   A N   
715  C CA  . SER   A 66  ? 0.13170 0.24840 0.19350 -0.00880 0.00290  0.01440  70  SER   A CA  
716  C C   . SER   A 66  ? 0.12330 0.23880 0.18950 -0.00330 -0.00770 -0.00120 70  SER   A C   
717  O O   . SER   A 66  ? 0.13010 0.25680 0.20200 -0.01600 -0.02050 0.00540  70  SER   A O   
718  C CB  . SER   A 66  ? 0.12800 0.24840 0.18640 -0.00700 -0.01220 0.02460  70  SER   A CB  
719  O OG  . SER   A 66  ? 0.13660 0.25200 0.19580 -0.00480 -0.01100 0.00190  70  SER   A OG  
724  N N   . SER   A 67  ? 0.14230 0.24570 0.19000 -0.01360 -0.00470 0.00560  71  SER   A N   
725  C CA  . SER   A 67  ? 0.12530 0.24090 0.18010 -0.01350 -0.00530 0.01010  71  SER   A CA  
726  C C   . SER   A 67  ? 0.11560 0.22440 0.19360 -0.02440 -0.00960 0.00570  71  SER   A C   
727  O O   . SER   A 67  ? 0.11830 0.21430 0.20070 -0.02220 0.00450  -0.00600 71  SER   A O   
728  C CB  . SER   A 67  ? 0.11470 0.24540 0.19540 -0.01240 -0.00760 0.00660  71  SER   A CB  
729  O OG  . SER   A 67  ? 0.10910 0.23790 0.18630 -0.01010 0.00370  0.02060  71  SER   A OG  
735  N N   . PHE   A 68  ? 0.10900 0.22850 0.20390 -0.02830 -0.00370 0.01140  72  PHE   A N   
736  C CA  . PHE   A 68  ? 0.12170 0.23970 0.19560 -0.01120 -0.00470 -0.00390 72  PHE   A CA  
737  C C   . PHE   A 68  ? 0.11400 0.23020 0.20170 -0.00300 0.00730  -0.02180 72  PHE   A C   
738  O O   . PHE   A 68  ? 0.11270 0.21660 0.21490 0.00790  -0.00960 -0.01090 72  PHE   A O   
739  C CB  . PHE   A 68  ? 0.12640 0.25320 0.20800 -0.02050 0.01520  0.00120  72  PHE   A CB  
740  C CG  . PHE   A 68  ? 0.11810 0.25550 0.21030 -0.00680 0.01350  -0.00190 72  PHE   A CG  
741  C CD1 . PHE   A 68  ? 0.11650 0.26170 0.20710 -0.01860 0.03990  0.01680  72  PHE   A CD1 
742  C CD2 . PHE   A 68  ? 0.12390 0.28020 0.20640 -0.01910 0.00950  -0.00190 72  PHE   A CD2 
743  C CE1 . PHE   A 68  ? 0.10700 0.26460 0.23310 -0.00090 0.01640  0.03190  72  PHE   A CE1 
744  C CE2 . PHE   A 68  ? 0.14030 0.28040 0.21330 -0.01890 -0.01150 0.00570  72  PHE   A CE2 
745  C CZ  . PHE   A 68  ? 0.13200 0.27450 0.21520 -0.01510 -0.01320 0.03330  72  PHE   A CZ  
755  N N   . LYS   A 69  ? 0.12310 0.26140 0.20550 -0.00900 -0.01570 -0.03030 73  LYS   A N   
756  C CA  . LYS   A 69  ? 0.10910 0.27480 0.21030 -0.01640 -0.00500 -0.03090 73  LYS   A CA  
757  C C   . LYS   A 69  ? 0.11500 0.27430 0.19490 -0.01110 -0.02170 -0.01580 73  LYS   A C   
758  O O   . LYS   A 69  ? 0.12730 0.25770 0.20150 -0.02020 -0.02350 -0.01240 73  LYS   A O   
759  C CB  . LYS   A 69  ? 0.13010 0.27860 0.20040 -0.01040 -0.00600 -0.02320 73  LYS   A CB  
760  C CG  . LYS   A 69  ? 0.12530 0.28120 0.19470 -0.02180 -0.01270 -0.03620 73  LYS   A CG  
761  C CD  . LYS   A 69  ? 0.14540 0.30460 0.20030 -0.00650 0.00620  -0.00490 73  LYS   A CD  
762  C CE  . LYS   A 69  ? 0.14980 0.31650 0.19490 0.00330  -0.01880 0.01900  73  LYS   A CE  
763  N NZ  . LYS   A 69  ? 0.15570 0.32890 0.21320 0.00700  -0.00540 0.02490  73  LYS   A NZ  
777  N N   . GLY   A 70  ? 0.11870 0.27810 0.19620 0.00710  -0.00670 -0.00800 74  GLY   A N   
778  C CA  . GLY   A 70  ? 0.13040 0.27560 0.19080 -0.00320 0.01000  0.00980  74  GLY   A CA  
779  C C   . GLY   A 70  ? 0.12020 0.25000 0.20320 -0.01120 0.00730  0.01180  74  GLY   A C   
780  O O   . GLY   A 70  ? 0.14080 0.24020 0.20450 -0.02220 -0.00750 0.01090  74  GLY   A O   
784  N N   . PHE   A 71  ? 0.10820 0.25350 0.22670 -0.01350 -0.01430 0.01530  75  PHE   A N   
785  C CA  . PHE   A 71  ? 0.11560 0.24510 0.21900 -0.00880 -0.01120 0.00070  75  PHE   A CA  
786  C C   . PHE   A 71  ? 0.12380 0.24320 0.19890 -0.00870 -0.02150 -0.02720 75  PHE   A C   
787  O O   . PHE   A 71  ? 0.13630 0.25180 0.22540 -0.00850 -0.01530 -0.02120 75  PHE   A O   
788  C CB  . PHE   A 71  ? 0.11330 0.23950 0.23300 -0.00650 -0.00580 0.00700  75  PHE   A CB  
789  C CG  . PHE   A 71  ? 0.13050 0.23170 0.20330 0.00280  0.00840  0.01780  75  PHE   A CG  
790  C CD1 . PHE   A 71  ? 0.13880 0.23270 0.20830 -0.01920 0.00160  0.01630  75  PHE   A CD1 
791  C CD2 . PHE   A 71  ? 0.13300 0.23730 0.21060 -0.00210 0.00760  0.01980  75  PHE   A CD2 
792  C CE1 . PHE   A 71  ? 0.14850 0.23000 0.21240 -0.01400 0.00580  0.01480  75  PHE   A CE1 
793  C CE2 . PHE   A 71  ? 0.13850 0.22850 0.21030 0.01040  0.00760  0.01590  75  PHE   A CE2 
794  C CZ  . PHE   A 71  ? 0.12490 0.22050 0.20170 0.00710  -0.00500 0.00890  75  PHE   A CZ  
804  N N   . LEU   A 72  ? 0.11970 0.25120 0.19750 -0.01440 -0.01470 -0.03360 76  LEU   A N   
805  C CA  . LEU   A 72  ? 0.12830 0.24620 0.20110 -0.02010 -0.01220 -0.02230 76  LEU   A CA  
806  C C   . LEU   A 72  ? 0.12570 0.23250 0.20180 -0.01480 -0.01350 -0.02310 76  LEU   A C   
807  O O   . LEU   A 72  ? 0.15580 0.23060 0.21440 -0.00440 -0.01450 -0.01870 76  LEU   A O   
808  C CB  . LEU   A 72  ? 0.14500 0.26360 0.19440 -0.02040 0.00970  -0.00750 76  LEU   A CB  
809  C CG  . LEU   A 72  ? 0.18290 0.27730 0.21220 -0.02000 -0.02860 -0.01330 76  LEU   A CG  
810  C CD1 . LEU   A 72  ? 0.18690 0.30120 0.22990 -0.00420 0.00040  -0.01380 76  LEU   A CD1 
811  C CD2 . LEU   A 72  ? 0.22500 0.27990 0.24460 -0.03890 -0.03070 -0.01060 76  LEU   A CD2 
823  N N   . ALA   A 73  ? 0.12220 0.23860 0.21980 -0.01590 -0.01410 -0.00900 77  ALA   A N   
824  C CA  . ALA   A 73  ? 0.13950 0.25210 0.21320 -0.02510 -0.01630 -0.01650 77  ALA   A CA  
825  C C   . ALA   A 73  ? 0.16080 0.26690 0.23330 -0.03510 -0.01420 -0.01230 77  ALA   A C   
826  O O   . ALA   A 73  ? 0.17600 0.27450 0.22190 -0.02460 -0.02510 -0.01630 77  ALA   A O   
827  C CB  . ALA   A 73  ? 0.15440 0.26170 0.20970 -0.01980 -0.01620 -0.01820 77  ALA   A CB  
833  N N   . ALA   A 74  ? 0.14100 0.26890 0.23660 -0.03480 -0.02310 -0.00420 78  ALA   A N   
834  C CA  . ALA   A 74  ? 0.15450 0.27160 0.23610 -0.01870 -0.01070 0.00520  78  ALA   A CA  
835  C C   . ALA   A 74  ? 0.17750 0.26150 0.24320 -0.00420 -0.03140 0.00340  78  ALA   A C   
836  O O   . ALA   A 74  ? 0.19070 0.26570 0.23720 -0.00290 -0.01940 -0.00710 78  ALA   A O   
837  C CB  . ALA   A 74  ? 0.18630 0.29100 0.24290 -0.01090 -0.00730 0.01000  78  ALA   A CB  
843  N N   . ALA   A 75  ? 0.16650 0.24250 0.23830 -0.00650 -0.01400 0.00050  79  ALA   A N   
844  C CA  . ALA   A 75  ? 0.17250 0.23460 0.24070 -0.01270 -0.01930 -0.00530 79  ALA   A CA  
845  C C   . ALA   A 75  ? 0.16820 0.22150 0.23870 -0.02100 -0.02270 -0.02480 79  ALA   A C   
846  O O   . ALA   A 75  ? 0.19880 0.22750 0.26170 -0.02390 -0.01120 -0.03690 79  ALA   A O   
847  C CB  . ALA   A 75  ? 0.18310 0.24460 0.21850 -0.01280 0.00290  0.02150  79  ALA   A CB  
853  N N   . VAL   A 76  ? 0.17830 0.24330 0.25020 -0.02170 -0.02890 -0.02490 80  VAL   A N   
854  C CA  . VAL   A 76  ? 0.20360 0.26050 0.23860 -0.01510 -0.04650 -0.02070 80  VAL   A CA  
855  C C   . VAL   A 76  ? 0.17430 0.26610 0.23890 -0.03140 -0.04410 -0.03320 80  VAL   A C   
856  O O   . VAL   A 76  ? 0.18500 0.26980 0.26870 -0.00960 -0.03120 -0.04050 80  VAL   A O   
857  C CB  . VAL   A 76  ? 0.23560 0.27870 0.24360 -0.00330 -0.04590 -0.00390 80  VAL   A CB  
858  C CG1 . VAL   A 76  ? 0.23680 0.29090 0.27640 0.00180  -0.05550 -0.00240 80  VAL   A CG1 
859  C CG2 . VAL   A 76  ? 0.25750 0.28430 0.26100 -0.00080 -0.04120 0.01430  80  VAL   A CG2 
869  N N   . LEU   A 77  ? 0.16860 0.27450 0.24660 -0.03880 -0.03180 -0.03390 81  LEU   A N   
870  C CA  . LEU   A 77  ? 0.19310 0.28100 0.26070 -0.03670 -0.01100 -0.03970 81  LEU   A CA  
871  C C   . LEU   A 77  ? 0.20130 0.27070 0.27670 -0.04340 -0.03590 -0.04410 81  LEU   A C   
872  O O   . LEU   A 77  ? 0.21650 0.25990 0.31410 -0.03930 -0.04000 -0.03400 81  LEU   A O   
873  C CB  . LEU   A 77  ? 0.20290 0.28730 0.26160 -0.02070 -0.00690 -0.03900 81  LEU   A CB  
874  C CG  . LEU   A 77  ? 0.20220 0.28600 0.26390 -0.03610 -0.03980 -0.03360 81  LEU   A CG  
875  C CD1 . LEU   A 77  ? 0.22080 0.28620 0.26710 -0.05130 -0.02440 -0.02160 81  LEU   A CD1 
876  C CD2 . LEU   A 77  ? 0.20650 0.27840 0.28670 -0.04330 -0.03510 -0.02670 81  LEU   A CD2 
888  N N   . ALA   A 78  ? 0.21160 0.28410 0.29630 -0.03050 -0.03950 -0.05750 82  ALA   A N   
889  C CA  . ALA   A 78  ? 0.22380 0.29280 0.31470 -0.01100 -0.05310 -0.04610 82  ALA   A CA  
890  C C   . ALA   A 78  ? 0.23530 0.30370 0.31920 0.00340  -0.04280 -0.04820 82  ALA   A C   
891  O O   . ALA   A 78  ? 0.25590 0.30780 0.32290 0.00430  -0.05820 -0.02590 82  ALA   A O   
892  C CB  . ALA   A 78  ? 0.21460 0.28930 0.32850 -0.00890 -0.06340 -0.03790 82  ALA   A CB  
898  N N   . ARG   A 79  ? 0.24820 0.30970 0.30150 0.01620  -0.02520 -0.06280 83  ARG   A N   
899  C CA  . ARG   A 79  ? 0.28560 0.33240 0.31490 0.03580  -0.02040 -0.06360 83  ARG   A CA  
900  C C   . ARG   A 79  ? 0.30680 0.32140 0.32060 0.02460  -0.04440 -0.06410 83  ARG   A C   
901  O O   . ARG   A 79  ? 0.34040 0.32650 0.35040 0.02990  -0.03270 -0.05750 83  ARG   A O   
902  C CB  . ARG   A 79  ? 0.34690 0.37640 0.35090 0.05440  0.00420  -0.05770 83  ARG   A CB  
903  C CG  . ARG   A 79  ? 0.42990 0.42210 0.40900 0.05790  0.01070  -0.04580 83  ARG   A CG  
904  C CD  . ARG   A 79  ? 0.51090 0.47180 0.46270 0.05780  0.01360  -0.03140 83  ARG   A CD  
905  N NE  . ARG   A 79  ? 0.57090 0.51200 0.50290 0.06150  0.01290  -0.02060 83  ARG   A NE  
906  C CZ  . ARG   A 79  ? 0.61410 0.53870 0.54160 0.06970  0.01870  -0.02020 83  ARG   A CZ  
907  N NH1 . ARG   A 79  ? 0.63510 0.54960 0.56670 0.06890  0.01440  -0.02180 83  ARG   A NH1 
908  N NH2 . ARG   A 79  ? 0.63010 0.55110 0.55350 0.06950  0.02320  -0.01300 83  ARG   A NH2 
922  N N   . SER   A 80  ? 0.28440 0.31860 0.31590 0.01160  -0.08190 -0.03970 84  SER   A N   
923  C CA  . SER   A 80  ? 0.30640 0.32790 0.35580 -0.02150 -0.10100 -0.03610 84  SER   A CA  
924  C C   . SER   A 80  ? 0.34000 0.32800 0.35830 -0.04000 -0.12070 -0.02760 84  SER   A C   
925  O O   . SER   A 80  ? 0.33950 0.32340 0.37830 -0.06320 -0.13600 -0.02650 84  SER   A O   
926  C CB  . SER   A 80  ? 0.28090 0.34180 0.35580 -0.03740 -0.12310 -0.02600 84  SER   A CB  
927  O OG  . SER   A 80  ? 0.28500 0.34770 0.36380 -0.04240 -0.11030 -0.01830 84  SER   A OG  
933  N N   . GLN   A 81  ? 0.37440 0.33270 0.37040 -0.03450 -0.12360 -0.02050 85  GLN   A N   
934  C CA  . GLN   A 81  ? 0.43330 0.34670 0.38170 -0.01610 -0.11630 -0.02370 85  GLN   A CA  
935  C C   . GLN   A 81  ? 0.52020 0.36260 0.39470 0.00220  -0.12970 -0.03390 85  GLN   A C   
936  O O   . GLN   A 81  ? 0.55690 0.37240 0.43140 -0.00950 -0.11560 -0.04040 85  GLN   A O   
937  C CB  . GLN   A 81  ? 0.41340 0.34970 0.38420 -0.02970 -0.10800 -0.03080 85  GLN   A CB  
938  C CG  . GLN   A 81  ? 0.41060 0.35970 0.39430 -0.03620 -0.08460 -0.02810 85  GLN   A CG  
939  C CD  . GLN   A 81  ? 0.41330 0.36670 0.40440 -0.02700 -0.05640 -0.02400 85  GLN   A CD  
940  O OE1 . GLN   A 81  ? 0.41150 0.36870 0.41260 -0.04520 -0.05680 -0.02730 85  GLN   A OE1 
941  N NE2 . GLN   A 81  ? 0.42010 0.37640 0.41230 -0.00270 -0.04460 -0.02530 85  GLN   A NE2 
950  N N   . GLN   A 82  ? 0.56480 0.38240 0.38740 0.03450  -0.14330 -0.03450 86  GLN   A N   
951  C CA  . GLN   A 82  ? 0.61670 0.41270 0.40930 0.04540  -0.12220 -0.03830 86  GLN   A CA  
952  C C   . GLN   A 82  ? 0.63780 0.40010 0.39800 0.05020  -0.13400 -0.04330 86  GLN   A C   
953  O O   . GLN   A 82  ? 0.64190 0.40100 0.40320 0.05900  -0.11950 -0.04360 86  GLN   A O   
954  C CB  . GLN   A 82  ? 0.64560 0.45440 0.44860 0.04620  -0.09800 -0.04140 86  GLN   A CB  
955  C CG  . GLN   A 82  ? 0.67340 0.48840 0.49750 0.04710  -0.06830 -0.04660 86  GLN   A CG  
956  C CD  . GLN   A 82  ? 0.69770 0.51530 0.54640 0.05320  -0.04290 -0.05730 86  GLN   A CD  
957  O OE1 . GLN   A 82  ? 0.70500 0.53060 0.57250 0.05940  -0.03970 -0.06250 86  GLN   A OE1 
958  N NE2 . GLN   A 82  ? 0.71030 0.52910 0.56480 0.04900  -0.03240 -0.05260 86  GLN   A NE2 
967  N N   . GLN   A 83  ? 0.65340 0.38950 0.38440 0.04570  -0.15340 -0.04500 87  GLN   A N   
968  C CA  . GLN   A 83  ? 0.67350 0.38100 0.37850 0.04100  -0.15570 -0.03030 87  GLN   A CA  
969  C C   . GLN   A 83  ? 0.67830 0.36040 0.36780 0.01760  -0.18280 -0.01900 87  GLN   A C   
970  O O   . GLN   A 83  ? 0.67900 0.34180 0.35850 0.01670  -0.20350 -0.02090 87  GLN   A O   
971  C CB  . GLN   A 83  ? 0.68030 0.39090 0.40370 0.05270  -0.14480 -0.03990 87  GLN   A CB  
972  C CG  . GLN   A 83  ? 0.69050 0.40520 0.44380 0.06580  -0.12500 -0.03300 87  GLN   A CG  
973  C CD  . GLN   A 83  ? 0.69890 0.42410 0.47740 0.06900  -0.10620 -0.02560 87  GLN   A CD  
974  O OE1 . GLN   A 83  ? 0.70700 0.43950 0.52010 0.06840  -0.08970 -0.02960 87  GLN   A OE1 
975  N NE2 . GLN   A 83  ? 0.69520 0.42160 0.46360 0.07640  -0.09780 -0.01660 87  GLN   A NE2 
984  N N   . ALA   A 84  ? 0.67880 0.34750 0.37750 -0.00550 -0.18860 -0.01250 88  ALA   A N   
985  C CA  . ALA   A 84  ? 0.67420 0.35380 0.41260 -0.01550 -0.17760 -0.01080 88  ALA   A CA  
986  C C   . ALA   A 84  ? 0.65590 0.36260 0.42980 -0.02980 -0.18550 -0.02190 88  ALA   A C   
987  O O   . ALA   A 84  ? 0.66200 0.37810 0.45790 -0.03980 -0.18230 -0.01660 88  ALA   A O   
988  C CB  . ALA   A 84  ? 0.68100 0.36050 0.43960 -0.01660 -0.17350 -0.00710 88  ALA   A CB  
994  N N   . ASP   A 85  ? 0.63760 0.35560 0.40980 -0.02970 -0.20590 -0.02320 89  ASP   A N   
995  C CA  . ASP   A 85  ? 0.62390 0.36380 0.41330 -0.02910 -0.20180 -0.01270 89  ASP   A CA  
996  C C   . ASP   A 85  ? 0.56900 0.34660 0.39210 -0.03640 -0.20030 -0.00820 89  ASP   A C   
997  O O   . ASP   A 85  ? 0.57490 0.33670 0.38990 -0.03450 -0.21320 -0.00530 89  ASP   A O   
998  C CB  . ASP   A 85  ? 0.65950 0.39210 0.43690 -0.01320 -0.19150 -0.00830 89  ASP   A CB  
999  C CG  . ASP   A 85  ? 0.68580 0.42050 0.47040 0.00350  -0.19010 -0.01790 89  ASP   A CG  
1000 O OD1 . ASP   A 85  ? 0.70640 0.43410 0.50850 -0.00420 -0.17430 -0.02800 89  ASP   A OD1 
1001 O OD2 . ASP   A 85  ? 0.69640 0.43230 0.48620 0.02030  -0.19350 -0.02570 89  ASP   A OD2 
1006 N N   . LEU   A 86  ? 0.50540 0.33520 0.38090 -0.04210 -0.18120 -0.00650 90  LEU   A N   
1007 C CA  . LEU   A 86  ? 0.43840 0.31920 0.36470 -0.04180 -0.15860 -0.01930 90  LEU   A CA  
1008 C C   . LEU   A 86  ? 0.39480 0.31340 0.36390 -0.05840 -0.14720 -0.00730 90  LEU   A C   
1009 O O   . LEU   A 86  ? 0.36750 0.31010 0.36380 -0.07270 -0.14240 -0.01340 90  LEU   A O   
1010 C CB  . LEU   A 86  ? 0.41660 0.31030 0.35310 -0.02050 -0.15110 -0.02640 90  LEU   A CB  
1011 C CG  . LEU   A 86  ? 0.39090 0.31060 0.35390 -0.01830 -0.13800 -0.04220 90  LEU   A CG  
1012 C CD1 . LEU   A 86  ? 0.38990 0.30750 0.37320 0.00220  -0.13780 -0.04040 90  LEU   A CD1 
1013 C CD2 . LEU   A 86  ? 0.36720 0.31360 0.35900 -0.02850 -0.13420 -0.03710 90  LEU   A CD2 
1025 N N   . LEU   A 87  ? 0.37150 0.30450 0.37690 -0.06900 -0.12970 0.00690  91  LEU   A N   
1026 C CA  . LEU   A 87  ? 0.34850 0.30030 0.36070 -0.07250 -0.13630 0.01300  91  LEU   A CA  
1027 C C   . LEU   A 87  ? 0.34420 0.29890 0.32820 -0.05160 -0.12210 0.01700  91  LEU   A C   
1028 O O   . LEU   A 87  ? 0.30600 0.28990 0.31470 -0.04350 -0.11530 0.01500  91  LEU   A O   
1029 C CB  . LEU   A 87  ? 0.35460 0.30460 0.34440 -0.06490 -0.12990 0.03130  91  LEU   A CB  
1030 C CG  . LEU   A 87  ? 0.38460 0.32170 0.33650 -0.06890 -0.11610 0.04240  91  LEU   A CG  
1031 C CD1 . LEU   A 87  ? 0.41790 0.33740 0.35910 -0.07640 -0.11670 0.05020  91  LEU   A CD1 
1032 C CD2 . LEU   A 87  ? 0.37280 0.32930 0.34720 -0.07770 -0.10810 0.03550  91  LEU   A CD2 
1044 N N   . ASP   A 88  ? 0.34180 0.30740 0.34480 -0.05830 -0.13180 0.01260  92  ASP   A N   
1045 C CA  . ASP   A 88  ? 0.33640 0.30800 0.33490 -0.06210 -0.12630 -0.00060 92  ASP   A CA  
1046 C C   . ASP   A 88  ? 0.30220 0.31450 0.31340 -0.05490 -0.10380 -0.00750 92  ASP   A C   
1047 O O   . ASP   A 88  ? 0.28350 0.33020 0.31610 -0.07860 -0.10270 0.01730  92  ASP   A O   
1048 C CB  . ASP   A 88  ? 0.39090 0.32710 0.37310 -0.05520 -0.12120 -0.00680 92  ASP   A CB  
1049 C CG  . ASP   A 88  ? 0.45690 0.35130 0.41910 -0.04720 -0.08340 0.00010  92  ASP   A CG  
1050 O OD1 . ASP   A 88  ? 0.51150 0.37500 0.42260 -0.03040 -0.06900 0.00750  92  ASP   A OD1 
1051 O OD2 . ASP   A 88  ? 0.46210 0.35450 0.45800 -0.06480 -0.07050 0.00720  92  ASP   A OD2 
1056 N N   . THR   A 89  ? 0.29420 0.30850 0.30510 -0.03350 -0.06690 -0.02180 93  THR   A N   
1057 C CA  . THR   A 89  ? 0.26490 0.30420 0.30520 -0.00930 -0.06390 -0.04110 93  THR   A CA  
1058 C C   . THR   A 89  ? 0.23440 0.29930 0.26060 -0.01150 -0.05340 -0.03550 93  THR   A C   
1059 O O   . THR   A 89  ? 0.21830 0.29300 0.25500 -0.02160 -0.03630 -0.02220 93  THR   A O   
1060 C CB  . THR   A 89  ? 0.26800 0.29600 0.33980 0.01200  -0.05440 -0.06150 93  THR   A CB  
1061 O OG1 . THR   A 89  ? 0.28580 0.29340 0.37210 0.02400  -0.05120 -0.06300 93  THR   A OG1 
1062 C CG2 . THR   A 89  ? 0.27200 0.30270 0.34660 0.01600  -0.03030 -0.08610 93  THR   A CG2 
1070 N N   A PRO   A 90  ? 0.22960 0.30270 0.25300 -0.00060 -0.03140 -0.02700 94  PRO   A N   
1071 N N   B PRO   A 90  ? 0.22700 0.30090 0.24610 -0.00690 -0.03590 -0.02160 94  PRO   A N   
1072 C CA  A PRO   A 90  ? 0.22470 0.30820 0.25330 -0.00500 -0.01250 -0.03090 94  PRO   A CA  
1073 C CA  B PRO   A 90  ? 0.21650 0.30610 0.24200 -0.01550 -0.02330 -0.03070 94  PRO   A CA  
1074 C C   A PRO   A 90  ? 0.21850 0.31950 0.26510 0.01110  0.00290  -0.03020 94  PRO   A C   
1075 C C   B PRO   A 90  ? 0.20700 0.31810 0.25550 -0.00260 -0.00870 -0.03560 94  PRO   A C   
1076 O O   A PRO   A 90  ? 0.22150 0.32980 0.28110 0.03430  0.02640  -0.01640 94  PRO   A O   
1077 O O   B PRO   A 90  ? 0.19110 0.32830 0.26290 0.01050  0.00160  -0.03600 94  PRO   A O   
1078 C CB  A PRO   A 90  ? 0.22690 0.30230 0.26080 -0.00820 -0.02730 -0.03650 94  PRO   A CB  
1079 C CB  B PRO   A 90  ? 0.21980 0.30030 0.24770 -0.01870 -0.04170 -0.03470 94  PRO   A CB  
1080 C CG  A PRO   A 90  ? 0.22510 0.30140 0.27620 -0.00040 -0.02590 -0.03760 94  PRO   A CG  
1081 C CG  B PRO   A 90  ? 0.22590 0.30060 0.26510 -0.01080 -0.03160 -0.02680 94  PRO   A CG  
1082 C CD  A PRO   A 90  ? 0.22930 0.30070 0.26170 -0.00160 -0.02900 -0.03590 94  PRO   A CD  
1083 C CD  B PRO   A 90  ? 0.22630 0.29750 0.25720 -0.01210 -0.03610 -0.02340 94  PRO   A CD  
1098 N N   . ILE   A 91  ? 0.20420 0.31620 0.25160 -0.00210 0.00730  -0.03660 95  ILE   A N   
1099 C CA  . ILE   A 91  ? 0.19670 0.32700 0.25290 -0.01560 -0.00560 -0.01100 95  ILE   A CA  
1100 C C   . ILE   A 91  ? 0.19220 0.33910 0.24950 -0.01920 0.02340  0.00810  95  ILE   A C   
1101 O O   . ILE   A 91  ? 0.17500 0.33180 0.23780 -0.02630 0.00290  0.02160  95  ILE   A O   
1102 C CB  . ILE   A 91  ? 0.20330 0.32920 0.28440 -0.01300 -0.02060 -0.00380 95  ILE   A CB  
1103 C CG1 . ILE   A 91  ? 0.22830 0.33090 0.31460 0.00030  -0.02520 -0.00470 95  ILE   A CG1 
1104 C CG2 . ILE   A 91  ? 0.20290 0.33920 0.28860 -0.00610 -0.00930 -0.00180 95  ILE   A CG2 
1105 C CD1 . ILE   A 91  ? 0.21920 0.33700 0.31900 0.00960  -0.01690 0.00300  95  ILE   A CD1 
1118 N N   . ARG   A 92  ? 0.22760 0.36680 0.24950 -0.01930 0.03190  -0.00350 96  ARG   A N   
1119 C CA  . ARG   A 92  ? 0.23760 0.38930 0.23980 -0.03060 0.01850  -0.00460 96  ARG   A CA  
1120 C C   . ARG   A 92  ? 0.19680 0.38620 0.25310 -0.01910 -0.00210 -0.00920 96  ARG   A C   
1121 O O   . ARG   A 92  ? 0.19830 0.39170 0.31070 -0.01410 0.01700  0.00130  96  ARG   A O   
1122 C CB  . ARG   A 92  ? 0.29980 0.42290 0.25870 -0.05460 0.01540  -0.01420 96  ARG   A CB  
1123 C CG  . ARG   A 92  ? 0.37000 0.44590 0.29090 -0.09550 -0.01450 -0.02840 96  ARG   A CG  
1124 C CD  . ARG   A 92  ? 0.39510 0.46920 0.32430 -0.10150 -0.03810 -0.04130 96  ARG   A CD  
1125 N NE  . ARG   A 92  ? 0.41490 0.48780 0.35630 -0.09600 -0.01230 -0.05310 96  ARG   A NE  
1126 C CZ  . ARG   A 92  ? 0.38870 0.49950 0.35220 -0.10020 0.03080  -0.05080 96  ARG   A CZ  
1127 N NH1 . ARG   A 92  ? 0.38760 0.50440 0.35390 -0.07760 0.06360  -0.04140 96  ARG   A NH1 
1128 N NH2 . ARG   A 92  ? 0.41800 0.51390 0.37280 -0.10400 0.04070  -0.03670 96  ARG   A NH2 
1142 N N   . TYR   A 93  ? 0.13970 0.37870 0.23090 -0.02130 -0.00410 -0.00950 97  TYR   A N   
1143 C CA  . TYR   A 93  ? 0.17240 0.36440 0.25530 -0.01910 0.00570  -0.01460 97  TYR   A CA  
1144 C C   . TYR   A 93  ? 0.18550 0.38110 0.25870 -0.02540 -0.00440 -0.00060 97  TYR   A C   
1145 O O   . TYR   A 93  ? 0.18170 0.38510 0.24790 -0.01160 0.00250  -0.00060 97  TYR   A O   
1146 C CB  . TYR   A 93  ? 0.15590 0.35470 0.23250 -0.01950 0.00130  -0.01960 97  TYR   A CB  
1147 C CG  . TYR   A 93  ? 0.15600 0.34170 0.22300 -0.01310 -0.02300 -0.00410 97  TYR   A CG  
1148 C CD1 . TYR   A 93  ? 0.15530 0.33760 0.22440 -0.01690 -0.02630 -0.01200 97  TYR   A CD1 
1149 C CD2 . TYR   A 93  ? 0.16290 0.32500 0.22880 -0.01560 -0.03370 -0.00770 97  TYR   A CD2 
1150 C CE1 . TYR   A 93  ? 0.13600 0.33150 0.22230 -0.00860 -0.03870 -0.01040 97  TYR   A CE1 
1151 C CE2 . TYR   A 93  ? 0.16310 0.32910 0.22740 -0.01740 -0.02510 -0.01280 97  TYR   A CE2 
1152 C CZ  . TYR   A 93  ? 0.14430 0.33020 0.20850 -0.01580 -0.00920 -0.01510 97  TYR   A CZ  
1153 O OH  . TYR   A 93  ? 0.15320 0.34140 0.22050 -0.00060 -0.01920 -0.01440 97  TYR   A OH  
1164 N N   . GLY   A 94  ? 0.19590 0.38850 0.29840 -0.04400 -0.00930 0.02760  98  GLY   A N   
1165 C CA  . GLY   A 94  ? 0.20650 0.38090 0.29000 -0.04300 -0.00850 0.01870  98  GLY   A CA  
1166 C C   . GLY   A 94  ? 0.18050 0.37710 0.27140 -0.05580 -0.00510 0.00830  98  GLY   A C   
1167 O O   . GLY   A 94  ? 0.17810 0.37020 0.28870 -0.06280 -0.00810 0.00090  98  GLY   A O   
1171 N N   . LYS   A 95  ? 0.19620 0.38290 0.27110 -0.05850 -0.00810 0.01160  99  LYS   A N   
1172 C CA  . LYS   A 95  ? 0.23650 0.38770 0.28470 -0.04540 -0.01350 0.02240  99  LYS   A CA  
1173 C C   . LYS   A 95  ? 0.25980 0.39220 0.30480 -0.04380 -0.01490 0.03700  99  LYS   A C   
1174 O O   . LYS   A 95  ? 0.27030 0.37600 0.28620 -0.03180 -0.00870 0.04350  99  LYS   A O   
1175 C CB  . LYS   A 95  ? 0.29950 0.39740 0.30750 -0.02430 -0.01150 0.02190  99  LYS   A CB  
1176 C CG  . LYS   A 95  ? 0.37600 0.41260 0.35860 -0.01060 -0.03270 0.03220  99  LYS   A CG  
1177 C CD  . LYS   A 95  ? 0.44650 0.43070 0.40930 0.00750  -0.02710 0.04260  99  LYS   A CD  
1178 C CE  . LYS   A 95  ? 0.50180 0.44660 0.45880 0.01240  -0.03290 0.05500  99  LYS   A CE  
1179 N NZ  . LYS   A 95  ? 0.53800 0.46190 0.50070 0.00870  -0.03490 0.04920  99  LYS   A NZ  
1193 N N   . ASN   A 96  ? 0.24040 0.40450 0.32270 -0.07610 0.00350  0.04530  100 ASN   A N   
1194 C CA  . ASN   A 96  ? 0.24760 0.43130 0.36680 -0.07760 -0.02590 0.04380  100 ASN   A CA  
1195 C C   . ASN   A 96  ? 0.25350 0.42750 0.35330 -0.08100 -0.05380 0.03690  100 ASN   A C   
1196 O O   . ASN   A 96  ? 0.28280 0.43300 0.36290 -0.10870 -0.07730 0.02800  100 ASN   A O   
1197 C CB  . ASN   A 96  ? 0.24170 0.46050 0.40260 -0.06440 -0.02460 0.03650  100 ASN   A CB  
1198 C CG  . ASN   A 96  ? 0.25100 0.48640 0.43410 -0.02850 -0.02040 0.04770  100 ASN   A CG  
1199 O OD1 . ASN   A 96  ? 0.30620 0.49290 0.46480 -0.00790 0.00320  0.05450  100 ASN   A OD1 
1200 N ND2 . ASN   A 96  ? 0.25200 0.50430 0.45470 -0.02540 -0.03840 0.03770  100 ASN   A ND2 
1207 N N   . ALA   A 97  ? 0.21930 0.40850 0.31300 -0.07110 -0.05220 0.04800  101 ALA   A N   
1208 C CA  . ALA   A 97  ? 0.22580 0.39850 0.31040 -0.05230 -0.06770 0.05120  101 ALA   A CA  
1209 C C   . ALA   A 97  ? 0.20430 0.38750 0.29000 -0.05630 -0.05940 0.05210  101 ALA   A C   
1210 O O   . ALA   A 97  ? 0.20580 0.40140 0.30750 -0.06290 -0.02720 0.05670  101 ALA   A O   
1211 C CB  . ALA   A 97  ? 0.24290 0.39770 0.31990 -0.03840 -0.04640 0.05090  101 ALA   A CB  
1217 N N   . LEU   A 98  ? 0.20460 0.36340 0.28100 -0.06160 -0.05320 0.04330  102 LEU   A N   
1218 C CA  . LEU   A 98  ? 0.21890 0.34650 0.28110 -0.06530 -0.05850 0.03650  102 LEU   A CA  
1219 C C   . LEU   A 98  ? 0.27850 0.35330 0.32790 -0.05740 -0.05840 0.04620  102 LEU   A C   
1220 O O   . LEU   A 98  ? 0.30040 0.36550 0.35660 -0.05740 -0.06290 0.04040  102 LEU   A O   
1221 C CB  . LEU   A 98  ? 0.21650 0.33350 0.26830 -0.02710 -0.03660 0.04200  102 LEU   A CB  
1222 C CG  . LEU   A 98  ? 0.20780 0.33040 0.26720 -0.02960 -0.04900 0.01470  102 LEU   A CG  
1223 C CD1 . LEU   A 98  ? 0.20690 0.34700 0.28390 -0.03270 -0.07130 0.02930  102 LEU   A CD1 
1224 C CD2 . LEU   A 98  ? 0.21900 0.32060 0.26860 -0.02200 -0.03450 0.00240  102 LEU   A CD2 
1236 N N   . VAL   A 99  ? 0.27240 0.35670 0.33760 -0.03230 -0.08200 0.02540  103 VAL   A N   
1237 C CA  . VAL   A 99  ? 0.23330 0.36040 0.32210 -0.02970 -0.05940 0.00950  103 VAL   A CA  
1238 C C   . VAL   A 99  ? 0.20660 0.35850 0.28210 -0.02560 -0.06690 0.02120  103 VAL   A C   
1239 O O   . VAL   A 99  ? 0.22120 0.36420 0.29500 -0.02390 -0.05670 0.01820  103 VAL   A O   
1240 C CB  . VAL   A 99  ? 0.22930 0.37530 0.32180 -0.01510 -0.03790 0.01880  103 VAL   A CB  
1241 C CG1 . VAL   A 99  ? 0.23680 0.38830 0.34800 -0.01040 -0.04680 0.00390  103 VAL   A CG1 
1242 C CG2 . VAL   A 99  ? 0.21350 0.36660 0.33550 -0.01370 0.00850  0.05540  103 VAL   A CG2 
1252 N N   . PRO   A 100 ? 0.22100 0.35420 0.27300 -0.02060 -0.07150 0.01340  104 PRO   A N   
1253 C CA  . PRO   A 100 ? 0.22910 0.34830 0.27070 -0.02030 -0.07220 0.01540  104 PRO   A CA  
1254 C C   . PRO   A 100 ? 0.21540 0.34660 0.25640 -0.00550 -0.06030 0.02340  104 PRO   A C   
1255 O O   . PRO   A 100 ? 0.23280 0.35240 0.25040 -0.00740 -0.02150 0.03500  104 PRO   A O   
1256 C CB  . PRO   A 100 ? 0.26810 0.34630 0.29460 -0.02030 -0.04640 0.00500  104 PRO   A CB  
1257 C CG  . PRO   A 100 ? 0.29120 0.34980 0.30220 -0.01440 -0.03400 0.00750  104 PRO   A CG  
1258 C CD  . PRO   A 100 ? 0.27430 0.35270 0.27510 -0.02680 -0.05640 0.00800  104 PRO   A CD  
1266 N N   A TRP   A 101 ? 0.23610 0.34510 0.27100 0.00150  -0.06620 0.01630  105 TRP   A N   
1267 N N   C TRP   A 101 ? 0.22500 0.34110 0.27030 0.00370  -0.05790 0.01240  105 TRP   A N   
1268 C CA  A TRP   A 101 ? 0.24650 0.34220 0.27760 0.00090  -0.06660 0.00680  105 TRP   A CA  
1269 C CA  C TRP   A 101 ? 0.21890 0.33290 0.26960 0.00200  -0.04880 -0.00300 105 TRP   A CA  
1270 C C   A TRP   A 101 ? 0.20650 0.33760 0.26200 -0.00020 -0.05920 -0.00170 105 TRP   A C   
1271 C C   C TRP   A 101 ? 0.18620 0.33370 0.25820 0.00040  -0.05130 -0.00680 105 TRP   A C   
1272 O O   A TRP   A 101 ? 0.20960 0.33280 0.25960 -0.00540 -0.06910 -0.00280 105 TRP   A O   
1273 O O   C TRP   A 101 ? 0.18820 0.32810 0.25510 -0.00610 -0.06710 -0.00780 105 TRP   A O   
1274 C CB  A TRP   A 101 ? 0.31020 0.35040 0.33020 0.00800  -0.07100 0.00730  105 TRP   A CB  
1275 C CB  C TRP   A 101 ? 0.26570 0.33350 0.32530 0.00950  -0.04040 -0.01380 105 TRP   A CB  
1276 C CG  A TRP   A 101 ? 0.39050 0.36600 0.39510 -0.00000 -0.05610 0.01090  105 TRP   A CG  
1277 C CG  C TRP   A 101 ? 0.32740 0.34280 0.39550 0.00910  -0.01340 -0.02240 105 TRP   A CG  
1278 C CD1 A TRP   A 101 ? 0.41560 0.36740 0.41990 -0.00530 -0.04290 0.01100  105 TRP   A CD1 
1279 C CD1 C TRP   A 101 ? 0.37210 0.35160 0.45210 -0.00530 -0.01170 -0.02490 105 TRP   A CD1 
1280 C CD2 A TRP   A 101 ? 0.42220 0.37280 0.42330 -0.01000 -0.05200 0.00470  105 TRP   A CD2 
1281 C CD2 C TRP   A 101 ? 0.37140 0.35430 0.43020 0.00930  -0.01260 -0.02120 105 TRP   A CD2 
1282 N NE1 A TRP   A 101 ? 0.42620 0.37190 0.43220 -0.00820 -0.04000 0.00720  105 TRP   A NE1 
1283 N NE1 C TRP   A 101 ? 0.39350 0.35880 0.47570 -0.00380 -0.00670 -0.03310 105 TRP   A NE1 
1284 C CE2 A TRP   A 101 ? 0.43250 0.37650 0.43820 -0.01050 -0.03810 0.00260  105 TRP   A CE2 
1285 C CE2 C TRP   A 101 ? 0.38700 0.35800 0.47060 0.00310  -0.00870 -0.02650 105 TRP   A CE2 
1286 C CE3 A TRP   A 101 ? 0.44290 0.37730 0.43770 -0.01250 -0.04290 0.00230  105 TRP   A CE3 
1287 C CE3 C TRP   A 101 ? 0.39080 0.36300 0.45310 0.00500  -0.01250 -0.01790 105 TRP   A CE3 
1288 C CZ2 A TRP   A 101 ? 0.45010 0.37930 0.44830 -0.01450 -0.02350 -0.00070 105 TRP   A CZ2 
1289 C CZ2 C TRP   A 101 ? 0.40840 0.36520 0.49350 0.00810  -0.00110 -0.01900 105 TRP   A CZ2 
1290 C CZ3 A TRP   A 101 ? 0.46070 0.38030 0.44870 -0.00690 -0.02730 -0.00510 105 TRP   A CZ3 
1291 C CZ3 C TRP   A 101 ? 0.41860 0.36680 0.47880 0.00460  -0.00260 -0.01680 105 TRP   A CZ3 
1292 C CH2 A TRP   A 101 ? 0.45930 0.37950 0.45110 -0.00890 -0.02100 -0.00510 105 TRP   A CH2 
1293 C CH2 C TRP   A 101 ? 0.41950 0.36870 0.49340 0.01030  0.00320  -0.01670 105 TRP   A CH2 
1314 N N   . SER   A 102 ? 0.17740 0.33250 0.24280 0.00200  -0.05100 -0.00760 106 SER   A N   
1315 C CA  . SER   A 102 ? 0.14940 0.32200 0.23960 -0.01790 -0.02930 -0.00730 106 SER   A CA  
1316 C C   . SER   A 102 ? 0.16120 0.33490 0.24510 0.01150  -0.04110 -0.00720 106 SER   A C   
1317 O O   . SER   A 102 ? 0.19160 0.33990 0.25160 0.00270  -0.06500 -0.00110 106 SER   A O   
1318 C CB  . SER   A 102 ? 0.14980 0.31740 0.25780 -0.02300 -0.01750 0.00740  106 SER   A CB  
1319 O OG  . SER   A 102 ? 0.17500 0.31480 0.25170 -0.01530 -0.01790 -0.00070 106 SER   A OG  
1326 N N   . PRO   A 103 ? 0.14810 0.35530 0.24770 0.01540  -0.04870 -0.00740 107 PRO   A N   
1327 C CA  . PRO   A 103 ? 0.15380 0.35630 0.27790 0.00760  -0.03010 -0.01530 107 PRO   A CA  
1328 C C   . PRO   A 103 ? 0.15370 0.36200 0.28700 -0.00010 -0.05870 -0.00200 107 PRO   A C   
1329 O O   . PRO   A 103 ? 0.17520 0.37030 0.31110 -0.00080 -0.08330 -0.00750 107 PRO   A O   
1330 C CB  . PRO   A 103 ? 0.18250 0.36120 0.29800 0.01850  -0.02100 -0.01120 107 PRO   A CB  
1331 C CG  . PRO   A 103 ? 0.17900 0.36940 0.28990 0.03030  -0.03510 -0.01030 107 PRO   A CG  
1332 C CD  . PRO   A 103 ? 0.17130 0.36800 0.25170 0.02960  -0.04980 -0.00900 107 PRO   A CD  
1340 N N   . ILE   A 104 ? 0.14080 0.35230 0.24620 -0.02050 -0.05390 0.01640  108 ILE   A N   
1341 C CA  . ILE   A 104 ? 0.12450 0.34420 0.21260 -0.03160 -0.04080 -0.00440 108 ILE   A CA  
1342 C C   . ILE   A 104 ? 0.14910 0.33580 0.20460 -0.01710 -0.03370 -0.01890 108 ILE   A C   
1343 O O   . ILE   A 104 ? 0.15770 0.33500 0.21570 -0.02630 -0.04850 -0.00090 108 ILE   A O   
1344 C CB  . ILE   A 104 ? 0.15060 0.36620 0.22510 -0.01930 -0.04380 -0.02040 108 ILE   A CB  
1345 C CG1 . ILE   A 104 ? 0.16840 0.38010 0.21670 -0.01560 -0.02660 -0.02660 108 ILE   A CG1 
1346 C CG2 . ILE   A 104 ? 0.16980 0.36680 0.24760 -0.01170 -0.06460 -0.01290 108 ILE   A CG2 
1347 C CD1 . ILE   A 104 ? 0.18030 0.39410 0.23970 0.00660  -0.03690 -0.02780 108 ILE   A CD1 
1359 N N   A SER   A 105 ? 0.15790 0.33620 0.22280 -0.00890 -0.04680 -0.01380 109 SER   A N   
1360 N N   B SER   A 105 ? 0.15150 0.33220 0.21170 -0.01540 -0.02520 -0.01590 109 SER   A N   
1361 C CA  A SER   A 105 ? 0.15730 0.33450 0.23330 -0.00090 -0.01750 -0.01310 109 SER   A CA  
1362 C CA  B SER   A 105 ? 0.15250 0.32810 0.21650 -0.01270 -0.00840 -0.01200 109 SER   A CA  
1363 C C   A SER   A 105 ? 0.15370 0.34200 0.21220 -0.01700 -0.01840 -0.00720 109 SER   A C   
1364 C C   B SER   A 105 ? 0.13870 0.33190 0.21830 -0.01560 -0.01110 -0.00930 109 SER   A C   
1365 O O   A SER   A 105 ? 0.16510 0.34560 0.18440 -0.00970 -0.00430 0.00900  109 SER   A O   
1366 O O   B SER   A 105 ? 0.12450 0.33000 0.21260 0.00020  0.00470  -0.01600 109 SER   A O   
1367 C CB  A SER   A 105 ? 0.15880 0.32170 0.24660 -0.00080 -0.01430 -0.01090 109 SER   A CB  
1368 C CB  B SER   A 105 ? 0.16680 0.32070 0.21970 -0.01240 0.00630  -0.00900 109 SER   A CB  
1369 O OG  A SER   A 105 ? 0.14670 0.30020 0.23590 -0.00670 -0.01430 -0.00230 109 SER   A OG  
1370 O OG  B SER   A 105 ? 0.17520 0.31540 0.22470 -0.01120 0.02050  -0.00190 109 SER   A OG  
1381 N N   . GLU   A 106 ? 0.13240 0.33540 0.22550 -0.02980 -0.02550 0.00380  110 GLU   A N   
1382 C CA  . GLU   A 106 ? 0.15590 0.34020 0.23450 -0.02780 -0.03900 0.01280  110 GLU   A CA  
1383 C C   . GLU   A 106 ? 0.15180 0.32800 0.22390 -0.01430 -0.03870 0.01900  110 GLU   A C   
1384 O O   . GLU   A 106 ? 0.15550 0.32450 0.24500 -0.01480 -0.03750 0.02430  110 GLU   A O   
1385 C CB  . GLU   A 106 ? 0.19380 0.34720 0.29260 -0.03190 -0.03560 0.00430  110 GLU   A CB  
1386 C CG  . GLU   A 106 ? 0.22020 0.35660 0.35390 -0.01790 -0.05480 -0.01690 110 GLU   A CG  
1387 C CD  . GLU   A 106 ? 0.26390 0.36730 0.39360 -0.01450 -0.03380 -0.02900 110 GLU   A CD  
1388 O OE1 . GLU   A 106 ? 0.28220 0.34800 0.39650 -0.02770 -0.02970 -0.02960 110 GLU   A OE1 
1389 O OE2 . GLU   A 106 ? 0.30430 0.39600 0.42250 -0.01790 -0.01430 -0.04260 110 GLU   A OE2 
1397 N N   A LYS   A 107 ? 0.14280 0.31840 0.21770 -0.01140 -0.03620 0.01310  111 LYS   A N   
1398 N N   B LYS   A 107 ? 0.14150 0.32170 0.21870 -0.01090 -0.04430 0.01180  111 LYS   A N   
1399 C CA  A LYS   A 107 ? 0.14800 0.31920 0.22360 -0.00590 -0.01470 0.01100  111 LYS   A CA  
1400 C CA  B LYS   A 107 ? 0.14350 0.32490 0.22540 -0.00340 -0.03290 0.00840  111 LYS   A CA  
1401 C C   A LYS   A 107 ? 0.13500 0.31780 0.21730 -0.01050 -0.02260 0.00690  111 LYS   A C   
1402 C C   B LYS   A 107 ? 0.13240 0.32290 0.21820 -0.00630 -0.03160 0.00790  111 LYS   A C   
1403 O O   A LYS   A 107 ? 0.13190 0.32360 0.21620 -0.01650 -0.02330 0.01540  111 LYS   A O   
1404 O O   B LYS   A 107 ? 0.13340 0.33290 0.21760 -0.00510 -0.03280 0.01520  111 LYS   A O   
1405 C CB  A LYS   A 107 ? 0.16760 0.32260 0.24860 0.00620  -0.01080 0.00910  111 LYS   A CB  
1406 C CB  B LYS   A 107 ? 0.15780 0.33170 0.24980 0.00830  -0.04490 -0.00010 111 LYS   A CB  
1407 C CG  A LYS   A 107 ? 0.18780 0.32760 0.26880 0.01300  -0.00470 0.01310  111 LYS   A CG  
1408 C CG  B LYS   A 107 ? 0.17280 0.34030 0.26680 0.01440  -0.05390 -0.00490 111 LYS   A CG  
1409 C CD  A LYS   A 107 ? 0.19680 0.33360 0.29860 0.01930  -0.00830 -0.00950 111 LYS   A CD  
1410 C CD  B LYS   A 107 ? 0.17860 0.34970 0.28850 0.01420  -0.04890 -0.03270 111 LYS   A CD  
1411 C CE  A LYS   A 107 ? 0.20090 0.34000 0.31880 0.02810  -0.00380 -0.01560 111 LYS   A CE  
1412 C CE  B LYS   A 107 ? 0.18540 0.35610 0.30620 0.00710  -0.07310 -0.04400 111 LYS   A CE  
1413 N NZ  A LYS   A 107 ? 0.21910 0.34030 0.32200 0.02180  0.03250  -0.02300 111 LYS   A NZ  
1414 N NZ  B LYS   A 107 ? 0.20430 0.35970 0.32620 0.00580  -0.08310 -0.05370 111 LYS   A NZ  
1441 N N   . TYR   A 108 ? 0.12260 0.31810 0.22210 -0.01810 -0.03630 -0.00330 112 TYR   A N   
1442 C CA  . TYR   A 108 ? 0.12020 0.32090 0.21130 -0.01520 -0.02180 -0.00920 112 TYR   A CA  
1443 C C   . TYR   A 108 ? 0.14630 0.32380 0.23060 -0.02640 -0.03700 0.00610  112 TYR   A C   
1444 O O   . TYR   A 108 ? 0.16360 0.32280 0.21800 -0.01190 -0.02940 0.00960  112 TYR   A O   
1445 C CB  . TYR   A 108 ? 0.11390 0.31260 0.20960 0.01270  -0.01130 -0.01010 112 TYR   A CB  
1446 C CG  . TYR   A 108 ? 0.13930 0.30990 0.21380 -0.00850 -0.00930 -0.01200 112 TYR   A CG  
1447 C CD1 . TYR   A 108 ? 0.13360 0.31150 0.22260 -0.01970 -0.00900 -0.02730 112 TYR   A CD1 
1448 C CD2 . TYR   A 108 ? 0.15090 0.29730 0.20680 -0.00000 -0.00850 -0.00840 112 TYR   A CD2 
1449 C CE1 . TYR   A 108 ? 0.13250 0.30220 0.21270 -0.00050 -0.00010 -0.02260 112 TYR   A CE1 
1450 C CE2 . TYR   A 108 ? 0.13730 0.30060 0.21190 -0.00460 -0.01410 -0.02390 112 TYR   A CE2 
1451 C CZ  . TYR   A 108 ? 0.12360 0.29450 0.20190 -0.00910 -0.00580 -0.02820 112 TYR   A CZ  
1452 O OH  . TYR   A 108 ? 0.14750 0.30400 0.23730 -0.00950 -0.01100 -0.02410 112 TYR   A OH  
1463 N N   . LEU   A 109 ? 0.15230 0.33200 0.26090 -0.02410 -0.02180 0.00700  113 LEU   A N   
1464 C CA  . LEU   A 109 ? 0.13710 0.33070 0.26860 -0.02680 -0.00530 -0.00270 113 LEU   A CA  
1465 C C   . LEU   A 109 ? 0.12350 0.33580 0.23430 -0.02610 0.00440  0.00740  113 LEU   A C   
1466 O O   . LEU   A 109 ? 0.13370 0.32780 0.21570 -0.01780 -0.00580 -0.00200 113 LEU   A O   
1467 C CB  . LEU   A 109 ? 0.14330 0.32110 0.26450 -0.04940 -0.00670 0.01930  113 LEU   A CB  
1468 C CG  . LEU   A 109 ? 0.16320 0.32140 0.28180 -0.05500 -0.01030 0.01810  113 LEU   A CG  
1469 C CD1 . LEU   A 109 ? 0.17490 0.33310 0.27770 -0.03740 0.00360  0.01650  113 LEU   A CD1 
1470 C CD2 . LEU   A 109 ? 0.19540 0.33820 0.30490 -0.04650 -0.02440 0.02680  113 LEU   A CD2 
1482 N N   . THR   A 110 ? 0.14320 0.34470 0.23570 -0.03030 -0.01420 0.02030  114 THR   A N   
1483 C CA  . THR   A 110 ? 0.14680 0.34700 0.22370 -0.01540 -0.01000 0.01540  114 THR   A CA  
1484 C C   . THR   A 110 ? 0.14420 0.35070 0.21170 -0.01750 -0.00740 0.01010  114 THR   A C   
1485 O O   . THR   A 110 ? 0.18220 0.36580 0.22550 -0.00930 -0.00420 -0.00220 114 THR   A O   
1486 C CB  . THR   A 110 ? 0.15320 0.35580 0.26050 -0.00090 -0.01960 0.01820  114 THR   A CB  
1487 O OG1 . THR   A 110 ? 0.15650 0.35560 0.23250 -0.00160 -0.02000 -0.00190 114 THR   A OG1 
1488 C CG2 . THR   A 110 ? 0.13720 0.36570 0.27910 -0.00580 -0.02430 0.00670  114 THR   A CG2 
1496 N N   . THR   A 111 ? 0.15890 0.34420 0.19430 -0.01820 -0.01590 -0.00580 115 THR   A N   
1497 C CA  . THR   A 111 ? 0.16000 0.32300 0.19610 -0.01880 -0.01080 -0.01790 115 THR   A CA  
1498 C C   . THR   A 111 ? 0.15890 0.31610 0.21630 -0.01460 0.01200  -0.01260 115 THR   A C   
1499 O O   . THR   A 111 ? 0.16470 0.32380 0.23580 -0.02760 0.00390  -0.02330 115 THR   A O   
1500 C CB  . THR   A 111 ? 0.14860 0.32380 0.18380 -0.00810 0.00920  -0.00680 115 THR   A CB  
1501 O OG1 . THR   A 111 ? 0.14730 0.32480 0.20270 -0.01060 0.00370  -0.01080 115 THR   A OG1 
1502 C CG2 . THR   A 111 ? 0.18080 0.32300 0.20650 0.00040  -0.00250 0.00490  115 THR   A CG2 
1510 N N   . GLY   A 112 ? 0.14400 0.31240 0.19840 -0.00770 -0.00070 0.00190  116 GLY   A N   
1511 C CA  . GLY   A 112 ? 0.15190 0.31180 0.21000 -0.01070 0.01680  0.01210  116 GLY   A CA  
1512 C C   . GLY   A 112 ? 0.14760 0.31170 0.18940 -0.01950 -0.00770 0.01060  116 GLY   A C   
1513 O O   . GLY   A 112 ? 0.15390 0.30280 0.20770 -0.01590 0.00390  -0.00940 116 GLY   A O   
1517 N N   A MET   A 113 ? 0.16080 0.32350 0.21530 -0.01610 0.00150  -0.00200 117 MET   A N   
1518 N N   B MET   A 113 ? 0.14210 0.31450 0.21450 -0.02530 -0.01160 0.00210  117 MET   A N   
1519 C CA  A MET   A 113 ? 0.18560 0.33180 0.20720 -0.01290 -0.01380 -0.02010 117 MET   A CA  
1520 C CA  B MET   A 113 ? 0.15410 0.31380 0.20160 -0.03200 -0.03590 -0.01120 117 MET   A CA  
1521 C C   A MET   A 113 ? 0.18170 0.33000 0.19600 -0.01610 -0.01390 -0.01330 117 MET   A C   
1522 C C   B MET   A 113 ? 0.17470 0.31890 0.19860 -0.03350 -0.03850 -0.01600 117 MET   A C   
1523 O O   A MET   A 113 ? 0.16420 0.32820 0.17470 -0.00440 0.00920  -0.00760 117 MET   A O   
1524 O O   B MET   A 113 ? 0.18140 0.31390 0.18960 -0.03520 -0.03660 -0.01870 117 MET   A O   
1525 C CB  A MET   A 113 ? 0.20830 0.33790 0.22460 0.00430  -0.00720 -0.03310 117 MET   A CB  
1526 C CB  B MET   A 113 ? 0.15130 0.30190 0.21030 -0.02290 -0.01370 -0.00220 117 MET   A CB  
1527 C CG  A MET   A 113 ? 0.22610 0.34860 0.22280 0.02330  -0.02570 -0.03690 117 MET   A CG  
1528 C CG  B MET   A 113 ? 0.13500 0.29650 0.19740 -0.01960 -0.03030 0.00710  117 MET   A CG  
1529 S SD  A MET   A 113 ? 0.24510 0.36340 0.23650 0.04270  -0.03030 -0.04030 117 MET   A SD  
1530 S SD  B MET   A 113 ? 0.16150 0.30560 0.20780 -0.01530 -0.02490 0.00350  117 MET   A SD  
1531 C CE  A MET   A 113 ? 0.25260 0.37410 0.28050 0.03670  -0.02250 -0.03320 117 MET   A CE  
1532 C CE  B MET   A 113 ? 0.17150 0.30920 0.21670 -0.03400 -0.06220 0.01070  117 MET   A CE  
1551 N N   . THR   A 114 ? 0.17290 0.32330 0.20490 -0.02120 -0.02020 -0.01970 118 THR   A N   
1552 C CA  . THR   A 114 ? 0.17700 0.31310 0.21910 -0.03260 -0.04850 -0.02500 118 THR   A CA  
1553 C C   . THR   A 114 ? 0.18650 0.29030 0.21450 -0.03770 -0.04230 -0.01890 118 THR   A C   
1554 O O   . THR   A 114 ? 0.17850 0.27630 0.20810 -0.03760 -0.02900 -0.01120 118 THR   A O   
1555 C CB  . THR   A 114 ? 0.20460 0.32320 0.23180 -0.04270 -0.04940 -0.02800 118 THR   A CB  
1556 O OG1 . THR   A 114 ? 0.20990 0.32480 0.23520 -0.04090 -0.04270 0.00900  118 THR   A OG1 
1557 C CG2 . THR   A 114 ? 0.24000 0.32730 0.24640 -0.07160 -0.06300 -0.04240 118 THR   A CG2 
1566 N N   . VAL   A 115 ? 0.19540 0.29730 0.22180 -0.01520 -0.06580 0.00770  119 VAL   A N   
1567 C CA  . VAL   A 115 ? 0.19730 0.28900 0.23840 -0.01840 -0.06400 0.01860  119 VAL   A CA  
1568 C C   . VAL   A 115 ? 0.18030 0.29530 0.24660 -0.02640 -0.05670 0.01530  119 VAL   A C   
1569 O O   . VAL   A 115 ? 0.18970 0.29220 0.24900 -0.02110 -0.03570 -0.01110 119 VAL   A O   
1570 C CB  . VAL   A 115 ? 0.19530 0.30060 0.25200 -0.01470 -0.05970 0.01370  119 VAL   A CB  
1571 C CG1 . VAL   A 115 ? 0.19070 0.30160 0.26290 -0.00910 -0.07310 0.01640  119 VAL   A CG1 
1572 C CG2 . VAL   A 115 ? 0.20590 0.29740 0.27790 0.00430  -0.04150 -0.01400 119 VAL   A CG2 
1582 N N   . ALA   A 116 ? 0.19020 0.29980 0.24080 -0.02910 -0.05370 0.01300  120 ALA   A N   
1583 C CA  . ALA   A 116 ? 0.18960 0.30600 0.23670 -0.03290 -0.04880 0.02680  120 ALA   A CA  
1584 C C   . ALA   A 116 ? 0.18880 0.30740 0.22820 -0.02890 -0.04680 0.02780  120 ALA   A C   
1585 O O   . ALA   A 116 ? 0.20360 0.30970 0.22830 -0.04680 -0.06380 0.01530  120 ALA   A O   
1586 C CB  . ALA   A 116 ? 0.21030 0.31650 0.25100 -0.04480 -0.04680 0.02450  120 ALA   A CB  
1592 N N   . GLU   A 117 ? 0.16670 0.31170 0.22850 -0.03070 -0.05250 0.02570  121 GLU   A N   
1593 C CA  . GLU   A 117 ? 0.16140 0.32110 0.21750 -0.04440 -0.05180 0.01430  121 GLU   A CA  
1594 C C   . GLU   A 117 ? 0.15360 0.31150 0.20300 -0.03290 -0.04350 0.01630  121 GLU   A C   
1595 O O   . GLU   A 117 ? 0.16010 0.32040 0.20760 -0.02960 -0.03700 0.01200  121 GLU   A O   
1596 C CB  . GLU   A 117 ? 0.15150 0.33870 0.22390 -0.03400 -0.03380 0.03230  121 GLU   A CB  
1597 C CG  . GLU   A 117 ? 0.12110 0.35940 0.23390 -0.05510 -0.03140 0.04440  121 GLU   A CG  
1598 C CD  . GLU   A 117 ? 0.13880 0.39630 0.25720 -0.04530 -0.02560 0.03590  121 GLU   A CD  
1599 O OE1 . GLU   A 117 ? 0.14380 0.38460 0.25820 -0.04400 -0.02700 0.03220  121 GLU   A OE1 
1600 O OE2 . GLU   A 117 ? 0.13020 0.44440 0.27880 -0.02640 -0.03510 0.03790  121 GLU   A OE2 
1607 N N   . LEU   A 118 ? 0.16880 0.29940 0.20250 -0.03080 -0.04460 0.00580  122 LEU   A N   
1608 C CA  . LEU   A 118 ? 0.16370 0.29810 0.19990 -0.03740 -0.02530 0.00390  122 LEU   A CA  
1609 C C   . LEU   A 118 ? 0.16250 0.30300 0.19580 -0.03730 -0.03870 -0.00180 122 LEU   A C   
1610 O O   . LEU   A 118 ? 0.14180 0.30180 0.20620 -0.02250 -0.02480 -0.01520 122 LEU   A O   
1611 C CB  . LEU   A 118 ? 0.17140 0.29870 0.21020 -0.05590 -0.00850 -0.01470 122 LEU   A CB  
1612 C CG  . LEU   A 118 ? 0.20720 0.30950 0.21050 -0.04570 -0.02160 -0.00980 122 LEU   A CG  
1613 C CD1 . LEU   A 118 ? 0.22660 0.32310 0.21540 -0.06010 0.00310  -0.00060 122 LEU   A CD1 
1614 C CD2 . LEU   A 118 ? 0.22890 0.31890 0.20070 -0.03410 -0.02290 0.00950  122 LEU   A CD2 
1626 N N   . SER   A 119 ? 0.16610 0.30280 0.20170 -0.02930 -0.04440 0.01940  123 SER   A N   
1627 C CA  . SER   A 119 ? 0.17350 0.29960 0.20900 -0.02240 -0.03030 0.02660  123 SER   A CA  
1628 C C   . SER   A 119 ? 0.17300 0.29390 0.18550 -0.02900 -0.02070 0.00800  123 SER   A C   
1629 O O   . SER   A 119 ? 0.17170 0.28790 0.20090 -0.02910 -0.03070 -0.00810 123 SER   A O   
1630 C CB  . SER   A 119 ? 0.18030 0.29750 0.22390 -0.03110 -0.05440 0.02750  123 SER   A CB  
1631 O OG  . SER   A 119 ? 0.19310 0.29140 0.24880 -0.02200 -0.05670 0.02040  123 SER   A OG  
1637 N N   . ALA   A 120 ? 0.15390 0.30930 0.20540 -0.04780 -0.02220 0.00790  124 ALA   A N   
1638 C CA  . ALA   A 120 ? 0.14410 0.33160 0.22120 -0.05370 -0.03440 0.02330  124 ALA   A CA  
1639 C C   . ALA   A 120 ? 0.15230 0.32540 0.18950 -0.05220 -0.03110 0.01440  124 ALA   A C   
1640 O O   . ALA   A 120 ? 0.15770 0.34740 0.20020 -0.04650 -0.03050 -0.00240 124 ALA   A O   
1641 C CB  . ALA   A 120 ? 0.13910 0.34670 0.26260 -0.06000 -0.03360 0.03460  124 ALA   A CB  
1647 N N   . ALA   A 121 ? 0.15030 0.31530 0.20240 -0.03210 -0.03320 0.02070  125 ALA   A N   
1648 C CA  . ALA   A 121 ? 0.15430 0.29780 0.20370 -0.01980 -0.02700 0.00030  125 ALA   A CA  
1649 C C   . ALA   A 121 ? 0.13450 0.30530 0.19210 -0.02970 -0.01940 -0.00330 125 ALA   A C   
1650 O O   . ALA   A 121 ? 0.13140 0.32490 0.19700 -0.02290 -0.03490 0.00200  125 ALA   A O   
1651 C CB  . ALA   A 121 ? 0.14880 0.30300 0.21170 -0.01180 -0.03750 -0.00260 125 ALA   A CB  
1657 N N   . ALA   A 122 ? 0.13750 0.30720 0.18470 -0.02210 -0.02340 -0.00240 126 ALA   A N   
1658 C CA  . ALA   A 122 ? 0.14190 0.31270 0.19490 -0.02900 -0.02100 0.01160  126 ALA   A CA  
1659 C C   . ALA   A 122 ? 0.11660 0.30350 0.19310 -0.01960 -0.02380 -0.00220 126 ALA   A C   
1660 O O   . ALA   A 122 ? 0.12470 0.29400 0.21630 -0.02370 -0.03330 0.00070  126 ALA   A O   
1661 C CB  . ALA   A 122 ? 0.14120 0.31280 0.19030 -0.03300 -0.01910 0.01470  126 ALA   A CB  
1667 N N   . VAL   A 123 ? 0.12320 0.31340 0.19130 -0.03050 -0.02860 0.00460  127 VAL   A N   
1668 C CA  . VAL   A 123 ? 0.11470 0.31200 0.19420 -0.01180 -0.03320 0.01100  127 VAL   A CA  
1669 C C   . VAL   A 123 ? 0.11100 0.32110 0.21420 -0.01930 -0.01870 0.01080  127 VAL   A C   
1670 O O   . VAL   A 123 ? 0.12560 0.32450 0.22120 -0.00470 -0.02980 0.00680  127 VAL   A O   
1671 C CB  . VAL   A 123 ? 0.11440 0.31340 0.21040 -0.01850 -0.01820 0.01680  127 VAL   A CB  
1672 C CG1 . VAL   A 123 ? 0.13260 0.30770 0.22090 -0.02380 -0.00550 0.01690  127 VAL   A CG1 
1673 C CG2 . VAL   A 123 ? 0.13620 0.32540 0.22510 -0.01310 -0.03680 0.02030  127 VAL   A CG2 
1683 N N   . GLN   A 124 ? 0.11720 0.33070 0.21430 -0.00930 -0.02720 0.01420  128 GLN   A N   
1684 C CA  . GLN   A 124 ? 0.10800 0.34900 0.21980 -0.01940 -0.01910 0.01180  128 GLN   A CA  
1685 C C   . GLN   A 124 ? 0.12510 0.34400 0.20930 -0.01680 -0.01810 0.00660  128 GLN   A C   
1686 O O   . GLN   A 124 ? 0.11640 0.35080 0.21560 -0.01220 -0.01230 0.01920  128 GLN   A O   
1687 C CB  . GLN   A 124 ? 0.12820 0.35360 0.25620 -0.03220 -0.00490 0.01420  128 GLN   A CB  
1688 C CG  . GLN   A 124 ? 0.14250 0.35010 0.27750 -0.06160 -0.02290 0.02380  128 GLN   A CG  
1689 C CD  . GLN   A 124 ? 0.17190 0.36930 0.30460 -0.05800 -0.05730 0.02710  128 GLN   A CD  
1690 O OE1 . GLN   A 124 ? 0.22610 0.38420 0.35870 -0.06830 -0.11760 0.03420  128 GLN   A OE1 
1691 N NE2 . GLN   A 124 ? 0.17200 0.37560 0.31250 -0.05530 -0.03710 0.00650  128 GLN   A NE2 
1700 N N   . TYR   A 125 ? 0.13290 0.33680 0.23550 -0.01980 -0.01380 0.01270  129 TYR   A N   
1701 C CA  . TYR   A 125 ? 0.14040 0.33010 0.21220 -0.01090 -0.02190 0.01940  129 TYR   A CA  
1702 C C   . TYR   A 125 ? 0.14840 0.30640 0.21440 -0.00960 -0.02280 0.02100  129 TYR   A C   
1703 O O   . TYR   A 125 ? 0.15820 0.29120 0.24920 -0.01010 -0.00660 0.01720  129 TYR   A O   
1704 C CB  . TYR   A 125 ? 0.13740 0.37110 0.20770 -0.00060 -0.03240 0.02940  129 TYR   A CB  
1705 C CG  . TYR   A 125 ? 0.13880 0.40320 0.22550 0.00590  -0.04530 0.01790  129 TYR   A CG  
1706 C CD1 . TYR   A 125 ? 0.15860 0.42200 0.24630 0.00390  -0.05150 0.02940  129 TYR   A CD1 
1707 C CD2 . TYR   A 125 ? 0.14840 0.43080 0.25660 0.00490  -0.04890 0.00870  129 TYR   A CD2 
1708 C CE1 . TYR   A 125 ? 0.16010 0.43790 0.28480 -0.01050 -0.05650 0.03120  129 TYR   A CE1 
1709 C CE2 . TYR   A 125 ? 0.13540 0.44530 0.26630 -0.00670 -0.03610 0.01180  129 TYR   A CE2 
1710 C CZ  . TYR   A 125 ? 0.14530 0.45350 0.31720 -0.01700 -0.04780 0.03130  129 TYR   A CZ  
1711 O OH  . TYR   A 125 ? 0.15670 0.47980 0.35940 -0.03300 -0.04750 0.05520  129 TYR   A OH  
1721 N N   . SER   A 126 ? 0.13490 0.30250 0.22450 -0.01470 -0.02090 0.02580  130 SER   A N   
1722 C CA  . SER   A 126 ? 0.12900 0.29230 0.21180 0.00210  -0.03900 0.02020  130 SER   A CA  
1723 C C   . SER   A 126 ? 0.14760 0.28690 0.21100 -0.00710 -0.03190 0.00960  130 SER   A C   
1724 O O   . SER   A 126 ? 0.16260 0.28910 0.22210 -0.01600 -0.05250 0.01760  130 SER   A O   
1725 C CB  . SER   A 126 ? 0.13990 0.29480 0.22430 -0.00410 -0.04550 0.01000  130 SER   A CB  
1726 O OG  . SER   A 126 ? 0.14710 0.30030 0.20250 -0.00600 -0.02660 -0.00060 130 SER   A OG  
1732 N N   . ASP   A 127 ? 0.15340 0.29080 0.19840 -0.02800 -0.02410 0.01300  131 ASP   A N   
1733 C CA  . ASP   A 127 ? 0.14050 0.29350 0.18320 -0.03610 -0.03140 0.00980  131 ASP   A CA  
1734 C C   . ASP   A 127 ? 0.13340 0.28470 0.19640 -0.01680 -0.02210 0.01420  131 ASP   A C   
1735 O O   . ASP   A 127 ? 0.12340 0.29040 0.22890 -0.00320 -0.03140 0.01710  131 ASP   A O   
1736 C CB  . ASP   A 127 ? 0.12970 0.30220 0.18740 -0.02930 -0.03240 -0.00010 131 ASP   A CB  
1737 C CG  . ASP   A 127 ? 0.13900 0.30700 0.21820 -0.01810 -0.03330 -0.01430 131 ASP   A CG  
1738 O OD1 . ASP   A 127 ? 0.14200 0.30790 0.21910 -0.03300 -0.02500 -0.00650 131 ASP   A OD1 
1739 O OD2 . ASP   A 127 ? 0.14950 0.31920 0.20060 0.01220  -0.04500 -0.01860 131 ASP   A OD2 
1744 N N   . ASN   A 128 ? 0.12100 0.28550 0.20150 -0.01260 -0.02770 0.00320  132 ASN   A N   
1745 C CA  . ASN   A 128 ? 0.12340 0.27300 0.21130 -0.00520 -0.02640 0.00760  132 ASN   A CA  
1746 C C   . ASN   A 128 ? 0.14030 0.27460 0.21420 -0.00300 -0.01920 0.00770  132 ASN   A C   
1747 O O   . ASN   A 128 ? 0.13800 0.28120 0.22160 -0.00050 -0.00810 -0.00320 132 ASN   A O   
1748 C CB  . ASN   A 128 ? 0.14380 0.26670 0.19600 -0.00330 -0.00440 0.00730  132 ASN   A CB  
1749 C CG  . ASN   A 128 ? 0.14310 0.25550 0.19860 -0.00410 -0.01250 -0.00770 132 ASN   A CG  
1750 O OD1 . ASN   A 128 ? 0.14480 0.28710 0.21860 -0.01800 -0.01080 -0.01140 132 ASN   A OD1 
1751 N ND2 . ASN   A 128 ? 0.16690 0.23930 0.20250 0.02530  -0.01250 -0.00070 132 ASN   A ND2 
1758 N N   . ALA   A 129 ? 0.14480 0.28210 0.19920 -0.02040 -0.02220 0.01570  133 ALA   A N   
1759 C CA  . ALA   A 129 ? 0.14960 0.29140 0.21370 -0.02870 -0.01430 0.01250  133 ALA   A CA  
1760 C C   . ALA   A 129 ? 0.14380 0.28920 0.21040 -0.01300 -0.02510 -0.00530 133 ALA   A C   
1761 O O   . ALA   A 129 ? 0.14490 0.28780 0.21610 -0.00860 -0.01260 -0.01570 133 ALA   A O   
1762 C CB  . ALA   A 129 ? 0.16280 0.30260 0.22370 -0.02460 -0.01440 0.02910  133 ALA   A CB  
1768 N N   . ALA   A 130 ? 0.14820 0.27170 0.21260 -0.02400 -0.01620 -0.00390 134 ALA   A N   
1769 C CA  . ALA   A 130 ? 0.14970 0.26280 0.22160 -0.02010 -0.01960 -0.00580 134 ALA   A CA  
1770 C C   . ALA   A 130 ? 0.16190 0.27350 0.21460 -0.00230 -0.01830 -0.00530 134 ALA   A C   
1771 O O   . ALA   A 130 ? 0.16460 0.27130 0.21690 -0.00430 -0.01910 -0.00170 134 ALA   A O   
1772 C CB  . ALA   A 130 ? 0.14390 0.25720 0.22840 -0.02900 -0.01430 -0.00140 134 ALA   A CB  
1778 N N   . ALA   A 131 ? 0.16570 0.27920 0.20500 -0.01970 -0.02330 -0.01220 135 ALA   A N   
1779 C CA  . ALA   A 131 ? 0.14780 0.29520 0.20710 -0.00610 -0.02780 0.00760  135 ALA   A CA  
1780 C C   . ALA   A 131 ? 0.15110 0.29430 0.19900 -0.00230 -0.01360 -0.00700 135 ALA   A C   
1781 O O   . ALA   A 131 ? 0.16450 0.28910 0.20180 0.00220  -0.01270 -0.00410 135 ALA   A O   
1782 C CB  . ALA   A 131 ? 0.13360 0.30440 0.19400 0.00080  -0.02940 0.01150  135 ALA   A CB  
1788 N N   . ASN   A 132 ? 0.13680 0.29930 0.19880 -0.01570 0.00470  -0.00790 136 ASN   A N   
1789 C CA  . ASN   A 132 ? 0.13890 0.30190 0.18270 -0.01210 -0.01310 -0.01610 136 ASN   A CA  
1790 C C   . ASN   A 132 ? 0.15200 0.31380 0.20650 -0.01020 -0.01450 -0.02820 136 ASN   A C   
1791 O O   . ASN   A 132 ? 0.15960 0.32610 0.18880 0.02120  -0.00910 -0.02390 136 ASN   A O   
1792 C CB  . ASN   A 132 ? 0.16220 0.30300 0.18150 0.00090  -0.00640 -0.00630 136 ASN   A CB  
1793 C CG  . ASN   A 132 ? 0.18460 0.30520 0.20090 -0.00180 -0.00230 0.00040  136 ASN   A CG  
1794 O OD1 . ASN   A 132 ? 0.18280 0.29120 0.20770 -0.00560 -0.01260 -0.00900 136 ASN   A OD1 
1795 N ND2 . ASN   A 132 ? 0.21810 0.32670 0.19570 0.00700  -0.01290 -0.00710 136 ASN   A ND2 
1802 N N   . LEU   A 133 ? 0.14960 0.31930 0.19200 -0.01290 -0.01950 -0.01510 137 LEU   A N   
1803 C CA  . LEU   A 133 ? 0.16750 0.31650 0.19330 -0.00710 -0.00930 -0.01790 137 LEU   A CA  
1804 C C   . LEU   A 133 ? 0.18240 0.31320 0.20990 -0.00350 -0.02490 -0.03490 137 LEU   A C   
1805 O O   . LEU   A 133 ? 0.21530 0.33540 0.21750 -0.00860 -0.00740 -0.04420 137 LEU   A O   
1806 C CB  . LEU   A 133 ? 0.16910 0.32100 0.21280 -0.01830 -0.00160 -0.00420 137 LEU   A CB  
1807 C CG  . LEU   A 133 ? 0.18140 0.33460 0.20720 -0.02480 -0.02310 0.00160  137 LEU   A CG  
1808 C CD1 . LEU   A 133 ? 0.19350 0.34390 0.24140 -0.02880 -0.03810 0.00720  137 LEU   A CD1 
1809 C CD2 . LEU   A 133 ? 0.20000 0.33910 0.23360 -0.02320 -0.02450 0.00530  137 LEU   A CD2 
1821 N N   . LEU   A 134 ? 0.15780 0.29320 0.22560 0.00700  -0.01730 -0.03840 138 LEU   A N   
1822 C CA  . LEU   A 134 ? 0.16540 0.28410 0.25010 -0.01460 -0.01590 -0.02200 138 LEU   A CA  
1823 C C   . LEU   A 134 ? 0.17430 0.28820 0.24230 -0.00930 -0.01030 -0.01410 138 LEU   A C   
1824 O O   . LEU   A 134 ? 0.17720 0.29390 0.25600 -0.00160 -0.02690 0.00680  138 LEU   A O   
1825 C CB  . LEU   A 134 ? 0.15120 0.27150 0.25030 -0.02290 -0.00180 -0.01050 138 LEU   A CB  
1826 C CG  . LEU   A 134 ? 0.14370 0.27000 0.25150 -0.03090 -0.02130 -0.00710 138 LEU   A CG  
1827 C CD1 . LEU   A 134 ? 0.15810 0.28010 0.26790 -0.02610 -0.00650 0.01770  138 LEU   A CD1 
1828 C CD2 . LEU   A 134 ? 0.18240 0.26260 0.27830 -0.01860 -0.02700 -0.00120 138 LEU   A CD2 
1840 N N   . LEU   A 135 ? 0.16050 0.28340 0.22480 -0.01430 -0.01130 -0.01240 139 LEU   A N   
1841 C CA  . LEU   A 135 ? 0.15000 0.31030 0.23840 -0.00570 -0.01670 -0.02720 139 LEU   A CA  
1842 C C   . LEU   A 135 ? 0.16110 0.34320 0.25520 0.01010  -0.00560 -0.02700 139 LEU   A C   
1843 O O   . LEU   A 135 ? 0.14800 0.34430 0.28020 0.01880  0.00500  -0.02460 139 LEU   A O   
1844 C CB  . LEU   A 135 ? 0.15820 0.31520 0.24770 -0.00230 -0.01850 -0.01500 139 LEU   A CB  
1845 C CG  . LEU   A 135 ? 0.19140 0.31800 0.23420 -0.00720 -0.02840 -0.00860 139 LEU   A CG  
1846 C CD1 . LEU   A 135 ? 0.20360 0.31950 0.22870 0.01140  -0.02410 -0.00680 139 LEU   A CD1 
1847 C CD2 . LEU   A 135 ? 0.20530 0.31890 0.22580 -0.01060 -0.05710 -0.01750 139 LEU   A CD2 
1859 N N   . LYS   A 136 ? 0.19450 0.36370 0.23440 0.01410  -0.00690 -0.02910 140 LYS   A N   
1860 C CA  . LYS   A 136 ? 0.24400 0.40160 0.25790 0.03750  -0.00660 -0.03480 140 LYS   A CA  
1861 C C   . LYS   A 136 ? 0.23290 0.41770 0.28440 0.03680  -0.00450 -0.06910 140 LYS   A C   
1862 O O   . LYS   A 136 ? 0.23940 0.42180 0.30910 0.04370  0.01040  -0.06280 140 LYS   A O   
1863 C CB  . LYS   A 136 ? 0.30240 0.43290 0.24810 0.05560  -0.01150 -0.02940 140 LYS   A CB  
1864 C CG  . LYS   A 136 ? 0.38470 0.46680 0.31630 0.06880  0.00080  -0.00410 140 LYS   A CG  
1865 C CD  . LYS   A 136 ? 0.46790 0.49290 0.40040 0.06220  -0.01100 -0.00490 140 LYS   A CD  
1866 C CE  . LYS   A 136 ? 0.52840 0.51840 0.46080 0.05900  -0.01080 -0.01820 140 LYS   A CE  
1867 N NZ  . LYS   A 136 ? 0.56960 0.53770 0.48420 0.06380  -0.01020 -0.02770 140 LYS   A NZ  
1881 N N   . GLU   A 137 ? 0.21550 0.41960 0.29390 0.03940  -0.04230 -0.08630 141 GLU   A N   
1882 C CA  . GLU   A 137 ? 0.25630 0.41570 0.33530 0.04410  -0.05550 -0.09670 141 GLU   A CA  
1883 C C   . GLU   A 137 ? 0.27140 0.39350 0.33910 0.03530  -0.05600 -0.09710 141 GLU   A C   
1884 O O   . GLU   A 137 ? 0.31720 0.40000 0.37780 0.03950  -0.07240 -0.10250 141 GLU   A O   
1885 C CB  . GLU   A 137 ? 0.31940 0.43830 0.39040 0.04530  -0.07250 -0.09900 141 GLU   A CB  
1886 C CG  . GLU   A 137 ? 0.41850 0.45860 0.44630 0.05180  -0.07310 -0.11000 141 GLU   A CG  
1887 C CD  . GLU   A 137 ? 0.48730 0.48060 0.48390 0.05190  -0.08040 -0.11370 141 GLU   A CD  
1888 O OE1 . GLU   A 137 ? 0.49880 0.47510 0.49500 0.04140  -0.08020 -0.11960 141 GLU   A OE1 
1889 O OE2 . GLU   A 137 ? 0.52620 0.49840 0.51990 0.06090  -0.08260 -0.10130 141 GLU   A OE2 
1896 N N   . LEU   A 138 ? 0.23010 0.36980 0.30520 0.01170  -0.03880 -0.08500 142 LEU   A N   
1897 C CA  . LEU   A 138 ? 0.23600 0.34850 0.28850 0.01970  -0.03000 -0.08520 142 LEU   A CA  
1898 C C   . LEU   A 138 ? 0.22550 0.34280 0.29290 0.01330  -0.02470 -0.07780 142 LEU   A C   
1899 O O   . LEU   A 138 ? 0.25300 0.35240 0.33970 0.01640  -0.00420 -0.05340 142 LEU   A O   
1900 C CB  . LEU   A 138 ? 0.27620 0.35410 0.33570 0.03380  -0.02390 -0.06890 142 LEU   A CB  
1901 C CG  . LEU   A 138 ? 0.29670 0.36060 0.37580 0.05490  -0.00020 -0.07220 142 LEU   A CG  
1902 C CD1 . LEU   A 138 ? 0.32840 0.36190 0.39010 0.07280  0.02960  -0.07180 142 LEU   A CD1 
1903 C CD2 . LEU   A 138 ? 0.30410 0.36670 0.39990 0.03470  -0.00940 -0.06180 142 LEU   A CD2 
1915 N N   . GLY   A 139 ? 0.21270 0.32860 0.31380 -0.00700 0.00570  -0.07730 143 GLY   A N   
1916 C CA  . GLY   A 139 ? 0.19660 0.33180 0.33090 0.01130  -0.00570 -0.07310 143 GLY   A CA  
1917 C C   . GLY   A 139 ? 0.18540 0.32980 0.33630 0.00930  -0.01490 -0.06440 143 GLY   A C   
1918 O O   . GLY   A 139 ? 0.20020 0.34440 0.41300 0.01560  0.00760  -0.04840 143 GLY   A O   
1922 N N   . GLY   A 140 ? 0.18090 0.30620 0.25900 0.01550  -0.00830 -0.05010 144 GLY   A N   
1923 C CA  . GLY   A 140 ? 0.18160 0.30280 0.23340 0.01020  0.01060  -0.02970 144 GLY   A CA  
1924 C C   . GLY   A 140 ? 0.18770 0.30240 0.22800 0.01760  -0.00190 -0.01850 144 GLY   A C   
1925 O O   . GLY   A 140 ? 0.15770 0.30140 0.23920 0.01250  -0.01490 -0.02420 144 GLY   A O   
1929 N N   . PRO   A 141 ? 0.19610 0.30240 0.20210 -0.00100 -0.00490 -0.00760 145 PRO   A N   
1930 C CA  . PRO   A 141 ? 0.17620 0.30100 0.20810 -0.00790 0.00630  -0.00920 145 PRO   A CA  
1931 C C   . PRO   A 141 ? 0.15000 0.30010 0.21190 -0.01010 0.00400  -0.00410 145 PRO   A C   
1932 O O   . PRO   A 141 ? 0.14290 0.29220 0.21680 -0.00930 0.01690  -0.00080 145 PRO   A O   
1933 C CB  . PRO   A 141 ? 0.18650 0.30550 0.22330 0.00680  -0.00300 0.00200  145 PRO   A CB  
1934 C CG  . PRO   A 141 ? 0.19670 0.30190 0.22290 0.01330  0.00700  0.00150  145 PRO   A CG  
1935 C CD  . PRO   A 141 ? 0.20560 0.29840 0.21170 0.00610  0.01430  0.00480  145 PRO   A CD  
1943 N N   . ALA   A 142 ? 0.14510 0.31150 0.21090 0.01960  0.00550  0.00220  146 ALA   A N   
1944 C CA  . ALA   A 142 ? 0.12520 0.32440 0.24550 0.02060  -0.01140 -0.00670 146 ALA   A CA  
1945 C C   . ALA   A 142 ? 0.13770 0.32040 0.24030 0.01430  -0.00820 -0.01180 146 ALA   A C   
1946 O O   . ALA   A 142 ? 0.16270 0.31720 0.22860 0.01450  -0.01350 -0.02550 146 ALA   A O   
1947 C CB  . ALA   A 142 ? 0.13710 0.33750 0.27790 0.02160  0.00110  0.01510  146 ALA   A CB  
1953 N N   . GLY   A 143 ? 0.13940 0.32030 0.23620 0.00750  0.01080  -0.00720 147 GLY   A N   
1954 C CA  . GLY   A 143 ? 0.15450 0.31160 0.25100 0.00700  0.02930  -0.03360 147 GLY   A CA  
1955 C C   . GLY   A 143 ? 0.14610 0.29530 0.25250 0.00460  0.01130  -0.03340 147 GLY   A C   
1956 O O   . GLY   A 143 ? 0.16870 0.29410 0.24510 0.01960  -0.01020 -0.04870 147 GLY   A O   
1960 N N   . LEU   A 144 ? 0.13270 0.28020 0.23110 0.00460  0.01650  -0.03030 148 LEU   A N   
1961 C CA  . LEU   A 144 ? 0.13090 0.27280 0.24780 0.00240  0.00730  -0.02170 148 LEU   A CA  
1962 C C   . LEU   A 144 ? 0.14220 0.26730 0.23970 0.00600  -0.01350 -0.00900 148 LEU   A C   
1963 O O   . LEU   A 144 ? 0.13610 0.27130 0.22580 0.00660  -0.01090 -0.02880 148 LEU   A O   
1964 C CB  . LEU   A 144 ? 0.14020 0.27000 0.23640 -0.00460 -0.00050 -0.01980 148 LEU   A CB  
1965 C CG  . LEU   A 144 ? 0.14340 0.26820 0.24060 -0.00510 -0.00070 -0.01210 148 LEU   A CG  
1966 C CD1 . LEU   A 144 ? 0.13040 0.27050 0.26040 -0.02010 0.02710  -0.01610 148 LEU   A CD1 
1967 C CD2 . LEU   A 144 ? 0.16490 0.26840 0.22580 0.00660  -0.00570 -0.00830 148 LEU   A CD2 
1979 N N   . THR   A 145 ? 0.13530 0.26850 0.21700 0.01060  0.00350  -0.00760 149 THR   A N   
1980 C CA  . THR   A 145 ? 0.12260 0.26330 0.20860 0.00320  -0.00330 -0.01660 149 THR   A CA  
1981 C C   . THR   A 145 ? 0.12290 0.25930 0.20710 -0.00240 -0.00020 -0.02470 149 THR   A C   
1982 O O   . THR   A 145 ? 0.14280 0.26180 0.22560 -0.00940 -0.00150 -0.00600 149 THR   A O   
1983 C CB  . THR   A 145 ? 0.14730 0.23880 0.20700 -0.00100 0.00150  -0.01490 149 THR   A CB  
1984 O OG1 . THR   A 145 ? 0.14640 0.22530 0.21810 -0.00910 0.01030  -0.01560 149 THR   A OG1 
1985 C CG2 . THR   A 145 ? 0.13310 0.24480 0.21820 -0.02160 0.01290  0.00060  149 THR   A CG2 
1993 N N   . ALA   A 146 ? 0.14830 0.26030 0.22520 -0.00890 -0.00810 -0.02640 150 ALA   A N   
1994 C CA  . ALA   A 146 ? 0.16460 0.26630 0.25270 0.01300  -0.00930 -0.03220 150 ALA   A CA  
1995 C C   . ALA   A 146 ? 0.15510 0.26280 0.24520 0.01130  -0.00920 -0.02850 150 ALA   A C   
1996 O O   . ALA   A 146 ? 0.15960 0.27250 0.25440 0.00390  -0.00330 -0.01060 150 ALA   A O   
1997 C CB  . ALA   A 146 ? 0.17590 0.27140 0.27840 0.00790  0.02940  -0.03560 150 ALA   A CB  
2003 N N   . PHE   A 147 ? 0.14810 0.25240 0.23420 -0.00090 -0.00430 -0.01970 151 PHE   A N   
2004 C CA  . PHE   A 147 ? 0.16310 0.24360 0.24710 -0.00790 -0.02640 -0.00410 151 PHE   A CA  
2005 C C   . PHE   A 147 ? 0.14120 0.24430 0.26100 -0.00650 -0.00900 0.00180  151 PHE   A C   
2006 O O   . PHE   A 147 ? 0.13780 0.25830 0.26830 0.00490  -0.01200 0.00950  151 PHE   A O   
2007 C CB  . PHE   A 147 ? 0.16040 0.24460 0.24750 -0.01100 -0.00500 -0.03320 151 PHE   A CB  
2008 C CG  . PHE   A 147 ? 0.14790 0.24540 0.26090 -0.01610 -0.00390 -0.03150 151 PHE   A CG  
2009 C CD1 . PHE   A 147 ? 0.15080 0.25700 0.26620 -0.01910 -0.00650 -0.01480 151 PHE   A CD1 
2010 C CD2 . PHE   A 147 ? 0.14780 0.26020 0.26620 -0.01450 -0.01600 -0.02130 151 PHE   A CD2 
2011 C CE1 . PHE   A 147 ? 0.16580 0.26680 0.27570 -0.02770 -0.02380 -0.01300 151 PHE   A CE1 
2012 C CE2 . PHE   A 147 ? 0.15140 0.26670 0.26860 -0.02220 -0.01320 -0.00950 151 PHE   A CE2 
2013 C CZ  . PHE   A 147 ? 0.15840 0.27080 0.26600 -0.02250 -0.00530 0.00670  151 PHE   A CZ  
2023 N N   . MET   A 148 ? 0.12630 0.23910 0.23980 0.00280  -0.02190 -0.00750 152 MET   A N   
2024 C CA  . MET   A 148 ? 0.13360 0.24450 0.25690 0.00320  -0.00460 0.00870  152 MET   A CA  
2025 C C   . MET   A 148 ? 0.12060 0.24730 0.24790 0.01800  -0.00200 0.01270  152 MET   A C   
2026 O O   . MET   A 148 ? 0.13160 0.24930 0.25600 -0.00110 0.00220  0.01690  152 MET   A O   
2027 C CB  . MET   A 148 ? 0.11700 0.24430 0.23790 0.00860  0.01210  0.01180  152 MET   A CB  
2028 C CG  . MET   A 148 ? 0.12360 0.25390 0.24030 0.01450  0.01290  0.01560  152 MET   A CG  
2029 S SD  . MET   A 148 ? 0.12730 0.25920 0.26300 -0.00190 -0.00710 0.00940  152 MET   A SD  
2030 C CE  . MET   A 148 ? 0.13910 0.26750 0.24880 -0.01250 -0.00860 0.00580  152 MET   A CE  
2040 N N   . ARG   A 149 ? 0.14870 0.26690 0.25820 0.01330  -0.00100 0.00070  153 ARG   A N   
2041 C CA  . ARG   A 149 ? 0.13340 0.27860 0.25950 0.01540  0.01830  0.00210  153 ARG   A CA  
2042 C C   . ARG   A 149 ? 0.14610 0.27560 0.28000 0.01530  0.01010  -0.00460 153 ARG   A C   
2043 O O   . ARG   A 149 ? 0.14780 0.27980 0.29000 0.01430  -0.01380 -0.01180 153 ARG   A O   
2044 C CB  . ARG   A 149 ? 0.14620 0.29470 0.25580 -0.00240 0.01470  0.00740  153 ARG   A CB  
2045 C CG  . ARG   A 149 ? 0.13860 0.28200 0.23370 -0.01200 0.00600  0.01810  153 ARG   A CG  
2046 C CD  . ARG   A 149 ? 0.13550 0.28710 0.23090 -0.00960 0.00120  0.02910  153 ARG   A CD  
2047 N NE  . ARG   A 149 ? 0.09620 0.27920 0.22640 -0.00870 0.00550  0.00980  153 ARG   A NE  
2048 C CZ  . ARG   A 149 ? 0.11650 0.28300 0.23000 -0.00070 0.00970  -0.00370 153 ARG   A CZ  
2049 N NH1 . ARG   A 149 ? 0.12060 0.26770 0.24970 0.01030  0.03420  0.01680  153 ARG   A NH1 
2050 N NH2 . ARG   A 149 ? 0.10050 0.28850 0.22890 -0.00190 0.00650  -0.00160 153 ARG   A NH2 
2064 N N   . SER   A 150 ? 0.16350 0.27200 0.29850 0.02340  0.00200  -0.00920 154 SER   A N   
2065 C CA  . SER   A 150 ? 0.17950 0.27930 0.30310 0.02760  0.00360  -0.00520 154 SER   A CA  
2066 C C   . SER   A 150 ? 0.18460 0.27550 0.31280 0.01330  -0.00120 -0.00030 154 SER   A C   
2067 O O   . SER   A 150 ? 0.22020 0.27780 0.31940 0.00200  0.02120  0.01060  154 SER   A O   
2068 C CB  . SER   A 150 ? 0.18910 0.28960 0.31420 0.01400  -0.01290 -0.01800 154 SER   A CB  
2069 O OG  . SER   A 150 ? 0.18410 0.29610 0.31000 0.00760  -0.00830 -0.03530 154 SER   A OG  
2075 N N   . ILE   A 151 ? 0.17270 0.28700 0.28800 0.01330  -0.00080 -0.00470 155 ILE   A N   
2076 C CA  . ILE   A 151 ? 0.16950 0.28920 0.27450 -0.00500 -0.00770 0.01870  155 ILE   A CA  
2077 C C   . ILE   A 151 ? 0.17570 0.29120 0.28100 -0.00510 -0.00100 0.02090  155 ILE   A C   
2078 O O   . ILE   A 151 ? 0.18930 0.30750 0.29490 -0.00120 0.00930  0.02820  155 ILE   A O   
2079 C CB  . ILE   A 151 ? 0.16230 0.28870 0.29770 -0.00300 -0.00290 0.02470  155 ILE   A CB  
2080 C CG1 . ILE   A 151 ? 0.13550 0.28310 0.30460 0.00980  -0.00460 0.01990  155 ILE   A CG1 
2081 C CG2 . ILE   A 151 ? 0.16080 0.29020 0.32550 -0.00100 0.00120  0.02270  155 ILE   A CG2 
2082 C CD1 . ILE   A 151 ? 0.13650 0.29900 0.34820 0.00390  0.00390  0.02720  155 ILE   A CD1 
2094 N N   . GLY   A 152 ? 0.17810 0.28610 0.29430 0.00770  -0.00640 0.02420  156 GLY   A N   
2095 C CA  . GLY   A 152 ? 0.17470 0.27140 0.28700 0.01540  0.01490  0.02390  156 GLY   A CA  
2096 C C   . GLY   A 152 ? 0.16680 0.26600 0.27640 0.00950  0.02080  0.02970  156 GLY   A C   
2097 O O   . GLY   A 152 ? 0.19530 0.27850 0.29890 0.01570  -0.01680 0.02380  156 GLY   A O   
2101 N N   . ASP   A 153 ? 0.13650 0.26100 0.24510 -0.00750 0.00610  0.04260  157 ASP   A N   
2102 C CA  . ASP   A 153 ? 0.13870 0.25840 0.22840 -0.00010 0.01460  0.02000  157 ASP   A CA  
2103 C C   . ASP   A 153 ? 0.12680 0.26770 0.22930 0.00400  -0.00840 0.02220  157 ASP   A C   
2104 O O   . ASP   A 153 ? 0.13750 0.27340 0.22460 -0.01510 -0.00810 0.00610  157 ASP   A O   
2105 C CB  . ASP   A 153 ? 0.11800 0.25760 0.22520 0.01320  0.00890  -0.00660 157 ASP   A CB  
2106 C CG  . ASP   A 153 ? 0.11810 0.26200 0.21800 0.00680  -0.02460 0.00220  157 ASP   A CG  
2107 O OD1 . ASP   A 153 ? 0.13430 0.27610 0.22280 0.00230  -0.00060 0.00660  157 ASP   A OD1 
2108 O OD2 . ASP   A 153 ? 0.10750 0.26070 0.23790 0.00130  0.00010  0.00790  157 ASP   A OD2 
2113 N N   . THR   A 154 ? 0.10950 0.28250 0.25630 -0.00250 0.00020  0.00190  158 THR   A N   
2114 C CA  . THR   A 154 ? 0.10140 0.30390 0.23910 -0.00300 -0.00030 0.00310  158 THR   A CA  
2115 C C   . THR   A 154 ? 0.11140 0.30410 0.21700 0.00210  0.01300  0.01750  158 THR   A C   
2116 O O   . THR   A 154 ? 0.11110 0.30630 0.25860 0.01020  0.02840  0.02200  158 THR   A O   
2117 C CB  . THR   A 154 ? 0.14330 0.31830 0.27850 0.00860  -0.00950 0.01730  158 THR   A CB  
2118 O OG1 . THR   A 154 ? 0.16390 0.33560 0.27810 0.01060  -0.02220 0.02980  158 THR   A OG1 
2119 C CG2 . THR   A 154 ? 0.15280 0.31550 0.32540 0.01490  0.00140  0.03610  158 THR   A CG2 
2127 N N   . THR   A 155 ? 0.11310 0.30810 0.20780 0.01240  0.01110  0.01590  159 THR   A N   
2128 C CA  . THR   A 155 ? 0.12620 0.29610 0.20230 0.00940  0.01670  0.01920  159 THR   A CA  
2129 C C   . THR   A 155 ? 0.12820 0.28650 0.20820 0.00860  0.02420  0.01770  159 THR   A C   
2130 O O   . THR   A 155 ? 0.12820 0.28140 0.20210 0.02030  0.00810  0.01660  159 THR   A O   
2131 C CB  . THR   A 155 ? 0.11690 0.30730 0.21230 0.02490  0.01040  0.02370  159 THR   A CB  
2132 O OG1 . THR   A 155 ? 0.14510 0.30840 0.20910 0.04540  0.01080  0.02680  159 THR   A OG1 
2133 C CG2 . THR   A 155 ? 0.14040 0.32370 0.21320 0.04670  0.01980  0.01400  159 THR   A CG2 
2141 N N   . PHE   A 156 ? 0.09510 0.26720 0.22400 0.01030  0.01030  0.01380  160 PHE   A N   
2142 C CA  . PHE   A 156 ? 0.10640 0.26150 0.20140 0.00870  0.00990  0.01060  160 PHE   A CA  
2143 C C   . PHE   A 156 ? 0.11220 0.26310 0.20100 0.00720  0.02710  0.00020  160 PHE   A C   
2144 O O   . PHE   A 156 ? 0.12450 0.26460 0.20290 -0.00050 0.03060  -0.00550 160 PHE   A O   
2145 C CB  . PHE   A 156 ? 0.13100 0.25730 0.20300 -0.00350 0.01730  0.00060  160 PHE   A CB  
2146 C CG  . PHE   A 156 ? 0.11740 0.25620 0.19450 -0.00610 -0.00330 0.00200  160 PHE   A CG  
2147 C CD1 . PHE   A 156 ? 0.13880 0.25490 0.18610 -0.00250 -0.00120 0.00670  160 PHE   A CD1 
2148 C CD2 . PHE   A 156 ? 0.11500 0.26710 0.20520 -0.00240 -0.00660 -0.00650 160 PHE   A CD2 
2149 C CE1 . PHE   A 156 ? 0.13090 0.26170 0.20040 -0.00580 -0.00050 -0.00200 160 PHE   A CE1 
2150 C CE2 . PHE   A 156 ? 0.12760 0.27670 0.20800 -0.00760 -0.00950 0.01160  160 PHE   A CE2 
2151 C CZ  . PHE   A 156 ? 0.12210 0.27040 0.20360 -0.00270 -0.00870 0.01480  160 PHE   A CZ  
2161 N N   . ARG   A 157 ? 0.11810 0.26740 0.20110 -0.00820 0.01150  0.00070  161 ARG   A N   
2162 C CA  . ARG   A 157 ? 0.12850 0.25290 0.19760 -0.00680 0.01720  0.00920  161 ARG   A CA  
2163 C C   . ARG   A 157 ? 0.12130 0.22580 0.18710 -0.00460 0.01580  -0.01650 161 ARG   A C   
2164 O O   . ARG   A 157 ? 0.13830 0.23580 0.19650 0.02710  0.02130  -0.01160 161 ARG   A O   
2165 C CB  . ARG   A 157 ? 0.12450 0.25710 0.21770 -0.01460 0.00740  0.02820  161 ARG   A CB  
2166 C CG  . ARG   A 157 ? 0.11310 0.26170 0.20840 -0.01890 0.00380  0.02790  161 ARG   A CG  
2167 C CD  . ARG   A 157 ? 0.11900 0.27590 0.20930 0.00360  -0.00450 0.02530  161 ARG   A CD  
2168 N NE  . ARG   A 157 ? 0.10500 0.28860 0.20880 -0.00460 0.00210  0.00680  161 ARG   A NE  
2169 C CZ  . ARG   A 157 ? 0.12540 0.31110 0.21130 -0.01280 -0.00380 0.00560  161 ARG   A CZ  
2170 N NH1 . ARG   A 157 ? 0.13590 0.33810 0.21130 0.00460  -0.00980 -0.00390 161 ARG   A NH1 
2171 N NH2 . ARG   A 157 ? 0.11530 0.32190 0.22550 -0.00500 0.00320  0.02940  161 ARG   A NH2 
2185 N N   . LEU   A 158 ? 0.12390 0.21180 0.20500 -0.01310 0.00480  -0.00620 162 LEU   A N   
2186 C CA  . LEU   A 158 ? 0.11450 0.23730 0.20210 -0.00050 0.00320  0.00610  162 LEU   A CA  
2187 C C   . LEU   A 158 ? 0.13330 0.24050 0.21490 0.00150  0.00850  0.01400  162 LEU   A C   
2188 O O   . LEU   A 158 ? 0.13480 0.24490 0.21580 0.00990  0.01390  0.02090  162 LEU   A O   
2189 C CB  . LEU   A 158 ? 0.12440 0.23730 0.19520 -0.01100 -0.00030 0.00510  162 LEU   A CB  
2190 C CG  . LEU   A 158 ? 0.13580 0.25070 0.20250 -0.03030 0.00710  -0.00850 162 LEU   A CG  
2191 C CD1 . LEU   A 158 ? 0.14150 0.25900 0.20830 0.00180  -0.00100 -0.00980 162 LEU   A CD1 
2192 C CD2 . LEU   A 158 ? 0.14620 0.27370 0.22390 -0.03450 -0.01390 -0.00570 162 LEU   A CD2 
2204 N N   . ASP   A 159 ? 0.10660 0.24660 0.20030 -0.00310 0.01510  0.01610  163 ASP   A N   
2205 C CA  . ASP   A 159 ? 0.11910 0.25410 0.20210 -0.01300 0.01480  0.01630  163 ASP   A CA  
2206 C C   . ASP   A 159 ? 0.12950 0.27540 0.19560 -0.01150 0.00800  0.00860  163 ASP   A C   
2207 O O   . ASP   A 159 ? 0.15930 0.30800 0.20390 0.00760  0.02310  0.02190  163 ASP   A O   
2208 C CB  . ASP   A 159 ? 0.11470 0.25800 0.21190 -0.02040 0.02910  0.01100  163 ASP   A CB  
2209 C CG  . ASP   A 159 ? 0.12490 0.28200 0.21690 -0.00810 0.02060  0.00170  163 ASP   A CG  
2210 O OD1 . ASP   A 159 ? 0.11770 0.27690 0.19360 -0.01560 -0.00400 -0.01000 163 ASP   A OD1 
2211 O OD2 . ASP   A 159 ? 0.13390 0.31540 0.20810 0.02210  0.00870  0.01910  163 ASP   A OD2 
2216 N N   . ARG   A 160 ? 0.12770 0.27090 0.18610 -0.00390 0.01110  0.00420  164 ARG   A N   
2217 C CA  . ARG   A 160 ? 0.13100 0.27760 0.18770 -0.00890 0.01450  -0.00450 164 ARG   A CA  
2218 C C   . ARG   A 160 ? 0.13470 0.27730 0.19510 -0.00910 -0.00050 0.00500  164 ARG   A C   
2219 O O   . ARG   A 160 ? 0.15450 0.26480 0.20340 0.01120  -0.00620 -0.01430 164 ARG   A O   
2220 C CB  . ARG   A 160 ? 0.14590 0.28890 0.19910 -0.02760 0.01580  -0.01170 164 ARG   A CB  
2221 C CG  . ARG   A 160 ? 0.15000 0.28610 0.16550 -0.02170 0.01150  -0.00350 164 ARG   A CG  
2222 C CD  . ARG   A 160 ? 0.14020 0.27590 0.19040 -0.03470 -0.00480 0.00510  164 ARG   A CD  
2223 N NE  . ARG   A 160 ? 0.13680 0.28330 0.18650 -0.02110 0.01630  0.01040  164 ARG   A NE  
2224 C CZ  . ARG   A 160 ? 0.13800 0.28520 0.19590 -0.02190 0.00360  -0.00260 164 ARG   A CZ  
2225 N NH1 . ARG   A 160 ? 0.14040 0.29920 0.21330 -0.02420 0.00860  0.00600  164 ARG   A NH1 
2226 N NH2 . ARG   A 160 ? 0.12090 0.28180 0.19080 -0.01860 0.01060  -0.00820 164 ARG   A NH2 
2240 N N   . TRP   A 161 ? 0.14010 0.30180 0.19880 -0.00050 -0.02060 0.01450  165 TRP   A N   
2241 C CA  . TRP   A 161 ? 0.16440 0.30800 0.18440 -0.00690 -0.02070 0.01600  165 TRP   A CA  
2242 C C   . TRP   A 161 ? 0.14420 0.30620 0.18000 -0.01580 -0.02630 -0.00150 165 TRP   A C   
2243 O O   . TRP   A 161 ? 0.14050 0.32020 0.19710 -0.00200 -0.01130 -0.00810 165 TRP   A O   
2244 C CB  . TRP   A 161 ? 0.17640 0.31690 0.20130 0.00820  -0.03900 0.01330  165 TRP   A CB  
2245 C CG  . TRP   A 161 ? 0.17760 0.33770 0.22190 0.00960  -0.00220 -0.00840 165 TRP   A CG  
2246 C CD1 . TRP   A 161 ? 0.17400 0.33870 0.23560 0.02320  0.00310  -0.02840 165 TRP   A CD1 
2247 C CD2 . TRP   A 161 ? 0.17560 0.33720 0.20610 0.01440  0.00720  -0.02180 165 TRP   A CD2 
2248 N NE1 . TRP   A 161 ? 0.17770 0.34140 0.23430 0.02500  0.01330  -0.03320 165 TRP   A NE1 
2249 C CE2 . TRP   A 161 ? 0.17270 0.33610 0.22060 0.02160  -0.00570 -0.02940 165 TRP   A CE2 
2250 C CE3 . TRP   A 161 ? 0.19210 0.34660 0.20500 0.00750  0.01720  -0.02800 165 TRP   A CE3 
2251 C CZ2 . TRP   A 161 ? 0.18490 0.34310 0.22900 0.01920  -0.00410 -0.03850 165 TRP   A CZ2 
2252 C CZ3 . TRP   A 161 ? 0.20500 0.35510 0.21210 -0.00430 0.00160  -0.02100 165 TRP   A CZ3 
2253 C CH2 . TRP   A 161 ? 0.20930 0.34860 0.22450 0.00860  -0.00670 -0.03160 165 TRP   A CH2 
2264 N N   . GLU   A 162 ? 0.15920 0.30190 0.19020 -0.01960 -0.01760 -0.00800 166 GLU   A N   
2265 C CA  . GLU   A 162 ? 0.13890 0.29190 0.20060 -0.01430 -0.01760 -0.00050 166 GLU   A CA  
2266 C C   . GLU   A 162 ? 0.17400 0.30710 0.21980 -0.02770 -0.02210 0.00410  166 GLU   A C   
2267 O O   . GLU   A 162 ? 0.19430 0.32910 0.20320 -0.04090 -0.00790 0.00430  166 GLU   A O   
2268 C CB  . GLU   A 162 ? 0.13280 0.28310 0.21260 -0.02150 0.00630  0.00030  166 GLU   A CB  
2269 C CG  . GLU   A 162 ? 0.13420 0.28370 0.22980 -0.02150 -0.00500 0.01300  166 GLU   A CG  
2270 C CD  . GLU   A 162 ? 0.12280 0.28710 0.22210 -0.02840 -0.00670 0.01730  166 GLU   A CD  
2271 O OE1 . GLU   A 162 ? 0.13890 0.28390 0.19670 -0.02660 -0.00090 0.01130  166 GLU   A OE1 
2272 O OE2 . GLU   A 162 ? 0.12670 0.30090 0.20880 -0.03830 -0.01170 0.01160  166 GLU   A OE2 
2279 N N   . LEU   A 163 ? 0.16810 0.28710 0.19240 -0.02010 -0.02190 0.00360  167 LEU   A N   
2280 C CA  . LEU   A 163 ? 0.16750 0.28660 0.22290 -0.01350 -0.02600 0.01010  167 LEU   A CA  
2281 C C   . LEU   A 163 ? 0.13720 0.28370 0.20490 -0.02750 -0.01490 0.00440  167 LEU   A C   
2282 O O   . LEU   A 163 ? 0.14560 0.29040 0.19840 -0.01710 -0.00500 0.00200  167 LEU   A O   
2283 C CB  . LEU   A 163 ? 0.19760 0.31290 0.27180 -0.00840 -0.05990 -0.00070 167 LEU   A CB  
2284 C CG  . LEU   A 163 ? 0.23590 0.33260 0.31830 0.00570  -0.04200 0.02410  167 LEU   A CG  
2285 C CD1 . LEU   A 163 ? 0.26470 0.33360 0.34300 0.00870  -0.03550 0.03450  167 LEU   A CD1 
2286 C CD2 . LEU   A 163 ? 0.22480 0.35230 0.26620 -0.02120 -0.03850 0.02590  167 LEU   A CD2 
2298 N N   . GLU   A 164 ? 0.13590 0.29220 0.21730 -0.01380 -0.00590 0.01210  168 GLU   A N   
2299 C CA  . GLU   A 164 ? 0.14090 0.30080 0.21380 -0.02660 0.02030  0.01800  168 GLU   A CA  
2300 C C   . GLU   A 164 ? 0.10130 0.28290 0.21690 -0.03040 0.00100  0.00930  168 GLU   A C   
2301 O O   . GLU   A 164 ? 0.13250 0.27230 0.21420 -0.02110 -0.01070 0.00100  168 GLU   A O   
2302 C CB  . GLU   A 164 ? 0.15520 0.34210 0.23320 -0.00990 0.03270  0.02010  168 GLU   A CB  
2303 C CG  . GLU   A 164 ? 0.19300 0.37490 0.24800 -0.01460 0.03420  0.03350  168 GLU   A CG  
2304 C CD  . GLU   A 164 ? 0.25690 0.40860 0.27030 -0.02770 0.03330  0.06210  168 GLU   A CD  
2305 O OE1 . GLU   A 164 ? 0.25630 0.42910 0.27220 -0.03020 0.04690  0.03860  168 GLU   A OE1 
2306 O OE2 . GLU   A 164 ? 0.26240 0.40280 0.25890 -0.03330 0.01080  0.10100  168 GLU   A OE2 
2313 N N   . LEU   A 165 ? 0.12230 0.28640 0.21180 -0.02020 0.00600  0.01290  169 LEU   A N   
2314 C CA  . LEU   A 165 ? 0.11280 0.27360 0.18460 -0.01350 0.00130  0.02030  169 LEU   A CA  
2315 C C   . LEU   A 165 ? 0.12440 0.27340 0.19570 -0.01160 -0.00750 0.00820  169 LEU   A C   
2316 O O   . LEU   A 165 ? 0.15030 0.28160 0.19500 -0.00710 -0.00420 0.01080  169 LEU   A O   
2317 C CB  . LEU   A 165 ? 0.09210 0.26670 0.19840 -0.01540 0.00930  0.00190  169 LEU   A CB  
2318 C CG  . LEU   A 165 ? 0.11830 0.25530 0.19860 -0.00510 0.00030  -0.00990 169 LEU   A CG  
2319 C CD1 . LEU   A 165 ? 0.11180 0.26250 0.23280 0.00370  -0.00980 -0.02240 169 LEU   A CD1 
2320 C CD2 . LEU   A 165 ? 0.13380 0.25700 0.18230 -0.00750 -0.00650 0.01880  169 LEU   A CD2 
2332 N N   . ASN   A 166 ? 0.10750 0.26490 0.19430 -0.02450 -0.00530 0.00720  170 ASN   A N   
2333 C CA  . ASN   A 166 ? 0.12830 0.26870 0.19410 -0.01640 -0.02650 -0.00620 170 ASN   A CA  
2334 C C   . ASN   A 166 ? 0.12180 0.26530 0.20670 -0.01190 0.00230  0.00180  170 ASN   A C   
2335 O O   . ASN   A 166 ? 0.12890 0.27110 0.22660 -0.01380 0.00010  -0.02600 170 ASN   A O   
2336 C CB  . ASN   A 166 ? 0.12220 0.27520 0.20150 -0.04180 -0.01780 0.00600  170 ASN   A CB  
2337 C CG  . ASN   A 166 ? 0.12970 0.29200 0.20330 -0.04090 0.00410  0.00960  170 ASN   A CG  
2338 O OD1 . ASN   A 166 ? 0.14340 0.28950 0.21180 -0.04000 -0.00500 0.00660  170 ASN   A OD1 
2339 N ND2 . ASN   A 166 ? 0.14560 0.32040 0.20090 -0.03360 -0.00620 -0.00620 170 ASN   A ND2 
2346 N N   . SER   A 167 ? 0.10120 0.25110 0.21620 -0.01200 0.00540  0.00870  171 SER   A N   
2347 C CA  . SER   A 167 ? 0.09890 0.24210 0.22390 -0.03420 0.00810  0.02450  171 SER   A CA  
2348 C C   . SER   A 167 ? 0.09900 0.24810 0.22870 -0.02280 0.02570  0.02220  171 SER   A C   
2349 O O   . SER   A 167 ? 0.11680 0.23730 0.24590 -0.01050 0.00380  0.01700  171 SER   A O   
2350 C CB  . SER   A 167 ? 0.12740 0.24360 0.22780 -0.02450 -0.00030 0.01850  171 SER   A CB  
2351 O OG  . SER   A 167 ? 0.12800 0.24700 0.21260 -0.01510 -0.00120 0.00760  171 SER   A OG  
2357 N N   . ALA   A 168 ? 0.10980 0.25930 0.20570 -0.02200 0.01290  0.01430  172 ALA   A N   
2358 C CA  . ALA   A 168 ? 0.10920 0.24200 0.19410 -0.02310 0.01700  0.00370  172 ALA   A CA  
2359 C C   . ALA   A 168 ? 0.11500 0.23200 0.21140 -0.00080 -0.00190 -0.01360 172 ALA   A C   
2360 O O   . ALA   A 168 ? 0.12430 0.24920 0.19300 -0.02030 -0.00180 -0.01670 172 ALA   A O   
2361 C CB  . ALA   A 168 ? 0.10730 0.25220 0.19130 -0.03320 0.01050  0.00530  172 ALA   A CB  
2367 N N   . ILE   A 169 ? 0.10350 0.22880 0.21880 0.00520  0.00450  0.00040  173 ILE   A N   
2368 C CA  . ILE   A 169 ? 0.12680 0.23350 0.21100 -0.02170 0.01550  -0.00450 173 ILE   A CA  
2369 C C   . ILE   A 169 ? 0.11190 0.23250 0.20140 -0.01030 -0.00780 0.01460  173 ILE   A C   
2370 O O   . ILE   A 169 ? 0.12600 0.24300 0.20520 -0.00840 -0.01030 0.00580  173 ILE   A O   
2371 C CB  . ILE   A 169 ? 0.12390 0.24900 0.20950 -0.03530 0.01570  -0.02180 173 ILE   A CB  
2372 C CG1 . ILE   A 169 ? 0.15520 0.27520 0.21730 -0.03480 0.00900  -0.00790 173 ILE   A CG1 
2373 C CG2 . ILE   A 169 ? 0.12060 0.25340 0.23380 -0.03390 0.01750  -0.02260 173 ILE   A CG2 
2374 C CD1 . ILE   A 169 ? 0.17480 0.29480 0.25350 -0.01070 0.00340  0.00020  173 ILE   A CD1 
2386 N N   . PRO   A 170 ? 0.12720 0.23130 0.19480 -0.01180 0.00270  0.02470  174 PRO   A N   
2387 C CA  . PRO   A 170 ? 0.13650 0.23020 0.21180 -0.02010 -0.01030 -0.00520 174 PRO   A CA  
2388 C C   . PRO   A 170 ? 0.12720 0.22540 0.22370 -0.02570 -0.00670 -0.00050 174 PRO   A C   
2389 O O   . PRO   A 170 ? 0.12410 0.22450 0.23800 -0.02550 -0.01880 -0.00040 174 PRO   A O   
2390 C CB  . PRO   A 170 ? 0.12930 0.23180 0.23020 0.00540  -0.01370 -0.02500 174 PRO   A CB  
2391 C CG  . PRO   A 170 ? 0.13500 0.23880 0.22640 0.00940  -0.00180 -0.00390 174 PRO   A CG  
2392 C CD  . PRO   A 170 ? 0.13460 0.23950 0.20530 -0.00670 0.00160  0.02090  174 PRO   A CD  
2400 N N   . GLY   A 171 ? 0.13690 0.22600 0.22310 -0.01330 -0.00950 -0.00340 175 GLY   A N   
2401 C CA  . GLY   A 171 ? 0.14090 0.22150 0.21300 0.00100  -0.04240 -0.01600 175 GLY   A CA  
2402 C C   . GLY   A 171 ? 0.15130 0.24230 0.25300 -0.00160 -0.02990 -0.01380 175 GLY   A C   
2403 O O   . GLY   A 171 ? 0.17580 0.25690 0.27240 0.02750  -0.04480 -0.01790 175 GLY   A O   
2407 N N   . ASP   A 172 ? 0.12380 0.25230 0.22560 -0.01640 -0.02740 -0.00210 176 ASP   A N   
2408 C CA  . ASP   A 172 ? 0.11570 0.24970 0.22650 -0.00470 0.00070  -0.00860 176 ASP   A CA  
2409 C C   . ASP   A 172 ? 0.11680 0.25010 0.21650 -0.00540 0.00110  -0.01910 176 ASP   A C   
2410 O O   . ASP   A 172 ? 0.11030 0.26390 0.24230 -0.00310 0.00490  -0.00260 176 ASP   A O   
2411 C CB  . ASP   A 172 ? 0.11790 0.25950 0.22870 0.00100  0.01420  -0.00490 176 ASP   A CB  
2412 C CG  . ASP   A 172 ? 0.10860 0.24720 0.22210 0.01350  0.00810  0.00530  176 ASP   A CG  
2413 O OD1 . ASP   A 172 ? 0.15110 0.22690 0.25300 -0.01160 0.04130  0.01340  176 ASP   A OD1 
2414 O OD2 . ASP   A 172 ? 0.15540 0.28490 0.21380 0.01280  0.00120  -0.01010 176 ASP   A OD2 
2419 N N   . ALA   A 173 ? 0.09560 0.24530 0.23930 -0.01070 -0.00020 -0.00740 177 ALA   A N   
2420 C CA  . ALA   A 173 ? 0.12260 0.24140 0.23750 -0.01030 0.00730  -0.00780 177 ALA   A CA  
2421 C C   . ALA   A 173 ? 0.11350 0.24570 0.22840 -0.01250 0.00390  -0.00410 177 ALA   A C   
2422 O O   . ALA   A 173 ? 0.13040 0.25630 0.21220 -0.02880 0.00770  -0.00390 177 ALA   A O   
2423 C CB  . ALA   A 173 ? 0.14580 0.23660 0.24270 -0.00270 -0.01800 -0.00610 177 ALA   A CB  
2429 N N   . ARG   A 174 ? 0.10760 0.24810 0.23190 -0.02060 0.00890  -0.00480 178 ARG   A N   
2430 C CA  . ARG   A 174 ? 0.11380 0.24630 0.20250 -0.01750 0.01000  -0.03090 178 ARG   A CA  
2431 C C   . ARG   A 174 ? 0.10920 0.24690 0.20080 -0.00730 0.01380  -0.00560 178 ARG   A C   
2432 O O   . ARG   A 174 ? 0.10190 0.26620 0.18800 -0.00250 0.01370  0.00350  178 ARG   A O   
2433 C CB  . ARG   A 174 ? 0.13430 0.26050 0.20090 -0.01970 0.03650  -0.03830 178 ARG   A CB  
2434 C CG  . ARG   A 174 ? 0.13740 0.26070 0.22120 -0.02050 0.04930  -0.03540 178 ARG   A CG  
2435 C CD  . ARG   A 174 ? 0.15710 0.28460 0.20610 -0.02880 0.04000  -0.05490 178 ARG   A CD  
2436 N NE  . ARG   A 174 ? 0.15290 0.29460 0.21930 -0.04400 0.03310  -0.04800 178 ARG   A NE  
2437 C CZ  . ARG   A 174 ? 0.15490 0.31390 0.22790 -0.03990 0.03760  -0.04140 178 ARG   A CZ  
2438 N NH1 . ARG   A 174 ? 0.16890 0.34340 0.22430 -0.03780 0.04300  -0.02060 178 ARG   A NH1 
2439 N NH2 . ARG   A 174 ? 0.15920 0.30440 0.21910 -0.03230 0.03010  -0.03990 178 ARG   A NH2 
2453 N N   . ASP   A 175 ? 0.10920 0.23870 0.19650 -0.01010 0.00270  0.00040  179 ASP   A N   
2454 C CA  . ASP   A 175 ? 0.10090 0.24250 0.16060 -0.00720 0.00350  0.00400  179 ASP   A CA  
2455 C C   . ASP   A 175 ? 0.10520 0.22920 0.18380 0.00600  0.01080  -0.00710 179 ASP   A C   
2456 O O   . ASP   A 175 ? 0.10640 0.20650 0.18260 0.00790  -0.00750 -0.00810 179 ASP   A O   
2457 C CB  . ASP   A 175 ? 0.10660 0.25380 0.18230 -0.01200 0.02910  0.00800  179 ASP   A CB  
2458 C CG  . ASP   A 175 ? 0.12170 0.25870 0.18500 -0.01660 0.00680  -0.00120 179 ASP   A CG  
2459 O OD1 . ASP   A 175 ? 0.11550 0.26040 0.19210 -0.01330 0.02470  -0.00750 179 ASP   A OD1 
2460 O OD2 . ASP   A 175 ? 0.15380 0.27060 0.19610 -0.01880 0.03200  0.00950  179 ASP   A OD2 
2465 N N   . THR   A 176 ? 0.11070 0.24840 0.17120 0.00530  -0.00430 -0.01110 180 THR   A N   
2466 C CA  . THR   A 176 ? 0.12200 0.24960 0.17560 -0.00270 -0.00000 -0.01720 180 THR   A CA  
2467 C C   . THR   A 176 ? 0.10870 0.24260 0.18000 -0.00110 -0.00050 -0.01730 180 THR   A C   
2468 O O   . THR   A 176 ? 0.12280 0.23660 0.17510 -0.00820 0.00760  -0.00380 180 THR   A O   
2469 C CB  . THR   A 176 ? 0.12510 0.26780 0.18890 0.00080  0.01420  -0.00480 180 THR   A CB  
2470 O OG1 . THR   A 176 ? 0.11530 0.27570 0.19660 0.00090  -0.00440 0.00640  180 THR   A OG1 
2471 C CG2 . THR   A 176 ? 0.11670 0.27360 0.20550 -0.00400 0.01510  -0.02510 180 THR   A CG2 
2479 N N   . SER   A 177 ? 0.09150 0.24930 0.19070 0.00520  0.01480  0.00890  181 SER   A N   
2480 C CA  . SER   A 177 ? 0.13130 0.24700 0.19210 -0.00670 0.00620  0.00720  181 SER   A CA  
2481 C C   . SER   A 177 ? 0.11050 0.25530 0.17400 0.01150  0.01070  0.01000  181 SER   A C   
2482 O O   . SER   A 177 ? 0.16020 0.26140 0.17330 0.01260  -0.01140 0.00510  181 SER   A O   
2483 C CB  . SER   A 177 ? 0.13490 0.22060 0.20300 -0.02240 0.02180  0.00730  181 SER   A CB  
2484 O OG  . SER   A 177 ? 0.14200 0.22800 0.20100 -0.02260 0.00340  0.01340  181 SER   A OG  
2490 N N   . SER   A 178 ? 0.10300 0.26190 0.18310 0.00230  0.01930  0.01430  182 SER   A N   
2491 C CA  . SER   A 178 ? 0.10640 0.26050 0.17370 -0.00680 0.01120  0.02310  182 SER   A CA  
2492 C C   . SER   A 178 ? 0.11030 0.26100 0.18220 -0.00760 0.00370  0.01390  182 SER   A C   
2493 O O   . SER   A 178 ? 0.11780 0.27320 0.18980 -0.00580 0.00550  -0.00880 182 SER   A O   
2494 C CB  . SER   A 178 ? 0.11170 0.24140 0.20130 0.00190  0.00520  0.03590  182 SER   A CB  
2495 O OG  . SER   A 178 ? 0.11770 0.25120 0.19300 -0.01580 0.00140  0.02470  182 SER   A OG  
2501 N N   . PRO   A 179 ? 0.09590 0.25580 0.17710 -0.00670 -0.00160 0.01210  183 PRO   A N   
2502 C CA  . PRO   A 179 ? 0.09690 0.27720 0.18390 0.00230  -0.00050 0.01760  183 PRO   A CA  
2503 C C   . PRO   A 179 ? 0.11860 0.28540 0.17610 0.00250  0.00970  0.01090  183 PRO   A C   
2504 O O   . PRO   A 179 ? 0.10340 0.29910 0.19700 0.00440  0.00180  -0.00030 183 PRO   A O   
2505 C CB  . PRO   A 179 ? 0.11020 0.28510 0.20470 -0.00260 0.02370  0.01630  183 PRO   A CB  
2506 C CG  . PRO   A 179 ? 0.11250 0.27250 0.19810 -0.00160 0.00350  0.01210  183 PRO   A CG  
2507 C CD  . PRO   A 179 ? 0.10080 0.25900 0.20590 0.00190  -0.01840 -0.00410 183 PRO   A CD  
2515 N N   . ARG   A 180 ? 0.10330 0.28260 0.17480 -0.00050 0.00440  0.01120  184 ARG   A N   
2516 C CA  . ARG   A 180 ? 0.10980 0.27170 0.19680 0.00920  0.00190  0.02450  184 ARG   A CA  
2517 C C   . ARG   A 180 ? 0.11600 0.26340 0.18850 -0.00470 0.01660  0.01970  184 ARG   A C   
2518 O O   . ARG   A 180 ? 0.11630 0.26870 0.21290 -0.00110 0.00230  0.01100  184 ARG   A O   
2519 C CB  . ARG   A 180 ? 0.12030 0.27490 0.20690 0.00840  -0.01550 0.03940  184 ARG   A CB  
2520 C CG  . ARG   A 180 ? 0.13810 0.28340 0.19150 -0.00470 -0.02430 0.05000  184 ARG   A CG  
2521 C CD  . ARG   A 180 ? 0.17040 0.29940 0.19520 -0.00230 -0.03820 0.04020  184 ARG   A CD  
2522 N NE  . ARG   A 180 ? 0.22690 0.31070 0.21370 0.01340  -0.04210 0.04390  184 ARG   A NE  
2523 C CZ  . ARG   A 180 ? 0.29420 0.31100 0.25470 0.01300  -0.07000 0.04680  184 ARG   A CZ  
2524 N NH1 . ARG   A 180 ? 0.29680 0.31680 0.27520 -0.00600 -0.07340 0.03340  184 ARG   A NH1 
2525 N NH2 . ARG   A 180 ? 0.33270 0.31660 0.29910 0.01540  -0.09890 0.04880  184 ARG   A NH2 
2539 N N   . ALA   A 181 ? 0.11490 0.25790 0.21070 -0.00060 0.00200  0.00880  185 ALA   A N   
2540 C CA  . ALA   A 181 ? 0.11450 0.25760 0.20140 -0.00490 -0.00720 -0.00060 185 ALA   A CA  
2541 C C   . ALA   A 181 ? 0.10650 0.25140 0.19670 -0.00180 -0.01440 0.00110  185 ALA   A C   
2542 O O   . ALA   A 181 ? 0.11880 0.25550 0.20370 -0.00720 -0.00270 -0.00030 185 ALA   A O   
2543 C CB  . ALA   A 181 ? 0.10410 0.25950 0.19730 0.00360  0.00810  -0.01440 185 ALA   A CB  
2549 N N   . VAL   A 182 ? 0.10340 0.25980 0.20650 -0.00540 -0.00840 0.02160  186 VAL   A N   
2550 C CA  . VAL   A 182 ? 0.10810 0.25580 0.19780 -0.00400 -0.00340 0.02660  186 VAL   A CA  
2551 C C   . VAL   A 182 ? 0.10220 0.26300 0.18770 -0.01690 -0.00040 0.02050  186 VAL   A C   
2552 O O   . VAL   A 182 ? 0.10240 0.26650 0.20860 -0.01510 -0.00510 0.01750  186 VAL   A O   
2553 C CB  . VAL   A 182 ? 0.10360 0.24060 0.19610 0.00480  -0.00270 0.03080  186 VAL   A CB  
2554 C CG1 . VAL   A 182 ? 0.11010 0.23610 0.19120 0.00160  -0.02380 -0.00000 186 VAL   A CG1 
2555 C CG2 . VAL   A 182 ? 0.11950 0.24360 0.17700 -0.01750 0.00500  0.01600  186 VAL   A CG2 
2565 N N   . THR   A 183 ? 0.12470 0.26980 0.18100 -0.00350 0.01040  0.03260  187 THR   A N   
2566 C CA  . THR   A 183 ? 0.10210 0.27880 0.20060 0.00710  0.02370  0.02330  187 THR   A CA  
2567 C C   . THR   A 183 ? 0.11830 0.28750 0.21380 -0.00260 0.00540  0.04920  187 THR   A C   
2568 O O   . THR   A 183 ? 0.12950 0.29240 0.20580 -0.02240 0.00120  0.04230  187 THR   A O   
2569 C CB  . THR   A 183 ? 0.10630 0.28920 0.20960 -0.00080 0.02270  0.00690  187 THR   A CB  
2570 O OG1 . THR   A 183 ? 0.14760 0.30200 0.22620 0.01640  0.00900  0.02530  187 THR   A OG1 
2571 C CG2 . THR   A 183 ? 0.13060 0.30680 0.24880 -0.01730 0.01500  0.00170  187 THR   A CG2 
2579 N N   . GLU   A 184 ? 0.10830 0.28690 0.21970 0.00140  -0.01250 0.04970  188 GLU   A N   
2580 C CA  . GLU   A 184 ? 0.12670 0.27670 0.22260 0.00350  -0.00940 0.03890  188 GLU   A CA  
2581 C C   . GLU   A 184 ? 0.12690 0.25570 0.20830 -0.01120 -0.01160 0.02340  188 GLU   A C   
2582 O O   . GLU   A 184 ? 0.14700 0.26270 0.21980 -0.03800 0.00730  0.00700  188 GLU   A O   
2583 C CB  . GLU   A 184 ? 0.13130 0.28790 0.22910 0.00930  -0.02260 0.03840  188 GLU   A CB  
2584 C CG  . GLU   A 184 ? 0.13190 0.30450 0.22730 -0.00630 -0.02080 0.04570  188 GLU   A CG  
2585 C CD  . GLU   A 184 ? 0.16360 0.33590 0.23160 -0.00580 -0.01760 0.01690  188 GLU   A CD  
2586 O OE1 . GLU   A 184 ? 0.14280 0.35360 0.23680 -0.02270 -0.01110 0.01080  188 GLU   A OE1 
2587 O OE2 . GLU   A 184 ? 0.17920 0.34380 0.24860 0.02510  -0.03920 0.02850  188 GLU   A OE2 
2594 N N   . SER   A 185 ? 0.12650 0.24810 0.22150 -0.00730 -0.00280 0.01680  189 SER   A N   
2595 C CA  . SER   A 185 ? 0.11920 0.25510 0.20430 -0.00500 -0.00490 0.00580  189 SER   A CA  
2596 C C   . SER   A 185 ? 0.12740 0.25810 0.22140 -0.00350 0.01440  0.01880  189 SER   A C   
2597 O O   . SER   A 185 ? 0.12600 0.26780 0.23860 -0.01420 -0.00490 0.00540  189 SER   A O   
2598 C CB  . SER   A 185 ? 0.11490 0.26170 0.18930 -0.01190 0.00110  0.01740  189 SER   A CB  
2599 O OG  . SER   A 185 ? 0.11440 0.25240 0.21850 -0.00830 0.00300  0.01050  189 SER   A OG  
2605 N N   . LEU   A 186 ? 0.09820 0.25520 0.23110 -0.01990 0.00510  0.02080  190 LEU   A N   
2606 C CA  . LEU   A 186 ? 0.10850 0.26710 0.23780 -0.01210 -0.00690 0.02300  190 LEU   A CA  
2607 C C   . LEU   A 186 ? 0.12000 0.26940 0.23090 -0.01590 -0.00150 0.02910  190 LEU   A C   
2608 O O   . LEU   A 186 ? 0.11730 0.27570 0.24420 -0.02800 -0.01180 0.02110  190 LEU   A O   
2609 C CB  . LEU   A 186 ? 0.11320 0.27220 0.24090 -0.00790 0.00510  0.02220  190 LEU   A CB  
2610 C CG  . LEU   A 186 ? 0.11050 0.27060 0.26700 0.00950  -0.00190 0.02550  190 LEU   A CG  
2611 C CD1 . LEU   A 186 ? 0.12590 0.27180 0.27940 0.00600  -0.02970 0.00590  190 LEU   A CD1 
2612 C CD2 . LEU   A 186 ? 0.13210 0.27580 0.26590 -0.00380 -0.01860 0.03250  190 LEU   A CD2 
2624 N N   A GLN   A 187 ? 0.11960 0.27370 0.23080 -0.01550 0.00050  0.03190  191 GLN   A N   
2625 N N   B GLN   A 187 ? 0.12680 0.27010 0.23290 -0.01550 -0.00230 0.03360  191 GLN   A N   
2626 N N   C GLN   A 187 ? 0.11010 0.27140 0.22900 -0.02060 -0.00800 0.04110  191 GLN   A N   
2627 C CA  A GLN   A 187 ? 0.13160 0.27700 0.23910 -0.01000 0.00570  0.03490  191 GLN   A CA  
2628 C CA  B GLN   A 187 ? 0.14530 0.27010 0.24130 -0.01140 0.00000  0.03810  191 GLN   A CA  
2629 C CA  C GLN   A 187 ? 0.12170 0.27320 0.24380 -0.01370 -0.00890 0.05390  191 GLN   A CA  
2630 C C   A GLN   A 187 ? 0.14290 0.27980 0.24720 -0.01640 0.00910  0.03070  191 GLN   A C   
2631 C C   B GLN   A 187 ? 0.15070 0.27600 0.24810 -0.01680 0.00780  0.03240  191 GLN   A C   
2632 C C   C GLN   A 187 ? 0.13490 0.27920 0.25320 -0.02620 -0.00190 0.03670  191 GLN   A C   
2633 O O   A GLN   A 187 ? 0.13760 0.28040 0.25300 -0.02310 0.01450  0.03510  191 GLN   A O   
2634 O O   B GLN   A 187 ? 0.14750 0.27620 0.25290 -0.02350 0.01390  0.03600  191 GLN   A O   
2635 O O   C GLN   A 187 ? 0.12580 0.28150 0.27120 -0.04540 0.00580  0.04050  191 GLN   A O   
2636 C CB  A GLN   A 187 ? 0.13970 0.27930 0.23840 -0.00460 0.02420  0.03830  191 GLN   A CB  
2637 C CB  B GLN   A 187 ? 0.16400 0.26570 0.24200 -0.00840 0.00820  0.04460  191 GLN   A CB  
2638 C CB  C GLN   A 187 ? 0.13470 0.27310 0.25010 -0.00840 0.01360  0.07580  191 GLN   A CB  
2639 C CG  A GLN   A 187 ? 0.14910 0.28370 0.24350 -0.00440 0.03400  0.02720  191 GLN   A CG  
2640 C CG  B GLN   A 187 ? 0.18230 0.26360 0.24510 -0.00990 0.00540  0.03900  191 GLN   A CG  
2641 C CG  C GLN   A 187 ? 0.15470 0.27730 0.26990 -0.01470 0.01520  0.06880  191 GLN   A CG  
2642 C CD  A GLN   A 187 ? 0.16610 0.28820 0.25820 -0.00400 0.04060  0.01330  191 GLN   A CD  
2643 C CD  B GLN   A 187 ? 0.20590 0.26280 0.25290 -0.01120 0.00480  0.03170  191 GLN   A CD  
2644 C CD  C GLN   A 187 ? 0.17450 0.28330 0.31390 -0.02000 0.01160  0.05520  191 GLN   A CD  
2645 O OE1 A GLN   A 187 ? 0.17810 0.29940 0.26900 -0.00250 0.01920  0.00820  191 GLN   A OE1 
2646 O OE1 B GLN   A 187 ? 0.22430 0.26850 0.26060 -0.01210 0.00190  0.02950  191 GLN   A OE1 
2647 O OE1 C GLN   A 187 ? 0.16740 0.28910 0.31650 -0.01570 0.01550  0.04930  191 GLN   A OE1 
2648 N NE2 A GLN   A 187 ? 0.17920 0.28740 0.27380 -0.00150 0.04690  0.00720  191 GLN   A NE2 
2649 N NE2 B GLN   A 187 ? 0.20500 0.25870 0.25690 -0.00910 0.01180  0.02460  191 GLN   A NE2 
2650 N NE2 C GLN   A 187 ? 0.19250 0.29030 0.33800 -0.02290 -0.01070 0.05240  191 GLN   A NE2 
2675 N N   . LYS   A 188 ? 0.15800 0.28000 0.25490 -0.01280 0.01810  0.02830  192 LYS   A N   
2676 C CA  . LYS   A 188 ? 0.15460 0.26880 0.25350 0.00220  0.01170  0.02380  192 LYS   A CA  
2677 C C   . LYS   A 188 ? 0.15960 0.26620 0.27330 -0.01220 -0.00620 0.01280  192 LYS   A C   
2678 O O   . LYS   A 188 ? 0.17010 0.26470 0.28230 -0.00570 -0.00750 0.01600  192 LYS   A O   
2679 C CB  . LYS   A 188 ? 0.14100 0.28650 0.27500 0.01060  0.01570  0.02190  192 LYS   A CB  
2680 C CG  . LYS   A 188 ? 0.13520 0.28980 0.28120 -0.00730 0.01860  0.01710  192 LYS   A CG  
2681 C CD  . LYS   A 188 ? 0.14520 0.30480 0.30910 -0.01360 0.01270  0.01810  192 LYS   A CD  
2682 C CE  . LYS   A 188 ? 0.14970 0.32160 0.29760 -0.01130 0.01460  0.02430  192 LYS   A CE  
2683 N NZ  . LYS   A 188 ? 0.14390 0.33430 0.29330 -0.00440 -0.00620 0.01580  192 LYS   A NZ  
2699 N N   . LEU   A 189 ? 0.13090 0.26460 0.26920 -0.02870 -0.01090 0.01370  193 LEU   A N   
2700 C CA  . LEU   A 189 ? 0.13600 0.28480 0.27280 -0.03730 -0.00230 0.01490  193 LEU   A CA  
2701 C C   . LEU   A 189 ? 0.13530 0.30830 0.26480 -0.03980 -0.01400 0.00970  193 LEU   A C   
2702 O O   . LEU   A 189 ? 0.16630 0.33350 0.28110 -0.04300 -0.00380 -0.01250 193 LEU   A O   
2703 C CB  . LEU   A 189 ? 0.14070 0.28880 0.27100 -0.03590 -0.00960 0.00340  193 LEU   A CB  
2704 C CG  . LEU   A 189 ? 0.12700 0.29320 0.26420 -0.01790 0.00770  0.00350  193 LEU   A CG  
2705 C CD1 . LEU   A 189 ? 0.13410 0.31100 0.24880 -0.04030 0.01190  -0.00270 193 LEU   A CD1 
2706 C CD2 . LEU   A 189 ? 0.13900 0.29550 0.27840 -0.00460 0.02740  0.01720  193 LEU   A CD2 
2718 N N   . THR   A 190 ? 0.13580 0.30640 0.25010 -0.04490 0.00160  0.02660  194 THR   A N   
2719 C CA  . THR   A 190 ? 0.13980 0.30560 0.23930 -0.05980 0.00630  0.03490  194 THR   A CA  
2720 C C   . THR   A 190 ? 0.15520 0.31460 0.28360 -0.05200 0.00370  0.04270  194 THR   A C   
2721 O O   . THR   A 190 ? 0.17720 0.32530 0.32270 -0.06110 -0.01900 0.05830  194 THR   A O   
2722 C CB  . THR   A 190 ? 0.14470 0.30770 0.23910 -0.04700 0.00460  0.02400  194 THR   A CB  
2723 O OG1 . THR   A 190 ? 0.15210 0.30930 0.24450 -0.04140 0.00110  0.01380  194 THR   A OG1 
2724 C CG2 . THR   A 190 ? 0.14700 0.30480 0.25210 -0.06530 0.00010  0.00410  194 THR   A CG2 
2732 N N   . LEU   A 191 ? 0.16060 0.30810 0.28990 -0.04210 0.00500  0.05540  195 LEU   A N   
2733 C CA  . LEU   A 191 ? 0.17080 0.30990 0.29460 -0.04570 0.00480  0.04470  195 LEU   A CA  
2734 C C   . LEU   A 191 ? 0.18890 0.29940 0.32500 -0.04100 0.00360  0.04720  195 LEU   A C   
2735 O O   . LEU   A 191 ? 0.21710 0.29320 0.36700 -0.04490 0.03250  0.04910  195 LEU   A O   
2736 C CB  . LEU   A 191 ? 0.16490 0.32810 0.28450 -0.04180 0.01470  0.04830  195 LEU   A CB  
2737 C CG  . LEU   A 191 ? 0.18610 0.34100 0.28980 -0.03470 0.01990  0.05370  195 LEU   A CG  
2738 C CD1 . LEU   A 191 ? 0.18970 0.34280 0.28990 -0.02840 0.05050  0.04250  195 LEU   A CD1 
2739 C CD2 . LEU   A 191 ? 0.20250 0.35700 0.29230 -0.03640 0.01140  0.03850  195 LEU   A CD2 
2751 N N   . GLY   A 192 ? 0.19160 0.29410 0.33150 -0.01670 0.01220  0.06640  196 GLY   A N   
2752 C CA  . GLY   A 192 ? 0.19230 0.28440 0.33490 0.00310  0.00140  0.05580  196 GLY   A CA  
2753 C C   . GLY   A 192 ? 0.20540 0.28030 0.34500 -0.02120 0.00590  0.03110  196 GLY   A C   
2754 O O   . GLY   A 192 ? 0.21850 0.30860 0.35860 -0.02220 0.00570  0.00610  196 GLY   A O   
2758 N N   . SER   A 193 ? 0.22190 0.28250 0.34890 -0.01260 0.02270  0.03510  197 SER   A N   
2759 C CA  . SER   A 193 ? 0.26170 0.30840 0.36780 0.00910  -0.01380 0.01330  197 SER   A CA  
2760 C C   . SER   A 193 ? 0.24830 0.31460 0.35340 0.00700  -0.00270 -0.00280 197 SER   A C   
2761 O O   . SER   A 193 ? 0.28430 0.32910 0.33820 0.00750  -0.00540 -0.01210 197 SER   A O   
2762 C CB  . SER   A 193 ? 0.32420 0.33830 0.41630 0.02160  -0.01910 0.02970  197 SER   A CB  
2763 O OG  . SER   A 193 ? 0.36100 0.36070 0.44340 0.04370  -0.03390 0.04810  197 SER   A OG  
2769 N N   . ALA   A 194 ? 0.22830 0.30850 0.32930 0.00240  0.00380  0.01380  198 ALA   A N   
2770 C CA  . ALA   A 194 ? 0.21500 0.32650 0.30100 -0.00370 0.01070  0.00940  198 ALA   A CA  
2771 C C   . ALA   A 194 ? 0.23280 0.34160 0.30320 -0.00540 0.00710  0.01280  198 ALA   A C   
2772 O O   . ALA   A 194 ? 0.25370 0.37310 0.32190 -0.00110 0.00300  0.01270  198 ALA   A O   
2773 C CB  . ALA   A 194 ? 0.21300 0.32990 0.29710 -0.00650 0.01820  0.02510  198 ALA   A CB  
2779 N N   . LEU   A 195 ? 0.23360 0.32040 0.29170 -0.02720 -0.01250 0.01140  199 LEU   A N   
2780 C CA  . LEU   A 195 ? 0.25610 0.32110 0.32320 -0.02290 -0.03640 0.02410  199 LEU   A CA  
2781 C C   . LEU   A 195 ? 0.28340 0.32900 0.34640 -0.03080 -0.03700 0.02570  199 LEU   A C   
2782 O O   . LEU   A 195 ? 0.31700 0.34490 0.33880 -0.04860 -0.01180 0.04420  199 LEU   A O   
2783 C CB  . LEU   A 195 ? 0.24410 0.31670 0.32360 -0.03580 -0.05240 0.02570  199 LEU   A CB  
2784 C CG  . LEU   A 195 ? 0.23580 0.30980 0.28720 -0.04410 -0.05300 0.02300  199 LEU   A CG  
2785 C CD1 . LEU   A 195 ? 0.23660 0.31410 0.27590 -0.04890 -0.03550 0.01640  199 LEU   A CD1 
2786 C CD2 . LEU   A 195 ? 0.24650 0.31180 0.30000 -0.02430 -0.02500 0.02730  199 LEU   A CD2 
2798 N N   . ALA   A 196 ? 0.27880 0.31330 0.38510 -0.04130 -0.05330 0.00700  200 ALA   A N   
2799 C CA  . ALA   A 196 ? 0.27190 0.30340 0.40250 -0.04770 -0.04080 0.01490  200 ALA   A CA  
2800 C C   . ALA   A 196 ? 0.26960 0.29030 0.40900 -0.05650 -0.04070 0.02970  200 ALA   A C   
2801 O O   . ALA   A 196 ? 0.27110 0.28930 0.38390 -0.03890 -0.04100 0.01520  200 ALA   A O   
2802 C CB  . ALA   A 196 ? 0.27770 0.29700 0.40440 -0.04820 -0.02310 0.00060  200 ALA   A CB  
2808 N N   . ALA   A 197 ? 0.27500 0.28640 0.42730 -0.06250 -0.04210 0.05650  201 ALA   A N   
2809 C CA  . ALA   A 197 ? 0.28120 0.28190 0.45250 -0.07650 -0.02210 0.05950  201 ALA   A CA  
2810 C C   . ALA   A 197 ? 0.27400 0.28900 0.44380 -0.08270 -0.04230 0.03530  201 ALA   A C   
2811 O O   . ALA   A 197 ? 0.27330 0.29640 0.41570 -0.08890 -0.02300 0.03710  201 ALA   A O   
2812 C CB  . ALA   A 197 ? 0.27330 0.27820 0.47520 -0.08300 -0.00560 0.06190  201 ALA   A CB  
2818 N N   . PRO   A 198 ? 0.29080 0.29090 0.45810 -0.06650 -0.06080 0.02250  202 PRO   A N   
2819 C CA  . PRO   A 198 ? 0.28910 0.29720 0.44650 -0.06610 -0.05970 0.01120  202 PRO   A CA  
2820 C C   . PRO   A 198 ? 0.27040 0.29650 0.40730 -0.05590 -0.05180 0.00080  202 PRO   A C   
2821 O O   . PRO   A 198 ? 0.24600 0.29680 0.40540 -0.06370 -0.03920 -0.01440 202 PRO   A O   
2822 C CB  . PRO   A 198 ? 0.30370 0.29170 0.43860 -0.05580 -0.08060 0.01540  202 PRO   A CB  
2823 C CG  . PRO   A 198 ? 0.32270 0.29610 0.46520 -0.05770 -0.06790 0.00600  202 PRO   A CG  
2824 C CD  . PRO   A 198 ? 0.29990 0.29280 0.46990 -0.06620 -0.06210 0.01290  202 PRO   A CD  
2832 N N   . GLN   A 199 ? 0.25940 0.29700 0.36660 -0.06270 -0.05410 -0.00270 203 GLN   A N   
2833 C CA  . GLN   A 199 ? 0.24410 0.29490 0.34410 -0.05930 -0.05480 0.00320  203 GLN   A CA  
2834 C C   . GLN   A 199 ? 0.21510 0.28650 0.32000 -0.05950 -0.03030 0.02290  203 GLN   A C   
2835 O O   . GLN   A 199 ? 0.20630 0.27970 0.31700 -0.06740 -0.02580 0.02500  203 GLN   A O   
2836 C CB  . GLN   A 199 ? 0.25270 0.31050 0.33000 -0.03760 -0.06900 -0.00970 203 GLN   A CB  
2837 C CG  . GLN   A 199 ? 0.27770 0.33260 0.33030 -0.03700 -0.07310 -0.00820 203 GLN   A CG  
2838 C CD  . GLN   A 199 ? 0.31980 0.35330 0.35710 -0.04030 -0.08310 0.00600  203 GLN   A CD  
2839 O OE1 . GLN   A 199 ? 0.30190 0.34760 0.37810 -0.05310 -0.06490 0.02180  203 GLN   A OE1 
2840 N NE2 . GLN   A 199 ? 0.37420 0.36910 0.37810 -0.02420 -0.09930 0.01620  203 GLN   A NE2 
2849 N N   A ARG   A 200 ? 0.20920 0.28880 0.32970 -0.05990 -0.03960 0.02570  204 ARG   A N   
2850 N N   B ARG   A 200 ? 0.21260 0.28220 0.31430 -0.05890 -0.03140 0.02740  204 ARG   A N   
2851 C CA  A ARG   A 200 ? 0.20040 0.29090 0.33030 -0.06390 -0.02170 0.02410  204 ARG   A CA  
2852 C CA  B ARG   A 200 ? 0.20750 0.27710 0.30300 -0.06130 -0.01870 0.02910  204 ARG   A CA  
2853 C C   A ARG   A 200 ? 0.18610 0.28330 0.30260 -0.05740 -0.01820 0.02360  204 ARG   A C   
2854 C C   B ARG   A 200 ? 0.19530 0.28150 0.30030 -0.05750 -0.01540 0.02960  204 ARG   A C   
2855 O O   A ARG   A 200 ? 0.17420 0.27350 0.27720 -0.05120 -0.01970 0.02550  204 ARG   A O   
2856 O O   B ARG   A 200 ? 0.19120 0.27550 0.28910 -0.05490 -0.01420 0.03080  204 ARG   A O   
2857 C CB  A ARG   A 200 ? 0.22300 0.30220 0.35980 -0.06880 -0.02680 0.02530  204 ARG   A CB  
2858 C CB  B ARG   A 200 ? 0.22150 0.26910 0.29450 -0.06540 -0.01920 0.03120  204 ARG   A CB  
2859 C CG  A ARG   A 200 ? 0.24860 0.32260 0.38480 -0.06430 -0.01960 0.02700  204 ARG   A CG  
2860 C CG  B ARG   A 200 ? 0.23540 0.26890 0.28280 -0.06180 -0.01790 0.03320  204 ARG   A CG  
2861 C CD  A ARG   A 200 ? 0.26160 0.33800 0.39830 -0.06940 -0.03080 0.03280  204 ARG   A CD  
2862 C CD  B ARG   A 200 ? 0.24750 0.26690 0.27380 -0.06160 -0.02330 0.03360  204 ARG   A CD  
2863 N NE  A ARG   A 200 ? 0.28450 0.35100 0.41860 -0.07920 -0.05090 0.03520  204 ARG   A NE  
2864 N NE  B ARG   A 200 ? 0.26510 0.27000 0.29090 -0.06850 -0.01910 0.03160  204 ARG   A NE  
2865 C CZ  A ARG   A 200 ? 0.30050 0.36070 0.42730 -0.07850 -0.03660 0.03110  204 ARG   A CZ  
2866 C CZ  B ARG   A 200 ? 0.28430 0.27530 0.31380 -0.06970 -0.02320 0.03030  204 ARG   A CZ  
2867 N NH1 A ARG   A 200 ? 0.31000 0.36720 0.44120 -0.07360 -0.01790 0.02590  204 ARG   A NH1 
2868 N NH1 B ARG   A 200 ? 0.30300 0.28300 0.31780 -0.06700 -0.01140 0.03300  204 ARG   A NH1 
2869 N NH2 A ARG   A 200 ? 0.28790 0.36210 0.41920 -0.07720 -0.03230 0.03310  204 ARG   A NH2 
2870 N NH2 B ARG   A 200 ? 0.29250 0.27550 0.32750 -0.07800 -0.02520 0.03400  204 ARG   A NH2 
2897 N N   . GLN   A 201 ? 0.18880 0.29780 0.31590 -0.05530 -0.01350 0.03680  205 GLN   A N   
2898 C CA  . GLN   A 201 ? 0.18610 0.33550 0.33540 -0.07300 -0.01700 0.04340  205 GLN   A CA  
2899 C C   . GLN   A 201 ? 0.17040 0.33400 0.30670 -0.06870 -0.01860 0.03870  205 GLN   A C   
2900 O O   . GLN   A 201 ? 0.14600 0.35170 0.29140 -0.03850 -0.00880 0.03860  205 GLN   A O   
2901 C CB  . GLN   A 201 ? 0.21020 0.36530 0.36690 -0.08030 -0.01330 0.05870  205 GLN   A CB  
2902 C CG  . GLN   A 201 ? 0.23040 0.38910 0.40020 -0.08020 -0.01630 0.05940  205 GLN   A CG  
2903 C CD  . GLN   A 201 ? 0.25870 0.41040 0.41890 -0.07260 -0.01290 0.05760  205 GLN   A CD  
2904 O OE1 . GLN   A 201 ? 0.27870 0.43140 0.43860 -0.06330 -0.00890 0.06110  205 GLN   A OE1 
2905 N NE2 . GLN   A 201 ? 0.27150 0.41440 0.41560 -0.08460 -0.01040 0.03990  205 GLN   A NE2 
2915 N N   . GLN   A 202 ? 0.19620 0.33150 0.31570 -0.06380 -0.03780 0.02200  206 GLN   A N   
2916 C CA  . GLN   A 202 ? 0.19480 0.32810 0.28590 -0.05130 -0.01620 0.00480  206 GLN   A CA  
2917 C C   . GLN   A 202 ? 0.16360 0.30750 0.26750 -0.03790 0.00160  0.00030  206 GLN   A C   
2918 O O   . GLN   A 202 ? 0.16800 0.30340 0.25440 -0.02840 0.00090  0.00130  206 GLN   A O   
2919 C CB  . GLN   A 202 ? 0.20570 0.33880 0.29560 -0.06040 -0.03520 -0.03050 206 GLN   A CB  
2920 C CG  . GLN   A 202 ? 0.22050 0.34840 0.29690 -0.06280 -0.01720 -0.03630 206 GLN   A CG  
2921 C CD  . GLN   A 202 ? 0.24030 0.36820 0.30780 -0.06160 -0.04200 -0.04730 206 GLN   A CD  
2922 O OE1 . GLN   A 202 ? 0.24250 0.38950 0.33680 -0.05110 -0.06730 -0.06800 206 GLN   A OE1 
2923 N NE2 . GLN   A 202 ? 0.23680 0.37390 0.29480 -0.04510 -0.04840 -0.01950 206 GLN   A NE2 
2932 N N   . PHE   A 203 ? 0.14680 0.29040 0.27420 -0.03700 -0.01300 0.00980  207 PHE   A N   
2933 C CA  . PHE   A 203 ? 0.13390 0.28610 0.25530 -0.04630 -0.00670 0.01630  207 PHE   A CA  
2934 C C   . PHE   A 203 ? 0.13530 0.28880 0.25890 -0.04270 0.00100  0.01350  207 PHE   A C   
2935 O O   . PHE   A 203 ? 0.13180 0.28770 0.23160 -0.03340 0.00050  -0.00620 207 PHE   A O   
2936 C CB  . PHE   A 203 ? 0.14050 0.27380 0.25340 -0.03500 0.00660  0.02950  207 PHE   A CB  
2937 C CG  . PHE   A 203 ? 0.11370 0.27830 0.24750 -0.01360 0.00610  0.02070  207 PHE   A CG  
2938 C CD1 . PHE   A 203 ? 0.14660 0.28540 0.24120 -0.03060 -0.00230 0.02520  207 PHE   A CD1 
2939 C CD2 . PHE   A 203 ? 0.13580 0.27930 0.25200 -0.01250 -0.00670 0.01270  207 PHE   A CD2 
2940 C CE1 . PHE   A 203 ? 0.15480 0.27910 0.24020 -0.03410 -0.00730 0.02970  207 PHE   A CE1 
2941 C CE2 . PHE   A 203 ? 0.13170 0.28260 0.24990 -0.01640 0.00340  0.00750  207 PHE   A CE2 
2942 C CZ  . PHE   A 203 ? 0.13380 0.28810 0.25920 -0.01560 0.01150  0.02060  207 PHE   A CZ  
2952 N N   . VAL   A 204 ? 0.13540 0.30450 0.24950 -0.03850 0.00610  0.00890  208 VAL   A N   
2953 C CA  . VAL   A 204 ? 0.16000 0.31790 0.24290 -0.04610 -0.00640 0.02230  208 VAL   A CA  
2954 C C   . VAL   A 204 ? 0.14920 0.33160 0.23670 -0.04100 -0.02140 0.03010  208 VAL   A C   
2955 O O   . VAL   A 204 ? 0.15980 0.34760 0.23380 -0.03380 -0.00530 0.03030  208 VAL   A O   
2956 C CB  . VAL   A 204 ? 0.19170 0.32400 0.24480 -0.04220 0.00660  0.03490  208 VAL   A CB  
2957 C CG1 . VAL   A 204 ? 0.18900 0.33180 0.25240 -0.03460 0.04820  0.03960  208 VAL   A CG1 
2958 C CG2 . VAL   A 204 ? 0.20740 0.31970 0.24900 -0.03510 -0.02350 0.05310  208 VAL   A CG2 
2968 N N   . ASP   A 205 ? 0.12420 0.34780 0.25490 -0.05480 -0.00190 0.02480  209 ASP   A N   
2969 C CA  . ASP   A 205 ? 0.12890 0.36540 0.26500 -0.05960 -0.02020 0.01480  209 ASP   A CA  
2970 C C   . ASP   A 205 ? 0.12950 0.36260 0.26730 -0.05670 -0.01040 0.00430  209 ASP   A C   
2971 O O   . ASP   A 205 ? 0.12090 0.36310 0.26410 -0.02750 0.00220  -0.00170 209 ASP   A O   
2972 C CB  . ASP   A 205 ? 0.13340 0.37920 0.30830 -0.07270 -0.03370 0.02230  209 ASP   A CB  
2973 C CG  . ASP   A 205 ? 0.18610 0.39080 0.37710 -0.08030 -0.02990 0.01720  209 ASP   A CG  
2974 O OD1 . ASP   A 205 ? 0.22630 0.39700 0.40870 -0.08000 -0.00390 0.04400  209 ASP   A OD1 
2975 O OD2 . ASP   A 205 ? 0.23950 0.40360 0.42580 -0.08900 -0.02820 0.00650  209 ASP   A OD2 
2980 N N   . TRP   A 206 ? 0.13380 0.35590 0.21920 -0.05780 -0.01910 0.01490  210 TRP   A N   
2981 C CA  . TRP   A 206 ? 0.13360 0.32920 0.23970 -0.03990 -0.01740 0.01660  210 TRP   A CA  
2982 C C   . TRP   A 206 ? 0.13640 0.32200 0.22270 -0.03100 -0.00750 0.02070  210 TRP   A C   
2983 O O   . TRP   A 206 ? 0.14420 0.32300 0.22850 -0.02890 0.00250  0.00030  210 TRP   A O   
2984 C CB  . TRP   A 206 ? 0.13590 0.31770 0.23800 -0.03670 -0.00600 -0.00190 210 TRP   A CB  
2985 C CG  . TRP   A 206 ? 0.15730 0.31100 0.24240 -0.04590 -0.02800 -0.00170 210 TRP   A CG  
2986 C CD1 . TRP   A 206 ? 0.18000 0.32520 0.24210 -0.04670 -0.02190 -0.00980 210 TRP   A CD1 
2987 C CD2 . TRP   A 206 ? 0.17190 0.30720 0.22570 -0.05010 -0.00930 0.00070  210 TRP   A CD2 
2988 N NE1 . TRP   A 206 ? 0.18710 0.32700 0.23860 -0.04670 -0.03060 -0.00810 210 TRP   A NE1 
2989 C CE2 . TRP   A 206 ? 0.19440 0.32020 0.24410 -0.04720 0.00060  0.00150  210 TRP   A CE2 
2990 C CE3 . TRP   A 206 ? 0.17490 0.29730 0.23490 -0.04170 -0.02700 -0.00210 210 TRP   A CE3 
2991 C CZ2 . TRP   A 206 ? 0.20210 0.30600 0.22650 -0.05220 -0.01820 0.01070  210 TRP   A CZ2 
2992 C CZ3 . TRP   A 206 ? 0.19460 0.29510 0.24450 -0.03740 -0.00380 0.01090  210 TRP   A CZ3 
2993 C CH2 . TRP   A 206 ? 0.18910 0.29810 0.25180 -0.04380 -0.00230 -0.00200 210 TRP   A CH2 
3004 N N   . LEU   A 207 ? 0.12480 0.31700 0.21930 -0.02070 -0.00360 0.01080  211 LEU   A N   
3005 C CA  . LEU   A 207 ? 0.11960 0.31450 0.23150 -0.01430 0.00270  0.00740  211 LEU   A CA  
3006 C C   . LEU   A 207 ? 0.10700 0.32380 0.23060 -0.02970 0.00620  0.00210  211 LEU   A C   
3007 O O   . LEU   A 207 ? 0.11780 0.32920 0.23120 -0.03690 -0.00780 0.01220  211 LEU   A O   
3008 C CB  . LEU   A 207 ? 0.11990 0.30640 0.21340 -0.03030 -0.00690 0.00990  211 LEU   A CB  
3009 C CG  . LEU   A 207 ? 0.11320 0.30400 0.23260 -0.02650 -0.00910 0.00830  211 LEU   A CG  
3010 C CD1 . LEU   A 207 ? 0.10640 0.30860 0.26330 -0.02030 -0.00570 0.02410  211 LEU   A CD1 
3011 C CD2 . LEU   A 207 ? 0.10570 0.29220 0.24830 -0.03950 -0.00520 0.00570  211 LEU   A CD2 
3023 N N   . LYS   A 208 ? 0.09980 0.33670 0.24550 -0.04420 0.01440  -0.00790 212 LYS   A N   
3024 C CA  . LYS   A 208 ? 0.09780 0.34340 0.26380 -0.04540 -0.01470 0.00180  212 LYS   A CA  
3025 C C   . LYS   A 208 ? 0.11870 0.36270 0.26310 -0.02300 -0.01890 -0.00140 212 LYS   A C   
3026 O O   . LYS   A 208 ? 0.13520 0.37290 0.26420 -0.01210 0.00320  0.01030  212 LYS   A O   
3027 C CB  . LYS   A 208 ? 0.13210 0.34430 0.29200 -0.04630 0.00970  -0.01110 212 LYS   A CB  
3028 C CG  . LYS   A 208 ? 0.16010 0.35510 0.29560 -0.05490 0.03900  -0.03780 212 LYS   A CG  
3029 C CD  . LYS   A 208 ? 0.21730 0.38030 0.35730 -0.05480 0.06070  -0.03930 212 LYS   A CD  
3030 C CE  . LYS   A 208 ? 0.23990 0.40090 0.41010 -0.07980 0.03840  -0.03520 212 LYS   A CE  
3031 N NZ  . LYS   A 208 ? 0.24970 0.41200 0.43530 -0.10870 0.05760  -0.03020 212 LYS   A NZ  
3045 N N   . GLY   A 209 ? 0.11820 0.36590 0.24690 -0.02760 -0.01820 0.00060  213 GLY   A N   
3046 C CA  . GLY   A 209 ? 0.13980 0.37060 0.24960 -0.02370 -0.02210 0.01000  213 GLY   A CA  
3047 C C   . GLY   A 209 ? 0.11820 0.36760 0.23220 -0.02470 -0.01240 0.01670  213 GLY   A C   
3048 O O   . GLY   A 209 ? 0.14550 0.37140 0.26880 -0.02210 -0.02800 0.00670  213 GLY   A O   
3052 N N   . ASN   A 210 ? 0.10930 0.36590 0.21930 -0.03120 -0.00330 0.02180  214 ASN   A N   
3053 C CA  . ASN   A 210 ? 0.10200 0.35510 0.21120 -0.02310 0.00860  0.01700  214 ASN   A CA  
3054 C C   . ASN   A 210 ? 0.11510 0.35090 0.22400 -0.00500 -0.00150 0.01010  214 ASN   A C   
3055 O O   . ASN   A 210 ? 0.12920 0.34480 0.24640 -0.01320 -0.00180 0.02570  214 ASN   A O   
3056 C CB  . ASN   A 210 ? 0.10660 0.33930 0.20860 -0.02570 -0.01020 0.02130  214 ASN   A CB  
3057 C CG  . ASN   A 210 ? 0.10620 0.32100 0.20690 -0.02910 0.00760  0.02130  214 ASN   A CG  
3058 O OD1 . ASN   A 210 ? 0.12570 0.31820 0.22120 -0.02610 -0.00360 0.04440  214 ASN   A OD1 
3059 N ND2 . ASN   A 210 ? 0.13070 0.31280 0.22070 -0.01970 -0.00490 0.00760  214 ASN   A ND2 
3066 N N   . THR   A 211 ? 0.11520 0.35830 0.21970 -0.00300 -0.00620 0.01160  215 THR   A N   
3067 C CA  . THR   A 211 ? 0.11350 0.35920 0.23800 -0.00020 -0.00030 0.01730  215 THR   A CA  
3068 C C   . THR   A 211 ? 0.11580 0.35530 0.24000 -0.00060 -0.00790 0.01970  215 THR   A C   
3069 O O   . THR   A 211 ? 0.12000 0.35600 0.25300 0.00960  -0.01650 0.01460  215 THR   A O   
3070 C CB  . THR   A 211 ? 0.13580 0.36870 0.25490 0.00900  -0.01480 -0.00420 215 THR   A CB  
3071 O OG1 . THR   A 211 ? 0.14650 0.36860 0.23580 0.00660  -0.03630 0.01160  215 THR   A OG1 
3072 C CG2 . THR   A 211 ? 0.13050 0.37080 0.28260 0.03150  -0.02930 -0.01130 215 THR   A CG2 
3080 N N   . THR   A 212 ? 0.11030 0.33670 0.21730 0.00180  -0.01490 0.02780  216 THR   A N   
3081 C CA  . THR   A 212 ? 0.12170 0.32830 0.21890 0.01130  -0.01730 0.01770  216 THR   A CA  
3082 C C   . THR   A 212 ? 0.10850 0.32460 0.21340 -0.01230 0.00350  0.01620  216 THR   A C   
3083 O O   . THR   A 212 ? 0.12230 0.32730 0.23330 -0.00510 -0.00020 0.02520  216 THR   A O   
3084 C CB  . THR   A 212 ? 0.14030 0.32700 0.22120 0.00050  -0.01280 0.01930  216 THR   A CB  
3085 O OG1 . THR   A 212 ? 0.11530 0.33780 0.25390 -0.00930 -0.00280 0.00190  216 THR   A OG1 
3086 C CG2 . THR   A 212 ? 0.17550 0.34510 0.23090 -0.03150 -0.01240 0.01820  216 THR   A CG2 
3094 N N   . GLY   A 213 ? 0.10700 0.32250 0.21830 -0.00780 -0.00040 0.00410  217 GLY   A N   
3095 C CA  . GLY   A 213 ? 0.10980 0.31810 0.22640 0.00350  0.00340  0.00120  217 GLY   A CA  
3096 C C   . GLY   A 213 ? 0.09060 0.32440 0.23960 -0.00690 -0.01130 0.00890  217 GLY   A C   
3097 O O   . GLY   A 213 ? 0.10920 0.32470 0.21730 -0.00110 -0.00690 0.01660  217 GLY   A O   
3101 N N   . ASN   A 214 ? 0.08380 0.33150 0.27020 -0.00230 0.00930  0.01000  218 ASN   A N   
3102 C CA  . ASN   A 214 ? 0.09220 0.34320 0.27810 0.01720  0.00160  0.01370  218 ASN   A CA  
3103 C C   . ASN   A 214 ? 0.11100 0.34030 0.27820 0.01060  0.00720  0.00440  218 ASN   A C   
3104 O O   . ASN   A 214 ? 0.14510 0.34700 0.28110 -0.00840 0.02010  -0.01490 218 ASN   A O   
3105 C CB  . ASN   A 214 ? 0.10430 0.37340 0.30250 0.02170  -0.01590 -0.00570 218 ASN   A CB  
3106 C CG  . ASN   A 214 ? 0.13370 0.39780 0.34940 0.01220  -0.04020 -0.01980 218 ASN   A CG  
3107 O OD1 . ASN   A 214 ? 0.12830 0.41130 0.33630 0.00640  -0.01020 -0.03330 218 ASN   A OD1 
3108 N ND2 . ASN   A 214 ? 0.20210 0.41920 0.39760 0.00390  -0.07900 -0.02230 218 ASN   A ND2 
3115 N N   . HIS   A 215 ? 0.10610 0.32890 0.25070 0.01660  0.01730  -0.00090 219 HIS   A N   
3116 C CA  . HIS   A 215 ? 0.13900 0.32670 0.24220 0.02740  0.01830  0.01770  219 HIS   A CA  
3117 C C   . HIS   A 215 ? 0.10790 0.31850 0.24860 0.02240  0.01260  0.00820  219 HIS   A C   
3118 O O   . HIS   A 215 ? 0.13340 0.31140 0.25360 0.01980  0.01860  0.00650  219 HIS   A O   
3119 C CB  . HIS   A 215 ? 0.17040 0.34240 0.27760 0.02780  0.01580  0.02130  219 HIS   A CB  
3120 C CG  . HIS   A 215 ? 0.22750 0.37190 0.32450 0.04420  0.00010  0.01390  219 HIS   A CG  
3121 N ND1 . HIS   A 215 ? 0.23010 0.39100 0.35350 0.05650  -0.01650 0.01690  219 HIS   A ND1 
3122 C CD2 . HIS   A 215 ? 0.25730 0.39490 0.34930 0.05860  -0.01930 0.01460  219 HIS   A CD2 
3123 C CE1 . HIS   A 215 ? 0.23930 0.40210 0.37390 0.06640  -0.03600 0.02070  219 HIS   A CE1 
3124 N NE2 . HIS   A 215 ? 0.26330 0.40610 0.36320 0.07560  -0.02990 0.02510  219 HIS   A NE2 
3132 N N   . ARG   A 216 ? 0.09010 0.31950 0.23580 0.01470  0.01960  0.02340  220 ARG   A N   
3133 C CA  . ARG   A 216 ? 0.09110 0.30370 0.20600 0.00890  0.01700  0.00430  220 ARG   A CA  
3134 C C   . ARG   A 216 ? 0.10480 0.31000 0.19800 0.00250  0.00280  0.02150  220 ARG   A C   
3135 O O   . ARG   A 216 ? 0.11190 0.31380 0.22910 0.00190  0.02130  -0.00250 220 ARG   A O   
3136 C CB  . ARG   A 216 ? 0.11410 0.28600 0.22300 -0.00960 0.01390  0.00100  220 ARG   A CB  
3137 C CG  . ARG   A 216 ? 0.10900 0.28330 0.21380 0.00170  -0.00430 0.01070  220 ARG   A CG  
3138 C CD  . ARG   A 216 ? 0.12430 0.27410 0.22480 -0.00180 0.00610  0.01400  220 ARG   A CD  
3139 N NE  . ARG   A 216 ? 0.11900 0.27490 0.23520 -0.00200 0.01540  0.01220  220 ARG   A NE  
3140 C CZ  . ARG   A 216 ? 0.11610 0.28270 0.21370 -0.00780 0.00110  0.01530  220 ARG   A CZ  
3141 N NH1 . ARG   A 216 ? 0.10740 0.29640 0.21860 -0.00120 0.00610  0.01000  220 ARG   A NH1 
3142 N NH2 . ARG   A 216 ? 0.10970 0.29250 0.24070 -0.01230 0.00610  0.01890  220 ARG   A NH2 
3156 N N   . ILE   A 217 ? 0.09890 0.30710 0.20760 -0.00340 0.02120  0.02450  221 ILE   A N   
3157 C CA  . ILE   A 217 ? 0.10540 0.29900 0.19590 -0.00990 0.01140  0.00370  221 ILE   A CA  
3158 C C   . ILE   A 217 ? 0.11160 0.30460 0.21950 -0.01150 0.01610  0.01860  221 ILE   A C   
3159 O O   . ILE   A 217 ? 0.11160 0.31540 0.22070 -0.01140 0.03490  0.01700  221 ILE   A O   
3160 C CB  . ILE   A 217 ? 0.10860 0.30280 0.20460 -0.00250 0.01520  0.01940  221 ILE   A CB  
3161 C CG1 . ILE   A 217 ? 0.11540 0.30000 0.19380 0.00140  0.01850  0.01550  221 ILE   A CG1 
3162 C CG2 . ILE   A 217 ? 0.11300 0.30200 0.21860 -0.01290 0.01650  0.00230  221 ILE   A CG2 
3163 C CD1 . ILE   A 217 ? 0.11080 0.29030 0.21850 0.00630  0.01000  0.00800  221 ILE   A CD1 
3175 N N   . ARG   A 218 ? 0.10450 0.29760 0.22150 -0.01780 0.02920  0.02290  222 ARG   A N   
3176 C CA  . ARG   A 218 ? 0.10390 0.30920 0.22520 -0.01360 0.01260  0.01080  222 ARG   A CA  
3177 C C   . ARG   A 218 ? 0.09600 0.32240 0.24890 -0.00890 0.01150  0.00580  222 ARG   A C   
3178 O O   . ARG   A 218 ? 0.10860 0.32350 0.24220 -0.02560 0.01290  0.00730  222 ARG   A O   
3179 C CB  . ARG   A 218 ? 0.11790 0.30260 0.24710 -0.02190 0.00090  0.01170  222 ARG   A CB  
3180 C CG  . ARG   A 218 ? 0.14050 0.31290 0.25040 -0.00560 0.01210  0.01380  222 ARG   A CG  
3181 C CD  . ARG   A 218 ? 0.14960 0.32140 0.26340 0.00170  0.00200  0.02520  222 ARG   A CD  
3182 N NE  . ARG   A 218 ? 0.14890 0.32190 0.27850 -0.01720 0.01310  0.01460  222 ARG   A NE  
3183 C CZ  . ARG   A 218 ? 0.16360 0.33320 0.30510 -0.02890 0.02450  0.01770  222 ARG   A CZ  
3184 N NH1 . ARG   A 218 ? 0.17170 0.34280 0.33720 -0.03580 0.03670  -0.01300 222 ARG   A NH1 
3185 N NH2 . ARG   A 218 ? 0.17110 0.33810 0.29810 -0.03770 0.05230  0.02710  222 ARG   A NH2 
3199 N N   . ALA   A 219 ? 0.09880 0.32460 0.24330 0.00530  0.01920  0.01420  223 ALA   A N   
3200 C CA  . ALA   A 219 ? 0.10670 0.33390 0.26250 -0.00900 0.02710  0.01030  223 ALA   A CA  
3201 C C   . ALA   A 219 ? 0.14110 0.35270 0.27490 -0.00440 0.04380  -0.00310 223 ALA   A C   
3202 O O   . ALA   A 219 ? 0.18440 0.36720 0.29500 0.03110  0.05250  -0.00940 223 ALA   A O   
3203 C CB  . ALA   A 219 ? 0.13390 0.32620 0.25820 -0.02100 0.03010  -0.00320 223 ALA   A CB  
3209 N N   . ALA   A 220 ? 0.13720 0.35560 0.24570 0.00060  0.03780  -0.00560 224 ALA   A N   
3210 C CA  . ALA   A 220 ? 0.13910 0.37340 0.25640 -0.00020 0.01690  -0.01190 224 ALA   A CA  
3211 C C   . ALA   A 220 ? 0.13020 0.38410 0.25530 -0.00890 0.02870  0.02990  224 ALA   A C   
3212 O O   . ALA   A 220 ? 0.22130 0.40590 0.26050 -0.00810 0.01950  0.05240  224 ALA   A O   
3213 C CB  . ALA   A 220 ? 0.14550 0.37820 0.25520 -0.01320 -0.00830 -0.03710 224 ALA   A CB  
3219 N N   . VAL   A 221 ? 0.12930 0.37810 0.26230 -0.01890 0.02540  0.03910  225 VAL   A N   
3220 C CA  . VAL   A 221 ? 0.15020 0.37700 0.31000 -0.02500 0.03990  0.04970  225 VAL   A CA  
3221 C C   . VAL   A 221 ? 0.16130 0.37610 0.32110 -0.02450 0.05360  0.06400  225 VAL   A C   
3222 O O   . VAL   A 221 ? 0.14890 0.37950 0.33920 -0.01440 0.05760  0.07180  225 VAL   A O   
3223 C CB  . VAL   A 221 ? 0.14990 0.37100 0.35180 -0.02100 0.05180  0.03010  225 VAL   A CB  
3224 C CG1 . VAL   A 221 ? 0.15770 0.37220 0.38640 -0.02710 0.06060  0.02550  225 VAL   A CG1 
3225 C CG2 . VAL   A 221 ? 0.14080 0.36810 0.35190 -0.01850 0.05450  0.02910  225 VAL   A CG2 
3235 N N   . PRO   A 222 ? 0.17110 0.38100 0.28220 -0.02290 0.04530  0.06320  226 PRO   A N   
3236 C CA  . PRO   A 222 ? 0.17060 0.38790 0.29120 -0.02630 0.05460  0.06330  226 PRO   A CA  
3237 C C   . PRO   A 222 ? 0.16030 0.39160 0.28140 -0.01000 0.04990  0.08440  226 PRO   A C   
3238 O O   . PRO   A 222 ? 0.14710 0.38940 0.27140 -0.00400 0.05760  0.05070  226 PRO   A O   
3239 C CB  . PRO   A 222 ? 0.19290 0.39650 0.29670 -0.03100 0.06190  0.04760  226 PRO   A CB  
3240 C CG  . PRO   A 222 ? 0.19850 0.39960 0.28700 -0.03200 0.05020  0.04310  226 PRO   A CG  
3241 C CD  . PRO   A 222 ? 0.19770 0.39050 0.27320 -0.02610 0.04810  0.04450  226 PRO   A CD  
3249 N N   . ALA   A 223 ? 0.16730 0.40530 0.28470 0.01130  0.02490  0.09080  227 ALA   A N   
3250 C CA  . ALA   A 223 ? 0.17880 0.42870 0.31280 0.01670  0.02280  0.08030  227 ALA   A CA  
3251 C C   . ALA   A 223 ? 0.16610 0.44400 0.28170 0.00570  0.02330  0.06050  227 ALA   A C   
3252 O O   . ALA   A 223 ? 0.21880 0.47400 0.25940 -0.00070 0.01010  0.06380  227 ALA   A O   
3253 C CB  . ALA   A 223 ? 0.21980 0.43990 0.34770 0.02430  0.04250  0.08100  227 ALA   A CB  
3259 N N   . ASP   A 224 ? 0.14500 0.42090 0.24530 -0.00070 0.02110  0.04740  228 ASP   A N   
3260 C CA  . ASP   A 224 ? 0.14420 0.39550 0.24490 -0.00880 0.00860  0.02660  228 ASP   A CA  
3261 C C   . ASP   A 224 ? 0.13110 0.37530 0.25680 -0.02180 0.00780  0.01190  228 ASP   A C   
3262 O O   . ASP   A 224 ? 0.15410 0.38660 0.31080 -0.03750 0.00050  0.00970  228 ASP   A O   
3263 C CB  . ASP   A 224 ? 0.11290 0.38750 0.23090 -0.01900 0.00580  0.02450  228 ASP   A CB  
3264 C CG  . ASP   A 224 ? 0.14980 0.38740 0.22940 -0.02280 0.02810  0.02090  228 ASP   A CG  
3265 O OD1 . ASP   A 224 ? 0.13790 0.37700 0.21750 -0.00690 0.02670  0.01990  228 ASP   A OD1 
3266 O OD2 . ASP   A 224 ? 0.19060 0.39600 0.25170 -0.04780 0.01260  0.00410  228 ASP   A OD2 
3271 N N   . TRP   A 225 ? 0.13730 0.36710 0.23680 -0.00910 0.02480  0.01250  229 TRP   A N   
3272 C CA  . TRP   A 225 ? 0.15060 0.36530 0.22680 0.00420  0.01470  0.00760  229 TRP   A CA  
3273 C C   . TRP   A 225 ? 0.19900 0.37890 0.22380 0.01750  0.00250  0.02530  229 TRP   A C   
3274 O O   . TRP   A 225 ? 0.28220 0.39520 0.24980 0.04990  0.03950  0.03090  229 TRP   A O   
3275 C CB  . TRP   A 225 ? 0.13210 0.37170 0.22530 -0.02150 0.04660  0.01310  229 TRP   A CB  
3276 C CG  . TRP   A 225 ? 0.11790 0.37850 0.21500 -0.02880 0.02290  0.01750  229 TRP   A CG  
3277 C CD1 . TRP   A 225 ? 0.10800 0.38450 0.21330 -0.03520 0.01800  0.01910  229 TRP   A CD1 
3278 C CD2 . TRP   A 225 ? 0.11350 0.39480 0.25910 -0.03930 0.01690  -0.01300 229 TRP   A CD2 
3279 N NE1 . TRP   A 225 ? 0.13010 0.40550 0.24500 -0.04150 0.01630  0.01530  229 TRP   A NE1 
3280 C CE2 . TRP   A 225 ? 0.13340 0.40940 0.25850 -0.02740 0.00090  -0.01360 229 TRP   A CE2 
3281 C CE3 . TRP   A 225 ? 0.12210 0.39960 0.28470 -0.02040 0.00940  -0.04730 229 TRP   A CE3 
3282 C CZ2 . TRP   A 225 ? 0.14100 0.42750 0.26580 -0.02280 0.01590  -0.01950 229 TRP   A CZ2 
3283 C CZ3 . TRP   A 225 ? 0.14180 0.42480 0.30840 -0.02380 0.00130  -0.04100 229 TRP   A CZ3 
3284 C CH2 . TRP   A 225 ? 0.16190 0.43850 0.29950 -0.02250 -0.00840 -0.03160 229 TRP   A CH2 
3295 N N   . ALA   A 226 ? 0.13700 0.37970 0.22720 -0.00440 0.02890  0.02440  230 ALA   A N   
3296 C CA  . ALA   A 226 ? 0.12640 0.37470 0.23910 -0.01460 0.03240  0.01760  230 ALA   A CA  
3297 C C   . ALA   A 226 ? 0.11870 0.36010 0.23110 -0.00360 0.01220  0.02690  230 ALA   A C   
3298 O O   . ALA   A 226 ? 0.11310 0.35670 0.22180 -0.00200 0.01180  0.04070  230 ALA   A O   
3299 C CB  . ALA   A 226 ? 0.14080 0.38710 0.24070 -0.03680 0.03560  0.00030  230 ALA   A CB  
3305 N N   A VAL   A 227 ? 0.10230 0.35030 0.22530 0.01080  0.00150  0.02190  231 VAL   A N   
3306 N N   B VAL   A 227 ? 0.11370 0.34990 0.22380 0.00600  0.00950  0.02220  231 VAL   A N   
3307 C CA  A VAL   A 227 ? 0.12020 0.34310 0.23620 -0.00710 0.00300  0.01320  231 VAL   A CA  
3308 C CA  B VAL   A 227 ? 0.12910 0.34160 0.22420 -0.00280 0.01150  0.01570  231 VAL   A CA  
3309 C C   A VAL   A 227 ? 0.11320 0.31490 0.21690 -0.01630 0.00240  0.03240  231 VAL   A C   
3310 C C   B VAL   A 227 ? 0.11270 0.32590 0.22760 -0.02190 0.01100  0.02150  231 VAL   A C   
3311 O O   A VAL   A 227 ? 0.13040 0.29470 0.21830 -0.00360 -0.01140 0.04450  231 VAL   A O   
3312 O O   B VAL   A 227 ? 0.11250 0.32220 0.24940 -0.02490 0.01420  0.01830  231 VAL   A O   
3313 C CB  A VAL   A 227 ? 0.12410 0.35980 0.28090 -0.01090 -0.02170 -0.01300 231 VAL   A CB  
3314 C CB  B VAL   A 227 ? 0.14560 0.34730 0.23390 0.00940  0.00850  0.00570  231 VAL   A CB  
3315 C CG1 A VAL   A 227 ? 0.13530 0.36070 0.30950 -0.00510 -0.01680 -0.01980 231 VAL   A CG1 
3316 C CG1 B VAL   A 227 ? 0.17670 0.35050 0.25210 0.01130  0.00130  0.00520  231 VAL   A CG1 
3317 C CG2 A VAL   A 227 ? 0.13640 0.36710 0.27540 -0.01210 -0.04120 -0.01570 231 VAL   A CG2 
3318 C CG2 B VAL   A 227 ? 0.14230 0.34870 0.22220 0.00180  0.01970  0.00070  231 VAL   A CG2 
3337 N N   . GLY   A 228 ? 0.09740 0.31620 0.21370 -0.03890 0.01590  0.01700  232 GLY   A N   
3338 C CA  . GLY   A 228 ? 0.11890 0.32680 0.20920 -0.04120 0.01020  -0.00150 232 GLY   A CA  
3339 C C   . GLY   A 228 ? 0.12280 0.31920 0.19680 -0.03920 0.02610  0.00780  232 GLY   A C   
3340 O O   . GLY   A 228 ? 0.14410 0.33260 0.20500 -0.05150 -0.00320 0.01880  232 GLY   A O   
3345 N N   . ASP   A 229 ? 0.09850 0.30090 0.20460 -0.03750 0.00720  0.02300  233 ASP   A N   
3346 C CA  . ASP   A 229 ? 0.10650 0.28900 0.17770 -0.04020 0.00010  0.01550  233 ASP   A CA  
3347 C C   . ASP   A 229 ? 0.09000 0.28420 0.19830 -0.02220 0.01120  0.01920  233 ASP   A C   
3348 O O   . ASP   A 229 ? 0.09570 0.28750 0.21840 -0.01790 -0.00410 0.03070  233 ASP   A O   
3349 C CB  . ASP   A 229 ? 0.12020 0.29160 0.18170 -0.02030 -0.01130 0.00280  233 ASP   A CB  
3350 C CG  . ASP   A 229 ? 0.10690 0.29210 0.20590 -0.01370 0.00400  0.00870  233 ASP   A CG  
3351 O OD1 . ASP   A 229 ? 0.09820 0.29770 0.21630 -0.00530 -0.00520 0.01370  233 ASP   A OD1 
3352 O OD2 . ASP   A 229 ? 0.10740 0.28270 0.21720 -0.01400 0.00030  -0.00220 233 ASP   A OD2 
3357 N N   . LYS   A 230 ? 0.09770 0.27310 0.20550 -0.02600 -0.00860 0.01330  234 LYS   A N   
3358 C CA  . LYS   A 230 ? 0.12230 0.25910 0.20620 -0.00850 -0.01140 0.01100  234 LYS   A CA  
3359 C C   . LYS   A 230 ? 0.10900 0.25300 0.18740 -0.01990 0.00470  0.01950  234 LYS   A C   
3360 O O   . LYS   A 230 ? 0.11760 0.24260 0.18450 -0.00120 -0.01140 0.01690  234 LYS   A O   
3361 C CB  . LYS   A 230 ? 0.12460 0.26150 0.20910 -0.01850 0.00020  0.01680  234 LYS   A CB  
3362 C CG  . LYS   A 230 ? 0.12860 0.26010 0.20050 -0.01930 -0.01440 0.02040  234 LYS   A CG  
3363 C CD  . LYS   A 230 ? 0.16500 0.26900 0.21070 -0.02840 -0.00490 0.02620  234 LYS   A CD  
3364 C CE  . LYS   A 230 ? 0.14010 0.26410 0.21420 -0.02420 -0.01220 0.03030  234 LYS   A CE  
3365 N NZ  . LYS   A 230 ? 0.15350 0.26370 0.20800 -0.03000 -0.02400 0.02350  234 LYS   A NZ  
3379 N N   . THR   A 231 ? 0.10190 0.25820 0.20680 -0.00900 0.00130  0.00400  235 THR   A N   
3380 C CA  . THR   A 231 ? 0.08810 0.24960 0.20540 -0.00640 0.00180  0.01520  235 THR   A CA  
3381 C C   . THR   A 231 ? 0.09860 0.25490 0.19880 -0.02630 -0.01530 -0.00130 235 THR   A C   
3382 O O   . THR   A 231 ? 0.10940 0.26080 0.19190 -0.00340 -0.00100 0.00110  235 THR   A O   
3383 C CB  . THR   A 231 ? 0.10550 0.29020 0.22720 0.01290  0.01190  0.01940  235 THR   A CB  
3384 O OG1 . THR   A 231 ? 0.12510 0.31450 0.20940 0.00440  -0.00750 0.02500  235 THR   A OG1 
3385 C CG2 . THR   A 231 ? 0.10130 0.29750 0.24460 0.02270  0.02170  0.01170  235 THR   A CG2 
3393 N N   . GLY   A 232 ? 0.09790 0.25930 0.19330 -0.03230 0.00180  -0.01080 236 GLY   A N   
3394 C CA  . GLY   A 232 ? 0.11440 0.26220 0.20610 -0.03030 -0.00090 -0.01020 236 GLY   A CA  
3395 C C   . GLY   A 232 ? 0.09180 0.25440 0.17440 -0.00600 -0.00330 -0.02120 236 GLY   A C   
3396 O O   . GLY   A 232 ? 0.10760 0.25570 0.18290 -0.00210 0.00320  -0.00440 236 GLY   A O   
3400 N N   . THR   A 233 ? 0.11270 0.25790 0.16930 0.00280  -0.00030 -0.01880 237 THR   A N   
3401 C CA  . THR   A 233 ? 0.10690 0.25280 0.18740 0.00020  -0.00490 0.00070  237 THR   A CA  
3402 C C   . THR   A 233 ? 0.12680 0.26800 0.18450 -0.00400 0.00120  -0.00630 237 THR   A C   
3403 O O   . THR   A 233 ? 0.12260 0.29560 0.18600 -0.01830 -0.01800 0.00130  237 THR   A O   
3404 C CB  . THR   A 233 ? 0.10790 0.26590 0.22850 0.00090  0.00600  0.02240  237 THR   A CB  
3405 O OG1 . THR   A 233 ? 0.11070 0.27960 0.22870 0.00380  0.01300  0.02160  237 THR   A OG1 
3406 C CG2 . THR   A 233 ? 0.13710 0.28430 0.23720 0.03580  0.02560  -0.00050 237 THR   A CG2 
3414 N N   . CYS   A 234 ? 0.11700 0.26980 0.20090 -0.01750 -0.00970 0.00190  238 CYS   A N   
3415 C CA  . CYS   A 234 ? 0.12600 0.26260 0.21550 -0.03130 0.00080  0.01170  238 CYS   A CA  
3416 C C   . CYS   A 234 ? 0.12550 0.28770 0.23300 -0.02050 -0.01060 0.01200  238 CYS   A C   
3417 O O   . CYS   A 234 ? 0.18960 0.30870 0.25890 -0.02990 0.00720  0.03140  238 CYS   A O   
3418 C CB  . CYS   A 234 ? 0.12990 0.25580 0.21700 -0.03630 0.00040  0.02320  238 CYS   A CB  
3419 S SG  . CYS   A 234 ? 0.10590 0.25630 0.21480 -0.00520 -0.00360 0.00790  238 CYS   A SG  
3424 N N   . GLY   A 235 ? 0.13960 0.28120 0.27570 -0.01370 -0.02110 -0.00360 239 GLY   A N   
3425 C CA  . GLY   A 235 ? 0.15540 0.28600 0.28260 -0.01680 -0.01310 0.01850  239 GLY   A CA  
3426 C C   . GLY   A 235 ? 0.16540 0.28490 0.28180 -0.01150 -0.00340 0.02880  239 GLY   A C   
3427 O O   . GLY   A 235 ? 0.16790 0.30120 0.29620 0.00130  -0.02350 0.03020  239 GLY   A O   
3431 N N   . VAL   A 236 ? 0.12540 0.27750 0.23600 -0.01470 -0.01740 0.02680  240 VAL   A N   
3432 C CA  . VAL   A 236 ? 0.13240 0.27230 0.23690 -0.01860 -0.02420 0.01700  240 VAL   A CA  
3433 C C   . VAL   A 236 ? 0.12100 0.25320 0.22580 -0.00350 -0.00750 0.01300  240 VAL   A C   
3434 O O   . VAL   A 236 ? 0.11820 0.25810 0.23160 -0.00770 -0.00130 0.00410  240 VAL   A O   
3435 C CB  . VAL   A 236 ? 0.14830 0.28060 0.25020 -0.02470 -0.00700 0.02260  240 VAL   A CB  
3436 C CG1 . VAL   A 236 ? 0.16780 0.29600 0.25930 -0.02880 -0.01020 0.03130  240 VAL   A CG1 
3437 C CG2 . VAL   A 236 ? 0.14870 0.29690 0.26180 -0.02550 0.00860  0.01400  240 VAL   A CG2 
3447 N N   . TYR   A 237 ? 0.12350 0.23940 0.22920 -0.00540 -0.00820 0.00350  241 TYR   A N   
3448 C CA  . TYR   A 237 ? 0.12400 0.23830 0.21900 -0.01990 0.00860  0.00550  241 TYR   A CA  
3449 C C   . TYR   A 237 ? 0.11970 0.24070 0.23930 -0.01390 0.01740  0.01020  241 TYR   A C   
3450 O O   . TYR   A 237 ? 0.12080 0.25860 0.22100 -0.01030 0.00280  0.00780  241 TYR   A O   
3451 C CB  . TYR   A 237 ? 0.11180 0.23390 0.22310 -0.01210 0.01730  -0.00660 241 TYR   A CB  
3452 C CG  . TYR   A 237 ? 0.11110 0.24280 0.20890 -0.01300 -0.01460 -0.00300 241 TYR   A CG  
3453 C CD1 . TYR   A 237 ? 0.11130 0.24120 0.19540 -0.00900 0.00820  0.00350  241 TYR   A CD1 
3454 C CD2 . TYR   A 237 ? 0.12170 0.25380 0.21030 -0.01320 -0.00610 0.00140  241 TYR   A CD2 
3455 C CE1 . TYR   A 237 ? 0.09010 0.25320 0.22630 -0.00370 0.00000  0.00490  241 TYR   A CE1 
3456 C CE2 . TYR   A 237 ? 0.13160 0.26050 0.20610 -0.00260 0.01260  -0.00220 241 TYR   A CE2 
3457 C CZ  . TYR   A 237 ? 0.12200 0.26260 0.24570 0.00380  0.02390  0.01520  241 TYR   A CZ  
3458 O OH  . TYR   A 237 ? 0.15350 0.27190 0.26740 0.00640  0.04510  0.01300  241 TYR   A OH  
3468 N N   . GLY   A 238 ? 0.12140 0.24750 0.24380 -0.00620 0.02310  -0.00590 242 GLY   A N   
3469 C CA  . GLY   A 238 ? 0.14840 0.26110 0.25880 -0.01410 0.03720  -0.03120 242 GLY   A CA  
3470 C C   . GLY   A 238 ? 0.13570 0.24540 0.21890 -0.01570 0.02570  -0.04010 242 GLY   A C   
3471 O O   . GLY   A 238 ? 0.15860 0.26440 0.23500 -0.01890 0.03550  -0.01740 242 GLY   A O   
3475 N N   . THR   A 239 ? 0.10760 0.23400 0.21230 -0.01600 -0.00840 -0.03330 243 THR   A N   
3476 C CA  . THR   A 239 ? 0.13700 0.22970 0.20100 -0.03050 0.01230  -0.00880 243 THR   A CA  
3477 C C   . THR   A 239 ? 0.12960 0.25370 0.18250 -0.03140 0.01250  0.00030  243 THR   A C   
3478 O O   . THR   A 239 ? 0.13460 0.26250 0.19560 -0.02590 0.00090  -0.00610 243 THR   A O   
3479 C CB  . THR   A 239 ? 0.13160 0.23050 0.19310 -0.01720 -0.00040 0.00560  243 THR   A CB  
3480 O OG1 . THR   A 239 ? 0.12150 0.24120 0.19780 -0.01710 -0.00420 0.01510  243 THR   A OG1 
3481 C CG2 . THR   A 239 ? 0.13000 0.23930 0.21050 0.00150  0.01810  -0.00040 243 THR   A CG2 
3489 N N   . ALA   A 240 ? 0.10950 0.25940 0.18300 -0.02650 0.00830  0.01670  244 ALA   A N   
3490 C CA  . ALA   A 240 ? 0.10410 0.25270 0.20300 -0.02180 0.00150  0.02540  244 ALA   A CA  
3491 C C   . ALA   A 240 ? 0.10700 0.24970 0.19960 -0.01250 0.00170  0.00700  244 ALA   A C   
3492 O O   . ALA   A 240 ? 0.10650 0.24920 0.19210 -0.01900 -0.00740 0.02100  244 ALA   A O   
3493 C CB  . ALA   A 240 ? 0.12140 0.25650 0.20710 0.00630  0.00120  0.01730  244 ALA   A CB  
3499 N N   . ASN   A 241 ? 0.09520 0.24540 0.20120 -0.00040 -0.00850 0.00650  245 ASN   A N   
3500 C CA  . ASN   A 241 ? 0.08610 0.24170 0.19910 -0.00250 -0.00390 -0.00160 245 ASN   A CA  
3501 C C   . ASN   A 241 ? 0.09410 0.25900 0.21030 -0.00350 0.00420  -0.00340 245 ASN   A C   
3502 O O   . ASN   A 241 ? 0.09120 0.26310 0.20840 0.00830  -0.01310 0.01300  245 ASN   A O   
3503 C CB  . ASN   A 241 ? 0.09090 0.24030 0.19100 -0.01780 0.00690  -0.01760 245 ASN   A CB  
3504 C CG  . ASN   A 241 ? 0.10720 0.24580 0.18110 -0.01840 0.01870  -0.02180 245 ASN   A CG  
3505 O OD1 . ASN   A 241 ? 0.09700 0.26720 0.20780 -0.02000 0.00480  -0.00460 245 ASN   A OD1 
3506 N ND2 . ASN   A 241 ? 0.10420 0.26410 0.17850 -0.00780 -0.00570 0.00370  245 ASN   A ND2 
3513 N N   . ASP   A 242 ? 0.10220 0.26800 0.20590 -0.00990 0.00820  0.01290  246 ASP   A N   
3514 C CA  . ASP   A 242 ? 0.08550 0.27050 0.18860 -0.01410 -0.00070 0.01700  246 ASP   A CA  
3515 C C   . ASP   A 242 ? 0.09600 0.27240 0.19780 -0.01800 0.02040  -0.00510 246 ASP   A C   
3516 O O   . ASP   A 242 ? 0.10560 0.27180 0.20280 -0.02100 -0.00270 -0.00370 246 ASP   A O   
3517 C CB  . ASP   A 242 ? 0.08820 0.26680 0.20250 -0.01220 -0.00490 0.00490  246 ASP   A CB  
3518 C CG  . ASP   A 242 ? 0.09520 0.27110 0.19350 -0.00470 0.00570  0.01760  246 ASP   A CG  
3519 O OD1 . ASP   A 242 ? 0.09970 0.26340 0.20520 -0.01640 -0.00090 -0.00800 246 ASP   A OD1 
3520 O OD2 . ASP   A 242 ? 0.10050 0.27900 0.20420 0.00370  -0.00520 0.01030  246 ASP   A OD2 
3525 N N   . TYR   A 243 ? 0.09210 0.27360 0.19330 -0.01230 -0.00620 -0.01230 247 TYR   A N   
3526 C CA  . TYR   A 243 ? 0.10100 0.26640 0.19580 -0.01410 0.00430  -0.00370 247 TYR   A CA  
3527 C C   . TYR   A 243 ? 0.09370 0.26360 0.20190 -0.00890 0.01170  0.03110  247 TYR   A C   
3528 O O   . TYR   A 243 ? 0.10150 0.26970 0.19870 -0.00760 0.00440  0.03230  247 TYR   A O   
3529 C CB  . TYR   A 243 ? 0.10890 0.26840 0.20690 -0.00450 0.00470  -0.00030 247 TYR   A CB  
3530 C CG  . TYR   A 243 ? 0.10370 0.25720 0.19060 -0.00750 0.00100  0.00650  247 TYR   A CG  
3531 C CD1 . TYR   A 243 ? 0.11440 0.25440 0.18860 -0.01270 -0.00190 0.01550  247 TYR   A CD1 
3532 C CD2 . TYR   A 243 ? 0.11580 0.27690 0.18370 -0.01320 -0.00400 0.01910  247 TYR   A CD2 
3533 C CE1 . TYR   A 243 ? 0.11310 0.26480 0.21520 -0.00300 -0.01010 0.00830  247 TYR   A CE1 
3534 C CE2 . TYR   A 243 ? 0.11180 0.26950 0.17240 -0.02120 0.00530  0.00850  247 TYR   A CE2 
3535 C CZ  . TYR   A 243 ? 0.11780 0.26390 0.18860 -0.00930 -0.01660 0.00390  247 TYR   A CZ  
3536 O OH  . TYR   A 243 ? 0.12270 0.26540 0.20530 -0.02160 -0.01070 0.01130  247 TYR   A OH  
3546 N N   . ALA   A 244 ? 0.11310 0.26490 0.19330 -0.03350 0.00540  0.03490  248 ALA   A N   
3547 C CA  . ALA   A 244 ? 0.09710 0.27550 0.18270 -0.03300 0.01780  0.02490  248 ALA   A CA  
3548 C C   . ALA   A 244 ? 0.09590 0.28570 0.21940 -0.02410 0.01660  0.01010  248 ALA   A C   
3549 O O   . ALA   A 244 ? 0.10370 0.28960 0.23030 -0.03640 -0.00500 0.03120  248 ALA   A O   
3550 C CB  . ALA   A 244 ? 0.10280 0.28290 0.21660 -0.02240 0.00990  0.02650  248 ALA   A CB  
3556 N N   . VAL   A 245 ? 0.11350 0.27870 0.22070 -0.02320 0.01020  0.00920  249 VAL   A N   
3557 C CA  . VAL   A 245 ? 0.11770 0.28280 0.22610 -0.01810 0.02570  0.02140  249 VAL   A CA  
3558 C C   . VAL   A 245 ? 0.11560 0.30470 0.21240 -0.01910 0.00990  0.04090  249 VAL   A C   
3559 O O   . VAL   A 245 ? 0.11610 0.30910 0.22580 -0.02260 0.00310  0.05600  249 VAL   A O   
3560 C CB  . VAL   A 245 ? 0.15910 0.29080 0.28670 -0.01330 0.00580  0.02530  249 VAL   A CB  
3561 C CG1 . VAL   A 245 ? 0.17910 0.29460 0.30280 -0.00880 0.00810  0.04160  249 VAL   A CG1 
3562 C CG2 . VAL   A 245 ? 0.19030 0.30500 0.32990 -0.00760 0.03010  0.02200  249 VAL   A CG2 
3572 N N   . VAL   A 246 ? 0.11070 0.33600 0.23100 -0.01300 0.01220  0.04670  250 VAL   A N   
3573 C CA  . VAL   A 246 ? 0.10240 0.34390 0.22030 -0.01570 0.01360  0.04320  250 VAL   A CA  
3574 C C   . VAL   A 246 ? 0.10880 0.35870 0.22260 -0.02150 0.00330  0.04220  250 VAL   A C   
3575 O O   . VAL   A 246 ? 0.11720 0.36020 0.25090 -0.00810 0.00500  0.06150  250 VAL   A O   
3576 C CB  . VAL   A 246 ? 0.11750 0.35080 0.23670 -0.01200 0.03150  0.03050  250 VAL   A CB  
3577 C CG1 . VAL   A 246 ? 0.13640 0.36020 0.25100 0.01120  0.02170  0.01240  250 VAL   A CG1 
3578 C CG2 . VAL   A 246 ? 0.15220 0.35050 0.25420 -0.01340 0.03060  0.03380  250 VAL   A CG2 
3588 N N   . TRP   A 247 ? 0.10100 0.35570 0.21940 -0.02900 -0.00100 0.04810  251 TRP   A N   
3589 C CA  . TRP   A 247 ? 0.12180 0.37130 0.25550 -0.02920 0.02810  0.05720  251 TRP   A CA  
3590 C C   . TRP   A 247 ? 0.11440 0.39270 0.27810 -0.02240 0.02770  0.06600  251 TRP   A C   
3591 O O   . TRP   A 247 ? 0.11870 0.40310 0.28670 -0.01590 0.00790  0.03650  251 TRP   A O   
3592 C CB  . TRP   A 247 ? 0.13560 0.36420 0.31440 -0.03330 0.02220  0.04580  251 TRP   A CB  
3593 C CG  . TRP   A 247 ? 0.14490 0.35240 0.33300 -0.02900 0.01150  0.03070  251 TRP   A CG  
3594 C CD1 . TRP   A 247 ? 0.14580 0.34380 0.35920 -0.02820 0.00180  0.02910  251 TRP   A CD1 
3595 C CD2 . TRP   A 247 ? 0.14390 0.34370 0.30290 -0.03850 -0.00570 0.02590  251 TRP   A CD2 
3596 N NE1 . TRP   A 247 ? 0.16010 0.34580 0.36300 -0.03250 -0.01380 0.01290  251 TRP   A NE1 
3597 C CE2 . TRP   A 247 ? 0.15350 0.34430 0.31510 -0.03870 -0.00180 0.00840  251 TRP   A CE2 
3598 C CE3 . TRP   A 247 ? 0.15120 0.34380 0.29130 -0.04530 0.00400  0.02420  251 TRP   A CE3 
3599 C CZ2 . TRP   A 247 ? 0.16440 0.34100 0.30160 -0.04060 -0.00110 -0.00750 251 TRP   A CZ2 
3600 C CZ3 . TRP   A 247 ? 0.16030 0.34290 0.30050 -0.03510 0.00230  0.01240  251 TRP   A CZ3 
3601 C CH2 . TRP   A 247 ? 0.17320 0.33630 0.29270 -0.03310 0.00990  -0.00660 251 TRP   A CH2 
3612 N N   . PRO   A 248 ? 0.11450 0.40030 0.28170 0.00240  0.01700  0.07640  252 PRO   A N   
3613 C CA  . PRO   A 248 ? 0.12040 0.39980 0.29580 0.00550  0.03950  0.08090  252 PRO   A CA  
3614 C C   . PRO   A 248 ? 0.14490 0.39150 0.33680 0.02660  0.07910  0.08210  252 PRO   A C   
3615 O O   . PRO   A 248 ? 0.19470 0.39320 0.42460 0.03730  0.12850  0.09460  252 PRO   A O   
3616 C CB  . PRO   A 248 ? 0.13590 0.41480 0.28100 0.02020  0.03630  0.07900  252 PRO   A CB  
3617 C CG  . PRO   A 248 ? 0.12260 0.41470 0.24410 0.01480  0.02360  0.07230  252 PRO   A CG  
3618 C CD  . PRO   A 248 ? 0.11510 0.40680 0.26740 0.00520  0.02640  0.07700  252 PRO   A CD  
3626 N N   . THR   A 249 ? 0.10860 0.38160 0.27780 0.02510  0.03000  0.05610  254 THR   A N   
3627 C CA  . THR   A 249 ? 0.12390 0.38690 0.26110 0.02760  0.05530  0.05790  254 THR   A CA  
3628 C C   . THR   A 249 ? 0.17140 0.41510 0.32720 0.05240  0.09010  0.10400  254 THR   A C   
3629 O O   . THR   A 249 ? 0.17380 0.43980 0.35110 0.02800  0.01070  0.09940  254 THR   A O   
3630 C CB  . THR   A 249 ? 0.12110 0.35880 0.23120 0.01750  0.02230  0.03860  254 THR   A CB  
3631 O OG1 . THR   A 249 ? 0.11440 0.33520 0.24150 -0.00980 0.02450  0.01720  254 THR   A OG1 
3632 C CG2 . THR   A 249 ? 0.13510 0.35340 0.23520 0.01190  0.02170  0.03610  254 THR   A CG2 
3640 N N   . GLY   A 250 ? 0.21680 0.42290 0.37300 0.06420  0.12740  0.13180  255 GLY   A N   
3641 C CA  . GLY   A 250 ? 0.17850 0.45010 0.36130 0.06660  0.07420  0.17440  255 GLY   A CA  
3642 C C   . GLY   A 250 ? 0.16890 0.44650 0.35400 0.05640  0.06610  0.16710  255 GLY   A C   
3643 O O   . GLY   A 250 ? 0.16620 0.46530 0.37370 0.05460  0.05240  0.17290  255 GLY   A O   
3647 N N   . ARG   A 251 ? 0.14920 0.42390 0.34510 0.04060  0.05030  0.14830  256 ARG   A N   
3648 C CA  . ARG   A 251 ? 0.15610 0.43140 0.33140 0.03520  0.04370  0.13880  256 ARG   A CA  
3649 C C   . ARG   A 251 ? 0.12930 0.40390 0.30020 0.01750  0.02640  0.13720  256 ARG   A C   
3650 O O   . ARG   A 251 ? 0.13810 0.41870 0.29630 0.01660  0.01650  0.09290  256 ARG   A O   
3651 C CB  . ARG   A 251 ? 0.17750 0.44780 0.32470 0.04860  0.04370  0.13640  256 ARG   A CB  
3652 C CG  . ARG   A 251 ? 0.20860 0.46030 0.31820 0.05540  0.03910  0.12580  256 ARG   A CG  
3653 C CD  . ARG   A 251 ? 0.22600 0.47890 0.32330 0.05730  0.04780  0.10220  256 ARG   A CD  
3654 N NE  . ARG   A 251 ? 0.26330 0.49200 0.33740 0.04740  0.03330  0.07440  256 ARG   A NE  
3655 C CZ  . ARG   A 251 ? 0.30850 0.50430 0.39250 0.04190  0.03660  0.04700  256 ARG   A CZ  
3656 N NH1 . ARG   A 251 ? 0.33740 0.51380 0.41550 0.02700  0.04520  0.03880  256 ARG   A NH1 
3657 N NH2 . ARG   A 251 ? 0.34860 0.51060 0.41500 0.03670  0.03610  0.04390  256 ARG   A NH2 
3671 N N   . ALA   A 252 ? 0.12710 0.38680 0.30780 0.00960  0.02120  0.12260  257 ALA   A N   
3672 C CA  . ALA   A 252 ? 0.12060 0.37050 0.29110 0.00700  0.02610  0.10160  257 ALA   A CA  
3673 C C   . ALA   A 252 ? 0.11500 0.34480 0.28140 0.00070  0.02720  0.06730  257 ALA   A C   
3674 O O   . ALA   A 252 ? 0.12340 0.35290 0.26360 -0.00600 0.03120  0.04790  257 ALA   A O   
3675 C CB  . ALA   A 252 ? 0.12720 0.36830 0.30840 0.01930  0.03620  0.09320  257 ALA   A CB  
3681 N N   . PRO   A 253 ? 0.13290 0.31680 0.26520 -0.00460 0.02310  0.05220  258 PRO   A N   
3682 C CA  . PRO   A 253 ? 0.14690 0.31140 0.25640 -0.02130 0.01810  0.04760  258 PRO   A CA  
3683 C C   . PRO   A 253 ? 0.12990 0.29780 0.24960 -0.02470 0.01220  0.04560  258 PRO   A C   
3684 O O   . PRO   A 253 ? 0.13440 0.28800 0.27680 -0.01940 0.01370  0.02960  258 PRO   A O   
3685 C CB  . PRO   A 253 ? 0.19120 0.32640 0.27390 -0.01800 0.01730  0.03400  258 PRO   A CB  
3686 C CG  . PRO   A 253 ? 0.22790 0.32850 0.28430 0.01010  0.00920  0.03400  258 PRO   A CG  
3687 C CD  . PRO   A 253 ? 0.14600 0.31470 0.30550 -0.01040 0.03850  0.03830  258 PRO   A CD  
3695 N N   A ILE   A 254 ? 0.11500 0.29860 0.24150 -0.02720 0.03630  0.05560  259 ILE   A N   
3696 N N   B ILE   A 254 ? 0.11910 0.29640 0.24000 -0.02080 0.02540  0.05110  259 ILE   A N   
3697 C CA  A ILE   A 254 ? 0.12570 0.29800 0.24290 -0.01630 0.03620  0.05320  259 ILE   A CA  
3698 C CA  B ILE   A 254 ? 0.12440 0.29390 0.24020 -0.00710 0.02180  0.04610  259 ILE   A CA  
3699 C C   A ILE   A 254 ? 0.11380 0.29850 0.23410 -0.01450 0.01320  0.04200  259 ILE   A C   
3700 C C   B ILE   A 254 ? 0.11230 0.29610 0.22920 -0.01100 0.00960  0.03600  259 ILE   A C   
3701 O O   A ILE   A 254 ? 0.11350 0.30620 0.23170 -0.01290 -0.00040 0.05630  259 ILE   A O   
3702 O O   B ILE   A 254 ? 0.11050 0.30290 0.22290 -0.01110 -0.00160 0.04290  259 ILE   A O   
3703 C CB  A ILE   A 254 ? 0.14810 0.30870 0.25090 -0.01250 0.03930  0.03900  259 ILE   A CB  
3704 C CB  B ILE   A 254 ? 0.14290 0.29940 0.24820 0.00400  0.00720  0.03140  259 ILE   A CB  
3705 C CG1 A ILE   A 254 ? 0.15410 0.31710 0.27660 -0.01680 0.03800  0.03260  259 ILE   A CG1 
3706 C CG1 B ILE   A 254 ? 0.14910 0.30350 0.27380 0.00650  0.00750  0.01810  259 ILE   A CG1 
3707 C CG2 A ILE   A 254 ? 0.16380 0.31310 0.25190 -0.01770 0.04630  0.02140  259 ILE   A CG2 
3708 C CG2 B ILE   A 254 ? 0.15430 0.30380 0.24550 0.00130  0.00320  0.01930  259 ILE   A CG2 
3709 C CD1 A ILE   A 254 ? 0.16830 0.32100 0.28120 -0.03700 0.02690  0.03120  259 ILE   A CD1 
3710 C CD1 B ILE   A 254 ? 0.16990 0.30900 0.28240 0.00940  0.01000  0.00780  259 ILE   A CD1 
3733 N N   . VAL   A 255 ? 0.10270 0.29510 0.23340 -0.02290 0.01190  0.03610  260 VAL   A N   
3734 C CA  . VAL   A 255 ? 0.12420 0.30000 0.21900 -0.01640 -0.00280 0.03950  260 VAL   A CA  
3735 C C   . VAL   A 255 ? 0.11740 0.29660 0.21060 -0.02020 -0.00690 0.02880  260 VAL   A C   
3736 O O   . VAL   A 255 ? 0.12880 0.31040 0.21810 -0.03600 -0.02680 0.04330  260 VAL   A O   
3737 C CB  . VAL   A 255 ? 0.11830 0.32280 0.23090 -0.01080 0.00780  0.03360  260 VAL   A CB  
3738 C CG1 . VAL   A 255 ? 0.16680 0.33100 0.24760 0.00540  -0.01700 0.02190  260 VAL   A CG1 
3739 C CG2 . VAL   A 255 ? 0.12410 0.34120 0.26430 -0.00690 0.03030  0.01250  260 VAL   A CG2 
3750 N N   . LEU   A 256 ? 0.11860 0.29050 0.21670 -0.02390 -0.00330 0.03010  261 LEU   A N   
3751 C CA  . LEU   A 256 ? 0.11370 0.27620 0.22600 -0.01350 0.01380  0.02040  261 LEU   A CA  
3752 C C   . LEU   A 256 ? 0.12770 0.28060 0.20880 -0.02120 -0.00020 0.01680  261 LEU   A C   
3753 O O   . LEU   A 256 ? 0.13110 0.28580 0.20900 -0.03120 0.00710  0.03160  261 LEU   A O   
3754 C CB  . LEU   A 256 ? 0.12030 0.28810 0.22340 -0.00930 0.01260  0.01030  261 LEU   A CB  
3755 C CG  . LEU   A 256 ? 0.12960 0.30210 0.21760 -0.00950 -0.00850 -0.00180 261 LEU   A CG  
3756 C CD1 . LEU   A 256 ? 0.14940 0.31740 0.26380 -0.01340 0.01240  -0.02150 261 LEU   A CD1 
3757 C CD2 . LEU   A 256 ? 0.13230 0.31280 0.23680 -0.00580 -0.00710 -0.00530 261 LEU   A CD2 
3769 N N   . ALA   A 257 ? 0.11810 0.26780 0.19630 -0.03170 -0.00700 0.02030  262 ALA   A N   
3770 C CA  . ALA   A 257 ? 0.11420 0.27130 0.18990 -0.03800 -0.02580 0.01920  262 ALA   A CA  
3771 C C   . ALA   A 257 ? 0.11370 0.27330 0.18290 -0.03660 -0.00630 0.01040  262 ALA   A C   
3772 O O   . ALA   A 257 ? 0.10780 0.28080 0.18690 -0.03550 -0.00080 0.01020  262 ALA   A O   
3773 C CB  . ALA   A 257 ? 0.12550 0.27810 0.22050 -0.02960 0.01070  0.04510  262 ALA   A CB  
3779 N N   . VAL   A 258 ? 0.10110 0.27350 0.18210 -0.01430 -0.00620 0.01100  263 VAL   A N   
3780 C CA  . VAL   A 258 ? 0.10670 0.26130 0.19490 -0.00100 -0.00350 0.01370  263 VAL   A CA  
3781 C C   . VAL   A 258 ? 0.09140 0.25520 0.19140 0.00220  -0.00300 0.00520  263 VAL   A C   
3782 O O   . VAL   A 258 ? 0.09090 0.26150 0.20720 -0.00670 -0.00480 0.01870  263 VAL   A O   
3783 C CB  . VAL   A 258 ? 0.12370 0.26470 0.21500 -0.00080 0.00920  0.03700  263 VAL   A CB  
3784 C CG1 . VAL   A 258 ? 0.12960 0.27700 0.22510 0.01740  0.00970  0.04060  263 VAL   A CG1 
3785 C CG2 . VAL   A 258 ? 0.14080 0.26510 0.23210 -0.01110 0.02460  0.04950  263 VAL   A CG2 
3795 N N   . TYR   A 259 ? 0.11330 0.24570 0.18040 -0.01640 -0.01100 0.00520  264 TYR   A N   
3796 C CA  . TYR   A 259 ? 0.10840 0.24690 0.17820 -0.01240 -0.00470 0.00870  264 TYR   A CA  
3797 C C   . TYR   A 259 ? 0.10060 0.24340 0.17850 -0.01200 0.00530  0.00970  264 TYR   A C   
3798 O O   . TYR   A 259 ? 0.13170 0.23400 0.18060 -0.01930 -0.00900 0.01040  264 TYR   A O   
3799 C CB  . TYR   A 259 ? 0.09580 0.24630 0.18570 -0.00300 0.00560  0.02440  264 TYR   A CB  
3800 C CG  . TYR   A 259 ? 0.09800 0.23680 0.20240 -0.00760 0.00010  0.00290  264 TYR   A CG  
3801 C CD1 . TYR   A 259 ? 0.10380 0.22880 0.16760 -0.01010 0.00420  0.00680  264 TYR   A CD1 
3802 C CD2 . TYR   A 259 ? 0.08970 0.22270 0.18780 -0.00360 -0.00260 0.01370  264 TYR   A CD2 
3803 C CE1 . TYR   A 259 ? 0.09820 0.21990 0.18280 -0.00250 -0.01790 0.00370  264 TYR   A CE1 
3804 C CE2 . TYR   A 259 ? 0.09800 0.23070 0.16970 -0.02200 -0.01000 -0.01090 264 TYR   A CE2 
3805 C CZ  . TYR   A 259 ? 0.11210 0.21560 0.18200 -0.01530 -0.00650 -0.01060 264 TYR   A CZ  
3806 O OH  . TYR   A 259 ? 0.11200 0.22610 0.18100 -0.00600 0.00900  0.00070  264 TYR   A OH  
3816 N N   . THR   A 260 ? 0.10770 0.24900 0.18130 0.00430  0.00450  -0.00020 265 THR   A N   
3817 C CA  . THR   A 260 ? 0.12280 0.25660 0.17600 0.00240  -0.00680 0.01330  265 THR   A CA  
3818 C C   . THR   A 260 ? 0.12270 0.25760 0.18200 -0.00980 -0.01920 0.01610  265 THR   A C   
3819 O O   . THR   A 260 ? 0.11540 0.26480 0.19950 -0.01750 -0.00340 -0.00760 265 THR   A O   
3820 C CB  . THR   A 260 ? 0.12450 0.27600 0.19370 -0.00110 0.00370  -0.00040 265 THR   A CB  
3821 O OG1 . THR   A 260 ? 0.12510 0.27250 0.21100 -0.00640 -0.00830 -0.01910 265 THR   A OG1 
3822 C CG2 . THR   A 260 ? 0.11450 0.28910 0.20750 -0.00450 0.04680  -0.00860 265 THR   A CG2 
3830 N N   . ARG   A 261 ? 0.10830 0.26670 0.20360 -0.00680 -0.01550 0.01290  266 ARG   A N   
3831 C CA  . ARG   A 261 ? 0.11640 0.27140 0.20540 -0.02840 0.01360  0.03530  266 ARG   A CA  
3832 C C   . ARG   A 261 ? 0.12480 0.26630 0.19340 -0.02620 0.00910  0.02010  266 ARG   A C   
3833 O O   . ARG   A 261 ? 0.14960 0.25770 0.19330 -0.03080 0.02360  -0.00080 266 ARG   A O   
3834 C CB  . ARG   A 261 ? 0.11170 0.30500 0.23180 -0.02400 0.01560  0.04110  266 ARG   A CB  
3835 C CG  . ARG   A 261 ? 0.10780 0.35060 0.23230 -0.01200 0.01050  0.04870  266 ARG   A CG  
3836 C CD  . ARG   A 261 ? 0.11760 0.41270 0.27770 -0.04130 0.01220  0.01450  266 ARG   A CD  
3837 N NE  . ARG   A 261 ? 0.18680 0.46650 0.32470 -0.02390 -0.02500 0.03740  266 ARG   A NE  
3838 C CZ  . ARG   A 261 ? 0.22910 0.51190 0.33920 -0.08890 -0.07110 -0.00650 266 ARG   A CZ  
3839 N NH1 . ARG   A 261 ? 0.18160 0.50110 0.25440 -0.10920 -0.00130 -0.02650 266 ARG   A NH1 
3840 N NH2 . ARG   A 261 ? 0.29830 0.54160 0.41290 -0.08460 -0.07820 -0.01400 266 ARG   A NH2 
3854 N N   . ALA   A 262 ? 0.12800 0.27720 0.18550 -0.01930 0.01670  0.00240  267 ALA   A N   
3855 C CA  . ALA   A 262 ? 0.13020 0.26470 0.20200 -0.02890 0.01770  -0.00800 267 ALA   A CA  
3856 C C   . ALA   A 262 ? 0.14020 0.26200 0.20220 -0.02610 0.02340  0.00310  267 ALA   A C   
3857 O O   . ALA   A 262 ? 0.12190 0.25310 0.21520 -0.02000 0.00230  -0.00210 267 ALA   A O   
3858 C CB  . ALA   A 262 ? 0.14850 0.25670 0.24480 -0.03770 0.00610  -0.02140 267 ALA   A CB  
3864 N N   . PRO   A 263 ? 0.14310 0.26480 0.20190 -0.01760 0.01680  -0.01220 268 PRO   A N   
3865 C CA  . PRO   A 263 ? 0.12890 0.25640 0.20520 -0.01350 0.01360  -0.00750 268 PRO   A CA  
3866 C C   . PRO   A 263 ? 0.11900 0.24040 0.21130 -0.00500 0.01560  0.00360  268 PRO   A C   
3867 O O   . PRO   A 263 ? 0.12140 0.24550 0.23000 0.00090  0.01530  0.00290  268 PRO   A O   
3868 C CB  . PRO   A 263 ? 0.14740 0.27310 0.21320 -0.02210 -0.00330 -0.00600 268 PRO   A CB  
3869 C CG  . PRO   A 263 ? 0.18290 0.28760 0.25150 -0.03630 0.01880  -0.02520 268 PRO   A CG  
3870 C CD  . PRO   A 263 ? 0.15860 0.26830 0.20470 -0.03690 0.01470  -0.03570 268 PRO   A CD  
3878 N N   . ASN   A 264 ? 0.11690 0.23450 0.21020 -0.00120 -0.00280 0.02160  269 ASN   A N   
3879 C CA  . ASN   A 264 ? 0.12720 0.24390 0.23340 -0.02120 0.01630  0.02410  269 ASN   A CA  
3880 C C   . ASN   A 264 ? 0.11020 0.24390 0.23840 -0.00690 -0.00070 0.01730  269 ASN   A C   
3881 O O   . ASN   A 264 ? 0.11100 0.25660 0.22680 0.00440  0.00450  0.00950  269 ASN   A O   
3882 C CB  . ASN   A 264 ? 0.15920 0.27500 0.24340 -0.03420 0.00980  0.00970  269 ASN   A CB  
3883 C CG  . ASN   A 264 ? 0.22330 0.30210 0.27400 -0.05120 0.00720  0.00450  269 ASN   A CG  
3884 O OD1 . ASN   A 264 ? 0.25630 0.30480 0.26900 -0.08750 -0.02330 0.02290  269 ASN   A OD1 
3885 N ND2 . ASN   A 264 ? 0.25730 0.32250 0.31110 -0.03820 0.00910  -0.03650 269 ASN   A ND2 
3892 N N   . LYS   A 265 ? 0.10470 0.23260 0.23980 -0.00250 0.00980  0.02690  270 LYS   A N   
3893 C CA  . LYS   A 265 ? 0.12540 0.25780 0.23160 -0.01550 -0.01000 0.02220  270 LYS   A CA  
3894 C C   . LYS   A 265 ? 0.14230 0.26460 0.24220 -0.00250 -0.01370 0.02790  270 LYS   A C   
3895 O O   . LYS   A 265 ? 0.14320 0.27580 0.24940 -0.00510 -0.01210 0.01670  270 LYS   A O   
3896 C CB  . LYS   A 265 ? 0.14060 0.27450 0.20640 -0.02350 0.00530  0.01790  270 LYS   A CB  
3897 C CG  . LYS   A 265 ? 0.18020 0.27880 0.22970 -0.03100 -0.00170 0.01190  270 LYS   A CG  
3898 C CD  . LYS   A 265 ? 0.24130 0.29420 0.23390 -0.05260 0.01040  0.00290  270 LYS   A CD  
3899 C CE  . LYS   A 265 ? 0.29250 0.30220 0.26900 -0.07240 0.05630  0.00400  270 LYS   A CE  
3900 N NZ  . LYS   A 265 ? 0.37210 0.31350 0.30670 -0.08620 0.07860  -0.00240 270 LYS   A NZ  
3914 N N   . ASP   A 266 ? 0.12380 0.28700 0.26680 0.00660  0.00230  0.02510  271 ASP   A N   
3915 C CA  . ASP   A 266 ? 0.13000 0.29830 0.31710 0.00700  0.01180  0.02320  271 ASP   A CA  
3916 C C   . ASP   A 266 ? 0.11940 0.28920 0.27900 -0.00580 0.02560  -0.00100 271 ASP   A C   
3917 O O   . ASP   A 266 ? 0.13590 0.29930 0.30380 0.01240  0.02840  -0.01610 271 ASP   A O   
3918 C CB  . ASP   A 266 ? 0.17230 0.31730 0.41250 0.03130  0.01670  0.05100  271 ASP   A CB  
3919 C CG  . ASP   A 266 ? 0.25440 0.33470 0.50790 0.02810  0.02870  0.05460  271 ASP   A CG  
3920 O OD1 . ASP   A 266 ? 0.29010 0.35190 0.54910 -0.00120 0.00820  0.02160  271 ASP   A OD1 
3921 O OD2 . ASP   A 266 ? 0.33380 0.35660 0.56000 0.02610  0.04560  0.05040  271 ASP   A OD2 
3926 N N   . ASP   A 267 ? 0.13570 0.27870 0.27260 -0.00560 0.02660  -0.00120 272 ASP   A N   
3927 C CA  . ASP   A 267 ? 0.12450 0.28610 0.26730 -0.01890 -0.01060 -0.00310 272 ASP   A CA  
3928 C C   . ASP   A 267 ? 0.12270 0.29500 0.31450 -0.02270 0.00980  0.02610  272 ASP   A C   
3929 O O   . ASP   A 267 ? 0.15970 0.30120 0.31250 -0.03620 -0.01400 0.02240  272 ASP   A O   
3930 C CB  . ASP   A 267 ? 0.15210 0.29420 0.26200 -0.00070 -0.00230 0.00180  272 ASP   A CB  
3931 C CG  . ASP   A 267 ? 0.17730 0.29730 0.25660 0.00690  0.00770  -0.01160 272 ASP   A CG  
3932 O OD1 . ASP   A 267 ? 0.20240 0.31280 0.29390 0.01430  -0.01270 -0.00530 272 ASP   A OD1 
3933 O OD2 . ASP   A 267 ? 0.14620 0.29390 0.24290 -0.00580 0.01570  -0.01910 272 ASP   A OD2 
3938 N N   . LYS   A 268 ? 0.13140 0.31000 0.37070 -0.02250 0.01200  0.04640  273 LYS   A N   
3939 C CA  . LYS   A 268 ? 0.14120 0.32300 0.39370 -0.01100 0.01010  0.04420  273 LYS   A CA  
3940 C C   . LYS   A 268 ? 0.14170 0.31490 0.31760 -0.00610 0.00360  0.02410  273 LYS   A C   
3941 O O   . LYS   A 268 ? 0.17870 0.31930 0.27290 -0.02230 0.01450  0.01690  273 LYS   A O   
3942 C CB  . LYS   A 268 ? 0.16500 0.35060 0.48780 -0.02870 -0.00500 0.05230  273 LYS   A CB  
3943 C CG  . LYS   A 268 ? 0.23420 0.38450 0.54590 -0.01870 -0.02410 0.05460  273 LYS   A CG  
3944 C CD  . LYS   A 268 ? 0.31810 0.41020 0.58940 -0.00970 -0.03350 0.05990  273 LYS   A CD  
3945 C CE  . LYS   A 268 ? 0.38320 0.42300 0.62350 -0.01430 -0.03550 0.06280  273 LYS   A CE  
3946 N NZ  . LYS   A 268 ? 0.41910 0.43550 0.64610 -0.00720 -0.03680 0.07000  273 LYS   A NZ  
3960 N N   . HIS   A 269 ? 0.14020 0.31040 0.27840 -0.00450 0.00370  0.01000  274 HIS   A N   
3961 C CA  . HIS   A 269 ? 0.13530 0.32100 0.24890 -0.00150 0.03050  0.00110  274 HIS   A CA  
3962 C C   . HIS   A 269 ? 0.13160 0.30930 0.26000 0.00590  0.02390  0.00750  274 HIS   A C   
3963 O O   . HIS   A 269 ? 0.14260 0.31090 0.28820 0.00010  0.03120  0.01930  274 HIS   A O   
3964 C CB  . HIS   A 269 ? 0.14820 0.33390 0.23380 0.00710  0.02400  -0.01330 274 HIS   A CB  
3965 C CG  . HIS   A 269 ? 0.15630 0.34480 0.23690 0.00410  0.00680  0.00620  274 HIS   A CG  
3966 N ND1 . HIS   A 269 ? 0.19940 0.35840 0.26270 -0.00490 -0.02360 0.00460  274 HIS   A ND1 
3967 C CD2 . HIS   A 269 ? 0.15720 0.35390 0.26330 0.00220  -0.01560 -0.01210 274 HIS   A CD2 
3968 C CE1 . HIS   A 269 ? 0.21430 0.35990 0.27550 -0.01180 -0.02620 -0.00120 274 HIS   A CE1 
3969 N NE2 . HIS   A 269 ? 0.18420 0.35710 0.25810 -0.00040 -0.02110 -0.01640 274 HIS   A NE2 
3978 N N   . SER   A 270 ? 0.14370 0.30330 0.24630 0.00410  0.03860  0.01230  275 SER   A N   
3979 C CA  . SER   A 270 ? 0.13610 0.30010 0.24570 0.00050  0.01740  -0.00560 275 SER   A CA  
3980 C C   . SER   A 270 ? 0.11940 0.29660 0.25790 0.00030  0.02400  0.00820  275 SER   A C   
3981 O O   . SER   A 270 ? 0.11540 0.29390 0.27670 0.00640  0.00330  0.01180  275 SER   A O   
3982 C CB  . SER   A 270 ? 0.15730 0.30480 0.25710 -0.00390 0.02050  -0.00420 275 SER   A CB  
3983 O OG  . SER   A 270 ? 0.19780 0.31720 0.25280 -0.01080 0.06480  -0.01660 275 SER   A OG  
3989 N N   . GLU   A 271 ? 0.12080 0.29150 0.24790 -0.01460 0.01330  -0.00140 276 GLU   A N   
3990 C CA  . GLU   A 271 ? 0.10560 0.29330 0.26130 -0.00440 0.00200  0.00420  276 GLU   A CA  
3991 C C   . GLU   A 271 ? 0.10950 0.29520 0.25460 0.01060  0.00780  0.00960  276 GLU   A C   
3992 O O   . GLU   A 271 ? 0.11350 0.28890 0.26900 0.00240  0.00900  0.00720  276 GLU   A O   
3993 C CB  . GLU   A 271 ? 0.12900 0.31180 0.27010 -0.00620 0.01390  0.00090  276 GLU   A CB  
3994 C CG  . GLU   A 271 ? 0.13670 0.31420 0.28660 -0.00120 0.02720  -0.00130 276 GLU   A CG  
3995 C CD  . GLU   A 271 ? 0.12720 0.31480 0.26240 0.01230  0.02060  -0.00400 276 GLU   A CD  
3996 O OE1 . GLU   A 271 ? 0.14690 0.33800 0.27750 0.02260  0.00710  -0.00090 276 GLU   A OE1 
3997 O OE2 . GLU   A 271 ? 0.12460 0.31270 0.27020 0.00700  -0.00580 0.00090  276 GLU   A OE2 
4004 N N   . ALA   A 272 ? 0.13570 0.31050 0.25550 0.02260  0.02620  0.01730  277 ALA   A N   
4005 C CA  . ALA   A 272 ? 0.14800 0.32190 0.24680 0.02660  0.01900  0.01360  277 ALA   A CA  
4006 C C   . ALA   A 272 ? 0.14190 0.31700 0.24770 0.02470  0.03050  0.00070  277 ALA   A C   
4007 O O   . ALA   A 272 ? 0.13650 0.30770 0.23980 0.02160  0.03140  0.00330  277 ALA   A O   
4008 C CB  . ALA   A 272 ? 0.18250 0.34400 0.26450 0.02560  0.01190  0.03150  277 ALA   A CB  
4014 N N   . VAL   A 273 ? 0.14500 0.31670 0.24620 0.00800  0.01470  0.00270  278 VAL   A N   
4015 C CA  . VAL   A 273 ? 0.14530 0.31900 0.26690 0.00330  0.00700  -0.01290 278 VAL   A CA  
4016 C C   . VAL   A 273 ? 0.13430 0.32010 0.23680 0.00410  0.00970  -0.02090 278 VAL   A C   
4017 O O   . VAL   A 273 ? 0.13800 0.32430 0.22980 -0.00760 0.00730  -0.00120 278 VAL   A O   
4018 C CB  . VAL   A 273 ? 0.18950 0.32310 0.32810 -0.01410 -0.00490 -0.00260 278 VAL   A CB  
4019 C CG1 . VAL   A 273 ? 0.22040 0.32900 0.38280 -0.03070 -0.00240 0.01350  278 VAL   A CG1 
4020 C CG2 . VAL   A 273 ? 0.20970 0.34050 0.35310 -0.02220 -0.03760 0.00350  278 VAL   A CG2 
4030 N N   . ILE   A 274 ? 0.11210 0.31590 0.21400 0.01300  0.01810  -0.01210 279 ILE   A N   
4031 C CA  . ILE   A 274 ? 0.11950 0.30950 0.22160 0.00780  0.01000  -0.01290 279 ILE   A CA  
4032 C C   . ILE   A 274 ? 0.10610 0.30570 0.22690 0.00040  0.01130  -0.00320 279 ILE   A C   
4033 O O   . ILE   A 274 ? 0.11830 0.30230 0.21710 0.00080  0.01090  0.00880  279 ILE   A O   
4034 C CB  . ILE   A 274 ? 0.11830 0.30290 0.23050 0.00810  0.00800  0.00140  279 ILE   A CB  
4035 C CG1 . ILE   A 274 ? 0.10530 0.29210 0.23580 0.01250  0.01240  0.00470  279 ILE   A CG1 
4036 C CG2 . ILE   A 274 ? 0.11150 0.31080 0.23540 -0.01680 0.00590  0.02000  279 ILE   A CG2 
4037 C CD1 . ILE   A 274 ? 0.13720 0.27910 0.23510 0.02560  0.03190  0.01000  279 ILE   A CD1 
4049 N N   . ALA   A 275 ? 0.11510 0.30910 0.22700 -0.00870 0.02110  -0.00770 280 ALA   A N   
4050 C CA  . ALA   A 275 ? 0.10780 0.30740 0.21470 -0.01230 0.00770  -0.00470 280 ALA   A CA  
4051 C C   . ALA   A 275 ? 0.11340 0.31680 0.20900 0.00010  0.01630  0.00320  280 ALA   A C   
4052 O O   . ALA   A 275 ? 0.13070 0.33200 0.19730 -0.01150 0.01010  0.01100  280 ALA   A O   
4053 C CB  . ALA   A 275 ? 0.11550 0.31050 0.23820 -0.02980 0.00870  -0.00000 280 ALA   A CB  
4059 N N   . ALA   A 276 ? 0.10230 0.32860 0.22120 0.01120  0.01830  -0.00010 281 ALA   A N   
4060 C CA  . ALA   A 276 ? 0.13010 0.32780 0.21750 0.00740  0.01550  0.00280  281 ALA   A CA  
4061 C C   . ALA   A 276 ? 0.11840 0.32240 0.21050 -0.01060 0.01340  0.00240  281 ALA   A C   
4062 O O   . ALA   A 276 ? 0.13550 0.33370 0.21930 -0.00380 0.01930  -0.00030 281 ALA   A O   
4063 C CB  . ALA   A 276 ? 0.14020 0.33410 0.22800 0.01170  0.02630  -0.00020 281 ALA   A CB  
4069 N N   . ALA   A 277 ? 0.11540 0.32820 0.20950 -0.01950 0.02020  -0.00430 282 ALA   A N   
4070 C CA  . ALA   A 277 ? 0.12750 0.32900 0.20810 -0.00320 0.00570  -0.01190 282 ALA   A CA  
4071 C C   . ALA   A 277 ? 0.12450 0.32970 0.20360 0.00700  0.01600  0.00680  282 ALA   A C   
4072 O O   . ALA   A 277 ? 0.11760 0.33050 0.20810 0.01730  0.00260  0.00380  282 ALA   A O   
4073 C CB  . ALA   A 277 ? 0.12050 0.32780 0.22910 -0.01490 0.02540  0.00600  282 ALA   A CB  
4079 N N   . ALA   A 278 ? 0.11000 0.31990 0.19930 0.01200  0.00280  -0.00270 283 ALA   A N   
4080 C CA  . ALA   A 278 ? 0.12720 0.32230 0.21740 0.00010  0.00750  0.00820  283 ALA   A CA  
4081 C C   . ALA   A 278 ? 0.13770 0.33020 0.20640 0.00340  0.00530  0.02150  283 ALA   A C   
4082 O O   . ALA   A 278 ? 0.14580 0.33110 0.21020 -0.00260 0.00990  0.02400  283 ALA   A O   
4083 C CB  . ALA   A 278 ? 0.14400 0.31600 0.24200 -0.01650 0.00960  0.02980  283 ALA   A CB  
4089 N N   A ARG   A 279 ? 0.13460 0.33490 0.21370 -0.00380 0.01820  0.01180  284 ARG   A N   
4090 N N   B ARG   A 279 ? 0.12700 0.33220 0.21950 -0.00330 0.00800  0.01230  284 ARG   A N   
4091 C CA  A ARG   A 279 ? 0.15300 0.34810 0.21590 -0.00210 0.03710  0.00720  284 ARG   A CA  
4092 C CA  B ARG   A 279 ? 0.14680 0.34610 0.22810 0.00300  0.01660  0.01010  284 ARG   A CA  
4093 C C   A ARG   A 279 ? 0.13990 0.34740 0.22450 -0.00500 0.03750  0.01300  284 ARG   A C   
4094 C C   B ARG   A 279 ? 0.13930 0.34810 0.23110 -0.00090 0.03090  0.01550  284 ARG   A C   
4095 O O   A ARG   A 279 ? 0.14380 0.35380 0.23630 -0.00340 0.04340  0.01530  284 ARG   A O   
4096 O O   B ARG   A 279 ? 0.15190 0.35720 0.24390 0.00190  0.03890  0.02100  284 ARG   A O   
4097 C CB  A ARG   A 279 ? 0.16390 0.36200 0.22840 -0.00610 0.06220  0.00070  284 ARG   A CB  
4098 C CB  B ARG   A 279 ? 0.15020 0.35830 0.25670 0.00290  0.02120  0.00650  284 ARG   A CB  
4099 C CG  A ARG   A 279 ? 0.18370 0.36940 0.23520 0.00370  0.09430  0.00270  284 ARG   A CG  
4100 C CG  B ARG   A 279 ? 0.16260 0.36230 0.27570 0.02590  0.02900  0.01310  284 ARG   A CG  
4101 C CD  A ARG   A 279 ? 0.22200 0.38440 0.27230 0.00460  0.08720  0.00580  284 ARG   A CD  
4102 C CD  B ARG   A 279 ? 0.18070 0.36620 0.28480 0.03130  0.02080  0.02170  284 ARG   A CD  
4103 N NE  A ARG   A 279 ? 0.25780 0.39900 0.32200 -0.00070 0.08060  -0.00220 284 ARG   A NE  
4104 N NE  B ARG   A 279 ? 0.19490 0.37200 0.31350 0.02350  0.01220  0.03900  284 ARG   A NE  
4105 C CZ  A ARG   A 279 ? 0.31090 0.41190 0.35690 0.00160  0.05690  -0.01580 284 ARG   A CZ  
4106 C CZ  B ARG   A 279 ? 0.19640 0.37160 0.30570 0.01210  0.02950  0.04890  284 ARG   A CZ  
4107 N NH1 A ARG   A 279 ? 0.32950 0.41850 0.38220 0.00660  0.04560  -0.02050 284 ARG   A NH1 
4108 N NH1 B ARG   A 279 ? 0.15880 0.37770 0.29250 0.03330  0.05020  0.06290  284 ARG   A NH1 
4109 N NH2 A ARG   A 279 ? 0.33540 0.41710 0.37250 -0.00170 0.05850  -0.01900 284 ARG   A NH2 
4110 N NH2 B ARG   A 279 ? 0.22510 0.36930 0.32940 -0.00890 0.02270  0.02510  284 ARG   A NH2 
4137 N N   . LEU   A 280 ? 0.13180 0.34200 0.21920 -0.01000 0.02600  0.01020  285 LEU   A N   
4138 C CA  . LEU   A 280 ? 0.15320 0.34710 0.21900 -0.00110 0.02130  0.01170  285 LEU   A CA  
4139 C C   . LEU   A 280 ? 0.13800 0.35450 0.21530 0.00380  0.01520  0.00300  285 LEU   A C   
4140 O O   . LEU   A 280 ? 0.15610 0.35530 0.21040 -0.00760 0.02320  0.01480  285 LEU   A O   
4141 C CB  . LEU   A 280 ? 0.16770 0.35520 0.22110 -0.00320 0.00800  -0.00430 285 LEU   A CB  
4142 C CG  . LEU   A 280 ? 0.17980 0.36550 0.24260 -0.00750 0.00190  -0.02510 285 LEU   A CG  
4143 C CD1 . LEU   A 280 ? 0.17680 0.36140 0.25640 -0.00630 0.00070  -0.00100 285 LEU   A CD1 
4144 C CD2 . LEU   A 280 ? 0.20920 0.37480 0.23710 -0.00170 0.02740  -0.04480 285 LEU   A CD2 
4157 N N   . ALA   A 281 ? 0.12950 0.35810 0.23590 -0.00080 0.00640  -0.00010 286 ALA   A N   
4158 C CA  . ALA   A 281 ? 0.15160 0.35440 0.23610 0.01450  0.03080  0.00420  286 ALA   A CA  
4159 C C   . ALA   A 281 ? 0.15870 0.35170 0.23450 -0.00180 0.00600  0.01680  286 ALA   A C   
4160 O O   . ALA   A 281 ? 0.16220 0.35840 0.23490 0.00100  0.00360  0.01230  286 ALA   A O   
4161 C CB  . ALA   A 281 ? 0.15660 0.36470 0.23620 -0.00350 0.01980  -0.00690 286 ALA   A CB  
4167 N N   . LEU   A 282 ? 0.15400 0.35030 0.24290 -0.01640 0.00170  0.02610  287 LEU   A N   
4168 C CA  . LEU   A 282 ? 0.16520 0.37500 0.24930 -0.02620 -0.00070 0.02370  287 LEU   A CA  
4169 C C   . LEU   A 282 ? 0.16390 0.38910 0.24250 -0.02090 0.01790  0.02100  287 LEU   A C   
4170 O O   . LEU   A 282 ? 0.18200 0.40680 0.26680 -0.02630 0.01710  0.02330  287 LEU   A O   
4171 C CB  . LEU   A 282 ? 0.19540 0.38650 0.29700 -0.01150 -0.02080 0.01770  287 LEU   A CB  
4172 C CG  . LEU   A 282 ? 0.21920 0.39910 0.33010 -0.00290 -0.04770 0.00580  287 LEU   A CG  
4173 C CD1 . LEU   A 282 ? 0.22650 0.40610 0.37680 -0.01120 -0.04660 0.00350  287 LEU   A CD1 
4174 C CD2 . LEU   A 282 ? 0.23150 0.40640 0.33550 0.00080  -0.04250 0.00060  287 LEU   A CD2 
4186 N N   . GLU   A 283 ? 0.15490 0.39490 0.24950 -0.01060 0.02640  0.02260  288 GLU   A N   
4187 C CA  . GLU   A 283 ? 0.18350 0.40200 0.25480 -0.00590 0.04320  0.03560  288 GLU   A CA  
4188 C C   . GLU   A 283 ? 0.18540 0.39620 0.24360 -0.01370 0.02970  0.02970  288 GLU   A C   
4189 O O   . GLU   A 283 ? 0.20230 0.39430 0.23780 -0.01670 0.03440  0.02420  288 GLU   A O   
4190 C CB  . GLU   A 283 ? 0.19440 0.41590 0.27610 0.02090  0.04690  0.03310  288 GLU   A CB  
4191 C CG  . GLU   A 283 ? 0.23610 0.44440 0.36060 0.03290  0.04000  0.02580  288 GLU   A CG  
4192 C CD  . GLU   A 283 ? 0.28020 0.48360 0.46230 0.03300  0.03430  0.00160  288 GLU   A CD  
4193 O OE1 . GLU   A 283 ? 0.31290 0.49820 0.50470 0.01540  0.06180  -0.00020 288 GLU   A OE1 
4194 O OE2 . GLU   A 283 ? 0.31430 0.50270 0.51130 0.04430  0.01130  -0.00460 288 GLU   A OE2 
4201 N N   . GLY   A 284 ? 0.15830 0.39050 0.22800 -0.03040 0.02900  0.05090  289 GLY   A N   
4202 C CA  . GLY   A 284 ? 0.17980 0.38840 0.22230 -0.01770 0.02290  0.03740  289 GLY   A CA  
4203 C C   . GLY   A 284 ? 0.19000 0.40080 0.24380 -0.01760 0.01930  0.03630  289 GLY   A C   
4204 O O   . GLY   A 284 ? 0.22510 0.40880 0.25640 -0.00440 0.00380  0.03610  289 GLY   A O   
4208 N N   . LEU   A 285 ? 0.20650 0.39770 0.23360 -0.02940 0.03430  0.02960  290 LEU   A N   
4209 C CA  . LEU   A 285 ? 0.22200 0.38890 0.24770 -0.03780 0.03800  0.04070  290 LEU   A CA  
4210 C C   . LEU   A 285 ? 0.24170 0.40160 0.26820 -0.04790 0.03730  0.06290  290 LEU   A C   
4211 O O   . LEU   A 285 ? 0.24610 0.40330 0.28420 -0.04820 0.03930  0.06020  290 LEU   A O   
4212 C CB  . LEU   A 285 ? 0.18750 0.37340 0.25200 -0.03690 0.01980  0.04270  290 LEU   A CB  
4213 C CG  . LEU   A 285 ? 0.17040 0.35690 0.26780 -0.01720 0.02340  0.03320  290 LEU   A CG  
4214 C CD1 . LEU   A 285 ? 0.16790 0.35360 0.27360 -0.02100 0.02450  0.03120  290 LEU   A CD1 
4215 C CD2 . LEU   A 285 ? 0.17750 0.34910 0.29310 -0.01300 0.00760  0.03770  290 LEU   A CD2 
4227 N N   . GLY   A 286 ? 0.25680 0.41790 0.27470 -0.05860 0.04880  0.07410  291 GLY   A N   
4228 C CA  . GLY   A 286 ? 0.25950 0.45070 0.28250 -0.06790 0.03970  0.06900  291 GLY   A CA  
4229 C C   . GLY   A 286 ? 0.25790 0.47880 0.32700 -0.06440 0.03590  0.07030  291 GLY   A C   
4230 O O   . GLY   A 286 ? 0.27760 0.48730 0.35560 -0.09040 0.03440  0.06810  291 GLY   A O   
4234 N N   . VAL   A 287 ? 0.24590 0.50420 0.35370 -0.04810 0.01420  0.06050  292 VAL   A N   
4235 C CA  . VAL   A 287 ? 0.26240 0.51570 0.42320 -0.02530 0.00050  0.04710  292 VAL   A CA  
4236 C C   . VAL   A 287 ? 0.24410 0.51450 0.46970 0.00770  0.00320  0.03150  292 VAL   A C   
4237 O O   . VAL   A 287 ? 0.23520 0.51500 0.50100 0.02460  -0.02670 0.02880  292 VAL   A O   
4238 C CB  . VAL   A 287 ? 0.27850 0.51980 0.43430 -0.04000 0.00630  0.05990  292 VAL   A CB  
4239 C CG1 . VAL   A 287 ? 0.28770 0.52880 0.44590 -0.02190 -0.00730 0.06490  292 VAL   A CG1 
4240 C CG2 . VAL   A 287 ? 0.29710 0.51800 0.43510 -0.04890 0.00980  0.06730  292 VAL   A CG2 
4250 N N   . ASN   A 288 ? 0.26230 0.51510 0.49160 0.03100  0.00210  0.00430  293 ASN   A N   
4251 C CA  . ASN   A 288 ? 0.26390 0.50970 0.48240 0.04720  -0.01350 -0.00850 293 ASN   A CA  
4252 C C   . ASN   A 288 ? 0.27840 0.50060 0.48230 0.05600  -0.04910 -0.01190 293 ASN   A C   
4253 O O   . ASN   A 288 ? 0.30180 0.50240 0.50310 0.04300  -0.05480 -0.01550 293 ASN   A O   
4254 C CB  . ASN   A 288 ? 0.24190 0.51130 0.47860 0.04950  -0.00340 -0.02370 293 ASN   A CB  
4255 C CG  . ASN   A 288 ? 0.23580 0.52000 0.46860 0.03110  0.00040  -0.04790 293 ASN   A CG  
4256 O OD1 . ASN   A 288 ? 0.30700 0.52690 0.51620 0.01390  -0.02630 -0.05770 293 ASN   A OD1 
4257 N ND2 . ASN   A 288 ? 0.13710 0.51320 0.40190 0.02870  0.01380  -0.05220 293 ASN   A ND2 
4264 N N   . GLY   A 289 ? 0.28850 0.49730 0.47510 0.07260  -0.04190 -0.01480 294 GLY   A N   
4265 C CA  . GLY   A 289 ? 0.31720 0.49860 0.48230 0.07710  -0.02180 -0.00200 294 GLY   A CA  
4266 C C   . GLY   A 289 ? 0.33810 0.50320 0.49960 0.05640  -0.00420 0.01450  294 GLY   A C   
4267 O O   . GLY   A 289 ? 0.35060 0.50880 0.51200 0.02890  0.02630  0.02170  294 GLY   A O   
4271 C C1  A GOL   B .   ? 0.35240 0.51320 0.45880 -0.07110 0.00430  0.01220  501 GOL   A C1  
4272 C C1  B GOL   B .   ? 0.38740 0.52780 0.47500 -0.04950 0.00720  0.01300  501 GOL   A C1  
4273 O O1  A GOL   B .   ? 0.35910 0.51430 0.46420 -0.07190 0.00210  0.00680  501 GOL   A O1  
4274 O O1  B GOL   B .   ? 0.40510 0.53050 0.48280 -0.04420 0.01910  0.01270  501 GOL   A O1  
4275 C C2  A GOL   B .   ? 0.33770 0.50960 0.44690 -0.07480 0.01470  0.01590  501 GOL   A C2  
4276 C C2  B GOL   B .   ? 0.36260 0.52500 0.46420 -0.05800 -0.00100 0.01230  501 GOL   A C2  
4277 O O2  A GOL   B .   ? 0.32380 0.50840 0.45440 -0.08100 0.01660  0.01000  501 GOL   A O2  
4278 O O2  B GOL   B .   ? 0.32780 0.51900 0.46760 -0.07500 0.00510  0.00140  501 GOL   A O2  
4279 C C3  A GOL   B .   ? 0.33030 0.50220 0.42620 -0.08190 0.02430  0.02500  501 GOL   A C3  
4280 C C3  B GOL   B .   ? 0.37440 0.52240 0.45020 -0.05850 -0.01560 0.02560  501 GOL   A C3  
4281 O O3  A GOL   B .   ? 0.32130 0.49770 0.41170 -0.08890 0.03810  0.03150  501 GOL   A O3  
4282 O O3  B GOL   B .   ? 0.37900 0.52470 0.43900 -0.05690 -0.01710 0.04090  501 GOL   A O3  
4289 O OAC A NXL   C .   ? 0.13270 0.27780 0.18230 0.02130  -0.02000 -0.00380 502 NXL   A OAC 
4290 C CAN A NXL   C .   ? 0.12260 0.27000 0.18600 0.01100  -0.00060 -0.00210 502 NXL   A CAN 
4291 N N   A NXL   C .   ? 0.12860 0.28490 0.18160 0.00590  -0.02580 0.01080  502 NXL   A N   
4292 C CAJ A NXL   C .   ? 0.15180 0.29910 0.23740 0.01710  -0.05380 0.02610  502 NXL   A CAJ 
4293 C CA  A NXL   C .   ? 0.15510 0.28720 0.21290 0.00520  -0.01500 0.02540  502 NXL   A CA  
4294 C C   A NXL   C .   ? 0.16070 0.29340 0.22980 -0.03810 0.00630  0.01800  502 NXL   A C   
4295 O O   A NXL   C .   ? 0.12970 0.28990 0.20350 -0.04360 -0.00740 0.00260  502 NXL   A O   
4296 N NAA A NXL   C .   ? 0.22150 0.31740 0.29080 -0.04110 0.02490  0.03850  502 NXL   A NAA 
4297 C CB  A NXL   C .   ? 0.19050 0.29540 0.27070 0.02320  -0.03090 0.02890  502 NXL   A CB  
4298 C CAH A NXL   C .   ? 0.23110 0.30880 0.30900 0.02250  -0.04740 0.02420  502 NXL   A CAH 
4299 C CAO A NXL   C .   ? 0.22580 0.31380 0.28120 0.02450  -0.04360 0.03890  502 NXL   A CAO 
4300 N NAK A NXL   C .   ? 0.27360 0.33640 0.29890 0.04140  -0.07500 0.03600  502 NXL   A NAK 
4301 O OAL A NXL   C .   ? 0.34690 0.34030 0.30090 0.00830  -0.06120 0.01800  502 NXL   A OAL 
4302 S SAR A NXL   C .   ? 0.37980 0.33950 0.26540 0.00150  -0.09150 0.03150  502 NXL   A SAR 
4303 O OAD A NXL   C .   ? 0.41820 0.36300 0.33720 0.02950  -0.08020 0.00900  502 NXL   A OAD 
4304 O OAE A NXL   C .   ? 0.41290 0.37560 0.29640 -0.01650 -0.07800 0.01320  502 NXL   A OAE 
4305 O OAG A NXL   C .   ? 0.39120 0.35060 0.26350 -0.00930 -0.08570 0.02980  502 NXL   A OAG 
4318 C C5  B A1H3M D .   ? 0.27250 0.28650 0.38150 -0.01000 -0.03710 -0.01790 503 A1H3M A C5  
4319 C C6  B A1H3M D .   ? 0.27350 0.28420 0.34080 -0.01130 -0.00350 -0.00180 503 A1H3M A C6  
4320 N N1  B A1H3M D .   ? 0.21330 0.28860 0.38410 -0.03210 -0.02750 -0.04190 503 A1H3M A N1  
4321 C C2  B A1H3M D .   ? 0.24370 0.28440 0.36940 -0.02260 -0.02750 -0.02050 503 A1H3M A C2  
4322 C C4  B A1H3M D .   ? 0.26320 0.28220 0.35690 -0.00050 -0.02500 -0.01090 503 A1H3M A C4  
4323 N N   B A1H3M D .   ? 0.20770 0.27340 0.28500 -0.00670 -0.01450 -0.01420 503 A1H3M A N   
4324 C C   B A1H3M D .   ? 0.16800 0.26330 0.23770 -0.00210 -0.00310 -0.00940 503 A1H3M A C   
4325 O O   B A1H3M D .   ? 0.17450 0.26620 0.23580 0.00070  -0.01630 -0.00550 503 A1H3M A O   
4326 C C1  B A1H3M D .   ? 0.21810 0.28000 0.32950 -0.01430 -0.02630 -0.01500 503 A1H3M A C1  
4327 C C3  B A1H3M D .   ? 0.24670 0.27790 0.32160 -0.00180 -0.01250 -0.00840 503 A1H3M A C3  
4328 N N2  B A1H3M D .   ? 0.31070 0.29720 0.37650 -0.00960 0.01210  0.01060  503 A1H3M A N2  
4329 O O1  B A1H3M D .   ? 0.26810 0.28370 0.32550 -0.01360 -0.01060 -0.00350 503 A1H3M A O1  
4340 S S   . SO4   E .   ? 0.23910 0.41200 0.45900 0.05510  0.02630  0.01720  504 SO4   A S   
4341 O O1  . SO4   E .   ? 0.32170 0.42760 0.50070 0.06770  0.04500  -0.03220 504 SO4   A O1  
4342 O O2  . SO4   E .   ? 0.27560 0.40580 0.39040 0.07930  0.04450  0.04370  504 SO4   A O2  
4343 O O3  . SO4   E .   ? 0.24630 0.44280 0.50380 0.07380  0.04230  0.03020  504 SO4   A O3  
4344 O O4  . SO4   E .   ? 0.21180 0.38300 0.39210 0.05340  0.01190  0.00760  504 SO4   A O4  
4345 S S   B SO4   F .   ? 0.07350 0.27800 0.18720 -0.01940 0.01290  0.00740  505 SO4   A S   
4346 O O1  B SO4   F .   ? 0.13970 0.30000 0.22190 -0.01650 0.01310  -0.01110 505 SO4   A O1  
4347 O O2  B SO4   F .   ? 0.08570 0.30670 0.22970 -0.03280 -0.00740 0.03290  505 SO4   A O2  
4348 O O3  B SO4   F .   ? 0.14500 0.31470 0.22020 -0.01800 -0.03260 0.00150  505 SO4   A O3  
4349 O O4  B SO4   F .   ? 0.12920 0.32020 0.22730 0.00760  0.00580  -0.00680 505 SO4   A O4  
4350 O O   . HOH   G .   ? 0.64690 0.62540 0.68920 -0.10240 -0.02400 0.02550  601 HOH   A O   
4351 O O   . HOH   G .   ? 0.20150 0.62890 0.66000 -0.01410 0.01610  -0.01100 602 HOH   A O   
4352 O O   . HOH   G .   ? 0.31500 0.59180 0.68020 -0.10680 0.05590  -0.12580 603 HOH   A O   
4353 O O   . HOH   G .   ? 0.64230 0.51190 0.38010 -0.13140 0.01890  0.17610  604 HOH   A O   
4354 O O   . HOH   G .   ? 0.44760 0.54180 0.77340 0.14050  0.30150  0.13720  605 HOH   A O   
4355 O O   . HOH   G .   ? 0.47760 0.71610 0.36920 0.02110  0.09940  0.14740  606 HOH   A O   
4356 O O   C HOH   G .   ? 0.31340 0.39700 0.42180 -0.04550 -0.05010 0.00750  607 HOH   A O   
4357 O O   . HOH   G .   ? 0.44560 0.90180 0.43460 0.08660  -0.04710 -0.23060 608 HOH   A O   
4358 O O   . HOH   G .   ? 0.78110 0.32740 0.55990 0.12320  -0.11180 0.05900  609 HOH   A O   
4359 O O   . HOH   G .   ? 0.74930 0.59200 0.54040 0.07650  -0.08400 -0.15910 610 HOH   A O   
4360 O O   . HOH   G .   ? 0.29260 0.33450 0.37830 -0.01410 -0.02600 0.08750  611 HOH   A O   
4361 O O   . HOH   G .   ? 0.67500 0.47120 0.51510 0.17540  0.22940  -0.02750 612 HOH   A O   
4362 O O   . HOH   G .   ? 0.54890 1.00530 0.29420 0.24100  0.00030  -0.08250 613 HOH   A O   
4363 O O   . HOH   G .   ? 0.44870 0.54300 0.60070 0.03100  -0.06330 -0.06330 614 HOH   A O   
4364 O O   . HOH   G .   ? 0.63940 0.67510 0.62350 -0.04750 -0.25470 0.23790  615 HOH   A O   
4365 O O   . HOH   G .   ? 0.34340 0.45870 0.60840 -0.11190 -0.11040 0.24210  616 HOH   A O   
4366 O O   . HOH   G .   ? 0.13210 0.30340 0.21210 -0.01590 0.02040  -0.01320 617 HOH   A O   
4367 O O   . HOH   G .   ? 0.37430 0.77860 0.34110 0.02050  0.09990  0.03810  618 HOH   A O   
4368 O O   . HOH   G .   ? 0.25320 0.31300 0.34820 0.03110  -0.04060 -0.01060 619 HOH   A O   
4369 O O   . HOH   G .   ? 0.13380 0.27420 0.22340 -0.02750 0.01200  0.02710  620 HOH   A O   
4370 O O   . HOH   G .   ? 0.27390 0.54220 0.57010 -0.02040 -0.00210 0.13110  621 HOH   A O   
4371 O O   . HOH   G .   ? 0.70320 0.69460 0.41540 0.03180  0.01390  -0.15200 622 HOH   A O   
4372 O O   . HOH   G .   ? 0.30410 0.57870 0.52930 -0.12930 -0.05050 0.07610  623 HOH   A O   
4373 O O   . HOH   G .   ? 0.20920 0.48300 0.69860 0.00340  0.11670  0.03870  624 HOH   A O   
4374 O O   . HOH   G .   ? 0.22900 0.56150 0.26830 -0.02980 0.04210  0.10320  625 HOH   A O   
4375 O O   . HOH   G .   ? 0.66240 0.78760 0.60910 -0.10010 0.27130  0.09150  626 HOH   A O   
4376 O O   . HOH   G .   ? 0.15610 0.60150 0.37840 -0.03390 0.01250  -0.04370 627 HOH   A O   
4377 O O   A HOH   G .   ? 0.69850 0.51700 0.56300 -0.31410 -0.08800 0.12840  628 HOH   A O   
4378 O O   . HOH   G .   ? 0.63620 0.41770 0.75250 -0.08620 0.26190  -0.01090 629 HOH   A O   
4379 O O   . HOH   G .   ? 0.49550 0.34510 0.41880 0.02720  0.11080  0.09800  630 HOH   A O   
4380 O O   . HOH   G .   ? 0.52480 0.45470 0.69310 -0.10180 0.32990  -0.00410 631 HOH   A O   
4381 O O   . HOH   G .   ? 0.15350 0.25450 0.24270 -0.00040 0.00450  -0.00780 632 HOH   A O   
4382 O O   . HOH   G .   ? 0.50820 0.53320 0.52790 -0.14700 -0.08910 -0.05000 633 HOH   A O   
4383 O O   . HOH   G .   ? 0.51680 0.55620 0.71560 0.24810  -0.25030 -0.29740 634 HOH   A O   
4384 O O   . HOH   G .   ? 0.34190 0.60150 0.57910 -0.03590 0.00150  -0.15150 635 HOH   A O   
4385 O O   . HOH   G .   ? 0.30670 0.54390 0.47110 -0.04660 0.06120  0.01360  636 HOH   A O   
4386 O O   . HOH   G .   ? 0.19520 0.37660 0.33480 0.05210  -0.00080 0.09770  637 HOH   A O   
4387 O O   . HOH   G .   ? 0.69970 0.73110 0.74980 0.07880  -0.23900 0.02730  638 HOH   A O   
4388 O O   . HOH   G .   ? 0.17000 0.37430 0.24600 -0.03200 0.01200  0.00340  639 HOH   A O   
4389 O O   . HOH   G .   ? 0.18160 0.64680 0.29260 -0.07160 0.02890  0.00130  640 HOH   A O   
4390 O O   . HOH   G .   ? 0.18320 0.54880 0.31540 -0.00590 0.00680  -0.06890 641 HOH   A O   
4391 O O   . HOH   G .   ? 0.23340 0.85990 0.30160 -0.04580 0.02090  0.08240  642 HOH   A O   
4392 O O   . HOH   G .   ? 0.27480 0.45450 0.37790 0.05390  -0.09400 -0.13970 643 HOH   A O   
4393 O O   . HOH   G .   ? 0.51180 0.61170 0.63850 -0.22800 0.07430  -0.01350 644 HOH   A O   
4394 O O   . HOH   G .   ? 0.24740 0.42760 0.43590 -0.05470 -0.10190 0.03530  645 HOH   A O   
4395 O O   . HOH   G .   ? 0.52360 0.50030 0.37560 0.10000  -0.09670 0.00580  646 HOH   A O   
4396 O O   . HOH   G .   ? 0.32880 0.34630 0.37160 0.05720  -0.12000 -0.00370 647 HOH   A O   
4397 O O   . HOH   G .   ? 0.11800 0.24310 0.22740 -0.01970 0.01110  -0.00610 648 HOH   A O   
4398 O O   . HOH   G .   ? 0.27340 0.54200 0.41250 -0.19580 -0.02990 0.08810  649 HOH   A O   
4399 O O   . HOH   G .   ? 0.16330 0.33830 0.50890 0.00400  -0.05220 0.05530  650 HOH   A O   
4400 O O   . HOH   G .   ? 0.28280 0.42360 0.33070 -0.04820 -0.02030 -0.09440 651 HOH   A O   
4401 O O   . HOH   G .   ? 0.47260 0.53090 0.54740 -0.00960 0.20940  -0.07020 652 HOH   A O   
4402 O O   . HOH   G .   ? 0.73920 0.62730 0.45700 -0.07960 0.02530  -0.15940 653 HOH   A O   
4403 O O   . HOH   G .   ? 0.40790 0.40300 0.32390 0.07410  0.02010  -0.03640 654 HOH   A O   
4404 O O   . HOH   G .   ? 0.18040 0.34040 0.34040 0.00560  -0.00510 0.01940  655 HOH   A O   
4405 O O   . HOH   G .   ? 0.28620 0.21050 0.33800 -0.00340 -0.10540 -0.03260 656 HOH   A O   
4406 O O   . HOH   G .   ? 0.29750 0.45090 0.69270 -0.17900 -0.00430 -0.05420 657 HOH   A O   
4407 O O   . HOH   G .   ? 0.16790 0.41350 0.25190 -0.01770 -0.00080 -0.01160 658 HOH   A O   
4408 O O   . HOH   G .   ? 0.24430 0.55610 0.43420 -0.08880 0.05930  -0.02170 659 HOH   A O   
4409 O O   . HOH   G .   ? 0.36240 0.36400 0.33810 -0.06210 -0.05320 0.03180  660 HOH   A O   
4410 O O   . HOH   G .   ? 0.28980 0.36430 0.29330 -0.03550 -0.03590 0.01270  661 HOH   A O   
4411 O O   . HOH   G .   ? 0.13050 0.25050 0.20750 -0.01040 -0.00100 -0.02320 662 HOH   A O   
4412 O O   . HOH   G .   ? 0.44930 0.61670 0.29720 0.01850  -0.11800 0.02510  663 HOH   A O   
4413 O O   . HOH   G .   ? 0.20280 0.61910 0.62020 -0.00260 -0.03080 -0.17900 664 HOH   A O   
4414 O O   . HOH   G .   ? 0.61930 0.64860 0.60870 0.20620  0.26440  0.11690  665 HOH   A O   
4415 O O   . HOH   G .   ? 0.25900 0.54380 0.68850 -0.03590 0.09310  0.22040  666 HOH   A O   
4416 O O   . HOH   G .   ? 0.33160 0.71070 0.89230 -0.12090 -0.19890 0.06260  667 HOH   A O   
4417 O O   . HOH   G .   ? 0.18170 0.44020 0.29400 -0.03800 -0.00590 -0.01840 668 HOH   A O   
4418 O O   . HOH   G .   ? 0.40590 0.29350 0.28720 -0.01810 -0.00560 0.03890  669 HOH   A O   
4419 O O   . HOH   G .   ? 0.29590 0.56800 0.49830 -0.06890 -0.17770 0.08830  670 HOH   A O   
4420 O O   . HOH   G .   ? 0.13190 0.28820 0.19800 0.00650  0.01340  -0.01630 671 HOH   A O   
4421 O O   . HOH   G .   ? 0.33770 0.53520 0.47510 0.03890  0.14940  0.08180  672 HOH   A O   
4422 O O   . HOH   G .   ? 0.36770 0.40910 0.40610 -0.07900 -0.09500 0.03320  673 HOH   A O   
4423 O O   . HOH   G .   ? 0.09860 0.32060 0.22430 -0.02800 0.01790  0.01460  674 HOH   A O   
4424 O O   . HOH   G .   ? 0.53790 0.62120 0.51600 -0.03690 -0.14760 0.02040  675 HOH   A O   
4425 O O   . HOH   G .   ? 0.30410 0.56940 0.37040 0.01270  0.03010  0.09010  676 HOH   A O   
4426 O O   . HOH   G .   ? 0.36820 0.62230 0.56590 -0.01270 -0.14670 0.04820  677 HOH   A O   
4427 O O   . HOH   G .   ? 0.20910 0.52810 0.38270 -0.01370 -0.01650 0.01460  678 HOH   A O   
4428 O O   . HOH   G .   ? 0.44440 0.79560 0.46240 0.03550  -0.13200 -0.01450 679 HOH   A O   
4429 O O   . HOH   G .   ? 0.25550 0.73880 0.57120 -0.00840 0.15340  -0.06720 680 HOH   A O   
4430 O O   . HOH   G .   ? 0.44940 0.54970 0.46830 -0.08320 0.03100  0.12070  681 HOH   A O   
4431 O O   . HOH   G .   ? 0.22610 0.36000 0.24820 0.02010  0.03840  0.02520  682 HOH   A O   
4432 O O   . HOH   G .   ? 0.20320 0.35490 0.30640 0.05990  0.00570  -0.02820 683 HOH   A O   
4433 O O   . HOH   G .   ? 0.24280 0.49150 0.33070 -0.02400 0.10590  0.01960  684 HOH   A O   
4434 O O   . HOH   G .   ? 0.25490 0.43800 0.45500 0.01440  0.07960  0.00660  685 HOH   A O   
4435 O O   . HOH   G .   ? 0.15880 0.38640 0.23080 -0.01990 -0.01830 0.02250  686 HOH   A O   
4436 O O   . HOH   G .   ? 0.67960 0.56810 0.74070 -0.01100 0.41670  -0.08220 687 HOH   A O   
4437 O O   . HOH   G .   ? 0.48590 0.50660 0.44220 -0.16980 0.12220  -0.07290 688 HOH   A O   
4438 O O   . HOH   G .   ? 0.53180 0.68280 0.41360 0.11820  0.09400  0.04610  689 HOH   A O   
4439 O O   . HOH   G .   ? 0.43020 0.36180 0.95830 0.07750  0.27710  0.02880  690 HOH   A O   
4440 O O   . HOH   G .   ? 0.10130 0.32420 0.20660 0.00330  0.01330  0.03080  691 HOH   A O   
4441 O O   . HOH   G .   ? 0.27260 0.47890 0.33100 -0.15340 -0.05590 0.06370  692 HOH   A O   
4442 O O   . HOH   G .   ? 0.71990 0.34650 0.52600 -0.09190 -0.05390 -0.08200 693 HOH   A O   
4443 O O   . HOH   G .   ? 0.20180 0.47310 0.30170 0.01120  0.06010  -0.01170 694 HOH   A O   
4444 O O   . HOH   G .   ? 0.19620 0.56800 0.38210 -0.01100 -0.03100 0.14020  695 HOH   A O   
4445 O O   . HOH   G .   ? 0.21920 0.47400 0.32110 -0.03990 0.01660  0.11240  696 HOH   A O   
4446 O O   . HOH   G .   ? 0.34380 0.56480 0.51760 -0.18010 0.09450  0.02590  697 HOH   A O   
4447 O O   . HOH   G .   ? 0.14180 0.22230 0.19750 0.00580  -0.00000 0.00000  698 HOH   A O   
4448 O O   . HOH   G .   ? 0.13510 0.41050 0.25540 0.04190  -0.02890 0.00450  699 HOH   A O   
4449 O O   . HOH   G .   ? 0.57650 0.68910 0.64840 -0.05040 -0.24770 0.05830  700 HOH   A O   
4450 O O   . HOH   G .   ? 0.40210 0.59590 0.88320 0.12250  -0.26590 -0.02820 701 HOH   A O   
4451 O O   . HOH   G .   ? 0.14500 0.31580 0.25460 0.00150  -0.01780 0.04800  702 HOH   A O   
4452 O O   . HOH   G .   ? 0.57750 0.65740 0.55210 -0.17740 -0.29730 0.16260  703 HOH   A O   
4453 O O   . HOH   G .   ? 0.32790 0.74190 0.41870 0.11440  0.03420  -0.03780 704 HOH   A O   
4454 O O   . HOH   G .   ? 0.32410 0.32070 0.60300 0.04130  -0.10550 0.00150  705 HOH   A O   
4455 O O   . HOH   G .   ? 0.14370 0.27500 0.25160 -0.00800 0.00200  0.03280  706 HOH   A O   
4456 O O   . HOH   G .   ? 0.57970 0.78780 0.53340 -0.22050 -0.27660 0.20920  707 HOH   A O   
4457 O O   . HOH   G .   ? 0.14460 0.42360 0.21860 -0.01880 0.00950  0.05060  708 HOH   A O   
4458 O O   . HOH   G .   ? 0.43140 0.63840 0.72970 -0.08700 0.01070  -0.04000 709 HOH   A O   
4459 O O   . HOH   G .   ? 0.80970 0.57230 0.31270 0.18440  -0.11320 -0.11560 710 HOH   A O   
4460 O O   . HOH   G .   ? 0.56190 0.42410 0.40690 -0.10600 -0.13740 -0.02220 711 HOH   A O   
4461 O O   . HOH   G .   ? 0.29660 0.51390 0.37660 -0.00990 -0.05560 0.01010  712 HOH   A O   
4462 O O   . HOH   G .   ? 0.16040 0.35780 0.40060 -0.05590 0.00270  0.08250  713 HOH   A O   
4463 O O   . HOH   G .   ? 0.32090 0.34640 0.53140 -0.04030 -0.01920 -0.02450 714 HOH   A O   
4464 O O   . HOH   G .   ? 0.26050 0.48090 0.30040 0.00860  -0.01340 0.00920  715 HOH   A O   
4465 O O   . HOH   G .   ? 0.61290 0.57200 0.48210 0.17880  -0.19380 -0.05770 716 HOH   A O   
4466 O O   . HOH   G .   ? 0.25380 0.40670 0.36190 -0.01650 -0.08210 0.06460  717 HOH   A O   
4467 O O   . HOH   G .   ? 0.47770 0.64730 0.43220 -0.15380 -0.22350 -0.01560 718 HOH   A O   
4468 O O   B HOH   G .   ? 0.33800 0.35080 0.38410 0.05620  -0.19390 0.05000  719 HOH   A O   
4469 O O   . HOH   G .   ? 0.54340 0.53340 0.57250 0.05400  -0.11610 0.14910  720 HOH   A O   
4470 O O   . HOH   G .   ? 0.21250 0.53270 0.42410 -0.08010 -0.05250 -0.00350 721 HOH   A O   
4471 O O   . HOH   G .   ? 0.46590 0.48010 0.26940 0.04920  0.00140  0.01830  722 HOH   A O   
4472 O O   . HOH   G .   ? 0.63590 0.63160 0.36210 -0.04360 0.03300  -0.04830 723 HOH   A O   
4473 O O   . HOH   G .   ? 0.29910 0.84660 0.53340 -0.15390 -0.02260 -0.02290 724 HOH   A O   
4474 O O   . HOH   G .   ? 0.34030 0.58720 0.41800 0.01520  -0.06350 -0.18430 725 HOH   A O   
4475 O O   . HOH   G .   ? 0.22850 0.72540 0.54440 -0.06500 -0.07500 0.03680  726 HOH   A O   
4476 O O   . HOH   G .   ? 0.39710 0.72710 0.59060 0.17170  -0.08850 -0.13890 727 HOH   A O   
4477 O O   . HOH   G .   ? 0.33980 0.33240 0.45680 0.02170  0.01990  -0.10710 728 HOH   A O   
4478 O O   . HOH   G .   ? 0.13890 0.33300 0.24280 0.01310  -0.01280 0.03320  729 HOH   A O   
4479 O O   . HOH   G .   ? 0.42200 0.50380 0.42660 0.06440  0.10970  0.04950  730 HOH   A O   
4480 O O   . HOH   G .   ? 0.53480 0.49670 0.62400 0.15200  0.13390  0.21040  731 HOH   A O   
4481 O O   . HOH   G .   ? 0.27060 0.52780 0.46360 0.08150  0.04010  0.03000  732 HOH   A O   
4482 O O   . HOH   G .   ? 0.24790 0.57320 0.60380 -0.10310 -0.12740 -0.04120 733 HOH   A O   
4483 O O   . HOH   G .   ? 0.39950 0.51520 0.23780 0.04940  -0.04400 0.03250  734 HOH   A O   
4484 O O   . HOH   G .   ? 0.23380 0.33200 0.39970 0.04830  0.01140  -0.08320 735 HOH   A O   
4485 O O   . HOH   G .   ? 0.39980 0.74680 0.69140 -0.00430 0.03170  0.22200  736 HOH   A O   
4486 O O   . HOH   G .   ? 0.29750 0.36430 0.29920 -0.06660 0.00610  0.02300  737 HOH   A O   
4487 O O   . HOH   G .   ? 0.12730 0.33180 0.22640 -0.01220 0.02460  0.00870  738 HOH   A O   
4488 O O   . HOH   G .   ? 0.54050 0.72910 0.71040 -0.19110 0.12060  -0.01780 739 HOH   A O   
4489 O O   . HOH   G .   ? 0.56280 0.57100 0.44790 0.23750  -0.06690 -0.07030 740 HOH   A O   
4490 O O   . HOH   G .   ? 0.23310 0.39350 0.29660 -0.02170 0.01370  -0.02800 741 HOH   A O   
4491 O O   . HOH   G .   ? 0.83320 0.86720 0.49540 0.05090  0.06450  -0.02470 742 HOH   A O   
4492 O O   . HOH   G .   ? 0.53020 0.39640 0.73270 -0.15850 0.01150  0.12970  743 HOH   A O   
4493 O O   . HOH   G .   ? 0.27140 0.51280 0.24520 -0.01630 0.00730  -0.00860 744 HOH   A O   
4494 O O   . HOH   G .   ? 0.37300 0.45700 0.82510 0.09720  -0.07300 -0.16040 745 HOH   A O   
4495 O O   . HOH   G .   ? 0.12520 0.41150 0.29880 -0.02270 0.01590  0.00810  746 HOH   A O   
4496 O O   . HOH   G .   ? 0.48220 0.60740 0.87540 0.21060  -0.01800 -0.03200 747 HOH   A O   
4497 O O   . HOH   G .   ? 0.28440 0.32510 0.97200 -0.05510 0.02120  0.04090  748 HOH   A O   
4498 O O   . HOH   G .   ? 0.13660 0.30250 0.33230 -0.01490 0.01010  0.01500  749 HOH   A O   
4499 O O   . HOH   G .   ? 0.18730 0.33380 0.42170 0.01390  0.02820  0.06530  750 HOH   A O   
4500 O O   . HOH   G .   ? 0.22670 0.49660 0.50660 0.05020  0.01160  -0.02710 751 HOH   A O   
4501 O O   . HOH   G .   ? 0.25710 0.48890 0.26610 0.03990  0.00100  0.03570  752 HOH   A O   
4502 O O   . HOH   G .   ? 0.48690 0.37450 0.48550 -0.14400 -0.23240 0.08840  753 HOH   A O   
4503 O O   . HOH   G .   ? 0.30070 0.51340 0.51160 0.00990  -0.00870 -0.00980 754 HOH   A O   
4504 O O   . HOH   G .   ? 0.34360 0.77200 0.37880 -0.03830 0.03110  -0.08070 755 HOH   A O   
4505 O O   . HOH   G .   ? 0.39250 0.37740 0.54560 0.05260  0.18280  -0.02490 756 HOH   A O   
4506 O O   . HOH   G .   ? 0.34150 0.35370 0.34590 0.02980  -0.01200 -0.01790 757 HOH   A O   
4507 O O   . HOH   G .   ? 0.41110 0.66350 0.61690 -0.02520 -0.08960 0.09410  758 HOH   A O   
4508 O O   . HOH   G .   ? 0.43120 0.42660 0.25030 -0.01970 -0.05520 0.01320  759 HOH   A O   
4509 O O   . HOH   G .   ? 0.34550 0.45280 0.56410 -0.03090 -0.21080 0.14040  760 HOH   A O   
4510 O O   . HOH   G .   ? 0.18190 0.30560 0.33600 -0.01670 -0.01080 -0.01070 761 HOH   A O   
4511 O O   . HOH   G .   ? 0.28630 0.49450 0.40680 -0.07140 0.01760  0.07270  762 HOH   A O   
4512 O O   . HOH   G .   ? 0.38890 0.53650 0.29030 0.06710  0.01190  0.02670  763 HOH   A O   
4513 O O   . HOH   G .   ? 0.29670 0.83380 0.91720 0.10020  0.15790  0.03790  764 HOH   A O   
4514 O O   . HOH   G .   ? 0.24260 0.45630 0.24300 0.02100  0.03620  -0.02970 765 HOH   A O   
4515 O O   . HOH   G .   ? 0.23700 0.68580 0.32470 -0.03680 0.00890  0.05730  766 HOH   A O   
4516 O O   . HOH   G .   ? 0.32740 0.41860 0.33120 0.06910  0.08370  0.01830  767 HOH   A O   
4517 O O   . HOH   G .   ? 0.29310 0.62640 0.53950 0.04760  -0.01910 0.13300  768 HOH   A O   
4518 O O   . HOH   G .   ? 0.23450 0.64280 0.34800 -0.15800 -0.04240 0.03990  769 HOH   A O   
4519 O O   . HOH   G .   ? 0.17450 0.35160 0.25870 -0.02290 0.02080  0.01060  770 HOH   A O   
4520 O O   . HOH   G .   ? 0.20020 0.40500 0.60630 -0.05760 -0.00010 -0.00720 771 HOH   A O   
4521 O O   . HOH   G .   ? 0.25520 0.49070 0.39740 0.01640  -0.01370 -0.04950 772 HOH   A O   
4522 O O   . HOH   G .   ? 0.52040 0.69270 0.38340 0.01210  0.04150  0.07320  773 HOH   A O   
4523 O O   . HOH   G .   ? 0.33740 0.62660 0.51480 -0.10890 0.05120  0.05380  774 HOH   A O   
4524 O O   . HOH   G .   ? 0.22070 0.85840 0.26310 0.04190  -0.00090 0.06910  775 HOH   A O   
4525 O O   . HOH   G .   ? 0.79380 0.56410 0.70740 0.08700  -0.21350 -0.06100 776 HOH   A O   
4526 O O   . HOH   G .   ? 0.54620 0.47600 0.38380 0.14890  -0.01040 0.02290  777 HOH   A O   
4527 O O   . HOH   G .   ? 0.40220 0.52670 0.66630 -0.04020 0.19590  -0.14660 778 HOH   A O   
4528 O O   . HOH   G .   ? 0.22520 0.69750 0.50110 0.04240  -0.08780 0.05790  779 HOH   A O   
4529 O O   . HOH   G .   ? 0.28560 0.41880 0.26010 0.01700  -0.01050 0.06240  780 HOH   A O   
4530 O O   . HOH   G .   ? 0.63600 0.60020 0.76400 -0.12130 -0.31910 -0.00490 781 HOH   A O   
4531 O O   . HOH   G .   ? 0.14430 0.35410 0.33590 0.01780  0.00610  -0.05060 782 HOH   A O   
4532 O O   . HOH   G .   ? 0.61560 0.41170 0.79370 -0.02500 0.14420  0.20080  783 HOH   A O   
4533 O O   . HOH   G .   ? 0.43120 0.96890 0.46410 0.14080  -0.04690 -0.19260 784 HOH   A O   
4534 O O   . HOH   G .   ? 0.19870 0.57260 0.36750 -0.04450 0.07470  -0.04570 785 HOH   A O   
4535 O O   . HOH   G .   ? 0.38040 0.55110 0.29910 -0.05480 -0.01720 0.08760  786 HOH   A O   
4536 O O   . HOH   G .   ? 0.37280 0.60150 0.58840 -0.04760 -0.03290 -0.05760 787 HOH   A O   
4537 O O   . HOH   G .   ? 0.11470 0.24800 0.20240 -0.01540 -0.00310 0.01750  788 HOH   A O   
4538 O O   . HOH   G .   ? 0.58750 0.61020 0.60950 0.14750  -0.10350 0.04310  789 HOH   A O   
4539 O O   . HOH   G .   ? 0.32120 0.44300 0.33850 -0.06740 0.03850  0.10650  790 HOH   A O   
4540 O O   . HOH   G .   ? 0.27760 0.76580 0.59810 -0.12610 0.06350  -0.26580 791 HOH   A O   
4541 O O   . HOH   G .   ? 0.27330 0.53470 0.52450 -0.00630 -0.06470 -0.12980 792 HOH   A O   
4542 O O   . HOH   G .   ? 0.37460 0.40560 0.37740 -0.04560 -0.12950 0.01630  793 HOH   A O   
4543 O O   . HOH   G .   ? 1.00070 0.43580 0.53980 -0.00860 -0.05490 -0.02690 794 HOH   A O   
4544 O O   . HOH   G .   ? 0.25950 0.58510 0.27810 0.11790  0.04440  -0.06130 795 HOH   A O   
4545 O O   . HOH   G .   ? 0.54310 0.67010 0.41130 -0.32990 -0.17410 0.16500  796 HOH   A O   
4546 O O   . HOH   G .   ? 0.50340 0.43290 0.50220 0.05330  0.20030  0.15290  797 HOH   A O   
4547 O O   . HOH   G .   ? 0.34260 0.37180 0.46480 -0.06270 -0.07440 0.00050  798 HOH   A O   
4548 O O   . HOH   G .   ? 0.48800 0.39800 0.20820 -0.08330 0.03430  0.00180  799 HOH   A O   
4549 O O   . HOH   G .   ? 0.71450 0.53160 0.60670 -0.02750 0.03840  0.23730  800 HOH   A O   
4550 O O   . HOH   G .   ? 0.39430 0.70490 0.49740 -0.24730 0.13490  -0.02450 801 HOH   A O   
4551 O O   . HOH   G .   ? 0.13650 0.39680 0.37950 -0.01380 0.00610  0.08960  802 HOH   A O   
4552 O O   . HOH   G .   ? 0.50930 0.53680 0.54840 -0.13750 -0.04450 -0.09370 803 HOH   A O   
4553 O O   . HOH   G .   ? 0.57360 0.46720 0.75240 -0.05560 -0.32800 -0.12640 804 HOH   A O   
4554 O O   . HOH   G .   ? 0.44940 0.60390 0.56390 0.07600  0.17750  0.19640  805 HOH   A O   
4555 O O   . HOH   G .   ? 0.27400 0.36430 0.27620 -0.01520 0.01280  0.02980  806 HOH   A O   
4556 O O   . HOH   G .   ? 0.69280 0.69620 0.63090 0.20760  0.36000  0.07630  807 HOH   A O   
4557 O O   . HOH   G .   ? 0.42710 0.91340 0.65430 0.16990  -0.08080 0.20350  808 HOH   A O   
4558 O O   . HOH   G .   ? 0.21530 0.80010 0.38050 0.01050  -0.00870 -0.08360 809 HOH   A O   
4559 O O   . HOH   G .   ? 0.40700 0.54550 0.61830 0.05850  0.05090  0.28460  810 HOH   A O   
4560 O O   . HOH   G .   ? 0.58340 0.58250 0.47810 -0.12560 0.10870  -0.06530 811 HOH   A O   
4561 O O   . HOH   G .   ? 0.55780 0.74360 0.47970 -0.25790 -0.12560 -0.01970 812 HOH   A O   
4562 O O   . HOH   G .   ? 0.56140 0.65120 0.46800 0.05540  -0.13350 -0.27770 813 HOH   A O   
4563 O O   . HOH   G .   ? 0.33790 0.57640 0.35380 0.08050  -0.07200 -0.08820 814 HOH   A O   
4564 O O   . HOH   G .   ? 0.45380 0.65320 1.01550 -0.01520 0.01790  0.00160  815 HOH   A O   
4565 O O   . HOH   G .   ? 0.31290 0.55270 0.38790 0.15880  0.04190  0.18100  816 HOH   A O   
4566 O O   . HOH   G .   ? 0.44830 0.92760 0.65440 -0.07000 0.29160  0.01370  817 HOH   A O   
4567 O O   . HOH   G .   ? 0.27840 0.54660 0.37180 0.10220  0.02910  -0.05540 818 HOH   A O   
4568 O O   . HOH   G .   ? 0.91940 0.47500 0.65550 -0.00140 0.16420  -0.12540 819 HOH   A O   
4569 O O   . HOH   G .   ? 0.44180 0.49240 0.40380 0.16530  -0.21750 -0.06420 820 HOH   A O   
4570 O O   . HOH   G .   ? 0.43560 0.57040 0.81010 -0.15700 -0.07310 0.06810  821 HOH   A O   
4571 O O   . HOH   G .   ? 0.47960 0.58820 0.61010 0.11610  -0.00620 0.16990  822 HOH   A O   
4572 O O   . HOH   G .   ? 0.20630 0.47820 0.29080 0.00190  0.02290  0.04200  823 HOH   A O   
4573 O O   . HOH   G .   ? 0.37330 0.67790 0.63890 0.00560  -0.08340 -0.12770 824 HOH   A O   
4574 O O   . HOH   G .   ? 0.39750 0.68370 0.55690 0.15680  -0.02370 -0.01280 825 HOH   A O   
4575 O O   . HOH   G .   ? 0.43000 0.51640 0.32390 -0.09090 0.09350  -0.00610 826 HOH   A O   
4576 O O   . HOH   G .   ? 1.01480 0.54970 0.45960 0.05430  -0.19120 0.04640  827 HOH   A O   
4577 O O   . HOH   G .   ? 0.25670 0.48650 0.27140 0.04160  0.02150  0.02310  828 HOH   A O   
4578 O O   . HOH   G .   ? 0.23110 0.59030 0.42970 -0.02440 0.01170  0.05010  829 HOH   A O   
4579 O O   . HOH   G .   ? 0.52220 0.36170 0.42920 -0.12430 -0.16310 0.07520  830 HOH   A O   
4580 O O   . HOH   G .   ? 0.20320 0.45800 0.26860 -0.07770 0.03610  -0.06150 831 HOH   A O   
4581 O O   . HOH   G .   ? 0.99640 0.48780 0.75210 -0.00520 -0.13810 -0.11900 832 HOH   A O   
4582 O O   . HOH   G .   ? 0.27230 0.74010 0.53570 0.11210  0.10040  0.25360  833 HOH   A O   
4583 O O   . HOH   G .   ? 0.52720 0.61060 0.81160 -0.00920 -0.32850 0.06400  834 HOH   A O   
4584 O O   . HOH   G .   ? 0.68100 0.69680 0.64130 -0.25370 -0.08460 0.05610  835 HOH   A O   
4585 O O   . HOH   G .   ? 0.60490 0.62990 0.67290 0.03210  0.09440  -0.10480 836 HOH   A O   
4586 O O   . HOH   G .   ? 0.32570 0.37960 0.33930 -0.07640 -0.00040 -0.01470 837 HOH   A O   
4587 O O   . HOH   G .   ? 0.64970 0.62020 0.38660 -0.09110 0.11160  0.12950  838 HOH   A O   
4588 O O   . HOH   G .   ? 0.58570 0.69090 0.86370 -0.26140 -0.15080 0.35230  839 HOH   A O   
4589 O O   . HOH   G .   ? 0.54840 0.77030 0.45310 -0.23830 -0.00560 -0.13390 840 HOH   A O   
4590 O O   . HOH   G .   ? 0.72270 0.41390 0.59430 -0.03330 -0.05260 -0.01910 841 HOH   A O   
4591 O O   . HOH   G .   ? 0.27080 0.67280 0.74960 -0.09570 -0.03630 0.01780  842 HOH   A O   
4592 O O   . HOH   G .   ? 0.66890 0.73890 0.53490 -0.06150 -0.23140 -0.12480 843 HOH   A O   
4593 O O   . HOH   G .   ? 0.43620 0.89010 0.34040 0.05340  0.12030  -0.00330 844 HOH   A O   
4594 O O   . HOH   G .   ? 0.65700 0.64870 0.71320 -0.06460 0.20030  0.17030  845 HOH   A O   
4595 O O   . HOH   G .   ? 0.33560 0.75050 0.67180 0.11390  -0.04070 -0.00390 846 HOH   A O   
4596 O O   . HOH   G .   ? 0.50200 0.52960 0.77100 0.01240  0.01300  0.25680  847 HOH   A O   
4597 O O   . HOH   G .   ? 0.75720 0.51140 0.52060 0.12800  0.17420  -0.02720 848 HOH   A O   
4598 O O   . HOH   G .   ? 0.87770 0.85310 0.44310 0.02890  0.00680  -0.09950 849 HOH   A O   
4599 O O   . HOH   G .   ? 0.52940 0.59880 0.66320 0.11620  0.05050  -0.00090 850 HOH   A O   
4600 O O   A HOH   G .   ? 0.49040 0.64500 0.45770 0.02810  0.05560  -0.08590 851 HOH   A O   
4601 O O   . HOH   G .   ? 0.54530 0.54190 0.50970 -0.09170 -0.06440 0.02550  852 HOH   A O   
4602 O O   . HOH   G .   ? 0.55660 0.55000 0.87120 0.05100  -0.04820 0.10980  853 HOH   A O   
4603 O O   . HOH   G .   ? 0.67570 0.53560 0.79890 0.19710  0.14640  -0.07440 854 HOH   A O   
4604 O O   . HOH   G .   ? 0.71530 0.97450 0.47090 -0.20860 -0.02360 0.27190  855 HOH   A O   
4605 O O   . HOH   G .   ? 0.57640 0.52560 0.54220 -0.03900 0.20740  -0.06860 856 HOH   A O   
4606 O O   . HOH   G .   ? 0.43270 0.68490 0.88000 0.03860  -0.29110 0.04540  857 HOH   A O   
4607 O O   . HOH   G .   ? 0.75150 0.55010 0.80350 0.15370  0.42390  0.01090  858 HOH   A O   
4608 O O   . HOH   G .   ? 0.23940 0.74380 0.29930 0.06830  -0.00550 -0.04710 859 HOH   A O   
4609 O O   . HOH   G .   ? 0.84000 0.65570 0.69670 0.38930  -0.26920 -0.09720 860 HOH   A O   
4610 O O   . HOH   G .   ? 0.21840 0.49330 0.72370 -0.04470 0.02860  -0.20280 861 HOH   A O   
4611 O O   B HOH   G .   ? 0.40640 0.55000 0.55120 0.03260  -0.00750 0.02600  862 HOH   A O   
4612 O O   . HOH   G .   ? 0.56070 0.57960 0.71070 0.23720  0.09890  -0.04600 863 HOH   A O   
4613 O O   . HOH   G .   ? 0.61700 0.64530 0.66070 -0.01720 -0.18800 0.17030  864 HOH   A O   
4614 O O   A HOH   G .   ? 0.53970 0.42790 0.85630 -0.08360 -0.01640 0.18990  865 HOH   A O   
4615 O O   . HOH   G .   ? 0.83850 0.61350 0.53220 0.04220  -0.23400 0.06110  866 HOH   A O   
4616 O O   . HOH   G .   ? 0.20420 0.60880 0.35290 0.09340  0.01900  -0.05250 867 HOH   A O   
4617 O O   . HOH   G .   ? 0.59300 0.58570 0.64890 0.00160  -0.13910 0.10880  868 HOH   A O   
4618 O O   . HOH   G .   ? 0.89940 0.61520 0.61340 -0.32470 -0.03440 0.03110  869 HOH   A O   
4619 O O   . HOH   G .   ? 0.33050 0.71940 0.82050 -0.07460 -0.13330 -0.22870 870 HOH   A O   
4620 O O   . HOH   G .   ? 0.69140 0.38820 0.40430 -0.05290 0.15150  -0.08440 871 HOH   A O   
4621 O O   . HOH   G .   ? 0.72760 0.57800 0.64170 -0.23020 0.05340  -0.20500 872 HOH   A O   
4622 O O   . HOH   G .   ? 0.55300 0.61630 0.75420 0.10560  -0.33290 0.09630  873 HOH   A O   
4623 O O   . HOH   G .   ? 0.45500 0.56750 0.79480 -0.01850 -0.12980 0.08260  874 HOH   A O   
4624 O O   . HOH   G .   ? 0.28060 0.52460 0.68940 -0.10670 -0.11810 0.23850  875 HOH   A O   
4625 O O   . HOH   G .   ? 0.36950 0.67370 0.60460 0.13990  0.17380  0.19320  876 HOH   A O   
4626 O O   . HOH   G .   ? 0.46040 0.77920 0.42380 0.18560  0.08410  0.04890  877 HOH   A O   
4627 O O   . HOH   G .   ? 0.30310 0.43300 0.36000 -0.06280 0.01840  -0.03660 878 HOH   A O   
4628 O O   . HOH   G .   ? 0.62080 0.41140 0.91140 -0.09840 0.13720  0.04840  879 HOH   A O   
4629 O O   . HOH   G .   ? 0.39400 0.69070 0.42180 -0.00470 0.12730  0.13210  880 HOH   A O   
4630 O O   . HOH   G .   ? 0.27060 0.67060 0.28820 -0.09810 0.00060  -0.01610 881 HOH   A O   
4631 O O   . HOH   G .   ? 0.34750 0.46850 0.44600 -0.03520 -0.01750 -0.04420 882 HOH   A O   
4632 O O   . HOH   G .   ? 0.14130 0.34400 0.23260 -0.05340 0.01010  -0.00370 883 HOH   A O   
4633 O O   . HOH   G .   ? 0.52500 0.71760 0.38120 0.14880  0.12510  0.13930  884 HOH   A O   
4634 O O   . HOH   G .   ? 0.27190 0.58000 0.83250 -0.02200 -0.08900 -0.21660 885 HOH   A O   
4635 O O   . HOH   G .   ? 0.61720 0.45470 0.69080 -0.18070 -0.22710 0.05920  886 HOH   A O   
4636 O O   . HOH   G .   ? 0.56480 0.59910 0.79670 0.09150  0.00860  0.24070  887 HOH   A O   
4637 O O   . HOH   G .   ? 0.59690 0.37560 0.46950 -0.14180 -0.11370 -0.08130 888 HOH   A O   
4638 O O   . HOH   G .   ? 0.19490 0.51000 0.35260 -0.10880 0.00000  0.00000  889 HOH   A O   
4639 O O   . HOH   G .   ? 0.19590 0.46140 0.43590 0.00410  -0.07100 -0.10410 890 HOH   A O   
4640 O O   . HOH   G .   ? 0.39330 0.62180 0.69430 0.08730  0.05470  -0.16510 891 HOH   A O   
4641 O O   . HOH   G .   ? 0.85440 0.59740 0.77750 0.22160  0.28920  -0.10960 892 HOH   A O   
4642 O O   . HOH   G .   ? 0.96920 0.72160 0.84980 -0.08910 -0.08030 0.10580  893 HOH   A O   
4643 O O   . HOH   G .   ? 0.23010 0.83410 0.42470 -0.05110 0.00640  -0.08190 894 HOH   A O   
4644 O O   . HOH   G .   ? 0.65310 0.40710 0.35350 -0.02430 -0.01240 0.06450  895 HOH   A O   
4645 O O   . HOH   G .   ? 0.65930 0.61550 0.82070 0.00790  0.03020  0.02570  896 HOH   A O   
4646 O O   . HOH   G .   ? 0.30130 0.46180 0.34830 0.03340  0.01140  -0.02450 897 HOH   A O   
4647 O O   . HOH   G .   ? 0.52730 0.77100 0.65990 -0.02550 -0.25120 0.00030  898 HOH   A O   
4648 O O   . HOH   G .   ? 0.54770 0.92430 0.54040 -0.10460 -0.00580 0.23350  899 HOH   A O   
4649 O O   . HOH   G .   ? 0.23220 0.36490 0.31200 -0.04100 -0.01120 0.02880  900 HOH   A O   
4650 O O   . HOH   G .   ? 0.71440 0.67950 0.51870 0.07280  -0.15920 0.06480  901 HOH   A O   
4651 O O   . HOH   G .   ? 0.39840 0.79580 0.39220 0.00820  0.07460  0.07100  902 HOH   A O   
4652 O O   . HOH   G .   ? 0.27590 0.65370 0.90000 -0.05540 -0.07900 0.21530  903 HOH   A O   
4653 O O   . HOH   G .   ? 0.47150 0.60520 0.31270 -0.15520 0.01190  -0.12340 904 HOH   A O   
4654 O O   . HOH   G .   ? 0.55800 0.57150 0.41800 0.11650  -0.09740 0.00210  905 HOH   A O   
4655 O O   . HOH   G .   ? 0.35010 0.55050 0.84310 -0.01860 0.10270  -0.03180 906 HOH   A O   
4656 O O   . HOH   G .   ? 0.54490 0.80720 0.41780 0.11310  -0.10010 0.02160  907 HOH   A O   
4657 O O   . HOH   G .   ? 0.25380 0.94520 0.48060 -0.06190 0.01460  0.07440  908 HOH   A O   
4658 O O   . HOH   G .   ? 0.76210 0.51750 0.57500 0.11010  -0.16430 -0.17210 909 HOH   A O   
4659 O O   . HOH   G .   ? 0.79270 0.46900 0.88740 -0.11470 0.07460  -0.08280 910 HOH   A O   
4660 O O   . HOH   G .   ? 0.98080 0.46210 0.44250 0.16810  0.05280  0.11410  911 HOH   A O   
4661 O O   . HOH   G .   ? 0.74670 0.34880 0.51210 -0.06770 0.02120  -0.00610 912 HOH   A O   
4662 O O   . HOH   G .   ? 0.40320 0.46800 0.44490 0.01490  -0.07930 0.10240  913 HOH   A O   
4663 O O   . HOH   G .   ? 0.59750 0.64860 0.56700 -0.02250 0.31450  -0.07980 914 HOH   A O   
4664 O O   . HOH   G .   ? 0.86000 0.50640 0.73650 -0.05450 0.10950  0.08940  915 HOH   A O   
4665 O O   . HOH   G .   ? 0.57590 0.66090 0.58270 -0.02980 0.14980  -0.13690 916 HOH   A O   
4666 O O   . HOH   G .   ? 0.38000 0.57350 0.53530 0.06020  -0.00670 0.03470  917 HOH   A O   
4667 O O   . HOH   G .   ? 0.95350 0.69010 0.85820 0.03640  0.15100  0.02210  918 HOH   A O   
4668 O O   . HOH   G .   ? 0.63730 0.59830 0.69650 -0.02280 -0.00280 0.13200  919 HOH   A O   
4669 O O   . HOH   G .   ? 0.66810 0.58430 0.63450 0.03510  -0.10110 -0.17200 920 HOH   A O   
4670 O O   . HOH   G .   ? 0.78060 0.61080 0.45460 -0.07520 -0.20590 -0.05150 921 HOH   A O   
4671 O O   . HOH   G .   ? 0.44440 0.47870 0.63090 0.08950  -0.10250 0.02860  922 HOH   A O   
4672 O O   . HOH   G .   ? 0.59290 0.47480 0.71580 0.05850  -0.12880 -0.08600 923 HOH   A O   
4673 O O   . HOH   G .   ? 0.62980 0.64110 0.71780 -0.03910 0.18700  -0.18570 924 HOH   A O   
4674 O O   . HOH   G .   ? 0.50240 0.64300 0.60860 -0.02400 0.09690  -0.30600 925 HOH   A O   
4675 O O   . HOH   G .   ? 0.70480 0.62590 0.77770 0.24670  0.04140  -0.08460 926 HOH   A O   
4676 O O   . HOH   G .   ? 0.25030 0.37780 0.33610 0.05190  0.02420  -0.00520 927 HOH   A O   
4677 O O   . HOH   G .   ? 0.44240 0.54440 0.58680 0.11620  0.01450  -0.06850 928 HOH   A O   
4678 O O   . HOH   G .   ? 0.69770 0.51860 0.66580 -0.08450 -0.03630 0.17420  929 HOH   A O   
4679 O O   . HOH   G .   ? 0.70150 0.31590 0.46210 0.03330  -0.23760 0.04910  930 HOH   A O   
4680 O O   . HOH   G .   ? 0.13470 0.40090 0.26650 -0.01870 -0.00400 0.07020  931 HOH   A O   
4681 O O   . HOH   G .   ? 0.25370 0.46300 0.52260 0.01310  -0.05000 0.00560  932 HOH   A O   
4682 O O   . HOH   G .   ? 0.32590 0.75190 0.52880 0.01140  -0.01840 0.12970  933 HOH   A O   
4683 O O   B HOH   G .   ? 0.57510 0.40720 0.54910 0.00950  -0.08850 0.01730  934 HOH   A O   
4684 O O   . HOH   G .   ? 0.28200 0.78090 0.51680 -0.01580 0.04860  0.30780  935 HOH   A O   
4685 O O   . HOH   G .   ? 0.54470 0.84860 0.44200 -0.17830 -0.02710 0.02140  936 HOH   A O   
4686 O O   . HOH   G .   ? 0.50690 0.62360 0.61180 0.17970  0.11290  -0.06670 937 HOH   A O   
4687 O O   . HOH   G .   ? 0.52640 0.48150 0.45050 0.15990  -0.11940 0.06810  938 HOH   A O   
4688 O O   . HOH   G .   ? 0.44230 0.84520 0.95000 -0.11710 0.18510  0.19270  939 HOH   A O   
4689 O O   . HOH   G .   ? 0.22790 0.57220 0.33880 0.04060  -0.05520 0.01210  940 HOH   A O   
4690 O O   . HOH   G .   ? 0.40660 0.56500 0.34870 0.01940  0.04340  0.13950  941 HOH   A O   
4691 O O   . HOH   G .   ? 0.33770 0.78410 0.34040 -0.22630 -0.09210 0.16930  942 HOH   A O   
4692 O O   . HOH   G .   ? 0.48320 0.84440 0.54130 0.15070  -0.07810 -0.26570 943 HOH   A O   
4693 O O   . HOH   G .   ? 0.42140 0.90270 0.52940 -0.10590 0.15520  -0.02050 944 HOH   A O   
4694 O O   . HOH   G .   ? 0.69750 0.74290 0.59540 0.38070  -0.03020 -0.04840 945 HOH   A O   
4695 O O   . HOH   G .   ? 0.55170 0.30960 1.02300 0.03560  0.11340  -0.00310 946 HOH   A O   
4696 O O   . HOH   G .   ? 0.58210 0.38930 0.40870 0.03210  -0.05730 0.00870  947 HOH   A O   
4697 O O   . HOH   G .   ? 0.71640 0.71050 0.34470 -0.07030 -0.05540 0.07060  948 HOH   A O   
4698 O O   . HOH   G .   ? 0.31430 0.51100 0.39350 -0.14490 0.14710  -0.15060 949 HOH   A O   
4699 O O   . HOH   G .   ? 0.50520 0.48460 0.62770 -0.13780 -0.04900 -0.03060 950 HOH   A O   
4700 O O   . HOH   G .   ? 0.58460 0.61580 0.68550 0.02270  -0.06130 0.27800  951 HOH   A O   
4701 O O   . HOH   G .   ? 0.38510 0.75000 0.69600 -0.05170 0.03070  0.26400  952 HOH   A O   
4702 O O   . HOH   G .   ? 0.47120 0.44820 0.71520 -0.07990 0.05100  0.07210  953 HOH   A O   
4703 O O   . HOH   G .   ? 0.59890 0.59400 0.49540 -0.01910 0.06020  -0.03080 954 HOH   A O   
4704 O O   . HOH   G .   ? 0.62590 0.73770 0.51050 -0.08450 0.08680  0.19220  955 HOH   A O   
4705 O O   . HOH   G .   ? 0.67890 0.76430 0.37490 -0.08440 -0.03110 0.12710  956 HOH   A O   
4706 O O   . HOH   G .   ? 0.44720 0.60830 0.38770 -0.05690 0.02500  0.04660  957 HOH   A O   
4707 O O   . HOH   G .   ? 0.49460 0.49450 0.35660 -0.05060 0.12500  0.07370  958 HOH   A O   
4708 O O   . HOH   G .   ? 0.52100 0.80250 0.54860 0.26860  0.10340  0.15320  959 HOH   A O   
4709 O O   . HOH   G .   ? 0.86680 0.55570 0.52120 -0.07300 0.07720  0.06680  960 HOH   A O   
# 
